0 B17R1.4851 C#CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000184674 [0,0,0,0,0,0|2,0,0]=2 1 B17R1.4851 C#CCC(=O)CCCOc1ccc(cc1F)F 1458a_100000746133_100000184674 [0,0,0,0,0,0|2,2,0]=4 2 B17R1.4851 C#CCC(=O)NCCOc1ccc(cc1C)Cl 1626a_100025744827_100011220946 [0,0,0,0,0,0|4,0,0]=4 3 B17R1.4851 C#CCC(=O)NCCOc1ccc(cc1C)Cl 527a_100025744827_100011220946 [0,0,0,0,0,0|4,0,0]=4 4 B17R1.4851 C#CCC(=O)NCCOc1ccc(cc1Cl)F 1626a_100020586385_100011220946 [0,0,0,0,0,0|3,1,0]=4 5 B17R1.4851 C#CCC(=O)NCCOc1ccc(cc1Cl)F 527a_100020586385_100011220946 [0,0,0,0,0,0|3,1,0]=4 6 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1Br)Cl 34a_100000685586_100000199037 [0,0,0,0,0,0|2,1,0]=3 7 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1Br)Cl 7a_100000685586_100000199037 [0,0,0,0,0,0|2,1,0]=3 8 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1C)C 34a_100000685586_100011210784 [0,0,0,0,0,0|4,0,0]=4 9 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1C)C 7a_100000685586_100011210784 [0,0,0,0,0,0|4,0,0]=4 10 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1Cl)Cl 34a_100000685586_100000184432 [0,0,0,0,0,0|2,0,0]=2 11 B17R1.4851 C#CCC(C)OCCOc1ccc(cc1Cl)Cl 7a_100000685586_100000184432 [0,0,0,0,0,0|2,0,0]=2 12 B17R1.4851 C#CCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000038162 [0,0,0,0,0,0|2,0,0]=2 13 B17R1.4851 C#CCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000184674 [0,0,0,0,0,0|2,0,0]=2 14 B17R1.4851 C=CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000210623 [0,0,0,0,0,0|2,0,2]=4 15 B17R1.4851 C=CCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000210623 [0,0,0,0,0,0|2,0,2]=4 16 B17R1.4851 C=CCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100000210623 [0,0,0,0,0,0|2,0,2]=4 17 B17R1.4851 C=CCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100015514636 [0,0,0,0,0,0|2,0,2]=4 18 B17R1.4851 C=CC[C@@H](C)OCCOc1ccc(cc1Cl)Cl 34a_100000731007_100000184432 [0,0,0,0,0,0|2,0,2]=4 19 B17R1.4851 C=CC[C@@H](C)OCCOc1ccc(cc1Cl)Cl 7a_100000731007_100000184432 [0,0,0,0,0,0|2,0,2]=4 20 B17R1.4851 CC#CC(C)OCCOc1ccc(cc1Cl)Cl 34a_100011216543_100000184432 [0,0,0,0,0,0|2,0,2]=4 21 B17R1.4851 CC(CC#N)NCCOc1ccc(cc1Cl)F 2230a_100020586385_100009813641 [0,0,0,0,0,0|3,1,0]=4 22 B17R1.4851 CC(CC#N)OCCCc1ccc(cc1Cl)Cl 7a_200011713141_100009813641 [0,0,0,0,0,0|4,0,0]=4 23 B17R1.4851 CC(CC#N)OCCOc1ccc(cc1Br)Cl 7a_100000193638_100009813641 [0,0,0,0,0,0|3,1,0]=4 24 B17R1.4851 CC(CC#N)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100009813641 [0,0,0,0,0,0|3,0,0]=3 25 B17R1.4851 CC(CC#N)OCCSc1ccc(cc1Cl)Cl 7a_200010001942_100009813641 [0,0,0,0,0,0|3,1,0]=4 26 B17R1.4851 CC(CC#N)SCCOc1ccc(cc1Br)Cl 62a_100000199037_100009813641 [0,0,0,0,0,0|3,1,0]=4 27 B17R1.4851 CC(CC#N)SCCOc1ccc(cc1Br)Cl 62a_100009813641_100000199037 [0,0,0,0,0,0|3,1,0]=4 28 B17R1.4851 CC(CC#N)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100009813641 [0,0,0,0,0,0|3,0,0]=3 29 B17R1.4851 CC(CC#N)SCCOc1ccc(cc1Cl)Cl 62a_100009813641_100000184432 [0,0,0,0,0,0|3,0,0]=3 30 B17R1.4851 CC(CCBr)OCCOc1ccc(cc1Cl)Cl 34a_100012276601_100000184432 [0,0,0,0,0,0|3,0,1]=4 31 B17R1.4851 CC(CCO)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100009893172 [0,0,0,0,0,0|3,0,1]=4 32 B17R1.4851 CC(CCO)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100009893172 [0,0,0,0,0,0|3,0,1]=4 33 B17R1.4851 CC(CCO)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100009893172 [0,0,0,0,0,0|3,0,1]=4 34 B17R1.4851 CC(CCO)SCCOc1ccc(cc1Cl)Cl 62a_100009893172_100000184432 [0,0,0,0,0,0|3,0,1]=4 35 B17R1.4851 CCCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000210303 [0,0,0,0,0,0|2,0,2]=4 36 B17R1.4851 CCCC(C)NCCOc1ccc(cc1Cl)Cl 2230a_100000741246_100000184432 [0,0,0,0,0,0|2,0,2]=4 37 B17R1.4851 CCCC(C)OCCOc1ccc(cc1Cl)Cl 34a_100000764384_100000184432 [0,0,0,0,0,0|2,0,2]=4 38 B17R1.4851 CCCC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000766640 [0,0,0,0,0,0|2,0,2]=4 39 B17R1.4851 CCCC(C)OCCOc1ccc(cc1Cl)Cl 7a_100000764384_100000184432 [0,0,0,0,0,0|2,0,2]=4 40 B17R1.4851 CCCC(C)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000766640 [0,0,0,0,0,0|2,0,2]=4 41 B17R1.4851 CCCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000210303 [0,0,0,0,0,0|2,0,2]=4 42 B17R1.4851 CCCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100000210303 [0,0,0,0,0,0|2,0,2]=4 43 B17R1.4851 CCCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000210303 [0,0,0,0,0,0|2,0,2]=4 44 B17R1.4851 COCC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000765312 [0,0,0,0,0,0|3,0,1]=4 45 B17R1.4851 COCC(C)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000765312 [0,0,0,0,0,0|3,0,1]=4 46 B17R1.4851 COCC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000765312 [0,0,0,0,0,0|3,0,1]=4 47 B17R1.4851 COCC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000765312_100000184432 [0,0,0,0,0,0|3,0,1]=4 48 B17R1.4851 COCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000766300 [0,0,0,0,0,0|3,0,1]=4 49 B17R1.4851 COCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100000766300 [0,0,0,0,0,0|3,0,1]=4 50 B17R1.4851 COC[C@@H](C)NCCOc1ccc(cc1Cl)Cl 2230a_100000764878_100000184432 [0,0,0,0,0,0|3,0,1]=4 51 B17R1.4851 COC[C@@H](C)OCCOc1ccc(cc1Cl)Cl 34a_100011934205_100000184432 [0,0,0,0,0,0|3,0,1]=4 52 B17R1.4851 CSCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100011218213 [0,0,0,0,0,0|3,0,1]=4 53 B17R1.4851 CSCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100011218213 [0,0,0,0,0,0|3,0,1]=4 54 B17R1.4851 CSCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100011218213 [0,0,0,0,0,0|3,0,1]=4 55 B17R1.4851 C[C@@H](CC#N)NCCOc1ccc(cc1Br)Cl 2230a_100016994482_100000199037 [0,0,0,0,0,0|3,1,0]=4 56 B17R1.4851 C[C@@H](CC#N)NCCOc1ccc(cc1Cl)Cl 2230a_100016994482_100000184432 [0,0,0,0,0,0|3,0,0]=3 57 B17R1.4851 C[C@H](CCO)NCCOc1ccc(cc1Cl)Cl 2230a_100000706166_100000184432 [0,0,0,0,0,0|3,0,1]=4 58 B17R1.4851 C[C@H](CCO)NCCOc1ccc(cc1Cl)Cl 34a_100000706166_100000184432 [0,0,0,0,0,0|3,0,1]=4 59 B17R1.4851 Cc1cc(ccc1OCCNC(C)CC#N)Cl 2230a_100025744827_100009813641 [0,0,0,0,0,0|4,0,0]=4 60 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CC#N 2230a_100015183116_100011215382 [0,0,0,0,0,0|3,0,0]=3 61 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CC#N 269982a_100015183116_100011214920 [0,0,0,0,0,0|3,0,0]=3 62 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CC=O 2230a_100015183116_200015260668 [0,0,0,0,0,0|3,0,1]=4 63 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CC=O 269982a_100015183116_200015260668 [0,0,0,0,0,0|3,0,1]=4 64 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CC=O 34a_100015183116_200009817547 [0,0,0,0,0,0|3,0,1]=4 65 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCF 2230a_100015183116_100011217306 [0,0,0,0,0,0|3,0,1]=4 66 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCF 269982a_100015183116_100011217306 [0,0,0,0,0,0|3,0,1]=4 67 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCF 34a_100015183116_100011217306 [0,0,0,0,0,0|3,0,1]=4 68 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCO 2230a_100015183116_100000211926 [0,0,0,0,0,0|3,0,1]=4 69 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCO 269982a_100015183116_100000211926 [0,0,0,0,0,0|3,0,1]=4 70 B17R1.4851 Cc1ccc(c(c1)C)OCCCN(C)CCO 34a_100015183116_100000211926 [0,0,0,0,0,0|3,0,1]=4 71 B17R1.4851 N#CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100011214920 [0,0,0,0,0,0|3,0,0]=3 72 B17R1.4851 O=C(CCF)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100011217306 [0,0,0,0,0,0|3,0,1]=4 73 B17R1.4851 O=C(CCO)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000211926 [0,0,0,0,0,0|3,0,1]=4 74 B16R1.9 C#CCC(=O)CCCCc1ccc(cc1)Cl 1458a_100000684701_100000184674 [1,0,0,0,0,0|3,0,0]=4 75 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)Br 1458a_100000183208_100000184674 [1,0,0,0,0,0|2,1,0]=4 76 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)Br 1458a_100011220946_100011259224 [1,0,0,0,0,0|2,1,0]=4 77 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)C 1458a_100000182836_100000184674 [1,0,0,0,0,0|3,0,0]=4 78 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_100000184674 [1,0,0,0,0,0|2,0,0]=3 79 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)F 1458a_100000735736_100000184674 [1,0,0,0,0,0|2,1,0]=4 80 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)F 1458a_100011220946_100000181347 [1,0,0,0,0,0|2,1,0]=4 81 B16R1.9 C#CCC(=O)CCCOc1ccc(cc1)I 1458a_100000744034_100000184674 [1,0,0,0,0,0|2,1,0]=4 82 B16R1.9 C#CCC(=O)CCCSc1ccc(cc1)Cl 1458a_100000182790_100000184674 [1,0,0,0,0,0|2,1,0]=4 83 B16R1.9 C#CCC(=O)NCCOc1ccc(cc1)Cl 1626a_100000697975_100011220946 [1,0,0,0,0,0|3,0,0]=4 84 B16R1.9 C#CCC(=O)NCCOc1ccc(cc1)Cl 527a_100000697975_100011220946 [1,0,0,0,0,0|3,0,0]=4 85 B16R1.9 C#CCC(C)OCCCc1ccc(cc1)Cl 34a_100000685586_100000759440 [1,0,0,0,0,0|3,0,0]=4 86 B16R1.9 C#CCC(C)OCCCc1ccc(cc1)Cl 7a_100000685586_100000759440 [1,0,0,0,0,0|3,0,0]=4 87 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)Br 34a_100000685586_100000183278 [1,0,0,0,0,0|2,1,0]=4 88 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)Br 7a_100000685586_100000183278 [1,0,0,0,0,0|2,1,0]=4 89 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)C 34a_100000685586_100000183172 [1,0,0,0,0,0|3,0,0]=4 90 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)C 7a_100000685586_100000183172 [1,0,0,0,0,0|3,0,0]=4 91 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)Cl 34a_100000685586_100000184122 [1,0,0,0,0,0|2,0,0]=3 92 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)Cl 7a_100000685586_100000184122 [1,0,0,0,0,0|2,0,0]=3 93 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)F 34a_100000685586_100000184936 [1,0,0,0,0,0|2,1,0]=4 94 B16R1.9 C#CCC(C)OCCOc1ccc(cc1)F 7a_100000685586_100000184936 [1,0,0,0,0,0|2,1,0]=4 95 B16R1.9 C#CCN(C)CCCCc1ccc(cc1)Br 2230a_100000225692_200012094861 [1,0,0,0,0,0|1,1,0]=3 96 B16R1.9 C#CCN(C)CCCCc1ccc(cc1)Br 34a_100000225692_200012094861 [1,0,0,0,0,0|1,1,0]=3 97 B16R1.9 C#CCN(C)CCCCc1ccc(cc1)F 2230a_100000225692_100012093538 [1,0,0,0,0,0|1,1,0]=3 98 B16R1.9 C#CCN(C)CCCCc1ccc(cc1)F 34a_100000225692_100012093538 [1,0,0,0,0,0|1,1,0]=3 99 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Br 2230a_100000225692_100011259224 [1,0,0,0,0,0|0,1,0]=2 100 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000038162 [1,0,0,0,0,0|0,1,0]=2 101 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Br 34a_100000225692_100011259224 [1,0,0,0,0,0|0,1,0]=2 102 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100000184674 [1,0,0,0,0,0|0,1,0]=2 103 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000038162 [1,0,0,0,0,0|1,0,0]=2 104 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100000184674 [1,0,0,0,0,0|1,0,0]=2 105 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000038162 [1,0,0,0,0,0|0,0,0]=1 106 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000184674 [1,0,0,0,0,0|0,0,0]=1 107 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)F 2230a_100000225692_100000181347 [1,0,0,0,0,0|0,1,0]=2 108 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000038162 [1,0,0,0,0,0|0,1,0]=2 109 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)F 34a_100000225692_100000181347 [1,0,0,0,0,0|0,1,0]=2 110 B16R1.9 C#CCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100000184674 [1,0,0,0,0,0|0,1,0]=2 111 B16R1.9 C#CCN(C)CCCSc1ccc(cc1)C 2230a_100015185772_100000038162 [1,0,0,0,0,0|1,1,0]=3 112 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Br 2230a_100000225617_100011259224 [1,0,0,0,0,0|0,1,2]=4 113 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000210623 [1,0,0,0,0,0|0,1,2]=4 114 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Br 269982a_100000225617_100011259224 [1,0,0,0,0,0|0,1,2]=4 115 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000210623 [1,0,0,0,0,0|0,1,2]=4 116 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100015514636 [1,0,0,0,0,0|0,1,2]=4 117 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000210623 [1,0,0,0,0,0|1,0,2]=4 118 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100000210623 [1,0,0,0,0,0|1,0,2]=4 119 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100015514636 [1,0,0,0,0,0|1,0,2]=4 120 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000210623 [1,0,0,0,0,0|0,0,2]=3 121 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000210623 [1,0,0,0,0,0|0,0,2]=3 122 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100015514636 [1,0,0,0,0,0|0,0,2]=3 123 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)F 2230a_100000225617_100000181347 [1,0,0,0,0,0|0,1,2]=4 124 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000210623 [1,0,0,0,0,0|0,1,2]=4 125 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)F 269982a_100000225617_100000181347 [1,0,0,0,0,0|0,1,2]=4 126 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000210623 [1,0,0,0,0,0|0,1,2]=4 127 B16R1.9 C=CCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100015514636 [1,0,0,0,0,0|0,1,2]=4 128 B16R1.9 CC(CC#N)NCCOc1ccc(cc1)Cl 2230a_100000697975_100009813641 [1,0,0,0,0,0|3,0,0]=4 129 B16R1.9 CC(CC#N)OCCOc1ccc(cc1)Cl 7a_100000237962_100009813641 [1,0,0,0,0,0|3,0,0]=4 130 B16R1.9 CC(CC#N)SCCOc1ccc(cc1)Cl 62a_100000184122_100009813641 [1,0,0,0,0,0|3,0,0]=4 131 B16R1.9 CC(CC#N)SCCOc1ccc(cc1)Cl 62a_100009813641_100000184122 [1,0,0,0,0,0|3,0,0]=4 132 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Br 2230a_100000747261_100011259224 [1,0,0,0,0,0|0,1,2]=4 133 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000210303 [1,0,0,0,0,0|0,1,2]=4 134 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Br 269982a_100000747261_100011259224 [1,0,0,0,0,0|0,1,2]=4 135 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000210303 [1,0,0,0,0,0|0,1,2]=4 136 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100000210303 [1,0,0,0,0,0|0,1,2]=4 137 B16R1.9 CCCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000210303 [1,0,0,0,0,0|1,0,2]=4 138 B16R1.9 CCCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100000210303 [1,0,0,0,0,0|1,0,2]=4 139 B16R1.9 CCCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100000210303 [1,0,0,0,0,0|1,0,2]=4 140 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000210303 [1,0,0,0,0,0|0,0,2]=3 141 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000210303 [1,0,0,0,0,0|0,0,2]=3 142 B16R1.9 CCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000210303 [1,0,0,0,0,0|0,0,2]=3 143 B16R1.9 CCCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000210303 [1,0,0,0,0,0|0,1,2]=4 144 B16R1.9 CCCN(C)CCCOc1ccc(cc1)F 2230a_100000747261_100000181347 [1,0,0,0,0,0|0,1,2]=4 145 B16R1.9 CCCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000210303 [1,0,0,0,0,0|0,1,2]=4 146 B16R1.9 CCCN(C)CCCOc1ccc(cc1)F 269982a_100000747261_100000181347 [1,0,0,0,0,0|0,1,2]=4 147 B16R1.9 CCCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100000210303 [1,0,0,0,0,0|0,1,2]=4 148 B16R1.9 CN(CC#N)CCCCc1ccc(cc1)Br 2230a_100000748184_200012094861 [1,0,0,0,0,0|2,1,0]=4 149 B16R1.9 CN(CC#N)CCCCc1ccc(cc1)F 2230a_100000748184_100012093538 [1,0,0,0,0,0|2,1,0]=4 150 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)Br 2230a_100000748184_100011259224 [1,0,0,0,0,0|1,1,0]=3 151 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)Br 2230a_100102699777_100011215382 [1,0,0,0,0,0|1,1,0]=3 152 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)Br 269982a_100102699777_100011214920 [1,0,0,0,0,0|1,1,0]=3 153 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011215382 [1,0,0,0,0,0|1,0,0]=2 154 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011214920 [1,0,0,0,0,0|1,0,0]=2 155 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)F 2230a_100000225698_100011215382 [1,0,0,0,0,0|1,1,0]=3 156 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)F 2230a_100000748184_100000181347 [1,0,0,0,0,0|1,1,0]=3 157 B16R1.9 CN(CC#N)CCCOc1ccc(cc1)F 269982a_100000225698_100011214920 [1,0,0,0,0,0|1,1,0]=3 158 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Br 2230a_100102699777_200015260668 [1,0,0,0,0,0|1,1,1]=4 159 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Br 269982a_100102699777_200015260668 [1,0,0,0,0,0|1,1,1]=4 160 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Br 34a_100102699777_200009817547 [1,0,0,0,0,0|1,1,1]=4 161 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Cl 2230a_100000225747_200015260668 [1,0,0,0,0,0|1,0,1]=3 162 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Cl 269982a_100000225747_200015260668 [1,0,0,0,0,0|1,0,1]=3 163 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)Cl 34a_100000225747_200009817547 [1,0,0,0,0,0|1,0,1]=3 164 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)F 2230a_100000225698_200015260668 [1,0,0,0,0,0|1,1,1]=4 165 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)F 269982a_100000225698_200015260668 [1,0,0,0,0,0|1,1,1]=4 166 B16R1.9 CN(CC=O)CCCOc1ccc(cc1)F 34a_100000225698_200009817547 [1,0,0,0,0,0|1,1,1]=4 167 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Br 2230a_100102699777_100011217306 [1,0,0,0,0,0|1,1,1]=4 168 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Br 269982a_100102699777_100011217306 [1,0,0,0,0,0|1,1,1]=4 169 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Br 34a_100102699777_100011217306 [1,0,0,0,0,0|1,1,1]=4 170 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011217306 [1,0,0,0,0,0|1,0,1]=3 171 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011217306 [1,0,0,0,0,0|1,0,1]=3 172 B16R1.9 CN(CCF)CCCOc1ccc(cc1)Cl 34a_100000225747_100011217306 [1,0,0,0,0,0|1,0,1]=3 173 B16R1.9 CN(CCF)CCCOc1ccc(cc1)F 2230a_100000225698_100011217306 [1,0,0,0,0,0|1,1,1]=4 174 B16R1.9 CN(CCF)CCCOc1ccc(cc1)F 269982a_100000225698_100011217306 [1,0,0,0,0,0|1,1,1]=4 175 B16R1.9 CN(CCF)CCCOc1ccc(cc1)F 34a_100000225698_100011217306 [1,0,0,0,0,0|1,1,1]=4 176 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Br 2230a_100000210263_100011259224 [1,0,0,0,0,0|1,1,1]=4 177 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Br 2230a_100102699777_100000211926 [1,0,0,0,0,0|1,1,1]=4 178 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Br 269982a_100000210263_100011259224 [1,0,0,0,0,0|1,1,1]=4 179 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Br 269982a_100102699777_100000211926 [1,0,0,0,0,0|1,1,1]=4 180 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Br 34a_100102699777_100000211926 [1,0,0,0,0,0|1,1,1]=4 181 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000211926 [1,0,0,0,0,0|1,0,1]=3 182 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000211926 [1,0,0,0,0,0|1,0,1]=3 183 B16R1.9 CN(CCO)CCCOc1ccc(cc1)Cl 34a_100000225747_100000211926 [1,0,0,0,0,0|1,0,1]=3 184 B16R1.9 CN(CCO)CCCOc1ccc(cc1)F 2230a_100000210263_100000181347 [1,0,0,0,0,0|1,1,1]=4 185 B16R1.9 CN(CCO)CCCOc1ccc(cc1)F 2230a_100000225698_100000211926 [1,0,0,0,0,0|1,1,1]=4 186 B16R1.9 CN(CCO)CCCOc1ccc(cc1)F 269982a_100000210263_100000181347 [1,0,0,0,0,0|1,1,1]=4 187 B16R1.9 CN(CCO)CCCOc1ccc(cc1)F 269982a_100000225698_100000211926 [1,0,0,0,0,0|1,1,1]=4 188 B16R1.9 CN(CCO)CCCOc1ccc(cc1)F 34a_100000225698_100000211926 [1,0,0,0,0,0|1,1,1]=4 189 B16R1.9 COCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000766300 [1,0,0,0,0,0|1,1,1]=4 190 B16R1.9 COCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000766300 [1,0,0,0,0,0|1,1,1]=4 191 B16R1.9 COCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000766300 [1,0,0,0,0,0|2,0,1]=4 192 B16R1.9 COCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100000766300 [1,0,0,0,0,0|2,0,1]=4 193 B16R1.9 COCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000766300 [1,0,0,0,0,0|1,0,1]=3 194 B16R1.9 COCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000766300 [1,0,0,0,0,0|1,0,1]=3 195 B16R1.9 COCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000766300 [1,0,0,0,0,0|1,1,1]=4 196 B16R1.9 COCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000766300 [1,0,0,0,0,0|1,1,1]=4 197 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100011218213 [1,0,0,0,0,0|1,1,1]=4 198 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100011218213 [1,0,0,0,0,0|1,1,1]=4 199 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100011218213 [1,0,0,0,0,0|1,1,1]=4 200 B16R1.9 CSCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100011218213 [1,0,0,0,0,0|2,0,1]=4 201 B16R1.9 CSCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100011218213 [1,0,0,0,0,0|2,0,1]=4 202 B16R1.9 CSCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100011218213 [1,0,0,0,0,0|2,0,1]=4 203 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011218213 [1,0,0,0,0,0|1,0,1]=3 204 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011218213 [1,0,0,0,0,0|1,0,1]=3 205 B16R1.9 CSCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100011218213 [1,0,0,0,0,0|1,0,1]=3 206 B16R1.9 CSCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100011218213 [1,0,0,0,0,0|1,1,1]=4 207 B16R1.9 CSCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100011218213 [1,0,0,0,0,0|1,1,1]=4 208 B16R1.9 CSCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100011218213 [1,0,0,0,0,0|1,1,1]=4 209 B16R1.9 C[C@@H](CC#N)NCCOc1ccc(cc1)Cl 2230a_100016994482_100000184122 [1,0,0,0,0,0|3,0,0]=4 210 B16R1.9 Cc1ccc(cc1)OCCCN(C)CC#N 2230a_100011252574_100011215382 [1,0,0,0,0,0|2,0,0]=3 211 B16R1.9 Cc1ccc(cc1)OCCCN(C)CC#N 269982a_100011252574_100011214920 [1,0,0,0,0,0|2,0,0]=3 212 B16R1.9 Cc1ccc(cc1)OCCCN(C)CC=O 2230a_100011252574_200015260668 [1,0,0,0,0,0|2,0,1]=4 213 B16R1.9 Cc1ccc(cc1)OCCCN(C)CC=O 269982a_100011252574_200015260668 [1,0,0,0,0,0|2,0,1]=4 214 B16R1.9 Cc1ccc(cc1)OCCCN(C)CC=O 34a_100011252574_200009817547 [1,0,0,0,0,0|2,0,1]=4 215 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCF 2230a_100011252574_100011217306 [1,0,0,0,0,0|2,0,1]=4 216 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCF 269982a_100011252574_100011217306 [1,0,0,0,0,0|2,0,1]=4 217 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCF 34a_100011252574_100011217306 [1,0,0,0,0,0|2,0,1]=4 218 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCO 2230a_100011252574_100000211926 [1,0,0,0,0,0|2,0,1]=4 219 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCO 269982a_100011252574_100000211926 [1,0,0,0,0,0|2,0,1]=4 220 B16R1.9 Cc1ccc(cc1)OCCCN(C)CCO 34a_100011252574_100000211926 [1,0,0,0,0,0|2,0,1]=4 221 B16R1.9 Cc1ccc(cc1)SCCCN(C)CC#N 2230a_100015185772_100011215382 [1,0,0,0,0,0|2,1,0]=4 222 B16R1.9 Cc1ccc(cc1)SCCCN(C)CC#N 269982a_100015185772_100011214920 [1,0,0,0,0,0|2,1,0]=4 223 B16R1.9 N#CCC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_100011214920 [1,0,0,0,0,0|3,0,0]=4 224 B16R1.258 C#CCCCCCNc1ccc(cc1Br)Cl 34a_100000752454_100012094781 [1,0,0,0,0,0|2,1,0]=4 225 B16R1.258 C#CCCCCCNc1ccc(cc1C)Cl 34a_100000210418_100012094781 [1,0,0,0,0,0|3,0,0]=4 226 B16R1.258 C#CCCCCCNc1ccc(cc1C)Cl 7a_100000210418_100012094781 [1,0,0,0,0,0|3,0,0]=4 227 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)Br 34a_100000211467_100012094781 [1,0,0,0,0,0|2,1,0]=4 228 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)C 34a_100000210522_100012094781 [1,0,0,0,0,0|3,0,0]=4 229 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)Cl 34a_100000185861_100012094781 [1,0,0,0,0,0|2,0,0]=3 230 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)F 34a_100000212003_100012094781 [1,0,0,0,0,0|2,1,0]=4 231 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)I 34a_100011218065_100012094781 [1,0,0,0,0,0|2,1,0]=4 232 B16R1.258 C#CCCCCCNc1ccc(cc1Cl)O 34a_100011215599_100012094781 [1,0,0,0,0,0|3,0,0]=4 233 B16R1.258 C#CCCCCCNc1ccc(cc1F)Cl 34a_100000211020_100012094781 [1,0,0,0,0,0|2,1,0]=4 234 B16R1.258 C#CCCCCCNc1ccc(cc1I)Cl 34a_100000761889_100012094781 [1,0,0,0,0,0|2,1,0]=4 235 B16R1.258 C#CCCCCCNc1ccc(cc1O)Cl 34a_100000185728_100012094781 [1,0,0,0,0,0|3,0,0]=4 236 B16R1.258 C#CCCCCCOc1ccc(cc1Br)Br 34a_100000188717_100012094781 [1,0,0,0,0,0|1,2,0]=4 237 B16R1.258 C#CCCCCCOc1ccc(cc1Br)Br 7a_100000188717_100012094781 [1,0,0,0,0,0|1,2,0]=4 238 B16R1.258 C#CCCCCCOc1ccc(cc1Br)C 34a_100000210800_100012094781 [1,0,0,0,0,0|2,1,0]=4 239 B16R1.258 C#CCCCCCOc1ccc(cc1Br)C 7a_100000210800_100012094781 [1,0,0,0,0,0|2,1,0]=4 240 B16R1.258 C#CCCCCCOc1ccc(cc1Br)Cl 34a_100000211998_100012094781 [1,0,0,0,0,0|1,1,0]=3 241 B16R1.258 C#CCCCCCOc1ccc(cc1Br)Cl 7a_100000211998_100012094781 [1,0,0,0,0,0|1,1,0]=3 242 B16R1.258 C#CCCCCCOc1ccc(cc1Br)F 34a_100000211999_100012094781 [1,0,0,0,0,0|1,2,0]=4 243 B16R1.258 C#CCCCCCOc1ccc(cc1Br)F 7a_100000211999_100012094781 [1,0,0,0,0,0|1,2,0]=4 244 B16R1.258 C#CCCCCCOc1ccc(cc1Br)I 34a_100012361655_100012094781 [1,0,0,0,0,0|1,2,0]=4 245 B16R1.258 C#CCCCCCOc1ccc(cc1Br)I 7a_100012361655_100012094781 [1,0,0,0,0,0|1,2,0]=4 246 B16R1.258 C#CCCCCCOc1ccc(cc1Br)N 34a_100011534360_100012094781 [1,0,0,0,0,0|2,1,0]=4 247 B16R1.258 C#CCCCCCOc1ccc(cc1Br)N 7a_100011534360_100012094781 [1,0,0,0,0,0|2,1,0]=4 248 B16R1.258 C#CCCCCCOc1ccc(cc1C)Br 34a_100000186361_100012094781 [1,0,0,0,0,0|2,1,0]=4 249 B16R1.258 C#CCCCCCOc1ccc(cc1C)Br 7a_100000186361_100012094781 [1,0,0,0,0,0|2,1,0]=4 250 B16R1.258 C#CCCCCCOc1ccc(cc1C)C 34a_100000211776_100012094781 [1,0,0,0,0,0|3,0,0]=4 251 B16R1.258 C#CCCCCCOc1ccc(cc1C)C 7a_100000211776_100012094781 [1,0,0,0,0,0|3,0,0]=4 252 B16R1.258 C#CCCCCCOc1ccc(cc1C)Cl 34a_100000211091_100012094781 [1,0,0,0,0,0|2,0,0]=3 253 B16R1.258 C#CCCCCCOc1ccc(cc1C)Cl 7a_100000211091_100012094781 [1,0,0,0,0,0|2,0,0]=3 254 B16R1.258 C#CCCCCCOc1ccc(cc1C)F 34a_100000764316_100012094781 [1,0,0,0,0,0|2,1,0]=4 255 B16R1.258 C#CCCCCCOc1ccc(cc1C)F 7a_100000764316_100012094781 [1,0,0,0,0,0|2,1,0]=4 256 B16R1.258 C#CCCCCCOc1ccc(cc1C)I 34a_100011218673_100012094781 [1,0,0,0,0,0|2,1,0]=4 257 B16R1.258 C#CCCCCCOc1ccc(cc1C)I 7a_100011218673_100012094781 [1,0,0,0,0,0|2,1,0]=4 258 B16R1.258 C#CCCCCCOc1ccc(cc1C)N 34a_100011218179_100012094781 [1,0,0,0,0,0|3,0,0]=4 259 B16R1.258 C#CCCCCCOc1ccc(cc1C)N 7a_100011218179_100012094781 [1,0,0,0,0,0|3,0,0]=4 260 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)Br 34a_100000186472_100012094781 [1,0,0,0,0,0|1,1,0]=3 261 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)Br 7a_100000186472_100012094781 [1,0,0,0,0,0|1,1,0]=3 262 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)C 34a_100000749699_100012094781 [1,0,0,0,0,0|2,0,0]=3 263 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)C 7a_100000749699_100012094781 [1,0,0,0,0,0|2,0,0]=3 264 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100012094781 [1,0,0,0,0,0|1,0,0]=2 265 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100012094781 [1,0,0,0,0,0|1,0,0]=2 266 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)F 34a_100000212004_100012094781 [1,0,0,0,0,0|1,1,0]=3 267 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)F 7a_100000212004_100012094781 [1,0,0,0,0,0|1,1,0]=3 268 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)I 34a_100012360047_100012094781 [1,0,0,0,0,0|1,1,0]=3 269 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)I 7a_100012360047_100012094781 [1,0,0,0,0,0|1,1,0]=3 270 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)N 34a_100000744943_100012094781 [1,0,0,0,0,0|2,0,0]=3 271 B16R1.258 C#CCCCCCOc1ccc(cc1Cl)N 7a_100000744943_100012094781 [1,0,0,0,0,0|2,0,0]=3 272 B16R1.258 C#CCCCCCOc1ccc(cc1F)Br 34a_100000185481_100012094781 [1,0,0,0,0,0|1,2,0]=4 273 B16R1.258 C#CCCCCCOc1ccc(cc1F)Br 7a_100000185481_100012094781 [1,0,0,0,0,0|1,2,0]=4 274 B16R1.258 C#CCCCCCOc1ccc(cc1F)C 34a_100011216688_100012094781 [1,0,0,0,0,0|2,1,0]=4 275 B16R1.258 C#CCCCCCOc1ccc(cc1F)C 7a_100011216688_100012094781 [1,0,0,0,0,0|2,1,0]=4 276 B16R1.258 C#CCCCCCOc1ccc(cc1F)Cl 34a_100000230166_100012094781 [1,0,0,0,0,0|1,1,0]=3 277 B16R1.258 C#CCCCCCOc1ccc(cc1F)Cl 7a_100000230166_100012094781 [1,0,0,0,0,0|1,1,0]=3 278 B16R1.258 C#CCCCCCOc1ccc(cc1F)F 34a_100000230127_100012094781 [1,0,0,0,0,0|1,2,0]=4 279 B16R1.258 C#CCCCCCOc1ccc(cc1F)F 7a_100000230127_100012094781 [1,0,0,0,0,0|1,2,0]=4 280 B16R1.258 C#CCCCCCOc1ccc(cc1F)I 34a_100011356965_100012094781 [1,0,0,0,0,0|1,2,0]=4 281 B16R1.258 C#CCCCCCOc1ccc(cc1F)I 7a_100011356965_100012094781 [1,0,0,0,0,0|1,2,0]=4 282 B16R1.258 C#CCCCCCOc1ccc(cc1F)N 34a_100011220035_100012094781 [1,0,0,0,0,0|2,1,0]=4 283 B16R1.258 C#CCCCCCOc1ccc(cc1F)N 7a_100011220035_100012094781 [1,0,0,0,0,0|2,1,0]=4 284 B16R1.258 C#CCCCCCOc1ccc(cc1I)Br 34a_100012355227_100012094781 [1,0,0,0,0,0|1,2,0]=4 285 B16R1.258 C#CCCCCCOc1ccc(cc1I)Br 7a_100012355227_100012094781 [1,0,0,0,0,0|1,2,0]=4 286 B16R1.258 C#CCCCCCOc1ccc(cc1I)C 34a_100000765521_100012094781 [1,0,0,0,0,0|2,1,0]=4 287 B16R1.258 C#CCCCCCOc1ccc(cc1I)C 7a_100000765521_100012094781 [1,0,0,0,0,0|2,1,0]=4 288 B16R1.258 C#CCCCCCOc1ccc(cc1I)Cl 34a_100011356953_100012094781 [1,0,0,0,0,0|1,1,0]=3 289 B16R1.258 C#CCCCCCOc1ccc(cc1I)Cl 7a_100011356953_100012094781 [1,0,0,0,0,0|1,1,0]=3 290 B16R1.258 C#CCCCCCOc1ccc(cc1I)F 34a_100012355409_100012094781 [1,0,0,0,0,0|1,2,0]=4 291 B16R1.258 C#CCCCCCOc1ccc(cc1I)F 7a_100012355409_100012094781 [1,0,0,0,0,0|1,2,0]=4 292 B16R1.258 C#CCCCCCOc1ccc(cc1I)I 7a_100010001573_100012094781 [1,0,0,0,0,0|1,2,0]=4 293 B16R1.258 C#CCCCCCOc1ccc(cc1N)Br 34a_100000752626_100012094781 [1,0,0,0,0,0|2,1,0]=4 294 B16R1.258 C#CCCCCCOc1ccc(cc1N)Br 7a_100000752626_100012094781 [1,0,0,0,0,0|2,1,0]=4 295 B16R1.258 C#CCCCCCOc1ccc(cc1N)C 34a_100011215204_100012094781 [1,0,0,0,0,0|3,0,0]=4 296 B16R1.258 C#CCCCCCOc1ccc(cc1N)C 7a_100011215204_100012094781 [1,0,0,0,0,0|3,0,0]=4 297 B16R1.258 C#CCCCCCOc1ccc(cc1N)Cl 34a_100000210500_100012094781 [1,0,0,0,0,0|2,0,0]=3 298 B16R1.258 C#CCCCCCOc1ccc(cc1N)Cl 7a_100000210500_100012094781 [1,0,0,0,0,0|2,0,0]=3 299 B16R1.258 C#CCCCCCOc1ccc(cc1N)F 34a_100000759472_100012094781 [1,0,0,0,0,0|2,1,0]=4 300 B16R1.258 C#CCCCCCOc1ccc(cc1N)F 7a_100000759472_100012094781 [1,0,0,0,0,0|2,1,0]=4 301 B16R1.258 C#CCCCCCOc1ccc(cc1N)I 34a_100000753495_100012094781 [1,0,0,0,0,0|2,1,0]=4 302 B16R1.258 C#CCCCCCOc1ccc(cc1N)I 7a_100000753495_100012094781 [1,0,0,0,0,0|2,1,0]=4 303 B16R1.258 C#CCCCCCOc1ccc(cc1N)N 34a_100000725306_100012094781 [1,0,0,0,0,0|3,0,0]=4 304 B16R1.258 C#CCCCCCOc1ccc(nc1Br)Cl 34a_100010219353_100012094781 [1,0,0,0,0,0|2,1,0]=4 305 B16R1.258 C#CCCCCCOc1ccc(nc1Br)Cl 7a_100010219353_100012094781 [1,0,0,0,0,0|2,1,0]=4 306 B16R1.258 C#CCCCCCOc1ccc(nc1C)Cl 34a_100012184626_100012094781 [1,0,0,0,0,0|3,0,0]=4 307 B16R1.258 C#CCCCCCOc1ccc(nc1C)Cl 7a_100012184626_100012094781 [1,0,0,0,0,0|3,0,0]=4 308 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)Br 34a_100010246206_100012094781 [1,0,0,0,0,0|2,1,0]=4 309 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)Br 7a_100010246206_100012094781 [1,0,0,0,0,0|2,1,0]=4 310 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)C 34a_100000086286_100012094781 [1,0,0,0,0,0|3,0,0]=4 311 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)C 7a_100000086286_100012094781 [1,0,0,0,0,0|3,0,0]=4 312 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)Cl 34a_100000101165_100012094781 [1,0,0,0,0,0|2,0,0]=3 313 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)Cl 7a_100000101165_100012094781 [1,0,0,0,0,0|2,0,0]=3 314 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)I 34a_100000721234_100012094781 [1,0,0,0,0,0|2,1,0]=4 315 B16R1.258 C#CCCCCCOc1ccc(nc1Cl)I 7a_100000721234_100012094781 [1,0,0,0,0,0|2,1,0]=4 316 B16R1.258 C#CCCCCCOc1ccc(nc1F)Cl 34a_100009880201_100012094781 [1,0,0,0,0,0|2,1,0]=4 317 B16R1.258 C#CCCCCCOc1ccc(nc1F)Cl 7a_100009880201_100012094781 [1,0,0,0,0,0|2,1,0]=4 318 B16R1.258 C#CCCCCCOc1ccc(nc1I)Cl 34a_100000696390_100012094781 [1,0,0,0,0,0|2,1,0]=4 319 B16R1.258 C#CCCCCCOc1ccc(nc1I)Cl 7a_100000696390_100012094781 [1,0,0,0,0,0|2,1,0]=4 320 B16R1.258 C#CCCCCCOc1ccc(nc1N)Cl 34a_100000717809_100012094781 [1,0,0,0,0,0|3,0,0]=4 321 B16R1.258 C#CCCCCCOc1ccc(nc1N)Cl 7a_100000717809_100012094781 [1,0,0,0,0,0|3,0,0]=4 322 B16R1.258 C#CCCCCCOc1cnc(cc1C)Cl 34a_100000692680_100012094781 [1,0,0,0,0,0|3,0,0]=4 323 B16R1.258 C#CCCCCCOc1cnc(cc1C)Cl 7a_100000692680_100012094781 [1,0,0,0,0,0|3,0,0]=4 324 B16R1.258 C#CCCCCCOc1cnc(cc1Cl)Cl 34a_100009868576_100012094781 [1,0,0,0,0,0|2,0,0]=3 325 B16R1.258 C#CCCCCCOc1cnc(cc1Cl)Cl 7a_100009868576_100012094781 [1,0,0,0,0,0|2,0,0]=3 326 B16R1.258 C#CCCCCCOc1cnc(cc1I)Cl 34a_100000698892_100012094781 [1,0,0,0,0,0|2,1,0]=4 327 B16R1.258 C#CCCCCCOc1cnc(cc1I)Cl 7a_100000698892_100012094781 [1,0,0,0,0,0|2,1,0]=4 328 B16R1.258 C#CCCCCCOc1cnc(nc1Cl)Cl 34a_100010725077_100012094781 [1,0,0,0,0,0|3,0,0]=4 329 B16R1.258 C#CCCCCCOc1cnc(nc1Cl)Cl 7a_100010725077_100012094781 [1,0,0,0,0,0|3,0,0]=4 330 B16R1.258 C#CCCCCCOc1ncc(cc1Cl)Br 34a_100012339560_100012094781 [1,0,0,0,0,0|2,1,0]=4 331 B16R1.258 C#CCCCCCOc1ncc(cc1Cl)F 34a_100009847679_100012094781 [1,0,0,0,0,0|2,1,0]=4 332 B16R1.258 C#CCCCCCOc1ncc(cc1F)Cl 34a_100011998252_100012094781 [1,0,0,0,0,0|2,1,0]=4 333 B16R1.258 C#CCCCCCOc1ncc(cc1N)Cl 34a_100011998249_100012094781 [1,0,0,0,0,0|3,0,0]=4 334 B16R1.258 C#CCCCCCSc1ccc(cc1C)Cl 62a_100011219607_100012094781 [1,0,0,0,0,0|2,1,0]=4 335 B16R1.258 C#CCCCCCSc1ccc(cc1C)Cl 62a_100012094781_100011219607 [1,0,0,0,0,0|2,1,0]=4 336 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)C 62a_100011263221_100012094781 [1,0,0,0,0,0|2,1,0]=4 337 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)C 62a_100012094781_100011263221 [1,0,0,0,0,0|2,1,0]=4 338 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)F 62a_100000733362_100012094781 [1,0,0,0,0,0|1,2,0]=4 339 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)F 62a_100012094781_100000733362 [1,0,0,0,0,0|1,2,0]=4 340 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)N 62a_100000761885_100012094781 [1,0,0,0,0,0|2,1,0]=4 341 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)N 62a_100012094781_100000761885 [1,0,0,0,0,0|2,1,0]=4 342 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)O 62a_100000047559_100012094781 [1,0,0,0,0,0|2,1,0]=4 343 B16R1.258 C#CCCCCCSc1ccc(cc1Cl)O 62a_100012094781_100000047559 [1,0,0,0,0,0|2,1,0]=4 344 B16R1.258 C#CCCCCCSc1ccc(cc1F)Cl 62a_100011216042_100012094781 [1,0,0,0,0,0|1,2,0]=4 345 B16R1.258 C#CCCCCCSc1ccc(cc1F)Cl 62a_100012094781_100011216042 [1,0,0,0,0,0|1,2,0]=4 346 B16R1.258 C#CCCCCCSc1ccc(cc1N)Cl 62a_100000761886_100012094781 [1,0,0,0,0,0|2,1,0]=4 347 B16R1.258 C#CCCCCCSc1ccc(cc1N)Cl 62a_100012094781_100000761886 [1,0,0,0,0,0|2,1,0]=4 348 B16R1.258 C#CCCCCCSc1ccc(cc1O)Cl 62a_100000050036_100012094781 [1,0,0,0,0,0|2,1,0]=4 349 B16R1.258 C#CCCCCCSc1ccc(cc1O)Cl 62a_100012094781_100000050036 [1,0,0,0,0,0|2,1,0]=4 350 B16R1.258 C#CCCCCCSc1ccc(nc1Cl)Cl 62a_100012094781_100000043682 [1,0,0,0,0,0|2,1,0]=4 351 B16R1.258 C#CCCCCCSc1cnc(cc1Cl)Cl 62a_100010200927_100012094781 [1,0,0,0,0,0|2,1,0]=4 352 B16R1.258 C#CCCCCCSc1cnc(cc1Cl)Cl 62a_100012094781_100010200927 [1,0,0,0,0,0|2,1,0]=4 353 B16R1.258 C#CCCCCNCc1ccc(cc1Cl)Cl 207a_100000706060_100000188887 [1,0,0,0,0,0|3,0,0]=4 354 B16R1.258 C#CCCCCNCc1ccc(cc1Cl)Cl 2230a_100000706060_100000188473 [1,0,0,0,0,0|3,0,0]=4 355 B16R1.258 C#CCCCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100010269958 [1,0,0,0,0,0|3,0,0]=4 356 B16R1.258 C#CCCCCNCc1ccc(cc1Cl)Cl 34a_100000706060_100000188473 [1,0,0,0,0,0|3,0,0]=4 357 B16R1.258 C#CCCCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100010269958 [1,0,0,0,0,0|3,0,0]=4 358 B16R1.258 C#CCCCCOCc1ccc(cc1Cl)Cl 34a_100000766709_100000188473 [1,0,0,0,0,0|3,0,0]=4 359 B16R1.258 C#CCCCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100010269958 [1,0,0,0,0,0|3,0,0]=4 360 B16R1.258 C#CCCCCOCc1ccc(cc1Cl)Cl 7a_100000766709_100000188473 [1,0,0,0,0,0|3,0,0]=4 361 B16R1.258 C#CCCCNCCc1ccc(cc1Cl)Cl 2230a_100000210994_100000731252 [1,0,0,0,0,0|3,0,0]=4 362 B16R1.258 C#CCCCNCCc1ccc(cc1Cl)Cl 34a_100000210994_100000695029 [1,0,0,0,0,0|3,0,0]=4 363 B16R1.258 C#CCCCNCCc1ccc(cc1Cl)Cl 34a_100000718082_200012161198 [1,0,0,0,0,0|3,0,0]=4 364 B16R1.258 C#CCCCOCCc1ccc(cc1Cl)Cl 34a_100000215630_200012161198 [1,0,0,0,0,0|3,0,0]=4 365 B16R1.258 C#CCCCOCCc1ccc(cc1Cl)Cl 34a_100011215701_100000695029 [1,0,0,0,0,0|3,0,0]=4 366 B16R1.258 C#CCCCOCCc1ccc(cc1Cl)Cl 7a_100000215630_200012161198 [1,0,0,0,0,0|3,0,0]=4 367 B16R1.258 C#CCCCOCCc1ccc(cc1Cl)Cl 7a_100011215701_100011215417 [1,0,0,0,0,0|3,0,0]=4 368 B16R1.258 C#CCCCSCCc1ccc(cc1Cl)Cl 62a_100011215417_200012161198 [1,0,0,0,0,0|3,0,0]=4 369 B16R1.258 C#CCCCSCCc1ccc(cc1Cl)Cl 62a_200012161198_100011215417 [1,0,0,0,0,0|3,0,0]=4 370 B16R1.258 C#CCCNCCOc1ccc(cc1Br)Cl 34a_100000755551_100000199037 [1,0,0,0,0,0|2,1,0]=4 371 B16R1.258 C#CCCNCCOc1ccc(cc1C)Cl 2230a_100025744827_100000688953 [1,0,0,0,0,0|3,0,0]=4 372 B16R1.258 C#CCCNCCOc1ccc(cc1C)Cl 34a_100025744827_100000688953 [1,0,0,0,0,0|3,0,0]=4 373 B16R1.258 C#CCCNCCOc1ccc(cc1Cl)Cl 34a_100000755551_100000184432 [1,0,0,0,0,0|2,0,0]=3 374 B16R1.258 C#CCCNCCOc1ccc(cc1Cl)F 2230a_100020586385_100000688953 [1,0,0,0,0,0|2,1,0]=4 375 B16R1.258 C#CCCNCCOc1ccc(cc1Cl)F 34a_100020586385_100000688953 [1,0,0,0,0,0|2,1,0]=4 376 B16R1.258 C#CCCOCCCc1ccc(cc1Cl)Cl 34a_200011713141_100000688953 [1,0,0,0,0,0|3,0,0]=4 377 B16R1.258 C#CCCOCCCc1ccc(cc1Cl)Cl 7a_200011713141_100000688953 [1,0,0,0,0,0|3,0,0]=4 378 B16R1.258 C#CCCOCCOc1ccc(cc1Br)Cl 34a_100000193638_100000688953 [1,0,0,0,0,0|2,1,0]=4 379 B16R1.258 C#CCCOCCOc1ccc(cc1Br)Cl 34a_100011215631_100000199037 [1,0,0,0,0,0|2,1,0]=4 380 B16R1.258 C#CCCOCCOc1ccc(cc1Br)Cl 7a_100000193638_100000688953 [1,0,0,0,0,0|2,1,0]=4 381 B16R1.258 C#CCCOCCOc1ccc(cc1Cl)Cl 34a_100011215631_100000184432 [1,0,0,0,0,0|2,0,0]=3 382 B16R1.258 C#CCCOCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000688953 [1,0,0,0,0,0|2,0,0]=3 383 B16R1.258 C#CCCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000688953 [1,0,0,0,0,0|2,0,0]=3 384 B16R1.258 C#CCCOCCSc1ccc(cc1Cl)Cl 34a_200010001942_100000688953 [1,0,0,0,0,0|2,1,0]=4 385 B16R1.258 C#CCCOCCSc1ccc(cc1Cl)Cl 7a_200010001942_100000688953 [1,0,0,0,0,0|2,1,0]=4 386 B16R1.258 C#CCCSCCOc1ccc(cc1Br)Cl 62a_100000199037_100000688953 [1,0,0,0,0,0|2,1,0]=4 387 B16R1.258 C#CCCSCCOc1ccc(cc1Br)Cl 62a_100000688953_100000199037 [1,0,0,0,0,0|2,1,0]=4 388 B16R1.258 C#CCCSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000688953 [1,0,0,0,0,0|2,0,0]=3 389 B16R1.258 C#CCCSCCOc1ccc(cc1Cl)Cl 62a_100000688953_100000184432 [1,0,0,0,0,0|2,0,0]=3 390 B16R1.258 C#CCNCCSCc1ccc(cc1Cl)Cl 2230a_100000696970_100000038162 [1,0,0,0,0,0|2,0,0]=3 391 B16R1.258 C#CCNCCSCc1ccc(cc1Cl)Cl 34a_100000696970_100000184674 [1,0,0,0,0,0|2,0,0]=3 392 B16R1.258 C#CCNCCSCc1ccc(cc1Cl)Cl 7a_100000696970_100000038162 [1,0,0,0,0,0|2,0,0]=3 393 B16R1.258 C#CCOCCNCc1ccc(cc1Cl)Cl 2230a_100000700922_100000188473 [1,0,0,0,0,0|3,0,0]=4 394 B16R1.258 C#CCOCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100010402529 [1,0,0,0,0,0|3,0,0]=4 395 B16R1.258 C#CCOCCNCc1ccc(cc1Cl)Cl 34a_100000700922_100000188473 [1,0,0,0,0,0|3,0,0]=4 396 B16R1.258 C#CCOCCOCc1ccc(cc1Cl)Cl 34a_100000054580_100000188473 [1,0,0,0,0,0|3,0,0]=4 397 B16R1.258 C#CCOCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100010402529 [1,0,0,0,0,0|3,0,0]=4 398 B16R1.258 C#CCOCCOCc1ccc(cc1Cl)Cl 7a_100000054580_100000188473 [1,0,0,0,0,0|3,0,0]=4 399 B16R1.258 C#CCOCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100010402529 [1,0,0,0,0,0|3,0,0]=4 400 B16R1.258 C#CCOCCSCc1ccc(cc1Cl)Cl 62a_100000188473_100010402529 [1,0,0,0,0,0|3,0,0]=4 401 B16R1.258 C#CCOCCSCc1ccc(cc1Cl)Cl 62a_100010402529_100000188473 [1,0,0,0,0,0|3,0,0]=4 402 B16R1.258 Cc1cc(ccc1OCCCCCC#N)Cl 7a_100000211091_100009813376 [1,0,0,0,0,0|3,0,0]=4 403 B16R1.258 Cc1ccc(c(c1)Cl)OCCCCCC#N 7a_100000749699_100009813376 [1,0,0,0,0,0|3,0,0]=4 404 B16R1.258 FCCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100015922095 [1,0,0,0,0,0|2,0,1]=4 405 B16R1.258 FCCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100015922095 [1,0,0,0,0,0|2,0,1]=4 406 B16R1.258 N#CCCCCCOc1ccc(cc1Br)Cl 7a_100000211998_100009813376 [1,0,0,0,0,0|2,1,0]=4 407 B16R1.258 N#CCCCCCOc1ccc(cc1Cl)Br 7a_100000186472_100009813376 [1,0,0,0,0,0|2,1,0]=4 408 B16R1.258 N#CCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100009813376 [1,0,0,0,0,0|2,0,0]=3 409 B16R1.258 N#CCCCCCOc1ccc(cc1Cl)F 7a_100000212004_100009813376 [1,0,0,0,0,0|2,1,0]=4 410 B16R1.258 N#CCCCCCOc1ccc(cc1Cl)I 7a_100012360047_100009813376 [1,0,0,0,0,0|2,1,0]=4 411 B16R1.258 N#CCCCCCOc1ccc(cc1Cl)N 7a_100000744943_100009813376 [1,0,0,0,0,0|3,0,0]=4 412 B16R1.258 N#CCCCCCOc1ccc(cc1F)Cl 7a_100000230166_100009813376 [1,0,0,0,0,0|2,1,0]=4 413 B16R1.258 N#CCCCCCOc1ccc(cc1I)Cl 7a_100011356953_100009813376 [1,0,0,0,0,0|2,1,0]=4 414 B16R1.258 N#CCCCCCOc1ccc(cc1N)Cl 7a_100000210500_100009813376 [1,0,0,0,0,0|3,0,0]=4 415 B16R1.258 N#CCCCCCOc1ccc(nc1Cl)Cl 7a_100000101165_100009813376 [1,0,0,0,0,0|3,0,0]=4 416 B16R1.258 N#CCCCCCOc1cnc(cc1Cl)Cl 7a_100009868576_100009813376 [1,0,0,0,0,0|3,0,0]=4 417 B16R1.258 N#CCCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000184422 [1,0,0,0,0,0|3,0,0]=4 418 B16R1.258 N#CCCSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100011215226 [1,0,0,0,0,0|3,0,0]=4 419 B16R1.258 N#CCCSCCOc1ccc(cc1Cl)Cl 62a_100011215226_100000184432 [1,0,0,0,0,0|3,0,0]=4 420 B16R1.258 N#CCNCCSCc1ccc(cc1Cl)Cl 2230a_100000696970_100011215382 [1,0,0,0,0,0|3,0,0]=4 421 B16R1.258 N#CCNCCSCc1ccc(cc1Cl)Cl 7a_100000696970_100011215382 [1,0,0,0,0,0|3,0,0]=4 422 B16R1.258 O=CCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000139337 [1,0,0,0,0,0|2,0,1]=4 423 B16R1.258 OCCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000766143 [1,0,0,0,0,0|2,0,1]=4 424 B16R1.258 OCCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000766143 [1,0,0,0,0,0|2,0,1]=4 425 B16R1.889 C#CCC(=O)CCCOc1ccccc1Br 1458a_100011220946_200011259276 [1,0,0,0,0,0|2,1,0]=4 426 B16R1.889 C#CCC(=O)CCCOc1ccccc1C 1458a_100000735866_100000184674 [1,0,0,0,0,0|3,0,0]=4 427 B16R1.889 C#CCC(=O)CCCOc1ccccc1C 1458a_100011220946_100000742659 [1,0,0,0,0,0|3,0,0]=4 428 B16R1.889 C#CCC(=O)CCCOc1ccccc1Cl 1458a_100000747900_100000184674 [1,0,0,0,0,0|2,0,0]=3 429 B16R1.889 C#CCC(=O)CCCOc1ccccc1F 1458a_100011220946_100011203253 [1,0,0,0,0,0|2,1,0]=4 430 B16R1.889 C#CCC(=O)CCCSc1ccccc1Cl 1458a_100011220946_100000750589 [1,0,0,0,0,0|2,1,0]=4 431 B16R1.889 C#CCC(=O)NCCOc1ccccc1Cl 1626a_100000174932_100011220946 [1,0,0,0,0,0|3,0,0]=4 432 B16R1.889 C#CCC(=O)NCCOc1ccccc1Cl 527a_100000174932_100011220946 [1,0,0,0,0,0|3,0,0]=4 433 B16R1.889 C#CCC(C)OCCOc1ccccc1Br 34a_100000685586_100000695877 [1,0,0,0,0,0|2,1,0]=4 434 B16R1.889 C#CCC(C)OCCOc1ccccc1Br 7a_100000685586_100000695877 [1,0,0,0,0,0|2,1,0]=4 435 B16R1.889 C#CCC(C)OCCOc1ccccc1C 34a_100000685586_100000184434 [1,0,0,0,0,0|3,0,0]=4 436 B16R1.889 C#CCC(C)OCCOc1ccccc1C 7a_100000685586_100000184434 [1,0,0,0,0,0|3,0,0]=4 437 B16R1.889 C#CCC(C)OCCOc1ccccc1F 34a_100000685586_100000183290 [1,0,0,0,0,0|2,1,0]=4 438 B16R1.889 C#CCC(C)OCCOc1ccccc1F 7a_100000685586_100000183290 [1,0,0,0,0,0|2,1,0]=4 439 B16R1.889 C#CCN(C)CCCOc1ccccc1Br 2230a_100000225692_200011259276 [1,0,0,0,0,0|0,1,0]=2 440 B16R1.889 C#CCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000038162 [1,0,0,0,0,0|0,1,0]=2 441 B16R1.889 C#CCN(C)CCCOc1ccccc1Br 34a_100000225692_200011259276 [1,0,0,0,0,0|0,1,0]=2 442 B16R1.889 C#CCN(C)CCCOc1ccccc1C 2230a_100000225692_100000742659 [1,0,0,0,0,0|1,0,0]=2 443 B16R1.889 C#CCN(C)CCCOc1ccccc1C 2230a_100000742905_100000038162 [1,0,0,0,0,0|1,0,0]=2 444 B16R1.889 C#CCN(C)CCCOc1ccccc1C 34a_100000225692_100000742659 [1,0,0,0,0,0|1,0,0]=2 445 B16R1.889 C#CCN(C)CCCOc1ccccc1C 34a_100000742905_100000184674 [1,0,0,0,0,0|1,0,0]=2 446 B16R1.889 C#CCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000038162 [1,0,0,0,0,0|0,0,0]=1 447 B16R1.889 C#CCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000184674 [1,0,0,0,0,0|0,0,0]=1 448 B16R1.889 C#CCN(C)CCCOc1ccccc1F 2230a_100000225692_100011203253 [1,0,0,0,0,0|0,1,0]=2 449 B16R1.889 C#CCN(C)CCCOc1ccccc1F 34a_100000225692_100011203253 [1,0,0,0,0,0|0,1,0]=2 450 B16R1.889 C#CCN(C)CCCSc1ccccc1Cl 2230a_100000225692_100000750589 [1,0,0,0,0,0|0,1,0]=2 451 B16R1.889 C#CCN(C)CCCSc1ccccc1Cl 34a_100000225692_100000750589 [1,0,0,0,0,0|0,1,0]=2 452 B16R1.889 C=CCN(C)CCCOc1ccccc1Br 2230a_100000225617_200011259276 [1,0,0,0,0,0|0,1,2]=4 453 B16R1.889 C=CCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000210623 [1,0,0,0,0,0|0,1,2]=4 454 B16R1.889 C=CCN(C)CCCOc1ccccc1Br 269982a_100000225617_200011259276 [1,0,0,0,0,0|0,1,2]=4 455 B16R1.889 C=CCN(C)CCCOc1ccccc1Br 269982a_100015186278_100000210623 [1,0,0,0,0,0|0,1,2]=4 456 B16R1.889 C=CCN(C)CCCOc1ccccc1C 2230a_100000225617_100000742659 [1,0,0,0,0,0|1,0,2]=4 457 B16R1.889 C=CCN(C)CCCOc1ccccc1C 2230a_100000742905_100000210623 [1,0,0,0,0,0|1,0,2]=4 458 B16R1.889 C=CCN(C)CCCOc1ccccc1C 269982a_100000225617_100000742659 [1,0,0,0,0,0|1,0,2]=4 459 B16R1.889 C=CCN(C)CCCOc1ccccc1C 269982a_100000742905_100000210623 [1,0,0,0,0,0|1,0,2]=4 460 B16R1.889 C=CCN(C)CCCOc1ccccc1C 34a_100000742905_100015514636 [1,0,0,0,0,0|1,0,2]=4 461 B16R1.889 C=CCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000210623 [1,0,0,0,0,0|0,0,2]=3 462 B16R1.889 C=CCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000210623 [1,0,0,0,0,0|0,0,2]=3 463 B16R1.889 C=CCN(C)CCCOc1ccccc1Cl 34a_100011252689_100015514636 [1,0,0,0,0,0|0,0,2]=3 464 B16R1.889 C=CCN(C)CCCOc1ccccc1F 2230a_100000225617_100011203253 [1,0,0,0,0,0|0,1,2]=4 465 B16R1.889 C=CCN(C)CCCOc1ccccc1F 269982a_100000225617_100011203253 [1,0,0,0,0,0|0,1,2]=4 466 B16R1.889 C=CCN(C)CCCSc1ccccc1Cl 2230a_100000225617_100000750589 [1,0,0,0,0,0|0,1,2]=4 467 B16R1.889 C=CCN(C)CCCSc1ccccc1Cl 269982a_100000225617_100000750589 [1,0,0,0,0,0|0,1,2]=4 468 B16R1.889 CC(CC#N)NCCOc1ccccc1Cl 2230a_100000174932_100009813641 [1,0,0,0,0,0|3,0,0]=4 469 B16R1.889 CC(CC#N)OCCOc1ccccc1Cl 7a_200000230518_100009813641 [1,0,0,0,0,0|3,0,0]=4 470 B16R1.889 CCCN(C)CCCOc1ccccc1Br 2230a_100000747261_200011259276 [1,0,0,0,0,0|0,1,2]=4 471 B16R1.889 CCCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000210303 [1,0,0,0,0,0|0,1,2]=4 472 B16R1.889 CCCN(C)CCCOc1ccccc1Br 269982a_100000747261_200011259276 [1,0,0,0,0,0|0,1,2]=4 473 B16R1.889 CCCN(C)CCCOc1ccccc1Br 269982a_100015186278_100000210303 [1,0,0,0,0,0|0,1,2]=4 474 B16R1.889 CCCN(C)CCCOc1ccccc1C 2230a_100000742905_100000210303 [1,0,0,0,0,0|1,0,2]=4 475 B16R1.889 CCCN(C)CCCOc1ccccc1C 2230a_100000747261_100000742659 [1,0,0,0,0,0|1,0,2]=4 476 B16R1.889 CCCN(C)CCCOc1ccccc1C 269982a_100000742905_100000210303 [1,0,0,0,0,0|1,0,2]=4 477 B16R1.889 CCCN(C)CCCOc1ccccc1C 269982a_100000747261_100000742659 [1,0,0,0,0,0|1,0,2]=4 478 B16R1.889 CCCN(C)CCCOc1ccccc1C 34a_100000742905_100000210303 [1,0,0,0,0,0|1,0,2]=4 479 B16R1.889 CCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000210303 [1,0,0,0,0,0|0,0,2]=3 480 B16R1.889 CCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000210303 [1,0,0,0,0,0|0,0,2]=3 481 B16R1.889 CCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000210303 [1,0,0,0,0,0|0,0,2]=3 482 B16R1.889 CCCN(C)CCCOc1ccccc1F 2230a_100000747261_100011203253 [1,0,0,0,0,0|0,1,2]=4 483 B16R1.889 CCCN(C)CCCOc1ccccc1F 269982a_100000747261_100011203253 [1,0,0,0,0,0|0,1,2]=4 484 B16R1.889 CCCN(C)CCCSc1ccccc1Cl 2230a_100000747261_100000750589 [1,0,0,0,0,0|0,1,2]=4 485 B16R1.889 CCCN(C)CCCSc1ccccc1Cl 269982a_100000747261_100000750589 [1,0,0,0,0,0|0,1,2]=4 486 B16R1.889 CN(CC#N)CCCOc1ccccc1Br 2230a_100000748184_200011259276 [1,0,0,0,0,0|1,1,0]=3 487 B16R1.889 CN(CC#N)CCCOc1ccccc1Br 2230a_100015186278_100011215382 [1,0,0,0,0,0|1,1,0]=3 488 B16R1.889 CN(CC#N)CCCOc1ccccc1Br 269982a_100015186278_100011214920 [1,0,0,0,0,0|1,1,0]=3 489 B16R1.889 CN(CC#N)CCCOc1ccccc1Cl 2230a_100011252689_100011215382 [1,0,0,0,0,0|1,0,0]=2 490 B16R1.889 CN(CC#N)CCCOc1ccccc1Cl 269982a_100011252689_100011214920 [1,0,0,0,0,0|1,0,0]=2 491 B16R1.889 CN(CC#N)CCCOc1ccccc1F 2230a_100000748184_100011203253 [1,0,0,0,0,0|1,1,0]=3 492 B16R1.889 CN(CC#N)CCCSc1ccccc1Cl 2230a_100000748184_100000750589 [1,0,0,0,0,0|1,1,0]=3 493 B16R1.889 CN(CC=O)CCCOc1ccccc1Br 2230a_100015186278_200015260668 [1,0,0,0,0,0|1,1,1]=4 494 B16R1.889 CN(CC=O)CCCOc1ccccc1Br 269982a_100015186278_200015260668 [1,0,0,0,0,0|1,1,1]=4 495 B16R1.889 CN(CC=O)CCCOc1ccccc1Cl 2230a_100011252689_200015260668 [1,0,0,0,0,0|1,0,1]=3 496 B16R1.889 CN(CC=O)CCCOc1ccccc1Cl 269982a_100011252689_200015260668 [1,0,0,0,0,0|1,0,1]=3 497 B16R1.889 CN(CC=O)CCCOc1ccccc1Cl 34a_100011252689_200009817547 [1,0,0,0,0,0|1,0,1]=3 498 B16R1.889 CN(CCF)CCCOc1ccccc1Br 2230a_100015186278_100011217306 [1,0,0,0,0,0|1,1,1]=4 499 B16R1.889 CN(CCF)CCCOc1ccccc1Br 269982a_100015186278_100011217306 [1,0,0,0,0,0|1,1,1]=4 500 B16R1.889 CN(CCF)CCCOc1ccccc1Cl 2230a_100011252689_100011217306 [1,0,0,0,0,0|1,0,1]=3 501 B16R1.889 CN(CCF)CCCOc1ccccc1Cl 269982a_100011252689_100011217306 [1,0,0,0,0,0|1,0,1]=3 502 B16R1.889 CN(CCF)CCCOc1ccccc1Cl 34a_100011252689_100011217306 [1,0,0,0,0,0|1,0,1]=3 503 B16R1.889 CN(CCO)CCCOc1ccccc1Br 2230a_100000210263_200011259276 [1,0,0,0,0,0|1,1,1]=4 504 B16R1.889 CN(CCO)CCCOc1ccccc1Br 2230a_100015186278_100000211926 [1,0,0,0,0,0|1,1,1]=4 505 B16R1.889 CN(CCO)CCCOc1ccccc1Br 269982a_100000210263_200011259276 [1,0,0,0,0,0|1,1,1]=4 506 B16R1.889 CN(CCO)CCCOc1ccccc1Br 269982a_100015186278_100000211926 [1,0,0,0,0,0|1,1,1]=4 507 B16R1.889 CN(CCO)CCCOc1ccccc1Cl 2230a_100011252689_100000211926 [1,0,0,0,0,0|1,0,1]=3 508 B16R1.889 CN(CCO)CCCOc1ccccc1Cl 269982a_100011252689_100000211926 [1,0,0,0,0,0|1,0,1]=3 509 B16R1.889 CN(CCO)CCCOc1ccccc1Cl 34a_100011252689_100000211926 [1,0,0,0,0,0|1,0,1]=3 510 B16R1.889 CN(CCO)CCCOc1ccccc1F 2230a_100000210263_100011203253 [1,0,0,0,0,0|1,1,1]=4 511 B16R1.889 CN(CCO)CCCOc1ccccc1F 269982a_100000210263_100011203253 [1,0,0,0,0,0|1,1,1]=4 512 B16R1.889 CN(CCO)CCCSc1ccccc1Cl 2230a_100000210263_100000750589 [1,0,0,0,0,0|1,1,1]=4 513 B16R1.889 CN(CCO)CCCSc1ccccc1Cl 269982a_100000210263_100000750589 [1,0,0,0,0,0|1,1,1]=4 514 B16R1.889 COCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000766300 [1,0,0,0,0,0|1,1,1]=4 515 B16R1.889 COCN(C)CCCOc1ccccc1Br 269982a_100015186278_100000766300 [1,0,0,0,0,0|1,1,1]=4 516 B16R1.889 COCN(C)CCCOc1ccccc1C 2230a_100000742905_100000766300 [1,0,0,0,0,0|2,0,1]=4 517 B16R1.889 COCN(C)CCCOc1ccccc1C 269982a_100000742905_100000766300 [1,0,0,0,0,0|2,0,1]=4 518 B16R1.889 COCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000766300 [1,0,0,0,0,0|1,0,1]=3 519 B16R1.889 COCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000766300 [1,0,0,0,0,0|1,0,1]=3 520 B16R1.889 CSCN(C)CCCOc1ccccc1Br 2230a_100015186278_100011218213 [1,0,0,0,0,0|1,1,1]=4 521 B16R1.889 CSCN(C)CCCOc1ccccc1Br 269982a_100015186278_100011218213 [1,0,0,0,0,0|1,1,1]=4 522 B16R1.889 CSCN(C)CCCOc1ccccc1C 2230a_100000742905_100011218213 [1,0,0,0,0,0|2,0,1]=4 523 B16R1.889 CSCN(C)CCCOc1ccccc1C 269982a_100000742905_100011218213 [1,0,0,0,0,0|2,0,1]=4 524 B16R1.889 CSCN(C)CCCOc1ccccc1C 34a_100000742905_100011218213 [1,0,0,0,0,0|2,0,1]=4 525 B16R1.889 CSCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100011218213 [1,0,0,0,0,0|1,0,1]=3 526 B16R1.889 CSCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100011218213 [1,0,0,0,0,0|1,0,1]=3 527 B16R1.889 CSCN(C)CCCOc1ccccc1Cl 34a_100011252689_100011218213 [1,0,0,0,0,0|1,0,1]=3 528 B16R1.889 Cc1ccccc1OCCCN(C)CC#N 2230a_100000742905_100011215382 [1,0,0,0,0,0|2,0,0]=3 529 B16R1.889 Cc1ccccc1OCCCN(C)CC#N 2230a_100000748184_100000742659 [1,0,0,0,0,0|2,0,0]=3 530 B16R1.889 Cc1ccccc1OCCCN(C)CC#N 269982a_100000742905_100011214920 [1,0,0,0,0,0|2,0,0]=3 531 B16R1.889 Cc1ccccc1OCCCN(C)CC=O 2230a_100000742905_200015260668 [1,0,0,0,0,0|2,0,1]=4 532 B16R1.889 Cc1ccccc1OCCCN(C)CC=O 269982a_100000742905_200015260668 [1,0,0,0,0,0|2,0,1]=4 533 B16R1.889 Cc1ccccc1OCCCN(C)CC=O 34a_100000742905_200009817547 [1,0,0,0,0,0|2,0,1]=4 534 B16R1.889 Cc1ccccc1OCCCN(C)CCF 2230a_100000742905_100011217306 [1,0,0,0,0,0|2,0,1]=4 535 B16R1.889 Cc1ccccc1OCCCN(C)CCF 269982a_100000742905_100011217306 [1,0,0,0,0,0|2,0,1]=4 536 B16R1.889 Cc1ccccc1OCCCN(C)CCF 34a_100000742905_100011217306 [1,0,0,0,0,0|2,0,1]=4 537 B16R1.889 Cc1ccccc1OCCCN(C)CCO 2230a_100000210263_100000742659 [1,0,0,0,0,0|2,0,1]=4 538 B16R1.889 Cc1ccccc1OCCCN(C)CCO 2230a_100000742905_100000211926 [1,0,0,0,0,0|2,0,1]=4 539 B16R1.889 Cc1ccccc1OCCCN(C)CCO 269982a_100000210263_100000742659 [1,0,0,0,0,0|2,0,1]=4 540 B16R1.889 Cc1ccccc1OCCCN(C)CCO 269982a_100000742905_100000211926 [1,0,0,0,0,0|2,0,1]=4 541 B16R1.889 Cc1ccccc1OCCCN(C)CCO 34a_100000742905_100000211926 [1,0,0,0,0,0|2,0,1]=4 542 B16R1.889 N#CCC(=O)CCCOc1ccccc1Cl 1458a_100000747900_100011214920 [1,0,0,0,0,0|3,0,0]=4 543 B16R1.1318 C#CC(C)NCCCc1ccc(cc1Cl)Cl 270004a_100000707721_100000765304 [1,0,0,0,0,0|3,0,0]=4 544 B16R1.1318 C#CC(C)NCCOc1ccc(cc1Br)Cl 2230a_100000707721_100000199037 [1,0,0,0,0,0|2,1,0]=4 545 B16R1.1318 C#CC(C)NCCOc1ccc(cc1Br)Cl 34a_100000707721_100000199037 [1,0,0,0,0,0|2,1,0]=4 546 B16R1.1318 C#CC(C)NCCOc1ccc(cc1C)Cl 34a_100025744827_200000035995 [1,0,0,0,0,0|3,0,0]=4 547 B16R1.1318 C#CC(C)NCCOc1ccc(cc1Cl)Cl 2230a_100000707721_100000184432 [1,0,0,0,0,0|2,0,0]=3 548 B16R1.1318 C#CC(C)NCCOc1ccc(cc1Cl)Cl 34a_100000707721_100000184432 [1,0,0,0,0,0|2,0,0]=3 549 B16R1.1318 C#CC(C)NCCOc1ccc(cc1Cl)F 34a_100020586385_200000035995 [1,0,0,0,0,0|2,1,0]=4 550 B16R1.1318 C#CC(C)OCCCc1ccc(cc1Cl)Cl 34a_200011713141_200000035995 [1,0,0,0,0,0|3,0,0]=4 551 B16R1.1318 C#CC(C)OCCOc1ccc(cc1Br)Cl 34a_100000193638_200000035995 [1,0,0,0,0,0|2,1,0]=4 552 B16R1.1318 C#CC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_200000035995 [1,0,0,0,0,0|2,0,0]=3 553 B16R1.1318 C#CC(C)OCCSc1ccc(cc1Cl)Cl 34a_200010001942_200000035995 [1,0,0,0,0,0|2,1,0]=4 554 B16R1.1318 C#CC(C)SCCOc1ccc(cc1Br)Cl 62a_200000035995_100000199037 [1,0,0,0,0,0|2,1,0]=4 555 B16R1.1318 C#CC(C)SCCOc1ccc(cc1Cl)Cl 62a_200000035995_100000184432 [1,0,0,0,0,0|2,0,0]=3 556 B16R1.1318 C#C[C@@H](C)OCCOc1ccc(cc1Br)Cl 34a_100009815206_100000199037 [1,0,0,0,0,0|2,1,0]=4 557 B16R1.1318 C#C[C@@H](C)OCCOc1ccc(cc1Br)Cl 7a_100009815206_100000199037 [1,0,0,0,0,0|2,1,0]=4 558 B16R1.1318 C#C[C@@H](C)OCCOc1ccc(cc1Cl)Cl 34a_100009815206_100000184432 [1,0,0,0,0,0|2,0,0]=3 559 B16R1.1318 C#C[C@@H](C)OCCOc1ccc(cc1Cl)Cl 7a_100009815206_100000184432 [1,0,0,0,0,0|2,0,0]=3 560 B16R1.1318 CC(C#N)NCCOc1ccc(cc1Cl)Cl 2230a_100000737613_100000184432 [1,0,0,0,0,0|3,0,0]=4 561 B16R1.1318 CC(C#N)OCCOc1ccc(cc1Cl)Cl 34a_100011218135_100000184432 [1,0,0,0,0,0|3,0,0]=4 562 B16R1.1318 CC(C#N)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000703298 [1,0,0,0,0,0|3,0,0]=4 563 B16R1.1318 CC(C#N)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000703298 [1,0,0,0,0,0|3,0,0]=4 564 B16R1.1318 CC(C#N)SCCOc1ccc(cc1Cl)Cl 62a_100000703298_100000184432 [1,0,0,0,0,0|3,0,0]=4 565 B16R1.1318 CC(CF)OCCOc1ccc(cc1Cl)Cl 34a_100016041109_100000184432 [1,0,0,0,0,0|3,0,0]=4 566 B16R1.1318 CC(CF)OCCOc1ccc(cc1Cl)Cl 7a_100016041109_100000184432 [1,0,0,0,0,0|3,0,0]=4 567 B16R1.1318 CC(CN)OCCOc1ccc(cc1Cl)Cl 34a_100000210904_100000184432 [1,0,0,0,0,0|3,0,0]=4 568 B16R1.1318 CC(CO)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100012180447 [1,0,0,0,0,0|3,0,0]=4 569 B16R1.1318 CC(CO)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100012180447 [1,0,0,0,0,0|3,0,0]=4 570 B16R1.1318 CC(CO)SCCOc1ccc(cc1Cl)Cl 62a_100012180447_100000184432 [1,0,0,0,0,0|3,0,0]=4 571 B16R1.1318 CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000210202 [1,0,0,0,0,0|2,0,1]=4 572 B16R1.1318 CCC(C)NCCOc1ccc(cc1Cl)Cl 2230a_100000209981_100000184432 [1,0,0,0,0,0|2,0,1]=4 573 B16R1.1318 CCC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100011215416 [1,0,0,0,0,0|2,0,1]=4 574 B16R1.1318 CCC(C)OCCOc1ccc(cc1Cl)Cl 7a_100000210228_100000184432 [1,0,0,0,0,0|2,0,1]=4 575 B16R1.1318 CCC(C)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000758301 [1,0,0,0,0,0|2,0,1]=4 576 B16R1.1318 CCC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000758301 [1,0,0,0,0,0|2,0,1]=4 577 B16R1.1318 CCC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000758301_100000184432 [1,0,0,0,0,0|2,0,1]=4 578 B16R1.1318 CCN(C)CCCNc1ccc(cc1C)Cl 7a_100000210418_100015186262 [1,0,0,0,0,0|2,0,1]=4 579 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)Br 7a_100000188717_100015186262 [1,0,0,0,0,0|0,2,1]=4 580 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)C 7a_100000210800_100015186262 [1,0,0,0,0,0|1,1,1]=4 581 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100015186262 [1,0,0,0,0,0|0,1,1]=3 582 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)F 7a_100000211999_100015186262 [1,0,0,0,0,0|0,2,1]=4 583 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)I 7a_100012361655_100015186262 [1,0,0,0,0,0|0,2,1]=4 584 B16R1.1318 CCN(C)CCCOc1ccc(cc1Br)N 7a_100011534360_100015186262 [1,0,0,0,0,0|1,1,1]=4 585 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)Br 7a_100000186361_100015186262 [1,0,0,0,0,0|1,1,1]=4 586 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000210202 [1,0,0,0,0,0|2,0,1]=4 587 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100000204670 [1,0,0,0,0,0|2,0,1]=4 588 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000210202 [1,0,0,0,0,0|2,0,1]=4 589 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)C 7a_100000211776_100015186262 [1,0,0,0,0,0|2,0,1]=4 590 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)Cl 7a_100000211091_100015186262 [1,0,0,0,0,0|1,0,1]=3 591 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)F 7a_100000764316_100015186262 [1,0,0,0,0,0|1,1,1]=4 592 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)I 7a_100011218673_100015186262 [1,0,0,0,0,0|1,1,1]=4 593 B16R1.1318 CCN(C)CCCOc1ccc(cc1C)N 7a_100011218179_100015186262 [1,0,0,0,0,0|2,0,1]=4 594 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100015186262 [1,0,0,0,0,0|0,1,1]=3 595 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)C 7a_100000749699_100015186262 [1,0,0,0,0,0|1,0,1]=3 596 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100015186262 [1,0,0,0,0,0|0,0,1]=2 597 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)F 7a_100000212004_100015186262 [1,0,0,0,0,0|0,1,1]=3 598 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)I 7a_100012360047_100015186262 [1,0,0,0,0,0|0,1,1]=3 599 B16R1.1318 CCN(C)CCCOc1ccc(cc1Cl)N 7a_100000744943_100015186262 [1,0,0,0,0,0|1,0,1]=3 600 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)Br 7a_100000185481_100015186262 [1,0,0,0,0,0|0,2,1]=4 601 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)C 7a_100011216688_100015186262 [1,0,0,0,0,0|1,1,1]=4 602 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)Cl 7a_100000230166_100015186262 [1,0,0,0,0,0|0,1,1]=3 603 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)F 7a_100000230127_100015186262 [1,0,0,0,0,0|0,2,1]=4 604 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)I 7a_100011356965_100015186262 [1,0,0,0,0,0|0,2,1]=4 605 B16R1.1318 CCN(C)CCCOc1ccc(cc1F)N 7a_100011220035_100015186262 [1,0,0,0,0,0|1,1,1]=4 606 B16R1.1318 CCN(C)CCCOc1ccc(cc1I)Br 7a_100012355227_100015186262 [1,0,0,0,0,0|0,2,1]=4 607 B16R1.1318 CCN(C)CCCOc1ccc(cc1I)C 7a_100000765521_100015186262 [1,0,0,0,0,0|1,1,1]=4 608 B16R1.1318 CCN(C)CCCOc1ccc(cc1I)Cl 7a_100011356953_100015186262 [1,0,0,0,0,0|0,1,1]=3 609 B16R1.1318 CCN(C)CCCOc1ccc(cc1I)F 7a_100012355409_100015186262 [1,0,0,0,0,0|0,2,1]=4 610 B16R1.1318 CCN(C)CCCOc1ccc(cc1I)I 7a_100010001573_100015186262 [1,0,0,0,0,0|0,2,1]=4 611 B16R1.1318 CCN(C)CCCOc1ccc(cc1N)Br 7a_100000752626_100015186262 [1,0,0,0,0,0|1,1,1]=4 612 B16R1.1318 CCN(C)CCCOc1ccc(cc1N)C 7a_100011215204_100015186262 [1,0,0,0,0,0|2,0,1]=4 613 B16R1.1318 CCN(C)CCCOc1ccc(cc1N)Cl 7a_100000210500_100015186262 [1,0,0,0,0,0|1,0,1]=3 614 B16R1.1318 CCN(C)CCCOc1ccc(cc1N)F 7a_100000759472_100015186262 [1,0,0,0,0,0|1,1,1]=4 615 B16R1.1318 CCN(C)CCCOc1ccc(cc1N)I 7a_100000753495_100015186262 [1,0,0,0,0,0|1,1,1]=4 616 B16R1.1318 CCN(C)CCCOc1ccc(nc1Br)Cl 7a_100010219353_100015186262 [1,0,0,0,0,0|1,1,1]=4 617 B16R1.1318 CCN(C)CCCOc1ccc(nc1C)Cl 7a_100012184626_100015186262 [1,0,0,0,0,0|2,0,1]=4 618 B16R1.1318 CCN(C)CCCOc1ccc(nc1Cl)Br 7a_100010246206_100015186262 [1,0,0,0,0,0|1,1,1]=4 619 B16R1.1318 CCN(C)CCCOc1ccc(nc1Cl)C 7a_100000086286_100015186262 [1,0,0,0,0,0|2,0,1]=4 620 B16R1.1318 CCN(C)CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100015186262 [1,0,0,0,0,0|1,0,1]=3 621 B16R1.1318 CCN(C)CCCOc1ccc(nc1Cl)I 7a_100000721234_100015186262 [1,0,0,0,0,0|1,1,1]=4 622 B16R1.1318 CCN(C)CCCOc1ccc(nc1F)Cl 7a_100009880201_100015186262 [1,0,0,0,0,0|1,1,1]=4 623 B16R1.1318 CCN(C)CCCOc1ccc(nc1I)Cl 7a_100000696390_100015186262 [1,0,0,0,0,0|1,1,1]=4 624 B16R1.1318 CCN(C)CCCOc1ccc(nc1N)Cl 7a_100000717809_100015186262 [1,0,0,0,0,0|2,0,1]=4 625 B16R1.1318 CCN(C)CCCOc1cnc(cc1C)Cl 7a_100000692680_100015186262 [1,0,0,0,0,0|2,0,1]=4 626 B16R1.1318 CCN(C)CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100015186262 [1,0,0,0,0,0|1,0,1]=3 627 B16R1.1318 CCN(C)CCCOc1cnc(cc1I)Cl 7a_100000698892_100015186262 [1,0,0,0,0,0|1,1,1]=4 628 B16R1.1318 CCN(C)CCCOc1cnc(nc1Cl)Cl 7a_100010725077_100015186262 [1,0,0,0,0,0|2,0,1]=4 629 B16R1.1318 CCN(C)CCCSc1ccc(cc1Br)Cl 62a_100011219703_100015186262 [1,0,0,0,0,0|0,2,1]=4 630 B16R1.1318 CCN(C)CCCSc1ccc(cc1C)Cl 62a_100011219607_100015186262 [1,0,0,0,0,0|1,1,1]=4 631 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)Br 62a_100011216062_100015186262 [1,0,0,0,0,0|0,2,1]=4 632 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)C 62a_100011263221_100015186262 [1,0,0,0,0,0|1,1,1]=4 633 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100015186262 [1,0,0,0,0,0|0,1,1]=3 634 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)F 62a_100000733362_100015186262 [1,0,0,0,0,0|0,2,1]=4 635 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)N 62a_100000761885_100015186262 [1,0,0,0,0,0|1,1,1]=4 636 B16R1.1318 CCN(C)CCCSc1ccc(cc1Cl)O 62a_100000047559_100015186262 [1,0,0,0,0,0|1,1,1]=4 637 B16R1.1318 CCN(C)CCCSc1ccc(cc1F)Cl 62a_100011216042_100015186262 [1,0,0,0,0,0|0,2,1]=4 638 B16R1.1318 CCN(C)CCCSc1ccc(cc1N)Cl 62a_100000761886_100015186262 [1,0,0,0,0,0|1,1,1]=4 639 B16R1.1318 CCN(C)CCCSc1ccc(cc1O)Cl 62a_100000050036_100015186262 [1,0,0,0,0,0|1,1,1]=4 640 B16R1.1318 CCN(C)CCCSc1cnc(cc1Cl)Cl 62a_100010200927_100015186262 [1,0,0,0,0,0|1,1,1]=4 641 B16R1.1318 C[C@H](CO)NCCOc1ccc(cc1Cl)Cl 2230a_100000737577_100000184432 [1,0,0,0,0,0|3,0,0]=4 642 B16R1.1318 C[C@H](CO)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100016084084 [1,0,0,0,0,0|3,0,0]=4 643 B16R1.1318 C[C@H](CO)SCCOc1ccc(cc1Cl)Cl 62a_100016084084_100000184432 [1,0,0,0,0,0|3,0,0]=4 644 B16R1.1318 Cc1ccc(c(c1)C)OCCCN(C)CF 269982a_100015183116_100015361967 [1,0,0,0,0,0|3,0,0]=4 645 B16R1.1318 Cc1ccc(c(c1)C)OCCCN(C)CF 34a_100015183116_100015361967 [1,0,0,0,0,0|3,0,0]=4 646 B16R1.1318 O=C(CF)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100015361967 [1,0,0,0,0,0|3,0,0]=4 647 B18R1.4578 C#CCN(C)CC(=O)NCc1ccc(cc1Cl)Cl 2230a_100000225692_100000010247 [0,1,0,0,0,0|2,0,1]=4 648 B18R1.4578 C#CCN(C)CC(=O)NCc1ccc(cc1Cl)Cl 34a_100000225692_100000010247 [0,1,0,0,0,0|2,0,1]=4 649 B18R1.6122 C#CCN(C)C(=O)CCOc1ccc(cc1C)C 11a_100000225692_100000737123 [0,1,0,0,0,0|2,0,1]=4 650 B18R1.6122 C#CCN(C)C(=O)CCOc1ccc(cc1C)C 1626a_100000225692_100000737123 [0,1,0,0,0,0|2,0,1]=4 651 B18R1.6122 C#CCN(C)C(=O)CCOc1ccc(cc1Cl)F 1626a_100000225692_100000240429 [0,1,0,0,0,0|0,1,1]=3 652 B18R1.6122 C#CCN(C)C(=O)CCOc1ccc(cc1F)F 11a_100000225692_100000743258 [0,1,0,0,0,0|0,2,1]=4 653 B18R1.6122 C#CCN(C)C(=O)CCOc1ccc(cc1F)F 1626a_100000225692_100000743258 [0,1,0,0,0,0|0,2,1]=4 654 B18R1.6122 C#CCN(C)C(=O)CSCc1ccc(cc1Cl)Cl 11a_100000225692_100000150271 [0,1,0,0,0,0|2,0,1]=4 655 B18R1.6122 C#CCN(C)C(=O)CSCc1ccc(cc1Cl)Cl 1626a_100000225692_100000150271 [0,1,0,0,0,0|2,0,1]=4 656 B18R1.6122 C#CCN(C)C(=O)CSCc1ccc(cc1Cl)Cl 527a_100000225692_100000150271 [0,1,0,0,0,0|2,0,1]=4 657 B18R1.6122 C#CCN(C)C(=O)NCCc1ccc(cc1Cl)Cl 2708a_100000210994_100000225692 [0,1,0,0,0,0|2,0,1]=4 658 B18R1.6122 C#CCN(C)C(=O)NCCc1ccc(cc1Cl)Cl 273464a_100000210994_100000225692 [0,1,0,0,0,0|2,0,1]=4 659 B18R1.6122 CN(CC#N)C(=O)CCOc1ccc(cc1Cl)F 1626a_100000748184_100000240429 [0,1,0,0,0,0|1,1,1]=4 660 B18R1.10073 C#CCCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000753159 [0,1,0,0,0,0|2,0,0]=3 661 B18R1.10073 C#CCCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000688953 [0,1,0,0,0,0|2,0,0]=3 662 B18R1.10073 C#CCCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100000730999 [0,1,0,0,0,0|2,0,0]=3 663 B18R1.10073 C#CCCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000688953 [0,1,0,0,0,0|2,0,0]=3 664 B18R1.10073 C#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000212058_100000186546 [0,1,0,0,0,0|2,0,0]=3 665 B18R1.10073 C#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000212058_100000186546 [0,1,0,0,0,0|2,0,0]=3 666 B18R1.10073 C#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000212058_100000186546 [0,1,0,0,0,0|2,0,0]=3 667 B18R1.10073 C#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000212058_100000186546 [0,1,0,0,0,0|2,0,0]=3 668 B18R1.10073 C#CCOC(C)COCCc1ccc(cc1Cl)Cl 34a_200000093152_200012161198 [0,1,0,0,0,0|3,0,0]=4 669 B18R1.10073 C#CCOC(C)COCCc1ccc(cc1Cl)Cl 7a_200000093152_200012161198 [0,1,0,0,0,0|3,0,0]=4 670 B18R1.10073 