0 B14R1.158 C#CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000731252 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.158 C#CCCCC(=O)Cc1ccccc1 1458a_100000690238_100015291786 [0,0,0,0,0,0|1,0,2]=3 2 B14R1.158 C#CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000731252 [0,0,0,0,0,0|2,0,2]=4 3 B14R1.158 C#CCCCC(=O)Cc1ccccn1 1458a_100000690238_100000721315 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.158 C#CCCCC(=O)Cc1cccnc1 1458a_100000690238_100000733263 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.158 C#CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000731252 [0,0,0,0,0,0|2,0,2]=4 6 B14R1.158 C#CCCCC(=O)Cc1ccncc1 1458a_100000690238_100000705612 [0,0,0,0,0,0|2,0,2]=4 7 B14R1.158 C#CCCCC(=O)Nc1ccccc1 11a_100000106764_100000690238 [0,0,0,0,0,0|2,0,2]=4 8 B14R1.158 C#CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000690238 [0,0,0,0,0,0|2,0,2]=4 9 B14R1.158 C#CCCCC(=O)Nc1ccccc1 22a_100000106764_100000690238 [0,0,0,0,0,0|2,0,2]=4 10 B14R1.158 C#CCCCC(=O)Nc1ccccc1 527a_100000106764_100000690238 [0,0,0,0,0,0|2,0,2]=4 11 B14R1.158 C#CCCNC(=O)C[n+]1ccccc1 11a_100000755551_200000086051 [0,0,0,0,0,0|2,0,2]=4 12 B14R1.158 C#CCCNC(=O)C[n+]1ccccc1 240690a_100000755551_200000086051 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.158 C#CCCNC(=O)C[n+]1ccccc1 527a_100000755551_200000086051 [0,0,0,0,0,0|2,0,2]=4 14 B14R1.158 C#CCCNC(=O)Cc1ccccn1 11a_100000755551_100000233486 [0,0,0,0,0,0|2,0,2]=4 15 B14R1.158 C#CCCNC(=O)Cc1cccnc1 11a_100000755551_100000737805 [0,0,0,0,0,0|2,0,2]=4 16 B14R1.158 C#CCCNC(=O)Cc1cccnc1 240690a_100000755551_100000737805 [0,0,0,0,0,0|2,0,2]=4 17 B14R1.158 C#CCCNC(=O)Cc1cccnc1 527a_100000755551_100000737805 [0,0,0,0,0,0|2,0,2]=4 18 B14R1.158 C#CCCNC(=O)Cc1ccncc1 11a_100000755551_100011201483 [0,0,0,0,0,0|2,0,2]=4 19 B14R1.158 C#CCCNC(=O)Cc1ccncc1 240690a_100000755551_100011201483 [0,0,0,0,0,0|2,0,2]=4 20 B14R1.158 C#CCCNC(=O)Nc1ccccc1 2430a_100000106764_100000755551 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.158 C#CCCOC(C)Cc1ccccc1 34a_100000748627_100000688953 [0,0,0,0,0,0|1,0,3]=4 22 B14R1.158 C#CCCOC(C)Cc1ccccc1 34a_100011215631_200011218536 [0,0,0,0,0,0|1,0,3]=4 23 B14R1.158 C#CCCOC(C)Cc1ccccc1 7a_100000748627_100000688953 [0,0,0,0,0,0|1,0,3]=4 24 B14R1.158 C#CCOCC(=O)Cc1ccccc1 1458a_100011251226_100015291786 [0,0,0,0,0,0|2,0,2]=4 25 B14R1.158 C#CCSCC(=O)Cc1ccccc1 62a_100000038162_100000233483 [0,0,0,0,0,0|2,0,2]=4 26 B14R1.158 C/C=C/C=CC(=O)Cc1ccccc1 1458a_100000185730_100015291786 [0,0,0,0,0,0|1,0,3]=4 27 B14R1.158 C/C=C/COC(C)Cc1ccccc1 34a_100000748627_100102629194 [0,0,0,0,0,0|1,0,3]=4 28 B14R1.158 C/C=C/COC(C)Cc1ccccc1 34a_100016270725_200011218536 [0,0,0,0,0,0|1,0,3]=4 29 B14R1.158 C/C=C/COC(C)Cc1ccccc1 7a_100000748627_100102629194 [0,0,0,0,0,0|1,0,3]=4 30 B14R1.158 C=CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000757094 [0,0,0,0,0,0|2,0,2]=4 31 B14R1.158 C=CCCCC(=O)Cc1ccccc1 1458a_100000766728_100015291786 [0,0,0,0,0,0|1,0,2]=3 32 B14R1.158 C=CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000757094 [0,0,0,0,0,0|2,0,2]=4 33 B14R1.158 C=CCCCC(=O)Cc1ccccn1 1458a_100000766728_100000721315 [0,0,0,0,0,0|2,0,2]=4 34 B14R1.158 C=CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000757094 [0,0,0,0,0,0|2,0,2]=4 35 B14R1.158 C=CCCCC(=O)Cc1cccnc1 1458a_100000766728_100000733263 [0,0,0,0,0,0|2,0,2]=4 36 B14R1.158 C=CCCCC(=O)Cc1ccncc1 1458a_100000766728_100000705612 [0,0,0,0,0,0|2,0,2]=4 37 B14R1.158 C=CCCCC(=O)Nc1ccccc1 11a_100000106764_100000766728 [0,0,0,0,0,0|2,0,2]=4 38 B14R1.158 C=CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000766728 [0,0,0,0,0,0|2,0,2]=4 39 B14R1.158 C=CCCCC(=O)Nc1ccccc1 22a_100000106764_100000766728 [0,0,0,0,0,0|2,0,2]=4 40 B14R1.158 C=CCCCC(=O)Nc1ccccc1 527a_100000106764_100000766728 [0,0,0,0,0,0|2,0,2]=4 41 B14R1.158 C=CCCNC(=O)C[n+]1ccccc1 11a_100015191253_200000086051 [0,0,0,0,0,0|2,0,2]=4 42 B14R1.158 C=CCCNC(=O)C[n+]1ccccc1 240690a_100015191253_200000086051 [0,0,0,0,0,0|2,0,2]=4 43 B14R1.158 C=CCCNC(=O)C[n+]1ccccc1 527a_100015191253_200000086051 [0,0,0,0,0,0|2,0,2]=4 44 B14R1.158 C=CCCNC(=O)Cc1ccccn1 11a_100015191253_100000233486 [0,0,0,0,0,0|2,0,2]=4 45 B14R1.158 C=CCCNC(=O)Cc1cccnc1 11a_100015191253_100000737805 [0,0,0,0,0,0|2,0,2]=4 46 B14R1.158 C=CCCNC(=O)Cc1cccnc1 240690a_100015191253_100000737805 [0,0,0,0,0,0|2,0,2]=4 47 B14R1.158 C=CCCNC(=O)Cc1cccnc1 527a_100015191253_100000737805 [0,0,0,0,0,0|2,0,2]=4 48 B14R1.158 C=CCCNC(=O)Cc1ccncc1 11a_100015191253_100011201483 [0,0,0,0,0,0|2,0,2]=4 49 B14R1.158 C=CCCNC(=O)Cc1ccncc1 240690a_100015191253_100011201483 [0,0,0,0,0,0|2,0,2]=4 50 B14R1.158 C=CCCNC(=O)Nc1ccccc1 2430a_100000106764_100015191253 [0,0,0,0,0,0|2,0,2]=4 51 B14R1.158 C=CCCOC(C)Cc1ccccc1 34a_100000748627_100000754431 [0,0,0,0,0,0|1,0,3]=4 52 B14R1.158 C=CCCOC(C)Cc1ccccc1 34a_100011205117_200011218536 [0,0,0,0,0,0|1,0,3]=4 53 B14R1.158 C=CCCOC(C)Cc1ccccc1 7a_100000748627_100000754431 [0,0,0,0,0,0|1,0,3]=4 54 B14R1.158 C=CCNCC(=O)Cc1ccccc1 2230a_100020586998_100000233483 [0,0,0,0,0,0|2,0,2]=4 55 B14R1.158 C=CCSCC(=O)Cc1ccccc1 1458a_100000230395_100015291786 [0,0,0,0,0,0|2,0,2]=4 56 B14R1.158 C=CCSCC(=O)Cc1ccccc1 62a_100000210623_100000233483 [0,0,0,0,0,0|2,0,2]=4 57 B14R1.158 C=CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210623 [0,0,0,0,0,0|2,0,2]=4 58 B14R1.158 CC#CCNC(=O)C[n+]1ccccc1 11a_100000685387_200000086051 [0,0,0,0,0,0|2,0,2]=4 59 B14R1.158 CC#CCNC(=O)C[n+]1ccccc1 527a_100000685387_200000086051 [0,0,0,0,0,0|2,0,2]=4 60 B14R1.158 CC#CCNC(=O)Cc1ccccn1 11a_100000685387_100000233486 [0,0,0,0,0,0|2,0,2]=4 61 B14R1.158 CC#CCNC(=O)Cc1cccnc1 11a_100000685387_100000737805 [0,0,0,0,0,0|2,0,2]=4 62 B14R1.158 CC#CCNC(=O)Cc1cccnc1 527a_100000685387_100000737805 [0,0,0,0,0,0|2,0,2]=4 63 B14R1.158 CC#CCNC(=O)Cc1ccncc1 11a_100000685387_100011201483 [0,0,0,0,0,0|2,0,2]=4 64 B14R1.158 CC#CCNC(=O)Nc1ccccc1 2430a_100000106764_100000685387 [0,0,0,0,0,0|2,0,2]=4 65 B14R1.158 CC#CCOC(C)Cc1ccccc1 34a_100000748627_100000748600 [0,0,0,0,0,0|1,0,3]=4 66 B14R1.158 CC#CCOC(C)Cc1ccccc1 34a_100000761923_200011218536 [0,0,0,0,0,0|1,0,3]=4 67 B14R1.158 CC#CCOC(C)Cc1ccccc1 7a_100000748627_100000748600 [0,0,0,0,0,0|1,0,3]=4 68 B14R1.158 CC(Cc1ccccc1)NCCCF 34a_100015189416_200011218536 [0,0,0,0,0,0|3,0,1]=4 69 B14R1.158 CC(Cc1ccccc1)OCCC#N 7a_100000748627_100000184422 [0,0,0,0,0,0|2,0,2]=4 70 B14R1.158 CC(Cc1ccccc1)OCCCBr 34a_100011217188_200011218536 [0,0,0,0,0,0|2,0,1]=3 71 B14R1.158 CC(Cc1ccccc1)OCCCCl 34a_100000230001_200011218536 [0,0,0,0,0,0|2,0,1]=3 72 B14R1.158 CC(Cc1ccccc1)OCCCF 34a_100000748627_100011934791 [0,0,0,0,0,0|2,0,1]=3 73 B14R1.158 CC(Cc1ccccc1)OCCCF 34a_100000759539_200011218536 [0,0,0,0,0,0|2,0,1]=3 74 B14R1.158 CC(Cc1ccccc1)OCCCF 7a_100000748627_100011934791 [0,0,0,0,0,0|2,0,1]=3 75 B14R1.158 CC(Cc1ccccc1)OCCCN 34a_100000182051_200011218536 [0,0,0,0,0,0|2,0,1]=3 76 B14R1.158 CC(Cc1ccccc1)OCCCO 34a_100000748627_100000230001 [0,0,0,0,0,0|2,0,1]=3 77 B14R1.158 CC(Cc1ccccc1)OCCCO 7a_100000748627_100011215043 [0,0,0,0,0,0|2,0,1]=3 78 B14R1.158 CC(Cc1ccccc1)OCCON 34a_100000700252_200011218536 [0,0,0,0,0,0|3,0,1]=4 79 B14R1.158 CC(Cc1ccccc1)SCCCF 62a_100011934791_200011218536 [0,0,0,0,0,0|2,1,1]=4 80 B14R1.158 CC(Cc1ccccc1)SCCCF 62a_200011218536_100011934791 [0,0,0,0,0,0|2,1,1]=4 81 B14R1.158 CC(Cc1ccccc1)SCCCO 62a_100011215043_200011218536 [0,0,0,0,0,0|2,1,1]=4 82 B14R1.158 CC(Cc1ccccc1)SCCCO 62a_200011218536_100011215043 [0,0,0,0,0,0|2,1,1]=4 83 B14R1.158 CC/C=C/CC(=O)Cc1ccccc1 1458a_100016274230_100015291786 [0,0,0,0,0,0|1,0,2]=3 84 B14R1.158 CC/C=C/CC(=O)Cc1ccccn1 1458a_100016274230_100000721315 [0,0,0,0,0,0|2,0,2]=4 85 B14R1.158 CC/C=C/CC(=O)Cc1cccnc1 1458a_100016274230_100000733263 [0,0,0,0,0,0|2,0,2]=4 86 B14R1.158 CC/C=C/CC(=O)Cc1ccncc1 1458a_100016274230_100000705612 [0,0,0,0,0,0|2,0,2]=4 87 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 11a_100000106764_100016274230 [0,0,0,0,0,0|2,0,2]=4 88 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_100016274230 [0,0,0,0,0,0|2,0,2]=4 89 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 22a_100000106764_100016274230 [0,0,0,0,0,0|2,0,2]=4 90 B14R1.158 CC/C=C/CC(=O)Nc1ccccc1 527a_100000106764_100016274230 [0,0,0,0,0,0|2,0,2]=4 91 B14R1.158 CC/C=C\CC(=O)C[n+]1ccccc1 1458a_200000086051_100103147603 [0,0,0,0,0,0|2,0,2]=4 92 B14R1.158 CC/C=C\CC(=O)Cc1ccccn1 1458a_100000233486_100103147603 [0,0,0,0,0,0|2,0,2]=4 93 B14R1.158 CC/C=C\CC(=O)Cc1cccnc1 1458a_100000737805_100103147603 [0,0,0,0,0,0|2,0,2]=4 94 B14R1.158 CC=CCOC(C)Cc1ccccc1 34a_100000748627_100000070051 [0,0,0,0,0,0|1,0,3]=4 95 B14R1.158 CC=CCOC(C)Cc1ccccc1 7a_100000748627_100000070051 [0,0,0,0,0,0|1,0,3]=4 96 B14R1.158 CCC#CCC(=O)C[n+]1ccccc1 1458a_200000086051_100009813939 [0,0,0,0,0,0|2,0,2]=4 97 B14R1.158 CCC#CCC(=O)Cc1ccccn1 1458a_100000233486_100009813939 [0,0,0,0,0,0|2,0,2]=4 98 B14R1.158 CCC#CCC(=O)Cc1cccnc1 1458a_100000737805_100009813939 [0,0,0,0,0,0|2,0,2]=4 99 B14R1.158 CCC=NNC(=O)C[n+]1ccccc1 4a_100000199085_100000210100 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.158 CCC=NNC(=O)Cc1ccccc1 4a_100000182964_100000210100 [0,0,0,0,0,0|2,0,1]=3 101 B14R1.158 CCC=NNC(=O)Cc1ccccn1 4a_200000059813_100000210100 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.158 CCC=NNC(=O)Cc1ccncc1 4a_100000766356_100000210100 [0,0,0,0,0,0|3,0,1]=4 103 B14R1.158 CCCC#CC(=O)Cc1ccccc1 1458a_200011218047_100015291786 [0,0,0,0,0,0|1,0,1]=2 104 B14R1.158 CCCC#CC(=O)Cc1ccccn1 1458a_200011218047_100000721315 [0,0,0,0,0,0|2,0,1]=3 105 B14R1.158 CCCC#CC(=O)Cc1cccnc1 1458a_200011218047_100000733263 [0,0,0,0,0,0|2,0,1]=3 106 B14R1.158 CCCC#CC(=O)Cc1cccnn1 1458a_200011218047_100016990269 [0,0,0,0,0,0|3,0,1]=4 107 B14R1.158 CCCC#CC(=O)Cc1ccncc1 1458a_200011218047_100000705612 [0,0,0,0,0,0|2,0,1]=3 108 B14R1.158 CCCC#CC(=O)Cc1cnccn1 1458a_200011218047_100016995436 [0,0,0,0,0,0|3,0,1]=4 109 B14R1.158 CCCC#CC(=O)Cc1cncnc1 1458a_200011218047_100015196519 [0,0,0,0,0,0|3,0,1]=4 110 B14R1.158 CCCC#CC(=O)Cc1ncccn1 1458a_200011218047_100000703007 [0,0,0,0,0,0|3,0,1]=4 111 B14R1.158 CCCC#CC(=O)Nc1ccccc1 22a_100000106764_200011218047 [0,0,0,0,0,0|2,0,1]=3 112 B14R1.158 CCCC=CC(=O)Cc1ccccc1 1458a_100000212230_100015291786 [0,0,0,0,0,0|1,0,1]=2 113 B14R1.158 CCCC=CC(=O)Cc1ccccn1 1458a_100000212230_100000721315 [0,0,0,0,0,0|2,0,1]=3 114 B14R1.158 CCCC=CC(=O)Cc1cccnc1 1458a_100000212230_100000733263 [0,0,0,0,0,0|2,0,1]=3 115 B14R1.158 CCCC=CC(=O)Cc1cccnn1 1458a_100000212230_100016990269 [0,0,0,0,0,0|3,0,1]=4 116 B14R1.158 CCCC=CC(=O)Cc1ccncc1 1458a_100000212230_100000705612 [0,0,0,0,0,0|2,0,1]=3 117 B14R1.158 CCCC=CC(=O)Cc1cnccn1 1458a_100000212230_100016995436 [0,0,0,0,0,0|3,0,1]=4 118 B14R1.158 CCCC=CC(=O)Cc1cncnc1 1458a_100000212230_100015196519 [0,0,0,0,0,0|3,0,1]=4 119 B14R1.158 CCCC=CC(=O)Cc1ncccn1 1458a_100000212230_100000703007 [0,0,0,0,0,0|3,0,1]=4 120 B14R1.158 CCCC=CC(=O)Nc1ccccc1 11a_100000106764_100000212230 [0,0,0,0,0,0|2,0,1]=3 121 B14R1.158 CCCC=CC(=O)Nc1ccccc1 1626a_100000106764_100000212230 [0,0,0,0,0,0|2,0,1]=3 122 B14R1.158 CCCC=CC(=O)Nc1ccccc1 22a_100000106764_100000212230 [0,0,0,0,0,0|2,0,1]=3 123 B14R1.158 CCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210326 [0,0,0,0,0,0|2,0,0]=2 124 B14R1.158 CCCCCC(=O)Cc1ccccc1 1458a_100000212188_100015291786 [0,0,0,0,0,0|1,0,0]=1 125 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000212188_100000721315 [0,0,0,0,0,0|2,0,0]=2 126 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210326 [0,0,0,0,0,0|2,0,0]=2 127 B14R1.158 CCCCCC(=O)Cc1cccnc1 1458a_100000212188_100000733263 [0,0,0,0,0,0|2,0,0]=2 128 B14R1.158 CCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210326 [0,0,0,0,0,0|2,0,0]=2 129 B14R1.158 CCCCCC(=O)Cc1cccnn1 1458a_100000212188_100016990269 [0,0,0,0,0,0|3,0,0]=3 130 B14R1.158 CCCCCC(=O)Cc1ccncc1 1458a_100000212188_100000705612 [0,0,0,0,0,0|2,0,0]=2 131 B14R1.158 CCCCCC(=O)Cc1cnccn1 1458a_100000212188_100016995436 [0,0,0,0,0,0|3,0,0]=3 132 B14R1.158 CCCCCC(=O)Cc1cncnc1 1458a_100000212188_100015196519 [0,0,0,0,0,0|3,0,0]=3 133 B14R1.158 CCCCCC(=O)Cc1cncnc1 1458a_100000721575_100000210326 [0,0,0,0,0,0|3,0,0]=3 134 B14R1.158 CCCCCC(=O)Cc1ncccn1 1458a_100000212188_100000703007 [0,0,0,0,0,0|3,0,0]=3 135 B14R1.158 CCCCCC(=O)Nc1ccccc1 11a_100000106764_100000212188 [0,0,0,0,0,0|2,0,0]=2 136 B14R1.158 CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000212188 [0,0,0,0,0,0|2,0,0]=2 137 B14R1.158 CCCCCC(=O)Nc1ccccc1 22a_100000106764_100000212188 [0,0,0,0,0,0|2,0,0]=2 138 B14R1.158 CCCCCC(=O)Nc1ccccc1 527a_100000106764_100000212188 [0,0,0,0,0,0|2,0,0]=2 139 B14R1.158 CCCCCC(C)Nc1ccccc1 34a_100000106764_200011218191 [0,0,0,0,0,0|3,0,1]=4 140 B14R1.158 CCCCCC(C)Oc1ccccc1 34a_100000210340_200011218191 [0,0,0,0,0,0|3,0,1]=4 141 B14R1.158 CCCCCC(C)Oc1ccccc1 7a_100000210340_200011218191 [0,0,0,0,0,0|3,0,1]=4 142 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_100000719477_200011218191 [0,0,0,0,0,0|3,0,1]=4 143 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_200011218191_100000041952 [0,0,0,0,0,0|3,0,1]=4 144 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000186898_100000210326 [0,0,0,0,0,0|3,0,0]=3 145 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000223495_100015291786 [0,0,0,0,0,0|3,0,0]=3 146 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000186898_100000210215 [0,0,0,0,0,0|3,0,0]=3 147 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000223495_100000211182 [0,0,0,0,0,0|3,0,0]=3 148 B14R1.158 CCCCCN(C)Cc1ccccc1 270004a_100000223495_100015611070 [0,0,0,0,0,0|3,0,0]=3 149 B14R1.158 CCCCCN(C)Cc1ccccn1 2230a_100000207498_100000210326 [0,0,0,0,0,0|4,0,0]=4 150 B14R1.158 CCCCCN(C)Cc1ccccn1 2230a_100000223495_100000721315 [0,0,0,0,0,0|4,0,0]=4 151 B14R1.158 CCCCCN(C)Cc1ccccn1 269982a_100000207498_100000210215 [0,0,0,0,0,0|4,0,0]=4 152 B14R1.158 CCCCCN(C)Cc1ccccn1 269982a_100000223495_100000721315 [0,0,0,0,0,0|4,0,0]=4 153 B14R1.158 CCCCCN(C)Cc1ccccn1 270004a_100000223495_100000209966 [0,0,0,0,0,0|4,0,0]=4 154 B14R1.158 CCCCCN(C)Cc1cccnc1 2230a_100000184577_100000210326 [0,0,0,0,0,0|4,0,0]=4 155 B14R1.158 CCCCCN(C)Cc1cccnc1 2230a_100000223495_100000741622 [0,0,0,0,0,0|4,0,0]=4 156 B14R1.158 CCCCCN(C)Cc1cccnc1 269982a_100000184577_100000210215 [0,0,0,0,0,0|4,0,0]=4 157 B14R1.158 CCCCCN(C)Cc1cccnc1 269982a_100000223495_100000733263 [0,0,0,0,0,0|4,0,0]=4 158 B14R1.158 CCCCCN(C)Cc1cccnc1 270004a_100000223495_100000209961 [0,0,0,0,0,0|4,0,0]=4 159 B14R1.158 CCCCCN(C)Cc1ccncc1 2230a_100000187231_100000210326 [0,0,0,0,0,0|4,0,0]=4 160 B14R1.158 CCCCCN(C)Cc1ccncc1 2230a_100000223495_100015193705 [0,0,0,0,0,0|4,0,0]=4 161 B14R1.158 CCCCCN(C)Cc1ccncc1 269982a_100000187231_100000210215 [0,0,0,0,0,0|4,0,0]=4 162 B14R1.158 CCCCCN(C)Cc1ccncc1 269982a_100000223495_100015193705 [0,0,0,0,0,0|4,0,0]=4 163 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 11a_100000102301_200000086051 [0,0,0,0,0,0|2,0,0]=2 164 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 240690a_100000102301_200000086051 [0,0,0,0,0,0|2,0,0]=2 165 B14R1.158 CCCCNC(=O)C[n+]1ccccc1 527a_100000102301_200000086051 [0,0,0,0,0,0|2,0,0]=2 166 B14R1.158 CCCCNC(=O)Cc1ccccn1 11a_100000102301_100000233486 [0,0,0,0,0,0|2,0,0]=2 167 B14R1.158 CCCCNC(=O)Cc1cccnc1 11a_100000102301_100000737805 [0,0,0,0,0,0|2,0,0]=2 168 B14R1.158 CCCCNC(=O)Cc1cccnc1 240690a_100000102301_100000737805 [0,0,0,0,0,0|2,0,0]=2 169 B14R1.158 CCCCNC(=O)Cc1cccnc1 527a_100000102301_100000737805 [0,0,0,0,0,0|2,0,0]=2 170 B14R1.158 CCCCNC(=O)Cc1ccncc1 11a_100000102301_100011201483 [0,0,0,0,0,0|2,0,0]=2 171 B14R1.158 CCCCNC(=O)Cc1ccncc1 240690a_100000102301_100011201483 [0,0,0,0,0,0|2,0,0]=2 172 B14R1.158 CCCCNC(=O)Cc1cnccn1 11a_100000102301_100000726051 [0,0,0,0,0,0|3,0,0]=3 173 B14R1.158 CCCCNC(=O)Cc1cnccn1 240690a_100000102301_100000726051 [0,0,0,0,0,0|3,0,0]=3 174 B14R1.158 CCCCNC(=O)Cc1cnccn1 527a_100000102301_100000726051 [0,0,0,0,0,0|3,0,0]=3 175 B14R1.158 CCCCNC(=O)Cc1cncnc1 11a_100000102301_100000721575 [0,0,0,0,0,0|3,0,0]=3 176 B14R1.158 CCCCNC(=O)Cc1cncnc1 240690a_100000102301_100000721575 [0,0,0,0,0,0|3,0,0]=3 177 B14R1.158 CCCCNC(=O)Cc1cncnc1 527a_100000102301_100000721575 [0,0,0,0,0,0|3,0,0]=3 178 B14R1.158 CCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000102301 [0,0,0,0,0,0|2,0,0]=2 179 B14R1.158 CCCCNC(C)C[n+]1ccccc1 270004a_100000102301_100000034229 [0,0,0,0,0,0|3,0,1]=4 180 B14R1.158 CCCCNC(C)Cc1ccccc1 7a_106832991798_200011218536 [0,0,0,0,0,0|2,0,1]=3 181 B14R1.158 CCCCNC(C)Cc1ccccn1 2230a_100000238496_100000210211 [0,0,0,0,0,0|3,0,1]=4 182 B14R1.158 CCCCNC(C)Cc1cccnc1 2230a_100011207255_100000210211 [0,0,0,0,0,0|3,0,1]=4 183 B14R1.158 CCCCNC(C)Cc1cccnc1 270004a_100000102301_100015187140 [0,0,0,0,0,0|3,0,1]=4 184 B14R1.158 CCCCNC(C)Cc1ccncc1 270004a_100000102301_100000238508 [0,0,0,0,0,0|3,0,1]=4 185 B14R1.158 CCCCOC(=O)CN1CC=CCC1 2230a_100000698166_100000211628 [0,0,0,0,0,0|1,0,3]=4 186 B14R1.158 CCCCOC(=O)CN1CC=CCC1 269982a_100000698166_100000211628 [0,0,0,0,0,0|1,0,3]=4 187 B14R1.158 CCCCOC(=O)CN1CC=CCC1 34a_100000698166_100000211628 [0,0,0,0,0,0|1,0,3]=4 188 B14R1.158 CCCCOC(C)Cc1ccccc1 34a_100000210227_200011218536 [0,0,0,0,0,0|1,0,1]=2 189 B14R1.158 CCCCOC(C)Cc1ccccc1 34a_100000748627_100000210210 [0,0,0,0,0,0|1,0,1]=2 190 B14R1.158 CCCCOC(C)Cc1ccccc1 7a_100000210227_200011218536 [0,0,0,0,0,0|1,0,1]=2 191 B14R1.158 CCCCOC(C)Cc1ccccc1 7a_100000748627_100000210211 [0,0,0,0,0,0|1,0,1]=2 192 B14R1.158 CCCCSC(C)Cc1ccccc1 62a_100000210211_200011218536 [0,0,0,0,0,0|1,1,1]=3 193 B14R1.158 CCCCSC(C)Cc1ccccc1 62a_200011218536_100000210210 [0,0,0,0,0,0|1,1,1]=3 194 B14R1.158 CCCNCC(O)Cc1ccccc1 2230a_100000752270_100000210303 [0,0,0,0,0,0|2,0,2]=4 195 B14R1.158 CCCNN=C(C)C[n+]1ccccc1 4a_100000740057_100000034229 [0,0,0,0,0,0|4,0,0]=4 196 B14R1.158 CCCNNC(=O)C[n+]1ccccc1 22a_100000740057_200000086051 [0,0,0,0,0,0|3,0,0]=3 197 B14R1.158 CCCNNC(=O)Cc1ccccn1 22a_100000740057_100000233486 [0,0,0,0,0,0|3,0,0]=3 198 B14R1.158 CCCNNC(=O)Cc1cccnc1 22a_100000740057_100000737805 [0,0,0,0,0,0|3,0,0]=3 199 B14R1.158 CCCNNC(=O)Cc1ccncc1 22a_100000740057_100011201483 [0,0,0,0,0,0|3,0,0]=3 200 B14R1.158 CCCNNC(=O)Cc1cnccn1 22a_100000740057_100000726051 [0,0,0,0,0,0|4,0,0]=4 201 B14R1.158 CCCNNC(=O)Cc1cncnc1 22a_100000740057_100000721575 [0,0,0,0,0,0|4,0,0]=4 202 B14R1.158 CCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210303 [0,0,0,0,0,0|3,0,1]=4 203 B14R1.158 CCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210303 [0,0,0,0,0,0|3,0,1]=4 204 B14R1.158 CCCOCC(=O)Cc1ccccc1 1458a_100000745993_100015291786 [0,0,0,0,0,0|2,0,0]=2 205 B14R1.158 CCCOCC(=O)Cc1ccccn1 1458a_100000745993_100000721315 [0,0,0,0,0,0|3,0,0]=3 206 B14R1.158 CCCOCC(=O)Cc1cccnc1 1458a_100000745993_100000733263 [0,0,0,0,0,0|3,0,0]=3 207 B14R1.158 CCCOCC(=O)Cc1cccnn1 1458a_100000745993_100016990269 [0,0,0,0,0,0|4,0,0]=4 208 B14R1.158 CCCOCC(=O)Cc1ccncc1 1458a_100000745993_100000705612 [0,0,0,0,0,0|3,0,0]=3 209 B14R1.158 CCCOCC(=O)Cc1cnccn1 1458a_100000745993_100016995436 [0,0,0,0,0,0|4,0,0]=4 210 B14R1.158 CCCOCC(=O)Cc1cncnc1 1458a_100000745993_100015196519 [0,0,0,0,0,0|4,0,0]=4 211 B14R1.158 CCCOCC(=O)Cc1ncccn1 1458a_100000745993_100000703007 [0,0,0,0,0,0|4,0,0]=4 212 B14R1.158 CCCOCC(=O)Nc1ccccc1 11a_100000106764_100000745993 [0,0,0,0,0,0|3,0,0]=3 213 B14R1.158 CCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000745993 [0,0,0,0,0,0|3,0,0]=3 214 B14R1.158 CCCOCC(=O)Nc1ccccc1 22a_100000106764_100000745993 [0,0,0,0,0,0|3,0,0]=3 215 B14R1.158 CCCOCC(=O)Nc1ccccc1 34a_100000210258_100000182850 [0,0,0,0,0,0|3,0,0]=3 216 B14R1.158 CCCOCC(=O)Nc1ccccc1 34a_100000246334_100000210303 [0,0,0,0,0,0|3,0,0]=3 217 B14R1.158 CCCOCC(=O)Nc1ccccc1 527a_100000106764_100000745993 [0,0,0,0,0,0|3,0,0]=3 218 B14R1.158 CCCOCC(=O)Oc1ccccc1 34a_100000210258_100009813826 [0,0,0,0,0,0|3,0,0]=3 219 B14R1.158 CCCOCC(C)Cc1ccccc1 34a_100012125295_100000210303 [0,0,0,0,0,0|3,0,1]=4 220 B14R1.158 CCCOCC(C)Cc1ccccc1 7a_100012125295_100000210303 [0,0,0,0,0,0|3,0,1]=4 221 B14R1.158 CCCOCC(N)Cc1ccccc1 34a_100000739027_100000210303 [0,0,0,0,0,0|3,0,1]=4 222 B14R1.158 CCCOC[C@@H](O)Cc1ccccc1 34a_100000210258_100000729385 [0,0,0,0,0,0|2,0,2]=4 223 B14R1.158 CCCSCC(=O)Cc1ccccc1 1458a_100000217233_100015291786 [0,0,0,0,0,0|2,0,0]=2 224 B14R1.158 CCCSCC(=O)Cc1ccccc1 62a_100000210303_100000233483 [0,0,0,0,0,0|2,0,0]=2 225 B14R1.158 CCCSCC(=O)Cc1ccccc1 62a_100000233483_100000210303 [0,0,0,0,0,0|2,0,0]=2 226 B14R1.158 CCCSCC(=O)Cc1ccccn1 1458a_100000217233_100000721315 [0,0,0,0,0,0|3,0,0]=3 227 B14R1.158 CCCSCC(=O)Cc1cccnc1 1458a_100000217233_100000733263 [0,0,0,0,0,0|3,0,0]=3 228 B14R1.158 CCCSCC(=O)Cc1cccnn1 1458a_100000217233_100016990269 [0,0,0,0,0,0|4,0,0]=4 229 B14R1.158 CCCSCC(=O)Cc1ccncc1 1458a_100000217233_100000705612 [0,0,0,0,0,0|3,0,0]=3 230 B14R1.158 CCCSCC(=O)Cc1cnccn1 1458a_100000217233_100016995436 [0,0,0,0,0,0|4,0,0]=4 231 B14R1.158 CCCSCC(=O)Cc1cncnc1 1458a_100000217233_100015196519 [0,0,0,0,0,0|4,0,0]=4 232 B14R1.158 CCCSCC(=O)Cc1ncccn1 1458a_100000217233_100000703007 [0,0,0,0,0,0|4,0,0]=4 233 B14R1.158 CCCSCC(=O)Nc1ccccc1 11a_100000106764_100000217233 [0,0,0,0,0,0|3,0,0]=3 234 B14R1.158 CCCSCC(=O)Nc1ccccc1 1626a_100000106764_100000217233 [0,0,0,0,0,0|3,0,0]=3 235 B14R1.158 CCCSCC(=O)Nc1ccccc1 22a_100000106764_100000217233 [0,0,0,0,0,0|3,0,0]=3 236 B14R1.158 CCCSCC(=O)Nc1ccccc1 527a_100000106764_100000217233 [0,0,0,0,0,0|3,0,0]=3 237 B14R1.158 CCCSCC(=O)Nc1ccccc1 62a_100000210303_100000182850 [0,0,0,0,0,0|3,0,0]=3 238 B14R1.158 CCCSCC(=O)Nc1ccccc1 62a_100012148978_100000210303 [0,0,0,0,0,0|3,0,0]=3 239 B14R1.158 CCCSCC(=O)Nc1ccccn1 62a_100000210303_100020662008 [0,0,0,0,0,0|4,0,0]=4 240 B14R1.158 CCCSCC(=O)Nc1ccccn1 62a_100020662008_100000210303 [0,0,0,0,0,0|4,0,0]=4 241 B14R1.158 CCCSCC(=O)Nc1ccncc1 62a_100000210303_100000754145 [0,0,0,0,0,0|4,0,0]=4 242 B14R1.158 CCCSCC(=O)Oc1ccccc1 62a_100000210303_100009813826 [0,0,0,0,0,0|3,0,0]=3 243 B14R1.158 CCCSCC(=O)Oc1ccccc1 62a_100009813826_100000210303 [0,0,0,0,0,0|3,0,0]=3 244 B14R1.158 CCCSC[C@@H](O)Cc1ccccc1 62a_100000210303_100000729385 [0,0,0,0,0,0|2,0,2]=4 245 B14R1.158 CCCSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000210303 [0,0,0,0,0,0|2,0,2]=4 246 B14R1.158 CCNCCC(=O)Nc1ccccc1 2230a_100015525214_100000242058 [0,0,0,0,0,0|3,0,0]=3 247 B14R1.158 CCNCCC(=O)Nc1cccnc1 2230a_100015525214_200015187043 [0,0,0,0,0,0|4,0,0]=4 248 B14R1.158 CCNCCC(=O)Nc1cccnc1 34a_100000748795_100000210202 [0,0,0,0,0,0|4,0,0]=4 249 B14R1.158 CCNCCC(=O)Oc1ccccc1 2230a_100015525214_200000035796 [0,0,0,0,0,0|3,0,0]=3 250 B14R1.158 CCNCCN(C)Cc1ccccc1 2230a_100015525214_100015196923 [0,0,0,0,0,0|4,0,0]=4 251 B14R1.158 CCOC=CC(=O)Cc1ccccc1 1458a_100016266692_100015291786 [0,0,0,0,0,0|2,0,1]=3 252 B14R1.158 CCOC=CC(=O)Cc1ccccn1 1458a_100016266692_100000721315 [0,0,0,0,0,0|3,0,1]=4 253 B14R1.158 CCOC=CC(=O)Cc1cccnc1 1458a_100016266692_100000733263 [0,0,0,0,0,0|3,0,1]=4 254 B14R1.158 CCOC=CC(=O)Cc1ccncc1 1458a_100016266692_100000705612 [0,0,0,0,0,0|3,0,1]=4 255 B14R1.158 CCOC=CC(=O)Nc1ccccc1 11a_100000106764_100016266692 [0,0,0,0,0,0|3,0,1]=4 256 B14R1.158 CCOC=CC(=O)Nc1ccccc1 1626a_100000106764_100016266692 [0,0,0,0,0,0|3,0,1]=4 257 B14R1.158 CCOC=CC(=O)Nc1ccccc1 22a_100000106764_100016266692 [0,0,0,0,0,0|3,0,1]=4 258 B14R1.158 CCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215890 [0,0,0,0,0,0|3,0,0]=3 259 B14R1.158 CCOCCC(=O)Cc1ccccc1 1458a_100000749530_100015291786 [0,0,0,0,0,0|2,0,0]=2 260 B14R1.158 CCOCCC(=O)Cc1ccccn1 1458a_100000233486_100011215890 [0,0,0,0,0,0|3,0,0]=3 261 B14R1.158 CCOCCC(=O)Cc1ccccn1 1458a_100000749530_100000721315 [0,0,0,0,0,0|3,0,0]=3 262 B14R1.158 CCOCCC(=O)Cc1cccnc1 1458a_100000737805_100011215890 [0,0,0,0,0,0|3,0,0]=3 263 B14R1.158 CCOCCC(=O)Cc1cccnc1 1458a_100000749530_100000733263 [0,0,0,0,0,0|3,0,0]=3 264 B14R1.158 CCOCCC(=O)Cc1cccnn1 1458a_100000749530_100016990269 [0,0,0,0,0,0|4,0,0]=4 265 B14R1.158 CCOCCC(=O)Cc1ccncc1 1458a_100000749530_100000705612 [0,0,0,0,0,0|3,0,0]=3 266 B14R1.158 CCOCCC(=O)Cc1cnccn1 1458a_100000749530_100016995436 [0,0,0,0,0,0|4,0,0]=4 267 B14R1.158 CCOCCC(=O)Cc1cncnc1 1458a_100000721575_100011215890 [0,0,0,0,0,0|4,0,0]=4 268 B14R1.158 CCOCCC(=O)Cc1cncnc1 1458a_100000749530_100015196519 [0,0,0,0,0,0|4,0,0]=4 269 B14R1.158 CCOCCC(=O)Cc1ncccn1 1458a_100000749530_100000703007 [0,0,0,0,0,0|4,0,0]=4 270 B14R1.158 CCOCCC(=O)Nc1ccccc1 11a_100000106764_100000749530 [0,0,0,0,0,0|3,0,0]=3 271 B14R1.158 CCOCCC(=O)Nc1ccccc1 1626a_100000106764_100000749530 [0,0,0,0,0,0|3,0,0]=3 272 B14R1.158 CCOCCC(=O)Nc1ccccc1 22a_100000106764_100000749530 [0,0,0,0,0,0|3,0,0]=3 273 B14R1.158 CCOCCC(=O)Nc1ccccc1 34a_100121572206_100000242058 [0,0,0,0,0,0|3,0,0]=3 274 B14R1.158 CCOCCC(=O)Nc1ccccc1 527a_100000106764_100000749530 [0,0,0,0,0,0|3,0,0]=3 275 B14R1.158 CCOCCN(C)Cc1ccccc1 2230a_100000186898_100011215890 [0,0,0,0,0,0|4,0,0]=4 276 B14R1.158 CCOCCN(C)Cc1ccccc1 269982a_100000186898_100011215890 [0,0,0,0,0,0|4,0,0]=4 277 B14R1.158 CCOCCN(C)Cc1ccccc1 34a_100121572206_100015196923 [0,0,0,0,0,0|4,0,0]=4 278 B14R1.158 CCOCSC(C)Cc1ccccc1 62a_100000739092_200011218536 [0,0,0,0,0,0|2,1,1]=4 279 B14R1.158 CCOCSC(C)Cc1ccccc1 62a_200011218536_100000739092 [0,0,0,0,0,0|2,1,1]=4 280 B14R1.158 CCSCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000757381 [0,0,0,0,0,0|3,0,0]=3 281 B14R1.158 CCSCCC(=O)Cc1ccccc1 1458a_100000230768_100015291786 [0,0,0,0,0,0|2,0,0]=2 282 B14R1.158 CCSCCC(=O)Cc1ccccn1 1458a_100000230768_100000721315 [0,0,0,0,0,0|3,0,0]=3 283 B14R1.158 CCSCCC(=O)Cc1ccccn1 1458a_100000233486_100000757381 [0,0,0,0,0,0|3,0,0]=3 284 B14R1.158 CCSCCC(=O)Cc1cccnc1 1458a_100000230768_100000733263 [0,0,0,0,0,0|3,0,0]=3 285 B14R1.158 CCSCCC(=O)Cc1cccnc1 1458a_100000737805_100000757381 [0,0,0,0,0,0|3,0,0]=3 286 B14R1.158 CCSCCC(=O)Cc1cccnn1 1458a_100000230768_100016990269 [0,0,0,0,0,0|4,0,0]=4 287 B14R1.158 CCSCCC(=O)Cc1ccncc1 1458a_100000230768_100000705612 [0,0,0,0,0,0|3,0,0]=3 288 B14R1.158 CCSCCC(=O)Cc1cnccn1 1458a_100000230768_100016995436 [0,0,0,0,0,0|4,0,0]=4 289 B14R1.158 CCSCCC(=O)Cc1cncnc1 1458a_100000230768_100015196519 [0,0,0,0,0,0|4,0,0]=4 290 B14R1.158 CCSCCC(=O)Cc1cncnc1 1458a_100000721575_100000757381 [0,0,0,0,0,0|4,0,0]=4 291 B14R1.158 CCSCCC(=O)Cc1ncccn1 1458a_100000230768_100000703007 [0,0,0,0,0,0|4,0,0]=4 292 B14R1.158 CCSCCC(=O)Nc1ccccc1 11a_100000106764_100000230768 [0,0,0,0,0,0|3,0,0]=3 293 B14R1.158 CCSCCC(=O)Nc1ccccc1 1626a_100000106764_100000230768 [0,0,0,0,0,0|3,0,0]=3 294 B14R1.158 CCSCCC(=O)Nc1ccccc1 22a_100000106764_100000230768 [0,0,0,0,0,0|3,0,0]=3 295 B14R1.158 CCSCCC(=O)Nc1ccccc1 527a_100000106764_100000230768 [0,0,0,0,0,0|3,0,0]=3 296 B14R1.158 CCSCCC(=O)Nc1ccccc1 62a_100000210202_100000242058 [0,0,0,0,0,0|3,0,0]=3 297 B14R1.158 CCSCCC(=O)Nc1cccnc1 62a_100000210202_200015187043 [0,0,0,0,0,0|4,0,0]=4 298 B14R1.158 CCSCCC(=O)Oc1ccccc1 62a_100000210202_200000035796 [0,0,0,0,0,0|3,0,0]=3 299 B14R1.158 CCSCCN(C)Cc1ccccc1 2230a_100000186898_100000757381 [0,0,0,0,0,0|4,0,0]=4 300 B14R1.158 CCSCCN(C)Cc1ccccc1 269982a_100000186898_100000757381 [0,0,0,0,0,0|4,0,0]=4 301 B14R1.158 CCSCCN(C)Cc1ccccc1 62a_100000210202_100015196923 [0,0,0,0,0,0|4,0,0]=4 302 B14R1.158 CN(CCCCF)Cc1ccccc1 2230a_100000186898_100000729493 [0,0,0,0,0,0|4,0,0]=4 303 B14R1.158 CN(CCCCF)Cc1ccccc1 269982a_100000186898_100000729493 [0,0,0,0,0,0|4,0,0]=4 304 B14R1.158 CN(CCCCO)Cc1ccccc1 2230a_100000186360_200000210301 [0,0,0,0,0,0|4,0,0]=4 305 B14R1.158 CN(CCCCO)Cc1ccccc1 2230a_100000186898_100000210776 [0,0,0,0,0,0|4,0,0]=4 306 B14R1.158 CN(CCCCO)Cc1ccccc1 2230a_100000717598_100015291786 [0,0,0,0,0,0|4,0,0]=4 307 B14R1.158 CN(CCCCO)Cc1ccccc1 269982a_100000186360_200000210301 [0,0,0,0,0,0|4,0,0]=4 308 B14R1.158 CN(CCCCO)Cc1ccccc1 269982a_100000186898_100000210776 [0,0,0,0,0,0|4,0,0]=4 309 B14R1.158 CN(CCCCO)Cc1ccccc1 269982a_100000717598_100000211182 [0,0,0,0,0,0|4,0,0]=4 310 B14R1.158 CN(CCCCO)Cc1ccccc1 270004a_100000717598_100015611070 [0,0,0,0,0,0|4,0,0]=4 311 B14R1.158 CNCCCC(=O)Nc1ccccc1 2230a_106832991635_100011194425 [0,0,0,0,0,0|3,0,0]=3 312 B14R1.158 CNCCCC(=O)Nc1ccccc1 34a_100000750157_200000210301 [0,0,0,0,0,0|3,0,0]=3 313 B14R1.158 CNCCCC(=O)Nc1ccccc1 34a_100102657272_100011194425 [0,0,0,0,0,0|3,0,0]=3 314 B14R1.158 CNCCCC(=O)Nc1ccccc1 7a_106832991635_100011194425 [0,0,0,0,0,0|3,0,0]=3 315 B14R1.158 COCC=CC(=O)Cc1ccccc1 1458a_100016285016_100015291786 [0,0,0,0,0,0|2,0,1]=3 316 B14R1.158 COCC=CC(=O)Cc1ccccn1 1458a_100016285016_100000721315 [0,0,0,0,0,0|3,0,1]=4 317 B14R1.158 COCC=CC(=O)Cc1cccnc1 1458a_100016285016_100000733263 [0,0,0,0,0,0|3,0,1]=4 318 B14R1.158 COCC=CC(=O)Cc1ccncc1 1458a_100016285016_100000705612 [0,0,0,0,0,0|3,0,1]=4 319 B14R1.158 COCC=CC(=O)Nc1ccccc1 11a_100000106764_100016285016 [0,0,0,0,0,0|3,0,1]=4 320 B14R1.158 COCC=CC(=O)Nc1ccccc1 1626a_100000106764_100016285016 [0,0,0,0,0,0|3,0,1]=4 321 B14R1.158 COCC=CC(=O)Nc1ccccc1 22a_100000106764_100016285016 [0,0,0,0,0,0|3,0,1]=4 322 B14R1.158 COCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000740836 [0,0,0,0,0,0|3,0,0]=3 323 B14R1.158 COCCCC(=O)Cc1ccccc1 1458a_100000741012_100015291786 [0,0,0,0,0,0|2,0,0]=2 324 B14R1.158 COCCCC(=O)Cc1ccccn1 1458a_100000233486_100000740836 [0,0,0,0,0,0|3,0,0]=3 325 B14R1.158 COCCCC(=O)Cc1ccccn1 1458a_100000741012_100000721315 [0,0,0,0,0,0|3,0,0]=3 326 B14R1.158 COCCCC(=O)Cc1cccnc1 1458a_100000737805_100000740836 [0,0,0,0,0,0|3,0,0]=3 327 B14R1.158 COCCCC(=O)Cc1cccnc1 1458a_100000741012_100000733263 [0,0,0,0,0,0|3,0,0]=3 328 B14R1.158 COCCCC(=O)Cc1cccnn1 1458a_100000741012_100016990269 [0,0,0,0,0,0|4,0,0]=4 329 B14R1.158 COCCCC(=O)Cc1ccncc1 1458a_100000741012_100000705612 [0,0,0,0,0,0|3,0,0]=3 330 B14R1.158 COCCCC(=O)Cc1cnccn1 1458a_100000741012_100016995436 [0,0,0,0,0,0|4,0,0]=4 331 B14R1.158 COCCCC(=O)Cc1cncnc1 1458a_100000721575_100000740836 [0,0,0,0,0,0|4,0,0]=4 332 B14R1.158 COCCCC(=O)Cc1cncnc1 1458a_100000741012_100015196519 [0,0,0,0,0,0|4,0,0]=4 333 B14R1.158 COCCCC(=O)Cc1ncccn1 1458a_100000741012_100000703007 [0,0,0,0,0,0|4,0,0]=4 334 B14R1.158 COCCCC(=O)Nc1ccccc1 11a_100000106764_100000741012 [0,0,0,0,0,0|3,0,0]=3 335 B14R1.158 COCCCC(=O)Nc1ccccc1 1626a_100000106764_100000741012 [0,0,0,0,0,0|3,0,0]=3 336 B14R1.158 COCCCC(=O)Nc1ccccc1 22a_100000106764_100000741012 [0,0,0,0,0,0|3,0,0]=3 337 B14R1.158 COCCCC(=O)Nc1ccccc1 34a_100138415774_100011194425 [0,0,0,0,0,0|3,0,0]=3 338 B14R1.158 COCCCC(=O)Nc1ccccc1 527a_100000106764_100000741012 [0,0,0,0,0,0|3,0,0]=3 339 B14R1.158 COCCCN(C)Cc1ccccc1 2230a_100000186898_100000740836 [0,0,0,0,0,0|4,0,0]=4 340 B14R1.158 COCCCN(C)Cc1ccccc1 2230a_100000224831_100015291786 [0,0,0,0,0,0|4,0,0]=4 341 B14R1.158 COCCCN(C)Cc1ccccc1 2230a_100000707625_200000210301 [0,0,0,0,0,0|4,0,0]=4 342 B14R1.158 COCCCN(C)Cc1ccccc1 