CC#CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000748600 [0,1,0,0,0,0|2,0,0]=3 671 B18R1.10073 CC#CCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000748600 [0,1,0,0,0,0|2,0,0]=3 672 B18R1.10073 CC#CCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000748600 [0,1,0,0,0,0|2,0,0]=3 673 B18R1.10073 Cc1ccc(c(c1)C)OCCCN(C)CCC#N 2230a_100015183116_100011215226 [0,1,0,0,0,0|2,0,1]=4 674 B18R1.10073 Cc1ccc(c(c1)C)OCCCN(C)CCC#N 269982a_100015183116_100011215226 [0,1,0,0,0,0|2,0,1]=4 675 B18R1.10073 Cc1ccc(c(c1)C)OCCCN(C)CSC#N 269982a_100015183116_100000211825 [0,1,0,0,0,0|3,0,0]=4 676 B18R1.10073 N#CCCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100011215226 [0,1,0,0,0,0|2,0,1]=4 677 B18R1.10073 N#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000734998_100000186546 [0,1,0,0,0,0|3,0,0]=4 678 B18R1.10073 N#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000734998_100000186546 [0,1,0,0,0,0|3,0,0]=4 679 B18R1.34900 C#CC(C)C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200000035995 [0,1,0,0,0,0|2,0,0]=3 680 B18R1.34900 C#CC(C)N(C)CCCOc1ccc(cc1C)C 34a_100015183116_200000035995 [0,1,0,0,0,0|2,0,0]=3 681 B18R1.34900 CC(C#N)C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000703298 [0,1,0,0,0,0|3,0,0]=4 682 B18R1.34900 Cc1ccc(c(c1)C)OCCCN(C)C(C)C#N 2230a_100015183116_100000184139 [0,1,0,0,0,0|3,0,0]=4 683 B18R1.34900 Cc1ccc(c(c1)C)OCCCN(C)C(C)C#N 269982a_100015183116_100000703298 [0,1,0,0,0,0|3,0,0]=4 684 B18R1.44400 C#CCC(CC)OCCOc1ccc(cc1Br)Cl 34a_200011217983_100000199037 [0,1,0,0,0,0|2,1,0]=4 685 B18R1.44400 C#CCC(CC)OCCOc1ccc(cc1Br)Cl 7a_200011217983_100000199037 [0,1,0,0,0,0|2,1,0]=4 686 B18R1.44400 C#CCC(CC)OCCOc1ccc(cc1Cl)Cl 34a_200011217983_100000184432 [0,1,0,0,0,0|2,0,0]=3 687 B18R1.44400 C#CCC(CC)OCCOc1ccc(cc1Cl)Cl 7a_200011217983_100000184432 [0,1,0,0,0,0|2,0,0]=3 688 B18R1.44400 CC[C@H](CC#N)NCCOc1ccc(cc1Cl)Cl 2230a_200009818565_100000184432 [0,1,0,0,0,0|3,0,0]=4 689 B18R1.216708 C#CCC(C)OCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000685586_100011259511 [0,1,0,0,0,0|2,0,0]=3 690 B18R1.216708 C#CCC(C)OCCOc1c(cc(cc1Cl)Cl)Cl 7a_100000685586_100011259511 [0,1,0,0,0,0|2,0,0]=3 691 B18R1.216708 CC(CC#N)OCCOc1c(cc(cc1Cl)Cl)Cl 7a_100000748996_100009813641 [0,1,0,0,0,0|3,0,0]=4 692 B18R1.216708 C[C@@H](CC#N)NCCOc1c(cc(cc1Cl)Cl)Cl 2230a_100016994482_100011259511 [0,1,0,0,0,0|3,0,0]=4 693 B18R1.218449 C#CCN(C)CCCC(=O)c1ccc(cc1F)F 34a_100000225692_100012405562 [0,1,0,0,0,0|1,2,0]=4 694 B18R1.311628 C#CCN(C)CCC(=O)Nc1ccc(cc1Cl)Cl 2230a_100000225692_200000181506 [0,1,0,0,0,0|1,0,1]=3 695 B18R1.311628 C#CCN(C)CCC(=O)Nc1ccc(cc1F)Cl 2230a_100000225692_100000242067 [0,1,0,0,0,0|1,1,1]=4 696 B18R1.311628 CN(CC#N)CCC(=O)Nc1ccc(cc1Cl)Cl 2230a_100000748184_200000181506 [0,1,0,0,0,0|2,0,1]=4 697 B18R2.2032 C#CCN(C)CC1=Cc2cc(ccc2OC1)Br 270004a_100000225692_100000739462 [0,0,0,1,0,0|1,1,1]=4 698 B18R2.2032 C#CCN(C)CC1=Cc2cc(ccc2OC1)Cl 270004a_100000225692_100000024079 [0,0,0,1,0,0|1,0,1]=3 699 B18R2.33135 Cc1cc(ccc1OCCCN2CCCC2)Cl 34a_100000211091_100016991639 [0,0,0,1,0,0|1,0,2]=4 700 B18R2.33135 Cc1cc(ccc1OCCCN2CCCC2)Cl 7a_100000211091_100011445909 [0,0,0,1,0,0|1,0,2]=4 701 B18R2.33135 Cc1ccc(c(c1)Cl)OCCCN2CCCC2 34a_100000749699_100016991639 [0,0,0,1,0,0|1,0,2]=4 702 B18R2.33135 Cc1ccc(c(c1)Cl)OCCCN2CCCC2 7a_100000749699_100011445909 [0,0,0,1,0,0|1,0,2]=4 703 B18R2.33135 Clc1cc(c(cn1)OCCCN2CCCC2)Cl 34a_100009868576_100016991639 [0,0,0,1,0,0|1,0,2]=4 704 B18R2.33135 Clc1cc(c(cn1)OCCCN2CCCC2)Cl 7a_100009868576_100011445909 [0,0,0,1,0,0|1,0,2]=4 705 B18R2.33135 Clc1cc(ccc1OCCCN2CCCC2)Br 34a_100000186472_100016991639 [0,0,0,1,0,0|0,1,2]=4 706 B18R2.33135 Clc1cc(ccc1OCCCN2CCCC2)Br 7a_100000186472_100011445909 [0,0,0,1,0,0|0,1,2]=4 707 B18R2.33135 Clc1cc(ccc1OCCCN2CCCC2)I 34a_100012360047_100016991639 [0,0,0,1,0,0|0,1,2]=4 708 B18R2.33135 Clc1cc(ccc1OCCCN2CCCC2)I 7a_100012360047_100011445909 [0,0,0,1,0,0|0,1,2]=4 709 B18R2.33135 Clc1ccc(c(c1)Br)OCCCN2CCCC2 34a_100000211998_100016991639 [0,0,0,1,0,0|0,1,2]=4 710 B18R2.33135 Clc1ccc(c(c1)Br)OCCCN2CCCC2 7a_100000211998_100011445909 [0,0,0,1,0,0|0,1,2]=4 711 B18R2.33135 Clc1ccc(c(c1)Cl)NCCCN2CCCC2 34a_100000185861_100016991639 [0,0,0,1,0,0|1,0,2]=4 712 B18R2.33135 Clc1ccc(c(c1)Cl)OCCCN2CCCC2 34a_100015191787_100016991639 [0,0,0,1,0,0|0,0,2]=3 713 B18R2.33135 Clc1ccc(c(c1)Cl)OCCCN2CCCC2 7a_100015191787_100011445909 [0,0,0,1,0,0|0,0,2]=3 714 B18R2.33135 Clc1ccc(c(c1)Cl)SCCCN2CCCC2 62a_100000699841_100011445909 [0,0,0,1,0,0|0,1,2]=4 715 B18R2.33135 Clc1ccc(c(c1)Cl)SCCCN2CCCC2 62a_100016991639_100000699841 [0,0,0,1,0,0|0,1,2]=4 716 B18R2.33135 Clc1ccc(c(c1)I)OCCCN2CCCC2 34a_100011356953_100016991639 [0,0,0,1,0,0|0,1,2]=4 717 B18R2.33135 Clc1ccc(c(c1)I)OCCCN2CCCC2 7a_100011356953_100011445909 [0,0,0,1,0,0|0,1,2]=4 718 B18R2.33135 Clc1ccc(c(n1)Cl)OCCCN2CCCC2 34a_100000101165_100016991639 [0,0,0,1,0,0|1,0,2]=4 719 B18R2.33135 Clc1ccc(c(n1)Cl)OCCCN2CCCC2 7a_100000101165_100011445909 [0,0,0,1,0,0|1,0,2]=4 720 B18R2.33135 Fc1cc(ccc1OCCCN2CCCC2)Cl 34a_100000230166_100016991639 [0,0,0,1,0,0|0,1,2]=4 721 B18R2.33135 Fc1cc(ccc1OCCCN2CCCC2)Cl 7a_100000230166_100011445909 [0,0,0,1,0,0|0,1,2]=4 722 B18R2.33135 Fc1ccc(c(c1)Cl)OCCCN2CCCC2 34a_100000212004_100016991639 [0,0,0,1,0,0|0,1,2]=4 723 B18R2.33135 Fc1ccc(c(c1)Cl)OCCCN2CCCC2 7a_100000212004_100011445909 [0,0,0,1,0,0|0,1,2]=4 724 B18R2.33135 Nc1cc(ccc1OCCCN2CCCC2)Cl 34a_100000210500_100016991639 [0,0,0,1,0,0|1,0,2]=4 725 B18R2.33135 Nc1cc(ccc1OCCCN2CCCC2)Cl 7a_100000210500_100011445909 [0,0,0,1,0,0|1,0,2]=4 726 B18R2.33135 Nc1ccc(c(c1)Cl)OCCCN2CCCC2 34a_100000744943_100016991639 [0,0,0,1,0,0|1,0,2]=4 727 B18R2.33135 Nc1ccc(c(c1)Cl)OCCCN2CCCC2 7a_100000744943_100011445909 [0,0,0,1,0,0|1,0,2]=4 728 B18R2.65901 CN1CCCC(C1)CNc2ccc(cc2Cl)Cl 34a_100000185861_100015183302 [0,0,0,1,0,0|1,0,2]=4 729 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Br)Cl 34a_100000211998_100015183302 [0,0,0,1,0,0|0,1,2]=4 730 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Br)Cl 7a_100000211998_100000752043 [0,0,0,1,0,0|0,1,2]=4 731 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)Br 34a_100000186472_100015183302 [0,0,0,1,0,0|0,1,2]=4 732 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)Br 7a_100000186472_100000752043 [0,0,0,1,0,0|0,1,2]=4 733 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)Cl 34a_100015191787_100015183302 [0,0,0,1,0,0|0,0,2]=3 734 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)Cl 7a_100015191787_100000752043 [0,0,0,1,0,0|0,0,2]=3 735 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)F 34a_100000212004_100015183302 [0,0,0,1,0,0|0,1,2]=4 736 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)F 7a_100000212004_100000752043 [0,0,0,1,0,0|0,1,2]=4 737 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)I 34a_100012360047_100015183302 [0,0,0,1,0,0|0,1,2]=4 738 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)I 7a_100012360047_100000752043 [0,0,0,1,0,0|0,1,2]=4 739 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)N 34a_100000744943_100015183302 [0,0,0,1,0,0|1,0,2]=4 740 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2Cl)N 7a_100000744943_100000752043 [0,0,0,1,0,0|1,0,2]=4 741 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2F)Cl 34a_100000230166_100015183302 [0,0,0,1,0,0|0,1,2]=4 742 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2F)Cl 7a_100000230166_100000752043 [0,0,0,1,0,0|0,1,2]=4 743 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2I)Cl 34a_100011356953_100015183302 [0,0,0,1,0,0|0,1,2]=4 744 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2I)Cl 7a_100011356953_100000752043 [0,0,0,1,0,0|0,1,2]=4 745 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2N)Cl 34a_100000210500_100015183302 [0,0,0,1,0,0|1,0,2]=4 746 B18R2.65901 CN1CCCC(C1)COc2ccc(cc2N)Cl 7a_100000210500_100000752043 [0,0,0,1,0,0|1,0,2]=4 747 B18R2.65901 CN1CCCC(C1)COc2ccc(nc2Cl)Cl 34a_100000101165_100015183302 [0,0,0,1,0,0|1,0,2]=4 748 B18R2.65901 CN1CCCC(C1)COc2ccc(nc2Cl)Cl 7a_100000101165_100000752043 [0,0,0,1,0,0|1,0,2]=4 749 B18R2.65901 CN1CCCC(C1)COc2cnc(cc2Cl)Cl 34a_100009868576_100015183302 [0,0,0,1,0,0|1,0,2]=4 750 B18R2.65901 CN1CCCC(C1)COc2cnc(cc2Cl)Cl 7a_100009868576_100000752043 [0,0,0,1,0,0|1,0,2]=4 751 B18R2.65901 CN1CCCC(C1)CSc2ccc(cc2Cl)Cl 62a_100000699841_100000752043 [0,0,0,1,0,0|0,1,2]=4 752 B18R2.65901 CN1CCCC(C1)CSc2ccc(cc2Cl)Cl 62a_100000752043_100000699841 [0,0,0,1,0,0|0,1,2]=4 753 B18R2.65901 Cc1cc(ccc1OCC2CCCN(C2)C)Cl 34a_100000211091_100015183302 [0,0,0,1,0,0|1,0,2]=4 754 B18R2.65901 Cc1cc(ccc1OCC2CCCN(C2)C)Cl 7a_100000211091_100000752043 [0,0,0,1,0,0|1,0,2]=4 755 B18R2.65901 Cc1ccc(c(c1)Cl)OCC2CCCN(C2)C 34a_100000749699_100015183302 [0,0,0,1,0,0|1,0,2]=4 756 B18R2.65901 Cc1ccc(c(c1)Cl)OCC2CCCN(C2)C 7a_100000749699_100000752043 [0,0,0,1,0,0|1,0,2]=4 757 B18R2.66872 CN1CCCC1CCNc2ccc(cc2Cl)Cl 34a_100000185861_100000005710 [0,0,0,1,0,0|1,0,2]=4 758 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Br)Cl 34a_100000211998_100000005710 [0,0,0,1,0,0|0,1,2]=4 759 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Br)Cl 7a_100000211998_100000005710 [0,0,0,1,0,0|0,1,2]=4 760 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)Br 34a_100000186472_100000005710 [0,0,0,1,0,0|0,1,2]=4 761 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)Br 7a_100000186472_100000005710 [0,0,0,1,0,0|0,1,2]=4 762 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)Cl 34a_100015191787_100000005710 [0,0,0,1,0,0|0,0,2]=3 763 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)Cl 7a_100015191787_100000005710 [0,0,0,1,0,0|0,0,2]=3 764 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)F 34a_100000212004_100000005710 [0,0,0,1,0,0|0,1,2]=4 765 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)F 7a_100000212004_100000005710 [0,0,0,1,0,0|0,1,2]=4 766 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)I 34a_100012360047_100000005710 [0,0,0,1,0,0|0,1,2]=4 767 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)I 7a_100012360047_100000005710 [0,0,0,1,0,0|0,1,2]=4 768 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)N 34a_100000744943_100000005710 [0,0,0,1,0,0|1,0,2]=4 769 B18R2.66872 CN1CCCC1CCOc2ccc(cc2Cl)N 7a_100000744943_100000005710 [0,0,0,1,0,0|1,0,2]=4 770 B18R2.66872 CN1CCCC1CCOc2ccc(cc2F)Cl 34a_100000230166_100000005710 [0,0,0,1,0,0|0,1,2]=4 771 B18R2.66872 CN1CCCC1CCOc2ccc(cc2F)Cl 7a_100000230166_100000005710 [0,0,0,1,0,0|0,1,2]=4 772 B18R2.66872 CN1CCCC1CCOc2ccc(cc2I)Cl 34a_100011356953_100000005710 [0,0,0,1,0,0|0,1,2]=4 773 B18R2.66872 CN1CCCC1CCOc2ccc(cc2I)Cl 7a_100011356953_100000005710 [0,0,0,1,0,0|0,1,2]=4 774 B18R2.66872 CN1CCCC1CCOc2ccc(cc2N)Cl 34a_100000210500_100000005710 [0,0,0,1,0,0|1,0,2]=4 775 B18R2.66872 CN1CCCC1CCOc2ccc(cc2N)Cl 7a_100000210500_100000005710 [0,0,0,1,0,0|1,0,2]=4 776 B18R2.66872 CN1CCCC1CCOc2ccc(nc2Cl)Cl 34a_100000101165_100000005710 [0,0,0,1,0,0|1,0,2]=4 777 B18R2.66872 CN1CCCC1CCOc2ccc(nc2Cl)Cl 7a_100000101165_100000005710 [0,0,0,1,0,0|1,0,2]=4 778 B18R2.66872 CN1CCCC1CCOc2cnc(cc2Cl)Cl 34a_100009868576_100000005710 [0,0,0,1,0,0|1,0,2]=4 779 B18R2.66872 CN1CCCC1CCOc2cnc(cc2Cl)Cl 7a_100009868576_100000005710 [0,0,0,1,0,0|1,0,2]=4 780 B18R2.66872 CN1CCCC1CCSc2ccc(cc2Cl)Cl 62a_100000005710_100000699841 [0,0,0,1,0,0|0,1,2]=4 781 B18R2.66872 CN1CCCC1CCSc2ccc(cc2Cl)Cl 62a_100000699841_100000005710 [0,0,0,1,0,0|0,1,2]=4 782 B18R2.66872 Cc1cc(ccc1OCCC2CCCN2C)Cl 34a_100000211091_100000005710 [0,0,0,1,0,0|1,0,2]=4 783 B18R2.66872 Cc1cc(ccc1OCCC2CCCN2C)Cl 7a_100000211091_100000005710 [0,0,0,1,0,0|1,0,2]=4 784 B18R2.66872 Cc1ccc(c(c1)Cl)OCCC2CCCN2C 34a_100000749699_100000005710 [0,0,0,1,0,0|1,0,2]=4 785 B18R2.66872 Cc1ccc(c(c1)Cl)OCCC2CCCN2C 7a_100000749699_100000005710 [0,0,0,1,0,0|1,0,2]=4 786 B16R1.1541 C#CCC(=O)CCOc1ccc(cc1Br)Cl 1458a_100011220946_100000199037 [0,0,0,0,1,0|2,1,0]=4 787 B16R1.1541 C#CCC(=O)CCOc1ccc(cc1Cl)Cl 1458a_100011220946_100000184432 [0,0,0,0,1,0|2,0,0]=3 788 B16R1.1541 C#CCC(=O)CCOc1ccc(cc1Cl)F 1458a_100000240429_100000184674 [0,0,0,0,1,0|2,1,0]=4 789 B16R1.1541 C#CCC(=O)CSCc1ccc(cc1Cl)Cl 1458a_100000150271_100000184674 [0,0,0,0,1,0|3,0,0]=4 790 B16R1.1541 C#CCC(=O)NCCc1ccc(cc1Cl)Cl 1626a_100000210994_100011220946 [0,0,0,0,1,0|3,0,0]=4 791 B16R1.1541 C#CCC(=O)NCCc1ccc(cc1Cl)Cl 527a_100000210994_100011220946 [0,0,0,0,1,0|3,0,0]=4 792 B16R1.1541 C#CCC(C)OCCc1ccc(cc1Br)Cl 34a_100000685586_200012945151 [0,0,0,0,1,0|2,1,0]=4 793 B16R1.1541 C#CCC(C)OCCc1ccc(cc1Br)Cl 7a_100000685586_200012945151 [0,0,0,0,1,0|2,1,0]=4 794 B16R1.1541 C#CCC(C)OCCc1ccc(cc1Cl)Cl 34a_100000685586_200012161198 [0,0,0,0,1,0|2,0,0]=3 795 B16R1.1541 C#CCC(C)OCCc1ccc(cc1Cl)Cl 7a_100000685586_200012161198 [0,0,0,0,1,0|2,0,0]=3 796 B16R1.1541 C#CCN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000225692_100000765304 [0,0,0,0,1,0|0,0,0]=1 797 B16R1.1541 C#CCN(C)CCOc1ccc(cc1Br)Cl 2230a_100000225692_100000199037 [0,0,0,0,1,0|0,1,0]=2 798 B16R1.1541 C#CCN(C)CCOc1ccc(cc1Br)Cl 34a_100000225692_100000199037 [0,0,0,0,1,0|0,1,0]=2 799 B16R1.1541 C#CCN(C)CCOc1ccc(cc1C)C 2230a_100000225692_100011210784 [0,0,0,0,1,0|2,0,0]=3 800 B16R1.1541 C#CCN(C)CCOc1ccc(cc1C)C 34a_100000225692_100011210784 [0,0,0,0,1,0|2,0,0]=3 801 B16R1.1541 C#CCN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000225692_100000184432 [0,0,0,0,1,0|0,0,0]=1 802 B16R1.1541 C#CCN(C)CCOc1ccc(cc1Cl)Cl 34a_100000225692_100000184432 [0,0,0,0,1,0|0,0,0]=1 803 B16R1.1541 C=CCN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000225617_100000765304 [0,0,0,0,1,0|0,0,2]=3 804 B16R1.1541 C=CCN(C)CCOc1ccc(cc1Br)Cl 2230a_100000225617_100000199037 [0,0,0,0,1,0|0,1,2]=4 805 B16R1.1541 C=CCN(C)CCOc1ccc(cc1Br)Cl 269982a_100000225617_100000199037 [0,0,0,0,1,0|0,1,2]=4 806 B16R1.1541 C=CCN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000225617_100000184432 [0,0,0,0,1,0|0,0,2]=3 807 B16R1.1541 C=CCN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000225617_100000184432 [0,0,0,0,1,0|0,0,2]=3 808 B16R1.1541 CC(CC#N)NCCc1ccc(cc1Cl)Cl 2230a_100000210994_100009813641 [0,0,0,0,1,0|3,0,0]=4 809 B16R1.1541 CC(CC#N)OCCc1ccc(cc1Cl)Cl 7a_100011215701_100009813641 [0,0,0,0,1,0|3,0,0]=4 810 B16R1.1541 CC(CC#N)SCCc1ccc(cc1Cl)Cl 62a_100009813641_200012161198 [0,0,0,0,1,0|3,0,0]=4 811 B16R1.1541 CC(CC#N)SCCc1ccc(cc1Cl)Cl 62a_200012161198_100009813641 [0,0,0,0,1,0|3,0,0]=4 812 B16R1.1541 CCCN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000747261_100000765304 [0,0,0,0,1,0|0,0,2]=3 813 B16R1.1541 CCCN(C)CCOc1ccc(cc1Br)Cl 2230a_100000747261_100000199037 [0,0,0,0,1,0|0,1,2]=4 814 B16R1.1541 CCCN(C)CCOc1ccc(cc1Br)Cl 269982a_100000747261_100000199037 [0,0,0,0,1,0|0,1,2]=4 815 B16R1.1541 CCCN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000747261_100000184432 [0,0,0,0,1,0|0,0,2]=3 816 B16R1.1541 CCCN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000747261_100000184432 [0,0,0,0,1,0|0,0,2]=3 817 B16R1.1541 CN(CC#N)CCOc1ccc(cc1Br)Cl 2230a_100000748184_100000199037 [0,0,0,0,1,0|1,1,0]=3 818 B16R1.1541 CN(CC#N)CCOc1ccc(cc1Cl)Cl 2230a_100000748184_100000184432 [0,0,0,0,1,0|1,0,0]=2 819 B16R1.1541 CN(CCO)CCCc1ccc(cc1Cl)Cl 270004a_100000210263_100000765304 [0,0,0,0,1,0|1,0,1]=3 820 B16R1.1541 CN(CCO)CCOc1ccc(cc1Br)Cl 2230a_100000210263_100000199037 [0,0,0,0,1,0|1,1,1]=4 821 B16R1.1541 CN(CCO)CCOc1ccc(cc1Br)Cl 269982a_100000210263_100000199037 [0,0,0,0,1,0|1,1,1]=4 822 B16R1.1541 CN(CCO)CCOc1ccc(cc1Cl)Cl 2230a_100000210263_100000184432 [0,0,0,0,1,0|1,0,1]=3 823 B16R1.1541 CN(CCO)CCOc1ccc(cc1Cl)Cl 269982a_100000210263_100000184432 [0,0,0,0,1,0|1,0,1]=3 824 B16R1.1541 C[C@@H](CC#N)NCCc1ccc(cc1Cl)Cl 2230a_100016994482_200012161198 [0,0,0,0,1,0|3,0,0]=4 825 B16R1.1541 Cc1ccc(c(c1)C)OCCN(C)CC#N 2230a_100000748184_100011210784 [0,0,0,0,1,0|3,0,0]=4 826 B16R1.1541 N#CCC(=O)CCOc1ccc(cc1Cl)Cl 1458a_100051588842_100000184432 [0,0,0,0,1,0|3,0,0]=4 827 B18R1.25389 C=CCC(C)COCCOc1ccc(cc1Cl)Cl 34a_100009832082_100000184432 [0,0,0,0,0,1|1,0,2]=4 828 B18R1.25389 C=CCC(C)COCCOc1ccc(cc1Cl)Cl 7a_100009832082_100000184432 [0,0,0,0,0,1|1,0,2]=4 829 B18R1.25389 CC(CCN)COCCOc1ccc(cc1Cl)Cl 34a_106354213184_100000184432 [0,0,0,0,0,1|2,0,1]=4 830 B18R1.25389 CCCC(C)COCCOc1ccc(cc1Cl)Cl 34a_100000688023_100000184432 [0,0,0,0,0,1|1,0,2]=4 831 B18R1.25389 CCCC(C)COCCOc1ccc(cc1Cl)Cl 34a_200000205304_100011216630 [0,0,0,0,0,1|1,0,2]=4 832 B18R1.25389 CCCC(C)COCCOc1ccc(cc1Cl)Cl 7a_100000688023_100000184432 [0,0,0,0,0,1|1,0,2]=4 833 B18R1.25389 CCCC(C)COCCOc1ccc(cc1Cl)Cl 7a_200000205304_100011216630 [0,0,0,0,0,1|1,0,2]=4 834 B18R1.25389 N#CC[C@H](O)COCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000001066 [0,0,0,0,0,1|3,0,0]=4 835 B18R1.25389 N#CC[C@H](O)CSCCOc1ccc(cc1Cl)Cl 62a_100000001066_100000184432 [0,0,0,0,0,1|3,0,0]=4 836 B18R1.25389 N#CC[C@H](O)CSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000001066 [0,0,0,0,0,1|3,0,0]=4 837 B15R1.12 C#CCCCCCNc1ccc(cc1)Cl 2230a_100000210052_100012094781 [2,0,0,0,0,0|2,0,0]=4 838 B15R1.12 C#CCCCCCNc1ccc(cc1)Cl 34a_100000210052_100012094781 [2,0,0,0,0,0|2,0,0]=4 839 B15R1.12 C#CCCCCCOc1ccc(cc1)Br 34a_100000185759_100012094781 [2,0,0,0,0,0|1,1,0]=4 840 B15R1.12 C#CCCCCCOc1ccc(cc1)Br 7a_100000185759_100012094781 [2,0,0,0,0,0|1,1,0]=4 841 B15R1.12 C#CCCCCCOc1ccc(cc1)C 34a_100000210336_100012094781 [2,0,0,0,0,0|2,0,0]=4 842 B15R1.12 C#CCCCCCOc1ccc(cc1)C 7a_100000210336_100012094781 [2,0,0,0,0,0|2,0,0]=4 843 B15R1.12 C#CCCCCCOc1ccc(cc1)Cl 34a_100000210216_100012094781 [2,0,0,0,0,0|1,0,0]=3 844 B15R1.12 C#CCCCCCOc1ccc(cc1)Cl 7a_100000210216_100012094781 [2,0,0,0,0,0|1,0,0]=3 845 B15R1.12 C#CCCCCCOc1ccc(cc1)F 34a_100000210339_100012094781 [2,0,0,0,0,0|1,1,0]=4 846 B15R1.12 C#CCCCCCOc1ccc(cc1)I 34a_100000212066_100012094781 [2,0,0,0,0,0|1,1,0]=4 847 B15R1.12 C#CCCCCCOc1ccc(cc1)I 7a_100000212066_100012094781 [2,0,0,0,0,0|1,1,0]=4 848 B15R1.12 C#CCCCCCOc1ccc(cc1)N 34a_100000185829_100012094781 [2,0,0,0,0,0|2,0,0]=4 849 B15R1.12 C#CCCCCCOc1ccc(cn1)Cl 34a_100011215309_100012094781 [2,0,0,0,0,0|2,0,0]=4 850 B15R1.12 C#CCCCCCOc1ccc(nc1)Cl 34a_100000744096_100012094781 [2,0,0,0,0,0|2,0,0]=4 851 B15R1.12 C#CCCCCCOc1ccc(nc1)Cl 7a_100000744096_100012094781 [2,0,0,0,0,0|2,0,0]=4 852 B15R1.12 C#CCCCCCSc1ccc(cc1)Cl 62a_100000755918_100012094781 [2,0,0,0,0,0|1,1,0]=4 853 B15R1.12 C#CCCCCCSc1ccc(cc1)Cl 62a_100012094781_100000755918 [2,0,0,0,0,0|1,1,0]=4 854 B15R1.12 C#CCCNCCOc1ccc(cc1)Cl 2230a_100000697975_100000688953 [2,0,0,0,0,0|2,0,0]=4 855 B15R1.12 C#CCCNCCOc1ccc(cc1)Cl 34a_100000697975_100000688953 [2,0,0,0,0,0|2,0,0]=4 856 B15R1.12 C#CCCNCCOc1ccc(cc1)Cl 34a_100000755551_100000184122 [2,0,0,0,0,0|2,0,0]=4 857 B15R1.12 C#CCCOCCOc1ccc(cc1)Cl 34a_100000237962_100000688953 [2,0,0,0,0,0|2,0,0]=4 858 B15R1.12 C#CCCOCCOc1ccc(cc1)Cl 34a_100011215631_100000184122 [2,0,0,0,0,0|2,0,0]=4 859 B15R1.12 C#CCCOCCOc1ccc(cc1)Cl 7a_100000237962_100000688953 [2,0,0,0,0,0|2,0,0]=4 860 B15R1.12 C#CCCSCCOc1ccc(cc1)Cl 62a_100000184122_100000688953 [2,0,0,0,0,0|2,0,0]=4 861 B15R1.12 C#CCCSCCOc1ccc(cc1)Cl 62a_100000688953_100000184122 [2,0,0,0,0,0|2,0,0]=4 862 B15R1.12 C#CCNCCCCc1ccc(cc1)Br 34a_100000212058_200012094861 [2,0,0,0,0,0|1,1,0]=4 863 B15R1.12 C#CCNCCCCc1ccc(cc1)Cl 2230a_100160821348_100000038162 [2,0,0,0,0,0|1,0,0]=3 864 B15R1.12 C#CCNCCCCc1ccc(cc1)Cl 34a_100160821348_100000184674 [2,0,0,0,0,0|1,0,0]=3 865 B15R1.12 C#CCNCCCCc1ccc(cc1)F 34a_100000212058_100012093538 [2,0,0,0,0,0|1,1,0]=4 866 B15R1.12 C#CCNCCCOc1ccc(cc1)Br 34a_100000212058_100011259224 [2,0,0,0,0,0|0,1,0]=3 867 B15R1.12 C#CCNCCCOc1ccc(cc1)C 34a_100000747266_100000184674 [2,0,0,0,0,0|1,0,0]=3 868 B15R1.12 C#CCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100000038162 [2,0,0,0,0,0|0,0,0]=2 869 B15R1.12 C#CCNCCCOc1ccc(cc1)Cl 34a_200011199081_100000184674 [2,0,0,0,0,0|0,0,0]=2 870 B15R1.12 C#CCNCCCOc1ccc(cc1)F 2230a_100000747263_100000038162 [2,0,0,0,0,0|0,1,0]=3 871 B15R1.12 C#CCNCCCOc1ccc(cc1)F 34a_100000212058_100000181347 [2,0,0,0,0,0|0,1,0]=3 872 B15R1.12 C#CCNCCCOc1ccc(cc1)F 34a_100000747263_100000184674 [2,0,0,0,0,0|0,1,0]=3 873 B15R1.12 C#CCNCCCSc1ccc(cc1)Cl 2230a_100000189518_100000038162 [2,0,0,0,0,0|0,1,0]=3 874 B15R1.12 C#CCNCCCSc1ccc(cc1)F 2230a_100000683907_100000038162 [2,0,0,0,0,0|0,2,0]=4 875 B15R1.12 C#CCNCCOCc1ccc(cc1)Cl 2230a_100000189180_100000038162 [2,0,0,0,0,0|2,0,0]=4 876 B15R1.12 C#CCNCCOCc1ccc(cc1)Cl 34a_100000189180_100000184674 [2,0,0,0,0,0|2,0,0]=4 877 B15R1.12 C#CCNCCSCc1ccc(cc1)Cl 2230a_100000739548_100000038162 [2,0,0,0,0,0|2,0,0]=4 878 B15R1.12 C#CCNCCSCc1ccc(cc1)Cl 34a_100000739548_100000184674 [2,0,0,0,0,0|2,0,0]=4 879 B15R1.12 C#CCNCCSCc1ccc(cc1)Cl 7a_100000739548_100000038162 [2,0,0,0,0,0|2,0,0]=4 880 B15R1.12 C#CCOCCCOc1ccc(cc1)Br 34a_100000210247_100011259224 [2,0,0,0,0,0|1,1,0]=4 881 B15R1.12 C#CCOCCCOc1ccc(cc1)Br 34a_100000756186_100000184674 [2,0,0,0,0,0|1,1,0]=4 882 B15R1.12 C#CCOCCCOc1ccc(cc1)Br 7a_100000756186_100000038162 [2,0,0,0,0,0|1,1,0]=4 883 B15R1.12 C#CCOCCCOc1ccc(cc1)F 34a_100000210247_100000181347 [2,0,0,0,0,0|1,1,0]=4 884 B15R1.12 C#CCOCCCOc1ccc(cc1)N 34a_100000730458_100000184674 [2,0,0,0,0,0|2,0,0]=4 885 B15R1.12 C#CCSCCCOc1ccc(cc1)Br 62a_100000038162_100011259224 [2,0,0,0,0,0|1,1,0]=4 886 B15R1.12 C#CCSCCCOc1ccc(cc1)F 62a_100000038162_100000181347 [2,0,0,0,0,0|1,1,0]=4 887 B15R1.12 C=CCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100000210623 [2,0,0,0,0,0|0,0,2]=4 888 B15R1.12 C=CCNCCCOc1ccc(cc1)Cl 34a_200011199081_100015514636 [2,0,0,0,0,0|0,0,2]=4 889 B15R1.12 CCCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100000210303 [2,0,0,0,0,0|0,0,2]=4 890 B15R1.12 CCCNCCCOc1ccc(cc1)Cl 34a_200011199081_100000210303 [2,0,0,0,0,0|0,0,2]=4 891 B15R1.12 COCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100000766300 [2,0,0,0,0,0|1,0,1]=4 892 B15R1.12 CSCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100011218213 [2,0,0,0,0,0|1,0,1]=4 893 B15R1.12 CSCNCCCOc1ccc(cc1)Cl 34a_200011199081_100011218213 [2,0,0,0,0,0|1,0,1]=4 894 B15R1.12 FCCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100011217306 [2,0,0,0,0,0|1,0,1]=4 895 B15R1.12 FCCNCCCOc1ccc(cc1)Cl 34a_200011199081_100011217306 [2,0,0,0,0,0|1,0,1]=4 896 B15R1.12 N#CCCCCCOc1ccc(cc1)Cl 7a_100000210216_100009813376 [2,0,0,0,0,0|2,0,0]=4 897 B15R1.12 N#CCNCCCCc1ccc(cc1)Cl 2230a_100160821348_100011215382 [2,0,0,0,0,0|2,0,0]=4 898 B15R1.12 N#CCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100011215382 [2,0,0,0,0,0|1,0,0]=3 899 B15R1.12 N#CCNCCCOc1ccc(cc1)F 2230a_100000747263_100011215382 [2,0,0,0,0,0|1,1,0]=4 900 B15R1.12 N#CCNCCCSc1ccc(cc1)Cl 2230a_100000189518_100011215382 [2,0,0,0,0,0|1,1,0]=4 901 B15R1.12 O=CCNCCCOc1ccc(cc1)Cl 2230a_200011199081_200015260668 [2,0,0,0,0,0|1,0,1]=4 902 B15R1.12 O=CCNCCCOc1ccc(cc1)Cl 34a_200011199081_200009817547 [2,0,0,0,0,0|1,0,1]=4 903 B15R1.12 OCCNCCCOc1ccc(cc1)Cl 2230a_200011199081_100000211926 [2,0,0,0,0,0|1,0,1]=4 904 B15R1.12 OCCNCCCOc1ccc(cc1)Cl 34a_200011199081_100000211926 [2,0,0,0,0,0|1,0,1]=4 905 B15R1.26 C#CC(C)NCCOc1ccc(cc1)Cl 2230a_100000707721_100000184122 [2,0,0,0,0,0|2,0,0]=4 906 B15R1.26 C#CC(C)NCCOc1ccc(cc1)Cl 34a_100000697975_200000035995 [2,0,0,0,0,0|2,0,0]=4 907 B15R1.26 C#CC(C)NCCOc1ccc(cc1)Cl 34a_100000707721_100000184122 [2,0,0,0,0,0|2,0,0]=4 908 B15R1.26 C#CC(C)OCCOc1ccc(cc1)Cl 34a_100000237962_200000035995 [2,0,0,0,0,0|2,0,0]=4 909 B15R1.26 C#CC(C)SCCOc1ccc(cc1)Cl 62a_200000035995_100000184122 [2,0,0,0,0,0|2,0,0]=4 910 B15R1.26 C#C[C@@H](C)OCCOc1ccc(cc1)Cl 34a_100009815206_100000184122 [2,0,0,0,0,0|2,0,0]=4 911 B15R1.26 C#C[C@@H](C)OCCOc1ccc(cc1)Cl 7a_100009815206_100000184122 [2,0,0,0,0,0|2,0,0]=4 912 B15R1.26 CCN(C)CCCNc1ccc(cc1)Cl 2230a_100000210052_100015186262 [2,0,0,0,0,0|1,0,1]=4 913 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 2230a_100000225621_100011259224 [2,0,0,0,0,0|0,1,1]=4 914 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000210202 [2,0,0,0,0,0|0,1,1]=4 915 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 269982a_100000225621_100011259224 [2,0,0,0,0,0|0,1,1]=4 916 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000204670 [2,0,0,0,0,0|0,1,1]=4 917 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100000210202 [2,0,0,0,0,0|0,1,1]=4 918 B15R1.26 CCN(C)CCCOc1ccc(cc1)Br 7a_100000185759_100015186262 [2,0,0,0,0,0|0,1,1]=4 919 B15R1.26 CCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000210202 [2,0,0,0,0,0|1,0,1]=4 920 B15R1.26 CCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100000204670 [2,0,0,0,0,0|1,0,1]=4 921 B15R1.26 CCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100000210202 [2,0,0,0,0,0|1,0,1]=4 922 B15R1.26 CCN(C)CCCOc1ccc(cc1)C 7a_100000210336_100015186262 [2,0,0,0,0,0|1,0,1]=4 923 B15R1.26 CCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000210202 [2,0,0,0,0,0|0,0,1]=3 924 B15R1.26 CCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000204670 [2,0,0,0,0,0|0,0,1]=3 925 B15R1.26 CCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000210202 [2,0,0,0,0,0|0,0,1]=3 926 B15R1.26 CCN(C)CCCOc1ccc(cc1)Cl 7a_100000210216_100015186262 [2,0,0,0,0,0|0,0,1]=3 927 B15R1.26 CCN(C)CCCOc1ccc(cc1)F 2230a_100000225621_100000181347 [2,0,0,0,0,0|0,1,1]=4 928 B15R1.26 CCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000210202 [2,0,0,0,0,0|0,1,1]=4 929 B15R1.26 CCN(C)CCCOc1ccc(cc1)F 269982a_100000225621_100000181347 [2,0,0,0,0,0|0,1,1]=4 930 B15R1.26 CCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000204670 [2,0,0,0,0,0|0,1,1]=4 931 B15R1.26 CCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100000210202 [2,0,0,0,0,0|0,1,1]=4 932 B15R1.26 CCN(C)CCCOc1ccc(cc1)I 7a_100000212066_100015186262 [2,0,0,0,0,0|0,1,1]=4 933 B15R1.26 CCN(C)CCCOc1ccc(nc1)Cl 7a_100000744096_100015186262 [2,0,0,0,0,0|1,0,1]=4 934 B15R1.26 CCN(C)CCCSc1ccc(cc1)Cl 62a_100000755918_100015186262 [2,0,0,0,0,0|0,1,1]=4 935 B15R1.26 CN(CF)CCCOc1ccc(cc1)Br 269982a_100102699777_100015361967 [2,0,0,0,0,0|1,1,0]=4 936 B15R1.26 CN(CF)CCCOc1ccc(cc1)Br 34a_100102699777_100015361967 [2,0,0,0,0,0|1,1,0]=4 937 B15R1.26 CN(CF)CCCOc1ccc(cc1)Cl 269982a_100000225747_100015361967 [2,0,0,0,0,0|1,0,0]=3 938 B15R1.26 CN(CF)CCCOc1ccc(cc1)Cl 34a_100000225747_100015361967 [2,0,0,0,0,0|1,0,0]=3 939 B15R1.26 CN(CF)CCCOc1ccc(cc1)F 269982a_100000225698_100015361967 [2,0,0,0,0,0|1,1,0]=4 940 B15R1.26 CN(CF)CCCOc1ccc(cc1)F 34a_100000225698_100015361967 [2,0,0,0,0,0|1,1,0]=4 941 B15R1.26 Cc1ccc(cc1)OCCCN(C)CF 269982a_100011252574_100015361967 [2,0,0,0,0,0|2,0,0]=4 942 B15R1.26 Cc1ccc(cc1)OCCCN(C)CF 34a_100011252574_100015361967 [2,0,0,0,0,0|2,0,0]=4 943 B15R1.778 C#CCC(=O)CCCOc1ccccc1 1458a_100000212059_100000184674 [2,0,0,0,0,0|2,0,0]=4 944 B15R1.778 C#CCC(=O)CCCOc1ccccc1 1458a_100011220946_100000199009 [2,0,0,0,0,0|2,0,0]=4 945 B15R1.778 C#CCC(C)OCCOc1ccccc1 34a_100000685586_100000184471 [2,0,0,0,0,0|2,0,0]=4 946 B15R1.778 C#CCC(C)OCCOc1ccccc1 7a_100000685586_100000184471 [2,0,0,0,0,0|2,0,0]=4 947 B15R1.778 C#CCN(C)CCCCc1ccccc1 2230a_100000225692_100000701786 [2,0,0,0,0,0|1,0,0]=3 948 B15R1.778 C#CCN(C)CCCCc1ccccc1 2230a_100000741445_100000038162 [2,0,0,0,0,0|1,0,0]=3 949 B15R1.778 C#CCN(C)CCCCc1ccccc1 34a_100000225692_100000701786 [2,0,0,0,0,0|1,0,0]=3 950 B15R1.778 C#CCN(C)CCCCc1ccccc1 34a_100000741445_100000184674 [2,0,0,0,0,0|1,0,0]=3 951 B15R1.778 C#CCN(C)CCCCc1ccncc1 2230a_100000225692_100020630000 [2,0,0,0,0,0|2,0,0]=4 952 B15R1.778 C#CCN(C)CCCOc1ccccc1 2230a_100000225623_100000038162 [2,0,0,0,0,0|0,0,0]=2 953 B15R1.778 C#CCN(C)CCCOc1ccccc1 2230a_100000225692_100000199009 [2,0,0,0,0,0|0,0,0]=2 954 B15R1.778 C#CCN(C)CCCOc1ccccc1 34a_100000225692_100000199009 [2,0,0,0,0,0|0,0,0]=2 955 B15R1.778 C#CCN(C)CCCSc1ccccc1 2230a_100000225692_200011203293 [2,0,0,0,0,0|0,1,0]=3 956 B15R1.778 C#CCN(C)CCCSc1ccccc1 2230a_100015183843_100000038162 [2,0,0,0,0,0|0,1,0]=3 957 B15R1.778 C#CCN(C)CCCSc1ccccc1 34a_100000225692_200011203293 [2,0,0,0,0,0|0,1,0]=3 958 B15R1.778 C#CCN(C)CCOCc1ccccc1 2230a_100000225692_100000234347 [2,0,0,0,0,0|2,0,0]=4 959 B15R1.778 C#CCN(C)CCOCc1ccccc1 2230a_100000687121_100000038162 [2,0,0,0,0,0|2,0,0]=4 960 B15R1.778 C#CCN(C)CCOCc1ccccc1 34a_100000225692_100000234347 [2,0,0,0,0,0|2,0,0]=4 961 B15R1.778 C#CCN(C)CCSCc1ccccc1 2230a_100000225692_200011297719 [2,0,0,0,0,0|2,0,0]=4 962 B15R1.778 C#CCN(C)CCSCc1ccccc1 34a_100000225692_200011297719 [2,0,0,0,0,0|2,0,0]=4 963 B15R1.778 C=CCN(C)CCCOc1ccccc1 2230a_100000225617_100000199009 [2,0,0,0,0,0|0,0,2]=4 964 B15R1.778 C=CCN(C)CCCOc1ccccc1 2230a_100000225623_100000210623 [2,0,0,0,0,0|0,0,2]=4 965 B15R1.778 C=CCN(C)CCCOc1ccccc1 269982a_100000225617_100000199009 [2,0,0,0,0,0|0,0,2]=4 966 B15R1.778 C=CCN(C)CCCOc1ccccc1 269982a_100000225623_100000210623 [2,0,0,0,0,0|0,0,2]=4 967 B15R1.778 CCCN(C)CCCOc1ccccc1 2230a_100000225623_100000210303 [2,0,0,0,0,0|0,0,2]=4 968 B15R1.778 CCCN(C)CCCOc1ccccc1 2230a_100000747261_100000199009 [2,0,0,0,0,0|0,0,2]=4 969 B15R1.778 CCCN(C)CCCOc1ccccc1 269982a_100000225623_100000210303 [2,0,0,0,0,0|0,0,2]=4 970 B15R1.778 CCCN(C)CCCOc1ccccc1 269982a_100000747261_100000199009 [2,0,0,0,0,0|0,0,2]=4 971 B15R1.778 CN(CC#N)CCCCc1ccccc1 2230a_100000741445_100011215382 [2,0,0,0,0,0|2,0,0]=4 972 B15R1.778 CN(CC#N)CCCCc1ccccc1 2230a_100000748184_100000701786 [2,0,0,0,0,0|2,0,0]=4 973 B15R1.778 CN(CC#N)CCCCc1ccccc1 269982a_100000741445_100011214920 [2,0,0,0,0,0|2,0,0]=4 974 B15R1.778 CN(CC#N)CCCOc1ccccc1 2230a_100000225623_100011215382 [2,0,0,0,0,0|1,0,0]=3 975 B15R1.778 CN(CC#N)CCCOc1ccccc1 2230a_100000748184_100000199009 [2,0,0,0,0,0|1,0,0]=3 976 B15R1.778 CN(CC#N)CCCOc1ccccc1 269982a_100000225623_100011214920 [2,0,0,0,0,0|1,0,0]=3 977 B15R1.778 CN(CC#N)CCCSc1ccccc1 2230a_100000748184_200011203293 [2,0,0,0,0,0|1,1,0]=4 978 B15R1.778 CN(CC#N)CCCSc1ccccc1 2230a_100015183843_100011215382 [2,0,0,0,0,0|1,1,0]=4 979 B15R1.778 CN(CC#N)CCCSc1ccccc1 269982a_100015183843_100011214920 [2,0,0,0,0,0|1,1,0]=4 980 B15R1.778 CN(CC=O)CCCOc1ccccc1 2230a_100000225623_200015260668 [2,0,0,0,0,0|1,0,1]=4 981 B15R1.778 CN(CC=O)CCCOc1ccccc1 269982a_100000225623_200015260668 [2,0,0,0,0,0|1,0,1]=4 982 B15R1.778 CN(CCF)CCCOc1ccccc1 2230a_100000225623_100011217306 [2,0,0,0,0,0|1,0,1]=4 983 B15R1.778 CN(CCF)CCCOc1ccccc1 269982a_100000225623_100011217306 [2,0,0,0,0,0|1,0,1]=4 984 B15R1.778 CN(CCO)CCCOc1ccccc1 2230a_100000210263_100000199009 [2,0,0,0,0,0|1,0,1]=4 985 B15R1.778 CN(CCO)CCCOc1ccccc1 2230a_100000225623_100000211926 [2,0,0,0,0,0|1,0,1]=4 986 B15R1.778 CN(CCO)CCCOc1ccccc1 269982a_100000210263_100000199009 [2,0,0,0,0,0|1,0,1]=4 987 B15R1.778 CN(CCO)CCCOc1ccccc1 269982a_100000225623_100000211926 [2,0,0,0,0,0|1,0,1]=4 988 B15R1.778 COCN(C)CCCOc1ccccc1 2230a_100000225623_100000766300 [2,0,0,0,0,0|1,0,1]=4 989 B15R1.778 COCN(C)CCCOc1ccccc1 269982a_100000225623_100000766300 [2,0,0,0,0,0|1,0,1]=4 990 B15R1.778 CSCN(C)CCCOc1ccccc1 2230a_100000225623_100011218213 [2,0,0,0,0,0|1,0,1]=4 991 B15R1.778 CSCN(C)CCCOc1ccccc1 269982a_100000225623_100011218213 [2,0,0,0,0,0|1,0,1]=4 992 B15R1.220 C#CCCCCCNc1ccccc1Cl 34a_100000185783_100012094781 [2,0,0,0,0,0|2,0,0]=4 993 B15R1.220 C#CCCCCCOc1ccccc1Br 34a_100000181306_100012094781 [2,0,0,0,0,0|1,1,0]=4 994 B15R1.220 C#CCCCCCOc1ccccc1Br 7a_100000181306_100012094781 [2,0,0,0,0,0|1,1,0]=4 995 B15R1.220 C#CCCCCCOc1ccccc1C 34a_100000210338_100012094781 [2,0,0,0,0,0|2,0,0]=4 996 B15R1.220 C#CCCCCCOc1ccccc1C 7a_100000210338_100012094781 [2,0,0,0,0,0|2,0,0]=4 997 B15R1.220 C#CCCCCCOc1ccccc1Cl 34a_100000210172_100012094781 [2,0,0,0,0,0|1,0,0]=3 998 B15R1.220 C#CCCCCCOc1ccccc1Cl 7a_100000210172_100012094781 [2,0,0,0,0,0|1,0,0]=3 999 B15R1.220 C#CCCCCCOc1ccccc1F 34a_100000210171_100012094781 [2,0,0,0,0,0|1,1,0]=4 1000 B15R1.220 C#CCCCCCOc1ccccc1F 7a_100000210171_100012094781 [2,0,0,0,0,0|1,1,0]=4 1001 B15R1.220 C#CCCCCCOc1ccccc1I 34a_100000739446_100012094781 [2,0,0,0,0,0|1,1,0]=4 1002 B15R1.220 C#CCCCCCOc1ccccc1I 7a_100000739446_100012094781 [2,0,0,0,0,0|1,1,0]=4 1003 B15R1.220 C#CCCCCCOc1ccccc1N 34a_100000185747_100012094781 [2,0,0,0,0,0|2,0,0]=4 1004 B15R1.220 C#CCCCCCOc1ccccc1N 7a_100000185747_100012094781 [2,0,0,0,0,0|2,0,0]=4 1005 B15R1.220 C#CCCCCCOc1cccnc1Cl 34a_100000757616_100012094781 [2,0,0,0,0,0|2,0,0]=4 1006 B15R1.220 C#CCCCCCOc1cccnc1Cl 7a_100000757616_100012094781 [2,0,0,0,0,0|2,0,0]=4 1007 B15R1.220 C#CCCCCCOc1ccncc1Cl 34a_100011997054_100012094781 [2,0,0,0,0,0|2,0,0]=4 1008 B15R1.220 C#CCCCCCOc1cnccc1Cl 34a_100011996695_100012094781 [2,0,0,0,0,0|2,0,0]=4 1009 B15R1.220 C#CCCCCCOc1ncccc1Cl 34a_100011290957_100012094781 [2,0,0,0,0,0|2,0,0]=4 1010 B15R1.220 C#CCCCCCSc1ccccc1Cl 62a_100000764095_100012094781 [2,0,0,0,0,0|1,1,0]=4 1011 B15R1.220 C#CCCCCCSc1ccccc1Cl 62a_100012094781_100000764095 [2,0,0,0,0,0|1,1,0]=4 1012 B15R1.220 C#CCCNCCOc1ccccc1Cl 2230a_100000174932_100000688953 [2,0,0,0,0,0|2,0,0]=4 1013 B15R1.220 C#CCCNCCOc1ccccc1Cl 34a_100000174932_100000688953 [2,0,0,0,0,0|2,0,0]=4 1014 B15R1.220 C#CCCOCCOc1ccccc1Cl 34a_200000230518_100000688953 [2,0,0,0,0,0|2,0,0]=4 1015 B15R1.220 C#CCCOCCOc1ccccc1Cl 7a_200000230518_100000688953 [2,0,0,0,0,0|2,0,0]=4 1016 B15R1.220 C#CCNCCCOc1ccccc1Br 34a_100000212058_200011259276 [2,0,0,0,0,0|0,1,0]=3 1017 B15R1.220 C#CCNCCCOc1ccccc1C 2230a_106633784460_100000038162 [2,0,0,0,0,0|1,0,0]=3 1018 B15R1.220 C#CCNCCCOc1ccccc1C 34a_100000212058_100000742659 [2,0,0,0,0,0|1,0,0]=3 1019 B15R1.220 C#CCNCCCOc1ccccc1C 34a_106633784460_100000184674 [2,0,0,0,0,0|1,0,0]=3 1020 B15R1.220 C#CCNCCCOc1ccccc1F 2230a_100000707858_100000038162 [2,0,0,0,0,0|0,1,0]=3 1021 B15R1.220 C#CCNCCCOc1ccccc1F 34a_100000212058_100011203253 [2,0,0,0,0,0|0,1,0]=3 1022 B15R1.220 C#CCNCCCOc1ccccc1F 34a_100000707858_100000184674 [2,0,0,0,0,0|0,1,0]=3 1023 B15R1.220 C#CCNCCCSc1ccccc1Cl 34a_100000212058_100000750589 [2,0,0,0,0,0|0,1,0]=3 1024 B15R1.220 C#CCNCCOCc1ccccc1Cl 2230a_100000745786_100000038162 [2,0,0,0,0,0|2,0,0]=4 1025 B15R1.220 C#CCNCCOCc1ccccc1Cl 34a_100000745786_100000184674 [2,0,0,0,0,0|2,0,0]=4 1026 B15R1.220 C#CCNCCSCc1ccccc1Cl 2230a_100011219180_100000038162 [2,0,0,0,0,0|2,0,0]=4 1027 B15R1.220 C#CCNCCSCc1ccccc1Cl 34a_100011219180_100000184674 [2,0,0,0,0,0|2,0,0]=4 1028 B15R1.220 C#CCNCCSCc1ccccc1Cl 7a_100011219180_100000038162 [2,0,0,0,0,0|2,0,0]=4 1029 B15R1.220 C#CCOCCCOc1ccccc1Br 34a_100000210247_200011259276 [2,0,0,0,0,0|1,1,0]=4 1030 B15R1.220 C#CCOCCCOc1ccccc1C 34a_100000210247_100000742659 [2,0,0,0,0,0|2,0,0]=4 1031 B15R1.220 C#CCOCCCOc1ccccc1Cl 34a_100000230521_100000184674 [2,0,0,0,0,0|1,0,0]=3 1032 B15R1.220 C#CCOCCCOc1ccccc1Cl 7a_100000230521_100000038162 [2,0,0,0,0,0|1,0,0]=3 1033 B15R1.220 C#CCOCCCOc1ccccc1F 34a_100000210247_100011203253 [2,0,0,0,0,0|1,1,0]=4 1034 B15R1.220 C#CCOCCCSc1ccccc1Cl 34a_100000210247_100000750589 [2,0,0,0,0,0|1,1,0]=4 1035 B15R1.220 C#CCSCCCOc1ccccc1Br 62a_100000038162_200011259276 [2,0,0,0,0,0|1,1,0]=4 1036 B15R1.220 C#CCSCCCOc1ccccc1C 62a_100000038162_100000742659 [2,0,0,0,0,0|2,0,0]=4 1037 B15R1.220 C#CCSCCCOc1ccccc1F 62a_100000038162_100011203253 [2,0,0,0,0,0|1,1,0]=4 1038 B15R1.220 C#CCSCCCSc1ccccc1Cl 62a_100000038162_100000750589 [2,0,0,0,0,0|1,1,0]=4 1039 B15R1.220 Cc1ccccc1OCCCNCC#N 2230a_106633784460_100011215382 [2,0,0,0,0,0|2,0,0]=4 1040 B15R1.220 N#CCCCCCOc1ccccc1Cl 7a_100000210172_100009813376 [2,0,0,0,0,0|2,0,0]=4 1041 B15R1.220 N#CCNCCCOc1ccccc1F 2230a_100000707858_100011215382 [2,0,0,0,0,0|1,1,0]=4 1042 B15R1.220 N#CCOCCCOc1ccccc1Cl 7a_100000230521_100011215382 [2,0,0,0,0,0|2,0,0]=4 1043 B15R1.1176 C#CCCCCNc1ccc(cc1Br)Cl 34a_100000752454_100010269958 [2,0,0,0,0,0|1,1,0]=4 1044 B15R1.1176 C#CCCCCNc1ccc(cc1C)Cl 34a_100000210418_100010269958 [2,0,0,0,0,0|2,0,0]=4 1045 B15R1.1176 C#CCCCCNc1ccc(cc1C)Cl 7a_100000210418_100010269958 [2,0,0,0,0,0|2,0,0]=4 1046 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)Br 34a_100000211467_100010269958 [2,0,0,0,0,0|1,1,0]=4 1047 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)C 34a_100000210522_100010269958 [2,0,0,0,0,0|2,0,0]=4 1048 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)Cl 34a_100000185861_100010269958 [2,0,0,0,0,0|1,0,0]=3 1049 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)F 34a_100000212003_100010269958 [2,0,0,0,0,0|1,1,0]=4 1050 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)I 34a_100011218065_100010269958 [2,0,0,0,0,0|1,1,0]=4 1051 B15R1.1176 C#CCCCCNc1ccc(cc1Cl)O 34a_100011215599_100010269958 [2,0,0,0,0,0|2,0,0]=4 1052 B15R1.1176 C#CCCCCNc1ccc(cc1F)Cl 34a_100000211020_100010269958 [2,0,0,0,0,0|1,1,0]=4 1053 B15R1.1176 C#CCCCCNc1ccc(cc1I)Cl 34a_100000761889_100010269958 [2,0,0,0,0,0|1,1,0]=4 1054 B15R1.1176 C#CCCCCNc1ccc(cc1O)Cl 34a_100000185728_100010269958 [2,0,0,0,0,0|2,0,0]=4 1055 B15R1.1176 C#CCCCCOc1ccc(cc1Br)Br 34a_100000188717_100010269958 [2,0,0,0,0,0|0,2,0]=4 1056 B15R1.1176 C#CCCCCOc1ccc(cc1Br)Br 7a_100000188717_100010269958 [2,0,0,0,0,0|0,2,0]=4 1057 B15R1.1176 C#CCCCCOc1ccc(cc1Br)C 34a_100000210800_100010269958 [2,0,0,0,0,0|1,1,0]=4 1058 B15R1.1176 C#CCCCCOc1ccc(cc1Br)C 7a_100000210800_100010269958 [2,0,0,0,0,0|1,1,0]=4 1059 B15R1.1176 C#CCCCCOc1ccc(cc1Br)Cl 34a_100000211998_100010269958 [2,0,0,0,0,0|0,1,0]=3 1060 B15R1.1176 C#CCCCCOc1ccc(cc1Br)Cl 7a_100000211998_100010269958 [2,0,0,0,0,0|0,1,0]=3 1061 B15R1.1176 C#CCCCCOc1ccc(cc1Br)F 34a_100000211999_100010269958 [2,0,0,0,0,0|0,2,0]=4 1062 B15R1.1176 C#CCCCCOc1ccc(cc1Br)F 7a_100000211999_100010269958 [2,0,0,0,0,0|0,2,0]=4 1063 B15R1.1176 C#CCCCCOc1ccc(cc1Br)I 34a_100012361655_100010269958 [2,0,0,0,0,0|0,2,0]=4 1064 B15R1.1176 C#CCCCCOc1ccc(cc1Br)I 7a_100012361655_100010269958 [2,0,0,0,0,0|0,2,0]=4 1065 B15R1.1176 C#CCCCCOc1ccc(cc1Br)N 34a_100011534360_100010269958 [2,0,0,0,0,0|1,1,0]=4 1066 B15R1.1176 C#CCCCCOc1ccc(cc1Br)N 7a_100011534360_100010269958 [2,0,0,0,0,0|1,1,0]=4 1067 B15R1.1176 C#CCCCCOc1ccc(cc1C)Br 34a_100000186361_100010269958 [2,0,0,0,0,0|1,1,0]=4 1068 B15R1.1176 C#CCCCCOc1ccc(cc1C)Br 7a_100000186361_100010269958 [2,0,0,0,0,0|1,1,0]=4 1069 B15R1.1176 C#CCCCCOc1ccc(cc1C)C 34a_100000211776_100010269958 [2,0,0,0,0,0|2,0,0]=4 1070 B15R1.1176 C#CCCCCOc1ccc(cc1C)C 7a_100000211776_100010269958 [2,0,0,0,0,0|2,0,0]=4 1071 B15R1.1176 C#CCCCCOc1ccc(cc1C)Cl 34a_100000211091_100010269958 [2,0,0,0,0,0|1,0,0]=3 1072 B15R1.1176 C#CCCCCOc1ccc(cc1C)Cl 7a_100000211091_100010269958 [2,0,0,0,0,0|1,0,0]=3 1073 B15R1.1176 C#CCCCCOc1ccc(cc1C)F 34a_100000764316_100010269958 [2,0,0,0,0,0|1,1,0]=4 1074 B15R1.1176 C#CCCCCOc1ccc(cc1C)F 7a_100000764316_100010269958 [2,0,0,0,0,0|1,1,0]=4 1075 B15R1.1176 C#CCCCCOc1ccc(cc1C)I 34a_100011218673_100010269958 [2,0,0,0,0,0|1,1,0]=4 1076 B15R1.1176 C#CCCCCOc1ccc(cc1C)I 7a_100011218673_100010269958 [2,0,0,0,0,0|1,1,0]=4 1077 B15R1.1176 C#CCCCCOc1ccc(cc1C)N 34a_100011218179_100010269958 [2,0,0,0,0,0|2,0,0]=4 1078 B15R1.1176 C#CCCCCOc1ccc(cc1C)N 7a_100011218179_100010269958 [2,0,0,0,0,0|2,0,0]=4 1079 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)Br 34a_100000186472_100010269958 [2,0,0,0,0,0|0,1,0]=3 1080 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)Br 7a_100000186472_100010269958 [2,0,0,0,0,0|0,1,0]=3 1081 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)C 34a_100000749699_100010269958 [2,0,0,0,0,0|1,0,0]=3 1082 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)C 7a_100000749699_100010269958 [2,0,0,0,0,0|1,0,0]=3 1083 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100010269958 [2,0,0,0,0,0|0,0,0]=2 1084 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100010269958 [2,0,0,0,0,0|0,0,0]=2 1085 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)F 34a_100000212004_100010269958 [2,0,0,0,0,0|0,1,0]=3 1086 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)F 7a_100000212004_100010269958 [2,0,0,0,0,0|0,1,0]=3 1087 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)I 34a_100012360047_100010269958 [2,0,0,0,0,0|0,1,0]=3 1088 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)I 7a_100012360047_100010269958 [2,0,0,0,0,0|0,1,0]=3 1089 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)N 34a_100000744943_100010269958 [2,0,0,0,0,0|1,0,0]=3 1090 B15R1.1176 C#CCCCCOc1ccc(cc1Cl)N 7a_100000744943_100010269958 [2,0,0,0,0,0|1,0,0]=3 1091 B15R1.1176 C#CCCCCOc1ccc(cc1F)Br 34a_100000185481_100010269958 [2,0,0,0,0,0|0,2,0]=4 1092 B15R1.1176 C#CCCCCOc1ccc(cc1F)Br 7a_100000185481_100010269958 [2,0,0,0,0,0|0,2,0]=4 1093 B15R1.1176 C#CCCCCOc1ccc(cc1F)C 34a_100011216688_100010269958 [2,0,0,0,0,0|1,1,0]=4 1094 B15R1.1176 C#CCCCCOc1ccc(cc1F)C 7a_100011216688_100010269958 [2,0,0,0,0,0|1,1,0]=4 1095 B15R1.1176 C#CCCCCOc1ccc(cc1F)Cl 34a_100000230166_100010269958 [2,0,0,0,0,0|0,1,0]=3 1096 B15R1.1176 C#CCCCCOc1ccc(cc1F)Cl 7a_100000230166_100010269958 [2,0,0,0,0,0|0,1,0]=3 1097 B15R1.1176 C#CCCCCOc1ccc(cc1F)F 34a_100000230127_100010269958 [2,0,0,0,0,0|0,2,0]=4 1098 B15R1.1176 C#CCCCCOc1ccc(cc1F)F 7a_100000230127_100010269958 [2,0,0,0,0,0|0,2,0]=4 1099 B15R1.1176 C#CCCCCOc1ccc(cc1F)I 34a_100011356965_100010269958 [2,0,0,0,0,0|0,2,0]=4 1100 B15R1.1176 C#CCCCCOc1ccc(cc1F)I 7a_100011356965_100010269958 [2,0,0,0,0,0|0,2,0]=4 1101 B15R1.1176 C#CCCCCOc1ccc(cc1F)N 34a_100011220035_100010269958 [2,0,0,0,0,0|1,1,0]=4 1102 B15R1.1176 C#CCCCCOc1ccc(cc1F)N 7a_100011220035_100010269958 [2,0,0,0,0,0|1,1,0]=4 1103 B15R1.1176 C#CCCCCOc1ccc(cc1I)Br 34a_100012355227_100010269958 [2,0,0,0,0,0|0,2,0]=4 1104 B15R1.1176 C#CCCCCOc1ccc(cc1I)Br 7a_100012355227_100010269958 [2,0,0,0,0,0|0,2,0]=4 1105 B15R1.1176 C#CCCCCOc1ccc(cc1I)C 34a_100000765521_100010269958 [2,0,0,0,0,0|1,1,0]=4 1106 B15R1.1176 C#CCCCCOc1ccc(cc1I)C 7a_100000765521_100010269958 [2,0,0,0,0,0|1,1,0]=4 1107 B15R1.1176 C#CCCCCOc1ccc(cc1I)Cl 34a_100011356953_100010269958 [2,0,0,0,0,0|0,1,0]=3 1108 B15R1.1176 C#CCCCCOc1ccc(cc1I)Cl 7a_100011356953_100010269958 [2,0,0,0,0,0|0,1,0]=3 1109 B15R1.1176 C#CCCCCOc1ccc(cc1I)F 34a_100012355409_100010269958 [2,0,0,0,0,0|0,2,0]=4 1110 B15R1.1176 C#CCCCCOc1ccc(cc1I)F 7a_100012355409_100010269958 [2,0,0,0,0,0|0,2,0]=4 1111 B15R1.1176 C#CCCCCOc1ccc(cc1I)I 7a_100010001573_100010269958 [2,0,0,0,0,0|0,2,0]=4 1112 B15R1.1176 C#CCCCCOc1ccc(cc1N)Br 34a_100000752626_100010269958 [2,0,0,0,0,0|1,1,0]=4 1113 B15R1.1176 C#CCCCCOc1ccc(cc1N)Br 7a_100000752626_100010269958 [2,0,0,0,0,0|1,1,0]=4 1114 B15R1.1176 C#CCCCCOc1ccc(cc1N)C 34a_100011215204_100010269958 [2,0,0,0,0,0|2,0,0]=4 1115 B15R1.1176 C#CCCCCOc1ccc(cc1N)C 7a_100011215204_100010269958 [2,0,0,0,0,0|2,0,0]=4 1116 B15R1.1176 C#CCCCCOc1ccc(cc1N)Cl 34a_100000210500_100010269958 [2,0,0,0,0,0|1,0,0]=3 1117 B15R1.1176 C#CCCCCOc1ccc(cc1N)Cl 7a_100000210500_100010269958 [2,0,0,0,0,0|1,0,0]=3 1118 B15R1.1176 C#CCCCCOc1ccc(cc1N)F 34a_100000759472_100010269958 [2,0,0,0,0,0|1,1,0]=4 1119 B15R1.1176 C#CCCCCOc1ccc(cc1N)F 7a_100000759472_100010269958 [2,0,0,0,0,0|1,1,0]=4 1120 B15R1.1176 C#CCCCCOc1ccc(cc1N)I 34a_100000753495_100010269958 [2,0,0,0,0,0|1,1,0]=4 1121 B15R1.1176 C#CCCCCOc1ccc(cc1N)I 7a_100000753495_100010269958 [2,0,0,0,0,0|1,1,0]=4 1122 B15R1.1176 C#CCCCCOc1ccc(cc1N)N 34a_100000725306_100010269958 [2,0,0,0,0,0|2,0,0]=4 1123 B15R1.1176 C#CCCCCOc1ccc(nc1Br)Cl 34a_100010219353_100010269958 [2,0,0,0,0,0|1,1,0]=4 1124 B15R1.1176 C#CCCCCOc1ccc(nc1Br)Cl 7a_100010219353_100010269958 [2,0,0,0,0,0|1,1,0]=4 1125 B15R1.1176 C#CCCCCOc1ccc(nc1C)Cl 34a_100012184626_100010269958 [2,0,0,0,0,0|2,0,0]=4 1126 B15R1.1176 C#CCCCCOc1ccc(nc1C)Cl 7a_100012184626_100010269958 [2,0,0,0,0,0|2,0,0]=4 1127 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)Br 34a_100010246206_100010269958 [2,0,0,0,0,0|1,1,0]=4 1128 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)Br 7a_100010246206_100010269958 [2,0,0,0,0,0|1,1,0]=4 1129 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)C 34a_100000086286_100010269958 [2,0,0,0,0,0|2,0,0]=4 1130 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)C 7a_100000086286_100010269958 [2,0,0,0,0,0|2,0,0]=4 1131 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)Cl 34a_100000101165_100010269958 [2,0,0,0,0,0|1,0,0]=3 1132 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)Cl 7a_100000101165_100010269958 [2,0,0,0,0,0|1,0,0]=3 1133 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)I 34a_100000721234_100010269958 [2,0,0,0,0,0|1,1,0]=4 1134 B15R1.1176 C#CCCCCOc1ccc(nc1Cl)I 7a_100000721234_100010269958 [2,0,0,0,0,0|1,1,0]=4 1135 B15R1.1176 C#CCCCCOc1ccc(nc1F)Cl 34a_100009880201_100010269958 [2,0,0,0,0,0|1,1,0]=4 1136 B15R1.1176 C#CCCCCOc1ccc(nc1F)Cl 7a_100009880201_100010269958 [2,0,0,0,0,0|1,1,0]=4 1137 B15R1.1176 C#CCCCCOc1ccc(nc1I)Cl 34a_100000696390_100010269958 [2,0,0,0,0,0|1,1,0]=4 1138 B15R1.1176 C#CCCCCOc1ccc(nc1I)Cl 7a_100000696390_100010269958 [2,0,0,0,0,0|1,1,0]=4 1139 B15R1.1176 C#CCCCCOc1ccc(nc1N)Cl 34a_100000717809_100010269958 [2,0,0,0,0,0|2,0,0]=4 1140 B15R1.1176 C#CCCCCOc1ccc(nc1N)Cl 7a_100000717809_100010269958 [2,0,0,0,0,0|2,0,0]=4 1141 B15R1.1176 C#CCCCCOc1cnc(cc1C)Cl 34a_100000692680_100010269958 [2,0,0,0,0,0|2,0,0]=4 1142 B15R1.1176 C#CCCCCOc1cnc(cc1C)Cl 7a_100000692680_100010269958 [2,0,0,0,0,0|2,0,0]=4 1143 B15R1.1176 C#CCCCCOc1cnc(cc1Cl)Cl 34a_100009868576_100010269958 [2,0,0,0,0,0|1,0,0]=3 1144 B15R1.1176 C#CCCCCOc1cnc(cc1Cl)Cl 7a_100009868576_100010269958 [2,0,0,0,0,0|1,0,0]=3 1145 B15R1.1176 C#CCCCCOc1cnc(cc1I)Cl 34a_100000698892_100010269958 [2,0,0,0,0,0|1,1,0]=4 1146 B15R1.1176 C#CCCCCOc1cnc(cc1I)Cl 7a_100000698892_100010269958 [2,0,0,0,0,0|1,1,0]=4 1147 B15R1.1176 C#CCCCCOc1cnc(nc1Cl)Cl 34a_100010725077_100010269958 [2,0,0,0,0,0|2,0,0]=4 1148 B15R1.1176 C#CCCCCOc1cnc(nc1Cl)Cl 7a_100010725077_100010269958 [2,0,0,0,0,0|2,0,0]=4 1149 B15R1.1176 C#CCCCCOc1ncc(cc1Cl)Br 34a_100012339560_100010269958 [2,0,0,0,0,0|1,1,0]=4 1150 B15R1.1176 C#CCCCCOc1ncc(cc1Cl)F 34a_100009847679_100010269958 [2,0,0,0,0,0|1,1,0]=4 1151 B15R1.1176 C#CCCCCOc1ncc(cc1F)Cl 34a_100011998252_100010269958 [2,0,0,0,0,0|1,1,0]=4 1152 B15R1.1176 C#CCCCCOc1ncc(cc1N)Cl 34a_100011998249_100010269958 [2,0,0,0,0,0|2,0,0]=4 1153 B15R1.1176 C#CCCCCSc1ccc(cc1C)Cl 62a_100010269958_100011219607 [2,0,0,0,0,0|1,1,0]=4 1154 B15R1.1176 C#CCCCCSc1ccc(cc1C)Cl 62a_100011219607_100010269958 [2,0,0,0,0,0|1,1,0]=4 1155 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)C 62a_100010269958_100011263221 [2,0,0,0,0,0|1,1,0]=4 1156 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)C 62a_100011263221_100010269958 [2,0,0,0,0,0|1,1,0]=4 1157 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)Cl 62a_100000699841_100010269958 [2,0,0,0,0,0|0,1,0]=3 1158 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)Cl 62a_100010269958_100000699841 [2,0,0,0,0,0|0,1,0]=3 1159 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)F 62a_100000733362_100010269958 [2,0,0,0,0,0|0,2,0]=4 1160 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)F 62a_100010269958_100000733362 [2,0,0,0,0,0|0,2,0]=4 1161 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)N 62a_100000761885_100010269958 [2,0,0,0,0,0|1,1,0]=4 1162 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)N 62a_100010269958_100000761885 [2,0,0,0,0,0|1,1,0]=4 1163 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)O 62a_100000047559_100010269958 [2,0,0,0,0,0|1,1,0]=4 1164 B15R1.1176 C#CCCCCSc1ccc(cc1Cl)O 62a_100010269958_100000047559 [2,0,0,0,0,0|1,1,0]=4 1165 B15R1.1176 C#CCCCCSc1ccc(cc1F)Cl 62a_100010269958_100011216042 [2,0,0,0,0,0|0,2,0]=4 1166 B15R1.1176 C#CCCCCSc1ccc(cc1F)Cl 62a_100011216042_100010269958 [2,0,0,0,0,0|0,2,0]=4 1167 B15R1.1176 C#CCCCCSc1ccc(cc1N)Cl 62a_100000761886_100010269958 [2,0,0,0,0,0|1,1,0]=4 1168 B15R1.1176 C#CCCCCSc1ccc(cc1N)Cl 62a_100010269958_100000761886 [2,0,0,0,0,0|1,1,0]=4 1169 B15R1.1176 C#CCCCCSc1ccc(cc1O)Cl 62a_100000050036_100010269958 [2,0,0,0,0,0|1,1,0]=4 1170 B15R1.1176 C#CCCCCSc1ccc(cc1O)Cl 62a_100010269958_100000050036 [2,0,0,0,0,0|1,1,0]=4 1171 B15R1.1176 C#CCCCCSc1ccc(nc1Cl)Cl 62a_100010269958_100000043682 [2,0,0,0,0,0|1,1,0]=4 1172 B15R1.1176 C#CCCCCSc1cnc(cc1Cl)Cl 62a_100010200927_100010269958 [2,0,0,0,0,0|1,1,0]=4 1173 B15R1.1176 C#CCCCCSc1cnc(cc1Cl)Cl 62a_100010269958_100010200927 [2,0,0,0,0,0|1,1,0]=4 1174 B15R1.1176 C#CCCCNCc1ccc(cc1Cl)Cl 207a_100000718082_100000188887 [2,0,0,0,0,0|2,0,0]=4 1175 B15R1.1176 C#CCCCNCc1ccc(cc1Cl)Cl 270004a_100000718082_100000188887 [2,0,0,0,0,0|2,0,0]=4 1176 B15R1.1176 C#CCCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000695029 [2,0,0,0,0,0|2,0,0]=4 1177 B15R1.1176 C#CCCCNCc1ccc(cc1Cl)Cl 34a_100000718082_100000188473 [2,0,0,0,0,0|2,0,0]=4 1178 B15R1.1176 C#CCCCOCc1ccc(cc1Cl)Cl 34a_100000215630_100000188473 [2,0,0,0,0,0|2,0,0]=4 1179 B15R1.1176 C#CCCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000695029 [2,0,0,0,0,0|2,0,0]=4 1180 B15R1.1176 C#CCCCOCc1ccc(cc1Cl)Cl 7a_100000215630_100000188473 [2,0,0,0,0,0|2,0,0]=4 1181 B15R1.1176 C#CCCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100011215417 [2,0,0,0,0,0|2,0,0]=4 1182 B15R1.1176 C#CCCCSCc1ccc(cc1Cl)Cl 62a_100000188473_100011215417 [2,0,0,0,0,0|2,0,0]=4 1183 B15R1.1176 C#CCCCSCc1ccc(cc1Cl)Cl 62a_100011215417_100000188473 [2,0,0,0,0,0|2,0,0]=4 1184 B15R1.1176 C#CCCNCCc1ccc(cc1Cl)Cl 2230a_100000210994_100000688953 [2,0,0,0,0,0|2,0,0]=4 1185 B15R1.1176 C#CCCNCCc1ccc(cc1Cl)Cl 34a_100000210994_100000688953 [2,0,0,0,0,0|2,0,0]=4 1186 B15R1.1176 C#CCCNCCc1ccc(cc1Cl)Cl 34a_100000755551_200012161198 [2,0,0,0,0,0|2,0,0]=4 1187 B15R1.1176 C#CCCOCCc1ccc(cc1Cl)Cl 34a_100011215631_200012161198 [2,0,0,0,0,0|2,0,0]=4 1188 B15R1.1176 C#CCCOCCc1ccc(cc1Cl)Cl 34a_100011215701_100000688953 [2,0,0,0,0,0|2,0,0]=4 1189 B15R1.1176 C#CCCOCCc1ccc(cc1Cl)Cl 7a_100011215701_100000688953 [2,0,0,0,0,0|2,0,0]=4 1190 B15R1.1176 C#CCCSCCc1ccc(cc1Cl)Cl 62a_100000688953_200012161198 [2,0,0,0,0,0|2,0,0]=4 1191 B15R1.1176 C#CCCSCCc1ccc(cc1Cl)Cl 62a_200012161198_100000688953 [2,0,0,0,0,0|2,0,0]=4 1192 B15R1.1176 C#CCNCCOc1ccc(cc1Br)C 2230a_100025744979_100000038162 [2,0,0,0,0,0|1,1,0]=4 1193 B15R1.1176 C#CCNCCOc1ccc(cc1Br)C 34a_100025744979_100000184674 [2,0,0,0,0,0|1,1,0]=4 1194 B15R1.1176 C#CCNCCOc1ccc(cc1Br)Cl 34a_100000212058_100000199037 [2,0,0,0,0,0|0,1,0]=3 1195 B15R1.1176 C#CCNCCOc1ccc(cc1C)C 34a_100000212058_100011210784 [2,0,0,0,0,0|2,0,0]=4 1196 B15R1.1176 C#CCNCCOc1ccc(cc1C)Cl 2230a_100025744827_100000038162 [2,0,0,0,0,0|1,0,0]=3 1197 B15R1.1176 C#CCNCCOc1ccc(cc1C)Cl 34a_100025744827_100000184674 [2,0,0,0,0,0|1,0,0]=3 1198 B15R1.1176 C#CCNCCOc1ccc(cc1Cl)Cl 34a_100000212058_100000184432 [2,0,0,0,0,0|0,0,0]=2 1199 B15R1.1176 C#CCNCCOc1ccc(cc1Cl)F 2230a_100020586385_100000038162 [2,0,0,0,0,0|0,1,0]=3 1200 B15R1.1176 C#CCNCCOc1ccc(cc1Cl)F 34a_100020586385_100000184674 [2,0,0,0,0,0|0,1,0]=3 1201 B15R1.1176 C#CCOCCCc1ccc(cc1Cl)Cl 34a_200011713141_100000184674 [2,0,0,0,0,0|1,0,0]=3 1202 B15R1.1176 C#CCOCCCc1ccc(cc1Cl)Cl 7a_200011713141_100000038162 [2,0,0,0,0,0|1,0,0]=3 1203 B15R1.1176 C#CCOCCNc1ccc(cc1Cl)Cl 34a_100000185861_100010402529 [2,0,0,0,0,0|2,0,0]=4 1204 B15R1.1176 C#CCOCCOc1ccc(cc1Br)Cl 34a_100000193638_100000184674 [2,0,0,0,0,0|1,1,0]=4 1205 B15R1.1176 C#CCOCCOc1ccc(cc1Br)Cl 34a_100000210247_100000199037 [2,0,0,0,0,0|1,1,0]=4 1206 B15R1.1176 C#CCOCCOc1ccc(cc1Br)Cl 34a_100000211998_100010402529 [2,0,0,0,0,0|1,1,0]=4 1207 B15R1.1176 C#CCOCCOc1ccc(cc1Br)Cl 7a_100000193638_100000038162 [2,0,0,0,0,0|1,1,0]=4 1208 B15R1.1176 C#CCOCCOc1ccc(cc1Br)Cl 7a_100000211998_100010402529 [2,0,0,0,0,0|1,1,0]=4 1209 B15R1.1176 C#CCOCCOc1ccc(cc1C)Cl 34a_100000211091_100010402529 [2,0,0,0,0,0|2,0,0]=4 1210 B15R1.1176 C#CCOCCOc1ccc(cc1C)Cl 7a_100000211091_100010402529 [2,0,0,0,0,0|2,0,0]=4 1211 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Br 34a_100000186472_100010402529 [2,0,0,0,0,0|1,1,0]=4 1212 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Br 7a_100000186472_100010402529 [2,0,0,0,0,0|1,1,0]=4 1213 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)C 34a_100000749699_100010402529 [2,0,0,0,0,0|2,0,0]=4 1214 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)C 7a_100000749699_100010402529 [2,0,0,0,0,0|2,0,0]=4 1215 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Cl 34a_100000210247_100000184432 [2,0,0,0,0,0|1,0,0]=3 1216 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Cl 34a_100015191787_100010402529 [2,0,0,0,0,0|1,0,0]=3 1217 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000184674 [2,0,0,0,0,0|1,0,0]=3 1218 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Cl 7a_100015191787_100010402529 [2,0,0,0,0,0|1,0,0]=3 1219 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000038162 [2,0,0,0,0,0|1,0,0]=3 1220 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)F 34a_100000212004_100010402529 [2,0,0,0,0,0|1,1,0]=4 1221 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)F 7a_100000212004_100010402529 [2,0,0,0,0,0|1,1,0]=4 1222 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)I 34a_100012360047_100010402529 [2,0,0,0,0,0|1,1,0]=4 1223 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)I 7a_100012360047_100010402529 [2,0,0,0,0,0|1,1,0]=4 1224 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)N 34a_100000744943_100010402529 [2,0,0,0,0,0|2,0,0]=4 1225 B15R1.1176 C#CCOCCOc1ccc(cc1Cl)N 7a_100000744943_100010402529 [2,0,0,0,0,0|2,0,0]=4 1226 B15R1.1176 C#CCOCCOc1ccc(cc1F)Cl 34a_100000230166_100010402529 [2,0,0,0,0,0|1,1,0]=4 1227 B15R1.1176 C#CCOCCOc1ccc(cc1F)Cl 7a_100000230166_100010402529 [2,0,0,0,0,0|1,1,0]=4 1228 B15R1.1176 C#CCOCCOc1ccc(cc1I)Cl 34a_100011356953_100010402529 [2,0,0,0,0,0|1,1,0]=4 1229 B15R1.1176 C#CCOCCOc1ccc(cc1I)Cl 7a_100011356953_100010402529 [2,0,0,0,0,0|1,1,0]=4 1230 B15R1.1176 C#CCOCCOc1ccc(cc1N)Cl 34a_100000210500_100010402529 [2,0,0,0,0,0|2,0,0]=4 1231 B15R1.1176 C#CCOCCOc1ccc(cc1N)Cl 7a_100000210500_100010402529 [2,0,0,0,0,0|2,0,0]=4 1232 B15R1.1176 C#CCOCCOc1ccc(nc1Cl)Cl 34a_100000101165_100010402529 [2,0,0,0,0,0|2,0,0]=4 1233 B15R1.1176 C#CCOCCOc1ccc(nc1Cl)Cl 7a_100000101165_100010402529 [2,0,0,0,0,0|2,0,0]=4 1234 B15R1.1176 C#CCOCCOc1cnc(cc1Cl)Cl 34a_100009868576_100010402529 [2,0,0,0,0,0|2,0,0]=4 1235 B15R1.1176 C#CCOCCOc1cnc(cc1Cl)Cl 7a_100009868576_100010402529 [2,0,0,0,0,0|2,0,0]=4 1236 B15R1.1176 C#CCOCCSc1ccc(cc1Cl)Cl 34a_200010001942_100000184674 [2,0,0,0,0,0|1,1,0]=4 1237 B15R1.1176 C#CCOCCSc1ccc(cc1Cl)Cl 62a_100000699841_100010402529 [2,0,0,0,0,0|1,1,0]=4 1238 B15R1.1176 C#CCOCCSc1ccc(cc1Cl)Cl 62a_100010402529_100000699841 [2,0,0,0,0,0|1,1,0]=4 1239 B15R1.1176 C#CCOCCSc1ccc(cc1Cl)Cl 7a_200010001942_100000038162 [2,0,0,0,0,0|1,1,0]=4 1240 B15R1.1176 C#CCSCCOc1ccc(cc1Br)Cl 62a_100000038162_100000199037 [2,0,0,0,0,0|1,1,0]=4 1241 B15R1.1176 C#CCSCCOc1ccc(cc1Cl)Cl 62a_100000038162_100000184432 [2,0,0,0,0,0|1,0,0]=3 1242 B15R1.1176 C=CCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100011215482 [2,0,0,0,0,0|0,0,2]=4 1243 B15R1.1176 C=CCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011215482 [2,0,0,0,0,0|0,0,2]=4 1244 B15R1.1176 C=CCNCCCc1ccc(cc1Cl)Cl 270004a_100020586998_100000765304 [2,0,0,0,0,0|0,0,2]=4 1245 B15R1.1176 C=CCNCCOc1ccc(cc1Cl)Cl 2230a_100020586998_100000184432 [2,0,0,0,0,0|0,0,2]=4 1246 B15R1.1176 CCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210314 [2,0,0,0,0,0|0,0,2]=4 1247 B15R1.1176 CCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210314 [2,0,0,0,0,0|0,0,2]=4 1248 B15R1.1176 CCCNCCCc1ccc(cc1Cl)Cl 270004a_100020643023_100000765304 [2,0,0,0,0,0|0,0,2]=4 1249 B15R1.1176 CCOCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100012232248 [2,0,0,0,0,0|1,0,1]=4 1250 B15R1.1176 CCOCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100012232248 [2,0,0,0,0,0|1,0,1]=4 1251 B15R1.1176 COCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000755781 [2,0,0,0,0,0|1,0,1]=4 1252 B15R1.1176 COCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000730899 [2,0,0,0,0,0|1,0,1]=4 1253 B15R1.1176 Cc1cc(ccc1OCCCCC#N)Cl 7a_100000211091_100000211819 [2,0,0,0,0,0|2,0,0]=4 1254 B15R1.1176 Cc1cc(ccc1OCCNCC#N)Cl 2230a_100025744827_100011215382 [2,0,0,0,0,0|2,0,0]=4 1255 B15R1.1176 Cc1ccc(c(c1)Cl)OCCCCC#N 7a_100000749699_100000211819 [2,0,0,0,0,0|2,0,0]=4 1256 B15R1.1176 FCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000729378 [2,0,0,0,0,0|1,0,1]=4 1257 B15R1.1176 FCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000729378 [2,0,0,0,0,0|1,0,1]=4 1258 B15R1.1176 FCCNCCOc1ccc(cc1Cl)Cl 34a_100000724931_100000184432 [2,0,0,0,0,0|1,0,1]=4 1259 B15R1.1176 N#CCCCCOc1ccc(cc1Br)Cl 7a_100000211998_100000211819 [2,0,0,0,0,0|1,1,0]=4 1260 B15R1.1176 N#CCCCCOc1ccc(cc1Cl)Br 7a_100000186472_100000211819 [2,0,0,0,0,0|1,1,0]=4 1261 B15R1.1176 N#CCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000211819 [2,0,0,0,0,0|1,0,0]=3 1262 B15R1.1176 N#CCCCCOc1ccc(cc1Cl)F 7a_100000212004_100000211819 [2,0,0,0,0,0|1,1,0]=4 1263 B15R1.1176 N#CCCCCOc1ccc(cc1Cl)I 7a_100012360047_100000211819 [2,0,0,0,0,0|1,1,0]=4 1264 B15R1.1176 N#CCCCCOc1ccc(cc1Cl)N 7a_100000744943_100000211819 [2,0,0,0,0,0|2,0,0]=4 1265 B15R1.1176 N#CCCCCOc1ccc(cc1F)Cl 7a_100000230166_100000211819 [2,0,0,0,0,0|1,1,0]=4 1266 B15R1.1176 N#CCCCCOc1ccc(cc1I)Cl 7a_100011356953_100000211819 [2,0,0,0,0,0|1,1,0]=4 1267 B15R1.1176 N#CCCCCOc1ccc(cc1N)Cl 7a_100000210500_100000211819 [2,0,0,0,0,0|2,0,0]=4 1268 B15R1.1176 N#CCCCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000211819 [2,0,0,0,0,0|2,0,0]=4 1269 B15R1.1176 N#CCCCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000211819 [2,0,0,0,0,0|2,0,0]=4 1270 B15R1.1176 N#CCCCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000211819 [2,0,0,0,0,0|1,1,0]=4 1271 B15R1.1176 N#CCCCCSc1ccc(cc1Cl)Cl 62a_100011219923_100000699841 [2,0,0,0,0,0|1,1,0]=4 1272 B15R1.1176 N#CCNCCOc1ccc(cc1Cl)F 2230a_100020586385_100011215382 [2,0,0,0,0,0|1,1,0]=4 1273 B15R1.1176 N#CCOCCCc1ccc(cc1Cl)Cl 7a_200011713141_100011215382 [2,0,0,0,0,0|2,0,0]=4 1274 B15R1.1176 N#CCOCCOc1ccc(cc1Cl)Cl 7a_100015191787_200000047693 [2,0,0,0,0,0|2,0,0]=4 1275 B15R1.1176 N#CCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100011215382 [2,0,0,0,0,0|2,0,0]=4 1276 B15R1.1176 N#CCSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100011215382 [2,0,0,0,0,0|2,0,0]=4 1277 B15R1.1176 N#CCSCCOc1ccc(cc1Cl)Cl 62a_100011215382_100000184432 [2,0,0,0,0,0|2,0,0]=4 1278 B15R1.1176 O=CCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000139335 [2,0,0,0,0,0|1,0,1]=4 1279 B15R1.1176 OCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000746330 [2,0,0,0,0,0|1,0,1]=4 1280 B15R1.1176 OCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000746330 [2,0,0,0,0,0|1,0,1]=4 1281 B15R1.1176 OCCNCCCc1ccc(cc1Cl)Cl 270004a_100000210304_100000765304 [2,0,0,0,0,0|1,0,1]=4 1282 B15R1.1176 OCCNCCOc1ccc(cc1Cl)Cl 2230a_100016997473_100000184432 [2,0,0,0,0,0|1,0,1]=4 1283 B15R1.1176 OCCNCCOc1ccc(cc1Cl)Cl 34a_100016990907_100000184432 [2,0,0,0,0,0|1,0,1]=4 1284 B15R1.1091 C#CC(C)NCCOc1ccccc1Cl 34a_100000174932_200000035995 [2,0,0,0,0,0|2,0,0]=4 1285 B15R1.1091 C#CC(C)OCCOc1ccccc1Cl 34a_200000230518_200000035995 [2,0,0,0,0,0|2,0,0]=4 1286 B15R1.1091 CCN(C)CCCOc1ccccc1Br 2230a_100000225621_200011259276 [2,0,0,0,0,0|0,1,1]=4 1287 B15R1.1091 CCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000210202 [2,0,0,0,0,0|0,1,1]=4 1288 B15R1.1091 CCN(C)CCCOc1ccccc1Br 269982a_100000225621_200011259276 [2,0,0,0,0,0|0,1,1]=4 1289 B15R1.1091 CCN(C)CCCOc1ccccc1Br 269982a_100015186278_100000204670 [2,0,0,0,0,0|0,1,1]=4 1290 B15R1.1091 CCN(C)CCCOc1ccccc1Br 7a_100000181306_100015186262 [2,0,0,0,0,0|0,1,1]=4 1291 B15R1.1091 CCN(C)CCCOc1ccccc1C 2230a_100000225621_100000742659 [2,0,0,0,0,0|1,0,1]=4 1292 B15R1.1091 CCN(C)CCCOc1ccccc1C 2230a_100000742905_100000210202 [2,0,0,0,0,0|1,0,1]=4 1293 B15R1.1091 CCN(C)CCCOc1ccccc1C 269982a_100000225621_100000742659 [2,0,0,0,0,0|1,0,1]=4 1294 B15R1.1091 CCN(C)CCCOc1ccccc1C 269982a_100000742905_100000204670 [2,0,0,0,0,0|1,0,1]=4 1295 B15R1.1091 CCN(C)CCCOc1ccccc1C 34a_100000742905_100000210202 [2,0,0,0,0,0|1,0,1]=4 1296 B15R1.1091 CCN(C)CCCOc1ccccc1C 7a_100000210338_100015186262 [2,0,0,0,0,0|1,0,1]=4 1297 B15R1.1091 CCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000210202 [2,0,0,0,0,0|0,0,1]=3 1298 B15R1.1091 CCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000204670 [2,0,0,0,0,0|0,0,1]=3 1299 B15R1.1091 CCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000210202 [2,0,0,0,0,0|0,0,1]=3 1300 B15R1.1091 CCN(C)CCCOc1ccccc1Cl 7a_100000210172_100015186262 [2,0,0,0,0,0|0,0,1]=3 1301 B15R1.1091 CCN(C)CCCOc1ccccc1F 2230a_100000225621_100011203253 [2,0,0,0,0,0|0,1,1]=4 1302 B15R1.1091 CCN(C)CCCOc1ccccc1F 269982a_100000225621_100011203253 [2,0,0,0,0,0|0,1,1]=4 1303 B15R1.1091 CCN(C)CCCOc1ccccc1F 7a_100000210171_100015186262 [2,0,0,0,0,0|0,1,1]=4 1304 B15R1.1091 CCN(C)CCCOc1ccccc1I 7a_100000739446_100015186262 [2,0,0,0,0,0|0,1,1]=4 1305 B15R1.1091 CCN(C)CCCOc1ccccc1N 7a_100000185747_100015186262 [2,0,0,0,0,0|1,0,1]=4 1306 B15R1.1091 CCN(C)CCCOc1cccnc1Cl 7a_100000757616_100015186262 [2,0,0,0,0,0|1,0,1]=4 1307 B15R1.1091 CCN(C)CCCSc1ccccc1Cl 2230a_100000225621_100000750589 [2,0,0,0,0,0|0,1,1]=4 1308 B15R1.1091 CCN(C)CCCSc1ccccc1Cl 269982a_100000225621_100000750589 [2,0,0,0,0,0|0,1,1]=4 1309 B15R1.1091 CCN(C)CCCSc1ccccc1Cl 62a_100000764095_100015186262 [2,0,0,0,0,0|0,1,1]=4 1310 B15R1.1091 CN(CF)CCCOc1ccccc1Br 269982a_100015186278_100015361967 [2,0,0,0,0,0|1,1,0]=4 1311 B15R1.1091 CN(CF)CCCOc1ccccc1Cl 269982a_100011252689_100015361967 [2,0,0,0,0,0|1,0,0]=3 1312 B15R1.1091 CN(CF)CCCOc1ccccc1Cl 34a_100011252689_100015361967 [2,0,0,0,0,0|1,0,0]=3 1313 B15R1.1091 Cc1ccccc1OCCCN(C)CF 269982a_100000742905_100015361967 [2,0,0,0,0,0|2,0,0]=4 1314 B15R1.1091 Cc1ccccc1OCCCN(C)CF 34a_100000742905_100015361967 [2,0,0,0,0,0|2,0,0]=4 1315 B15R1.5821 CC(=CCCOc1ccc(cc1Cl)Cl)C 34a_100015191787_100011217483 [2,0,0,0,0,0|1,0,1]=4 1316 B15R1.5821 CC(=CCCOc1ccc(cc1Cl)Cl)C 7a_100015191787_100011217483 [2,0,0,0,0,0|1,0,1]=4 1317 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200000210301 [2,0,0,0,0,0|2,0,0]=4 1318 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000685027 [2,0,0,0,0,0|2,0,0]=4 1319 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011215641 [2,0,0,0,0,0|2,0,0]=4 1320 B15R1.5821 CC(C)CCCNc1ccc(cc1Cl)Cl 34a_100000185861_100011214892 [2,0,0,0,0,0|2,0,0]=4 1321 B15R1.5821 CC(C)CCCOc1ccc(cc1Br)Cl 34a_100000211998_100011214892 [2,0,0,0,0,0|1,1,0]=4 1322 B15R1.5821 CC(C)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100011214892 [2,0,0,0,0,0|1,1,0]=4 1323 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)Br 34a_100000186472_100011214892 [2,0,0,0,0,0|1,1,0]=4 1324 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100011214892 [2,0,0,0,0,0|1,1,0]=4 1325 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100011214892 [2,0,0,0,0,0|1,0,0]=3 1326 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011214892 [2,0,0,0,0,0|1,0,0]=3 1327 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)F 34a_100000212004_100011214892 [2,0,0,0,0,0|1,1,0]=4 1328 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)F 7a_100000212004_100011214892 [2,0,0,0,0,0|1,1,0]=4 1329 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)I 34a_100012360047_100011214892 [2,0,0,0,0,0|1,1,0]=4 1330 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)I 7a_100012360047_100011214892 [2,0,0,0,0,0|1,1,0]=4 1331 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)N 34a_100000744943_100011214892 [2,0,0,0,0,0|2,0,0]=4 1332 B15R1.5821 CC(C)CCCOc1ccc(cc1Cl)N 7a_100000744943_100011214892 [2,0,0,0,0,0|2,0,0]=4 1333 B15R1.5821 CC(C)CCCOc1ccc(cc1F)Cl 34a_100000230166_100011214892 [2,0,0,0,0,0|1,1,0]=4 1334 B15R1.5821 CC(C)CCCOc1ccc(cc1F)Cl 7a_100000230166_100011214892 [2,0,0,0,0,0|1,1,0]=4 1335 B15R1.5821 CC(C)CCCOc1ccc(cc1I)Cl 34a_100011356953_100011214892 [2,0,0,0,0,0|1,1,0]=4 1336 B15R1.5821 CC(C)CCCOc1ccc(cc1I)Cl 7a_100011356953_100011214892 [2,0,0,0,0,0|1,1,0]=4 1337 B15R1.5821 CC(C)CCCOc1ccc(cc1N)Cl 34a_100000210500_100011214892 [2,0,0,0,0,0|2,0,0]=4 1338 B15R1.5821 CC(C)CCCOc1ccc(cc1N)Cl 7a_100000210500_100011214892 [2,0,0,0,0,0|2,0,0]=4 1339 B15R1.5821 CC(C)CCCOc1ccc(nc1Cl)Cl 34a_100000101165_100011214892 [2,0,0,0,0,0|2,0,0]=4 1340 B15R1.5821 CC(C)CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100011214892 [2,0,0,0,0,0|2,0,0]=4 1341 B15R1.5821 CC(C)CCCOc1cnc(cc1Cl)Cl 34a_100009868576_100011214892 [2,0,0,0,0,0|2,0,0]=4 1342 B15R1.5821 CC(C)CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100011214892 [2,0,0,0,0,0|2,0,0]=4 1343 B15R1.5821 CC(C)NCCOc1ccc(cc1Cl)Cl 2230a_100138425928_100000184432 [2,0,0,0,0,0|2,0,0]=4 1344 B15R1.5821 CC(C)NCCOc1ccc(cc1Cl)Cl 34a_100138425928_100000184432 [2,0,0,0,0,0|2,0,0]=4 1345 B15R1.5821 CC(C)OCCOc1ccc(cc1Cl)Cl 34a_100000212225_100000184432 [2,0,0,0,0,0|2,0,0]=4 1346 B15R1.5821 CC(C)OCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000211751 [2,0,0,0,0,0|2,0,0]=4 1347 B15R1.5821 CC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000210206 [2,0,0,0,0,0|2,0,0]=4 1348 B15R1.5821 CC(C)OCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000211751 [2,0,0,0,0,0|2,0,0]=4 1349 B15R1.5821 CC(C)OCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000210206 [2,0,0,0,0,0|2,0,0]=4 1350 B15R1.5821 CC(C)SCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000730970 [2,0,0,0,0,0|2,0,0]=4 1351 B15R1.5821 CC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000210206 [2,0,0,0,0,0|2,0,0]=4 1352 B15R1.5821 CC(C)SCCOc1ccc(cc1Cl)Cl 62a_100000210206_100000184432 [2,0,0,0,0,0|2,0,0]=4 1353 B15R1.5821 CC(C)SCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000730970 [2,0,0,0,0,0|2,0,0]=4 1354 B15R1.5821 CC(O)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_200000718107 [2,0,0,0,0,0|2,0,0]=4 1355 B15R1.5821 CC(O)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_200000718107 [2,0,0,0,0,0|2,0,0]=4 1356 B15R1.5821 CN(C)CCCOc1ccc(cc1Br)Br 7a_100000188717_100000757444 [2,0,0,0,0,0|0,2,0]=4 1357 B15R1.5821 CN(C)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100000757444 [2,0,0,0,0,0|0,1,0]=3 1358 B15R1.5821 CN(C)CCCOc1ccc(cc1Br)F 7a_100000211999_100000757444 [2,0,0,0,0,0|0,2,0]=4 1359 B15R1.5821 CN(C)CCCOc1ccc(cc1Br)I 7a_100012361655_100000757444 [2,0,0,0,0,0|0,2,0]=4 1360 B15R1.5821 CN(C)CCCOc1ccc(cc1Br)N 7a_100011534360_100000757444 [2,0,0,0,0,0|1,1,0]=4 1361 B15R1.5821 CN(C)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100000757444 [2,0,0,0,0,0|0,1,0]=3 1362 B15R1.5821 CN(C)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000757444 [2,0,0,0,0,0|0,0,0]=2 1363 B15R1.5821 CN(C)CCCOc1ccc(cc1Cl)F 7a_100000212004_100000757444 [2,0,0,0,0,0|0,1,0]=3 1364 B15R1.5821 CN(C)CCCOc1ccc(cc1Cl)I 7a_100012360047_100000757444 [2,0,0,0,0,0|0,1,0]=3 1365 B15R1.5821 CN(C)CCCOc1ccc(cc1Cl)N 7a_100000744943_100000757444 [2,0,0,0,0,0|1,0,0]=3 1366 B15R1.5821 CN(C)CCCOc1ccc(cc1F)Br 7a_100000185481_100000757444 [2,0,0,0,0,0|0,2,0]=4 1367 B15R1.5821 CN(C)CCCOc1ccc(cc1F)Cl 7a_100000230166_100000757444 [2,0,0,0,0,0|0,1,0]=3 1368 B15R1.5821 CN(C)CCCOc1ccc(cc1F)F 7a_100000230127_100000757444 [2,0,0,0,0,0|0,2,0]=4 1369 B15R1.5821 CN(C)CCCOc1ccc(cc1F)I 7a_100011356965_100000757444 [2,0,0,0,0,0|0,2,0]=4 1370 B15R1.5821 CN(C)CCCOc1ccc(cc1F)N 7a_100011220035_100000757444 [2,0,0,0,0,0|1,1,0]=4 1371 B15R1.5821 CN(C)CCCOc1ccc(cc1I)Br 7a_100012355227_100000757444 [2,0,0,0,0,0|0,2,0]=4 1372 B15R1.5821 CN(C)CCCOc1ccc(cc1I)Cl 7a_100011356953_100000757444 [2,0,0,0,0,0|0,1,0]=3 1373 B15R1.5821 CN(C)CCCOc1ccc(cc1I)F 7a_100012355409_100000757444 [2,0,0,0,0,0|0,2,0]=4 1374 B15R1.5821 CN(C)CCCOc1ccc(cc1I)I 7a_100010001573_100000757444 [2,0,0,0,0,0|0,2,0]=4 1375 B15R1.5821 CN(C)CCCOc1ccc(cc1N)Br 7a_100000752626_100000757444 [2,0,0,0,0,0|1,1,0]=4 1376 B15R1.5821 CN(C)CCCOc1ccc(cc1N)Cl 7a_100000210500_100000757444 [2,0,0,0,0,0|1,0,0]=3 1377 B15R1.5821 CN(C)CCCOc1ccc(cc1N)F 7a_100000759472_100000757444 [2,0,0,0,0,0|1,1,0]=4 1378 B15R1.5821 CN(C)CCCOc1ccc(cc1N)I 7a_100000753495_100000757444 [2,0,0,0,0,0|1,1,0]=4 1379 B15R1.5821 CN(C)CCCOc1ccc(nc1Br)Cl 7a_100010219353_100000757444 [2,0,0,0,0,0|1,1,0]=4 1380 B15R1.5821 CN(C)CCCOc1ccc(nc1Cl)Br 7a_100010246206_100000757444 [2,0,0,0,0,0|1,1,0]=4 1381 B15R1.5821 CN(C)CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000757444 [2,0,0,0,0,0|1,0,0]=3 1382 B15R1.5821 CN(C)CCCOc1ccc(nc1Cl)I 7a_100000721234_100000757444 [2,0,0,0,0,0|1,1,0]=4 1383 B15R1.5821 CN(C)CCCOc1ccc(nc1F)Cl 7a_100009880201_100000757444 [2,0,0,0,0,0|1,1,0]=4 1384 B15R1.5821 CN(C)CCCOc1ccc(nc1I)Cl 7a_100000696390_100000757444 [2,0,0,0,0,0|1,1,0]=4 1385 B15R1.5821 CN(C)CCCOc1ccc(nc1N)Cl 7a_100000717809_100000757444 [2,0,0,0,0,0|2,0,0]=4 1386 B15R1.5821 CN(C)CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000757444 [2,0,0,0,0,0|1,0,0]=3 1387 B15R1.5821 CN(C)CCCOc1cnc(cc1I)Cl 7a_100000698892_100000757444 [2,0,0,0,0,0|1,1,0]=4 1388 B15R1.5821 CN(C)CCCOc1cnc(nc1Cl)Cl 7a_100010725077_100000757444 [2,0,0,0,0,0|2,0,0]=4 1389 B15R1.5821 CN(C)CCCSc1ccc(cc1Br)Cl 62a_100011219703_100000757444 [2,0,0,0,0,0|0,2,0]=4 1390 B15R1.5821 CN(C)CCCSc1ccc(cc1Cl)Br 62a_100011216062_100000757444 [2,0,0,0,0,0|0,2,0]=4 1391 B15R1.5821 CN(C)CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000757444 [2,0,0,0,0,0|0,1,0]=3 1392 B15R1.5821 CN(C)CCCSc1ccc(cc1Cl)F 62a_100000733362_100000757444 [2,0,0,0,0,0|0,2,0]=4 1393 B15R1.5821 CN(C)CCCSc1ccc(cc1Cl)N 62a_100000761885_100000757444 [2,0,0,0,0,0|1,1,0]=4 1394 B15R1.5821 CN(C)CCCSc1ccc(cc1Cl)O 62a_100000047559_100000757444 [2,0,0,0,0,0|1,1,0]=4 1395 B15R1.5821 CN(C)CCCSc1ccc(cc1F)Cl 62a_100011216042_100000757444 [2,0,0,0,0,0|0,2,0]=4 1396 B15R1.5821 CN(C)CCCSc1ccc(cc1N)Cl 62a_100000761886_100000757444 [2,0,0,0,0,0|1,1,0]=4 1397 B15R1.5821 CN(C)CCCSc1ccc(cc1O)Cl 62a_100000050036_100000757444 [2,0,0,0,0,0|1,1,0]=4 1398 B15R1.5821 CN(C)CCCSc1cnc(cc1Cl)Cl 62a_100010200927_100000757444 [2,0,0,0,0,0|1,1,0]=4 1399 B15R1.5821 CN(C)CCNCc1ccc(cc1Cl)Cl 207a_100000210585_100000188887 [2,0,0,0,0,0|2,0,0]=4 1400 B15R1.5821 CN(C)CCNCc1ccc(cc1Cl)Cl 270004a_100000210585_100000188887 [2,0,0,0,0,0|2,0,0]=4 1401 B15R1.5821 CN(C)CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000755713 [2,0,0,0,0,0|2,0,0]=4 1402 B15R1.5821 CN(C)CCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000755713 [2,0,0,0,0,0|2,0,0]=4 1403 B15R1.5821 Cc1cc(ccc1NCCCN(C)C)Cl 7a_100000210418_100000757444 [2,0,0,0,0,0|2,0,0]=4 1404 B15R1.5821 Cc1cc(ccc1OCCCC(C)C)Cl 34a_100000211091_100011214892 [2,0,0,0,0,0|2,0,0]=4 1405 B15R1.5821 Cc1cc(ccc1OCCCC(C)C)Cl 7a_100000211091_100011214892 [2,0,0,0,0,0|2,0,0]=4 1406 B15R1.5821 Cc1cc(ccc1OCCCN(C)C)Br 7a_100000186361_100000757444 [2,0,0,0,0,0|1,1,0]=4 1407 B15R1.5821 Cc1cc(ccc1OCCCN(C)C)Cl 7a_100000211091_100000757444 [2,0,0,0,0,0|1,0,0]=3 1408 B15R1.5821 Cc1cc(ccc1OCCCN(C)C)F 7a_100000764316_100000757444 [2,0,0,0,0,0|1,1,0]=4 1409 B15R1.5821 Cc1cc(ccc1OCCCN(C)C)I 7a_100011218673_100000757444 [2,0,0,0,0,0|1,1,0]=4 1410 B15R1.5821 Cc1cc(ccc1OCCCN(C)C)N 7a_100011218179_100000757444 [2,0,0,0,0,0|2,0,0]=4 1411 B15R1.5821 Cc1cc(ccc1SCCCN(C)C)Cl 62a_100011219607_100000757444 [2,0,0,0,0,0|1,1,0]=4 1412 B15R1.5821 Cc1cc(ncc1OCCCN(C)C)Cl 7a_100000692680_100000757444 [2,0,0,0,0,0|2,0,0]=4 1413 B15R1.5821 Cc1ccc(c(c1)Br)OCCCN(C)C 7a_100000210800_100000757444 [2,0,0,0,0,0|1,1,0]=4 1414 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)C 2230a_100015183116_200000210301 [2,0,0,0,0,0|2,0,0]=4 1415 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)C 269982a_100015183116_200000210301 [2,0,0,0,0,0|2,0,0]=4 1416 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)C 34a_100015183116_200000210301 [2,0,0,0,0,0|2,0,0]=4 1417 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)C 7a_100000211776_100000757444 [2,0,0,0,0,0|2,0,0]=4 1418 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)[13CH3] 2230a_100015183116_200025704644 [2,0,0,0,0,0|2,0,0]=4 1419 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)[13CH3] 269982a_100015183116_200025704644 [2,0,0,0,0,0|2,0,0]=4 1420 B15R1.5821 Cc1ccc(c(c1)C)OCCCN(C)[13CH3] 34a_100015183116_200025704644 [2,0,0,0,0,0|2,0,0]=4 1421 B15R1.5821 Cc1ccc(c(c1)Cl)OCCCC(C)C 34a_100000749699_100011214892 [2,0,0,0,0,0|2,0,0]=4 1422 B15R1.5821 Cc1ccc(c(c1)Cl)OCCCC(C)C 7a_100000749699_100011214892 [2,0,0,0,0,0|2,0,0]=4 1423 B15R1.5821 Cc1ccc(c(c1)Cl)OCCCN(C)C 7a_100000749699_100000757444 [2,0,0,0,0,0|1,0,0]=3 1424 B15R1.5821 Cc1ccc(c(c1)Cl)SCCCN(C)C 62a_100011263221_100000757444 [2,0,0,0,0,0|1,1,0]=4 1425 B15R1.5821 Cc1ccc(c(c1)F)OCCCN(C)C 7a_100011216688_100000757444 [2,0,0,0,0,0|1,1,0]=4 1426 B15R1.5821 Cc1ccc(c(c1)I)OCCCN(C)C 7a_100000765521_100000757444 [2,0,0,0,0,0|1,1,0]=4 1427 B15R1.5821 Cc1ccc(c(c1)N)OCCCN(C)C 7a_100011215204_100000757444 [2,0,0,0,0,0|2,0,0]=4 1428 B15R1.5821 Cc1ccc(c(n1)Cl)OCCCN(C)C 7a_100000086286_100000757444 [2,0,0,0,0,0|2,0,0]=4 1429 B15R1.5821 Cc1nc(ccc1OCCCN(C)C)Cl 7a_100012184626_100000757444 [2,0,0,0,0,0|2,0,0]=4 1430 B15R1.5821 [13CH3]C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200025704644 [2,0,0,0,0,0|2,0,0]=4 1431 B17R1.13 C#CCCC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_100000753159 [1,1,0,0,0,0|2,0,0]=4 1432 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000688953 [1,1,0,0,0,0|0,1,0]=3 1433 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000730999 [1,1,0,0,0,0|0,1,0]=3 1434 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100000688953 [1,1,0,0,0,0|0,1,0]=3 1435 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000688953 [1,1,0,0,0,0|1,0,0]=3 1436 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)C 269982a_100011252574_100000730999 [1,1,0,0,0,0|1,0,0]=3 1437 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100000688953 [1,1,0,0,0,0|1,0,0]=3 1438 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000688953 [1,1,0,0,0,0|0,0,0]=2 1439 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000730999 [1,1,0,0,0,0|0,0,0]=2 1440 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000688953 [1,1,0,0,0,0|0,0,0]=2 1441 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000688953 [1,1,0,0,0,0|0,1,0]=3 1442 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000730999 [1,1,0,0,0,0|0,1,0]=3 1443 B17R1.13 C#CCCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100000688953 [1,1,0,0,0,0|0,1,0]=3 1444 B17R1.13 C#CCCN(C)CCCSc1ccc(cc1)C 2230a_100015185772_100000688953 [1,1,0,0,0,0|1,1,0]=4 1445 B17R1.13 C#CCCN(C)CCCSc1ccc(cc1)C 269982a_100015185772_100000730999 [1,1,0,0,0,0|1,1,0]=4 1446 B17R1.13 C#CCNC(=O)CCCOc1ccc(cc1)Cl 11a_100000212058_100000741531 [1,1,0,0,0,0|2,0,0]=4 1447 B17R1.13 C#CCNC(=O)CCCOc1ccc(cc1)Cl 1626a_100000212058_100000741531 [1,1,0,0,0,0|2,0,0]=4 1448 B17R1.13 C#CCNC(=O)CCCOc1ccc(cc1)Cl 240690a_100000212058_100000741531 [1,1,0,0,0,0|2,0,0]=4 1449 B17R1.13 C#CCNC(=O)CCCOc1ccc(cc1)Cl 527a_100000212058_100000741531 [1,1,0,0,0,0|2,0,0]=4 1450 B17R1.13 C/C=C/CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100102629194 [1,1,0,0,0,0|0,0,2]=4 1451 B17R1.13 C/C=C/CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100102629194 [1,1,0,0,0,0|0,0,2]=4 1452 B17R1.13 C=CCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000754431 [1,1,0,0,0,0|0,0,2]=4 1453 B17R1.13 C=CCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000754431 [1,1,0,0,0,0|0,0,2]=4 1454 B17R1.13 C=CCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000754431 [1,1,0,0,0,0|0,0,2]=4 1455 B17R1.13 CC#CCC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_100000748600 [1,1,0,0,0,0|2,0,0]=4 1456 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000748600 [1,1,0,0,0,0|0,1,0]=3 1457 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)Br 34a_100102699777_100000748600 [1,1,0,0,0,0|0,1,0]=3 1458 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)C 2230a_100011252574_100000748600 [1,1,0,0,0,0|1,0,0]=3 1459 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)C 34a_100011252574_100000748600 [1,1,0,0,0,0|1,0,0]=3 1460 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000748600 [1,1,0,0,0,0|0,0,0]=2 1461 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000748600 [1,1,0,0,0,0|0,0,0]=2 1462 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000748600 [1,1,0,0,0,0|0,1,0]=3 1463 B17R1.13 CC#CCN(C)CCCOc1ccc(cc1)F 34a_100000225698_100000748600 [1,1,0,0,0,0|0,1,0]=3 1464 B17R1.13 CC#CCN(C)CCCSc1ccc(cc1)C 2230a_100015185772_100000748600 [1,1,0,0,0,0|1,1,0]=4 1465 B17R1.13 CC=CCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000070051 [1,1,0,0,0,0|0,0,2]=4 1466 B17R1.13 CC=CCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000070051 [1,1,0,0,0,0|0,0,2]=4 1467 B17R1.13 CCCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000210211 [1,1,0,0,0,0|0,0,2]=4 1468 B17R1.13 CCCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000210211 [1,1,0,0,0,0|0,0,2]=4 1469 B17R1.13 CCCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000210210 [1,1,0,0,0,0|0,0,2]=4 1470 B17R1.13 CCOCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000739092 [1,1,0,0,0,0|0,0,2]=4 1471 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)Br 2230a_100000184479_100011259224 [1,1,0,0,0,0|0,1,1]=4 1472 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)Br 2230a_100102699777_100011215226 [1,1,0,0,0,0|0,1,1]=4 1473 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)Br 269982a_100102699777_100011215226 [1,1,0,0,0,0|0,1,1]=4 1474 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011215226 [1,1,0,0,0,0|0,0,1]=3 1475 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011215226 [1,1,0,0,0,0|0,0,1]=3 1476 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)F 2230a_100000184479_100000181347 [1,1,0,0,0,0|0,1,1]=4 1477 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)F 2230a_100000225698_100011215226 [1,1,0,0,0,0|0,1,1]=4 1478 B17R1.13 CN(CCC#N)CCCOc1ccc(cc1)F 269982a_100000225698_100011215226 [1,1,0,0,0,0|0,1,1]=4 1479 B17R1.13 CN(CCCF)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011934791 [1,1,0,0,0,0|0,0,2]=4 1480 B17R1.13 CN(CCCF)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011934791 [1,1,0,0,0,0|0,0,2]=4 1481 B17R1.13 CN(CCCF)CCCOc1ccc(cc1)Cl 34a_100000225747_100011934791 [1,1,0,0,0,0|0,0,2]=4 1482 B17R1.13 CN(CCCO)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000230001 [1,1,0,0,0,0|0,0,2]=4 1483 B17R1.13 CN(CCCO)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011215043 [1,1,0,0,0,0|0,0,2]=4 1484 B17R1.13 CN(CCCO)CCCOc1ccc(cc1)Cl 34a_100000225747_100000230001 [1,1,0,0,0,0|0,0,2]=4 1485 B17R1.13 CN(CCCOc1ccc(cc1)Br)CSC#N 269982a_100102699777_100000211825 [1,1,0,0,0,0|1,1,0]=4 1486 B17R1.13 CN(CCCOc1ccc(cc1)Cl)CSC#N 269982a_100000225747_100000211825 [1,1,0,0,0,0|1,0,0]=3 1487 B17R1.13 CN(CCCOc1ccc(cc1)F)CSC#N 269982a_100000225698_100000211825 [1,1,0,0,0,0|1,1,0]=4 1488 B17R1.13 COCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011201679 [1,1,0,0,0,0|0,0,2]=4 1489 B17R1.13 COCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000233755 [1,1,0,0,0,0|0,0,2]=4 1490 B17R1.13 COCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100011201679 [1,1,0,0,0,0|0,0,2]=4 1491 B17R1.13 CSCCN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000751147 [1,1,0,0,0,0|0,0,2]=4 1492 B17R1.13 CSCCN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000212216 [1,1,0,0,0,0|0,0,2]=4 1493 B17R1.13 CSCCN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000212216 [1,1,0,0,0,0|0,0,2]=4 1494 B17R1.13 Cc1ccc(cc1)OCCCN(C)CCC#N 2230a_100011252574_100011215226 [1,1,0,0,0,0|1,0,1]=4 1495 B17R1.13 Cc1ccc(cc1)OCCCN(C)CCC#N 269982a_100011252574_100011215226 [1,1,0,0,0,0|1,0,1]=4 1496 B17R1.13 Cc1ccc(cc1)OCCCN(C)CSC#N 269982a_100011252574_100000211825 [1,1,0,0,0,0|2,0,0]=4 1497 B17R1.14 C#CCN(C)C(=O)CCCc1ccc(cc1)Cl 11a_100000225692_100000741339 [1,1,0,0,0,0|1,0,1]=4 1498 B17R1.14 C#CCN(C)C(=O)CCCc1ccc(cc1)Cl 1626a_100000225692_100000741339 [1,1,0,0,0,0|1,0,1]=4 1499 B17R1.14 C#CCN(C)C(=O)CCCc1ccc(cc1)Cl 527a_100000225692_100000741339 [1,1,0,0,0,0|1,0,1]=4 1500 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)C 11a_100000225692_100000182323 [1,1,0,0,0,0|1,0,1]=4 1501 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)C 1626a_100000225692_100000182323 [1,1,0,0,0,0|1,0,1]=4 1502 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)Cl 11a_100000225692_100000186438 [1,1,0,0,0,0|0,0,1]=3 1503 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)Cl 1626a_100000225692_100000186438 [1,1,0,0,0,0|0,0,1]=3 1504 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)F 11a_100000225692_100000737396 [1,1,0,0,0,0|0,1,1]=4 1505 B17R1.14 C#CCN(C)C(=O)CCOc1ccc(cc1)F 1626a_100000225692_100000737396 [1,1,0,0,0,0|0,1,1]=4 1506 B17R1.14 C#CCN(C)C(=O)CCSc1ccc(cc1)Cl 11a_100000225692_100000182369 [1,1,0,0,0,0|0,1,1]=4 1507 B17R1.14 C#CCN(C)C(=O)CCSc1ccc(cc1)Cl 1626a_100000225692_100000182369 [1,1,0,0,0,0|0,1,1]=4 1508 B17R1.14 C#CCN(C)C(=O)CCSc1ccc(cc1)Cl 527a_100000225692_100000182369 [1,1,0,0,0,0|0,1,1]=4 1509 B17R1.14 C#CCN(C)C(C)CCSc1ccc(cc1)F 270004a_100000225692_100000208766 [1,1,0,0,0,0|0,2,0]=4 1510 B17R1.14 CN(CC#N)C(=O)CCOc1ccc(cc1)Cl 11a_100000748184_100000186438 [1,1,0,0,0,0|1,0,1]=4 1511 B17R1.14 CN(CC#N)C(=O)CCOc1ccc(cc1)Cl 1626a_100000748184_100000186438 [1,1,0,0,0,0|1,0,1]=4 1512 B17R1.27 C#CCC(CC)OCCOc1ccc(cc1)Cl 34a_200011217983_100000184122 [1,1,0,0,0,0|2,0,0]=4 1513 B17R1.27 C#CCC(CC)OCCOc1ccc(cc1)Cl 7a_200011217983_100000184122 [1,1,0,0,0,0|2,0,0]=4 1514 B17R1.27 C#CCN(CC)CCCCc1ccc(cc1)Br 2230a_100000744766_200012094861 [1,1,0,0,0,0|1,1,0]=4 1515 B17R1.27 C#CCN(CC)CCCCc1ccc(cc1)Br 269982a_100000744766_200012094861 [1,1,0,0,0,0|1,1,0]=4 1516 B17R1.27 C#CCN(CC)CCCCc1ccc(cc1)F 2230a_100000744766_100012093538 [1,1,0,0,0,0|1,1,0]=4 1517 B17R1.27 C#CCN(CC)CCCCc1ccc(cc1)F 269982a_100000744766_100012093538 [1,1,0,0,0,0|1,1,0]=4 1518 B17R1.27 C#CCN(CC)CCCOc1ccc(cc1)Br 2230a_100000744766_100011259224 [1,1,0,0,0,0|0,1,0]=3 1519 B17R1.27 C#CCN(CC)CCCOc1ccc(cc1)Br 269982a_100000744766_100011259224 [1,1,0,0,0,0|0,1,0]=3 1520 B17R1.27 C#CCN(CC)CCCOc1ccc(cc1)F 2230a_100000744766_100000181347 [1,1,0,0,0,0|0,1,0]=3 1521 B17R1.27 C#CCN(CC)CCCOc1ccc(cc1)F 269982a_100000744766_100000181347 [1,1,0,0,0,0|0,1,0]=3 1522 B17R1.50 C#CC(C)C(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_200000035995 [1,1,0,0,0,0|2,0,0]=4 1523 B17R1.50 C#CC(C)N(C)CCCOc1ccc(cc1)Br 34a_100102699777_200000035995 [1,1,0,0,0,0|0,1,0]=3 1524 B17R1.50 C#CC(C)N(C)CCCOc1ccc(cc1)C 34a_100011252574_200000035995 [1,1,0,0,0,0|1,0,0]=3 1525 B17R1.50 C#CC(C)N(C)CCCOc1ccc(cc1)Cl 34a_100000225747_200000035995 [1,1,0,0,0,0|0,0,0]=2 1526 B17R1.50 C#CC(C)N(C)CCCOc1ccc(cc1)F 34a_100000225698_200000035995 [1,1,0,0,0,0|0,1,0]=3 1527 B17R1.50 C=CC(C)N(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011215867 [1,1,0,0,0,0|0,0,2]=4 1528 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)Br 2230a_100102699777_100000184139 [1,1,0,0,0,0|1,1,0]=4 1529 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)Br 269982a_100102699777_100000703298 [1,1,0,0,0,0|1,1,0]=4 1530 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000184139 [1,1,0,0,0,0|1,0,0]=3 1531 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000703298 [1,1,0,0,0,0|1,0,0]=3 1532 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)F 2230a_100000225698_100000184139 [1,1,0,0,0,0|1,1,0]=4 1533 B17R1.50 CC(C#N)N(C)CCCOc1ccc(cc1)F 269982a_100000225698_100000703298 [1,1,0,0,0,0|1,1,0]=4 1534 B17R1.50 CC(CO)N(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100012180447 [1,1,0,0,0,0|1,0,1]=4 1535 B17R1.50 CC(CO)N(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100012180447 [1,1,0,0,0,0|1,0,1]=4 1536 B17R1.50 CCC(C)N(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000758301 [1,1,0,0,0,0|0,0,2]=4 1537 B17R1.50 CCC(C)N(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000758301 [1,1,0,0,0,0|0,0,2]=4 1538 B17R1.50 CCC(C)N(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100011215416 [1,1,0,0,0,0|0,0,2]=4 1539 B17R1.50 COC(C)N(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100009879195 [1,1,0,0,0,0|1,0,1]=4 1540 B17R1.50 C[C@H](CO)N(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100016084084 [1,1,0,0,0,0|1,0,1]=4 1541 B17R1.50 Cc1ccc(cc1)OCCCN(C)C(C)C#N 2230a_100011252574_100000184139 [1,1,0,0,0,0|2,0,0]=4 1542 B17R1.50 Cc1ccc(cc1)OCCCN(C)C(C)C#N 269982a_100011252574_100000703298 [1,1,0,0,0,0|2,0,0]=4 1543 B17R1.968 C#CCN(C)CCCC(=O)c1ccc(cc1)Br 2230a_100000225692_100000211046 [1,1,0,0,0,0|1,1,0]=4 1544 B17R1.968 C#CCN(C)CCCC(=O)c1ccc(cc1)Br 34a_100000225692_100000211046 [1,1,0,0,0,0|1,1,0]=4 1545 B17R1.968 C#CCN(C)CCCC(=O)c1ccc(cc1)F 2230a_100000225692_100000211961 [1,1,0,0,0,0|1,1,0]=4 1546 B17R1.968 C#CCN(C)CCCC(=O)c1ccc(cc1)O 2230a_100000225692_100000039620 [1,1,0,0,0,0|2,0,0]=4 1547 B17R1.973 C#CCN(C)CCC(=O)Nc1ccc(cc1)Cl 2230a_100000225692_100000188356 [1,1,0,0,0,0|1,0,1]=4 1548 B17R1.1112 C=C(C)CN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000748629 [1,1,0,0,0,0|0,0,2]=4 1549 B17R1.1112 C=C(C)CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000748629 [1,1,0,0,0,0|0,0,2]=4 1550 B17R1.1112 C=C(C)CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000748629 [1,1,0,0,0,0|0,0,2]=4 1551 B17R1.1112 C=C(F)CN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100009893438 [1,1,0,0,0,0|0,0,2]=4 1552 B17R1.1112 C=C(F)CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100009893438 [1,1,0,0,0,0|0,0,2]=4 1553 B17R1.1112 C=C(F)CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100009893438 [1,1,0,0,0,0|0,0,2]=4 1554 B17R1.1112 CC(C)CN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100000210760 [1,1,0,0,0,0|0,0,2]=4 1555 B17R1.1112 CC(C)CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100000210624 [1,1,0,0,0,0|0,0,2]=4 1556 B17R1.1112 CC(C)CN(C)CCCOc1ccc(cc1)Cl 270004a_100000225747_100000210432 [1,1,0,0,0,0|0,0,2]=4 1557 B17R1.1112 CC(C)CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100000210624 [1,1,0,0,0,0|0,0,2]=4 1558 B17R1.1112 CC(O)CN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100011218427 [1,1,0,0,0,0|0,0,2]=4 1559 B17R1.1112 CC(O)CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100011218427 [1,1,0,0,0,0|0,0,2]=4 1560 B17R1.1112 CC(O)CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100011218427 [1,1,0,0,0,0|0,0,2]=4 1561 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(=O)N 2230a_100000225747_100000747473 [1,1,0,0,0,0|1,0,1]=4 1562 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(=O)N 269982a_100000225747_100000187820 [1,1,0,0,0,0|1,0,1]=4 1563 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(=O)N 34a_100000225747_100000187820 [1,1,0,0,0,0|1,0,1]=4 1564 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(=O)[O-] 269982a_100000225747_100020667443 [1,1,0,0,0,0|1,0,1]=4 1565 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(=O)[O-] 34a_100000225747_100020667443 [1,1,0,0,0,0|1,0,1]=4 1566 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(F)F 2230a_100000225747_100011934356 [1,1,0,0,0,0|1,0,1]=4 1567 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(F)F 269982a_100000225747_100011934356 [1,1,0,0,0,0|1,0,1]=4 1568 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)CC(F)F 34a_100000225747_100011934356 [1,1,0,0,0,0|1,0,1]=4 1569 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)C[N+](=O)[O-] 269982a_100000225747_100000761209 [1,1,0,0,0,0|2,0,0]=4 1570 B17R1.1112 CN(CCCOc1ccc(cc1)Cl)C[N+](=O)[O-] 34a_100000225747_100000761209 [1,1,0,0,0,0|2,0,0]=4 1571 B17R1.1112 C[C@@H](O)CN(C)CCCOc1ccc(cc1)Cl 2230a_100000225747_100009817552 [1,1,0,0,0,0|0,0,2]=4 1572 B17R1.1112 C[C@@H](O)CN(C)CCCOc1ccc(cc1)Cl 269982a_100000225747_100009817552 [1,1,0,0,0,0|0,0,2]=4 1573 B17R1.1112 C[C@@H](O)CN(C)CCCOc1ccc(cc1)Cl 34a_100000225747_100009817552 [1,1,0,0,0,0|0,0,2]=4 1574 B17R1.1608 C#CCN(C)CCCCc1ccc(cc1)OC 2230a_100000225692_100012285823 [1,1,0,0,0,0|2,0,0]=4 1575 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)C#N 2230a_100000225692_200000738573 [1,1,0,0,0,0|1,0,0]=3 1576 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)C#N 34a_100000225692_200000738573 [1,1,0,0,0,0|1,0,0]=3 1577 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)CC 2230a_100015186272_100000038162 [1,1,0,0,0,0|1,0,0]=3 1578 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)CC 34a_100015186272_100000184674 [1,1,0,0,0,0|1,0,0]=3 1579 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)OC 2230a_100000225692_100000212274 [1,1,0,0,0,0|1,0,0]=3 1580 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)OC 2230a_100000225731_100000038162 [1,1,0,0,0,0|1,0,0]=3 1581 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)OC 34a_100000225692_100000212274 [1,1,0,0,0,0|1,0,0]=3 1582 B17R1.1608 C#CCN(C)CCCOc1ccc(cc1)OC 34a_100000225731_100000184674 [1,1,0,0,0,0|1,0,0]=3 1583 B17R1.1608 CCc1ccc(cc1)OCCCN(C)CC#N 2230a_100015186272_100011215382 [1,1,0,0,0,0|2,0,0]=4 1584 B17R1.1608 CCc1ccc(cc1)OCCCN(C)CC#N 269982a_100015186272_100011214920 [1,1,0,0,0,0|2,0,0]=4 1585 B17R1.1608 CN(CC#N)CCCOc1ccc(cc1)C#N 2230a_100000748184_200000738573 [1,1,0,0,0,0|2,0,0]=4 1586 B17R1.1608 COc1ccc(cc1)OCCCN(C)CC#N 2230a_100000225731_100011215382 [1,1,0,0,0,0|2,0,0]=4 1587 B17R1.1608 COc1ccc(cc1)OCCCN(C)CC#N 2230a_100000748184_100000212274 [1,1,0,0,0,0|2,0,0]=4 1588 B17R1.1608 COc1ccc(cc1)OCCCN(C)CC#N 269982a_100000225731_100011214920 [1,1,0,0,0,0|2,0,0]=4 1589 B17R1.30816 C#CCC(=O)CCCOc1ccc(c(c1)C)Cl 1458a_100000182829_100000184674 [1,1,0,0,0,0|2,0,0]=4 1590 B17R1.30816 C#CCN(C)CCCOc1ccc(c(c1)C)C 2230a_100000225692_100000737685 [1,1,0,0,0,0|1,0,0]=3 1591 B17R1.30816 C#CCN(C)CCCOc1ccc(c(c1)C)C 2230a_100011236293_100000038162 [1,1,0,0,0,0|1,0,0]=3 1592 B17R1.30816 C#CCN(C)CCCOc1ccc(c(c1)C)C 34a_100000225692_100000737685 [1,1,0,0,0,0|1,0,0]=3 1593 B17R1.30816 C#CCN(C)CCCOc1ccc(c(c1)C)C 34a_100011236293_100000184674 [1,1,0,0,0,0|1,0,0]=3 1594 B17R1.30816 Cc1ccc(cc1C)OCCCN(C)CC#N 2230a_100000748184_100000737685 [1,1,0,0,0,0|2,0,0]=4 1595 B17R1.30816 Cc1ccc(cc1C)OCCCN(C)CC#N 2230a_100011236293_100011215382 [1,1,0,0,0,0|2,0,0]=4 1596 B17R1.30816 Cc1ccc(cc1C)OCCCN(C)CC#N 269982a_100011236293_100011214920 [1,1,0,0,0,0|2,0,0]=4 1597 B17R1.298 C#CCCCCCOc1ccc(cc1C#N)Cl 34a_100011219380_100012094781 [1,1,0,0,0,0|2,0,0]=4 1598 B17R1.298 C#CCCCCCOc1ccc(cc1C#N)Cl 7a_100011219380_100012094781 [1,1,0,0,0,0|2,0,0]=4 1599 B17R1.298 C#CCCCCCOc1ccc(cc1CN)Cl 34a_100000238540_100012094781 [1,1,0,0,0,0|2,0,0]=4 1600 B17R1.298 C#CCCCCCOc1ccc(cc1CO)Cl 34a_100011218961_100012094781 [1,1,0,0,0,0|2,0,0]=4 1601 B17R1.298 C#CCCCCCOc1ccc(cc1CO)Cl 7a_100011218961_100012094781 [1,1,0,0,0,0|2,0,0]=4 1602 B17R1.298 C#CCCCCCOc1ccc(cc1OC)Cl 34a_100000033002_100012094781 [1,1,0,0,0,0|2,0,0]=4 1603 B17R1.300 C#CCCCCCOc1ccc(cc1Cl)C#N 34a_100000205955_100012094781 [1,1,0,0,0,0|2,0,0]=4 1604 B17R1.300 C#CCCCCCOc1ccc(cc1Cl)C#N 7a_100000205955_100012094781 [1,1,0,0,0,0|2,0,0]=4 1605 B17R1.300 C#CCCCCCOc1ccc(cc1Cl)OC 34a_100000038596_100012094781 [1,1,0,0,0,0|2,0,0]=4 1606 B17R1.300 C#CCCCCCOc1ccc(cc1Cl)OC 7a_100000038596_100012094781 [1,1,0,0,0,0|2,0,0]=4 1607 B17R1.1869 C#CCCCC(=O)COc1ccc(cc1Cl)Cl 1458a_100102647096_100000731252 [1,1,0,0,0,0|1,0,1]=4 1608 B17R1.1869 C#CCNCC(O)COc1ccc(cc1C)C 2230a_100015185969_100000038162 [1,1,0,0,0,0|2,0,0]=4 1609 B17R1.1869 C#CCNCC(O)COc1ccc(cc1C)C 34a_100015185969_100000184674 [1,1,0,0,0,0|2,0,0]=4 1610 B17R1.3014 C#CC(C)NCCSCc1ccc(cc1Cl)Cl 34a_100000696970_200000035995 [1,1,0,0,0,0|2,0,0]=4 1611 B17R1.4148 C#CCCCCCCNc1ccc(cc1Cl)Cl 34a_100000185861_100012276617 [1,1,0,0,0,0|2,0,0]=4 1612 B17R1.4148 C#CCCCCCCOc1ccc(cc1C)Cl 34a_100000211091_100012276617 [1,1,0,0,0,0|2,0,0]=4 1613 B17R1.4148 C#CCCCCCCOc1ccc(cc1C)Cl 7a_100000211091_100012276617 [1,1,0,0,0,0|2,0,0]=4 1614 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)C 34a_100000749699_100012276617 [1,1,0,0,0,0|2,0,0]=4 1615 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)C 7a_100000749699_100012276617 [1,1,0,0,0,0|2,0,0]=4 1616 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)Cl 34a_100015191787_100012276617 [1,1,0,0,0,0|1,0,0]=3 1617 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100012276617 [1,1,0,0,0,0|1,0,0]=3 1618 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)F 34a_100000212004_100012276617 [1,1,0,0,0,0|1,1,0]=4 1619 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)F 7a_100000212004_100012276617 [1,1,0,0,0,0|1,1,0]=4 1620 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)I 34a_100012360047_100012276617 [1,1,0,0,0,0|1,1,0]=4 1621 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)I 7a_100012360047_100012276617 [1,1,0,0,0,0|1,1,0]=4 1622 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)N 34a_100000744943_100012276617 [1,1,0,0,0,0|2,0,0]=4 1623 B17R1.4148 C#CCCCCCCOc1ccc(cc1Cl)N 7a_100000744943_100012276617 [1,1,0,0,0,0|2,0,0]=4 1624 B17R1.4148 C#CCCCCCCOc1ccc(cc1F)Cl 34a_100000230166_100012276617 [1,1,0,0,0,0|1,1,0]=4 1625 B17R1.4148 C#CCCCCCCOc1ccc(cc1F)Cl 7a_100000230166_100012276617 [1,1,0,0,0,0|1,1,0]=4 1626 B17R1.4148 C#CCCCCCCOc1ccc(cc1I)Cl 34a_100011356953_100012276617 [1,1,0,0,0,0|1,1,0]=4 1627 B17R1.4148 C#CCCCCCCOc1ccc(cc1I)Cl 7a_100011356953_100012276617 [1,1,0,0,0,0|1,1,0]=4 1628 B17R1.4148 C#CCCCCCCOc1ccc(cc1N)Cl 34a_100000210500_100012276617 [1,1,0,0,0,0|2,0,0]=4 1629 B17R1.4148 C#CCCCCCCOc1ccc(cc1N)Cl 7a_100000210500_100012276617 [1,1,0,0,0,0|2,0,0]=4 1630 B17R1.4148 C#CCCCCCCOc1ccc(nc1Cl)Cl 34a_100000101165_100012276617 [1,1,0,0,0,0|2,0,0]=4 1631 B17R1.4148 C#CCCCCCCOc1ccc(nc1Cl)Cl 7a_100000101165_100012276617 [1,1,0,0,0,0|2,0,0]=4 1632 B17R1.4148 C#CCCCCCCOc1cnc(cc1Cl)Cl 34a_100009868576_100012276617 [1,1,0,0,0,0|2,0,0]=4 1633 B17R1.4148 C#CCCCCCCOc1cnc(cc1Cl)Cl 7a_100009868576_100012276617 [1,1,0,0,0,0|2,0,0]=4 1634 B17R1.4148 C#CCCCCCNCc1ccc(cc1Cl)Cl 34a_100000174880_100012094781 [1,1,0,0,0,0|2,0,0]=4 1635 B17R1.4148 C#CCCCCCOCc1ccc(cc1Br)Cl 34a_100000707881_100012094781 [1,1,0,0,0,0|1,1,0]=4 1636 B17R1.4148 C#CCCCCCOCc1ccc(cc1Br)Cl 34a_100000766912_100000755608 [1,1,0,0,0,0|1,1,0]=4 1637 B17R1.4148 C#CCCCCCOCc1ccc(cc1Br)Cl 7a_100000707881_100012094781 [1,1,0,0,0,0|1,1,0]=4 1638 B17R1.4148 C#CCCCCCOCc1ccc(cc1Br)Cl 7a_100000766912_100000755608 [1,1,0,0,0,0|1,1,0]=4 1639 B17R1.4148 C#CCCCCCOCc1ccc(cc1C)Cl 34a_100000702939_100012094781 [1,1,0,0,0,0|2,0,0]=4 1640 B17R1.4148 C#CCCCCCOCc1ccc(cc1C)Cl 34a_100000766912_100012361307 [1,1,0,0,0,0|2,0,0]=4 1641 B17R1.4148 C#CCCCCCOCc1ccc(cc1C)Cl 7a_100000702939_100012094781 [1,1,0,0,0,0|2,0,0]=4 1642 B17R1.4148 C#CCCCCCOCc1ccc(cc1C)Cl 7a_100000766912_100012361307 [1,1,0,0,0,0|2,0,0]=4 1643 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Br 34a_100000756401_100012094781 [1,1,0,0,0,0|1,1,0]=4 1644 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Br 34a_100000766912_100011740631 [1,1,0,0,0,0|1,1,0]=4 1645 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Br 7a_100000756401_100012094781 [1,1,0,0,0,0|1,1,0]=4 1646 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Br 7a_100000766912_100011740631 [1,1,0,0,0,0|1,1,0]=4 1647 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)C 34a_100000720314_100012094781 [1,1,0,0,0,0|2,0,0]=4 1648 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)C 34a_100000766912_100012349684 [1,1,0,0,0,0|2,0,0]=4 1649 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)C 7a_100000720314_100012094781 [1,1,0,0,0,0|2,0,0]=4 1650 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)C 7a_100000766912_100012349684 [1,1,0,0,0,0|2,0,0]=4 1651 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Cl 34a_100000215721_100012094781 [1,1,0,0,0,0|1,0,0]=3 1652 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Cl 34a_100000766912_100000188473 [1,1,0,0,0,0|1,0,0]=3 1653 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100012094781 [1,1,0,0,0,0|1,0,0]=3 1654 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)Cl 7a_100000766912_100000188473 [1,1,0,0,0,0|1,0,0]=3 1655 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)F 34a_100000766912_100011216360 [1,1,0,0,0,0|1,1,0]=4 1656 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)F 34a_100011219954_100012094781 [1,1,0,0,0,0|1,1,0]=4 1657 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)F 7a_100000766912_100011216360 [1,1,0,0,0,0|1,1,0]=4 1658 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)F 7a_100011219954_100012094781 [1,1,0,0,0,0|1,1,0]=4 1659 B17R1.4148 C#CCCCCCOCc1ccc(cc1Cl)N 34a_100000689119_100012094781 [1,1,0,0,0,0|2,0,0]=4 1660 B17R1.4148 C#CCCCCCOCc1ccc(cc1F)Cl 34a_100000766912_100000709361 [1,1,0,0,0,0|1,1,0]=4 1661 B17R1.4148 C#CCCCCCOCc1ccc(cc1F)Cl 34a_100011217562_100012094781 [1,1,0,0,0,0|1,1,0]=4 1662 B17R1.4148 C#CCCCCCOCc1ccc(cc1F)Cl 7a_100000766912_100000709361 [1,1,0,0,0,0|1,1,0]=4 1663 B17R1.4148 C#CCCCCCOCc1ccc(cc1F)Cl 7a_100011217562_100012094781 [1,1,0,0,0,0|1,1,0]=4 1664 B17R1.4148 C#CCCCCCOCc1ccc(cc1I)Cl 34a_100000722340_100012094781 [1,1,0,0,0,0|1,1,0]=4 1665 B17R1.4148 C#CCCCCCOCc1ccc(cc1I)Cl 34a_100000766912_100010254388 [1,1,0,0,0,0|1,1,0]=4 1666 B17R1.4148 C#CCCCCCOCc1ccc(cc1I)Cl 7a_100000722340_100012094781 [1,1,0,0,0,0|1,1,0]=4 1667 B17R1.4148 C#CCCCCCOCc1ccc(cc1I)Cl 7a_100000766912_100010254388 [1,1,0,0,0,0|1,1,0]=4 1668 B17R1.4148 C#CCCCCCOCc1ccc(cc1N)Cl 34a_100000238622_100012094781 [1,1,0,0,0,0|2,0,0]=4 1669 B17R1.4148 C#CCCCCCOCc1ccc(cc1N)Cl 7a_100000238622_100012094781 [1,1,0,0,0,0|2,0,0]=4 1670 B17R1.4148 C#CCCCCCOCc1ccc(nc1Cl)Cl 34a_100000720492_100012094781 [1,1,0,0,0,0|2,0,0]=4 1671 B17R1.4148 C#CCCCCCOCc1ccc(nc1Cl)Cl 34a_100000766912_100000722033 [1,1,0,0,0,0|2,0,0]=4 1672 B17R1.4148 C#CCCCCCOCc1ccc(nc1Cl)Cl 7a_100000720492_100012094781 [1,1,0,0,0,0|2,0,0]=4 1673 B17R1.4148 C#CCCCCCOCc1ccc(nc1Cl)Cl 7a_100000766912_100000722033 [1,1,0,0,0,0|2,0,0]=4 1674 B17R1.4148 C#CCCCCCOCc1cnc(cc1Cl)Cl 34a_100000702863_100012094781 [1,1,0,0,0,0|2,0,0]=4 1675 B17R1.4148 C#CCCCCCOCc1cnc(cc1Cl)Cl 34a_100000766912_100011997056 [1,1,0,0,0,0|2,0,0]=4 1676 B17R1.4148 C#CCCCCCOCc1cnc(cc1Cl)Cl 7a_100000702863_100012094781 [1,1,0,0,0,0|2,0,0]=4 1677 B17R1.4148 C#CCCCCCOCc1cnc(cc1Cl)Cl 7a_100000766912_100011997056 [1,1,0,0,0,0|2,0,0]=4 1678 B17R1.4148 C#CCCCCCOCc1ncc(cc1Cl)Cl 34a_100103146734_100012094781 [1,1,0,0,0,0|2,0,0]=4 1679 B17R1.4148 C#CCCCCCOCc1ncc(cc1Cl)Cl 7a_100103146734_100012094781 [1,1,0,0,0,0|2,0,0]=4 1680 B17R1.4148 C#CCCCCNCCc1ccc(cc1Cl)Cl 2230a_100000210994_100010269958 [1,1,0,0,0,0|2,0,0]=4 1681 B17R1.4148 C#CCCCCNCCc1ccc(cc1Cl)Cl 2230a_100000706060_200012161198 [1,1,0,0,0,0|2,0,0]=4 1682 B17R1.4148 C#CCCCCNCCc1ccc(cc1Cl)Cl 34a_100000210994_100010269958 [1,1,0,0,0,0|2,0,0]=4 1683 B17R1.4148 C#CCCCCNCCc1ccc(cc1Cl)Cl 34a_100000706060_200012161198 [1,1,0,0,0,0|2,0,0]=4 1684 B17R1.4148 C#CCCCCOCCc1ccc(cc1Cl)Cl 34a_100000766709_200012161198 [1,1,0,0,0,0|2,0,0]=4 1685 B17R1.4148 C#CCCCCOCCc1ccc(cc1Cl)Cl 34a_100011215701_100010269958 [1,1,0,0,0,0|2,0,0]=4 1686 B17R1.4148 C#CCCCCOCCc1ccc(cc1Cl)Cl 7a_100000766709_200012161198 [1,1,0,0,0,0|2,0,0]=4 1687 B17R1.4148 C#CCCCCOCCc1ccc(cc1Cl)Cl 7a_100011215701_100010269958 [1,1,0,0,0,0|2,0,0]=4 1688 B17R1.4148 C#CCCCNCCCc1ccc(cc1Cl)Cl 270004a_100000718082_100000765304 [1,1,0,0,0,0|2,0,0]=4 1689 B17R1.4148 C#CCCCNCCOc1ccc(cc1Br)Cl 34a_100000718082_100000199037 [1,1,0,0,0,0|1,1,0]=4 1690 B17R1.4148 C#CCCCNCCOc1ccc(cc1C)Cl 2230a_100025744827_100000731252 [1,1,0,0,0,0|2,0,0]=4 1691 B17R1.4148 C#CCCCNCCOc1ccc(cc1C)Cl 34a_100025744827_100000695029 [1,1,0,0,0,0|2,0,0]=4 1692 B17R1.4148 C#CCCCNCCOc1ccc(cc1Cl)Cl 34a_100000718082_100000184432 [1,1,0,0,0,0|1,0,0]=3 1693 B17R1.4148 C#CCCCNCCOc1ccc(cc1Cl)F 2230a_100020586385_100000731252 [1,1,0,0,0,0|1,1,0]=4 1694 B17R1.4148 C#CCCCNCCOc1ccc(cc1Cl)F 34a_100020586385_100000695029 [1,1,0,0,0,0|1,1,0]=4 1695 B17R1.4148 C#CCCCOCCCc1ccc(cc1Cl)Cl 34a_200011713141_100000695029 [1,1,0,0,0,0|2,0,0]=4 1696 B17R1.4148 C#CCCCOCCCc1ccc(cc1Cl)Cl 7a_200011713141_100011215417 [1,1,0,0,0,0|2,0,0]=4 1697 B17R1.4148 C#CCCCOCCOc1ccc(cc1Br)Cl 34a_100000193638_100000695029 [1,1,0,0,0,0|1,1,0]=4 1698 B17R1.4148 C#CCCCOCCOc1ccc(cc1Br)Cl 34a_100000215630_100000199037 [1,1,0,0,0,0|1,1,0]=4 1699 B17R1.4148 C#CCCCOCCOc1ccc(cc1Br)Cl 7a_100000193638_100011215417 [1,1,0,0,0,0|1,1,0]=4 1700 B17R1.4148 C#CCCCOCCOc1ccc(cc1Br)Cl 7a_100000215630_100000199037 [1,1,0,0,0,0|1,1,0]=4 1701 B17R1.4148 C#CCCCOCCOc1ccc(cc1Cl)Cl 34a_100000215630_100000184432 [1,1,0,0,0,0|1,0,0]=3 1702 B17R1.4148 C#CCCCOCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000695029 [1,1,0,0,0,0|1,0,0]=3 1703 B17R1.4148 C#CCCCOCCOc1ccc(cc1Cl)Cl 7a_100000215630_100000184432 [1,1,0,0,0,0|1,0,0]=3 1704 B17R1.4148 C#CCCCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100011215417 [1,1,0,0,0,0|1,0,0]=3 1705 B17R1.4148 C#CCCCOCCSc1ccc(cc1Cl)Cl 34a_200010001942_100000695029 [1,1,0,0,0,0|1,1,0]=4 1706 B17R1.4148 C#CCCCOCCSc1ccc(cc1Cl)Cl 7a_200010001942_100011215417 [1,1,0,0,0,0|1,1,0]=4 1707 B17R1.4148 C#CCCCSCCOc1ccc(cc1Br)Cl 62a_100000199037_100011215417 [1,1,0,0,0,0|1,1,0]=4 1708 B17R1.4148 C#CCCCSCCOc1ccc(cc1Br)Cl 62a_100011215417_100000199037 [1,1,0,0,0,0|1,1,0]=4 1709 B17R1.4148 C#CCCCSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100011215417 [1,1,0,0,0,0|1,0,0]=3 1710 B17R1.4148 C#CCCCSCCOc1ccc(cc1Cl)Cl 62a_100011215417_100000184432 [1,1,0,0,0,0|1,0,0]=3 1711 B17R1.4148 C#CCCNCCSCc1ccc(cc1Cl)Cl 2230a_100000696970_100000688953 [1,1,0,0,0,0|2,0,0]=4 1712 B17R1.4148 C#CCCNCCSCc1ccc(cc1Cl)Cl 34a_100000696970_100000688953 [1,1,0,0,0,0|2,0,0]=4 1713 B17R1.4148 C#CCCNCCSCc1ccc(cc1Cl)Cl 7a_100000696970_100000688953 [1,1,0,0,0,0|2,0,0]=4 1714 B17R1.4148 C#CCOCCNCCc1ccc(cc1Cl)Cl 2230a_100000210994_100010402529 [1,1,0,0,0,0|2,0,0]=4 1715 B17R1.4148 C#CCOCCNCCc1ccc(cc1Cl)Cl 2230a_100000700922_200012161198 [1,1,0,0,0,0|2,0,0]=4 1716 B17R1.4148 C#CCOCCNCCc1ccc(cc1Cl)Cl 34a_100000210994_100010402529 [1,1,0,0,0,0|2,0,0]=4 1717 B17R1.4148 C#CCOCCNCCc1ccc(cc1Cl)Cl 34a_100000700922_200012161198 [1,1,0,0,0,0|2,0,0]=4 1718 B17R1.4148 C#CCOCCOCCc1ccc(cc1Cl)Cl 34a_100000054580_200012161198 [1,1,0,0,0,0|2,0,0]=4 1719 B17R1.4148 C#CCOCCOCCc1ccc(cc1Cl)Cl 34a_100011215701_100010402529 [1,1,0,0,0,0|2,0,0]=4 1720 B17R1.4148 C#CCOCCOCCc1ccc(cc1Cl)Cl 7a_100000054580_200012161198 [1,1,0,0,0,0|2,0,0]=4 1721 B17R1.4148 C#CCOCCOCCc1ccc(cc1Cl)Cl 7a_100011215701_100010402529 [1,1,0,0,0,0|2,0,0]=4 1722 B17R1.4148 C#CCOCCSCCc1ccc(cc1Cl)Cl 62a_100010402529_200012161198 [1,1,0,0,0,0|2,0,0]=4 1723 B17R1.4148 C#CCOCCSCCc1ccc(cc1Cl)Cl 62a_200012161198_100010402529 [1,1,0,0,0,0|2,0,0]=4 1724 B17R1.4148 CC#CCCOCCOc1ccc(cc1Cl)Cl 34a_100000750427_100000184432 [1,1,0,0,0,0|2,0,0]=4 1725 B17R1.4148 CC#CCNCCSCc1ccc(cc1Cl)Cl 2230a_100000696970_100000748600 [1,1,0,0,0,0|2,0,0]=4 1726 B17R1.4148 CC#CCNCCSCc1ccc(cc1Cl)Cl 34a_100000696970_100000748600 [1,1,0,0,0,0|2,0,0]=4 1727 B17R1.4148 CC#CCNCCSCc1ccc(cc1Cl)Cl 7a_100000696970_100000748600 [1,1,0,0,0,0|2,0,0]=4 1728 B17R1.4148 N#CCCCCCCOc1ccc(cc1Cl)Cl 7a_100015191787_100009813337 [1,1,0,0,0,0|1,0,1]=4 1729 B17R1.4148 N#CCCCCCOCc1ccc(cc1Cl)Cl 7a_100000215721_100009813376 [1,1,0,0,0,0|2,0,0]=4 1730 B17R1.4148 N#CCCCOCCOc1ccc(cc1Cl)Cl 7a_200000205304_100000687738 [1,1,0,0,0,0|2,0,0]=4 1731 B17R1.4148 N#CCCCSCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000687738 [1,1,0,0,0,0|2,0,0]=4 1732 B17R1.4148 N#CCCCSCCOc1ccc(cc1Cl)Cl 62a_100000687738_100000184432 [1,1,0,0,0,0|2,0,0]=4 1733 B17R1.4909 C#CCCC(=O)CCOc1ccc(cc1Cl)Cl 1458a_100000692101_100000184432 [1,1,0,0,0,0|1,0,1]=4 1734 B17R1.4909 C#CCNC(=O)CCOc1ccc(cc1Cl)F 1626a_100000212058_100000240429 [1,1,0,0,0,0|0,1,1]=4 1735 B17R1.4909 C#CCNC(=O)CCOc1ccc(cc1Cl)F 240690a_100000212058_100000240429 [1,1,0,0,0,0|0,1,1]=4 1736 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)C 34a_100012000392_100012094781 [1,1,0,0,0,0|2,0,0]=4 1737 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)C 7a_100012000392_100012094781 [1,1,0,0,0,0|2,0,0]=4 1738 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)F 34a_100012017157_100012094781 [1,1,0,0,0,0|2,0,0]=4 1739 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)F 7a_100012017157_100012094781 [1,1,0,0,0,0|2,0,0]=4 1740 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100012094781 [1,1,0,0,0,0|2,0,0]=4 1741 B17R1.29495 C#CCCCCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100012094781 [1,1,0,0,0,0|2,0,0]=4 1742 B17R1.29495 C#CCCCCCOc1cc(c(cc1Br)Cl)C 34a_100022700756_100012094781 [1,1,0,0,0,0|1,1,0]=4 1743 B17R1.29495 C#CCCCCCOc1cc(c(cc1Br)Cl)C 7a_100022700756_100012094781 [1,1,0,0,0,0|1,1,0]=4 1744 B17R1.29495 C#CCCCCCOc1cc(c(cc1C)Cl)N 34a_100000092876_100012094781 [1,1,0,0,0,0|2,0,0]=4 1745 B17R1.29495 C#CCCCCCOc1cc(c(cc1C)Cl)N 7a_100000092876_100012094781 [1,1,0,0,0,0|2,0,0]=4 1746 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Br)C 34a_200012350488_100012094781 [1,1,0,0,0,0|1,1,0]=4 1747 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Br)C 7a_200012350488_100012094781 [1,1,0,0,0,0|1,1,0]=4 1748 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Br)F 34a_100000726166_100012094781 [1,1,0,0,0,0|1,1,0]=4 1749 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Br)F 7a_100000726166_100012094781 [1,1,0,0,0,0|1,1,0]=4 1750 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)C)C 34a_100000031796_100012094781 [1,1,0,0,0,0|2,0,0]=4 1751 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)C)C 7a_100000031796_100012094781 [1,1,0,0,0,0|2,0,0]=4 1752 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)C)N 34a_100009961766_100012094781 [1,1,0,0,0,0|2,0,0]=4 1753 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)C)N 7a_100009961766_100012094781 [1,1,0,0,0,0|2,0,0]=4 1754 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Cl)C 34a_100012002691_100012094781 [1,1,0,0,0,0|1,0,0]=3 1755 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Cl)C 7a_100012002691_100012094781 [1,1,0,0,0,0|1,0,0]=3 1756 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Cl)N 34a_100000037174_100012094781 [1,1,0,0,0,0|1,0,0]=3 1757 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)Cl)N 7a_100000037174_100012094781 [1,1,0,0,0,0|1,0,0]=3 1758 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)Br 34a_100010189047_100012094781 [1,1,0,0,0,0|1,1,0]=4 1759 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)Br 7a_100010189047_100012094781 [1,1,0,0,0,0|1,1,0]=4 1760 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)F 34a_100009848785_100012094781 [1,1,0,0,0,0|1,1,0]=4 1761 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)F 7a_100009848785_100012094781 [1,1,0,0,0,0|1,1,0]=4 1762 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)I 34a_100010735246_100012094781 [1,1,0,0,0,0|1,1,0]=4 1763 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)I 7a_100010735246_100012094781 [1,1,0,0,0,0|1,1,0]=4 1764 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)N 34a_100000042052_100012094781 [1,1,0,0,0,0|1,1,0]=4 1765 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)F)N 7a_100000042052_100012094781 [1,1,0,0,0,0|1,1,0]=4 1766 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)N)Cl 34a_100012000071_100012094781 [1,1,0,0,0,0|2,0,0]=4 1767 B17R1.29495 C#CCCCCCOc1cc(c(cc1Cl)N)Cl 7a_100012000071_100012094781 [1,1,0,0,0,0|2,0,0]=4 1768 B17R1.29495 C#CCCCCCOc1cc(c(cc1N)Cl)C 34a_100000091707_100012094781 [1,1,0,0,0,0|2,0,0]=4 1769 B17R1.29495 C#CCCCCCOc1cc(c(cc1N)Cl)C 7a_100000091707_100012094781 [1,1,0,0,0,0|2,0,0]=4 1770 B17R1.29495 C#CCCCCCOc1cc(c(cc1N)Cl)Cl 34a_100000696747_100012094781 [1,1,0,0,0,0|2,0,0]=4 1771 B17R1.29495 C#CCCCCCOc1cc(c(cc1N)Cl)Cl 7a_100000696747_100012094781 [1,1,0,0,0,0|2,0,0]=4 1772 B17R1.29495 C#CCCCCCOc1nc(c(cc1Cl)Cl)Cl 34a_100011933978_100012094781 [1,1,0,0,0,0|2,0,0]=4 1773 B17R1.29495 C#CCCCCCSc1cc(c(cc1Cl)Cl)N 62a_100012094781_100016224655 [1,1,0,0,0,0|1,1,0]=4 1774 B17R1.29495 C#CCCCCCSc1cc(c(cc1Cl)Cl)N 62a_100016224655_100012094781 [1,1,0,0,0,0|1,1,0]=4 1775 B17R1.29495 Cc1cc(c(cc1Cl)Cl)OCCCCCC#N 7a_100012002691_100009813376 [1,1,0,0,0,0|2,0,0]=4 1776 B17R1.29495 N#CCCCCCOc1cc(c(cc1Cl)Cl)N 7a_100000037174_100009813376 [1,1,0,0,0,0|2,0,0]=4 1777 B17R1.29496 C#CCCCCCNc1ccc(c(c1Cl)C)Cl 34a_100011935240_100012094781 [1,1,0,0,0,0|2,0,0]=4 1778 B17R1.29496 C#CCCCCCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100012094781 [1,1,0,0,0,0|2,0,0]=4 1779 B17R1.29496 C#CCCCCCNc1ccc(c(c1Cl)F)Cl 2230a_100000069711_100012094781 [1,1,0,0,0,0|2,0,0]=4 1780 B17R1.29496 C#CCCCCCNc1ccc(c(c1Cl)F)Cl 34a_100000069711_100012094781 [1,1,0,0,0,0|2,0,0]=4 1781 B17R1.29496 C#CCCCCCNc1ccc(c(c1Cl)F)Cl 7a_100000069711_100012094781 [1,1,0,0,0,0|2,0,0]=4 1782 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)C)Br 34a_100021574527_100012094781 [1,1,0,0,0,0|1,1,0]=4 1783 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100012094781 [1,1,0,0,0,0|1,1,0]=4 1784 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)Cl)N 34a_100012017499_100012094781 [1,1,0,0,0,0|2,0,0]=4 1785 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)Cl)N 7a_100012017499_100012094781 [1,1,0,0,0,0|2,0,0]=4 1786 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)F)Br 34a_100010245746_100012094781 [1,1,0,0,0,0|1,1,0]=4 1787 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100012094781 [1,1,0,0,0,0|1,1,0]=4 1788 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)F)N 34a_200000098347_100012094781 [1,1,0,0,0,0|2,0,0]=4 1789 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)F)N 7a_200000098347_100012094781 [1,1,0,0,0,0|2,0,0]=4 1790 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)N)Cl 34a_100016988457_100012094781 [1,1,0,0,0,0|1,0,0]=3 1791 B17R1.29496 C#CCCCCCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100012094781 [1,1,0,0,0,0|1,0,0]=3 1792 B17R1.29496 C#CCCCCCOc1ncc(c(c1Cl)Cl)Cl 34a_200010273840_100012094781 [1,1,0,0,0,0|2,0,0]=4 1793 B17R1.29496 N#CCCCCCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100009813376 [1,1,0,0,0,0|2,0,0]=4 1794 B17R1.66846 C#CCCCCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100012094781 [1,1,0,0,0,0|2,0,0]=4 1795 B17R1.66846 C#CCCCCCN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_100012094781 [1,1,0,0,0,0|2,0,0]=4 1796 B17R1.66846 C#CCCCCCN(C)c1ccc(cc1Cl)Cl 34a_114849113696_100012094781 [1,1,0,0,0,0|2,0,0]=4 1797 B17R1.73347 C#CCCCCCNc1c(cc(cc1Cl)Cl)C 34a_100011215104_100012094781 [1,1,0,0,0,0|2,0,0]=4 1798 B17R1.73347 C#CCCCCCNc1c(cc(cc1Cl)Cl)C 7a_100011215104_100012094781 [1,1,0,0,0,0|2,0,0]=4 1799 B17R1.73347 C#CCCCCCNc1c(cc(cc1Cl)Cl)F 34a_100000688862_100012094781 [1,1,0,0,0,0|2,0,0]=4 1800 B17R1.73347 C#CCCCCCNc1c(cc(cc1Cl)Cl)F 7a_100000688862_100012094781 [1,1,0,0,0,0|2,0,0]=4 1801 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)C 34a_100012337756_100012094781 [1,1,0,0,0,0|1,1,0]=4 1802 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)C 7a_100012337756_100012094781 [1,1,0,0,0,0|1,1,0]=4 1803 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)F 34a_100011830412_100012094781 [1,1,0,0,0,0|1,1,0]=4 1804 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100012094781 [1,1,0,0,0,0|1,1,0]=4 1805 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)N 34a_106741647128_100012094781 [1,1,0,0,0,0|1,1,0]=4 1806 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)Cl)N 7a_106741647128_100012094781 [1,1,0,0,0,0|1,1,0]=4 1807 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)F)Cl 34a_100011830411_100012094781 [1,1,0,0,0,0|1,1,0]=4 1808 B17R1.73347 C#CCCCCCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100012094781 [1,1,0,0,0,0|1,1,0]=4 1809 B17R1.73347 C#CCCCCCOc1c(cc(cc1C)Cl)C 34a_100000211519_100012094781 [1,1,0,0,0,0|2,0,0]=4 1810 B17R1.73347 C#CCCCCCOc1c(cc(cc1C)Cl)C 7a_100000211519_100012094781 [1,1,0,0,0,0|2,0,0]=4 1811 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)C 34a_100000211485_100012094781 [1,1,0,0,0,0|1,1,0]=4 1812 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)C 7a_100000211485_100012094781 [1,1,0,0,0,0|1,1,0]=4 1813 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)F 34a_100011216646_100012094781 [1,1,0,0,0,0|1,1,0]=4 1814 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100012094781 [1,1,0,0,0,0|1,1,0]=4 1815 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)N 34a_100000694353_100012094781 [1,1,0,0,0,0|1,1,0]=4 1816 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Br)N 7a_100000694353_100012094781 [1,1,0,0,0,0|1,1,0]=4 1817 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)C)Cl 34a_100000034925_100012094781 [1,1,0,0,0,0|2,0,0]=4 1818 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)C)Cl 7a_100000034925_100012094781 [1,1,0,0,0,0|2,0,0]=4 1819 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Cl)C 34a_100011218458_100012094781 [1,1,0,0,0,0|1,0,0]=3 1820 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Cl)C 7a_100011218458_100012094781 [1,1,0,0,0,0|1,0,0]=3 1821 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Cl)N 34a_100000695819_100012094781 [1,1,0,0,0,0|1,0,0]=3 1822 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100012094781 [1,1,0,0,0,0|1,0,0]=3 1823 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)F)Cl 34a_100011217724_100012094781 [1,1,0,0,0,0|1,1,0]=4 1824 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100012094781 [1,1,0,0,0,0|1,1,0]=4 1825 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)F)F 34a_100011935252_100012094781 [1,1,0,0,0,0|1,1,0]=4 1826 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)F)F 7a_100011935252_100012094781 [1,1,0,0,0,0|1,1,0]=4 1827 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)I)C 34a_200015900153_100012094781 [1,1,0,0,0,0|1,1,0]=4 1828 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)I)C 7a_200015900153_100012094781 [1,1,0,0,0,0|1,1,0]=4 1829 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)N)Cl 34a_100000695418_100012094781 [1,1,0,0,0,0|2,0,0]=4 1830 B17R1.73347 C#CCCCCCOc1c(cc(cc1Cl)N)Cl 7a_100000695418_100012094781 [1,1,0,0,0,0|2,0,0]=4 1831 B17R1.73347 C#CCCCCCOc1c(cc(cc1F)Cl)F 34a_100011830429_100012094781 [1,1,0,0,0,0|1,1,0]=4 1832 B17R1.73347 C#CCCCCCOc1c(cc(cc1F)Cl)F 7a_100011830429_100012094781 [1,1,0,0,0,0|1,1,0]=4 1833 B17R1.73347 C#CCCCCCOc1c(cc(cc1I)Cl)C 34a_100012343667_100012094781 [1,1,0,0,0,0|1,1,0]=4 1834 B17R1.73347 C#CCCCCCOc1c(cc(cc1I)Cl)C 7a_100012343667_100012094781 [1,1,0,0,0,0|1,1,0]=4 1835 B17R1.73347 C#CCCNCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000755551_100011259511 [1,1,0,0,0,0|2,0,0]=4 1836 B17R1.73347 C#CCCOCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000748996_100000688953 [1,1,0,0,0,0|2,0,0]=4 1837 B17R1.73347 C#CCCOCCOc1c(cc(cc1Cl)Cl)Cl 34a_100011215631_100011259511 [1,1,0,0,0,0|2,0,0]=4 1838 B17R1.73347 C#CCCOCCOc1c(cc(cc1Cl)Cl)Cl 7a_100000748996_100000688953 [1,1,0,0,0,0|2,0,0]=4 1839 B17R1.73347 C#CCCSCCOc1c(cc(cc1Cl)Cl)Cl 62a_100000688953_100011259511 [1,1,0,0,0,0|2,0,0]=4 1840 B17R1.73347 C#CCCSCCOc1c(cc(cc1Cl)Cl)Cl 62a_100011259511_100000688953 [1,1,0,0,0,0|2,0,0]=4 1841 B17R1.73347 Cc1cc(cc(c1OCCCCCC#N)Cl)Cl 7a_100011218458_100009813376 [1,1,0,0,0,0|2,0,0]=4 1842 B17R1.73347 N#CCCCCCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100009813376 [1,1,0,0,0,0|2,0,0]=4 1843 B17R1.101 C#CCN(CC)CCCOc1ccccc1Br 2230a_100000744766_200011259276 [1,1,0,0,0,0|0,1,0]=3 1844 B17R1.101 C#CCN(CC)CCCOc1ccccc1Br 269982a_100000744766_200011259276 [1,1,0,0,0,0|0,1,0]=3 1845 B17R1.101 C#CCN(CC)CCCOc1ccccc1C 2230a_100000744766_100000742659 [1,1,0,0,0,0|1,0,0]=3 1846 B17R1.101 C#CCN(CC)CCCOc1ccccc1C 269982a_100000744766_100000742659 [1,1,0,0,0,0|1,0,0]=3 1847 B17R1.101 C#CCN(CC)CCCOc1ccccc1F 2230a_100000744766_100011203253 [1,1,0,0,0,0|0,1,0]=3 1848 B17R1.101 C#CCN(CC)CCCOc1ccccc1F 269982a_100000744766_100011203253 [1,1,0,0,0,0|0,1,0]=3 1849 B17R1.101 C#CCN(CC)CCCSc1ccccc1Cl 2230a_100000744766_100000750589 [1,1,0,0,0,0|0,1,0]=3 1850 B17R1.101 C#CCN(CC)CCCSc1ccccc1Cl 269982a_100000744766_100000750589 [1,1,0,0,0,0|0,1,0]=3 1851 B17R1.450 C=C(C)CN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000748629 [1,1,0,0,0,0|0,0,2]=4 1852 B17R1.450 C=C(C)CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000748629 [1,1,0,0,0,0|0,0,2]=4 1853 B17R1.450 C=C(C)CN(C)CCCOc1ccccc1Cl 34a_100011252689_100000748629 [1,1,0,0,0,0|0,0,2]=4 1854 B17R1.450 C=C(F)CN(C)CCCOc1ccccc1Cl 2230a_100011252689_100009893438 [1,1,0,0,0,0|0,0,2]=4 1855 B17R1.450 C=C(F)CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100009893438 [1,1,0,0,0,0|0,0,2]=4 1856 B17R1.450 C=C(F)CN(C)CCCOc1ccccc1Cl 34a_100011252689_100009893438 [1,1,0,0,0,0|0,0,2]=4 1857 B17R1.450 CC(C)CN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000210760 [1,1,0,0,0,0|0,0,2]=4 1858 B17R1.450 CC(C)CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000210624 [1,1,0,0,0,0|0,0,2]=4 1859 B17R1.450 CC(C)CN(C)CCCOc1ccccc1Cl 270004a_100011252689_100000210432 [1,1,0,0,0,0|0,0,2]=4 1860 B17R1.450 CC(C)CN(C)CCCOc1ccccc1Cl 34a_100011252689_100000210624 [1,1,0,0,0,0|0,0,2]=4 1861 B17R1.450 CC(O)CN(C)CCCOc1ccccc1Cl 2230a_100011252689_100011218427 [1,1,0,0,0,0|0,0,2]=4 1862 B17R1.450 CC(O)CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100011218427 [1,1,0,0,0,0|0,0,2]=4 1863 B17R1.450 CC(O)CN(C)CCCOc1ccccc1Cl 34a_100011252689_100011218427 [1,1,0,0,0,0|0,0,2]=4 1864 B17R1.450 CN(CCCOc1ccccc1Cl)CC(=O)N 2230a_100011252689_100000747473 [1,1,0,0,0,0|1,0,1]=4 1865 B17R1.450 CN(CCCOc1ccccc1Cl)CC(=O)N 269982a_100011252689_100000187820 [1,1,0,0,0,0|1,0,1]=4 1866 B17R1.450 CN(CCCOc1ccccc1Cl)CC(=O)N 34a_100011252689_100000187820 [1,1,0,0,0,0|1,0,1]=4 1867 B17R1.450 CN(CCCOc1ccccc1Cl)CC(=O)[O-] 269982a_100011252689_100020667443 [1,1,0,0,0,0|1,0,1]=4 1868 B17R1.450 CN(CCCOc1ccccc1Cl)CC(=O)[O-] 34a_100011252689_100020667443 [1,1,0,0,0,0|1,0,1]=4 1869 B17R1.450 CN(CCCOc1ccccc1Cl)CC(F)F 2230a_100011252689_100011934356 [1,1,0,0,0,0|1,0,1]=4 1870 B17R1.450 CN(CCCOc1ccccc1Cl)CC(F)F 269982a_100011252689_100011934356 [1,1,0,0,0,0|1,0,1]=4 1871 B17R1.450 CN(CCCOc1ccccc1Cl)CC(F)F 34a_100011252689_100011934356 [1,1,0,0,0,0|1,0,1]=4 1872 B17R1.450 CN(CCCOc1ccccc1Cl)C[N+](=O)[O-] 269982a_100011252689_100000761209 [1,1,0,0,0,0|2,0,0]=4 1873 B17R1.450 CN(CCCOc1ccccc1Cl)C[N+](=O)[O-] 34a_100011252689_100000761209 [1,1,0,0,0,0|2,0,0]=4 1874 B17R1.450 C[C@@H](O)CN(C)CCCOc1ccccc1Cl 2230a_100011252689_100009817552 [1,1,0,0,0,0|0,0,2]=4 1875 B17R1.450 C[C@@H](O)CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100009817552 [1,1,0,0,0,0|0,0,2]=4 1876 B17R1.450 C[C@@H](O)CN(C)CCCOc1ccccc1Cl 34a_100011252689_100009817552 [1,1,0,0,0,0|0,0,2]=4 1877 B17R1.938 C#CCC(=O)CCCOc1cccc(c1Cl)Cl 1458a_100000746216_100000184674 [1,1,0,0,0,0|2,0,0]=4 1878 B17R1.938 C#CCN(C)CCCOc1cccc(c1C)C 2230a_100011252654_100000038162 [1,1,0,0,0,0|1,0,0]=3 1879 B17R1.938 C#CCN(C)CCCOc1cccc(c1C)C 34a_100011252654_100000184674 [1,1,0,0,0,0|1,0,0]=3 1880 B17R1.938 Cc1cccc(c1C)OCCCN(C)CC#N 2230a_100011252654_100011215382 [1,1,0,0,0,0|2,0,0]=4 1881 B17R1.938 Cc1cccc(c1C)OCCCN(C)CC#N 269982a_100011252654_100011214920 [1,1,0,0,0,0|2,0,0]=4 1882 B17R1.1515 C#CCCC(=O)CCCOc1ccccc1Cl 1458a_100000747900_100000753159 [1,1,0,0,0,0|2,0,0]=4 1883 B17R1.1515 C#CCCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000688953 [1,1,0,0,0,0|0,1,0]=3 1884 B17R1.1515 C#CCCN(C)CCCOc1ccccc1Br 269982a_100015186278_100000730999 [1,1,0,0,0,0|0,1,0]=3 1885 B17R1.1515 C#CCCN(C)CCCOc1ccccc1C 2230a_100000742905_100000688953 [1,1,0,0,0,0|1,0,0]=3 1886 B17R1.1515 C#CCCN(C)CCCOc1ccccc1C 269982a_100000742905_100000730999 [1,1,0,0,0,0|1,0,0]=3 1887 B17R1.1515 C#CCCN(C)CCCOc1ccccc1C 34a_100000742905_100000688953 [1,1,0,0,0,0|1,0,0]=3 1888 B17R1.1515 C#CCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000688953 [1,1,0,0,0,0|0,0,0]=2 1889 B17R1.1515 C#CCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000730999 [1,1,0,0,0,0|0,0,0]=2 1890 B17R1.1515 C#CCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000688953 [1,1,0,0,0,0|0,0,0]=2 1891 B17R1.1515 C#CCNC(=O)CCCOc1ccccc1Cl 11a_100000212058_100000747900 [1,1,0,0,0,0|2,0,0]=4 1892 B17R1.1515 C#CCNC(=O)CCCOc1ccccc1Cl 1626a_100000212058_100000747900 [1,1,0,0,0,0|2,0,0]=4 1893 B17R1.1515 C#CCNC(=O)CCCOc1ccccc1Cl 240690a_100000212058_100000747900 [1,1,0,0,0,0|2,0,0]=4 1894 B17R1.1515 C#CCNC(=O)CCCOc1ccccc1Cl 527a_100000212058_100000747900 [1,1,0,0,0,0|2,0,0]=4 1895 B17R1.1515 C/C=C/CN(C)CCCOc1ccccc1Cl 269982a_100011252689_100102629194 [1,1,0,0,0,0|0,0,2]=4 1896 B17R1.1515 C/C=C/CN(C)CCCOc1ccccc1Cl 34a_100011252689_100102629194 [1,1,0,0,0,0|0,0,2]=4 1897 B17R1.1515 C=CCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000754431 [1,1,0,0,0,0|0,0,2]=4 1898 B17R1.1515 C=CCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000754431 [1,1,0,0,0,0|0,0,2]=4 1899 B17R1.1515 C=CCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000754431 [1,1,0,0,0,0|0,0,2]=4 1900 B17R1.1515 CC#CCC(=O)CCCOc1ccccc1Cl 1458a_100000747900_100000748600 [1,1,0,0,0,0|2,0,0]=4 1901 B17R1.1515 CC#CCN(C)CCCOc1ccccc1Br 2230a_100015186278_100000748600 [1,1,0,0,0,0|0,1,0]=3 1902 B17R1.1515 CC#CCN(C)CCCOc1ccccc1C 2230a_100000742905_100000748600 [1,1,0,0,0,0|1,0,0]=3 1903 B17R1.1515 CC#CCN(C)CCCOc1ccccc1C 34a_100000742905_100000748600 [1,1,0,0,0,0|1,0,0]=3 1904 B17R1.1515 CC#CCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000748600 [1,1,0,0,0,0|0,0,0]=2 1905 B17R1.1515 CC#CCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000748600 [1,1,0,0,0,0|0,0,0]=2 1906 B17R1.1515 CC=CCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000070051 [1,1,0,0,0,0|0,0,2]=4 1907 B17R1.1515 CC=CCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000070051 [1,1,0,0,0,0|0,0,2]=4 1908 B17R1.1515 CCCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000210211 [1,1,0,0,0,0|0,0,2]=4 1909 B17R1.1515 CCCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000210211 [1,1,0,0,0,0|0,0,2]=4 1910 B17R1.1515 CCCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000210210 [1,1,0,0,0,0|0,0,2]=4 1911 B17R1.1515 CCOCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000739092 [1,1,0,0,0,0|0,0,2]=4 1912 B17R1.1515 CN(CCC#N)CCCOc1ccccc1Br 2230a_100000184479_200011259276 [1,1,0,0,0,0|0,1,1]=4 1913 B17R1.1515 CN(CCC#N)CCCOc1ccccc1Br 2230a_100015186278_100011215226 [1,1,0,0,0,0|0,1,1]=4 1914 B17R1.1515 CN(CCC#N)CCCOc1ccccc1Br 269982a_100015186278_100011215226 [1,1,0,0,0,0|0,1,1]=4 1915 B17R1.1515 CN(CCC#N)CCCOc1ccccc1Cl 2230a_100011252689_100011215226 [1,1,0,0,0,0|0,0,1]=3 1916 B17R1.1515 CN(CCC#N)CCCOc1ccccc1Cl 269982a_100011252689_100011215226 [1,1,0,0,0,0|0,0,1]=3 1917 B17R1.1515 CN(CCC#N)CCCOc1ccccc1F 2230a_100000184479_100011203253 [1,1,0,0,0,0|0,1,1]=4 1918 B17R1.1515 CN(CCC#N)CCCSc1ccccc1Cl 2230a_100000184479_100000750589 [1,1,0,0,0,0|0,1,1]=4 1919 B17R1.1515 CN(CCCF)CCCOc1ccccc1Cl 2230a_100011252689_100011934791 [1,1,0,0,0,0|0,0,2]=4 1920 B17R1.1515 CN(CCCF)CCCOc1ccccc1Cl 269982a_100011252689_100011934791 [1,1,0,0,0,0|0,0,2]=4 1921 B17R1.1515 CN(CCCF)CCCOc1ccccc1Cl 34a_100011252689_100011934791 [1,1,0,0,0,0|0,0,2]=4 1922 B17R1.1515 CN(CCCO)CCCOc1ccccc1Cl 2230a_100011252689_100000230001 [1,1,0,0,0,0|0,0,2]=4 1923 B17R1.1515 CN(CCCO)CCCOc1ccccc1Cl 269982a_100011252689_100011215043 [1,1,0,0,0,0|0,0,2]=4 1924 B17R1.1515 CN(CCCO)CCCOc1ccccc1Cl 34a_100011252689_100000230001 [1,1,0,0,0,0|0,0,2]=4 1925 B17R1.1515 CN(CCCOc1ccccc1Br)CSC#N 269982a_100015186278_100000211825 [1,1,0,0,0,0|1,1,0]=4 1926 B17R1.1515 CN(CCCOc1ccccc1Cl)CSC#N 269982a_100011252689_100000211825 [1,1,0,0,0,0|1,0,0]=3 1927 B17R1.1515 COCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100011201679 [1,1,0,0,0,0|0,0,2]=4 1928 B17R1.1515 COCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000233755 [1,1,0,0,0,0|0,0,2]=4 1929 B17R1.1515 COCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100011201679 [1,1,0,0,0,0|0,0,2]=4 1930 B17R1.1515 CSCCN(C)CCCOc1ccccc1Cl 2230a_100011252689_100000751147 [1,1,0,0,0,0|0,0,2]=4 1931 B17R1.1515 CSCCN(C)CCCOc1ccccc1Cl 269982a_100011252689_100000212216 [1,1,0,0,0,0|0,0,2]=4 1932 B17R1.1515 CSCCN(C)CCCOc1ccccc1Cl 34a_100011252689_100000212216 [1,1,0,0,0,0|0,0,2]=4 1933 B17R1.1515 Cc1ccccc1OCCCN(C)CCC#N 2230a_100000184479_100000742659 [1,1,0,0,0,0|1,0,1]=4 1934 B17R1.1515 Cc1ccccc1OCCCN(C)CCC#N 2230a_100000742905_100011215226 [1,1,0,0,0,0|1,0,1]=4 1935 B17R1.1515 Cc1ccccc1OCCCN(C)CCC#N 269982a_100000742905_100011215226 [1,1,0,0,0,0|1,0,1]=4 1936 B17R1.1515 Cc1ccccc1OCCCN(C)CSC#N 269982a_100000742905_100000211825 [1,1,0,0,0,0|2,0,0]=4 1937 B17R1.1661 C#CCN(C)CCCOc1ccccc1OC 2230a_100000225692_100011259231 [1,1,0,0,0,0|1,0,0]=3 1938 B17R1.1661 C#CCN(C)CCCOc1ccccc1OC 2230a_100000752054_100000038162 [1,1,0,0,0,0|1,0,0]=3 1939 B17R1.1661 C#CCN(C)CCCOc1ccccc1OC 34a_100000225692_100011259231 [1,1,0,0,0,0|1,0,0]=3 1940 B17R1.1661 COc1ccccc1OCCCN(C)CC#N 2230a_100000748184_100011259231 [1,1,0,0,0,0|2,0,0]=4 1941 B17R1.1661 COc1ccccc1OCCCN(C)CC#N 2230a_100000752054_100011215382 [1,1,0,0,0,0|2,0,0]=4 1942 B17R1.1661 COc1ccccc1OCCCN(C)CC#N 269982a_100000752054_100011214920 [1,1,0,0,0,0|2,0,0]=4 1943 B17R1.1748 C#CC(C)C(=O)CCCOc1ccccc1Cl 1458a_100000747900_200000035995 [1,1,0,0,0,0|2,0,0]=4 1944 B17R1.1748 C#CC(C)N(C)CCCOc1ccccc1C 34a_100000742905_200000035995 [1,1,0,0,0,0|1,0,0]=3 1945 B17R1.1748 C#CC(C)N(C)CCCOc1ccccc1Cl 34a_100011252689_200000035995 [1,1,0,0,0,0|0,0,0]=2 1946 B17R1.1748 C=CC(C)N(C)CCCOc1ccccc1Cl 269982a_100011252689_100011215867 [1,1,0,0,0,0|0,0,2]=4 1947 B17R1.1748 CC(C#N)N(C)CCCOc1ccccc1Br 2230a_100015186278_100000184139 [1,1,0,0,0,0|1,1,0]=4 1948 B17R1.1748 CC(C#N)N(C)CCCOc1ccccc1Br 269982a_100015186278_100000703298 [1,1,0,0,0,0|1,1,0]=4 1949 B17R1.1748 CC(C#N)N(C)CCCOc1ccccc1Cl 2230a_100011252689_100000184139 [1,1,0,0,0,0|1,0,0]=3 1950 B17R1.1748 CC(C#N)N(C)CCCOc1ccccc1Cl 269982a_100011252689_100000703298 [1,1,0,0,0,0|1,0,0]=3 1951 B17R1.1748 CC(CO)N(C)CCCOc1ccccc1Cl 2230a_100011252689_100012180447 [1,1,0,0,0,0|1,0,1]=4 1952 B17R1.1748 CC(CO)N(C)CCCOc1ccccc1Cl 34a_100011252689_100012180447 [1,1,0,0,0,0|1,0,1]=4 1953 B17R1.1748 CCC(C)N(C)CCCOc1ccccc1Cl 2230a_100011252689_100000758301 [1,1,0,0,0,0|0,0,2]=4 1954 B17R1.1748 CCC(C)N(C)CCCOc1ccccc1Cl 269982a_100011252689_100000758301 [1,1,0,0,0,0|0,0,2]=4 1955 B17R1.1748 CCC(C)N(C)CCCOc1ccccc1Cl 34a_100011252689_100011215416 [1,1,0,0,0,0|0,0,2]=4 1956 B17R1.1748 COC(C)N(C)CCCOc1ccccc1Cl 269982a_100011252689_100009879195 [1,1,0,0,0,0|1,0,1]=4 1957 B17R1.1748 C[C@H](CO)N(C)CCCOc1ccccc1Cl 269982a_100011252689_100016084084 [1,1,0,0,0,0|1,0,1]=4 1958 B17R1.1748 Cc1ccccc1OCCCN(C)C(C)C#N 2230a_100000742905_100000184139 [1,1,0,0,0,0|2,0,0]=4 1959 B17R1.1748 Cc1ccccc1OCCCN(C)C(C)C#N 269982a_100000742905_100000703298 [1,1,0,0,0,0|2,0,0]=4 1960 B17R1.5672 C#CCN(C)C(=O)CCCc1ccccc1Cl 11a_100000225692_100000700343 [1,1,0,0,0,0|1,0,1]=4 1961 B17R1.5672 C#CCN(C)C(=O)CCCc1ccccc1Cl 1626a_100000225692_100000700343 [1,1,0,0,0,0|1,0,1]=4 1962 B17R1.5672 C#CCN(C)C(=O)CCCc1ccccc1Cl 527a_100000225692_100000700343 [1,1,0,0,0,0|1,0,1]=4 1963 B17R1.5672 C#CCN(C)C(=O)CCOc1ccccc1C 11a_100000225692_100000182324 [1,1,0,0,0,0|1,0,1]=4 1964 B17R1.5672 C#CCN(C)C(=O)CCOc1ccccc1C 1626a_100000225692_100000182324 [1,1,0,0,0,0|1,0,1]=4 1965 B17R1.5672 C#CCN(C)C(=O)CCOc1ccccc1Cl 1626a_100000225692_100000240438 [1,1,0,0,0,0|0,0,1]=3 1966 B17R1.5672 C#CCN(C)C(=O)CCOc1ccccc1F 1626a_100000225692_100000184057 [1,1,0,0,0,0|0,1,1]=4 1967 B17R1.5672 CN(CC#N)C(=O)CCOc1ccccc1Cl 1626a_100000748184_100000240438 [1,1,0,0,0,0|1,0,1]=4 1968 B17R1.6640 C#CCN(C)CCC(=O)Nc1ccccc1Cl 2230a_100000225692_100000242055 [1,1,0,0,0,0|1,0,1]=4 1969 B17R1.21318 C#CCC(C)OCCOc1cc(ccc1Cl)C 34a_100000685586_100011277402 [1,1,0,0,0,0|2,0,0]=4 1970 B17R1.21318 C#CCC(C)OCCOc1cc(ccc1Cl)C 7a_100000685586_100011277402 [1,1,0,0,0,0|2,0,0]=4 1971 B17R1.21318 C#CCC(C)OCCOc1cc(ccc1Cl)Cl 34a_100000685586_100000198575 [1,1,0,0,0,0|2,0,0]=4 1972 B17R1.21318 C#CCC(C)OCCOc1cc(ccc1Cl)Cl 7a_100000685586_100000198575 [1,1,0,0,0,0|2,0,0]=4 1973 B17R1.21318 C#CCN(C)CCCOc1cc(ccc1C)C 2230a_100000225751_100000038162 [1,1,0,0,0,0|1,0,0]=3 1974 B17R1.21318 C#CCN(C)CCCOc1cc(ccc1C)C 34a_100000225751_100000184674 [1,1,0,0,0,0|1,0,0]=3 1975 B17R1.21318 Cc1ccc(c(c1)OCCCN(C)CC#N)C 2230a_100000225751_100011215382 [1,1,0,0,0,0|2,0,0]=4 1976 B17R1.21318 Cc1ccc(c(c1)OCCCN(C)CC#N)C 269982a_100000225751_100011214920 [1,1,0,0,0,0|2,0,0]=4 1977 B17R1.125842 C#CCC(C)OCCOc1c(cccc1Cl)Cl 34a_100000685586_100000184560 [1,1,0,0,0,0|2,0,0]=4 1978 B17R1.125842 C#CCC(C)OCCOc1c(cccc1Cl)Cl 7a_100000685586_100000184560 [1,1,0,0,0,0|2,0,0]=4 1979 B17R1.125842 C#CCN(C)CCCOc1c(cccc1C)C 2230a_100015183114_100000038162 [1,1,0,0,0,0|1,0,0]=3 1980 B17R1.125842 C#CCN(C)CCCOc1c(cccc1C)C 34a_100015183114_100000184674 [1,1,0,0,0,0|1,0,0]=3 1981 B17R1.125842 Cc1cccc(c1OCCCN(C)CC#N)C 2230a_100015183114_100011215382 [1,1,0,0,0,0|2,0,0]=4 1982 B17R1.125842 Cc1cccc(c1OCCCN(C)CC#N)C 269982a_100015183114_100011214920 [1,1,0,0,0,0|2,0,0]=4 1983 B17R1.5319 CCN(C)CCCOc1ccc(cc1C#N)Cl 7a_100011219380_100015186262 [1,1,0,0,0,0|1,0,1]=4 1984 B17R1.5319 CCN(C)CCCOc1ccc(cc1CO)Cl 7a_100011218961_100015186262 [1,1,0,0,0,0|1,0,1]=4 1985 B17R1.13175 C#CC(C)(C)NCCOc1ccc(cc1Cl)Cl 34a_100000054563_100000184432 [1,1,0,0,0,0|2,0,0]=4 1986 B17R1.13175 C#CC(C)(C)OCCOc1ccc(cc1Cl)Cl 34a_100000189450_100000184432 [1,1,0,0,0,0|2,0,0]=4 1987 B17R1.13175 C#CC(C)(C)OCCOc1ccc(cc1Cl)Cl 34a_200000205304_100000038118 [1,1,0,0,0,0|2,0,0]=4 1988 B17R1.13175 C#CC(C)(C)OCCOc1ccc(cc1Cl)Cl 7a_100000189450_100000184432 [1,1,0,0,0,0|2,0,0]=4 1989 B17R1.13175 C#CC(C)(C)SCCOc1ccc(cc1Cl)Cl 62a_100000038118_100000184432 [1,1,0,0,0,0|2,0,0]=4 1990 B17R1.13175 C#CC(C)(C)SCCOc1ccc(cc1Cl)Cl 62a_100000184432_100000038118 [1,1,0,0,0,0|2,0,0]=4 1991 B17R1.13175 CC(C)(C#N)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000759902 [1,1,0,0,0,0|2,0,0]=4 1992 B17R1.13175 CC(C)(C#N)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000759902 [1,1,0,0,0,0|2,0,0]=4 1993 B17R1.19764 C#CC(CC)OCCOc1ccc(cc1Cl)Cl 34a_100000758843_100000184432 [1,1,0,0,0,0|2,0,0]=4 1994 B17R1.19764 C#CC(CC)OCCOc1ccc(cc1Cl)Cl 7a_100000758843_100000184432 [1,1,0,0,0,0|2,0,0]=4 1995 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100000709985 [1,1,0,0,0,0|0,1,1]=4 1996 B17R1.19764 CCN(CC)CCCOc1ccc(cc1C)Cl 7a_100000211091_100000709985 [1,1,0,0,0,0|1,0,1]=4 1997 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100000709985 [1,1,0,0,0,0|0,1,1]=4 1998 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)C 7a_100000749699_100000709985 [1,1,0,0,0,0|1,0,1]=4 1999 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100000709985 [1,1,0,0,0,0|0,0,1]=3 2000 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)F 7a_100000212004_100000709985 [1,1,0,0,0,0|0,1,1]=4 2001 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)I 7a_100012360047_100000709985 [1,1,0,0,0,0|0,1,1]=4 2002 B17R1.19764 CCN(CC)CCCOc1ccc(cc1Cl)N 7a_100000744943_100000709985 [1,1,0,0,0,0|1,0,1]=4 