269982a_100000186898_100000740836 [0,0,0,0,0,0|4,0,0]=4 343 B14R1.158 COCCCN(C)Cc1ccccc1 269982a_100000224831_100000211182 [0,0,0,0,0,0|4,0,0]=4 344 B14R1.158 COCCCN(C)Cc1ccccc1 269982a_100000707625_200000210301 [0,0,0,0,0,0|4,0,0]=4 345 B14R1.158 COCCCN(C)Cc1ccccc1 270004a_100000224831_100015611070 [0,0,0,0,0,0|4,0,0]=4 346 B14R1.158 COCCCN([13CH3])Cc1ccccc1 2230a_100000707625_200025704644 [0,0,0,0,0,0|4,0,0]=4 347 B14R1.158 COCCCN([13CH3])Cc1ccccc1 269982a_100000707625_200025704644 [0,0,0,0,0,0|4,0,0]=4 348 B14R1.158 COCCNC(=O)C[n+]1ccccc1 240690a_100000209980_200000086051 [0,0,0,0,0,0|3,0,0]=3 349 B14R1.158 COCCNC(=O)C[n+]1ccccc1 527a_100000209980_200000086051 [0,0,0,0,0,0|3,0,0]=3 350 B14R1.158 COCCNC(=O)Cc1cccnc1 240690a_100000209980_100000737805 [0,0,0,0,0,0|3,0,0]=3 351 B14R1.158 COCCNC(=O)Cc1cccnc1 527a_100000209980_100000737805 [0,0,0,0,0,0|3,0,0]=3 352 B14R1.158 COCCNC(=O)Cc1ccncc1 240690a_100000209980_100011201483 [0,0,0,0,0,0|3,0,0]=3 353 B14R1.158 COCCNC(=O)Cc1cnccn1 240690a_100000209980_100000726051 [0,0,0,0,0,0|4,0,0]=4 354 B14R1.158 COCCNC(=O)Cc1cnccn1 527a_100000209980_100000726051 [0,0,0,0,0,0|4,0,0]=4 355 B14R1.158 COCCNC(=O)Cc1cncnc1 240690a_100000209980_100000721575 [0,0,0,0,0,0|4,0,0]=4 356 B14R1.158 COCCNC(=O)Cc1cncnc1 527a_100000209980_100000721575 [0,0,0,0,0,0|4,0,0]=4 357 B14R1.158 COCCNC(=O)Nc1ccccc1 2430a_100000106764_100000209980 [0,0,0,0,0,0|3,0,0]=3 358 B14R1.158 COCCOC(C)Cc1ccccc1 34a_100000210237_200011218536 [0,0,0,0,0,0|2,0,1]=3 359 B14R1.158 COCCOC(C)Cc1ccccc1 34a_100000748627_100011201679 [0,0,0,0,0,0|2,0,1]=3 360 B14R1.158 COCCOC(C)Cc1ccccc1 7a_100000748627_100000233755 [0,0,0,0,0,0|2,0,1]=3 361 B14R1.158 COCCSC(C)Cc1ccccc1 62a_100000233755_200011218536 [0,0,0,0,0,0|2,1,1]=4 362 B14R1.158 COCCSC(C)Cc1ccccc1 62a_200011218536_100000233755 [0,0,0,0,0,0|2,1,1]=4 363 B14R1.158 COCSCC(=O)Cc1ccccc1 62a_100000233483_100000766300 [0,0,0,0,0,0|3,0,0]=3 364 B14R1.158 COCSCC(=O)Cc1ccccc1 62a_100000766300_100000233483 [0,0,0,0,0,0|3,0,0]=3 365 B14R1.158 COCSCC(=O)Nc1ccccc1 62a_100000766300_100000182850 [0,0,0,0,0,0|4,0,0]=4 366 B14R1.158 COCSCC(=O)Nc1ccccc1 62a_100012148978_100000766300 [0,0,0,0,0,0|4,0,0]=4 367 B14R1.158 COCSCC(=O)Oc1ccccc1 62a_100000766300_100009813826 [0,0,0,0,0,0|4,0,0]=4 368 B14R1.158 COCSCC(=O)Oc1ccccc1 62a_100009813826_100000766300 [0,0,0,0,0,0|4,0,0]=4 369 B14R1.158 CSCCCC(=O)Cc1ccccc1 1458a_100000173376_100015291786 [0,0,0,0,0,0|2,0,0]=2 370 B14R1.158 CSCCCC(=O)Cc1ccccn1 1458a_100000173376_100000721315 [0,0,0,0,0,0|3,0,0]=3 371 B14R1.158 CSCCCC(=O)Cc1cccnc1 1458a_100000173376_100000733263 [0,0,0,0,0,0|3,0,0]=3 372 B14R1.158 CSCCCC(=O)Cc1cccnn1 1458a_100000173376_100016990269 [0,0,0,0,0,0|4,0,0]=4 373 B14R1.158 CSCCCC(=O)Cc1ccncc1 1458a_100000173376_100000705612 [0,0,0,0,0,0|3,0,0]=3 374 B14R1.158 CSCCCC(=O)Cc1cnccn1 1458a_100000173376_100016995436 [0,0,0,0,0,0|4,0,0]=4 375 B14R1.158 CSCCCC(=O)Cc1cncnc1 1458a_100000173376_100015196519 [0,0,0,0,0,0|4,0,0]=4 376 B14R1.158 CSCCCC(=O)Cc1ncccn1 1458a_100000173376_100000703007 [0,0,0,0,0,0|4,0,0]=4 377 B14R1.158 CSCCCC(=O)Nc1ccccc1 11a_100000106764_100000173376 [0,0,0,0,0,0|3,0,0]=3 378 B14R1.158 CSCCCC(=O)Nc1ccccc1 1626a_100000106764_100000173376 [0,0,0,0,0,0|3,0,0]=3 379 B14R1.158 CSCCCC(=O)Nc1ccccc1 22a_100000106764_100000173376 [0,0,0,0,0,0|3,0,0]=3 380 B14R1.158 CSCCCC(=O)Nc1ccccc1 527a_100000106764_100000173376 [0,0,0,0,0,0|3,0,0]=3 381 B14R1.158 CSCCCC(=O)Nc1ccccc1 62a_200000210301_100011194425 [0,0,0,0,0,0|3,0,0]=3 382 B14R1.158 CSCCNC(=O)C[n+]1ccccc1 11a_100020590264_200000086051 [0,0,0,0,0,0|3,0,0]=3 383 B14R1.158 CSCCNC(=O)C[n+]1ccccc1 240690a_100020590264_200000086051 [0,0,0,0,0,0|3,0,0]=3 384 B14R1.158 CSCCNC(=O)C[n+]1ccccc1 527a_100020590264_200000086051 [0,0,0,0,0,0|3,0,0]=3 385 B14R1.158 CSCCNC(=O)Cc1ccccn1 11a_100020590264_100000233486 [0,0,0,0,0,0|3,0,0]=3 386 B14R1.158 CSCCNC(=O)Cc1cccnc1 11a_100020590264_100000737805 [0,0,0,0,0,0|3,0,0]=3 387 B14R1.158 CSCCNC(=O)Cc1cccnc1 240690a_100020590264_100000737805 [0,0,0,0,0,0|3,0,0]=3 388 B14R1.158 CSCCNC(=O)Cc1cccnc1 527a_100020590264_100000737805 [0,0,0,0,0,0|3,0,0]=3 389 B14R1.158 CSCCNC(=O)Cc1ccncc1 11a_100020590264_100011201483 [0,0,0,0,0,0|3,0,0]=3 390 B14R1.158 CSCCNC(=O)Cc1ccncc1 240690a_100020590264_100011201483 [0,0,0,0,0,0|3,0,0]=3 391 B14R1.158 CSCCNC(=O)Cc1cnccn1 11a_100020590264_100000726051 [0,0,0,0,0,0|4,0,0]=4 392 B14R1.158 CSCCNC(=O)Cc1cnccn1 240690a_100020590264_100000726051 [0,0,0,0,0,0|4,0,0]=4 393 B14R1.158 CSCCNC(=O)Cc1cnccn1 527a_100020590264_100000726051 [0,0,0,0,0,0|4,0,0]=4 394 B14R1.158 CSCCNC(=O)Cc1cncnc1 11a_100020590264_100000721575 [0,0,0,0,0,0|4,0,0]=4 395 B14R1.158 CSCCNC(=O)Cc1cncnc1 240690a_100020590264_100000721575 [0,0,0,0,0,0|4,0,0]=4 396 B14R1.158 CSCCNC(=O)Cc1cncnc1 527a_100020590264_100000721575 [0,0,0,0,0,0|4,0,0]=4 397 B14R1.158 CSCCNC(=O)Nc1ccccc1 2430a_100000106764_100020590264 [0,0,0,0,0,0|3,0,0]=3 398 B14R1.158 CSCCOC(C)Cc1ccccc1 34a_100000230434_200011218536 [0,0,0,0,0,0|2,0,1]=3 399 B14R1.158 CSCCOC(C)Cc1ccccc1 34a_100000748627_100000212216 [0,0,0,0,0,0|2,0,1]=3 400 B14R1.158 CSCCOC(C)Cc1ccccc1 7a_100000230434_200011218536 [0,0,0,0,0,0|2,0,1]=3 401 B14R1.158 CSCCOC(C)Cc1ccccc1 7a_100000748627_100000212216 [0,0,0,0,0,0|2,0,1]=3 402 B14R1.158 CSCCSC(C)Cc1ccccc1 62a_100000212216_200011218536 [0,0,0,0,0,0|2,1,1]=4 403 B14R1.158 CSCCSC(C)Cc1ccccc1 62a_200011218536_100000751147 [0,0,0,0,0,0|2,1,1]=4 404 B14R1.158 CSCOCC(=O)Nc1ccccc1 34a_100000246334_100011218213 [0,0,0,0,0,0|4,0,0]=4 405 B14R1.158 CSCSCC(=O)Cc1ccccc1 62a_100000233483_100011218213 [0,0,0,0,0,0|3,0,0]=3 406 B14R1.158 CSCSCC(=O)Cc1ccccc1 62a_100011218213_100000233483 [0,0,0,0,0,0|3,0,0]=3 407 B14R1.158 CSCSCC(=O)Nc1ccccc1 62a_100011218213_100000182850 [0,0,0,0,0,0|4,0,0]=4 408 B14R1.158 CSCSCC(=O)Nc1ccccc1 62a_100012148978_100011218213 [0,0,0,0,0,0|4,0,0]=4 409 B14R1.158 CSCSCC(=O)Oc1ccccc1 62a_100009813826_100011218213 [0,0,0,0,0,0|4,0,0]=4 410 B14R1.158 CSCSCC(=O)Oc1ccccc1 62a_100011218213_100009813826 [0,0,0,0,0,0|4,0,0]=4 411 B14R1.158 N#CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000211468 [0,0,0,0,0,0|3,0,1]=4 412 B14R1.158 N#CCCCC(=O)Cc1ccccc1 1458a_100000075515_100015291786 [0,0,0,0,0,0|2,0,1]=3 413 B14R1.158 N#CCCCC(=O)Cc1ccccn1 1458a_100000075515_100000721315 [0,0,0,0,0,0|3,0,1]=4 414 B14R1.158 N#CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000211468 [0,0,0,0,0,0|3,0,1]=4 415 B14R1.158 N#CCCCC(=O)Cc1cccnc1 1458a_100000075515_100000733263 [0,0,0,0,0,0|3,0,1]=4 416 B14R1.158 N#CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000211468 [0,0,0,0,0,0|3,0,1]=4 417 B14R1.158 N#CCCCC(=O)Cc1ccncc1 1458a_100000075515_100000705612 [0,0,0,0,0,0|3,0,1]=4 418 B14R1.158 N#CCCCC(=O)Nc1ccccc1 11a_100000106764_100000075515 [0,0,0,0,0,0|3,0,1]=4 419 B14R1.158 N#CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000075515 [0,0,0,0,0,0|3,0,1]=4 420 B14R1.158 N#CCCCC(=O)Nc1ccccc1 22a_100000106764_100000075515 [0,0,0,0,0,0|3,0,1]=4 421 B14R1.158 N#CCCCC(=O)Nc1ccccc1 527a_100000106764_100000075515 [0,0,0,0,0,0|3,0,1]=4 422 B14R1.158 N#CCCNC(=O)C[n+]1ccccc1 11a_100000720768_200000086051 [0,0,0,0,0,0|3,0,1]=4 423 B14R1.158 N#CCCNC(=O)C[n+]1ccccc1 240690a_100000720768_200000086051 [0,0,0,0,0,0|3,0,1]=4 424 B14R1.158 N#CCCNC(=O)C[n+]1ccccc1 527a_100000720768_200000086051 [0,0,0,0,0,0|3,0,1]=4 425 B14R1.158 N#CCCNC(=O)Cc1ccccn1 11a_100000720768_100000233486 [0,0,0,0,0,0|3,0,1]=4 426 B14R1.158 N#CCCNC(=O)Cc1cccnc1 11a_100000720768_100000737805 [0,0,0,0,0,0|3,0,1]=4 427 B14R1.158 N#CCCNC(=O)Cc1cccnc1 240690a_100000720768_100000737805 [0,0,0,0,0,0|3,0,1]=4 428 B14R1.158 N#CCCNC(=O)Cc1cccnc1 527a_100000720768_100000737805 [0,0,0,0,0,0|3,0,1]=4 429 B14R1.158 N#CCCNC(=O)Cc1ccncc1 11a_100000720768_100011201483 [0,0,0,0,0,0|3,0,1]=4 430 B14R1.158 N#CCCNC(=O)Cc1ccncc1 240690a_100000720768_100011201483 [0,0,0,0,0,0|3,0,1]=4 431 B14R1.158 N#CCCNC(=O)Nc1ccccc1 2430a_100000106764_100000720768 [0,0,0,0,0,0|3,0,1]=4 432 B14R1.158 N#CCSCC(=O)Cc1ccccc1 1458a_100000150266_100015291786 [0,0,0,0,0,0|3,0,1]=4 433 B14R1.158 N#CCSCC(=O)Cc1ccccc1 62a_100000233483_100011215382 [0,0,0,0,0,0|3,0,1]=4 434 B14R1.158 N#CCSCC(=O)Cc1ccccc1 62a_100011215382_100000233483 [0,0,0,0,0,0|3,0,1]=4 435 B14R1.158 NCCOCC(=O)Nc1ccccc1 34a_100000210304_100000182850 [0,0,0,0,0,0|4,0,0]=4 436 B14R1.158 NCCOCC(=O)Oc1ccccc1 34a_100000210304_100009813826 [0,0,0,0,0,0|4,0,0]=4 437 B14R1.158 O=C(CCCCF)C[n+]1ccccc1 1458a_200000086051_100000729493 [0,0,0,0,0,0|3,0,0]=3 438 B14R1.158 O=C(CCCCF)Cc1ccccn1 1458a_100000233486_100000729493 [0,0,0,0,0,0|3,0,0]=3 439 B14R1.158 O=C(CCCCF)Cc1cccnc1 1458a_100000737805_100000729493 [0,0,0,0,0,0|3,0,0]=3 440 B14R1.158 O=C(CCCCF)Cc1cncnc1 1458a_100000721575_100000729493 [0,0,0,0,0,0|4,0,0]=4 441 B14R1.158 O=C(CCCCO)C[n+]1ccccc1 1458a_200000086051_100000210776 [0,0,0,0,0,0|3,0,0]=3 442 B14R1.158 O=C(CCCCO)Cc1ccccc1 1458a_100000695505_100015291786 [0,0,0,0,0,0|2,0,0]=2 443 B14R1.158 O=C(CCCCO)Cc1ccccn1 1458a_100000233486_100000210776 [0,0,0,0,0,0|3,0,0]=3 444 B14R1.158 O=C(CCCCO)Cc1ccccn1 1458a_100000695505_100000721315 [0,0,0,0,0,0|3,0,0]=3 445 B14R1.158 O=C(CCCCO)Cc1cccnc1 1458a_100000695505_100000733263 [0,0,0,0,0,0|3,0,0]=3 446 B14R1.158 O=C(CCCCO)Cc1cccnc1 1458a_100000737805_100000210776 [0,0,0,0,0,0|3,0,0]=3 447 B14R1.158 O=C(CCCCO)Cc1cccnn1 1458a_100000695505_100016990269 [0,0,0,0,0,0|4,0,0]=4 448 B14R1.158 O=C(CCCCO)Cc1ccncc1 1458a_100000695505_100000705612 [0,0,0,0,0,0|3,0,0]=3 449 B14R1.158 O=C(CCCCO)Cc1cnccn1 1458a_100000695505_100016995436 [0,0,0,0,0,0|4,0,0]=4 450 B14R1.158 O=C(CCCCO)Cc1cncnc1 1458a_100000695505_100015196519 [0,0,0,0,0,0|4,0,0]=4 451 B14R1.158 O=C(CCCCO)Cc1cncnc1 1458a_100000721575_100000210776 [0,0,0,0,0,0|4,0,0]=4 452 B14R1.158 O=C(CCCCO)Cc1ncccn1 1458a_100000695505_100000703007 [0,0,0,0,0,0|4,0,0]=4 453 B14R1.158 O=C(CCCCO)Nc1ccccc1 1626a_100000106764_100000695505 [0,0,0,0,0,0|3,0,0]=3 454 B14R1.158 O=C(CCSCF)Nc1ccccc1 62a_100015361967_100000242058 [0,0,0,0,0,0|4,0,0]=4 455 B14R1.158 O=C(CCSCF)Oc1ccccc1 62a_100015361967_200000035796 [0,0,0,0,0,0|4,0,0]=4 456 B14R1.158 O=C(CNCCF)Nc1ccccc1 34a_100000724931_100000182850 [0,0,0,0,0,0|4,0,0]=4 457 B14R1.158 O=C(CNCCF)Oc1ccccc1 34a_100000724931_100009813826 [0,0,0,0,0,0|4,0,0]=4 458 B14R1.158 O=C(CNCCO)Cc1ccccc1 2230a_100016997473_100000233483 [0,0,0,0,0,0|3,0,0]=3 459 B14R1.158 O=C(CNCCO)Nc1ccccc1 2230a_100016997473_100000182850 [0,0,0,0,0,0|4,0,0]=4 460 B14R1.158 O=C(CNCCO)Nc1ccccc1 34a_100016990907_100000182850 [0,0,0,0,0,0|4,0,0]=4 461 B14R1.158 O=C(CNCCO)Oc1ccccc1 2230a_100016997473_100009813826 [0,0,0,0,0,0|4,0,0]=4 462 B14R1.158 O=C(CNCCO)Oc1ccccc1 34a_100016990907_100009813826 [0,0,0,0,0,0|4,0,0]=4 463 B14R1.158 O=C(COCCBr)Nc1ccccc1 34a_100000211926_100000182850 [0,0,0,0,0,0|4,0,0]=4 464 B14R1.158 O=C(COCCBr)Oc1ccccc1 34a_100000211926_100009813826 [0,0,0,0,0,0|4,0,0]=4 465 B14R1.158 O=C(COCCF)Nc1ccccc1 34a_100000246334_100011217306 [0,0,0,0,0,0|4,0,0]=4 466 B14R1.158 O=C(COCCO)Cc1ccccc1 1458a_100000708028_100015291786 [0,0,0,0,0,0|3,0,0]=3 467 B14R1.158 O=C(COCCO)Cc1ccccn1 1458a_100000708028_100000721315 [0,0,0,0,0,0|4,0,0]=4 468 B14R1.158 O=C(COCCO)Cc1cccnc1 1458a_100000708028_100000733263 [0,0,0,0,0,0|4,0,0]=4 469 B14R1.158 O=C(COCCO)Cc1ccncc1 1458a_100000708028_100000705612 [0,0,0,0,0,0|4,0,0]=4 470 B14R1.158 O=C(COCCO)Nc1ccccc1 1626a_100000106764_100000708028 [0,0,0,0,0,0|4,0,0]=4 471 B14R1.158 O=C(COCCO)Nc1ccccc1 34a_100000246334_100000211926 [0,0,0,0,0,0|4,0,0]=4 472 B14R1.158 O=C(CSCCF)Cc1ccccc1 62a_100000233483_100011217306 [0,0,0,0,0,0|3,0,0]=3 473 B14R1.158 O=C(CSCCF)Cc1ccccc1 62a_100011217306_100000233483 [0,0,0,0,0,0|3,0,0]=3 474 B14R1.158 O=C(CSCCF)Nc1ccccc1 62a_100011217306_100000182850 [0,0,0,0,0,0|4,0,0]=4 475 B14R1.158 O=C(CSCCF)Nc1ccccc1 62a_100012148978_100011217306 [0,0,0,0,0,0|4,0,0]=4 476 B14R1.158 O=C(CSCCF)Oc1ccccc1 62a_100009813826_100011217306 [0,0,0,0,0,0|4,0,0]=4 477 B14R1.158 O=C(CSCCF)Oc1ccccc1 62a_100011217306_100009813826 [0,0,0,0,0,0|4,0,0]=4 478 B14R1.158 O=C(CSCCO)Cc1ccccc1 62a_100000211926_100000233483 [0,0,0,0,0,0|3,0,0]=3 479 B14R1.158 O=C(CSCCO)Cc1ccccc1 62a_100000233483_100000211926 [0,0,0,0,0,0|3,0,0]=3 480 B14R1.158 O=C(CSCCO)Nc1ccccc1 62a_100000211926_100000182850 [0,0,0,0,0,0|4,0,0]=4 481 B14R1.158 O=C(CSCCO)Nc1ccccc1 62a_100012148978_100000211926 [0,0,0,0,0,0|4,0,0]=4 482 B14R1.158 O=C(CSCCO)Oc1ccccc1 62a_100000211926_100009813826 [0,0,0,0,0,0|4,0,0]=4 483 B14R1.158 O=C(CSCCO)Oc1ccccc1 62a_100009813826_100000211926 [0,0,0,0,0,0|4,0,0]=4 484 B14R1.158 O=C(C[n+]1ccccc1)NCCCF 11a_100015189416_200000086051 [0,0,0,0,0,0|3,0,0]=3 485 B14R1.158 O=C(C[n+]1ccccc1)NCCCF 240690a_100015189416_200000086051 [0,0,0,0,0,0|3,0,0]=3 486 B14R1.158 O=C(C[n+]1ccccc1)NCCCF 527a_100015189416_200000086051 [0,0,0,0,0,0|3,0,0]=3 487 B14R1.158 O=C(C[n+]1ccccc1)NCCCO 240690a_100000182051_200000086051 [0,0,0,0,0,0|3,0,0]=3 488 B14R1.158 O=C(C[n+]1ccccc1)NCCCO 527a_100000182051_200000086051 [0,0,0,0,0,0|3,0,0]=3 489 B14R1.158 O=C(C[n+]1ccccc1)NNCCO 22a_100000210001_200000086051 [0,0,0,0,0,0|4,0,0]=4 490 B14R1.158 O=C(Cc1ccccn1)NCCCF 11a_100015189416_100000233486 [0,0,0,0,0,0|3,0,0]=3 491 B14R1.158 O=C(Cc1ccccn1)NNCCO 22a_100000210001_100000233486 [0,0,0,0,0,0|4,0,0]=4 492 B14R1.158 O=C(Cc1cccnc1)NCCCF 11a_100015189416_100000737805 [0,0,0,0,0,0|3,0,0]=3 493 B14R1.158 O=C(Cc1cccnc1)NCCCF 240690a_100015189416_100000737805 [0,0,0,0,0,0|3,0,0]=3 494 B14R1.158 O=C(Cc1cccnc1)NCCCF 527a_100015189416_100000737805 [0,0,0,0,0,0|3,0,0]=3 495 B14R1.158 O=C(Cc1cccnc1)NCCCO 240690a_100000182051_100000737805 [0,0,0,0,0,0|3,0,0]=3 496 B14R1.158 O=C(Cc1cccnc1)NCCCO 527a_100000182051_100000737805 [0,0,0,0,0,0|3,0,0]=3 497 B14R1.158 O=C(Cc1cccnc1)NNCCO 22a_100000210001_100000737805 [0,0,0,0,0,0|4,0,0]=4 498 B14R1.158 O=C(Cc1ccncc1)NCCCF 11a_100015189416_100011201483 [0,0,0,0,0,0|3,0,0]=3 499 B14R1.158 O=C(Cc1ccncc1)NCCCF 240690a_100015189416_100011201483 [0,0,0,0,0,0|3,0,0]=3 500 B14R1.158 O=C(Cc1ccncc1)NCCCO 240690a_100000182051_100011201483 [0,0,0,0,0,0|3,0,0]=3 501 B14R1.158 O=C(Cc1ccncc1)NNCCO 22a_100000210001_100011201483 [0,0,0,0,0,0|4,0,0]=4 502 B14R1.158 O=C(Cc1cnccn1)NCCCF 11a_100015189416_100000726051 [0,0,0,0,0,0|4,0,0]=4 503 B14R1.158 O=C(Cc1cnccn1)NCCCF 240690a_100015189416_100000726051 [0,0,0,0,0,0|4,0,0]=4 504 B14R1.158 O=C(Cc1cnccn1)NCCCF 527a_100015189416_100000726051 [0,0,0,0,0,0|4,0,0]=4 505 B14R1.158 O=C(Cc1cnccn1)NCCCO 240690a_100000182051_100000726051 [0,0,0,0,0,0|4,0,0]=4 506 B14R1.158 O=C(Cc1cnccn1)NCCCO 527a_100000182051_100000726051 [0,0,0,0,0,0|4,0,0]=4 507 B14R1.158 O=C(Cc1cncnc1)NCCCF 11a_100015189416_100000721575 [0,0,0,0,0,0|4,0,0]=4 508 B14R1.158 O=C(Cc1cncnc1)NCCCF 240690a_100015189416_100000721575 [0,0,0,0,0,0|4,0,0]=4 509 B14R1.158 O=C(Cc1cncnc1)NCCCF 527a_100015189416_100000721575 [0,0,0,0,0,0|4,0,0]=4 510 B14R1.158 O=C(Cc1cncnc1)NCCCO 240690a_100000182051_100000721575 [0,0,0,0,0,0|4,0,0]=4 511 B14R1.158 O=C(Cc1cncnc1)NCCCO 527a_100000182051_100000721575 [0,0,0,0,0,0|4,0,0]=4 512 B14R1.158 O=C(NCCCF)Nc1ccccc1 2430a_100000106764_100015189416 [0,0,0,0,0,0|3,0,0]=3 513 B14R1.158 O=C(NCCCO)Nc1ccccc1 2430a_100000106764_100000182051 [0,0,0,0,0,0|3,0,0]=3 514 B14R1.158 O=CCSCC(=O)Cc1ccccc1 62a_100000233483_200015260668 [0,0,0,0,0,0|3,0,1]=4 515 B14R1.158 O=CCSCC(=O)Cc1ccccc1 62a_200015260668_100000233483 [0,0,0,0,0,0|3,0,1]=4 516 B14R1.158 [13CH3]N(CCCCO)Cc1ccccc1 2230a_100000186360_200025704644 [0,0,0,0,0,0|4,0,0]=4 517 B14R1.158 [13CH3]N(CCCCO)Cc1ccccc1 269982a_100000186360_200025704644 [0,0,0,0,0,0|4,0,0]=4 518 B14R1.158 [13CH3]NCCCC(=O)Nc1ccccc1 34a_100000750157_200025704644 [0,0,0,0,0,0|3,0,0]=3 519 B14R1.158 [13CH3]SCCCC(=O)Nc1ccccc1 62a_200025704644_100011194425 [0,0,0,0,0,0|3,0,0]=3 520 B14R1.158 [N-]=[N+]=NCCC(=O)Cc1ccccc1 1458a_100000688302_100015291786 [0,0,0,0,0,0|4,0,0]=4 521 B13R1.28 BrCCCCOCc1ccccc1 34a_100011216708_100015291786 [1,0,0,0,0,0|3,0,0]=4 522 B13R1.28 BrCCCOCCc1ccccc1 34a_100011217188_100000765856 [1,0,0,0,0,0|1,0,1]=3 523 B13R1.28 C#CCCOCCc1ccccc1 34a_100000210268_100000688953 [1,0,0,0,0,0|0,0,3]=4 524 B13R1.28 C#CCCOCCc1ccccc1 34a_100011215631_100000765856 [1,0,0,0,0,0|0,0,3]=4 525 B13R1.28 C#CCCOCCc1ccccc1 7a_100000210268_100000688953 [1,0,0,0,0,0|0,0,3]=4 526 B13R1.28 C/C=C/COCCc1ccccc1 34a_100000210268_100102629194 [1,0,0,0,0,0|0,0,3]=4 527 B13R1.28 C/C=C/COCCc1ccccc1 34a_100016270725_100000765856 [1,0,0,0,0,0|0,0,3]=4 528 B13R1.28 C/C=C/COCCc1ccccc1 7a_100000210268_100102629194 [1,0,0,0,0,0|0,0,3]=4 529 B13R1.28 C=CCCOCCc1ccccc1 34a_100000210268_100000754431 [1,0,0,0,0,0|0,0,3]=4 530 B13R1.28 C=CCCOCCc1ccccc1 34a_100011205117_100000765856 [1,0,0,0,0,0|0,0,3]=4 531 B13R1.28 C=CCCOCCc1ccccc1 7a_100000210268_100000754431 [1,0,0,0,0,0|0,0,3]=4 532 B13R1.28 CC#CCOCCc1ccccc1 34a_100000210268_100000748600 [1,0,0,0,0,0|0,0,3]=4 533 B13R1.28 CC#CCOCCc1ccccc1 34a_100000761923_100000765856 [1,0,0,0,0,0|0,0,3]=4 534 B13R1.28 CC#CCOCCc1ccccc1 7a_100000210268_100000748600 [1,0,0,0,0,0|0,0,3]=4 535 B13R1.28 CC=CCOCCc1ccccc1 34a_100000210268_100000070051 [1,0,0,0,0,0|0,0,3]=4 536 B13R1.28 CC=CCOCCc1ccccc1 7a_100000210268_100000070051 [1,0,0,0,0,0|0,0,3]=4 537 B13R1.28 CCCC=NNCc1ccccc1 4a_100000007032_100000185831 [1,0,0,0,0,0|2,0,1]=4 538 B13R1.28 CCCCC=NNc1ccccc1 4a_100015195140_100000210104 [1,0,0,0,0,0|3,0,0]=4 539 B13R1.28 CCCCCC=Cc1ccccc1 271570a_100000062253_100000210277 [1,0,0,0,0,0|1,0,1]=3 540 B13R1.28 CCCCCC=Cc1ccccn1 271570a_100000062253_100011216584 [1,0,0,0,0,0|2,0,1]=4 541 B13R1.28 CCCCCC=Cc1cccnc1 271570a_100000062253_100000752921 [1,0,0,0,0,0|2,0,1]=4 542 B13R1.28 CCCCCC=Cc1ccncc1 271570a_100000062253_100000035832 [1,0,0,0,0,0|2,0,1]=4 543 B13R1.28 CCCCCCNc1ccccc1 34a_100000106764_100000210314 [1,0,0,0,0,0|2,0,1]=4 544 B13R1.28 CCCCCCOc1ccccc1 34a_100000210340_100000210314 [1,0,0,0,0,0|2,0,1]=4 545 B13R1.28 CCCCCCOc1ccccc1 7a_100000210340_100000210314 [1,0,0,0,0,0|2,0,1]=4 546 B13R1.28 CCCCCCSc1ccccc1 62a_100000210314_100000041952 [1,0,0,0,0,0|2,0,1]=4 547 B13R1.28 CCCCCCSc1ccccc1 62a_100000719477_100000210757 [1,0,0,0,0,0|2,0,1]=4 548 B13R1.28 CCCCCNCc1ccccc1 207a_100000209983_100015611070 [1,0,0,0,0,0|2,0,0]=3 549 B13R1.28 CCCCCNCc1ccccc1 2230a_100000209983_100015291786 [1,0,0,0,0,0|2,0,0]=3 550 B13R1.28 CCCCCNCc1ccccc1 2230a_100015324214_100000210326 [1,0,0,0,0,0|2,0,0]=3 551 B13R1.28 CCCCCNCc1ccccc1 270004a_100000209983_100015611070 [1,0,0,0,0,0|2,0,0]=3 552 B13R1.28 CCCCCNCc1ccccc1 34a_100015324214_100000718602 [1,0,0,0,0,0|2,0,0]=3 553 B13R1.28 CCCCCNCc1ccccn1 207a_100000209983_100000209966 [1,0,0,0,0,0|3,0,0]=4 554 B13R1.28 CCCCCNCc1ccccn1 2230a_100000209983_100000721315 [1,0,0,0,0,0|3,0,0]=4 555 B13R1.28 CCCCCNCc1ccccn1 270004a_100000209983_100000209966 [1,0,0,0,0,0|3,0,0]=4 556 B13R1.28 CCCCCNCc1cccnc1 207a_100000209983_100000209961 [1,0,0,0,0,0|3,0,0]=4 557 B13R1.28 CCCCCNCc1cccnc1 2230a_100000209983_100000741622 [1,0,0,0,0,0|3,0,0]=4 558 B13R1.28 CCCCCNCc1cccnc1 270004a_100000209983_100000209961 [1,0,0,0,0,0|3,0,0]=4 559 B13R1.28 CCCCCNCc1ccncc1 207a_100000209983_100000186114 [1,0,0,0,0,0|3,0,0]=4 560 B13R1.28 CCCCCNCc1ccncc1 2230a_100000209983_100015193705 [1,0,0,0,0,0|3,0,0]=4 561 B13R1.28 CCCCCOCc1ccccc1 34a_100000210253_100015291786 [1,0,0,0,0,0|2,0,0]=3 562 B13R1.28 CCCCCOCc1ccccc1 34a_100000210790_100000718602 [1,0,0,0,0,0|2,0,0]=3 563 B13R1.28 CCCCCOCc1ccccc1 7a_100000210253_100000211182 [1,0,0,0,0,0|2,0,0]=3 564 B13R1.28 CCCCCOCc1ccccc1 7a_100000210790_100000210326 [1,0,0,0,0,0|2,0,0]=3 565 B13R1.28 CCCCCOCc1ccccn1 34a_100000210253_100000721315 [1,0,0,0,0,0|3,0,0]=4 566 B13R1.28 CCCCCOCc1ccccn1 7a_100000210253_100000721315 [1,0,0,0,0,0|3,0,0]=4 567 B13R1.28 CCCCCOCc1cccnc1 34a_100000210253_100000733263 [1,0,0,0,0,0|3,0,0]=4 568 B13R1.28 CCCCCOCc1cccnc1 7a_100000210253_100000741622 [1,0,0,0,0,0|3,0,0]=4 569 B13R1.28 CCCCCOCc1ccncc1 7a_100000210253_100015193705 [1,0,0,0,0,0|3,0,0]=4 570 B13R1.28 CCCCCSCc1ccccc1 62a_100000210326_100015291786 [1,0,0,0,0,0|2,0,0]=3 571 B13R1.28 CCCCCSCc1ccccc1 62a_100000211182_100000210326 [1,0,0,0,0,0|2,0,0]=3 572 B13R1.28 CCCCCSCc1ccccn1 62a_100000210326_100000721315 [1,0,0,0,0,0|3,0,0]=4 573 B13R1.28 CCCCCSCc1ccccn1 62a_100000721315_100000210326 [1,0,0,0,0,0|3,0,0]=4 574 B13R1.28 CCCCCSCc1cccnc1 62a_100000210326_100000741622 [1,0,0,0,0,0|3,0,0]=4 575 B13R1.28 CCCCCSCc1cccnc1 62a_100000741622_100000210326 [1,0,0,0,0,0|3,0,0]=4 576 B13R1.28 CCCCCSCc1ccncc1 62a_100000210326_100015193705 [1,0,0,0,0,0|3,0,0]=4 577 B13R1.28 CCCCCSCc1ccncc1 62a_100015193705_100000210326 [1,0,0,0,0,0|3,0,0]=4 578 B13R1.28 CCCCNCCc1ccccc1 2230a_100000102301_100000765856 [1,0,0,0,0,0|1,0,1]=3 579 B13R1.28 CCCCNCCc1ccccc1 2230a_100000106460_100000210211 [1,0,0,0,0,0|1,0,1]=3 580 B13R1.28 CCCCNCCc1ccccc1 34a_100000106460_100000210210 [1,0,0,0,0,0|1,0,1]=3 581 B13R1.28 CCCCNCCc1ccccc1 7a_106832991798_100000765856 [1,0,0,0,0,0|1,0,1]=3 582 B13R1.28 CCCCNCCc1ccccn1 2230a_100000102301_100015183660 [1,0,0,0,0,0|2,0,1]=4 583 B13R1.28 CCCCNCCc1ccccn1 7a_106832991798_100015183660 [1,0,0,0,0,0|2,0,1]=4 584 B13R1.28 CCCCNCCc1cccnc1 2230a_100000102301_200011713674 [1,0,0,0,0,0|2,0,1]=4 585 B13R1.28 CCCCNCCc1cccnc1 2230a_100000736294_100000210211 [1,0,0,0,0,0|2,0,1]=4 586 B13R1.28 CCCCNCCc1cccnc1 7a_106832991798_200011713674 [1,0,0,0,0,0|2,0,1]=4 587 B13R1.28 CCCCNCCc1ccncc1 2230a_100000102301_100000723409 [1,0,0,0,0,0|2,0,1]=4 588 B13R1.28 CCCCNCCc1ccncc1 7a_106832991798_100000723409 [1,0,0,0,0,0|2,0,1]=4 589 B13R1.28 CCCCNCSc1ccccc1 2230a_100000102301_100011218342 [1,0,0,0,0,0|2,0,1]=4 590 B13R1.28 CCCCNN=Cc1ccccc1 4a_100025702795_100015611070 [1,0,0,0,0,0|2,0,1]=4 591 B13R1.28 CCCCOCCc1ccccc1 34a_100000210227_100000765856 [1,0,0,0,0,0|0,0,1]=2 592 B13R1.28 CCCCOCCc1ccccc1 34a_100000210268_100000210210 [1,0,0,0,0,0|0,0,1]=2 593 B13R1.28 CCCCOCCc1ccccc1 7a_100000210227_100000765856 [1,0,0,0,0,0|0,0,1]=2 594 B13R1.28 CCCCOCCc1ccccc1 7a_100000210268_100000210211 [1,0,0,0,0,0|0,0,1]=2 595 B13R1.28 CCCCOCCc1ccccn1 34a_100000210271_100000210210 [1,0,0,0,0,0|1,0,1]=3 596 B13R1.28 CCCCOCCc1ccccn1 7a_100000210227_100015183660 [1,0,0,0,0,0|1,0,1]=3 597 B13R1.28 CCCCOCCc1cccnc1 34a_100011217484_100000210210 [1,0,0,0,0,0|1,0,1]=3 598 B13R1.28 CCCCOCCc1cccnc1 7a_100000210227_200011713674 [1,0,0,0,0,0|1,0,1]=3 599 B13R1.28 CCCCOCCc1ccncc1 34a_100011216225_100000210210 [1,0,0,0,0,0|1,0,1]=3 600 B13R1.28 CCCCOCCc1ccncc1 7a_100000210227_100000723409 [1,0,0,0,0,0|1,0,1]=3 601 B13R1.28 CCCCOCCc1cnccn1 34a_100011349526_100000210210 [1,0,0,0,0,0|2,0,1]=4 602 B13R1.28 CCCCOCCc1cncnc1 34a_100011709255_100000210210 [1,0,0,0,0,0|2,0,1]=4 603 B13R1.28 CCCCOCNc1ccccc1 34a_100000106764_100011995733 [1,0,0,0,0,0|1,0,1]=3 604 B13R1.28 CCCCOCOc1ccccc1 34a_100000210340_100011995733 [1,0,0,0,0,0|1,0,1]=3 605 B13R1.28 CCCCOCOc1cccnc1 34a_100000210849_100011995733 [1,0,0,0,0,0|2,0,1]=4 606 B13R1.28 CCCCOCOc1ccncc1 34a_100000212176_100011995733 [1,0,0,0,0,0|2,0,1]=4 607 B13R1.28 CCCCOCSc1ccccc1 62a_100000719477_100011995733 [1,0,0,0,0,0|1,0,1]=3 608 B13R1.28 CCCCOCSc1ccccc1 62a_100011995733_100000041952 [1,0,0,0,0,0|1,0,1]=3 609 B13R1.28 CCCCOCSc1ccccn1 62a_100011216584_100011995733 [1,0,0,0,0,0|2,0,1]=4 610 B13R1.28 CCCCOCSc1ccccn1 62a_100011995733_100011216584 [1,0,0,0,0,0|2,0,1]=4 611 B13R1.28 CCCCOCSc1cccnc1 62a_100000210063_100011995733 [1,0,0,0,0,0|2,0,1]=4 612 B13R1.28 CCCCOCSc1cccnc1 62a_100011995733_100000210063 [1,0,0,0,0,0|2,0,1]=4 613 B13R1.28 CCCCOCSc1ccncc1 62a_100000728582_100011995733 [1,0,0,0,0,0|2,0,1]=4 614 B13R1.28 CCCCOCSc1ccncc1 62a_100011995733_100000728582 [1,0,0,0,0,0|2,0,1]=4 615 B13R1.28 CCCCSCCc1ccccc1 62a_100000210211_100011218657 [1,0,0,0,0,0|0,1,1]=3 616 B13R1.28 CCCCSCCc1ccccc1 62a_100000765856_100000210210 [1,0,0,0,0,0|0,1,1]=3 617 B13R1.28 CCCCSCCc1ccccn1 62a_100000210211_100015183660 [1,0,0,0,0,0|1,1,1]=4 618 B13R1.28 CCCCSCCc1ccccn1 62a_100015183660_100000210210 [1,0,0,0,0,0|1,1,1]=4 619 B13R1.28 CCCCSCCc1cccnc1 62a_100000210211_200011713674 [1,0,0,0,0,0|1,1,1]=4 620 B13R1.28 CCCCSCCc1cccnc1 62a_200011713674_100000210210 [1,0,0,0,0,0|1,1,1]=4 621 B13R1.28 CCCCSCCc1ccncc1 62a_100000210211_100000723409 [1,0,0,0,0,0|1,1,1]=4 622 B13R1.28 CCCCSCCc1ccncc1 62a_100000723409_100000210210 [1,0,0,0,0,0|1,1,1]=4 623 B13R1.28 CCCCSCSc1ccccc1 62a_100000210211_100011218342 [1,0,0,0,0,0|1,1,1]=4 624 B13R1.28 CCCCSCSc1ccccc1 62a_100011218342_100000210210 [1,0,0,0,0,0|1,1,1]=4 625 B13R1.28 CCCNC/C=C/c1ccccc1 2230a_100020603302_100000210303 [1,0,0,0,0,0|2,0,1]=4 626 B13R1.28 CCCNC/C=C/c1ccccc1 34a_100020603302_100000210303 [1,0,0,0,0,0|2,0,1]=4 627 B13R1.28 CCCNCC=Cc1ccccc1 270004a_100020643023_100000210105 [1,0,0,0,0,0|2,0,1]=4 628 B13R1.28 CCCNCCCc1ccccc1 2230a_100000211184_100000210303 [1,0,0,0,0,0|2,0,1]=4 629 B13R1.28 CCCNCCCc1ccccc1 34a_100000211184_100000210303 [1,0,0,0,0,0|2,0,1]=4 630 B13R1.28 CCCNN=CCc1ccccc1 4a_100000740057_100000209964 [1,0,0,0,0,0|2,0,0]=3 631 B13R1.28 CCCOC/C=C/c1ccccc1 34a_100000210256_100000210303 [1,0,0,0,0,0|2,0,1]=4 632 B13R1.28 CCCOC/C=C/c1ccccc1 34a_100000210258_100016265936 [1,0,0,0,0,0|2,0,1]=4 633 B13R1.28 CCCOCCCc1ccccc1 34a_100000210258_100000211621 [1,0,0,0,0,0|2,0,1]=4 634 B13R1.28 CCCOCCCc1ccccc1 34a_100000210828_100000210303 [1,0,0,0,0,0|2,0,1]=4 635 B13R1.28 CCCOCCCc1ccccc1 7a_100000210828_100000210303 [1,0,0,0,0,0|2,0,1]=4 636 B13R1.28 CCCOCOCc1ccccc1 34a_100000210258_100000763385 [1,0,0,0,0,0|3,0,0]=4 637 B13R1.28 CCCOCSCc1ccccc1 34a_100000210258_200011217039 [1,0,0,0,0,0|3,0,0]=4 638 B13R1.28 CCCSC/C=C/c1ccccc1 62a_100000210303_100016265936 [1,0,0,0,0,0|2,0,1]=4 639 B13R1.28 CCCSC/C=C/c1ccccc1 62a_100016265936_100000210303 [1,0,0,0,0,0|2,0,1]=4 640 B13R1.28 CCCSCCCc1ccccc1 62a_100000210303_100000211621 [1,0,0,0,0,0|2,0,1]=4 641 B13R1.28 CCCSCCCc1ccccc1 62a_100000211621_100000210303 [1,0,0,0,0,0|2,0,1]=4 642 B13R1.28 CCCSCOCc1ccccc1 62a_100000210303_100000763385 [1,0,0,0,0,0|3,0,0]=4 643 B13R1.28 CCCSCOCc1ccccc1 62a_100000763385_100000210303 [1,0,0,0,0,0|3,0,0]=4 644 B13R1.28 CCCSCSCc1ccccc1 62a_100000210303_200011217039 [1,0,0,0,0,0|3,0,0]=4 645 B13R1.28 CCCSCSCc1ccccc1 62a_200011217039_100000210303 [1,0,0,0,0,0|3,0,0]=4 646 B13R1.28 CCNCCCCc1ccccc1 2230a_100015280158_100000210202 [1,0,0,0,0,0|2,0,1]=4 647 B13R1.28 CCNCCCCc1ccccc1 2230a_100015525214_100000701786 [1,0,0,0,0,0|2,0,1]=4 648 B13R1.28 CCNCCCCc1ccccc1 34a_100015280158_100000210202 [1,0,0,0,0,0|2,0,1]=4 649 B13R1.28 CCNCCOCc1ccccc1 2230a_100000753106_100000210202 [1,0,0,0,0,0|3,0,0]=4 650 B13R1.28 CCNCCOCc1ccccc1 2230a_100015525214_100000234347 [1,0,0,0,0,0|3,0,0]=4 651 B13R1.28 CCNCCOCc1ccccc1 34a_100000753106_100000210202 [1,0,0,0,0,0|3,0,0]=4 652 B13R1.28 CCNCCSCc1ccccc1 2230a_100000189534_100000210202 [1,0,0,0,0,0|3,0,0]=4 653 B13R1.28 CCNCCSCc1ccccc1 2230a_100015525214_200011297719 [1,0,0,0,0,0|3,0,0]=4 654 B13R1.28 CCNCCSCc1ccccc1 34a_100000189534_100000210202 [1,0,0,0,0,0|3,0,0]=4 655 B13R1.28 CCNCCSCc1ccccc1 7a_100000189534_100000210202 [1,0,0,0,0,0|3,0,0]=4 656 B13R1.28 CCOCCCCc1ccccc1 34a_100000703073_100000210202 [1,0,0,0,0,0|2,0,1]=4 657 B13R1.28 CCOCCCCc1ccccc1 34a_100121572206_100000701786 [1,0,0,0,0,0|2,0,1]=4 658 B13R1.28 CCOCCCCc1ccccc1 7a_100000703073_100000210202 [1,0,0,0,0,0|2,0,1]=4 659 B13R1.28 CCOCCNCc1ccccc1 207a_100011200944_100015611070 [1,0,0,0,0,0|3,0,0]=4 660 B13R1.28 CCOCCNCc1ccccc1 2230a_100015324214_100011215890 [1,0,0,0,0,0|3,0,0]=4 661 B13R1.28 CCOCCNCc1ccccc1 2230a_102516460346_100015291786 [1,0,0,0,0,0|3,0,0]=4 662 B13R1.28 CCOCCNCc1ccccc1 270004a_102516460346_100015611070 [1,0,0,0,0,0|3,0,0]=4 663 B13R1.28 CCOCCNCc1ccccc1 34a_100000180844_100000210202 [1,0,0,0,0,0|3,0,0]=4 664 B13R1.28 CCOCCNCc1ccccc1 34a_100015324214_100000210147 [1,0,0,0,0,0|3,0,0]=4 665 B13R1.28 CCOCCNCc1ccccc1 34a_102516460346_100015291786 [1,0,0,0,0,0|3,0,0]=4 666 B13R1.28 CCOCCOCc1ccccc1 34a_100000210136_100015291786 [1,0,0,0,0,0|3,0,0]=4 667 B13R1.28 CCOCCOCc1ccccc1 34a_100000210790_100000210147 [1,0,0,0,0,0|3,0,0]=4 668 B13R1.28 CCOCCOCc1ccccc1 34a_100000759325_100000210202 [1,0,0,0,0,0|3,0,0]=4 669 B13R1.28 CCOCCOCc1ccccc1 34a_100121572206_100000234347 [1,0,0,0,0,0|3,0,0]=4 670 B13R1.28 CCOCCOCc1ccccc1 7a_100000210136_100000211182 [1,0,0,0,0,0|3,0,0]=4 671 B13R1.28 CCOCCOCc1ccccc1 7a_100000210790_100011215890 [1,0,0,0,0,0|3,0,0]=4 672 B13R1.28 CCOCCOCc1ccccc1 7a_100000759325_100000210202 [1,0,0,0,0,0|3,0,0]=4 673 B13R1.28 CCOCCSCc1ccccc1 34a_100011205989_100000210202 [1,0,0,0,0,0|3,0,0]=4 674 B13R1.28 CCOCCSCc1ccccc1 34a_100121572206_200011297719 [1,0,0,0,0,0|3,0,0]=4 675 B13R1.28 CCOCCSCc1ccccc1 62a_100000210147_100015291786 [1,0,0,0,0,0|3,0,0]=4 676 B13R1.28 CCOCCSCc1ccccc1 62a_100000211182_100011215890 [1,0,0,0,0,0|3,0,0]=4 677 B13R1.28 CCOCCSCc1ccccc1 7a_100011205989_100000210202 [1,0,0,0,0,0|3,0,0]=4 678 B13R1.28 CCOCSCCc1ccccc1 62a_100000739092_100011218657 [1,0,0,0,0,0|1,1,1]=4 679 B13R1.28 CCOCSCCc1ccccc1 62a_100000765856_100000739092 [1,0,0,0,0,0|1,1,1]=4 680 B13R1.28 CCSCCCCc1ccccc1 62a_100000210202_100000701786 [1,0,0,0,0,0|2,0,1]=4 681 B13R1.28 CCSCCCCc1ccccc1 62a_100000701786_100000210202 [1,0,0,0,0,0|2,0,1]=4 682 B13R1.28 CCSCCNCc1ccccc1 207a_100000106463_100015611070 [1,0,0,0,0,0|3,0,0]=4 683 B13R1.28 CCSCCNCc1ccccc1 2230a_100000106463_100015291786 [1,0,0,0,0,0|3,0,0]=4 684 B13R1.28 CCSCCNCc1ccccc1 2230a_100015324214_100000757381 [1,0,0,0,0,0|3,0,0]=4 685 B13R1.28 CCSCCNCc1ccccc1 270004a_100000106463_100015611070 [1,0,0,0,0,0|3,0,0]=4 686 B13R1.28 CCSCCNCc1ccccc1 34a_100015324214_100000757381 [1,0,0,0,0,0|3,0,0]=4 687 B13R1.28 CCSCCOCc1ccccc1 34a_100000210790_100000757381 [1,0,0,0,0,0|3,0,0]=4 688 B13R1.28 CCSCCOCc1ccccc1 34a_100000212035_100015291786 [1,0,0,0,0,0|3,0,0]=4 689 B13R1.28 CCSCCOCc1ccccc1 62a_100000210202_100000234347 [1,0,0,0,0,0|3,0,0]=4 690 B13R1.28 CCSCCOCc1ccccc1 62a_100000234347_100000210202 [1,0,0,0,0,0|3,0,0]=4 691 B13R1.28 CCSCCOCc1ccccc1 7a_100000210790_100000757381 [1,0,0,0,0,0|3,0,0]=4 692 B13R1.28 CCSCCOCc1ccccc1 7a_100000212035_100000211182 [1,0,0,0,0,0|3,0,0]=4 693 B13R1.28 CCSCCSCc1ccccc1 62a_100000210202_200011297719 [1,0,0,0,0,0|3,0,0]=4 694 B13R1.28 CCSCCSCc1ccccc1 62a_100000211182_100000757381 [1,0,0,0,0,0|3,0,0]=4 695 B13R1.28 CCSCCSCc1ccccc1 62a_100000757381_100015291786 [1,0,0,0,0,0|3,0,0]=4 696 B13R1.28 CCSCCSCc1ccccc1 62a_200011297719_100000210202 [1,0,0,0,0,0|3,0,0]=4 697 B13R1.28 CNCCCCCc1ccccc1 2230a_100000750932_200000210301 [1,0,0,0,0,0|2,0,1]=4 698 B13R1.28 CNCCCCCc1ccccc1 2230a_106832991635_200011217138 [1,0,0,0,0,0|2,0,1]=4 699 B13R1.28 CNCCCCCc1ccccc1 34a_100000750932_200000210301 [1,0,0,0,0,0|2,0,1]=4 700 B13R1.28 CNCCCCCc1ccccc1 34a_100102657272_200011217138 [1,0,0,0,0,0|2,0,1]=4 701 B13R1.28 CNCCCCCc1ccccc1 7a_106832991635_200011217138 [1,0,0,0,0,0|2,0,1]=4 702 B13R1.28 CNCCCOCc1ccccc1 2230a_106832991635_100011215529 [1,0,0,0,0,0|3,0,0]=4 703 B13R1.28 CNCCCOCc1ccccc1 2230a_200000206031_200000210301 [1,0,0,0,0,0|3,0,0]=4 704 B13R1.28 CNCCCOCc1ccccc1 34a_100000213112_100015291786 [1,0,0,0,0,0|3,0,0]=4 705 B13R1.28 CNCCCOCc1ccccc1 34a_100102657272_100011215529 [1,0,0,0,0,0|3,0,0]=4 706 B13R1.28 CNCCCOCc1ccccc1 34a_200000206031_200000210301 [1,0,0,0,0,0|3,0,0]=4 707 B13R1.28 CNCCCOCc1ccccc1 7a_106832991635_100011215529 [1,0,0,0,0,0|3,0,0]=4 708 B13R1.28 COCCCCCc1ccccc1 34a_100138415774_200011217138 [1,0,0,0,0,0|2,0,1]=4 709 B13R1.28 COCCCCCc1ccccc1 34a_200011219639_200000210301 [1,0,0,0,0,0|2,0,1]=4 710 B13R1.28 COCCCCCc1ccccc1 7a_200011219639_200000210301 [1,0,0,0,0,0|2,0,1]=4 711 B13R1.28 COCCCNCc1ccccc1 207a_100150723488_100015611070 [1,0,0,0,0,0|3,0,0]=4 712 B13R1.28 COCCCNCc1ccccc1 2230a_100015324214_100000740836 [1,0,0,0,0,0|3,0,0]=4 713 B13R1.28 COCCCNCc1ccccc1 270004a_100150723488_100015611070 [1,0,0,0,0,0|3,0,0]=4 714 B13R1.28 COCCCNCc1ccccc1 34a_100000185501_200000210301 [1,0,0,0,0,0|3,0,0]=4 715 B13R1.28 COCCCNCc1ccccc1 34a_100015324214_100000740836 [1,0,0,0,0,0|3,0,0]=4 716 B13R1.28 COCCCNCc1ccccc1 34a_100150723488_100015291786 [1,0,0,0,0,0|3,0,0]=4 717 B13R1.28 COCCCOCc1ccccc1 34a_100000210790_100000740836 [1,0,0,0,0,0|3,0,0]=4 718 B13R1.28 COCCCOCc1ccccc1 34a_100000691849_200000210301 [1,0,0,0,0,0|3,0,0]=4 719 B13R1.28 COCCCOCc1ccccc1 34a_100000740835_100015291786 [1,0,0,0,0,0|3,0,0]=4 720 B13R1.28 COCCCOCc1ccccc1 34a_100138415774_100011215529 [1,0,0,0,0,0|3,0,0]=4 721 B13R1.28 COCCCOCc1ccccc1 7a_100000210790_100000740836 [1,0,0,0,0,0|3,0,0]=4 722 B13R1.28 COCCCOCc1ccccc1 7a_100000691849_200000210301 [1,0,0,0,0,0|3,0,0]=4 723 B13R1.28 COCCCSCc1ccccc1 62a_100000211182_100000709357 [1,0,0,0,0,0|3,0,0]=4 724 B13R1.28 COCCCSCc1ccccc1 62a_100000709357_100015291786 [1,0,0,0,0,0|3,0,0]=4 725 B13R1.28 COCCNCCc1ccccc1 2230a_100000106460_100011201679 [1,0,0,0,0,0|2,0,1]=4 726 B13R1.28 COCCNCCc1ccccc1 2230a_100000209980_100000765856 [1,0,0,0,0,0|2,0,1]=4 727 B13R1.28 COCCNCCc1ccccc1 34a_100000106460_100011201679 [1,0,0,0,0,0|2,0,1]=4 728 B13R1.28 COCCOCCc1ccccc1 34a_100000210237_100000765856 [1,0,0,0,0,0|1,0,1]=3 729 B13R1.28 COCCOCCc1ccccc1 34a_100000210268_100011201679 [1,0,0,0,0,0|1,0,1]=3 730 B13R1.28 COCCOCCc1ccccc1 7a_100000210268_100000233755 [1,0,0,0,0,0|1,0,1]=3 731 B13R1.28 COCCOCCc1ccccn1 34a_100000210271_100011201679 [1,0,0,0,0,0|2,0,1]=4 732 B13R1.28 COCCOCCc1cccnc1 34a_100011217484_100011201679 [1,0,0,0,0,0|2,0,1]=4 733 B13R1.28 COCCOCCc1ccncc1 34a_100011216225_100011201679 [1,0,0,0,0,0|2,0,1]=4 734 B13R1.28 COCCOCSc1ccccc1 62a_100000231047_100000041952 [1,0,0,0,0,0|2,0,1]=4 735 B13R1.28 COCCOCSc1ccccc1 62a_100000719477_100000231047 [1,0,0,0,0,0|2,0,1]=4 736 B13R1.28 COCCSCCc1ccccc1 62a_100000233755_100011218657 [1,0,0,0,0,0|1,1,1]=4 737 B13R1.28 COCCSCCc1ccccc1 62a_100000765856_100000233755 [1,0,0,0,0,0|1,1,1]=4 738 B13R1.28 CSCCCCCc1ccccc1 62a_200000210301_200011217138 [1,0,0,0,0,0|2,0,1]=4 739 B13R1.28 CSCCCCCc1ccccc1 62a_200011217138_200000210301 [1,0,0,0,0,0|2,0,1]=4 740 B13R1.28 CSCCCNCc1ccccc1 207a_100000749238_100015611070 [1,0,0,0,0,0|3,0,0]=4 741 B13R1.28 CSCCCNCc1ccccc1 2230a_100000749238_100015291786 [1,0,0,0,0,0|3,0,0]=4 742 B13R1.28 CSCCCNCc1ccccc1 270004a_100000749238_100015611070 [1,0,0,0,0,0|3,0,0]=4 743 B13R1.28 CSCCCOCc1ccccc1 34a_100000690336_100015291786 [1,0,0,0,0,0|3,0,0]=4 744 B13R1.28 CSCCCOCc1ccccc1 62a_100011215529_200000210301 [1,0,0,0,0,0|3,0,0]=4 745 B13R1.28 CSCCCOCc1ccccc1 62a_200000210301_100011215529 [1,0,0,0,0,0|3,0,0]=4 746 B13R1.28 CSCCCOCc1ccccc1 7a_100000690336_100000211182 [1,0,0,0,0,0|3,0,0]=4 747 B13R1.28 CSCCNCCc1ccccc1 2230a_100000106460_100000751147 [1,0,0,0,0,0|2,0,1]=4 748 B13R1.28 CSCCNCCc1ccccc1 2230a_100020590264_100000765856 [1,0,0,0,0,0|2,0,1]=4 749 B13R1.28 CSCCNCCc1ccccc1 34a_100000106460_100000212216 [1,0,0,0,0,0|2,0,1]=4 750 B13R1.28 CSCCOCCc1ccccc1 34a_100000210268_100000212216 [1,0,0,0,0,0|1,0,1]=3 751 B13R1.28 CSCCOCCc1ccccc1 34a_100000230434_100000765856 [1,0,0,0,0,0|1,0,1]=3 752 B13R1.28 CSCCOCCc1ccccc1 7a_100000210268_100000212216 [1,0,0,0,0,0|1,0,1]=3 753 B13R1.28 CSCCOCCc1ccccc1 7a_100000230434_100000765856 [1,0,0,0,0,0|1,0,1]=3 754 B13R1.28 CSCCOCCc1ccccn1 34a_100000210271_100000212216 [1,0,0,0,0,0|2,0,1]=4 755 B13R1.28 CSCCOCCc1ccccn1 7a_100000230434_100015183660 [1,0,0,0,0,0|2,0,1]=4 756 B13R1.28 CSCCOCCc1cccnc1 34a_100011217484_100000212216 [1,0,0,0,0,0|2,0,1]=4 757 B13R1.28 CSCCOCCc1cccnc1 7a_100000230434_200011713674 [1,0,0,0,0,0|2,0,1]=4 758 B13R1.28 CSCCOCCc1ccncc1 34a_100011216225_100000212216 [1,0,0,0,0,0|2,0,1]=4 759 B13R1.28 CSCCOCCc1ccncc1 7a_100000230434_100000723409 [1,0,0,0,0,0|2,0,1]=4 760 B13R1.28 CSCCSCCc1ccccc1 62a_100000212216_100011218657 [1,0,0,0,0,0|1,1,1]=4 761 B13R1.28 CSCCSCCc1ccccc1 62a_100000765856_100000751147 [1,0,0,0,0,0|1,1,1]=4 762 B13R1.28 ClCCCCOCc1ccccc1 34a_100000210776_100015291786 [1,0,0,0,0,0|3,0,0]=4 763 B13R1.28 ClCCCCOCc1ccccc1 7a_100000210776_100000211182 [1,0,0,0,0,0|3,0,0]=4 764 B13R1.28 ClCCCOCCc1ccccc1 34a_100000230001_100000765856 [1,0,0,0,0,0|1,0,1]=3 765 B13R1.28 FCCCCNCc1ccccc1 2230a_100015324214_100000729493 [1,0,0,0,0,0|3,0,0]=4 766 B13R1.28 FCCCCNCc1ccccc1 34a_100015324214_100000729493 [1,0,0,0,0,0|3,0,0]=4 767 B13R1.28 FCCCCOCc1ccccc1 34a_100000210790_100000729493 [1,0,0,0,0,0|3,0,0]=4 768 B13R1.28 FCCCCOCc1ccccc1 34a_100011995726_100015291786 [1,0,0,0,0,0|3,0,0]=4 769 B13R1.28 FCCCCOCc1ccccc1 7a_100000210790_100000729493 [1,0,0,0,0,0|3,0,0]=4 770 B13R1.28 FCCCCOCc1ccccc1 7a_100011995726_100000211182 [1,0,0,0,0,0|3,0,0]=4 771 B13R1.28 FCCCCSCc1ccccc1 62a_100000211182_100000729493 [1,0,0,0,0,0|3,0,0]=4 772 B13R1.28 FCCCCSCc1ccccc1 62a_100000729493_100015291786 [1,0,0,0,0,0|3,0,0]=4 773 B13R1.28 FCCCNCCc1ccccc1 2230a_100000106460_100011934791 [1,0,0,0,0,0|2,0,1]=4 774 B13R1.28 FCCCNCCc1ccccc1 2230a_100015189416_100000765856 [1,0,0,0,0,0|2,0,1]=4 775 B13R1.28 FCCCNCCc1ccccc1 34a_100000106460_100011934791 [1,0,0,0,0,0|2,0,1]=4 776 B13R1.28 FCCCNCCc1ccccc1 34a_100015189416_100000765856 [1,0,0,0,0,0|2,0,1]=4 777 B13R1.28 FCCCOCCc1ccccc1 34a_100000210268_100011934791 [1,0,0,0,0,0|1,0,1]=3 778 B13R1.28 FCCCOCCc1ccccc1 34a_100000759539_100000765856 [1,0,0,0,0,0|1,0,1]=3 779 B13R1.28 FCCCOCCc1ccccc1 7a_100000210268_100011934791 [1,0,0,0,0,0|1,0,1]=3 780 B13R1.28 FCCCOCCc1ccccn1 34a_100000210271_100011934791 [1,0,0,0,0,0|2,0,1]=4 781 B13R1.28 FCCCOCCc1cccnc1 34a_100011217484_100011934791 [1,0,0,0,0,0|2,0,1]=4 782 B13R1.28 FCCCOCCc1ccncc1 34a_100011216225_100011934791 [1,0,0,0,0,0|2,0,1]=4 783 B13R1.28 FCCCSCCc1ccccc1 62a_100000765856_100011934791 [1,0,0,0,0,0|1,1,1]=4 784 B13R1.28 FCCCSCCc1ccccc1 62a_100011934791_100011218657 [1,0,0,0,0,0|1,1,1]=4 785 B13R1.28 ICCCCOCc1ccccc1 34a_200012148704_100015291786 [1,0,0,0,0,0|3,0,0]=4 786 B13R1.28 N#CCCOCCc1ccccc1 7a_100000210268_100000184422 [1,0,0,0,0,0|1,0,2]=4 787 B13R1.28 NCCCCOCc1ccccc1 34a_100000750430_100015291786 [1,0,0,0,0,0|3,0,0]=4 788 B13R1.28 NCCCOCCc1ccccc1 34a_100000182051_100000765856 [1,0,0,0,0,0|1,0,1]=3 789 B13R1.28 NOCCOCCc1ccccc1 34a_100000700252_100000765856 [1,0,0,0,0,0|2,0,1]=4 790 B13R1.28 OCCCCNCc1ccccc1 207a_100000750430_100015611070 [1,0,0,0,0,0|3,0,0]=4 791 B13R1.28 OCCCCNCc1ccccc1 2230a_100000750430_100015291786 [1,0,0,0,0,0|3,0,0]=4 792 B13R1.28 OCCCCNCc1ccccc1 2230a_100015324214_100000210776 [1,0,0,0,0,0|3,0,0]=4 793 B13R1.28 OCCCCNCc1ccccc1 270004a_100000750430_100015611070 [1,0,0,0,0,0|3,0,0]=4 794 B13R1.28 OCCCCNCc1ccccc1 34a_100000750430_100015291786 [1,0,0,0,0,0|3,0,0]=4 795 B13R1.28 OCCCCNCc1ccccc1 34a_100015324214_100011216708 [1,0,0,0,0,0|3,0,0]=4 796 B13R1.28 OCCCCOCc1ccccc1 34a_100000210790_100011216708 [1,0,0,0,0,0|3,0,0]=4 797 B13R1.28 OCCCCOCc1ccccc1 7a_100000210790_100000210776 [1,0,0,0,0,0|3,0,0]=4 798 B13R1.28 OCCCCSCc1ccccc1 62a_100000210776_100015291786 [1,0,0,0,0,0|3,0,0]=4 799 B13R1.28 OCCCCSCc1ccccc1 62a_100000211182_100000210776 [1,0,0,0,0,0|3,0,0]=4 800 B13R1.28 OCCCNCCc1ccccc1 2230a_100000106460_100000230001 [1,0,0,0,0,0|2,0,1]=4 801 B13R1.28 OCCCNCCc1ccccc1 34a_100000106460_100000230001 [1,0,0,0,0,0|2,0,1]=4 802 B13R1.28 OCCCOCCc1ccccc1 34a_100000210268_100000230001 [1,0,0,0,0,0|1,0,1]=3 803 B13R1.28 OCCCOCCc1ccccc1 7a_100000210268_100011215043 [1,0,0,0,0,0|1,0,1]=3 804 B13R1.28 OCCCOCCc1ccccn1 34a_100000210271_100000230001 [1,0,0,0,0,0|2,0,1]=4 805 B13R1.28 OCCCOCCc1cccnc1 34a_100011217484_100000230001 [1,0,0,0,0,0|2,0,1]=4 806 B13R1.28 OCCCOCCc1ccncc1 34a_100011216225_100000230001 [1,0,0,0,0,0|2,0,1]=4 807 B13R1.28 OCCCSCCc1ccccc1 62a_100000765856_100011215043 [1,0,0,0,0,0|1,1,1]=4 808 B13R1.28 OCCCSCCc1ccccc1 62a_100011215043_100011218657 [1,0,0,0,0,0|1,1,1]=4 809 B13R1.28 OCCNN=CCc1ccccc1 4a_100000210001_100000209964 [1,0,0,0,0,0|3,0,0]=4 810 B13R1.28 [13CH3]NCCCCCc1ccccc1 2230a_100000750932_200025704644 [1,0,0,0,0,0|2,0,1]=4 811 B13R1.28 [13CH3]NCCCCCc1ccccc1 34a_100000750932_200025704644 [1,0,0,0,0,0|2,0,1]=4 812 B13R1.28 [13CH3]NCCCOCc1ccccc1 2230a_200000206031_200025704644 [1,0,0,0,0,0|3,0,0]=4 813 B13R1.28 [13CH3]NCCCOCc1ccccc1 34a_200000206031_200025704644 [1,0,0,0,0,0|3,0,0]=4 814 B13R1.28 [13CH3]OCCCCCc1ccccc1 34a_200011219639_200025704644 [1,0,0,0,0,0|2,0,1]=4 815 B13R1.28 [13CH3]OCCCCCc1ccccc1 7a_200011219639_200025704644 [1,0,0,0,0,0|2,0,1]=4 816 B13R1.28 [13CH3]OCCCNCc1ccccc1 34a_100000185501_200025704644 [1,0,0,0,0,0|3,0,0]=4 817 B13R1.28 [13CH3]OCCCOCc1ccccc1 34a_100000691849_200025704644 [1,0,0,0,0,0|3,0,0]=4 818 B13R1.28 [13CH3]OCCCOCc1ccccc1 7a_100000691849_200025704644 [1,0,0,0,0,0|3,0,0]=4 819 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200011217138_200025704644 [1,0,0,0,0,0|2,0,1]=4 820 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200025704644_200011217138 [1,0,0,0,0,0|2,0,1]=4 821 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_100011215529_200025704644 [1,0,0,0,0,0|3,0,0]=4 822 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_200025704644_100011215529 [1,0,0,0,0,0|3,0,0]=4 823 B13R1.44 C#CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000753159 [1,0,0,0,0,0|1,0,2]=4 824 B13R1.44 C#CCCC(=O)Cc1ccccc1 1458a_100000692101_100015291786 [1,0,0,0,0,0|0,0,2]=3 825 B13R1.44 C#CCCC(=O)Cc1ccccn1 1458a_100000233486_100000753159 [1,0,0,0,0,0|1,0,2]=4 826 B13R1.44 C#CCCC(=O)Cc1ccccn1 1458a_100000692101_100000721315 [1,0,0,0,0,0|1,0,2]=4 827 B13R1.44 C#CCCC(=O)Cc1cccnc1 1458a_100000692101_100000733263 [1,0,0,0,0,0|1,0,2]=4 828 B13R1.44 C#CCCC(=O)Cc1cccnc1 1458a_100000737805_100000753159 [1,0,0,0,0,0|1,0,2]=4 829 B13R1.44 C#CCCC(=O)Cc1ccncc1 1458a_100000692101_100000705612 [1,0,0,0,0,0|1,0,2]=4 830 B13R1.44 C#CCCC(=O)Nc1ccccc1 11a_100000106764_100000692101 [1,0,0,0,0,0|1,0,2]=4 831 B13R1.44 C#CCCC(=O)Nc1ccccc1 1626a_100000106764_100000692101 [1,0,0,0,0,0|1,0,2]=4 832 B13R1.44 C#CCCC(=O)Nc1ccccc1 22a_100000106764_100000692101 [1,0,0,0,0,0|1,0,2]=4 833 B13R1.44 C#CCCC(=O)Nc1ccccc1 527a_100000106764_100000692101 [1,0,0,0,0,0|1,0,2]=4 834 B13R1.44 C/C=C/CC(=O)C[n+]1ccccc1 1458a_200000086051_100102629194 [1,0,0,0,0,0|1,0,2]=4 835 B13R1.44 C/C=C/CC(=O)Cc1ccccn1 1458a_100000233486_100102629194 [1,0,0,0,0,0|1,0,2]=4 836 B13R1.44 C/C=C/CC(=O)Cc1cccnc1 1458a_100000737805_100102629194 [1,0,0,0,0,0|1,0,2]=4 837 B13R1.44 C=CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000754431 [1,0,0,0,0,0|1,0,2]=4 838 B13R1.44 C=CCCC(=O)Cc1ccccc1 1458a_100000749702_100015291786 [1,0,0,0,0,0|0,0,2]=3 839 B13R1.44 C=CCCC(=O)Cc1ccccn1 1458a_100000233486_100000754431 [1,0,0,0,0,0|1,0,2]=4 840 B13R1.44 C=CCCC(=O)Cc1ccccn1 1458a_100000749702_100000721315 [1,0,0,0,0,0|1,0,2]=4 841 B13R1.44 C=CCCC(=O)Cc1cccnc1 1458a_100000737805_100000754431 [1,0,0,0,0,0|1,0,2]=4 842 B13R1.44 C=CCCC(=O)Cc1cccnc1 1458a_100000749702_100000733263 [1,0,0,0,0,0|1,0,2]=4 843 B13R1.44 C=CCCC(=O)Cc1ccncc1 1458a_100000749702_100000705612 [1,0,0,0,0,0|1,0,2]=4 844 B13R1.44 C=CCCC(=O)Nc1ccccc1 11a_100000106764_100000749702 [1,0,0,0,0,0|1,0,2]=4 845 B13R1.44 C=CCCC(=O)Nc1ccccc1 1626a_100000106764_100000749702 [1,0,0,0,0,0|1,0,2]=4 846 B13R1.44 C=CCCC(=O)Nc1ccccc1 22a_100000106764_100000749702 [1,0,0,0,0,0|1,0,2]=4 847 B13R1.44 C=CCCC(=O)Nc1ccccc1 527a_100000106764_100000749702 [1,0,0,0,0,0|1,0,2]=4 848 B13R1.44 CC#CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000748600 [1,0,0,0,0,0|1,0,2]=4 849 B13R1.44 CC#CCC(=O)Cc1ccccn1 1458a_100000233486_100000748600 [1,0,0,0,0,0|1,0,2]=4 850 B13R1.44 CC#CCC(=O)Cc1cccnc1 1458a_100000737805_100000748600 [1,0,0,0,0,0|1,0,2]=4 851 B13R1.44 CC(Cc1ccccc1)OCCBr 34a_100000211926_200011218536 [1,0,0,0,0,0|2,0,1]=4 852 B13R1.44 CC(Cc1ccccc1)OCCF 34a_100000748627_100011217306 [1,0,0,0,0,0|2,0,1]=4 853 B13R1.44 CC(Cc1ccccc1)OCCF 7a_100000748627_100011217306 [1,0,0,0,0,0|2,0,1]=4 854 B13R1.44 CC(Cc1ccccc1)OCCN 34a_100000210304_200011218536 [1,0,0,0,0,0|2,0,1]=4 855 B13R1.44 CC(Cc1ccccc1)OCCO 34a_100000748627_100000211926 [1,0,0,0,0,0|2,0,1]=4 856 B13R1.44 CC(Cc1ccccc1)OCCO 7a_100000748627_100000211926 [1,0,0,0,0,0|2,0,1]=4 857 B13R1.44 CC=CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000070051 [1,0,0,0,0,0|1,0,2]=4 858 B13R1.44 CC=CCC(=O)Cc1ccccc1 1458a_100121576822_100015291786 [1,0,0,0,0,0|0,0,2]=3 859 B13R1.44 CC=CCC(=O)Cc1ccccn1 1458a_100000233486_100000070051 [1,0,0,0,0,0|1,0,2]=4 860 B13R1.44 CC=CCC(=O)Cc1ccccn1 1458a_100121576822_100000721315 [1,0,0,0,0,0|1,0,2]=4 861 B13R1.44 CC=CCC(=O)Cc1cccnc1 1458a_100000737805_100000070051 [1,0,0,0,0,0|1,0,2]=4 862 B13R1.44 CC=CCC(=O)Cc1cccnc1 1458a_100121576822_100000733263 [1,0,0,0,0,0|1,0,2]=4 863 B13R1.44 CC=CCC(=O)Cc1ccncc1 1458a_100121576822_100000705612 [1,0,0,0,0,0|1,0,2]=4 864 B13R1.44 CC=CCC(=O)Nc1ccccc1 11a_100000106764_100121576822 [1,0,0,0,0,0|1,0,2]=4 865 B13R1.44 CC=CCC(=O)Nc1ccccc1 1626a_100000106764_100121576822 [1,0,0,0,0,0|1,0,2]=4 866 B13R1.44 CC=CCC(=O)Nc1ccccc1 22a_100000106764_100121576822 [1,0,0,0,0,0|1,0,2]=4 867 B13R1.44 CC=CCC(=O)Nc1ccccc1 527a_100000106764_100121576822 [1,0,0,0,0,0|1,0,2]=4 868 B13R1.44 CC=NNC(=O)Cc1ccccc1 4a_100000182964_200000210099 [1,0,0,0,0,0|2,0,1]=4 869 B13R1.44 CCC#CC(=O)Cc1ccccc1 1458a_100011827653_100015291786 [1,0,0,0,0,0|0,0,2]=3 870 B13R1.44 CCC#CC(=O)Cc1ccccn1 1458a_100011827653_100000721315 [1,0,0,0,0,0|1,0,2]=4 871 B13R1.44 CCC#CC(=O)Cc1cccnc1 1458a_100011827653_100000733263 [1,0,0,0,0,0|1,0,2]=4 872 B13R1.44 CCC#CC(=O)Cc1ccncc1 1458a_100011827653_100000705612 [1,0,0,0,0,0|1,0,2]=4 873 B13R1.44 CCC#CC(=O)Nc1ccccc1 22a_100000106764_100011827653 [1,0,0,0,0,0|1,0,2]=4 874 B13R1.44 CCC=CC(=O)Cc1ccccc1 1458a_100000212282_100015291786 [1,0,0,0,0,0|0,0,2]=3 875 B13R1.44 CCC=CC(=O)Cc1ccccn1 1458a_100000212282_100000721315 [1,0,0,0,0,0|1,0,2]=4 876 B13R1.44 CCC=CC(=O)Cc1cccnc1 1458a_100000212282_100000733263 [1,0,0,0,0,0|1,0,2]=4 877 B13R1.44 CCC=CC(=O)Cc1ccncc1 1458a_100000212282_100000705612 [1,0,0,0,0,0|1,0,2]=4 878 B13R1.44 CCC=CC(=O)Nc1ccccc1 11a_100000106764_100000212282 [1,0,0,0,0,0|1,0,2]=4 879 B13R1.44 CCC=CC(=O)Nc1ccccc1 1626a_100000106764_100000212282 [1,0,0,0,0,0|1,0,2]=4 880 B13R1.44 CCC=CC(=O)Nc1ccccc1 22a_100000106764_100000212282 [1,0,0,0,0,0|1,0,2]=4 881 B13R1.44 CCCCC(=Cc1ccccc1)Br 271570a_206741709834_100000210277 [1,0,0,0,0,0|1,0,1]=3 882 B13R1.44 CCCCC(=Cc1ccccn1)Br 271570a_206741709834_100011216584 [1,0,0,0,0,0|2,0,1]=4 883 B13R1.44 CCCCC(=Cc1cccnc1)Br 