2003 B17R1.19764 CCN(CC)CCCOc1ccc(cc1F)Cl 7a_100000230166_100000709985 [1,1,0,0,0,0|0,1,1]=4 2004 B17R1.19764 CCN(CC)CCCOc1ccc(cc1I)Cl 7a_100011356953_100000709985 [1,1,0,0,0,0|0,1,1]=4 2005 B17R1.19764 CCN(CC)CCCOc1ccc(cc1N)Cl 7a_100000210500_100000709985 [1,1,0,0,0,0|1,0,1]=4 2006 B17R1.19764 CCN(CC)CCCOc1ccc(nc1Cl)Cl 7a_100000101165_100000709985 [1,1,0,0,0,0|1,0,1]=4 2007 B17R1.19764 CCN(CC)CCCOc1cnc(cc1Cl)Cl 7a_100009868576_100000709985 [1,1,0,0,0,0|1,0,1]=4 2008 B17R1.19764 CCN(CC)CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100000709985 [1,1,0,0,0,0|0,1,1]=4 2009 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)Br 7a_200012360370_100015186262 [1,1,0,0,0,0|1,0,1]=4 2010 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)C 7a_100012000392_100015186262 [1,1,0,0,0,0|1,0,1]=4 2011 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)Cl 7a_100000211015_100015186262 [1,1,0,0,0,0|1,0,1]=4 2012 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)F 7a_100012017157_100015186262 [1,1,0,0,0,0|1,0,1]=4 2013 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)I 7a_100016224655_100015186262 [1,1,0,0,0,0|1,0,1]=4 2014 B17R1.26531 CCN(C)CCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100015186262 [1,1,0,0,0,0|1,0,1]=4 2015 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Br)Cl)C 7a_100022700756_100015186262 [1,1,0,0,0,0|0,1,1]=4 2016 B17R1.26531 CCN(C)CCCOc1cc(c(cc1C)Cl)N 7a_100000092876_100015186262 [1,1,0,0,0,0|1,0,1]=4 2017 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Br)C 7a_200012350488_100015186262 [1,1,0,0,0,0|0,1,1]=4 2018 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Br)Cl 7a_100000719705_100015186262 [1,1,0,0,0,0|0,1,1]=4 2019 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Br)F 7a_100000726166_100015186262 [1,1,0,0,0,0|0,1,1]=4 2020 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Br)I 7a_100021297947_100015186262 [1,1,0,0,0,0|0,1,1]=4 2021 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)C)C 7a_100000031796_100015186262 [1,1,0,0,0,0|1,0,1]=4 2022 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)C)N 7a_100009961766_100015186262 [1,1,0,0,0,0|1,0,1]=4 2023 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Cl)Br 7a_100010203734_100015186262 [1,1,0,0,0,0|0,0,1]=3 2024 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Cl)C 7a_100012002691_100015186262 [1,1,0,0,0,0|0,0,1]=3 2025 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Cl)Cl 7a_100000211312_100015186262 [1,1,0,0,0,0|0,0,1]=3 2026 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)Cl)N 7a_100000037174_100015186262 [1,1,0,0,0,0|0,0,1]=3 2027 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)F)Br 7a_100010189047_100015186262 [1,1,0,0,0,0|0,1,1]=4 2028 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)F)F 7a_100009848785_100015186262 [1,1,0,0,0,0|0,1,1]=4 2029 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)F)I 7a_100010735246_100015186262 [1,1,0,0,0,0|0,1,1]=4 2030 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)F)N 7a_100000042052_100015186262 [1,1,0,0,0,0|0,1,1]=4 2031 B17R1.26531 CCN(C)CCCOc1cc(c(cc1Cl)N)Cl 7a_100012000071_100015186262 [1,1,0,0,0,0|1,0,1]=4 2032 B17R1.26531 CCN(C)CCCOc1cc(c(cc1N)Cl)C 7a_100000091707_100015186262 [1,1,0,0,0,0|1,0,1]=4 2033 B17R1.26531 CCN(C)CCCOc1cc(c(cc1N)Cl)Cl 7a_100000696747_100015186262 [1,1,0,0,0,0|1,0,1]=4 2034 B17R1.26531 CCN(C)CCCSc1cc(c(cc1Cl)Cl)N 62a_100016224655_100015186262 [1,1,0,0,0,0|0,1,1]=4 2035 B17R1.26532 CCN(C)CCCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100015186262 [1,1,0,0,0,0|1,0,1]=4 2036 B17R1.26532 CCN(C)CCCNc1ccc(c(c1Cl)F)Cl 2230a_100000069711_100015186262 [1,1,0,0,0,0|1,0,1]=4 2037 B17R1.26532 CCN(C)CCCNc1ccc(c(c1Cl)F)Cl 7a_100000069711_100015186262 [1,1,0,0,0,0|1,0,1]=4 2038 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100015186262 [1,1,0,0,0,0|0,1,1]=4 2039 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)Cl)Br 7a_100011988769_100015186262 [1,1,0,0,0,0|0,1,1]=4 2040 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_100015186262 [1,1,0,0,0,0|0,0,1]=3 2041 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)Cl)N 7a_100012017499_100015186262 [1,1,0,0,0,0|1,0,1]=4 2042 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100015186262 [1,1,0,0,0,0|0,1,1]=4 2043 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)F)N 7a_200000098347_100015186262 [1,1,0,0,0,0|1,0,1]=4 2044 B17R1.26532 CCN(C)CCCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100015186262 [1,1,0,0,0,0|0,0,1]=3 2045 B17R1.26532 CCN(C)CCCSc1ccc(c(c1Cl)C)Cl 62a_100010730154_100015186262 [1,1,0,0,0,0|0,1,1]=4 2046 B17R1.28898 CCN(C)CCCOc1ccc(cc1Cl)C#N 7a_100000205955_100015186262 [1,1,0,0,0,0|1,0,1]=4 2047 B17R1.28898 CCN(C)CCCOc1ccc(cc1Cl)OC 7a_100000038596_100015186262 [1,1,0,0,0,0|1,0,1]=4 2048 B17R1.139047 CCN(C)CCCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100015186262 [1,1,0,0,0,0|1,0,1]=4 2049 B17R1.139047 CCN(C)CCCN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_100015186262 [1,1,0,0,0,0|1,0,1]=4 2050 B17R1.151447 C#CC(C)NCCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000707721_100011259511 [1,1,0,0,0,0|2,0,0]=4 2051 B17R1.151447 C#CC(C)NCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000707721_100011259511 [1,1,0,0,0,0|2,0,0]=4 2052 B17R1.151447 C#CC(C)OCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000748996_200000035995 [1,1,0,0,0,0|2,0,0]=4 2053 B17R1.151447 C#CC(C)SCCOc1c(cc(cc1Cl)Cl)Cl 62a_200000035995_100011259511 [1,1,0,0,0,0|2,0,0]=4 2054 B17R1.151447 C#C[C@@H](C)OCCOc1c(cc(cc1Cl)Cl)Cl 34a_100009815206_100011259511 [1,1,0,0,0,0|2,0,0]=4 2055 B17R1.151447 C#C[C@@H](C)OCCOc1c(cc(cc1Cl)Cl)Cl 7a_100009815206_100011259511 [1,1,0,0,0,0|2,0,0]=4 2056 B17R1.151447 CCN(C)CCCNc1c(cc(cc1Cl)Cl)C 7a_100011215104_100015186262 [1,1,0,0,0,0|1,0,1]=4 2057 B17R1.151447 CCN(C)CCCNc1c(cc(cc1Cl)Cl)F 7a_100000688862_100015186262 [1,1,0,0,0,0|1,0,1]=4 2058 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Br)Cl 7a_100012337755_100015186262 [1,1,0,0,0,0|0,1,1]=4 2059 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Cl)Br 7a_100012337757_100015186262 [1,1,0,0,0,0|0,1,1]=4 2060 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Cl)C 7a_100012337756_100015186262 [1,1,0,0,0,0|0,1,1]=4 2061 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100015186262 [1,1,0,0,0,0|0,0,1]=3 2062 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100015186262 [1,1,0,0,0,0|0,1,1]=4 2063 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)Cl)N 7a_106741647128_100015186262 [1,1,0,0,0,0|0,1,1]=4 2064 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100015186262 [1,1,0,0,0,0|0,1,1]=4 2065 B17R1.151447 CCN(C)CCCOc1c(cc(cc1C)Cl)C 7a_100000211519_100015186262 [1,1,0,0,0,0|1,0,1]=4 2066 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Br)C 7a_100000211485_100015186262 [1,1,0,0,0,0|0,1,1]=4 2067 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100015186262 [1,1,0,0,0,0|0,1,1]=4 2068 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100015186262 [1,1,0,0,0,0|0,1,1]=4 2069 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Br)N 7a_100000694353_100015186262 [1,1,0,0,0,0|0,1,1]=4 2070 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)C)Cl 7a_100000034925_100015186262 [1,1,0,0,0,0|1,0,1]=4 2071 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Cl)C 7a_100011218458_100015186262 [1,1,0,0,0,0|0,0,1]=3 2072 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100015186262 [1,1,0,0,0,0|0,0,1]=3 2073 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100015186262 [1,1,0,0,0,0|0,0,1]=3 2074 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100015186262 [1,1,0,0,0,0|0,1,1]=4 2075 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)F)F 7a_100011935252_100015186262 [1,1,0,0,0,0|0,1,1]=4 2076 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)I)C 7a_200015900153_100015186262 [1,1,0,0,0,0|0,1,1]=4 2077 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)I)Cl 7a_100012339652_100015186262 [1,1,0,0,0,0|0,1,1]=4 2078 B17R1.151447 CCN(C)CCCOc1c(cc(cc1Cl)N)Cl 7a_100000695418_100015186262 [1,1,0,0,0,0|1,0,1]=4 2079 B17R1.151447 CCN(C)CCCOc1c(cc(cc1F)Cl)F 7a_100011830429_100015186262 [1,1,0,0,0,0|0,1,1]=4 2080 B17R1.151447 CCN(C)CCCOc1c(cc(cc1I)Cl)C 7a_100012343667_100015186262 [1,1,0,0,0,0|0,1,1]=4 2081 B17R1.151447 CCN(C)CCCOc1c(cc(cc1I)Cl)Cl 7a_200012339341_100015186262 [1,1,0,0,0,0|0,0,1]=3 2082 B17R1.151447 CCN(C)CCCOc1c(cc(cc1I)Cl)I 7a_100000730656_100015186262 [1,1,0,0,0,0|0,1,1]=4 2083 B17R1.151447 CCN(C)CCCOc1c(cc(cc1I)I)Cl 7a_100009997439_100015186262 [1,1,0,0,0,0|0,1,1]=4 2084 B17R1.151447 CCN(C)CCCSc1c(cc(cc1Cl)Cl)C 62a_200000035511_100015186262 [1,1,0,0,0,0|0,1,1]=4 2085 B17R1.1645 C#CCN(C)CCOc1ccc(cc1OC)C 2230a_100000225692_100011259456 [0,1,0,0,1,0|2,0,0]=4 2086 B17R1.1645 C#CCN(C)CCOc1ccc(cc1OC)C 34a_100000225692_100011259456 [0,1,0,0,1,0|2,0,0]=4 2087 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Br 11a_100000225692_100012349522 [0,1,0,0,1,0|0,1,1]=4 2088 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Br 1626a_100000225692_100012349522 [0,1,0,0,1,0|0,1,1]=4 2089 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Br 527a_100000225692_100012349522 [0,1,0,0,1,0|0,1,1]=4 2090 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Cl 11a_100000225692_100000736762 [0,1,0,0,1,0|0,0,1]=3 2091 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Cl 1626a_100000225692_100000736762 [0,1,0,0,1,0|0,0,1]=3 2092 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)Cl 527a_100000225692_100000736762 [0,1,0,0,1,0|0,0,1]=3 2093 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)F 11a_100000225692_100011308368 [0,1,0,0,1,0|0,1,1]=4 2094 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)F 1626a_100000225692_100011308368 [0,1,0,0,1,0|0,1,1]=4 2095 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1Cl)F 527a_100000225692_100011308368 [0,1,0,0,1,0|0,1,1]=4 2096 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1F)Cl 11a_100000225692_100012351355 [0,1,0,0,1,0|0,1,1]=4 2097 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1F)Cl 1626a_100000225692_100012351355 [0,1,0,0,1,0|0,1,1]=4 2098 B17R1.5037 C#CCN(C)C(=O)CCc1ccc(cc1F)Cl 527a_100000225692_100012351355 [0,1,0,0,1,0|0,1,1]=4 2099 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Br)Cl 11a_100000225692_100000184090 [0,1,0,0,1,0|0,1,1]=4 2100 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Br)Cl 1626a_100000225692_100000184090 [0,1,0,0,1,0|0,1,1]=4 2101 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Br)Cl 527a_100000225692_100000184090 [0,1,0,0,1,0|0,1,1]=4 2102 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1C)Cl 11a_100000225692_100000182498 [0,1,0,0,1,0|1,0,1]=4 2103 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1C)Cl 1626a_100000225692_100000182498 [0,1,0,0,1,0|1,0,1]=4 2104 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1C)Cl 527a_100000225692_100000182498 [0,1,0,0,1,0|1,0,1]=4 2105 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Br 11a_100000225692_100000185252 [0,1,0,0,1,0|0,1,1]=4 2106 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Br 1626a_100000225692_100000185252 [0,1,0,0,1,0|0,1,1]=4 2107 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Br 527a_100000225692_100000185252 [0,1,0,0,1,0|0,1,1]=4 2108 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)C 11a_100000225692_200011725833 [0,1,0,0,1,0|1,0,1]=4 2109 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)C 1626a_100000225692_200011725833 [0,1,0,0,1,0|1,0,1]=4 2110 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)C 527a_100000225692_200011725833 [0,1,0,0,1,0|1,0,1]=4 2111 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Cl 11a_100000225692_100102647096 [0,1,0,0,1,0|0,0,1]=3 2112 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Cl 1626a_100000225692_100102647096 [0,1,0,0,1,0|0,0,1]=3 2113 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)Cl 527a_100000225692_100102647096 [0,1,0,0,1,0|0,0,1]=3 2114 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)F 11a_100000225692_100000191239 [0,1,0,0,1,0|0,1,1]=4 2115 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)F 1626a_100000225692_100000191239 [0,1,0,0,1,0|0,1,1]=4 2116 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1Cl)F 527a_100000225692_100000191239 [0,1,0,0,1,0|0,1,1]=4 2117 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1F)Cl 11a_100000225692_100012771990 [0,1,0,0,1,0|0,1,1]=4 2118 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1F)Cl 1626a_100000225692_100012771990 [0,1,0,0,1,0|0,1,1]=4 2119 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1F)Cl 527a_100000225692_100012771990 [0,1,0,0,1,0|0,1,1]=4 2120 B17R1.5037 C#CCN(C)C(=O)COc1ccc(cc1O)Cl 527a_100000225692_100010174420 [0,1,0,0,1,0|1,0,1]=4 2121 B17R1.5037 C#CCN(C)C(=O)NCc1ccc(cc1Cl)Cl 2708a_100000174880_100000225692 [0,1,0,0,1,0|1,0,1]=4 2122 B17R1.5037 C#CCN(C)C(=O)NCc1ccc(cc1Cl)Cl 273464a_100000174880_100000225692 [0,1,0,0,1,0|1,0,1]=4 2123 B17R1.5037 CN(CC#N)C(=O)CCc1ccc(cc1Cl)Cl 11a_100000748184_100000736762 [0,1,0,0,1,0|1,0,1]=4 2124 B17R1.5037 CN(CC#N)C(=O)CCc1ccc(cc1Cl)Cl 1626a_100000748184_100000736762 [0,1,0,0,1,0|1,0,1]=4 2125 B17R1.5037 CN(CC#N)C(=O)COc1ccc(cc1Cl)Cl 11a_100000748184_100102647096 [0,1,0,0,1,0|1,0,1]=4 2126 B17R1.5037 CN(CC#N)C(=O)COc1ccc(cc1Cl)Cl 1626a_100000748184_100102647096 [0,1,0,0,1,0|1,0,1]=4 2127 B17R1.6209 C#CCC(CC)OCCc1ccc(cc1Cl)Cl 34a_200011217983_200012161198 [0,1,0,0,1,0|2,0,0]=4 2128 B17R1.6209 C#CCC(CC)OCCc1ccc(cc1Cl)Cl 7a_200011217983_200012161198 [0,1,0,0,1,0|2,0,0]=4 2129 B17R1.6209 C#CCN(CC)CCCc1ccc(cc1Cl)Cl 270004a_100000744766_100000765304 [0,1,0,0,1,0|0,0,0]=2 2130 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1Br)Cl 2230a_100000744766_100000199037 [0,1,0,0,1,0|0,1,0]=3 2131 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1Br)Cl 269982a_100000744766_100000199037 [0,1,0,0,1,0|0,1,0]=3 2132 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1C)C 2230a_100000744766_100011210784 [0,1,0,0,1,0|2,0,0]=4 2133 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1C)C 2230a_100015186970_100000038162 [0,1,0,0,1,0|2,0,0]=4 2134 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1C)C 269982a_100000744766_100011210784 [0,1,0,0,1,0|2,0,0]=4 2135 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1C)C 34a_100015186970_100000184674 [0,1,0,0,1,0|2,0,0]=4 2136 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1Cl)Cl 2230a_100000744766_100000184432 [0,1,0,0,1,0|0,0,0]=2 2137 B17R1.6209 C#CCN(CC)CCOc1ccc(cc1Cl)Cl 269982a_100000744766_100000184432 [0,1,0,0,1,0|0,0,0]=2 2138 B17R1.6209 CCCN(CC)CCCc1ccc(cc1Cl)Cl 270004a_100000226822_100000765304 [0,1,0,0,1,0|0,0,2]=4 2139 B17R1.6209 CCCN(CC)CCOc1ccc(cc1Cl)Cl 2230a_100000226822_100000184432 [0,1,0,0,1,0|0,0,2]=4 2140 B17R1.6209 CCCN(CC)CCOc1ccc(cc1Cl)Cl 269982a_100000226822_100000184432 [0,1,0,0,1,0|0,0,2]=4 2141 B17R1.6209 CCN(CCO)CCCc1ccc(cc1Cl)Cl 270004a_100000210973_100000765304 [0,1,0,0,1,0|1,0,1]=4 2142 B17R1.6209 CCN(CCO)CCOc1ccc(cc1Cl)Cl 2230a_100000210973_100000184432 [0,1,0,0,1,0|1,0,1]=4 2143 B17R1.6209 CCN(CCO)CCOc1ccc(cc1Cl)Cl 269982a_100000210973_100000184432 [0,1,0,0,1,0|1,0,1]=4 2144 B17R1.14584 C=C(C)CN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000225649_100000765304 [0,1,0,0,1,0|0,0,2]=4 2145 B17R1.14584 C=C(C)CN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000225649_100000184432 [0,1,0,0,1,0|0,0,2]=4 2146 B17R1.14584 C=C(C)CN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000225649_100000184432 [0,1,0,0,1,0|0,0,2]=4 2147 B17R1.14584 CC(C)CN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000747067_100000765304 [0,1,0,0,1,0|0,0,2]=4 2148 B17R1.14584 CC(C)CN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000747067_100000184432 [0,1,0,0,1,0|0,0,2]=4 2149 B17R1.14584 CC(C)CN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000747067_100000184432 [0,1,0,0,1,0|0,0,2]=4 2150 B17R1.14584 CC(O)CN(C)CCCc1ccc(cc1Cl)Cl 270004a_100000227577_100000765304 [0,1,0,0,1,0|0,0,2]=4 2151 B17R1.14584 CC(O)CN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000227577_100000184432 [0,1,0,0,1,0|0,0,2]=4 2152 B17R1.14584 CC(O)CN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000227577_100000184432 [0,1,0,0,1,0|0,0,2]=4 2153 B17R1.14584 CN(CCCc1ccc(cc1Cl)Cl)CC(=O)N 270004a_100000739694_100000765304 [0,1,0,0,1,0|1,0,1]=4 2154 B17R1.14584 CN(CCOc1ccc(cc1Cl)Cl)CC(=O)N 2230a_100000739694_100000184432 [0,1,0,0,1,0|1,0,1]=4 2155 B17R1.14584 CN(CCOc1ccc(cc1Cl)Cl)CC(=O)O 269956a_100000746989_100000184432 [0,1,0,0,1,0|1,0,1]=4 2156 B17R1.50037 C#CCC(C)OC[C@H](O)c1ccc(cc1Cl)Cl 34a_100000685586_100000761231 [0,1,0,0,1,0|2,0,0]=4 2157 B17R1.50037 C#CCC(C)OC[C@H](O)c1ccc(cc1Cl)Cl 7a_100000685586_100000761231 [0,1,0,0,1,0|2,0,0]=4 2158 B17R1.50037 C#CCN(C)COC(=O)c1ccc(cc1Cl)Cl 2230a_100000225692_100010978946 [0,1,0,0,1,0|1,0,1]=4 2159 B17R1.130990 C#CCN(C)CC(=O)Nc1ccc(cc1Cl)Cl 2230a_100000225692_100000183625 [0,1,0,0,1,0|1,0,1]=4 2160 B17R1.172656 C#CCC(=O)CCOc1c(cc(cc1Cl)Cl)Cl 1458a_100011220946_100011259511 [0,1,0,0,1,0|2,0,0]=4 2161 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1Br)F)F 2230a_100000225692_100011219851 [0,1,0,0,1,0|0,2,0]=4 2162 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1Br)F)F 34a_100000225692_100011219851 [0,1,0,0,1,0|0,2,0]=4 2163 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1C)C)C 2230a_100011430977_100000038162 [0,1,0,0,1,0|2,0,0]=4 2164 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1C)C)C 34a_100011430977_100000184674 [0,1,0,0,1,0|2,0,0]=4 2165 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000225692_100011259511 [0,1,0,0,1,0|0,0,0]=2 2166 B17R1.172656 C#CCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 34a_100000225692_100011259511 [0,1,0,0,1,0|0,0,0]=2 2167 B17R1.172656 C=CCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000225617_100011259511 [0,1,0,0,1,0|0,0,2]=4 2168 B17R1.172656 C=CCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 269982a_100000225617_100011259511 [0,1,0,0,1,0|0,0,2]=4 2169 B17R1.172656 CCCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000315232_200000210301 [0,1,0,0,1,0|0,0,2]=4 2170 B17R1.172656 CCCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000747261_100011259511 [0,1,0,0,1,0|0,0,2]=4 2171 B17R1.172656 CCCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 269982a_100000315232_200000210301 [0,1,0,0,1,0|0,0,2]=4 2172 B17R1.172656 CCCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 269982a_100000747261_100011259511 [0,1,0,0,1,0|0,0,2]=4 2173 B17R1.172656 CCCN(C)CCOc1c(cc(cc1Cl)Cl)Cl 34a_100000315232_200000210301 [0,1,0,0,1,0|0,0,2]=4 2174 B17R1.172656 CCCN([13CH3])CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000315232_200025704644 [0,1,0,0,1,0|0,0,2]=4 2175 B17R1.172656 CCCN([13CH3])CCOc1c(cc(cc1Cl)Cl)Cl 269982a_100000315232_200025704644 [0,1,0,0,1,0|0,0,2]=4 2176 B17R1.172656 CCCN([13CH3])CCOc1c(cc(cc1Cl)Cl)Cl 34a_100000315232_200025704644 [0,1,0,0,1,0|0,0,2]=4 2177 B17R1.172656 CN(CC#N)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000748184_100011259511 [0,1,0,0,1,0|1,0,0]=3 2178 B17R1.172656 CN(CCO)CCOc1c(cc(cc1Cl)Cl)Cl 2230a_100000210263_100011259511 [0,1,0,0,1,0|1,0,1]=4 2179 B17R1.172656 CN(CCO)CCOc1c(cc(cc1Cl)Cl)Cl 269982a_100000210263_100011259511 [0,1,0,0,1,0|1,0,1]=4 2180 B19R1.12397 C#CCNC(=O)CNCCOc1ccc(cc1Cl)Cl 2230a_100000747989_100000184432 [0,1,0,0,0,1|2,0,0]=4 2181 B19R1.12397 C#CCNC(=O)CNCCOc1ccc(cc1Cl)Cl 34a_100000747989_100000184432 [0,1,0,0,0,1|2,0,0]=4 2182 B19R1.12397 C#CCOC(C)COCCOc1ccc(cc1Br)Cl 34a_200000093152_100000199037 [0,1,0,0,0,1|1,1,0]=4 2183 B19R1.12397 C#CCOC(C)COCCOc1ccc(cc1Br)Cl 7a_200000093152_100000199037 [0,1,0,0,0,1|1,1,0]=4 2184 B19R1.12397 C#CCOC(C)COCCOc1ccc(cc1Cl)Cl 34a_200000093152_100000184432 [0,1,0,0,0,1|1,0,0]=3 2185 B19R1.12397 C#CCOC(C)COCCOc1ccc(cc1Cl)Cl 7a_200000093152_100000184432 [0,1,0,0,0,1|1,0,0]=3 2186 B19R1.39957 C#CCN(C)CC(=O)NCCc1ccc(cc1Cl)Cl 2230a_100000225692_100000183388 [0,1,0,0,0,1|1,0,1]=4 2187 B19R1.39957 C#CCN(C)CC(=O)NCCc1ccc(cc1Cl)Cl 34a_100000225692_100000183388 [0,1,0,0,0,1|1,0,1]=4 2188 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000225692_100000186546 [0,1,0,0,0,1|0,0,0]=2 2189 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000225692_100000186546 [0,1,0,0,0,1|0,0,0]=2 2190 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000225692_100000186546 [0,1,0,0,0,1|0,0,0]=2 2191 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1F)F 11a_100000225692_100000746133 [0,1,0,0,0,1|0,2,0]=4 2192 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1F)F 1626a_100000225692_100000746133 [0,1,0,0,0,1|0,2,0]=4 2193 B19R1.40579 C#CCN(C)C(=O)CCCOc1ccc(cc1F)F 527a_100000225692_100000746133 [0,1,0,0,0,1|0,2,0]=4 2194 B19R1.40579 C#CCN(C)C(=O)NCCOc1ccc(cc1C)Cl 2708a_100025744827_100000225692 [0,1,0,0,0,1|1,0,1]=4 2195 B19R1.40579 C#CCN(C)C(=O)NCCOc1ccc(cc1C)Cl 273464a_100025744827_100000225692 [0,1,0,0,0,1|1,0,1]=4 2196 B19R1.40579 C#CCN(C)C(=O)NCCOc1ccc(cc1Cl)F 2708a_100020586385_100000225692 [0,1,0,0,0,1|0,1,1]=4 2197 B19R1.40579 C#CCN(C)C(=O)NCCOc1ccc(cc1Cl)F 273464a_100020586385_100000225692 [0,1,0,0,0,1|0,1,1]=4 2198 B19R1.40579 C=CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000225617_100000186546 [0,1,0,0,0,1|0,0,2]=4 2199 B19R1.40579 C=CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000225617_100000186546 [0,1,0,0,0,1|0,0,2]=4 2200 B19R1.40579 C=CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000225617_100000186546 [0,1,0,0,0,1|0,0,2]=4 2201 B19R1.40579 C=CCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000225617_100000186546 [0,1,0,0,0,1|0,0,2]=4 2202 B19R1.40579 CC(CC#N)C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100009813641 [0,1,0,0,0,1|2,0,0]=4 2203 B19R1.40579 CCCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000747261_100000186546 [0,1,0,0,0,1|0,0,2]=4 2204 B19R1.40579 CCCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000747261_100000186546 [0,1,0,0,0,1|0,0,2]=4 2205 B19R1.40579 CCCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000747261_100000186546 [0,1,0,0,0,1|0,0,2]=4 2206 B19R1.40579 CCCN(C)C(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000747261_100000186546 [0,1,0,0,0,1|0,0,2]=4 2207 B19R1.40579 CN(CC#N)C(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000748184_100000186546 [0,1,0,0,0,1|1,0,0]=3 2208 B19R1.40579 CN(CC#N)C(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000748184_100000186546 [0,1,0,0,0,1|1,0,0]=3 2209 B19R1.40579 CN(CCO)C(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000210263_100000186546 [0,1,0,0,0,1|1,0,1]=4 2210 B19R1.40579 CN(CCO)C(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000210263_100000186546 [0,1,0,0,0,1|1,0,1]=4 2211 B19R1.356140 C#CCN(C)CCCOc1ccc(cc1OC)C=O 2230a_100000225692_200009813023 [0,2,0,0,0,0|2,0,0]=4 2212 B19R1.356140 C#CCN(C)CCCOc1ccc(cc1OC)C=O 34a_100000225692_200009813023 [0,2,0,0,0,0|2,0,0]=4 2213 B19R1.58855 C#CCN(CC)C(=O)CCOc1ccc(cc1Cl)F 1626a_100000744766_100000240429 [0,2,0,0,0,0|0,1,1]=4 2214 B19R1.58855 C#CCN(CC)C(=O)CCOc1ccc(cc1Cl)F 240690a_100000744766_100000240429 [0,2,0,0,0,0|0,1,1]=4 2215 B19R1.7164 C#CCCCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000731252 [0,2,0,0,0,0|2,0,0]=4 2216 B19R1.7164 C#CCCCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100000731252 [0,2,0,0,0,0|2,0,0]=4 2217 B19R1.7164 C#CCCCN(C)CCCOc1ccc(cc1C)C 269982a_100015183116_100011215417 [0,2,0,0,0,0|2,0,0]=4 2218 B19R1.7164 C#CCCCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000695029 [0,2,0,0,0,0|2,0,0]=4 2219 B19R1.7164 C#CCCNC(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000755551_100000186546 [0,2,0,0,0,0|2,0,0]=4 2220 B19R1.7164 C#CCCNC(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000755551_100000186546 [0,2,0,0,0,0|2,0,0]=4 2221 B19R1.7164 C#CCCNC(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000755551_100000186546 [0,2,0,0,0,0|2,0,0]=4 2222 B19R1.7164 C#CCCNC(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000755551_100000186546 [0,2,0,0,0,0|2,0,0]=4 2223 B19R1.7164 C#CCOCC(C)OCCOc1ccc(cc1Cl)Cl 34a_100011025554_100000184432 [0,2,0,0,0,0|2,0,0]=4 2224 B19R1.7164 C#CCOCC(C)OCCOc1ccc(cc1Cl)Cl 7a_100011025554_100000184432 [0,2,0,0,0,0|2,0,0]=4 2225 B19R1.7164 CC#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000685387_100000186546 [0,2,0,0,0,0|2,0,0]=4 2226 B19R1.7164 CC#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000685387_100000186546 [0,2,0,0,0,0|2,0,0]=4 2227 B19R1.7164 CC#CCNC(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000685387_100000186546 [0,2,0,0,0,0|2,0,0]=4 2228 B19R1.7164 CCC#CCC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100009813939 [0,2,0,0,0,0|2,0,0]=4 2229 B19R1.7164 CCC#CCC(C)OCCOc1ccc(cc1Cl)Cl 34a_200000035118_100000184432 [0,2,0,0,0,0|2,0,0]=4 2230 B19R1.7164 CCC#CCC(C)OCCOc1ccc(cc1Cl)Cl 7a_200000035118_100000184432 [0,2,0,0,0,0|2,0,0]=4 2231 B19R1.7164 CCC#CCN(C)CCCOc1ccc(cc1C)C 2230a_100015183116_100009813939 [0,2,0,0,0,0|2,0,0]=4 2232 B19R1.7164 CCC#CCN(C)CCCOc1ccc(cc1C)C 34a_100015183116_100009813939 [0,2,0,0,0,0|2,0,0]=4 2233 B19R1.7164 Cc1ccc(c(c1)C)OCCCN(C)CC#CCO 2230a_100015183116_200000047223 [0,2,0,0,0,0|2,0,0]=4 2234 B19R1.7164 Cc1ccc(c(c1)C)OCCCN(C)CC#CCO 34a_100015183116_200000047223 [0,2,0,0,0,0|2,0,0]=4 2235 B19R1.7164 O=C(CC#CCO)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200000047223 [0,2,0,0,0,0|2,0,0]=4 2236 B19R1.36958 C#CC(C)NC(=O)CCCOc1ccc(cc1Cl)Cl 11a_100000707721_100000186546 [0,2,0,0,0,0|2,0,0]=4 2237 B19R1.36958 C#CC(C)NC(=O)CCCOc1ccc(cc1Cl)Cl 1626a_100000707721_100000186546 [0,2,0,0,0,0|2,0,0]=4 2238 B19R1.36958 C#CC(C)NC(=O)CCCOc1ccc(cc1Cl)Cl 240690a_100000707721_100000186546 [0,2,0,0,0,0|2,0,0]=4 2239 B19R1.36958 C#CC(C)NC(=O)CCCOc1ccc(cc1Cl)Cl 527a_100000707721_100000186546 [0,2,0,0,0,0|2,0,0]=4 2240 B19R1.20346 C#CC(C)(C)C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_100000038118 [0,2,0,0,0,0|2,0,0]=4 2241 B19R1.20346 C#CC(C)(C)N(C)CCCOc1ccc(cc1C)C 34a_100015183116_100000038118 [0,2,0,0,0,0|2,0,0]=4 2242 B19R1.174489 C#CCC(CC)OCCOc1c(cc(cc1Cl)Cl)Cl 34a_200011217983_100011259511 [0,2,0,0,0,0|2,0,0]=4 2243 B19R1.174489 C#CCC(CC)OCCOc1c(cc(cc1Cl)Cl)Cl 7a_200011217983_100011259511 [0,2,0,0,0,0|2,0,0]=4 2244 B19R1.177101 C#CCN(CC)CCC(=O)Nc1ccc(cc1Cl)Cl 2230a_100000744766_200000181506 [0,2,0,0,0,0|1,0,1]=4 2245 B19R1.177101 C#CCN(CC)CCC(=O)Nc1ccc(cc1Cl)Cl 269982a_100000744766_200000181506 [0,2,0,0,0,0|1,0,1]=4 2246 B17R2.151 C#CCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100000038162 [1,0,0,1,0,0|0,0,0]=2 2247 B17R2.151 C#CCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100000184674 [1,0,0,1,0,0|0,0,0]=2 2248 B17R2.151 C#CCN1CCC(C1)Oc2ccc(cc2)F 2230a_100000700860_100000038162 [1,0,0,1,0,0|0,1,0]=3 2249 B17R2.151 C#CCN1CCC(C1)Oc2ccc(cc2)F 34a_100000700860_100000184674 [1,0,0,1,0,0|0,1,0]=3 2250 B17R2.151 C=CCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100000210623 [1,0,0,1,0,0|0,0,2]=4 2251 B17R2.151 C=CCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100000210623 [1,0,0,1,0,0|0,0,2]=4 2252 B17R2.151 C=CCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100015514636 [1,0,0,1,0,0|0,0,2]=4 2253 B17R2.151 CCCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100000210303 [1,0,0,1,0,0|0,0,2]=4 2254 B17R2.151 CCCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100000210303 [1,0,0,1,0,0|0,0,2]=4 2255 B17R2.151 CCCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100000210303 [1,0,0,1,0,0|0,0,2]=4 2256 B17R2.151 COCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100000766300 [1,0,0,1,0,0|1,0,1]=4 2257 B17R2.151 COCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100000766300 [1,0,0,1,0,0|1,0,1]=4 2258 B17R2.151 CSCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100011218213 [1,0,0,1,0,0|1,0,1]=4 2259 B17R2.151 CSCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100011218213 [1,0,0,1,0,0|1,0,1]=4 2260 B17R2.151 CSCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100011218213 [1,0,0,1,0,0|1,0,1]=4 2261 B17R2.151 FCCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100011217306 [1,0,0,1,0,0|1,0,1]=4 2262 B17R2.151 FCCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100011217306 [1,0,0,1,0,0|1,0,1]=4 2263 B17R2.151 FCCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100011217306 [1,0,0,1,0,0|1,0,1]=4 2264 B17R2.151 N#CCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100011215382 [1,0,0,1,0,0|1,0,0]=3 2265 B17R2.151 N#CCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100011214920 [1,0,0,1,0,0|1,0,0]=3 2266 B17R2.151 N#CCN1CCC(C1)Oc2ccc(cc2)F 2230a_100000700860_100011215382 [1,0,0,1,0,0|1,1,0]=4 2267 B17R2.151 N#CCN1CCC(C1)Oc2ccc(cc2)F 269982a_100000700860_100011214920 [1,0,0,1,0,0|1,1,0]=4 2268 B17R2.151 O=CCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_200015260668 [1,0,0,1,0,0|1,0,1]=4 2269 B17R2.151 O=CCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_200015260668 [1,0,0,1,0,0|1,0,1]=4 2270 B17R2.151 O=CCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_200009817547 [1,0,0,1,0,0|1,0,1]=4 2271 B17R2.151 OCCN1CCC(C1)Oc2ccc(cc2)Cl 2230a_100015196676_100000211926 [1,0,0,1,0,0|1,0,1]=4 2272 B17R2.151 OCCN1CCC(C1)Oc2ccc(cc2)Cl 269982a_100015196676_100000211926 [1,0,0,1,0,0|1,0,1]=4 2273 B17R2.151 OCCN1CCC(C1)Oc2ccc(cc2)Cl 34a_100015196676_100000211926 [1,0,0,1,0,0|1,0,1]=4 2274 B17R2.215 CN1CCCC(C1)COc2ccc(cc2)Cl 34a_100000210216_100015183302 [1,0,0,1,0,0|0,0,2]=4 2275 B17R2.215 CN1CCCC(C1)COc2ccc(cc2)Cl 7a_100000210216_100000752043 [1,0,0,1,0,0|0,0,2]=4 2276 B17R2.346 Clc1ccc(cc1)OCCCN2CCCC2 34a_100000210216_100016991639 [1,0,0,1,0,0|0,0,2]=4 2277 B17R2.346 Clc1ccc(cc1)OCCCN2CCCC2 7a_100000210216_100011445909 [1,0,0,1,0,0|0,0,2]=4 2278 B17R2.2461 C#CCN1CCC[C@H](C1)c2ccc(cc2)Br 2230a_106439422950_100000038162 [1,0,0,1,0,0|1,1,0]=4 2279 B17R2.2461 C#CCN1CCC[C@H](C1)c2ccc(cc2)Br 34a_106439422950_100000184674 [1,0,0,1,0,0|1,1,0]=4 2280 B17R2.3278 CN1CCCC1CCOc2ccc(cc2)Cl 34a_100000210216_100000005710 [1,0,0,1,0,0|0,0,2]=4 2281 B17R2.3278 CN1CCCC1CCOc2ccc(cc2)Cl 7a_100000210216_100000005710 [1,0,0,1,0,0|0,0,2]=4 2282 B17R2.56453 CN(CCCOc1ccc(cc1)Cl)C2CC2 269982a_100000225747_100000211595 [1,0,0,1,0,0|0,0,2]=4 2283 B17R2.56453 CN(CCCOc1ccc(cc1)Cl)C2CC2 34a_100000225747_100000211595 [1,0,0,1,0,0|0,0,2]=4 2284 B17R2.18267 C#CCN1CCC[C@@H]1c2ccc(cc2Cl)F 2230a_100138412352_100000038162 [1,0,0,1,0,0|1,1,0]=4 2285 B17R2.18267 C#CCN1CCC[C@@H]1c2ccc(cc2Cl)F 34a_100138412352_100000184674 [1,0,0,1,0,0|1,1,0]=4 2286 B17R2.54533 C#CCNC1CCOc2c1cc(cc2C)F 2230a_100012004503_100000038162 [1,0,0,1,0,0|1,1,0]=4 2287 B17R2.54533 C#CCNC1CCOc2c1cc(cc2C)F 34a_100012004503_100000184674 [1,0,0,1,0,0|1,1,0]=4 2288 B17R2.54533 C#CCNC1CCOc2c1cc(cc2Cl)F 2230a_100011382876_100000038162 [1,0,0,1,0,0|0,1,0]=3 2289 B17R2.54533 C#CCNC1CCOc2c1cc(cc2Cl)F 34a_100011382876_100000184674 [1,0,0,1,0,0|0,1,0]=3 2290 B17R2.54533 N#CCNC1CCOc2c1cc(cc2Cl)F 2230a_100011382876_100011215382 [1,0,0,1,0,0|1,1,0]=4 2291 B17R2.2159 C#CCN(C)CC1=Cc2ccccc2OC1 270004a_100000225692_100000013085 [1,0,0,1,0,0|1,0,1]=4 2292 B17R2.2159 C#CCN(C)CC1COc2ccccc2O1 2230a_100000225692_100011215957 [1,0,0,1,0,0|1,0,0]=3 2293 B17R2.2159 C#CCN(C)CC1COc2ccccc2O1 2230a_100000683454_100000038162 [1,0,0,1,0,0|1,0,0]=3 2294 B17R2.2159 C#CCN(C)CC1COc2ccccc2O1 34a_100000225692_100011215957 [1,0,0,1,0,0|1,0,0]=3 2295 B17R2.2159 C#CCN(C)CC1COc2ccccc2O1 34a_100000683454_100000184674 [1,0,0,1,0,0|1,0,0]=3 2296 B17R2.2159 CN(CC#N)CC1COc2ccccc2O1 2230a_100000683454_100011215382 [1,0,0,1,0,0|2,0,0]=4 2297 B17R2.2159 CN(CC#N)CC1COc2ccccc2O1 2230a_100000748184_100011215957 [1,0,0,1,0,0|2,0,0]=4 2298 B17R2.2159 CN(CC#N)CC1COc2ccccc2O1 269982a_100000683454_100011214920 [1,0,0,1,0,0|2,0,0]=4 2299 B17R2.3430 Clc1ccccc1OCCCN2CCCC2 34a_100000210172_100016991639 [1,0,0,1,0,0|0,0,2]=4 2300 B17R2.3430 Clc1ccccc1OCCCN2CCCC2 7a_100000210172_100011445909 [1,0,0,1,0,0|0,0,2]=4 2301 B17R2.3945 CN1CCCC1CCOc2ccccc2Cl 34a_100000210172_100000005710 [1,0,0,1,0,0|0,0,2]=4 2302 B17R2.3945 CN1CCCC1CCOc2ccccc2Cl 7a_100000210172_100000005710 [1,0,0,1,0,0|0,0,2]=4 2303 B17R2.20634 CN(CCCOc1ccccc1Cl)C2CC2 269982a_100011252689_100000211595 [1,0,0,1,0,0|0,0,2]=4 2304 B17R2.20634 CN(CCCOc1ccccc1Cl)C2CC2 34a_100011252689_100000211595 [1,0,0,1,0,0|0,0,2]=4 2305 B17R2.32216 C#CCN1CC(C1)OCc2ccccc2Cl 34a_100011749140_100000184674 [1,0,0,1,0,0|2,0,0]=4 2306 B17R2.41893 CN1CCCC(C1)COc2ccccc2Cl 34a_100000210172_100015183302 [1,0,0,1,0,0|0,0,2]=4 2307 B17R2.41893 CN1CCCC(C1)COc2ccccc2Cl 7a_100000210172_100000752043 [1,0,0,1,0,0|0,0,2]=4 2308 B17R2.3489 CN1CCC(C1)CNc2ccc(cc2Cl)Cl 34a_100000185861_200000690779 [1,0,0,1,0,0|1,0,1]=4 2309 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Br)Cl 34a_100000211998_200000690779 [1,0,0,1,0,0|0,1,1]=4 2310 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Br)Cl 7a_100000211998_200000690779 [1,0,0,1,0,0|0,1,1]=4 2311 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)Br 34a_100000186472_200000690779 [1,0,0,1,0,0|0,1,1]=4 2312 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)Br 7a_100000186472_200000690779 [1,0,0,1,0,0|0,1,1]=4 2313 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)Cl 34a_100015191787_200000690779 [1,0,0,1,0,0|0,0,1]=3 2314 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)Cl 7a_100015191787_200000690779 [1,0,0,1,0,0|0,0,1]=3 2315 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)F 34a_100000212004_200000690779 [1,0,0,1,0,0|0,1,1]=4 2316 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)F 7a_100000212004_200000690779 [1,0,0,1,0,0|0,1,1]=4 2317 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)I 34a_100012360047_200000690779 [1,0,0,1,0,0|0,1,1]=4 2318 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)I 7a_100012360047_200000690779 [1,0,0,1,0,0|0,1,1]=4 2319 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)N 34a_100000744943_200000690779 [1,0,0,1,0,0|1,0,1]=4 2320 B17R2.3489 CN1CCC(C1)COc2ccc(cc2Cl)N 7a_100000744943_200000690779 [1,0,0,1,0,0|1,0,1]=4 2321 B17R2.3489 CN1CCC(C1)COc2ccc(cc2F)Cl 34a_100000230166_200000690779 [1,0,0,1,0,0|0,1,1]=4 2322 B17R2.3489 CN1CCC(C1)COc2ccc(cc2F)Cl 7a_100000230166_200000690779 [1,0,0,1,0,0|0,1,1]=4 2323 B17R2.3489 CN1CCC(C1)COc2ccc(cc2I)Cl 34a_100011356953_200000690779 [1,0,0,1,0,0|0,1,1]=4 2324 B17R2.3489 CN1CCC(C1)COc2ccc(cc2I)Cl 7a_100011356953_200000690779 [1,0,0,1,0,0|0,1,1]=4 2325 B17R2.3489 CN1CCC(C1)COc2ccc(cc2N)Cl 34a_100000210500_200000690779 [1,0,0,1,0,0|1,0,1]=4 2326 B17R2.3489 CN1CCC(C1)COc2ccc(cc2N)Cl 7a_100000210500_200000690779 [1,0,0,1,0,0|1,0,1]=4 2327 B17R2.3489 CN1CCC(C1)COc2ccc(nc2Cl)Cl 34a_100000101165_200000690779 [1,0,0,1,0,0|1,0,1]=4 2328 B17R2.3489 CN1CCC(C1)COc2ccc(nc2Cl)Cl 7a_100000101165_200000690779 [1,0,0,1,0,0|1,0,1]=4 2329 B17R2.3489 CN1CCC(C1)COc2cnc(cc2Cl)Cl 34a_100009868576_200000690779 [1,0,0,1,0,0|1,0,1]=4 2330 B17R2.3489 CN1CCC(C1)COc2cnc(cc2Cl)Cl 7a_100009868576_200000690779 [1,0,0,1,0,0|1,0,1]=4 2331 B17R2.3489 CN1CCC(C1)CSc2ccc(cc2Cl)Cl 62a_100000699841_200000690779 [1,0,0,1,0,0|0,1,1]=4 2332 B17R2.3489 CN1CCC(C1)CSc2ccc(cc2Cl)Cl 62a_200000690779_100000699841 [1,0,0,1,0,0|0,1,1]=4 2333 B17R2.3489 Cc1cc(ccc1OCC2CCN(C2)C)Cl 34a_100000211091_200000690779 [1,0,0,1,0,0|1,0,1]=4 2334 B17R2.3489 Cc1cc(ccc1OCC2CCN(C2)C)Cl 7a_100000211091_200000690779 [1,0,0,1,0,0|1,0,1]=4 2335 B17R2.3489 Cc1ccc(c(c1)Cl)OCC2CCN(C2)C 34a_100000749699_200000690779 [1,0,0,1,0,0|1,0,1]=4 2336 B17R2.3489 Cc1ccc(c(c1)Cl)OCC2CCN(C2)C 7a_100000749699_200000690779 [1,0,0,1,0,0|1,0,1]=4 2337 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Br)Cl 7a_100000211998_200011861547 [1,0,0,1,0,0|0,1,1]=4 2338 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2C)Cl 7a_100000211091_200011861547 [1,0,0,1,0,0|1,0,1]=4 2339 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)Br 7a_100000186472_200011861547 [1,0,0,1,0,0|0,1,1]=4 2340 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)C 7a_100000749699_200011861547 [1,0,0,1,0,0|1,0,1]=4 2341 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)Cl 7a_100015191787_200011861547 [1,0,0,1,0,0|0,0,1]=3 2342 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)F 7a_100000212004_200011861547 [1,0,0,1,0,0|0,1,1]=4 2343 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)I 7a_100012360047_200011861547 [1,0,0,1,0,0|0,1,1]=4 2344 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2Cl)N 7a_100000744943_200011861547 [1,0,0,1,0,0|1,0,1]=4 2345 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2F)Cl 7a_100000230166_200011861547 [1,0,0,1,0,0|0,1,1]=4 2346 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2I)Cl 7a_100011356953_200011861547 [1,0,0,1,0,0|0,1,1]=4 2347 B17R2.10574 CCN1CCC(C1)Oc2ccc(cc2N)Cl 7a_100000210500_200011861547 [1,0,0,1,0,0|1,0,1]=4 2348 B17R2.10574 CCN1CCC(C1)Oc2ccc(nc2Cl)Cl 7a_100000101165_200011861547 [1,0,0,1,0,0|1,0,1]=4 2349 B17R2.10574 CCN1CCC(C1)Oc2cnc(cc2Cl)Cl 7a_100009868576_200011861547 [1,0,0,1,0,0|1,0,1]=4 2350 B17R2.10574 CCN1CCC(C1)Sc2ccc(cc2Cl)Cl 62a_100000699841_200011861547 [1,0,0,1,0,0|0,1,1]=4 2351 B17R2.157254 CN1CCC(C1=O)Oc2ccc(cc2Cl)Cl 34a_100015191787_100000755940 [1,0,0,1,0,0|1,0,1]=4 2352 B17R2.157254 CN1CCC(C1=O)Oc2ccc(cc2Cl)Cl 7a_100015191787_100000755940 [1,0,0,1,0,0|1,0,1]=4 2353 B17R2.2153 C#CCN(C)Cc1cc2cc(ccc2o1)Cl 270004a_100000225692_100012003054 [0,0,0,1,1,0|1,0,1]=4 2354 B17R2.2153 C#CCN(C)Cc1nc2cc(ccc2o1)Cl 2230a_100000225692_100011222916 [0,0,0,1,1,0|1,0,1]=4 2355 B17R2.6194 C#CCN(C)C1CCc2ccc(cc2C1)Br 270004a_100000225692_100010138410 [0,0,0,1,1,0|1,1,0]=4 2356 B17R2.6194 C#CCN(C)C1CCc2ccc(cc2C1)Cl 270004a_100000225692_100000117158 [0,0,0,1,1,0|1,0,0]=3 2357 B17R2.6194 C#CCN(C)C1CCc2ccc(cc2C1)O 270004a_100000225692_200000081095 [0,0,0,1,1,0|2,0,0]=4 2358 B17R2.20922 CC1CN(C1)CCCc2ccc(cc2Cl)Cl 270004a_100000702820_100000765304 [0,0,0,1,1,0|0,0,2]=4 2359 B17R2.20922 CC1CN(C1)CCOc2ccc(cc2Cl)Cl 2230a_100000702820_100000184432 [0,0,0,1,1,0|0,0,2]=4 2360 B17R2.20922 CC1CN(C1)CCOc2ccc(cc2Cl)Cl 269982a_100000702820_100000184432 [0,0,0,1,1,0|0,0,2]=4 2361 B17R2.20922 CC1CN(C1)CCOc2ccc(cc2Cl)Cl 34a_100000702820_100000184432 [0,0,0,1,1,0|0,0,2]=4 2362 B17R2.20922 FC1CN(C1)CCCc2ccc(cc2Cl)Cl 270004a_100000690557_100000765304 [0,0,0,1,1,0|1,0,1]=4 2363 B17R2.20922 FC1CN(C1)CCOc2ccc(cc2Cl)Cl 2230a_100000690557_100000184432 [0,0,0,1,1,0|1,0,1]=4 2364 B17R2.20922 FC1CN(C1)CCOc2ccc(cc2Cl)Cl 269982a_100000690557_100000184432 [0,0,0,1,1,0|1,0,1]=4 2365 B17R2.20922 FC1CN(C1)CCOc2ccc(cc2Cl)Cl 34a_100000690557_100000184432 [0,0,0,1,1,0|1,0,1]=4 2366 B17R2.20922 OC1CN(C1)CCOc2ccc(cc2Cl)Cl 269982a_100000749847_100000184432 [0,0,0,1,1,0|1,0,1]=4 2367 B17R2.32147 C#CCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100000184674 [0,0,0,1,1,0|0,0,0]=2 2368 B17R2.32147 C=CCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100000210623 [0,0,0,1,1,0|0,0,2]=4 2369 B17R2.32147 C=CCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100015514636 [0,0,0,1,1,0|0,0,2]=4 2370 B17R2.32147 CCCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100000210303 [0,0,0,1,1,0|0,0,2]=4 2371 B17R2.32147 CCCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100000210303 [0,0,0,1,1,0|0,0,2]=4 2372 B17R2.32147 COCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100000766300 [0,0,0,1,1,0|1,0,1]=4 2373 B17R2.32147 CSCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100011218213 [0,0,0,1,1,0|1,0,1]=4 2374 B17R2.32147 CSCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100011218213 [0,0,0,1,1,0|1,0,1]=4 2375 B17R2.32147 FCCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100011217306 [0,0,0,1,1,0|1,0,1]=4 2376 B17R2.32147 FCCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100011217306 [0,0,0,1,1,0|1,0,1]=4 2377 B17R2.32147 N#CCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100011214920 [0,0,0,1,1,0|1,0,0]=3 2378 B17R2.32147 O=CCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_200015260668 [0,0,0,1,1,0|1,0,1]=4 2379 B17R2.32147 O=CCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_200009817547 [0,0,0,1,1,0|1,0,1]=4 2380 B17R2.32147 OCCN1CC(C1)Oc2ccc(cc2Cl)Cl 269982a_200011749134_100000211926 [0,0,0,1,1,0|1,0,1]=4 2381 B17R2.32147 OCCN1CC(C1)Oc2ccc(cc2Cl)Cl 34a_200011749134_100000211926 [0,0,0,1,1,0|1,0,1]=4 2382 B17R2.157275 CN(CCCc1ccc(cc1Cl)Cl)C2CC2 270004a_100000226674_100000765304 [0,0,0,1,1,0|0,0,2]=4 2383 B17R2.157275 CN(CCOc1ccc(cc1Cl)Cl)C2CC2 2230a_100000226674_100000184432 [0,0,0,1,1,0|0,0,2]=4 2384 B17R2.157275 CN(CCOc1ccc(cc1Cl)Cl)C2CC2 269982a_100000226674_100000184432 [0,0,0,1,1,0|0,0,2]=4 2385 B19R2.50784 Clc1ccc(c(c1)Cl)COCCCN2CCCC2 34a_100000215721_100016991639 [0,0,0,1,0,1|0,0,2]=4 2386 B19R2.50784 Clc1ccc(c(c1)Cl)COCCCN2CCCC2 7a_100000215721_100011445909 [0,0,0,1,0,1|0,0,2]=4 2387 B19R2.79566 N#CCC1CN(C1)CCOc2ccc(cc2Cl)Cl 269982a_206645079572_100000184432 [0,0,0,1,0,1|2,0,0]=4 2388 B19R2.83134 C#CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100000038162 [0,0,0,1,0,1|0,0,0]=2 2389 B19R2.83134 C#CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100000184674 [0,0,0,1,0,1|0,0,0]=2 2390 B19R2.83134 C=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100000210623 [0,0,0,1,0,1|0,0,2]=4 2391 B19R2.83134 C=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100000210623 [0,0,0,1,0,1|0,0,2]=4 2392 B19R2.83134 C=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100015514636 [0,0,0,1,0,1|0,0,2]=4 2393 B19R2.83134 CCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100000210303 [0,0,0,1,0,1|0,0,2]=4 2394 B19R2.83134 CCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100000210303 [0,0,0,1,0,1|0,0,2]=4 2395 B19R2.83134 CCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100000210303 [0,0,0,1,0,1|0,0,2]=4 2396 B19R2.83134 COCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100000766300 [0,0,0,1,0,1|1,0,1]=4 2397 B19R2.83134 COCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100000766300 [0,0,0,1,0,1|1,0,1]=4 2398 B19R2.83134 CSCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100011218213 [0,0,0,1,0,1|1,0,1]=4 2399 B19R2.83134 CSCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100011218213 [0,0,0,1,0,1|1,0,1]=4 2400 B19R2.83134 CSCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100011218213 [0,0,0,1,0,1|1,0,1]=4 2401 B19R2.83134 FCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100011217306 [0,0,0,1,0,1|1,0,1]=4 2402 B19R2.83134 FCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100011217306 [0,0,0,1,0,1|1,0,1]=4 2403 B19R2.83134 FCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100011217306 [0,0,0,1,0,1|1,0,1]=4 2404 B19R2.83134 N#CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100011215382 [0,0,0,1,0,1|1,0,0]=3 2405 B19R2.83134 N#CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100011214920 [0,0,0,1,0,1|1,0,0]=3 2406 B19R2.83134 O=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_200015260668 [0,0,0,1,0,1|1,0,1]=4 2407 B19R2.83134 O=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_200015260668 [0,0,0,1,0,1|1,0,1]=4 2408 B19R2.83134 O=CCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_200009817547 [0,0,0,1,0,1|1,0,1]=4 2409 B19R2.83134 OCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 2230a_200016988960_100000211926 [0,0,0,1,0,1|1,0,1]=4 2410 B19R2.83134 OCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 269982a_200016988960_100000211926 [0,0,0,1,0,1|1,0,1]=4 2411 B19R2.83134 OCCN1CCC(C1)OCc2ccc(cc2Cl)Cl 34a_200016988960_100000211926 [0,0,0,1,0,1|1,0,1]=4 2412 B19R2.101610 CN1CCCC(C1)COCc2ccc(cc2Cl)Cl 34a_100000215721_100015183302 [0,0,0,1,0,1|0,0,2]=4 2413 B19R2.101610 CN1CCCC(C1)COCc2ccc(cc2Cl)Cl 7a_100000215721_100000752043 [0,0,0,1,0,1|0,0,2]=4 2414 B19R2.103333 CN1CCCC1CCOCc2ccc(cc2Cl)Cl 34a_100000215721_100000005710 [0,0,0,1,0,1|0,0,2]=4 2415 B19R2.103333 CN1CCCC1CCOCc2ccc(cc2Cl)Cl 34a_100011215177_100000188473 [0,0,0,1,0,1|0,0,2]=4 2416 B19R2.103333 CN1CCCC1CCOCc2ccc(cc2Cl)Cl 7a_100000215721_100000005710 [0,0,0,1,0,1|0,0,2]=4 2417 B19R2.103333 CN1CCCC1CCOCc2ccc(cc2Cl)Cl 7a_100011215177_100000188473 [0,0,0,1,0,1|0,0,2]=4 2418 B19R2.1704780 C#CCN(C)CC1=Cc2cc(cc(c2OC1)Cl)Cl 270004a_100000225692_100000025532 [0,1,0,1,0,0|0,0,1]=3 2419 B19R2.51016 CN1CCCCC1CCOc2ccc(cc2Cl)Cl 34a_100015191787_100000211948 [0,1,0,1,0,0|0,0,2]=4 2420 B19R2.51016 CN1CCCCC1CCOc2ccc(cc2Cl)Cl 7a_100015191787_100000211948 [0,1,0,1,0,0|0,0,2]=4 2421 B19R2.6495735 C#CCN(C)C(=O)C1CC1c2ccc(cc2Cl)Cl 11a_100000225692_200000753209 [0,1,0,1,0,0|1,0,1]=4 2422 B19R2.6495735 C#CCN(C)C(=O)C1CC1c2ccc(cc2Cl)Cl 527a_100000225692_200000753209 [0,1,0,1,0,0|1,0,1]=4 2423 B19R2.4547 Clc1ccc(c(c1)Cl)OCCCN2CCCCC2 34a_100015191787_100000690320 [0,1,0,1,0,0|0,0,2]=4 2424 B19R2.4547 Clc1ccc(c(c1)Cl)OCCCN2CCCCC2 7a_100015191787_100000007876 [0,1,0,1,0,0|0,0,2]=4 2425 B19R2.4547 Clc1ccc(c(c1)Cl)OCCCN2CCOCC2 34a_100015191787_100000748698 [0,1,0,1,0,0|0,0,2]=4 2426 B19R2.4547 Clc1ccc(c(c1)Cl)OCCCN2CCOCC2 7a_100015191787_100000748698 [0,1,0,1,0,0|0,0,2]=4 2427 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)Br 34a_100010203734_100000005710 [0,1,0,1,0,0|0,0,2]=4 2428 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)Br 7a_100010203734_100000005710 [0,1,0,1,0,0|0,0,2]=4 2429 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)Cl 34a_100000211312_100000005710 [0,1,0,1,0,0|0,0,2]=4 2430 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)Cl 7a_100000211312_100000005710 [0,1,0,1,0,0|0,0,2]=4 2431 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)N 34a_100000037174_100000005710 [0,1,0,1,0,0|0,0,2]=4 2432 B19R2.584345 CN1CCCC1CCOc2cc(c(cc2Cl)Cl)N 7a_100000037174_100000005710 [0,1,0,1,0,0|0,0,2]=4 2433 B19R2.584345 Cc1cc(c(cc1Cl)Cl)OCCC2CCCN2C 34a_100012002691_100000005710 [0,1,0,1,0,0|0,0,2]=4 2434 B19R2.584345 Cc1cc(c(cc1Cl)Cl)OCCC2CCCN2C 7a_100012002691_100000005710 [0,1,0,1,0,0|0,0,2]=4 2435 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)Br 34a_100010203734_100015183302 [0,1,0,1,0,0|0,0,2]=4 2436 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)Br 7a_100010203734_100000752043 [0,1,0,1,0,0|0,0,2]=4 2437 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)Cl 34a_100000211312_100015183302 [0,1,0,1,0,0|0,0,2]=4 2438 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)Cl 7a_100000211312_100000752043 [0,1,0,1,0,0|0,0,2]=4 2439 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)N 34a_100000037174_100015183302 [0,1,0,1,0,0|0,0,2]=4 2440 B19R2.956441 CN1CCCC(C1)COc2cc(c(cc2Cl)Cl)N 7a_100000037174_100000752043 [0,1,0,1,0,0|0,0,2]=4 2441 B19R2.956441 Cc1cc(c(cc1Cl)Cl)OCC2CCCN(C2)C 34a_100012002691_100015183302 [0,1,0,1,0,0|0,0,2]=4 2442 B19R2.956441 Cc1cc(c(cc1Cl)Cl)OCC2CCCN(C2)C 7a_100012002691_100000752043 [0,1,0,1,0,0|0,0,2]=4 2443 B19R2.964435 Cc1cc(c(cc1Cl)Cl)OCCCN2CCCC2 34a_100012002691_100016991639 [0,1,0,1,0,0|0,0,2]=4 2444 B19R2.964435 Cc1cc(c(cc1Cl)Cl)OCCCN2CCCC2 7a_100012002691_100011445909 [0,1,0,1,0,0|0,0,2]=4 2445 B19R2.964435 Clc1cc(c(cc1Br)OCCCN2CCCC2)Cl 34a_100010203734_100016991639 [0,1,0,1,0,0|0,0,2]=4 2446 B19R2.964435 Clc1cc(c(cc1Br)OCCCN2CCCC2)Cl 7a_100010203734_100011445909 [0,1,0,1,0,0|0,0,2]=4 2447 B19R2.964435 Clc1cc(c(cc1Cl)OCCCN2CCCC2)Cl 34a_100000211312_100016991639 [0,1,0,1,0,0|0,0,2]=4 2448 B19R2.964435 Clc1cc(c(cc1Cl)OCCCN2CCCC2)Cl 7a_100000211312_100011445909 [0,1,0,1,0,0|0,0,2]=4 2449 B19R2.964435 Nc1cc(c(cc1Cl)Cl)OCCCN2CCCC2 34a_100000037174_100016991639 [0,1,0,1,0,0|0,0,2]=4 2450 B19R2.964435 Nc1cc(c(cc1Cl)Cl)OCCCN2CCCC2 7a_100000037174_100011445909 [0,1,0,1,0,0|0,0,2]=4 2451 B19R2.51575 CN1CCCC1CCOc2ccc(c(c2Cl)Cl)Cl 34a_200011215298_100000005710 [0,1,0,1,0,0|0,0,2]=4 2452 B19R2.51575 CN1CCCC1CCOc2ccc(c(c2Cl)Cl)Cl 7a_200011215298_100000005710 [0,1,0,1,0,0|0,0,2]=4 2453 B19R2.51575 CN1CCCC1CCOc2ccc(c(c2Cl)N)Cl 34a_100016988457_100000005710 [0,1,0,1,0,0|0,0,2]=4 2454 B19R2.51575 CN1CCCC1CCOc2ccc(c(c2Cl)N)Cl 7a_100016988457_100000005710 [0,1,0,1,0,0|0,0,2]=4 2455 B19R2.101664 CN1CCCC(C1)COc2ccc(c(c2Cl)Cl)Cl 34a_200011215298_100015183302 [0,1,0,1,0,0|0,0,2]=4 2456 B19R2.101664 CN1CCCC(C1)COc2ccc(c(c2Cl)Cl)Cl 7a_200011215298_100000752043 [0,1,0,1,0,0|0,0,2]=4 2457 B19R2.101664 CN1CCCC(C1)COc2ccc(c(c2Cl)N)Cl 34a_100016988457_100015183302 [0,1,0,1,0,0|0,0,2]=4 2458 B19R2.101664 CN1CCCC(C1)COc2ccc(c(c2Cl)N)Cl 7a_100016988457_100000752043 [0,1,0,1,0,0|0,0,2]=4 2459 B19R2.103126 Clc1ccc(c(c1Cl)Cl)OCCCN2CCCC2 34a_200011215298_100016991639 [0,1,0,1,0,0|0,0,2]=4 2460 B19R2.103126 Clc1ccc(c(c1Cl)Cl)OCCCN2CCCC2 7a_200011215298_100011445909 [0,1,0,1,0,0|0,0,2]=4 2461 B19R2.103126 Nc1c(ccc(c1Cl)OCCCN2CCCC2)Cl 34a_100016988457_100016991639 [0,1,0,1,0,0|0,0,2]=4 2462 B19R2.103126 Nc1c(ccc(c1Cl)OCCCN2CCCC2)Cl 7a_100016988457_100011445909 [0,1,0,1,0,0|0,0,2]=4 2463 B19R2.25790 C#CCN(CC)CC1=Cc2cc(ccc2OC1)Cl 270004a_100000744766_100000024079 [0,1,0,1,0,0|1,0,1]=4 2464 B19R2.47078 C#CCN1CCC(CC1)Oc2ccc(cc2F)F 2230a_100000741140_100000038162 [0,1,0,1,0,0|0,2,0]=4 2465 B19R2.47078 C#CCN1CCC(CC1)Oc2ccc(cc2F)F 34a_100000741140_100000184674 [0,1,0,1,0,0|0,2,0]=4 2466 B19R2.47078 C#CCN1CCN(CC1)Cc2ccc(cc2Cl)Cl 2230a_100000246090_100000038162 [0,1,0,1,0,0|2,0,0]=4 2467 B19R2.47078 C#CCN1CCN(CC1)Cc2ccc(cc2Cl)Cl 2230a_100000739959_100000188473 [0,1,0,1,0,0|2,0,0]=4 2468 B19R2.47078 C#CCN1CCN(CC1)Cc2ccc(cc2Cl)Cl 269982a_100000739959_100000188473 [0,1,0,1,0,0|2,0,0]=4 2469 B19R2.47078 C#CCN1CCN(CC1)Cc2ccc(cc2Cl)Cl 26a_100000739959_100015191787 [0,1,0,1,0,0|2,0,0]=4 2470 B19R2.47078 C#CCN1CCN(CC1)Cc2ccc(cc2Cl)Cl 270004a_100000739959_100000188887 [0,1,0,1,0,0|2,0,0]=4 2471 B19R2.228698 Cc1cc(cc(c1OCCCN2CCCC2)Cl)Cl 34a_100011218458_100016991639 [0,1,0,1,0,0|0,0,2]=4 2472 B19R2.228698 Cc1cc(cc(c1OCCCN2CCCC2)Cl)Cl 7a_100011218458_100011445909 [0,1,0,1,0,0|0,0,2]=4 2473 B19R2.228698 Clc1cc(c(c(c1)Br)OCCCN2CCCC2)Cl 34a_200000243811_100016991639 [0,1,0,1,0,0|0,0,2]=4 2474 B19R2.228698 Clc1cc(c(c(c1)Br)OCCCN2CCCC2)Cl 7a_200000243811_100011445909 [0,1,0,1,0,0|0,0,2]=4 2475 B19R2.228698 Clc1cc(c(c(c1)Cl)OCCCN2CCCC2)Cl 34a_100000210218_100016991639 [0,1,0,1,0,0|0,0,2]=4 2476 B19R2.228698 Clc1cc(c(c(c1)Cl)OCCCN2CCCC2)Cl 7a_100000210218_100011445909 [0,1,0,1,0,0|0,0,2]=4 2477 B19R2.228698 Clc1cc(c(c(c1)I)OCCCN2CCCC2)Cl 34a_200012339341_100016991639 [0,1,0,1,0,0|0,0,2]=4 2478 B19R2.228698 Clc1cc(c(c(c1)I)OCCCN2CCCC2)Cl 7a_200012339341_100011445909 [0,1,0,1,0,0|0,0,2]=4 2479 B19R2.228698 Nc1cc(cc(c1OCCCN2CCCC2)Cl)Cl 34a_100000695819_100016991639 [0,1,0,1,0,0|0,0,2]=4 2480 B19R2.228698 Nc1cc(cc(c1OCCCN2CCCC2)Cl)Cl 7a_100000695819_100011445909 [0,1,0,1,0,0|0,0,2]=4 2481 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Br)Cl)Cl 34a_200000243811_100000005710 [0,1,0,1,0,0|0,0,2]=4 2482 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Br)Cl)Cl 7a_200000243811_100000005710 [0,1,0,1,0,0|0,0,2]=4 2483 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Cl)Cl)Cl 34a_100000210218_100000005710 [0,1,0,1,0,0|0,0,2]=4 2484 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Cl)Cl)Cl 7a_100000210218_100000005710 [0,1,0,1,0,0|0,0,2]=4 2485 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Cl)Cl)N 34a_100000695819_100000005710 [0,1,0,1,0,0|0,0,2]=4 2486 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2Cl)Cl)N 7a_100000695819_100000005710 [0,1,0,1,0,0|0,0,2]=4 2487 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2I)Cl)Cl 34a_200012339341_100000005710 [0,1,0,1,0,0|0,0,2]=4 2488 B19R2.510479 CN1CCCC1CCOc2c(cc(cc2I)Cl)Cl 7a_200012339341_100000005710 [0,1,0,1,0,0|0,0,2]=4 2489 B19R2.510479 Cc1cc(cc(c1OCCC2CCCN2C)Cl)Cl 34a_100011218458_100000005710 [0,1,0,1,0,0|0,0,2]=4 2490 B19R2.510479 Cc1cc(cc(c1OCCC2CCCN2C)Cl)Cl 7a_100011218458_100000005710 [0,1,0,1,0,0|0,0,2]=4 2491 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Br)Cl)Cl 34a_200000243811_100015183302 [0,1,0,1,0,0|0,0,2]=4 2492 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Br)Cl)Cl 7a_200000243811_100000752043 [0,1,0,1,0,0|0,0,2]=4 2493 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Cl)Cl)Cl 34a_100000210218_100015183302 [0,1,0,1,0,0|0,0,2]=4 2494 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Cl)Cl)Cl 7a_100000210218_100000752043 [0,1,0,1,0,0|0,0,2]=4 2495 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Cl)Cl)N 34a_100000695819_100015183302 [0,1,0,1,0,0|0,0,2]=4 2496 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2Cl)Cl)N 7a_100000695819_100000752043 [0,1,0,1,0,0|0,0,2]=4 2497 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2I)Cl)Cl 34a_200012339341_100015183302 [0,1,0,1,0,0|0,0,2]=4 2498 B19R2.957180 CN1CCCC(C1)COc2c(cc(cc2I)Cl)Cl 7a_200012339341_100000752043 [0,1,0,1,0,0|0,0,2]=4 2499 B19R2.957180 Cc1cc(cc(c1OCC2CCCN(C2)C)Cl)Cl 34a_100011218458_100015183302 [0,1,0,1,0,0|0,0,2]=4 2500 B19R2.957180 Cc1cc(cc(c1OCC2CCCN(C2)C)Cl)Cl 7a_100011218458_100000752043 [0,1,0,1,0,0|0,0,2]=4 2501 B15R1.11 C#CCC(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_100000184674 [1,0,0,0,1,0|2,0,0]=4 2502 B15R1.11 C#CCC(=O)CCCc1ccc(cc1)Cl 1458a_100011220946_100000759440 [1,0,0,0,1,0|2,0,0]=4 2503 B15R1.11 C#CCC(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_100000184674 [1,0,0,0,1,0|2,0,0]=4 2504 B15R1.11 C#CCC(=O)CCOc1ccc(cc1)Cl 1458a_100011220946_100000184122 [1,0,0,0,1,0|2,0,0]=4 2505 B15R1.11 C#CCC(C)OCCc1ccc(cc1)Cl 34a_100000685586_100011713675 [1,0,0,0,1,0|2,0,0]=4 2506 B15R1.11 C#CCC(C)OCCc1ccc(cc1)Cl 7a_100000685586_100011713675 [1,0,0,0,1,0|2,0,0]=4 2507 B15R1.11 C#CCN(C)CC=Cc1ccc(cc1)Cl 270004a_100000225692_100102525842 [1,0,0,0,1,0|0,0,2]=4 2508 B15R1.11 C#CCN(C)CCCc1ccc(cc1)Br 2230a_100000225692_100011713682 [1,0,0,0,1,0|0,1,0]=3 2509 B15R1.11 C#CCN(C)CCCc1ccc(cc1)Br 34a_100000225692_100011713682 [1,0,0,0,1,0|0,1,0]=3 2510 B15R1.11 C#CCN(C)CCCc1ccc(cc1)Cl 2230a_100000225692_100000759440 [1,0,0,0,1,0|0,0,0]=2 2511 B15R1.11 C#CCN(C)CCCc1ccc(cc1)Cl 34a_100000225692_100000759440 [1,0,0,0,1,0|0,0,0]=2 2512 B15R1.11 C#CCN(C)CCCc1ccc(cc1)F 2230a_100000225692_200011713563 [1,0,0,0,1,0|0,1,0]=3 2513 B15R1.11 C#CCN(C)CCCc1ccc(cc1)F 34a_100000225692_200011713563 [1,0,0,0,1,0|0,1,0]=3 2514 B15R1.11 C#CCN(C)CCOc1ccc(cc1)Br 2230a_100000225692_100000183278 [1,0,0,0,1,0|0,1,0]=3 2515 B15R1.11 C#CCN(C)CCOc1ccc(cc1)Br 34a_100000225692_100000183278 [1,0,0,0,1,0|0,1,0]=3 2516 B15R1.11 C#CCN(C)CCOc1ccc(cc1)C 2230a_100000225692_100000183172 [1,0,0,0,1,0|1,0,0]=3 2517 B15R1.11 C#CCN(C)CCOc1ccc(cc1)C 2230a_100015185911_100000038162 [1,0,0,0,1,0|1,0,0]=3 2518 B15R1.11 C#CCN(C)CCOc1ccc(cc1)C 34a_100000225692_100000183172 [1,0,0,0,1,0|1,0,0]=3 2519 B15R1.11 C#CCN(C)CCOc1ccc(cc1)C 34a_100015185911_100000184674 [1,0,0,0,1,0|1,0,0]=3 2520 B15R1.11 C#CCN(C)CCOc1ccc(cc1)Cl 2230a_100000225692_100000184122 [1,0,0,0,1,0|0,0,0]=2 2521 B15R1.11 C#CCN(C)CCOc1ccc(cc1)Cl 34a_100000225692_100000184122 [1,0,0,0,1,0|0,0,0]=2 2522 B15R1.11 C#CCN(C)CCOc1ccc(cc1)F 2230a_100000225692_100000184936 [1,0,0,0,1,0|0,1,0]=3 2523 B15R1.11 C#CCN(C)CCOc1ccc(cc1)F 34a_100000225692_100000184936 [1,0,0,0,1,0|0,1,0]=3 2524 B15R1.11 C#CCN(C)CCSc1ccc(cc1)C 2230a_100015185158_100000038162 [1,0,0,0,1,0|1,1,0]=4 2525 B15R1.11 C=CCN(C)CCCc1ccc(cc1)Cl 2230a_100000225617_100000759440 [1,0,0,0,1,0|0,0,2]=4 2526 B15R1.11 C=CCN(C)CCCc1ccc(cc1)Cl 269982a_100000225617_100000759440 [1,0,0,0,1,0|0,0,2]=4 2527 B15R1.11 C=CCN(C)CCOc1ccc(cc1)Cl 2230a_100000225617_100000184122 [1,0,0,0,1,0|0,0,2]=4 2528 B15R1.11 C=CCN(C)CCOc1ccc(cc1)Cl 269982a_100000225617_100000184122 [1,0,0,0,1,0|0,0,2]=4 2529 B15R1.11 CCCN(C)CCCc1ccc(cc1)Cl 2230a_100000747261_100000759440 [1,0,0,0,1,0|0,0,2]=4 2530 B15R1.11 CCCN(C)CCCc1ccc(cc1)Cl 269982a_100000747261_100000759440 [1,0,0,0,1,0|0,0,2]=4 2531 B15R1.11 CCCN(C)CCOc1ccc(cc1)Cl 2230a_100000747261_100000184122 [1,0,0,0,1,0|0,0,2]=4 2532 B15R1.11 CCCN(C)CCOc1ccc(cc1)Cl 269982a_100000747261_100000184122 [1,0,0,0,1,0|0,0,2]=4 2533 B15R1.11 CN(CC#N)CCCc1ccc(cc1)Br 2230a_100000748184_100011713682 [1,0,0,0,1,0|1,1,0]=4 2534 B15R1.11 CN(CC#N)CCCc1ccc(cc1)Cl 2230a_100000748184_100000759440 [1,0,0,0,1,0|1,0,0]=3 2535 B15R1.11 CN(CC#N)CCCc1ccc(cc1)F 2230a_100000748184_200011713563 [1,0,0,0,1,0|1,1,0]=4 2536 B15R1.11 CN(CC#N)CCOc1ccc(cc1)Br 2230a_100000748184_100000183278 [1,0,0,0,1,0|1,1,0]=4 2537 B15R1.11 CN(CC#N)CCOc1ccc(cc1)Cl 2230a_100000748184_100000184122 [1,0,0,0,1,0|1,0,0]=3 2538 B15R1.11 CN(CC#N)CCOc1ccc(cc1)F 2230a_100000748184_100000184936 [1,0,0,0,1,0|1,1,0]=4 2539 B15R1.11 CN(CCO)CCCc1ccc(cc1)Cl 2230a_100000210263_100000759440 [1,0,0,0,1,0|1,0,1]=4 2540 B15R1.11 CN(CCO)CCCc1ccc(cc1)Cl 269982a_100000210263_100000759440 [1,0,0,0,1,0|1,0,1]=4 2541 B15R1.11 CN(CCO)CCOc1ccc(cc1)Cl 2230a_100000210263_100000184122 [1,0,0,0,1,0|1,0,1]=4 2542 B15R1.11 CN(CCO)CCOc1ccc(cc1)Cl 2230a_100015184113_200000210301 [1,0,0,0,1,0|1,0,1]=4 2543 B15R1.11 CN(CCO)CCOc1ccc(cc1)Cl 269982a_100000210263_100000184122 [1,0,0,0,1,0|1,0,1]=4 2544 B15R1.11 CN(CCO)CCOc1ccc(cc1)Cl 269982a_100015184113_200000210301 [1,0,0,0,1,0|1,0,1]=4 2545 B15R1.11 CN(CCO)CCOc1ccc(cc1)Cl 34a_100015184113_200000210301 [1,0,0,0,1,0|1,0,1]=4 2546 B15R1.11 Cc1ccc(cc1)OCCN(C)CC#N 2230a_100000748184_100000183172 [1,0,0,0,1,0|2,0,0]=4 2547 B15R1.11 Cc1ccc(cc1)OCCN(C)CC#N 2230a_100015185911_100011215382 [1,0,0,0,1,0|2,0,0]=4 2548 B15R1.11 Cc1ccc(cc1)OCCN(C)CC#N 269982a_100015185911_100011214920 [1,0,0,0,1,0|2,0,0]=4 2549 B15R1.11 [13CH3]N(CCO)CCOc1ccc(cc1)Cl 2230a_100015184113_200025704644 [1,0,0,0,1,0|1,0,1]=4 2550 B15R1.11 [13CH3]N(CCO)CCOc1ccc(cc1)Cl 269982a_100015184113_200025704644 [1,0,0,0,1,0|1,0,1]=4 2551 B15R1.11 [13CH3]N(CCO)CCOc1ccc(cc1)Cl 34a_100015184113_200025704644 [1,0,0,0,1,0|1,0,1]=4 2552 B15R1.1252 C#CCC(=O)CCCc1ccccc1Cl 1458a_100000700343_100000184674 [1,0,0,0,1,0|2,0,0]=4 2553 B15R1.1252 C#CCC(=O)CCOc1ccccc1Cl 1458a_100000240438_100000184674 [1,0,0,0,1,0|2,0,0]=4 2554 B15R1.1252 C#CCC(C)OCCc1ccccc1Cl 34a_100000685586_100011713703 [1,0,0,0,1,0|2,0,0]=4 2555 B15R1.1252 C#CCC(C)OCCc1ccccc1Cl 7a_100000685586_100011713703 [1,0,0,0,1,0|2,0,0]=4 2556 B15R1.1252 C#CCN(C)CC=Cc1ccccc1Cl 270004a_100000225692_200102525841 [1,0,0,0,1,0|0,0,2]=4 2557 B15R1.1252 C#CCN(C)CCCc1ccccc1Br 2230a_100000225692_200011713681 [1,0,0,0,1,0|0,1,0]=3 2558 B15R1.1252 C#CCN(C)CCCc1ccccc1Br 34a_100000225692_200011713681 [1,0,0,0,1,0|0,1,0]=3 2559 B15R1.1252 C#CCN(C)CCOc1ccccc1Br 2230a_100000225692_100000695877 [1,0,0,0,1,0|0,1,0]=3 2560 B15R1.1252 C#CCN(C)CCOc1ccccc1Br 34a_100000225692_100000695877 [1,0,0,0,1,0|0,1,0]=3 2561 B15R1.1252 C#CCN(C)CCOc1ccccc1C 2230a_100000225692_100000184434 [1,0,0,0,1,0|1,0,0]=3 2562 B15R1.1252 C#CCN(C)CCOc1ccccc1C 34a_100000225692_100000184434 [1,0,0,0,1,0|1,0,0]=3 2563 B15R1.1252 C#CCN(C)CCOc1ccccc1F 2230a_100000225692_100000183290 [1,0,0,0,1,0|0,1,0]=3 2564 B15R1.1252 C#CCN(C)CCOc1ccccc1F 34a_100000225692_100000183290 [1,0,0,0,1,0|0,1,0]=3 2565 B15R1.1252 CN(CC#N)CCCc1ccccc1Br 2230a_100000748184_200011713681 [1,0,0,0,1,0|1,1,0]=4 2566 B15R1.1252 CN(CC#N)CCOc1ccccc1Br 2230a_100000748184_100000695877 [1,0,0,0,1,0|1,1,0]=4 2567 B15R1.1252 CN(CC#N)CCOc1ccccc1F 2230a_100000748184_100000183290 [1,0,0,0,1,0|1,1,0]=4 2568 B15R1.1252 Cc1ccccc1OCCN(C)CC#N 2230a_100000748184_100000184434 [1,0,0,0,1,0|2,0,0]=4 2569 B15R1.3836 C#CC(=O)CCOc1ccc(cc1Cl)Cl 1458a_100000211873_100000184432 [1,0,0,0,1,0|2,0,0]=4 2570 B15R1.3836 C#CC(C)NCCc1ccc(cc1Cl)Cl 2230a_100000707721_200012161198 [1,0,0,0,1,0|2,0,0]=4 2571 B15R1.3836 C#CC(C)NCCc1ccc(cc1Cl)Cl 34a_100000210994_200000035995 [1,0,0,0,1,0|2,0,0]=4 2572 B15R1.3836 C#CC(C)NCCc1ccc(cc1Cl)Cl 34a_100000707721_200012161198 [1,0,0,0,1,0|2,0,0]=4 2573 B15R1.3836 C#CC(C)OCCc1ccc(cc1Cl)Cl 34a_100011215701_200000035995 [1,0,0,0,1,0|2,0,0]=4 2574 B15R1.3836 C#CC(C)SCCc1ccc(cc1Cl)Cl 62a_200000035995_200012161198 [1,0,0,0,1,0|2,0,0]=4 2575 B15R1.3836 C#C[C@@H](C)OCCc1ccc(cc1Cl)Cl 34a_100009815206_200012161198 [1,0,0,0,1,0|2,0,0]=4 2576 B15R1.3836 C#C[C@@H](C)OCCc1ccc(cc1Cl)Cl 7a_100009815206_200012161198 [1,0,0,0,1,0|2,0,0]=4 2577 B15R1.3836 CCN(C)CCOc1ccc(cc1Br)Cl 2230a_100000225621_100000199037 [1,0,0,0,1,0|0,1,1]=4 2578 B15R1.3836 CCN(C)CCOc1ccc(cc1Br)Cl 269982a_100000225621_100000199037 [1,0,0,0,1,0|0,1,1]=4 2579 B15R1.3836 CCN(C)CCOc1ccc(cc1Cl)Cl 2230a_100000225621_100000184432 [1,0,0,0,1,0|0,0,1]=3 2580 B15R1.3836 CCN(C)CCOc1ccc(cc1Cl)Cl 269982a_100000225621_100000184432 [1,0,0,0,1,0|0,0,1]=3 2581 B15R1.791 C#CCC(=O)CCc1ccc(cc1Cl)Cl 1458a_100000736762_100000184674 [0,0,0,0,2,0|2,0,0]=4 2582 B15R1.791 C#CCC(=O)CCc1ccc(cc1Cl)Cl 1458a_100011220946_200012161198 [0,0,0,0,2,0|2,0,0]=4 2583 B15R1.791 C#CCC(=O)COc1ccc(cc1Cl)Cl 1458a_100102647096_100000184674 [0,0,0,0,2,0|2,0,0]=4 2584 B15R1.791 C#CCC(C)OCc1ccc(cc1Cl)Cl 34a_100000685586_100000188473 [0,0,0,0,2,0|2,0,0]=4 2585 B15R1.791 C#CCC(C)OCc1ccc(cc1Cl)Cl 7a_100000685586_100000188473 [0,0,0,0,2,0|2,0,0]=4 2586 B15R1.791 C#CCN(C)CCc1ccc(cc1Br)Cl 2230a_100000225692_200012945151 [0,0,0,0,2,0|0,1,0]=3 2587 B15R1.791 C#CCN(C)CCc1ccc(cc1Br)Cl 34a_100000225692_200012945151 [0,0,0,0,2,0|0,1,0]=3 2588 B15R1.791 C#CCN(C)CCc1ccc(cc1C)C 270004a_100000225692_100011754701 [0,0,0,0,2,0|2,0,0]=4 2589 B15R1.791 C#CCN(C)CCc1ccc(cc1Cl)Cl 2230a_100000225692_200012161198 [0,0,0,0,2,0|0,0,0]=2 2590 B15R1.791 C#CCN(C)CCc1ccc(cc1Cl)Cl 34a_100000225692_200012161198 [0,0,0,0,2,0|0,0,0]=2 2591 B15R1.791 C=CCN(C)CCc1ccc(cc1Cl)Cl 2230a_100000225617_200012161198 [0,0,0,0,2,0|0,0,2]=4 2592 B15R1.791 C=CCN(C)CCc1ccc(cc1Cl)Cl 269982a_100000225617_200012161198 [0,0,0,0,2,0|0,0,2]=4 2593 B15R1.791 CCCN(C)CCc1ccc(cc1Cl)Cl 2230a_100000747261_200012161198 [0,0,0,0,2,0|0,0,2]=4 2594 B15R1.791 CCCN(C)CCc1ccc(cc1Cl)Cl 269982a_100000747261_200012161198 [0,0,0,0,2,0|0,0,2]=4 2595 B15R1.791 CN(CC#N)CCc1ccc(cc1Br)Cl 2230a_100000748184_200012945151 [0,0,0,0,2,0|1,1,0]=4 2596 B15R1.791 CN(CC#N)CCc1ccc(cc1Cl)Cl 2230a_100000748184_200012161198 [0,0,0,0,2,0|1,0,0]=3 2597 B15R1.791 CN(CCO)CCc1ccc(cc1Cl)Cl 2230a_100000210263_200012161198 [0,0,0,0,2,0|1,0,1]=4 2598 B15R1.791 CN(CCO)CCc1ccc(cc1Cl)Cl 269982a_100000210263_200012161198 [0,0,0,0,2,0|1,0,1]=4 2599 B17R1.12 C#CCC(=O)CCCCOc1ccc(cc1)Cl 1458a_100011220946_100011270096 [1,0,0,0,0,1|2,0,0]=4 2600 B17R1.12 C#CCC(=O)NCCCOc1ccc(cc1)Cl 1626a_200011199081_100011220946 [1,0,0,0,0,1|2,0,0]=4 2601 B17R1.12 C#CCC(=O)NCCCOc1ccc(cc1)Cl 527a_200011199081_100011220946 [1,0,0,0,0,1|2,0,0]=4 2602 B17R1.12 C#CCC(C)OCCCOc1ccc(cc1)Br 34a_100000685586_100011259224 [1,0,0,0,0,1|1,1,0]=4 2603 B17R1.12 C#CCC(C)OCCCOc1ccc(cc1)Br 7a_100000685586_100011259224 [1,0,0,0,0,1|1,1,0]=4 2604 B17R1.12 C#CCC(C)OCCCOc1ccc(cc1)F 34a_100000685586_100000181347 [1,0,0,0,0,1|1,1,0]=4 2605 B17R1.12 C#CCC(C)OCCCOc1ccc(cc1)F 7a_100000685586_100000181347 [1,0,0,0,0,1|1,1,0]=4 2606 B17R1.12 C#CCN(C)CCCCOc1ccc(cc1)Br 2230a_100000225692_100011270094 [1,0,0,0,0,1|0,1,0]=3 2607 B17R1.12 C#CCN(C)CCCCOc1ccc(cc1)Br 34a_100000225692_100011270094 [1,0,0,0,0,1|0,1,0]=3 2608 B17R1.12 C#CCN(C)CCCCOc1ccc(cc1)Cl 2230a_100000225692_100011270096 [1,0,0,0,0,1|0,0,0]=2 2609 B17R1.12 C#CCN(C)CCCCOc1ccc(cc1)Cl 34a_100000225692_100011270096 [1,0,0,0,0,1|0,0,0]=2 2610 B17R1.12 C=CCN(C)CCCCOc1ccc(cc1)Cl 2230a_100000225617_100011270096 [1,0,0,0,0,1|0,0,2]=4 2611 B17R1.12 C=CCN(C)CCCCOc1ccc(cc1)Cl 269982a_100000225617_100011270096 [1,0,0,0,0,1|0,0,2]=4 2612 B17R1.12 CC(CC#N)NCCCOc1ccc(cc1)Cl 2230a_200011199081_100009813641 [1,0,0,0,0,1|2,0,0]=4 2613 B17R1.12 CCCN(C)CCCCOc1ccc(cc1)Cl 2230a_100000747261_100011270096 [1,0,0,0,0,1|0,0,2]=4 2614 B17R1.12 CCCN(C)CCCCOc1ccc(cc1)Cl 269982a_100000747261_100011270096 [1,0,0,0,0,1|0,0,2]=4 2615 B17R1.12 CN(CC#N)CCCCOc1ccc(cc1)Br 2230a_100000748184_100011270094 [1,0,0,0,0,1|1,1,0]=4 2616 B17R1.12 CN(CC#N)CCCCOc1ccc(cc1)Cl 2230a_100000748184_100011270096 [1,0,0,0,0,1|1,0,0]=3 2617 B17R1.12 CN(CCO)CCCCOc1ccc(cc1)Cl 2230a_100000210263_100011270096 [1,0,0,0,0,1|1,0,1]=4 2618 B17R1.12 CN(CCO)CCCCOc1ccc(cc1)Cl 269982a_100000210263_100011270096 [1,0,0,0,0,1|1,0,1]=4 2619 B17R1.957 C#CCC(C)OCCCOc1ccccc1Br 34a_100000685586_200011259276 [1,0,0,0,0,1|1,1,0]=4 2620 B17R1.957 C#CCC(C)OCCCOc1ccccc1Br 7a_100000685586_200011259276 [1,0,0,0,0,1|1,1,0]=4 2621 B17R1.957 C#CCC(C)OCCCOc1ccccc1C 34a_100000685586_100000742659 [1,0,0,0,0,1|2,0,0]=4 2622 B17R1.957 C#CCC(C)OCCCOc1ccccc1C 7a_100000685586_100000742659 [1,0,0,0,0,1|2,0,0]=4 2623 B17R1.957 C#CCC(C)OCCCOc1ccccc1F 34a_100000685586_100011203253 [1,0,0,0,0,1|1,1,0]=4 2624 B17R1.957 C#CCC(C)OCCCOc1ccccc1F 7a_100000685586_100011203253 [1,0,0,0,0,1|1,1,0]=4 2625 B17R1.957 C#CCC(C)OCCCSc1ccccc1Cl 34a_100000685586_100000750589 [1,0,0,0,0,1|1,1,0]=4 2626 B17R1.957 C#CCC(C)OCCCSc1ccccc1Cl 7a_100000685586_100000750589 [1,0,0,0,0,1|1,1,0]=4 2627 B17R1.957 CC(CC#N)OCCCOc1ccccc1Cl 7a_100000230521_100009813641 [1,0,0,0,0,1|2,0,0]=4 2628 B17R1.1617 C#CCN(C)CCCOc1cc(cc(c1)C)C 2230a_100000225692_100000204577 [0,0,0,0,1,1|2,0,0]=4 2629 B17R1.1617 C#CCN(C)CCCOc1cc(cc(c1)C)C 2230a_100000225742_100000038162 [0,0,0,0,1,1|2,0,0]=4 2630 B17R1.1617 C#CCN(C)CCCOc1cc(cc(c1)C)C 34a_100000225692_100000204577 [0,0,0,0,1,1|2,0,0]=4 2631 B17R1.1617 C#CCN(C)CCCOc1cc(cc(c1)C)C 34a_100000225742_100000184674 [0,0,0,0,1,1|2,0,0]=4