271570a_206741709834_100000752921 [1,0,0,0,0,0|2,0,1]=4 884 B13R1.44 CCCCC(=Cc1ccncc1)Br 271570a_206741709834_100000035832 [1,0,0,0,0,0|2,0,1]=4 885 B13R1.44 CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210211 [1,0,0,0,0,0|1,0,0]=2 886 B13R1.44 CCCCC(=O)Cc1ccccc1 1458a_100000210183_100015291786 [1,0,0,0,0,0|0,0,0]=1 887 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000210183_100000721315 [1,0,0,0,0,0|1,0,0]=2 888 B13R1.44 CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210211 [1,0,0,0,0,0|1,0,0]=2 889 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000210183_100000733263 [1,0,0,0,0,0|1,0,0]=2 890 B13R1.44 CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210211 [1,0,0,0,0,0|1,0,0]=2 891 B13R1.44 CCCCC(=O)Cc1cccnn1 1458a_100000210183_100016990269 [1,0,0,0,0,0|2,0,0]=3 892 B13R1.44 CCCCC(=O)Cc1ccncc1 1458a_100000210183_100000705612 [1,0,0,0,0,0|1,0,0]=2 893 B13R1.44 CCCCC(=O)Cc1cnccn1 1458a_100000210183_100016995436 [1,0,0,0,0,0|2,0,0]=3 894 B13R1.44 CCCCC(=O)Cc1cncnc1 1458a_100000210183_100015196519 [1,0,0,0,0,0|2,0,0]=3 895 B13R1.44 CCCCC(=O)Cc1cncnc1 1458a_100000721575_100000210211 [1,0,0,0,0,0|2,0,0]=3 896 B13R1.44 CCCCC(=O)Cc1ncccn1 1458a_100000210183_100000703007 [1,0,0,0,0,0|2,0,0]=3 897 B13R1.44 CCCCC(=O)Nc1ccccc1 11a_100000106764_100000210183 [1,0,0,0,0,0|1,0,0]=2 898 B13R1.44 CCCCC(=O)Nc1ccccc1 1626a_100000106764_100000210183 [1,0,0,0,0,0|1,0,0]=2 899 B13R1.44 CCCCC(=O)Nc1ccccc1 22a_100000106764_100000210183 [1,0,0,0,0,0|1,0,0]=2 900 B13R1.44 CCCCC(=O)Nc1ccccc1 527a_100000106764_100000210183 [1,0,0,0,0,0|1,0,0]=2 901 B13R1.44 CCCCC(C)Nc1ccccc1 34a_100000106764_200011215066 [1,0,0,0,0,0|2,0,1]=4 902 B13R1.44 CCCCC(C)Oc1ccccc1 34a_100000210340_200011215066 [1,0,0,0,0,0|2,0,1]=4 903 B13R1.44 CCCCC(C)Oc1ccccc1 7a_100000210340_200011215066 [1,0,0,0,0,0|2,0,1]=4 904 B13R1.44 CCCCC(C)Sc1ccccc1 62a_100000719477_200011215066 [1,0,0,0,0,0|2,0,1]=4 905 B13R1.44 CCCCC(C)Sc1ccccc1 62a_200011215066_100000041952 [1,0,0,0,0,0|2,0,1]=4 906 B13R1.44 CCCCN(C)Cc1ccccc1 2230a_100000186898_100000210211 [1,0,0,0,0,0|2,0,0]=3 907 B13R1.44 CCCCN(C)Cc1ccccc1 2230a_100000207549_100015291786 [1,0,0,0,0,0|2,0,0]=3 908 B13R1.44 CCCCN(C)Cc1ccccc1 2230a_200000196024_200000210301 [1,0,0,0,0,0|2,0,0]=3 909 B13R1.44 CCCCN(C)Cc1ccccc1 269982a_100000186898_100000210211 [1,0,0,0,0,0|2,0,0]=3 910 B13R1.44 CCCCN(C)Cc1ccccc1 269982a_100000207549_100000211182 [1,0,0,0,0,0|2,0,0]=3 911 B13R1.44 CCCCN(C)Cc1ccccc1 269982a_200000196024_200000210301 [1,0,0,0,0,0|2,0,0]=3 912 B13R1.44 CCCCN(C)Cc1ccccc1 270004a_100000207549_100015611070 [1,0,0,0,0,0|2,0,0]=3 913 B13R1.44 CCCCN(C)Cc1ccccn1 2230a_100000207498_100000210211 [1,0,0,0,0,0|3,0,0]=4 914 B13R1.44 CCCCN(C)Cc1ccccn1 2230a_100000207549_100000721315 [1,0,0,0,0,0|3,0,0]=4 915 B13R1.44 CCCCN(C)Cc1ccccn1 2230a_200000200672_200000210301 [1,0,0,0,0,0|3,0,0]=4 916 B13R1.44 CCCCN(C)Cc1ccccn1 269982a_100000207498_100000210211 [1,0,0,0,0,0|3,0,0]=4 917 B13R1.44 CCCCN(C)Cc1ccccn1 269982a_100000207549_100000721315 [1,0,0,0,0,0|3,0,0]=4 918 B13R1.44 CCCCN(C)Cc1ccccn1 269982a_200000200672_200000210301 [1,0,0,0,0,0|3,0,0]=4 919 B13R1.44 CCCCN(C)Cc1ccccn1 270004a_100000207549_100000209966 [1,0,0,0,0,0|3,0,0]=4 920 B13R1.44 CCCCN(C)Cc1cccnc1 2230a_100000184577_100000210211 [1,0,0,0,0,0|3,0,0]=4 921 B13R1.44 CCCCN(C)Cc1cccnc1 2230a_100000207549_100000741622 [1,0,0,0,0,0|3,0,0]=4 922 B13R1.44 CCCCN(C)Cc1cccnc1 2230a_200000200674_200000210301 [1,0,0,0,0,0|3,0,0]=4 923 B13R1.44 CCCCN(C)Cc1cccnc1 269982a_100000184577_100000210211 [1,0,0,0,0,0|3,0,0]=4 924 B13R1.44 CCCCN(C)Cc1cccnc1 269982a_100000207549_100000733263 [1,0,0,0,0,0|3,0,0]=4 925 B13R1.44 CCCCN(C)Cc1cccnc1 269982a_200000200674_200000210301 [1,0,0,0,0,0|3,0,0]=4 926 B13R1.44 CCCCN(C)Cc1cccnc1 270004a_100000207549_100000209961 [1,0,0,0,0,0|3,0,0]=4 927 B13R1.44 CCCCN(C)Cc1ccncc1 2230a_100000187231_100000210211 [1,0,0,0,0,0|3,0,0]=4 928 B13R1.44 CCCCN(C)Cc1ccncc1 2230a_100000207549_100015193705 [1,0,0,0,0,0|3,0,0]=4 929 B13R1.44 CCCCN(C)Cc1ccncc1 2230a_200015187765_200000210301 [1,0,0,0,0,0|3,0,0]=4 930 B13R1.44 CCCCN(C)Cc1ccncc1 269982a_100000187231_100000210211 [1,0,0,0,0,0|3,0,0]=4 931 B13R1.44 CCCCN(C)Cc1ccncc1 269982a_100000207549_100015193705 [1,0,0,0,0,0|3,0,0]=4 932 B13R1.44 CCCCN(C)Cc1ccncc1 269982a_200015187765_200000210301 [1,0,0,0,0,0|3,0,0]=4 933 B13R1.44 CCCCN([13CH3])Cc1ccccc1 2230a_200000196024_200025704644 [1,0,0,0,0,0|2,0,0]=3 934 B13R1.44 CCCCN([13CH3])Cc1ccccc1 269982a_200000196024_200025704644 [1,0,0,0,0,0|2,0,0]=3 935 B13R1.44 CCCCN([13CH3])Cc1ccccn1 2230a_200000200672_200025704644 [1,0,0,0,0,0|3,0,0]=4 936 B13R1.44 CCCCN([13CH3])Cc1ccccn1 269982a_200000200672_200025704644 [1,0,0,0,0,0|3,0,0]=4 937 B13R1.44 CCCCN([13CH3])Cc1cccnc1 2230a_200000200674_200025704644 [1,0,0,0,0,0|3,0,0]=4 938 B13R1.44 CCCCN([13CH3])Cc1cccnc1 269982a_200000200674_200025704644 [1,0,0,0,0,0|3,0,0]=4 939 B13R1.44 CCCCN([13CH3])Cc1ccncc1 2230a_200015187765_200025704644 [1,0,0,0,0,0|3,0,0]=4 940 B13R1.44 CCCCN([13CH3])Cc1ccncc1 269982a_200015187765_200025704644 [1,0,0,0,0,0|3,0,0]=4 941 B13R1.44 CCCNC(=O)C[n+]1ccccc1 11a_100020643023_200000086051 [1,0,0,0,0,0|2,0,0]=3 942 B13R1.44 CCCNC(=O)C[n+]1ccccc1 240690a_100020643023_200000086051 [1,0,0,0,0,0|2,0,0]=3 943 B13R1.44 CCCNC(=O)C[n+]1ccccc1 527a_100020643023_200000086051 [1,0,0,0,0,0|2,0,0]=3 944 B13R1.44 CCCNC(=O)Cc1ccccn1 11a_100020643023_100000233486 [1,0,0,0,0,0|2,0,0]=3 945 B13R1.44 CCCNC(=O)Cc1cccnc1 11a_100020643023_100000737805 [1,0,0,0,0,0|2,0,0]=3 946 B13R1.44 CCCNC(=O)Cc1cccnc1 240690a_100020643023_100000737805 [1,0,0,0,0,0|2,0,0]=3 947 B13R1.44 CCCNC(=O)Cc1cccnc1 527a_100020643023_100000737805 [1,0,0,0,0,0|2,0,0]=3 948 B13R1.44 CCCNC(=O)Cc1ccncc1 11a_100020643023_100011201483 [1,0,0,0,0,0|2,0,0]=3 949 B13R1.44 CCCNC(=O)Cc1ccncc1 240690a_100020643023_100011201483 [1,0,0,0,0,0|2,0,0]=3 950 B13R1.44 CCCNC(=O)Cc1cnccn1 11a_100020643023_100000726051 [1,0,0,0,0,0|3,0,0]=4 951 B13R1.44 CCCNC(=O)Cc1cnccn1 240690a_100020643023_100000726051 [1,0,0,0,0,0|3,0,0]=4 952 B13R1.44 CCCNC(=O)Cc1cnccn1 527a_100020643023_100000726051 [1,0,0,0,0,0|3,0,0]=4 953 B13R1.44 CCCNC(=O)Cc1cncnc1 11a_100020643023_100000721575 [1,0,0,0,0,0|3,0,0]=4 954 B13R1.44 CCCNC(=O)Cc1cncnc1 240690a_100020643023_100000721575 [1,0,0,0,0,0|3,0,0]=4 955 B13R1.44 CCCNC(=O)Cc1cncnc1 527a_100020643023_100000721575 [1,0,0,0,0,0|3,0,0]=4 956 B13R1.44 CCCNC(=O)Nc1ccccc1 2430a_100000106764_100020643023 [1,0,0,0,0,0|2,0,0]=3 957 B13R1.44 CCCOC(C)Cc1ccccc1 34a_100000210258_200011218536 [1,0,0,0,0,0|1,0,1]=3 958 B13R1.44 CCCOC(C)Cc1ccccc1 34a_100000748627_100000210303 [1,0,0,0,0,0|1,0,1]=3 959 B13R1.44 CCCOC(C)Cc1ccccc1 7a_100000748627_100000210303 [1,0,0,0,0,0|1,0,1]=3 960 B13R1.44 CCCSC(C)Cc1ccccc1 62a_100000210303_200011218536 [1,0,0,0,0,0|1,1,1]=4 961 B13R1.44 CCCSC(C)Cc1ccccc1 62a_200011218536_100000210303 [1,0,0,0,0,0|1,1,1]=4 962 B13R1.44 CCNCC(=O)Cc1ccccc1 2230a_100015525214_100000233483 [1,0,0,0,0,0|1,0,0]=2 963 B13R1.44 CCNCC(=O)Nc1ccccc1 2230a_100015525214_100000182850 [1,0,0,0,0,0|2,0,0]=3 964 B13R1.44 CCNCC(=O)Nc1ccccn1 2230a_100015525214_100020662008 [1,0,0,0,0,0|3,0,0]=4 965 B13R1.44 CCNCC(=O)Nc1ccncc1 2230a_100015525214_100000754145 [1,0,0,0,0,0|3,0,0]=4 966 B13R1.44 CCNCC(=O)Oc1ccccc1 2230a_100015525214_100009813826 [1,0,0,0,0,0|2,0,0]=3 967 B13R1.44 CCNCC(O)Cc1ccccc1 2230a_100000752270_100000210202 [1,0,0,0,0,0|1,0,2]=4 968 B13R1.44 CCNC[C@@H](O)Cc1ccccc1 2230a_100015525214_100000729385 [1,0,0,0,0,0|1,0,2]=4 969 B13R1.44 CCNNC(=O)C[n+]1ccccc1 22a_100000756455_200000086051 [1,0,0,0,0,0|3,0,0]=4 970 B13R1.44 CCNNC(=O)Cc1ccccn1 22a_100000756455_100000233486 [1,0,0,0,0,0|3,0,0]=4 971 B13R1.44 CCNNC(=O)Cc1cccnc1 22a_100000756455_100000737805 [1,0,0,0,0,0|3,0,0]=4 972 B13R1.44 CCNNC(=O)Cc1ccncc1 22a_100000756455_100011201483 [1,0,0,0,0,0|3,0,0]=4 973 B13R1.44 CCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210202 [1,0,0,0,0,0|2,0,1]=4 974 B13R1.44 CCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210202 [1,0,0,0,0,0|2,0,1]=4 975 B13R1.44 CCOCC(=O)Cc1ccccc1 1458a_100000211967_100015291786 [1,0,0,0,0,0|1,0,0]=2 976 B13R1.44 CCOCC(=O)Cc1ccccn1 1458a_100000211967_100000721315 [1,0,0,0,0,0|2,0,0]=3 977 B13R1.44 CCOCC(=O)Cc1cccnc1 1458a_100000211967_100000733263 [1,0,0,0,0,0|2,0,0]=3 978 B13R1.44 CCOCC(=O)Cc1cccnn1 1458a_100000211967_100016990269 [1,0,0,0,0,0|3,0,0]=4 979 B13R1.44 CCOCC(=O)Cc1ccncc1 1458a_100000211967_100000705612 [1,0,0,0,0,0|2,0,0]=3 980 B13R1.44 CCOCC(=O)Cc1cnccn1 1458a_100000211967_100016995436 [1,0,0,0,0,0|3,0,0]=4 981 B13R1.44 CCOCC(=O)Cc1cncnc1 1458a_100000211967_100015196519 [1,0,0,0,0,0|3,0,0]=4 982 B13R1.44 CCOCC(=O)Cc1ncccn1 1458a_100000211967_100000703007 [1,0,0,0,0,0|3,0,0]=4 983 B13R1.44 CCOCC(=O)Nc1ccccc1 11a_100000106764_100000211967 [1,0,0,0,0,0|2,0,0]=3 984 B13R1.44 CCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211967 [1,0,0,0,0,0|2,0,0]=3 985 B13R1.44 CCOCC(=O)Nc1ccccc1 22a_100000106764_100000211967 [1,0,0,0,0,0|2,0,0]=3 986 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100000246334_100000210202 [1,0,0,0,0,0|2,0,0]=3 987 B13R1.44 CCOCC(=O)Nc1ccccc1 34a_100121572206_100000182850 [1,0,0,0,0,0|2,0,0]=3 988 B13R1.44 CCOCC(=O)Nc1ccccc1 527a_100000106764_100000211967 [1,0,0,0,0,0|2,0,0]=3 989 B13R1.44 CCOCC(=O)Oc1ccccc1 34a_100121572206_100009813826 [1,0,0,0,0,0|2,0,0]=3 990 B13R1.44 CCOCC(C)Cc1ccccc1 34a_100012125295_100000210202 [1,0,0,0,0,0|2,0,1]=4 991 B13R1.44 CCOCC(C)Cc1ccccc1 7a_100012125295_100000210202 [1,0,0,0,0,0|2,0,1]=4 992 B13R1.44 CCOCC(N)Cc1ccccc1 34a_100000739027_100000210202 [1,0,0,0,0,0|2,0,1]=4 993 B13R1.44 CCOCN(C)Cc1ccccc1 269982a_100000186898_100000739092 [1,0,0,0,0,0|3,0,0]=4 994 B13R1.44 CCOC[C@@H](O)Cc1ccccc1 34a_100121572206_100000729385 [1,0,0,0,0,0|1,0,2]=4 995 B13R1.44 CCSCC(=O)Cc1ccccc1 1458a_100000230394_100015291786 [1,0,0,0,0,0|1,0,0]=2 996 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000210202_100000233483 [1,0,0,0,0,0|1,0,0]=2 997 B13R1.44 CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210202 [1,0,0,0,0,0|1,0,0]=2 998 B13R1.44 CCSCC(=O)Cc1ccccn1 1458a_100000230394_100000721315 [1,0,0,0,0,0|2,0,0]=3 999 B13R1.44 CCSCC(=O)Cc1cccnc1 1458a_100000230394_100000733263 [1,0,0,0,0,0|2,0,0]=3 1000 B13R1.44 CCSCC(=O)Cc1cccnn1 1458a_100000230394_100016990269 [1,0,0,0,0,0|3,0,0]=4 1001 B13R1.44 CCSCC(=O)Cc1ccncc1 1458a_100000230394_100000705612 [1,0,0,0,0,0|2,0,0]=3 1002 B13R1.44 CCSCC(=O)Cc1cnccn1 1458a_100000230394_100016995436 [1,0,0,0,0,0|3,0,0]=4 1003 B13R1.44 CCSCC(=O)Cc1cncnc1 1458a_100000230394_100015196519 [1,0,0,0,0,0|3,0,0]=4 1004 B13R1.44 CCSCC(=O)Cc1ncccn1 1458a_100000230394_100000703007 [1,0,0,0,0,0|3,0,0]=4 1005 B13R1.44 CCSCC(=O)Nc1ccccc1 11a_100000106764_100000230394 [1,0,0,0,0,0|2,0,0]=3 1006 B13R1.44 CCSCC(=O)Nc1ccccc1 1626a_100000106764_100000230394 [1,0,0,0,0,0|2,0,0]=3 1007 B13R1.44 CCSCC(=O)Nc1ccccc1 22a_100000106764_100000230394 [1,0,0,0,0,0|2,0,0]=3 1008 B13R1.44 CCSCC(=O)Nc1ccccc1 527a_100000106764_100000230394 [1,0,0,0,0,0|2,0,0]=3 1009 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100000210202_100000182850 [1,0,0,0,0,0|2,0,0]=3 1010 B13R1.44 CCSCC(=O)Nc1ccccc1 62a_100012148978_100000210202 [1,0,0,0,0,0|2,0,0]=3 1011 B13R1.44 CCSCC(=O)Nc1ccccn1 62a_100000210202_100020662008 [1,0,0,0,0,0|3,0,0]=4 1012 B13R1.44 CCSCC(=O)Nc1ccccn1 62a_100020662008_100000210202 [1,0,0,0,0,0|3,0,0]=4 1013 B13R1.44 CCSCC(=O)Nc1ccncc1 62a_100000210202_100000754145 [1,0,0,0,0,0|3,0,0]=4 1014 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100000210202_100009813826 [1,0,0,0,0,0|2,0,0]=3 1015 B13R1.44 CCSCC(=O)Oc1ccccc1 62a_100009813826_100000210202 [1,0,0,0,0,0|2,0,0]=3 1016 B13R1.44 CCSC[C@@H](O)Cc1ccccc1 62a_100000210202_100000729385 [1,0,0,0,0,0|1,0,2]=4 1017 B13R1.44 CCSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000210202 [1,0,0,0,0,0|1,0,2]=4 1018 B13R1.44 CN(CCCF)Cc1ccccc1 2230a_100000186898_100011934791 [1,0,0,0,0,0|3,0,0]=4 1019 B13R1.44 CN(CCCF)Cc1ccccc1 269982a_100000186898_100011934791 [1,0,0,0,0,0|3,0,0]=4 1020 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000185501_200000210301 [1,0,0,0,0,0|3,0,0]=4 1021 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000186898_100000230001 [1,0,0,0,0,0|3,0,0]=4 1022 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000213112_100015291786 [1,0,0,0,0,0|3,0,0]=4 1023 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000185501_200000210301 [1,0,0,0,0,0|3,0,0]=4 1024 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000186898_100011215043 [1,0,0,0,0,0|3,0,0]=4 1025 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000213112_100000211182 [1,0,0,0,0,0|3,0,0]=4 1026 B13R1.44 CN(CCCO)Cc1ccccc1 270004a_100000213112_100015611070 [1,0,0,0,0,0|3,0,0]=4 1027 B13R1.44 CN(CCS[13CH3])Cc1ccccc1 62a_200025704644_100015196923 [1,0,0,0,0,0|3,0,0]=4 1028 B13R1.44 CNCCC(=O)Nc1ccccc1 2230a_106832991635_100000242058 [1,0,0,0,0,0|2,0,0]=3 1029 B13R1.44 CNCCC(=O)Nc1ccccc1 34a_100102657272_100000242058 [1,0,0,0,0,0|2,0,0]=3 1030 B13R1.44 CNCCC(=O)Nc1ccccc1 7a_106832991635_100000242058 [1,0,0,0,0,0|2,0,0]=3 1031 B13R1.44 CNCCC(=O)Nc1cccnc1 2230a_106832991635_200015187043 [1,0,0,0,0,0|3,0,0]=4 1032 B13R1.44 CNCCC(=O)Nc1cccnc1 34a_100000748795_200000210301 [1,0,0,0,0,0|3,0,0]=4 1033 B13R1.44 CNCCC(=O)Nc1cccnc1 7a_106832991635_200015187043 [1,0,0,0,0,0|3,0,0]=4 1034 B13R1.44 CNCCC(=O)Oc1ccccc1 2230a_106832991635_200000035796 [1,0,0,0,0,0|2,0,0]=3 1035 B13R1.44 CNCCC(=O)Oc1ccccc1 7a_106832991635_200000035796 [1,0,0,0,0,0|2,0,0]=3 1036 B13R1.44 CNCCN(C)Cc1ccccc1 2230a_106832991635_100015196923 [1,0,0,0,0,0|3,0,0]=4 1037 B13R1.44 CNCCN(C)Cc1ccccc1 34a_100102657272_100015196923 [1,0,0,0,0,0|3,0,0]=4 1038 B13R1.44 CNCCN(C)Cc1ccccc1 7a_106832991635_100015196923 [1,0,0,0,0,0|3,0,0]=4 1039 B13R1.44 COC=CC(=O)Cc1ccccc1 1458a_100016268678_100015291786 [1,0,0,0,0,0|1,0,2]=4 1040 B13R1.44 COCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000233755 [1,0,0,0,0,0|2,0,0]=3 1041 B13R1.44 COCCC(=O)Cc1ccccc1 1458a_100000749529_100015291786 [1,0,0,0,0,0|1,0,0]=2 1042 B13R1.44 COCCC(=O)Cc1ccccn1 1458a_100000233486_100000233755 [1,0,0,0,0,0|2,0,0]=3 1043 B13R1.44 COCCC(=O)Cc1ccccn1 1458a_100000749529_100000721315 [1,0,0,0,0,0|2,0,0]=3 1044 B13R1.44 COCCC(=O)Cc1cccnc1 1458a_100000737805_100000233755 [1,0,0,0,0,0|2,0,0]=3 1045 B13R1.44 COCCC(=O)Cc1cccnc1 1458a_100000749529_100000733263 [1,0,0,0,0,0|2,0,0]=3 1046 B13R1.44 COCCC(=O)Cc1cccnn1 1458a_100000749529_100016990269 [1,0,0,0,0,0|3,0,0]=4 1047 B13R1.44 COCCC(=O)Cc1ccncc1 1458a_100000749529_100000705612 [1,0,0,0,0,0|2,0,0]=3 1048 B13R1.44 COCCC(=O)Cc1cnccn1 1458a_100000749529_100016995436 [1,0,0,0,0,0|3,0,0]=4 1049 B13R1.44 COCCC(=O)Cc1cncnc1 1458a_100000721575_100000233755 [1,0,0,0,0,0|3,0,0]=4 1050 B13R1.44 COCCC(=O)Cc1cncnc1 1458a_100000749529_100015196519 [1,0,0,0,0,0|3,0,0]=4 1051 B13R1.44 COCCC(=O)Cc1ncccn1 1458a_100000749529_100000703007 [1,0,0,0,0,0|3,0,0]=4 1052 B13R1.44 COCCC(=O)Nc1ccccc1 11a_100000106764_100000749529 [1,0,0,0,0,0|2,0,0]=3 1053 B13R1.44 COCCC(=O)Nc1ccccc1 1626a_100000106764_100000749529 [1,0,0,0,0,0|2,0,0]=3 1054 B13R1.44 COCCC(=O)Nc1ccccc1 22a_100000106764_100000749529 [1,0,0,0,0,0|2,0,0]=3 1055 B13R1.44 COCCC(=O)Nc1ccccc1 34a_100138415774_100000242058 [1,0,0,0,0,0|2,0,0]=3 1056 B13R1.44 COCCC(=O)Nc1ccccc1 527a_100000106764_100000749529 [1,0,0,0,0,0|2,0,0]=3 1057 B13R1.44 COCCN(C)Cc1ccccc1 2230a_100000186898_100011201679 [1,0,0,0,0,0|3,0,0]=4 1058 B13R1.44 COCCN(C)Cc1ccccc1 2230a_100000743101_100015291786 [1,0,0,0,0,0|3,0,0]=4 1059 B13R1.44 COCCN(C)Cc1ccccc1 269982a_100000186898_100000233755 [1,0,0,0,0,0|3,0,0]=4 1060 B13R1.44 COCCN(C)Cc1ccccc1 269982a_100000743101_100000211182 [1,0,0,0,0,0|3,0,0]=4 1061 B13R1.44 COCCN(C)Cc1ccccc1 270004a_100000743101_100015611070 [1,0,0,0,0,0|3,0,0]=4 1062 B13R1.44 COCCN(C)Cc1ccccc1 34a_100138415774_100015196923 [1,0,0,0,0,0|3,0,0]=4 1063 B13R1.44 CSCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000751147 [1,0,0,0,0,0|2,0,0]=3 1064 B13R1.44 CSCCC(=O)Cc1ccccc1 1458a_100000174002_100015291786 [1,0,0,0,0,0|1,0,0]=2 1065 B13R1.44 CSCCC(=O)Cc1ccccn1 1458a_100000174002_100000721315 [1,0,0,0,0,0|2,0,0]=3 1066 B13R1.44 CSCCC(=O)Cc1ccccn1 1458a_100000233486_100000751147 [1,0,0,0,0,0|2,0,0]=3 1067 B13R1.44 CSCCC(=O)Cc1cccnc1 1458a_100000174002_100000733263 [1,0,0,0,0,0|2,0,0]=3 1068 B13R1.44 CSCCC(=O)Cc1cccnc1 1458a_100000737805_100000751147 [1,0,0,0,0,0|2,0,0]=3 1069 B13R1.44 CSCCC(=O)Cc1cccnn1 1458a_100000174002_100016990269 [1,0,0,0,0,0|3,0,0]=4 1070 B13R1.44 CSCCC(=O)Cc1ccncc1 1458a_100000174002_100000705612 [1,0,0,0,0,0|2,0,0]=3 1071 B13R1.44 CSCCC(=O)Cc1cnccn1 1458a_100000174002_100016995436 [1,0,0,0,0,0|3,0,0]=4 1072 B13R1.44 CSCCC(=O)Cc1cncnc1 1458a_100000174002_100015196519 [1,0,0,0,0,0|3,0,0]=4 1073 B13R1.44 CSCCC(=O)Cc1cncnc1 1458a_100000721575_100000751147 [1,0,0,0,0,0|3,0,0]=4 1074 B13R1.44 CSCCC(=O)Cc1ncccn1 1458a_100000174002_100000703007 [1,0,0,0,0,0|3,0,0]=4 1075 B13R1.44 CSCCC(=O)Nc1ccccc1 11a_100000106764_100000174002 [1,0,0,0,0,0|2,0,0]=3 1076 B13R1.44 CSCCC(=O)Nc1ccccc1 1626a_100000106764_100000174002 [1,0,0,0,0,0|2,0,0]=3 1077 B13R1.44 CSCCC(=O)Nc1ccccc1 22a_100000106764_100000174002 [1,0,0,0,0,0|2,0,0]=3 1078 B13R1.44 CSCCC(=O)Nc1ccccc1 527a_100000106764_100000174002 [1,0,0,0,0,0|2,0,0]=3 1079 B13R1.44 CSCCC(=O)Nc1ccccc1 62a_200000210301_100000242058 [1,0,0,0,0,0|2,0,0]=3 1080 B13R1.44 CSCCC(=O)Nc1cccnc1 62a_200000210301_200015187043 [1,0,0,0,0,0|3,0,0]=4 1081 B13R1.44 CSCCC(=O)Oc1ccccc1 62a_200000210301_200000035796 [1,0,0,0,0,0|2,0,0]=3 1082 B13R1.44 CSCCN(C)Cc1ccccc1 2230a_100000186898_100000751147 [1,0,0,0,0,0|3,0,0]=4 1083 B13R1.44 CSCCN(C)Cc1ccccc1 2230a_100000686725_100015291786 [1,0,0,0,0,0|3,0,0]=4 1084 B13R1.44 CSCCN(C)Cc1ccccc1 269982a_100000186898_100000212216 [1,0,0,0,0,0|3,0,0]=4 1085 B13R1.44 CSCCN(C)Cc1ccccc1 269982a_100000686725_100000211182 [1,0,0,0,0,0|3,0,0]=4 1086 B13R1.44 CSCCN(C)Cc1ccccc1 270004a_100000686725_100015611070 [1,0,0,0,0,0|3,0,0]=4 1087 B13R1.44 CSCCN(C)Cc1ccccc1 62a_200000210301_100015196923 [1,0,0,0,0,0|3,0,0]=4 1088 B13R1.44 CSCOC(C)Cc1ccccc1 34a_100000748627_100011218213 [1,0,0,0,0,0|2,0,1]=4 1089 B13R1.44 N#CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215226 [1,0,0,0,0,0|2,0,1]=4 1090 B13R1.44 N#CCCC(=O)Cc1ccccc1 1458a_100011934036_100015291786 [1,0,0,0,0,0|1,0,1]=3 1091 B13R1.44 N#CCCC(=O)Cc1ccccn1 1458a_100000233486_100011215226 [1,0,0,0,0,0|2,0,1]=4 1092 B13R1.44 N#CCCC(=O)Cc1ccccn1 1458a_100011934036_100000721315 [1,0,0,0,0,0|2,0,1]=4 1093 B13R1.44 N#CCCC(=O)Cc1cccnc1 1458a_100000737805_100011215226 [1,0,0,0,0,0|2,0,1]=4 1094 B13R1.44 N#CCCC(=O)Cc1cccnc1 1458a_100011934036_100000733263 [1,0,0,0,0,0|2,0,1]=4 1095 B13R1.44 N#CCCC(=O)Cc1ccncc1 1458a_100011934036_100000705612 [1,0,0,0,0,0|2,0,1]=4 1096 B13R1.44 N#CCCC(=O)Nc1ccccc1 11a_100000106764_100011934036 [1,0,0,0,0,0|2,0,1]=4 1097 B13R1.44 N#CCCC(=O)Nc1ccccc1 1626a_100000106764_100011934036 [1,0,0,0,0,0|2,0,1]=4 1098 B13R1.44 N#CCCC(=O)Nc1ccccc1 22a_100000106764_100011934036 [1,0,0,0,0,0|2,0,1]=4 1099 B13R1.44 N#CCCC(=O)Nc1ccccc1 527a_100000106764_100011934036 [1,0,0,0,0,0|2,0,1]=4 1100 B13R1.44 O=C(C#CCO)Cc1ccccc1 1458a_100000049017_100015291786 [1,0,0,0,0,0|1,0,2]=4 1101 B13R1.44 O=C(CCCF)C[n+]1ccccc1 1458a_200000086051_100011934791 [1,0,0,0,0,0|2,0,0]=3 1102 B13R1.44 O=C(CCCF)Cc1ccccn1 1458a_100000233486_100011934791 [1,0,0,0,0,0|2,0,0]=3 1103 B13R1.44 O=C(CCCF)Cc1cccnc1 1458a_100000737805_100011934791 [1,0,0,0,0,0|2,0,0]=3 1104 B13R1.44 O=C(CCCF)Cc1cncnc1 1458a_100000721575_100011934791 [1,0,0,0,0,0|3,0,0]=4 1105 B13R1.44 O=C(CCCO)C[n+]1ccccc1 1458a_200000086051_100011215043 [1,0,0,0,0,0|2,0,0]=3 1106 B13R1.44 O=C(CCCO)Cc1ccccn1 1458a_100000233486_100011215043 [1,0,0,0,0,0|2,0,0]=3 1107 B13R1.44 O=C(CCCO)Cc1cccnc1 1458a_100000737805_100011215043 [1,0,0,0,0,0|2,0,0]=3 1108 B13R1.44 O=C(CCCO)Cc1cncnc1 1458a_100000721575_100011215043 [1,0,0,0,0,0|3,0,0]=4 1109 B13R1.44 O=C(COCF)Nc1ccccc1 34a_100000246334_100015361967 [1,0,0,0,0,0|3,0,0]=4 1110 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100000233483_100015361967 [1,0,0,0,0,0|2,0,0]=3 1111 B13R1.44 O=C(CSCF)Cc1ccccc1 62a_100015361967_100000233483 [1,0,0,0,0,0|2,0,0]=3 1112 B13R1.44 O=C(CSCF)Nc1ccccc1 62a_100012148978_100015361967 [1,0,0,0,0,0|3,0,0]=4 1113 B13R1.44 O=C(CSCF)Nc1ccccc1 62a_100015361967_100000182850 [1,0,0,0,0,0|3,0,0]=4 1114 B13R1.44 O=C(CSCF)Oc1ccccc1 62a_100009813826_100015361967 [1,0,0,0,0,0|3,0,0]=4 1115 B13R1.44 O=C(CSCF)Oc1ccccc1 62a_100015361967_100009813826 [1,0,0,0,0,0|3,0,0]=4 1116 B13R1.44 O=C(C[n+]1ccccc1)NCCF 11a_100000724931_200000086051 [1,0,0,0,0,0|3,0,0]=4 1117 B13R1.44 O=C(C[n+]1ccccc1)NCCF 240690a_100000724931_200000086051 [1,0,0,0,0,0|3,0,0]=4 1118 B13R1.44 O=C(C[n+]1ccccc1)NCCF 527a_100000724931_200000086051 [1,0,0,0,0,0|3,0,0]=4 1119 B13R1.44 O=C(C[n+]1ccccc1)NCCO 240690a_100000210304_200000086051 [1,0,0,0,0,0|3,0,0]=4 1120 B13R1.44 O=C(C[n+]1ccccc1)NCCO 527a_100000210304_200000086051 [1,0,0,0,0,0|3,0,0]=4 1121 B13R1.44 O=C(Cc1ccccn1)NCCF 11a_100000724931_100000233486 [1,0,0,0,0,0|3,0,0]=4 1122 B13R1.44 O=C(Cc1cccnc1)NCCF 11a_100000724931_100000737805 [1,0,0,0,0,0|3,0,0]=4 1123 B13R1.44 O=C(Cc1cccnc1)NCCF 240690a_100000724931_100000737805 [1,0,0,0,0,0|3,0,0]=4 1124 B13R1.44 O=C(Cc1cccnc1)NCCF 527a_100000724931_100000737805 [1,0,0,0,0,0|3,0,0]=4 1125 B13R1.44 O=C(Cc1cccnc1)NCCO 240690a_100000210304_100000737805 [1,0,0,0,0,0|3,0,0]=4 1126 B13R1.44 O=C(Cc1cccnc1)NCCO 527a_100000210304_100000737805 [1,0,0,0,0,0|3,0,0]=4 1127 B13R1.44 O=C(Cc1ccncc1)NCCF 11a_100000724931_100011201483 [1,0,0,0,0,0|3,0,0]=4 1128 B13R1.44 O=C(Cc1ccncc1)NCCF 240690a_100000724931_100011201483 [1,0,0,0,0,0|3,0,0]=4 1129 B13R1.44 O=C(Cc1ccncc1)NCCO 240690a_100000210304_100011201483 [1,0,0,0,0,0|3,0,0]=4 1130 B13R1.44 O=C(NCCF)Nc1ccccc1 2430a_100000106764_100000724931 [1,0,0,0,0,0|3,0,0]=4 1131 B13R1.44 O=C(NCCO)Nc1ccccc1 2430a_100000106764_100000210304 [1,0,0,0,0,0|3,0,0]=4 1132 B13R1.44 [13CH3]N(CCCO)Cc1ccccc1 2230a_100000185501_200025704644 [1,0,0,0,0,0|3,0,0]=4 1133 B13R1.44 [13CH3]N(CCCO)Cc1ccccc1 269982a_100000185501_200025704644 [1,0,0,0,0,0|3,0,0]=4 1134 B13R1.44 [13CH3]NCCC(=O)Nc1cccnc1 34a_100000748795_200025704644 [1,0,0,0,0,0|3,0,0]=4 1135 B13R1.44 [13CH3]SCCC(=O)Nc1ccccc1 62a_200025704644_100000242058 [1,0,0,0,0,0|2,0,0]=3 1136 B13R1.44 [13CH3]SCCC(=O)Nc1cccnc1 62a_200025704644_200015187043 [1,0,0,0,0,0|3,0,0]=4 1137 B13R1.44 [13CH3]SCCC(=O)Oc1ccccc1 62a_200025704644_200000035796 [1,0,0,0,0,0|2,0,0]=3 1138 B15R1.83 C#CCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100010269958 [0,1,0,0,0,0|2,0,1]=4 1139 B15R1.83 C#CCCCCC(=O)Cc1ccccc1 1458a_100000696528_100015291786 [0,1,0,0,0,0|1,0,1]=3 1140 B15R1.83 C#CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100010269958 [0,1,0,0,0,0|2,0,1]=4 1141 B15R1.83 C#CCCCCC(=O)Cc1ccccn1 1458a_100000696528_100000721315 [0,1,0,0,0,0|2,0,1]=4 1142 B15R1.83 C#CCCCCC(=O)Cc1cccnc1 1458a_100000696528_100000733263 [0,1,0,0,0,0|2,0,1]=4 1143 B15R1.83 C#CCCCCC(=O)Cc1cccnc1 1458a_100000737805_100010269958 [0,1,0,0,0,0|2,0,1]=4 1144 B15R1.83 C#CCCCCC(=O)Cc1ccncc1 1458a_100000696528_100000705612 [0,1,0,0,0,0|2,0,1]=4 1145 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 11a_100000106764_100000696528 [0,1,0,0,0,0|2,0,1]=4 1146 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000696528 [0,1,0,0,0,0|2,0,1]=4 1147 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 22a_100000106764_100000696528 [0,1,0,0,0,0|2,0,1]=4 1148 B15R1.83 C#CCCCCC(=O)Nc1ccccc1 527a_100000106764_100000696528 [0,1,0,0,0,0|2,0,1]=4 1149 B15R1.83 C#CCCCNC(=O)C[n+]1ccccc1 11a_100000718082_200000086051 [0,1,0,0,0,0|2,0,1]=4 1150 B15R1.83 C#CCCCNC(=O)C[n+]1ccccc1 240690a_100000718082_200000086051 [0,1,0,0,0,0|2,0,1]=4 1151 B15R1.83 C#CCCCNC(=O)C[n+]1ccccc1 527a_100000718082_200000086051 [0,1,0,0,0,0|2,0,1]=4 1152 B15R1.83 C#CCCCNC(=O)Cc1ccccn1 11a_100000718082_100000233486 [0,1,0,0,0,0|2,0,1]=4 1153 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 11a_100000718082_100000737805 [0,1,0,0,0,0|2,0,1]=4 1154 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 240690a_100000718082_100000737805 [0,1,0,0,0,0|2,0,1]=4 1155 B15R1.83 C#CCCCNC(=O)Cc1cccnc1 527a_100000718082_100000737805 [0,1,0,0,0,0|2,0,1]=4 1156 B15R1.83 C#CCCCNC(=O)Cc1ccncc1 11a_100000718082_100011201483 [0,1,0,0,0,0|2,0,1]=4 1157 B15R1.83 C#CCCCNC(=O)Cc1ccncc1 240690a_100000718082_100011201483 [0,1,0,0,0,0|2,0,1]=4 1158 B15R1.83 C#CCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000718082 [0,1,0,0,0,0|2,0,1]=4 1159 B15R1.83 C#CCCCOC(C)Cc1ccccc1 34a_100000215630_200011218536 [0,1,0,0,0,0|1,0,2]=4 1160 B15R1.83 C#CCCCOC(C)Cc1ccccc1 34a_100000748627_100000695029 [0,1,0,0,0,0|1,0,2]=4 1161 B15R1.83 C#CCCCOC(C)Cc1ccccc1 7a_100000215630_200011218536 [0,1,0,0,0,0|1,0,2]=4 1162 B15R1.83 C#CCCCOC(C)Cc1ccccc1 7a_100000748627_100011215417 [0,1,0,0,0,0|1,0,2]=4 1163 B15R1.83 C#CCCOCC(=O)Nc1ccccc1 34a_100000246334_100000688953 [0,1,0,0,0,0|1,0,2]=4 1164 B15R1.83 C#CCCOCC(=O)Nc1ccccc1 34a_100011215631_100000182850 [0,1,0,0,0,0|1,0,2]=4 1165 B15R1.83 C#CCCOCC(=O)Oc1ccccc1 34a_100011215631_100009813826 [0,1,0,0,0,0|1,0,2]=4 1166 B15R1.83 C#CCCSCC(=O)Cc1ccccc1 62a_100000233483_100000688953 [0,1,0,0,0,0|0,1,2]=4 1167 B15R1.83 C#CCCSCC(=O)Cc1ccccc1 62a_100000688953_100000233483 [0,1,0,0,0,0|0,1,2]=4 1168 B15R1.83 C#CCOCCC(=O)Cc1ccccc1 1458a_100000693358_100015291786 [0,1,0,0,0,0|1,0,2]=4 1169 B15R1.83 C/C(=C\c1ccccc1)/COCCCF 34a_200025717232_100011934791 [0,1,0,0,0,0|2,0,1]=4 1170 B15R1.83 C/C(=C\c1ccccc1)/COCCCF 7a_200025717232_100011934791 [0,1,0,0,0,0|2,0,1]=4 1171 B15R1.83 C/C(=C\c1ccccc1)/COCCCO 34a_200025717232_100000230001 [0,1,0,0,0,0|2,0,1]=4 1172 B15R1.83 C/C(=C\c1ccccc1)/COCCCO 7a_200025717232_100011215043 [0,1,0,0,0,0|2,0,1]=4 1173 B15R1.83 C/C=C/CCOC(C)Cc1ccccc1 34a_100016278192_200011218536 [0,1,0,0,0,0|1,0,2]=4 1174 B15R1.83 C/C=C/COCC(=O)Nc1ccccc1 34a_100000246334_100102629194 [0,1,0,0,0,0|1,0,2]=4 1175 B15R1.83 C/C=C/COCC(=O)Nc1ccccc1 34a_100016270725_100000182850 [0,1,0,0,0,0|1,0,2]=4 1176 B15R1.83 C/C=C/COCC(=O)Oc1ccccc1 34a_100016270725_100009813826 [0,1,0,0,0,0|1,0,2]=4 1177 B15R1.83 C/C=C/CSCC(=O)Cc1ccccc1 62a_100000233483_100102629194 [0,1,0,0,0,0|0,1,2]=4 1178 B15R1.83 C/C=C/CSCC(=O)Cc1ccccc1 62a_100102629194_100000233483 [0,1,0,0,0,0|0,1,2]=4 1179 B15R1.83 C=CCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215482 [0,1,0,0,0,0|2,0,1]=4 1180 B15R1.83 C=CCCCCC(=O)Cc1ccccc1 1458a_100011215552_100015291786 [0,1,0,0,0,0|1,0,1]=3 1181 B15R1.83 C=CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100011215482 [0,1,0,0,0,0|2,0,1]=4 1182 B15R1.83 C=CCCCCC(=O)Cc1ccccn1 1458a_100011215552_100000721315 [0,1,0,0,0,0|2,0,1]=4 1183 B15R1.83 C=CCCCCC(=O)Cc1cccnc1 1458a_100000737805_100011215482 [0,1,0,0,0,0|2,0,1]=4 1184 B15R1.83 C=CCCCCC(=O)Cc1cccnc1 1458a_100011215552_100000733263 [0,1,0,0,0,0|2,0,1]=4 1185 B15R1.83 C=CCCCCC(=O)Cc1ccncc1 1458a_100011215552_100000705612 [0,1,0,0,0,0|2,0,1]=4 1186 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 11a_100000106764_100011215552 [0,1,0,0,0,0|2,0,1]=4 1187 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 1626a_100000106764_100011215552 [0,1,0,0,0,0|2,0,1]=4 1188 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 22a_100000106764_100011215552 [0,1,0,0,0,0|2,0,1]=4 1189 B15R1.83 C=CCCCCC(=O)Nc1ccccc1 527a_100000106764_100011215552 [0,1,0,0,0,0|2,0,1]=4 1190 B15R1.83 C=CCCCNC(=O)C[n+]1ccccc1 11a_100000700776_200000086051 [0,1,0,0,0,0|2,0,1]=4 1191 B15R1.83 C=CCCCNC(=O)C[n+]1ccccc1 240690a_100000700776_200000086051 [0,1,0,0,0,0|2,0,1]=4 1192 B15R1.83 C=CCCCNC(=O)C[n+]1ccccc1 527a_100000700776_200000086051 [0,1,0,0,0,0|2,0,1]=4 1193 B15R1.83 C=CCCCNC(=O)Cc1ccccn1 11a_100000700776_100000233486 [0,1,0,0,0,0|2,0,1]=4 1194 B15R1.83 C=CCCCNC(=O)Cc1cccnc1 11a_100000700776_100000737805 [0,1,0,0,0,0|2,0,1]=4 1195 B15R1.83 C=CCCCNC(=O)Cc1cccnc1 240690a_100000700776_100000737805 [0,1,0,0,0,0|2,0,1]=4 1196 B15R1.83 C=CCCCNC(=O)Cc1cccnc1 527a_100000700776_100000737805 [0,1,0,0,0,0|2,0,1]=4 1197 B15R1.83 C=CCCCNC(=O)Cc1ccncc1 11a_100000700776_100011201483 [0,1,0,0,0,0|2,0,1]=4 1198 B15R1.83 C=CCCCNC(=O)Cc1ccncc1 240690a_100000700776_100011201483 [0,1,0,0,0,0|2,0,1]=4 1199 B15R1.83 C=CCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000700776 [0,1,0,0,0,0|2,0,1]=4 1200 B15R1.83 C=CCCCOC(C)Cc1ccccc1 34a_100000748627_100000757094 [0,1,0,0,0,0|1,0,2]=4 1201 B15R1.83 C=CCCCOC(C)Cc1ccccc1 34a_100000758997_200011218536 [0,1,0,0,0,0|1,0,2]=4 1202 B15R1.83 C=CCCCOC(C)Cc1ccccc1 7a_100000748627_100000757094 [0,1,0,0,0,0|1,0,2]=4 1203 B15R1.83 C=CCCCOC(C)Cc1ccccc1 7a_100000758997_200011218536 [0,1,0,0,0,0|1,0,2]=4 1204 B15R1.83 C=CCCNCC(=O)Cc1ccccc1 2230a_100015191253_100000233483 [0,1,0,0,0,0|1,0,2]=4 1205 B15R1.83 C=CCCOCC(=O)Nc1ccccc1 34a_100000246334_100000754431 [0,1,0,0,0,0|1,0,2]=4 1206 B15R1.83 C=CCCOCC(=O)Nc1ccccc1 34a_100011205117_100000182850 [0,1,0,0,0,0|1,0,2]=4 1207 B15R1.83 C=CCCOCC(=O)Oc1ccccc1 34a_100011205117_100009813826 [0,1,0,0,0,0|1,0,2]=4 1208 B15R1.83 C=CCCSCC(=O)Cc1ccccc1 62a_100000233483_100000754431 [0,1,0,0,0,0|0,1,2]=4 1209 B15R1.83 C=CCCSCC(=O)Cc1ccccc1 62a_100000754431_100000233483 [0,1,0,0,0,0|0,1,2]=4 1210 B15R1.83 C=CCOCCC(=O)Cc1ccccc1 1458a_200011217002_100015291786 [0,1,0,0,0,0|1,0,2]=4 1211 B15R1.83 CC#CCCOC(C)Cc1ccccc1 34a_100000750427_200011218536 [0,1,0,0,0,0|1,0,2]=4 1212 B15R1.83 CC#CCNCC(=O)Cc1ccccc1 2230a_100000685387_100000233483 [0,1,0,0,0,0|1,0,2]=4 1213 B15R1.83 CC#CCOCC(=O)Nc1ccccc1 34a_100000246334_100000748600 [0,1,0,0,0,0|1,0,2]=4 1214 B15R1.83 CC#CCOCC(=O)Nc1ccccc1 34a_100000761923_100000182850 [0,1,0,0,0,0|1,0,2]=4 1215 B15R1.83 CC#CCOCC(=O)Oc1ccccc1 34a_100000761923_100009813826 [0,1,0,0,0,0|1,0,2]=4 1216 B15R1.83 CC#CCSCC(=O)Cc1ccccc1 62a_100000233483_100000748600 [0,1,0,0,0,0|0,1,2]=4 1217 B15R1.83 CC#CCSCC(=O)Cc1ccccc1 62a_100000748600_100000233483 [0,1,0,0,0,0|0,1,2]=4 1218 B15R1.83 CC(COCCCF)Cc1ccccc1 34a_100012125295_100011934791 [0,1,0,0,0,0|2,0,1]=4 1219 B15R1.83 CC(COCCCF)Cc1ccccc1 7a_100012125295_100011934791 [0,1,0,0,0,0|2,0,1]=4 1220 B15R1.83 CC(COCCCO)Cc1ccccc1 34a_100012125295_100000230001 [0,1,0,0,0,0|2,0,1]=4 1221 B15R1.83 CC(COCCCO)Cc1ccccc1 7a_100012125295_100011215043 [0,1,0,0,0,0|2,0,1]=4 1222 B15R1.83 CC(Cc1ccccc1)NCCCCO 34a_100000750430_200011218536 [0,1,0,0,0,0|2,0,1]=4 1223 B15R1.83 CC(Cc1ccccc1)OCCCC#N 7a_100000748627_100000687738 [0,1,0,0,0,0|1,0,2]=4 1224 B15R1.83 CC(Cc1ccccc1)OCCCC=O 7a_100000748627_200011292268 [0,1,0,0,0,0|1,0,2]=4 1225 B15R1.83 CC(Cc1ccccc1)OCCCCBr 34a_100011216708_200011218536 [0,1,0,0,0,0|1,0,1]=3 1226 B15R1.83 CC(Cc1ccccc1)OCCCCCl 34a_100000210776_200011218536 [0,1,0,0,0,0|1,0,1]=3 1227 B15R1.83 CC(Cc1ccccc1)OCCCCCl 7a_100000210776_200011218536 [0,1,0,0,0,0|1,0,1]=3 1228 B15R1.83 CC(Cc1ccccc1)OCCCCF 34a_100000748627_100000729493 [0,1,0,0,0,0|1,0,1]=3 1229 B15R1.83 CC(Cc1ccccc1)OCCCCF 34a_100011995726_200011218536 [0,1,0,0,0,0|1,0,1]=3 1230 B15R1.83 CC(Cc1ccccc1)OCCCCF 7a_100000748627_100000729493 [0,1,0,0,0,0|1,0,1]=3 1231 B15R1.83 CC(Cc1ccccc1)OCCCCF 7a_100011995726_200011218536 [0,1,0,0,0,0|1,0,1]=3 1232 B15R1.83 CC(Cc1ccccc1)OCCCCI 34a_200012148704_200011218536 [0,1,0,0,0,0|1,0,1]=3 1233 B15R1.83 CC(Cc1ccccc1)OCCCCN 34a_100000750430_200011218536 [0,1,0,0,0,0|1,0,1]=3 1234 B15R1.83 CC(Cc1ccccc1)OCCCCO 34a_100000748627_100011216708 [0,1,0,0,0,0|1,0,1]=3 1235 B15R1.83 CC(Cc1ccccc1)OCCCCO 7a_100000748627_100000210776 [0,1,0,0,0,0|1,0,1]=3 1236 B15R1.83 CC(Cc1ccccc1)SCCCCF 62a_100000729493_200011218536 [0,1,0,0,0,0|1,1,1]=4 1237 B15R1.83 CC(Cc1ccccc1)SCCCCF 62a_200011218536_100000729493 [0,1,0,0,0,0|1,1,1]=4 1238 B15R1.83 CC(Cc1ccccc1)SCCCCO 62a_100000210776_200011218536 [0,1,0,0,0,0|1,1,1]=4 1239 B15R1.83 CC(Cc1ccccc1)SCCCCO 62a_200011218536_100000210776 [0,1,0,0,0,0|1,1,1]=4 1240 B15R1.83 CC/C=C\CCC(=O)C[n+]1ccccc1 1458a_200000086051_100015370543 [0,1,0,0,0,0|2,0,1]=4 1241 B15R1.83 CC/C=C\CCC(=O)Cc1ccccn1 1458a_100000233486_100015370543 [0,1,0,0,0,0|2,0,1]=4 1242 B15R1.83 CC/C=C\CCC(=O)Cc1cccnc1 1458a_100000737805_100015370543 [0,1,0,0,0,0|2,0,1]=4 1243 B15R1.83 CC/C=C\COC(C)Cc1ccccc1 34a_100000748627_100103147603 [0,1,0,0,0,0|1,0,2]=4 1244 B15R1.83 CC/C=C\COC(C)Cc1ccccc1 34a_100016268518_200011218536 [0,1,0,0,0,0|1,0,2]=4 1245 B15R1.83 CC/C=C\COC(C)Cc1ccccc1 7a_100000748627_100103147603 [0,1,0,0,0,0|1,0,2]=4 1246 B15R1.83 CC=CCOCC(=O)Nc1ccccc1 34a_100000246334_100000070051 [0,1,0,0,0,0|1,0,2]=4 1247 B15R1.83 CC=CCSCC(=O)Cc1ccccc1 62a_100000070051_100000233483 [0,1,0,0,0,0|0,1,2]=4 1248 B15R1.83 CC=CCSCC(=O)Cc1ccccc1 62a_100000233483_100000070051 [0,1,0,0,0,0|0,1,2]=4 1249 B15R1.83 CCC#CCOC(C)Cc1ccccc1 34a_100000032950_200011218536 [0,1,0,0,0,0|1,0,2]=4 1250 B15R1.83 CCC#CCOC(C)Cc1ccccc1 34a_100000748627_100009813939 [0,1,0,0,0,0|1,0,2]=4 1251 B15R1.83 CCC#CCOC(C)Cc1ccccc1 7a_100000748627_100009813939 [0,1,0,0,0,0|1,0,2]=4 1252 B15R1.83 CCC/C=C/CC(=O)Cc1ccccc1 1458a_200016266809_100015291786 [0,1,0,0,0,0|1,0,1]=3 1253 B15R1.83 CCC/C=C/CC(=O)Cc1ccccn1 1458a_200016266809_100000721315 [0,1,0,0,0,0|2,0,1]=4 1254 B15R1.83 CCC/C=C/CC(=O)Cc1cccnc1 1458a_200016266809_100000733263 [0,1,0,0,0,0|2,0,1]=4 1255 B15R1.83 CCC/C=C/CC(=O)Cc1ccncc1 1458a_200016266809_100000705612 [0,1,0,0,0,0|2,0,1]=4 1256 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 11a_100000106764_200016266809 [0,1,0,0,0,0|2,0,1]=4 1257 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_200016266809 [0,1,0,0,0,0|2,0,1]=4 1258 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 22a_100000106764_200016266809 [0,1,0,0,0,0|2,0,1]=4 1259 B15R1.83 CCC/C=C/CC(=O)Nc1ccccc1 527a_100000106764_200016266809 [0,1,0,0,0,0|2,0,1]=4 1260 B15R1.83 CCCC=NNC(=O)C[n+]1ccccc1 4a_100000199085_100000185831 [0,1,0,0,0,0|2,0,1]=4 1261 B15R1.83 CCCC=NNC(=O)Cc1ccccc1 4a_100000182964_100000185831 [0,1,0,0,0,0|1,0,1]=3 1262 B15R1.83 CCCC=NNC(=O)Cc1ccccn1 4a_200000059813_100000185831 [0,1,0,0,0,0|2,0,1]=4 1263 B15R1.83 CCCC=NNC(=O)Cc1ccncc1 4a_100000766356_100000185831 [0,1,0,0,0,0|2,0,1]=4 1264 B15R1.83 CCCCC=CC(=O)Cc1ccccc1 1458a_100016266645_100015291786 [0,1,0,0,0,0|1,0,0]=2 1265 B15R1.83 CCCCC=CC(=O)Cc1ccccn1 1458a_100016266645_100000721315 [0,1,0,0,0,0|2,0,0]=3 1266 B15R1.83 CCCCC=CC(=O)Cc1cccnc1 1458a_100016266645_100000733263 [0,1,0,0,0,0|2,0,0]=3 1267 B15R1.83 CCCCC=CC(=O)Cc1cccnn1 1458a_100016266645_100016990269 [0,1,0,0,0,0|3,0,0]=4 1268 B15R1.83 CCCCC=CC(=O)Cc1ccncc1 1458a_100016266645_100000705612 [0,1,0,0,0,0|2,0,0]=3 1269 B15R1.83 CCCCC=CC(=O)Cc1cnccn1 1458a_100016266645_100016995436 [0,1,0,0,0,0|3,0,0]=4 1270 B15R1.83 CCCCC=CC(=O)Cc1cncnc1 1458a_100016266645_100015196519 [0,1,0,0,0,0|3,0,0]=4 1271 B15R1.83 CCCCC=CC(=O)Cc1ncccn1 1458a_100016266645_100000703007 [0,1,0,0,0,0|3,0,0]=4 1272 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 11a_100000106764_100016266645 [0,1,0,0,0,0|2,0,0]=3 1273 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 1626a_100000106764_100016266645 [0,1,0,0,0,0|2,0,0]=3 1274 B15R1.83 CCCCC=CC(=O)Nc1ccccc1 22a_100000106764_100016266645 [0,1,0,0,0,0|2,0,0]=3 1275 B15R1.83 CCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210757 [0,1,0,0,0,0|2,0,0]=3 1276 B15R1.83 CCCCCCC(=O)Cc1ccccc1 1458a_100102632555_100015291786 [0,1,0,0,0,0|1,0,0]=2 1277 B15R1.83 CCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210757 [0,1,0,0,0,0|2,0,0]=3 1278 B15R1.83 CCCCCCC(=O)Cc1ccccn1 1458a_100102632555_100000721315 [0,1,0,0,0,0|2,0,0]=3 1279 B15R1.83 CCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210757 [0,1,0,0,0,0|2,0,0]=3 1280 B15R1.83 CCCCCCC(=O)Cc1cccnc1 1458a_100102632555_100000733263 [0,1,0,0,0,0|2,0,0]=3 1281 B15R1.83 CCCCCCC(=O)Cc1cccnn1 1458a_100102632555_100016990269 [0,1,0,0,0,0|3,0,0]=4 1282 B15R1.83 CCCCCCC(=O)Cc1ccncc1 1458a_100102632555_100000705612 [0,1,0,0,0,0|2,0,0]=3 1283 B15R1.83 CCCCCCC(=O)Cc1cnccn1 1458a_100102632555_100016995436 [0,1,0,0,0,0|3,0,0]=4 1284 B15R1.83 CCCCCCC(=O)Cc1cncnc1 1458a_100000721575_100000210757 [0,1,0,0,0,0|3,0,0]=4 1285 B15R1.83 CCCCCCC(=O)Cc1cncnc1 1458a_100102632555_100015196519 [0,1,0,0,0,0|3,0,0]=4 1286 B15R1.83 CCCCCCC(=O)Cc1ncccn1 1458a_100102632555_100000703007 [0,1,0,0,0,0|3,0,0]=4 1287 B15R1.83 CCCCCCC(=O)Nc1ccccc1 11a_100000106764_100102632555 [0,1,0,0,0,0|2,0,0]=3 1288 B15R1.83 CCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100102632555 [0,1,0,0,0,0|2,0,0]=3 1289 B15R1.83 CCCCCCC(=O)Nc1ccccc1 22a_100000106764_100102632555 [0,1,0,0,0,0|2,0,0]=3 1290 B15R1.83 CCCCCCC(=O)Nc1ccccc1 527a_100000106764_100102632555 [0,1,0,0,0,0|2,0,0]=3 1291 B15R1.83 CCCCCCN(C)Cc1ccccc1 2230a_100000186898_100000210314 [0,1,0,0,0,0|3,0,0]=4 1292 B15R1.83 CCCCCCN(C)Cc1ccccc1 2230a_106256046315_100015291786 [0,1,0,0,0,0|3,0,0]=4 1293 B15R1.83 CCCCCCN(C)Cc1ccccc1 269982a_100000186898_100000210757 [0,1,0,0,0,0|3,0,0]=4 1294 B15R1.83 CCCCCCN(C)Cc1ccccc1 269982a_106256046315_100000211182 [0,1,0,0,0,0|3,0,0]=4 1295 B15R1.83 CCCCCCN(C)Cc1ccccc1 270004a_106256046315_100015611070 [0,1,0,0,0,0|3,0,0]=4 1296 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 11a_100000209983_200000086051 [0,1,0,0,0,0|2,0,0]=3 1297 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 240690a_100000209983_200000086051 [0,1,0,0,0,0|2,0,0]=3 1298 B15R1.83 CCCCCNC(=O)C[n+]1ccccc1 527a_100000209983_200000086051 [0,1,0,0,0,0|2,0,0]=3 1299 B15R1.83 CCCCCNC(=O)Cc1ccccn1 11a_100000209983_100000233486 [0,1,0,0,0,0|2,0,0]=3 1300 B15R1.83 CCCCCNC(=O)Cc1cccnc1 11a_100000209983_100000737805 [0,1,0,0,0,0|2,0,0]=3 1301 B15R1.83 CCCCCNC(=O)Cc1cccnc1 240690a_100000209983_100000737805 [0,1,0,0,0,0|2,0,0]=3 1302 B15R1.83 CCCCCNC(=O)Cc1cccnc1 527a_100000209983_100000737805 [0,1,0,0,0,0|2,0,0]=3 1303 B15R1.83 CCCCCNC(=O)Cc1ccncc1 11a_100000209983_100011201483 [0,1,0,0,0,0|2,0,0]=3 1304 B15R1.83 CCCCCNC(=O)Cc1ccncc1 240690a_100000209983_100011201483 [0,1,0,0,0,0|2,0,0]=3 1305 B15R1.83 CCCCCNC(=O)Cc1cnccn1 11a_100000209983_100000726051 [0,1,0,0,0,0|3,0,0]=4 1306 B15R1.83 CCCCCNC(=O)Cc1cnccn1 240690a_100000209983_100000726051 [0,1,0,0,0,0|3,0,0]=4 1307 B15R1.83 CCCCCNC(=O)Cc1cnccn1 527a_100000209983_100000726051 [0,1,0,0,0,0|3,0,0]=4 1308 B15R1.83 CCCCCNC(=O)Cc1cncnc1 11a_100000209983_100000721575 [0,1,0,0,0,0|3,0,0]=4 1309 B15R1.83 CCCCCNC(=O)Cc1cncnc1 240690a_100000209983_100000721575 [0,1,0,0,0,0|3,0,0]=4 1310 B15R1.83 CCCCCNC(=O)Cc1cncnc1 527a_100000209983_100000721575 [0,1,0,0,0,0|3,0,0]=4 1311 B15R1.83 CCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000209983 [0,1,0,0,0,0|2,0,0]=3 1312 B15R1.83 CCCCCOC(C)Cc1ccccc1 34a_100000210253_200011218536 [0,1,0,0,0,0|1,0,1]=3 1313 B15R1.83 CCCCCOC(C)Cc1ccccc1 34a_100000748627_100000718602 [0,1,0,0,0,0|1,0,1]=3 1314 B15R1.83 CCCCCOC(C)Cc1ccccc1 7a_100000210253_200011218536 [0,1,0,0,0,0|1,0,1]=3 1315 B15R1.83 CCCCCOC(C)Cc1ccccc1 7a_100000748627_100000210326 [0,1,0,0,0,0|1,0,1]=3 1316 B15R1.83 CCCCCSC(C)Cc1ccccc1 62a_100000210326_200011218536 [0,1,0,0,0,0|1,1,1]=4 1317 B15R1.83 CCCCCSC(C)Cc1ccccc1 62a_200011218536_100000210326 [0,1,0,0,0,0|1,1,1]=4 1318 B15R1.83 CCCCNCC(=O)Cc1ccccc1 2230a_100000102301_100000233483 [0,1,0,0,0,0|1,0,0]=2 1319 B15R1.83 CCCCNCC(=O)Cc1ccccc1 7a_106832991798_100000233483 [0,1,0,0,0,0|1,0,0]=2 1320 B15R1.83 CCCCNCC(=O)Nc1ccccc1 2230a_100000102301_100000182850 [0,1,0,0,0,0|2,0,0]=3 1321 B15R1.83 CCCCNCC(=O)Nc1ccccc1 7a_106832991798_100000182850 [0,1,0,0,0,0|2,0,0]=3 1322 B15R1.83 CCCCNCC(=O)Nc1ccccn1 2230a_100000102301_100020662008 [0,1,0,0,0,0|3,0,0]=4 1323 B15R1.83 CCCCNCC(=O)Nc1ccccn1 7a_106832991798_100020662008 [0,1,0,0,0,0|3,0,0]=4 1324 B15R1.83 CCCCNCC(=O)Nc1ccncc1 2230a_100000102301_100000754145 [0,1,0,0,0,0|3,0,0]=4 1325 B15R1.83 CCCCNCC(=O)Nc1ccncc1 7a_106832991798_100000754145 [0,1,0,0,0,0|3,0,0]=4 1326 B15R1.83 CCCCNCC(=O)Oc1ccccc1 2230a_100000102301_100009813826 [0,1,0,0,0,0|2,0,0]=3 1327 B15R1.83 CCCCNCC(=O)Oc1ccccc1 7a_106832991798_100009813826 [0,1,0,0,0,0|2,0,0]=3 1328 B15R1.83 CCCCNCC(O)Cc1ccccc1 2230a_100000752270_100000210211 [0,1,0,0,0,0|1,0,2]=4 1329 B15R1.83 CCCCNC[C@@H](O)Cc1ccccc1 2230a_100000102301_100000729385 [0,1,0,0,0,0|1,0,2]=4 1330 B15R1.83 CCCCNC[C@@H](O)Cc1ccccc1 7a_106832991798_100000729385 [0,1,0,0,0,0|1,0,2]=4 1331 B15R1.83 CCCCNN=C(C)C[n+]1ccccc1 4a_100025702795_100000034229 [0,1,0,0,0,0|3,0,0]=4 1332 B15R1.83 CCCCNNC(=O)C[n+]1ccccc1 22a_100025702795_200000086051 [0,1,0,0,0,0|2,0,0]=3 1333 B15R1.83 CCCCNNC(=O)Cc1ccccn1 22a_100025702795_100000233486 [0,1,0,0,0,0|2,0,0]=3 1334 B15R1.83 CCCCNNC(=O)Cc1cccnc1 22a_100025702795_100000737805 [0,1,0,0,0,0|2,0,0]=3 1335 B15R1.83 CCCCNNC(=O)Cc1ccncc1 22a_100025702795_100011201483 [0,1,0,0,0,0|2,0,0]=3 1336 B15R1.83 CCCCNNC(=O)Cc1cnccn1 22a_100025702795_100000726051 [0,1,0,0,0,0|3,0,0]=4 1337 B15R1.83 CCCCNNC(=O)Cc1cncnc1 22a_100025702795_100000721575 [0,1,0,0,0,0|3,0,0]=4 1338 B15R1.83 CCCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210210 [0,1,0,0,0,0|1,0,1]=3 1339 B15R1.83 CCCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210211 [0,1,0,0,0,0|1,0,1]=3 1340 B15R1.83 CCCCOCC(=O)C[n+]1ccccc1 1458a_200000086051_100011995733 [0,1,0,0,0,0|1,0,0]=2 1341 B15R1.83 CCCCOCC(=O)Cc1ccccc1 1458a_100000757543_100015291786 [0,1,0,0,0,0|0,0,0]=1 1342 B15R1.83 CCCCOCC(=O)Cc1ccccc1 7a_100000210227_100000233483 [0,1,0,0,0,0|0,0,0]=1 1343 B15R1.83 CCCCOCC(=O)Cc1ccccn1 1458a_100000233486_100011995733 [0,1,0,0,0,0|1,0,0]=2 1344 B15R1.83 CCCCOCC(=O)Cc1ccccn1 1458a_100000757543_100000721315 [0,1,0,0,0,0|1,0,0]=2 1345 B15R1.83 CCCCOCC(=O)Cc1cccnc1 1458a_100000737805_100011995733 [0,1,0,0,0,0|1,0,0]=2 1346 B15R1.83 CCCCOCC(=O)Cc1cccnc1 1458a_100000757543_100000733263 [0,1,0,0,0,0|1,0,0]=2 1347 B15R1.83 CCCCOCC(=O)Cc1cccnn1 1458a_100000757543_100016990269 [0,1,0,0,0,0|2,0,0]=3 1348 B15R1.83 CCCCOCC(=O)Cc1ccncc1 1458a_100000757543_100000705612 [0,1,0,0,0,0|1,0,0]=2 1349 B15R1.83 CCCCOCC(=O)Cc1cnccn1 1458a_100000757543_100016995436 [0,1,0,0,0,0|2,0,0]=3 1350 B15R1.83 CCCCOCC(=O)Cc1cncnc1 1458a_100000721575_100011995733 [0,1,0,0,0,0|2,0,0]=3 1351 B15R1.83 CCCCOCC(=O)Cc1cncnc1 1458a_100000757543_100015196519 [0,1,0,0,0,0|2,0,0]=3 1352 B15R1.83 CCCCOCC(=O)Cc1ncccn1 1458a_100000757543_100000703007 [0,1,0,0,0,0|2,0,0]=3 1353 B15R1.83 CCCCOCC(=O)Nc1ccccc1 11a_100000106764_100000757543 [0,1,0,0,0,0|1,0,0]=2 1354 B15R1.83 CCCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000757543 [0,1,0,0,0,0|1,0,0]=2 1355 B15R1.83 CCCCOCC(=O)Nc1ccccc1 22a_100000106764_100000757543 [0,1,0,0,0,0|1,0,0]=2 1356 B15R1.83 CCCCOCC(=O)Nc1ccccc1 34a_100000210227_100000182850 [0,1,0,0,0,0|1,0,0]=2 1357 B15R1.83 CCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000210210 [0,1,0,0,0,0|1,0,0]=2 1358 B15R1.83 CCCCOCC(=O)Nc1ccccc1 527a_100000106764_100000757543 [0,1,0,0,0,0|1,0,0]=2 1359 B15R1.83 CCCCOCC(=O)Nc1ccccc1 7a_100000210227_100000182850 [0,1,0,0,0,0|1,0,0]=2 1360 B15R1.83 CCCCOCC(=O)Nc1ccccn1 7a_100000210227_100020662008 [0,1,0,0,0,0|2,0,0]=3 1361 B15R1.83 CCCCOCC(=O)Nc1ccncc1 7a_100000210227_100000754145 [0,1,0,0,0,0|2,0,0]=3 1362 B15R1.83 CCCCOCC(=O)Nc1ncccn1 7a_100000210227_100000183248 [0,1,0,0,0,0|3,0,0]=4 1363 B15R1.83 CCCCOCC(=O)Oc1ccccc1 34a_100000210227_100009813826 [0,1,0,0,0,0|1,0,0]=2 1364 B15R1.83 CCCCOCC(=O)Oc1ccccc1 7a_100000210227_100009813826 [0,1,0,0,0,0|1,0,0]=2 1365 B15R1.83 CCCCOCC(C)Cc1ccccc1 34a_100012125295_100000210210 [0,1,0,0,0,0|1,0,1]=3 1366 B15R1.83 CCCCOCC(C)Cc1ccccc1 7a_100012125295_100000210211 [0,1,0,0,0,0|1,0,1]=3 1367 B15R1.83 CCCCOCC(C)Oc1ccccc1 34a_200000036796_100000210210 [0,1,0,0,0,0|2,0,1]=4 1368 B15R1.83 CCCCOCC(C)Oc1ccccc1 7a_200000036796_100000210211 [0,1,0,0,0,0|2,0,1]=4 1369 B15R1.83 CCCCOCC(N)Cc1ccccc1 34a_100000739027_100000210210 [0,1,0,0,0,0|1,0,1]=3 1370 B15R1.83 CCCCOCN(C)Cc1ccccc1 2230a_100000186898_100011995733 [0,1,0,0,0,0|2,0,0]=3 1371 B15R1.83 CCCCOCN(C)Cc1ccccc1 269982a_100000186898_100011995733 [0,1,0,0,0,0|2,0,0]=3 1372 B15R1.83 CCCCOCN(C)Cc1ccccn1 2230a_100000207498_100011995733 [0,1,0,0,0,0|3,0,0]=4 1373 B15R1.83 CCCCOCN(C)Cc1ccccn1 269982a_100000207498_100011995733 [0,1,0,0,0,0|3,0,0]=4 1374 B15R1.83 CCCCOCN(C)Cc1cccnc1 2230a_100000184577_100011995733 [0,1,0,0,0,0|3,0,0]=4 1375 B15R1.83 CCCCOCN(C)Cc1cccnc1 269982a_100000184577_100011995733 [0,1,0,0,0,0|3,0,0]=4 1376 B15R1.83 CCCCOCN(C)Cc1ccncc1 2230a_100000187231_100011995733 [0,1,0,0,0,0|3,0,0]=4 1377 B15R1.83 CCCCOCN(C)Cc1ccncc1 269982a_100000187231_100011995733 [0,1,0,0,0,0|3,0,0]=4 1378 B15R1.83 CCCCOC[C@@H](O)Cc1ccccc1 34a_100000210227_100000729385 [0,1,0,0,0,0|0,0,2]=3 1379 B15R1.83 CCCCOC[C@@H](O)Cc1ccccc1 7a_100000210227_100000729385 [0,1,0,0,0,0|0,0,2]=3 1380 B15R1.83 CCCCSCC(=O)Cc1ccccc1 1458a_100000191162_100015291786 [0,1,0,0,0,0|0,1,0]=2 1381 B15R1.83 CCCCSCC(=O)Cc1ccccc1 62a_100000210211_100000233483 [0,1,0,0,0,0|0,1,0]=2 1382 B15R1.83 CCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000210210 [0,1,0,0,0,0|0,1,0]=2 1383 B15R1.83 CCCCSCC(=O)Cc1ccccn1 1458a_100000191162_100000721315 [0,1,0,0,0,0|1,1,0]=3 1384 B15R1.83 CCCCSCC(=O)Cc1cccnc1 1458a_100000191162_100000733263 [0,1,0,0,0,0|1,1,0]=3 1385 B15R1.83 CCCCSCC(=O)Cc1cccnn1 1458a_100000191162_100016990269 [0,1,0,0,0,0|2,1,0]=4 1386 B15R1.83 CCCCSCC(=O)Cc1ccncc1 1458a_100000191162_100000705612 [0,1,0,0,0,0|1,1,0]=3 1387 B15R1.83 CCCCSCC(=O)Cc1cnccn1 1458a_100000191162_100016995436 [0,1,0,0,0,0|2,1,0]=4 1388 B15R1.83 CCCCSCC(=O)Cc1cncnc1 1458a_100000191162_100015196519 [0,1,0,0,0,0|2,1,0]=4 1389 B15R1.83 CCCCSCC(=O)Cc1ncccn1 1458a_100000191162_100000703007 [0,1,0,0,0,0|2,1,0]=4 1390 B15R1.83 CCCCSCC(=O)Nc1ccccc1 11a_100000106764_100000191162 [0,1,0,0,0,0|1,1,0]=3 1391 B15R1.83 CCCCSCC(=O)Nc1ccccc1 1626a_100000106764_100000191162 [0,1,0,0,0,0|1,1,0]=3 1392 B15R1.83 CCCCSCC(=O)Nc1ccccc1 22a_100000106764_100000191162 [0,1,0,0,0,0|1,1,0]=3 1393 B15R1.83 CCCCSCC(=O)Nc1ccccc1 527a_100000106764_100000191162 [0,1,0,0,0,0|1,1,0]=3 1394 B15R1.83 CCCCSCC(=O)Nc1ccccc1 62a_100000210211_100000182850 [0,1,0,0,0,0|1,1,0]=3 1395 B15R1.83 CCCCSCC(=O)Nc1ccccc1 62a_100012148978_100000210210 [0,1,0,0,0,0|1,1,0]=3 1396 B15R1.83 CCCCSCC(=O)Nc1ccccn1 62a_100000210211_100020662008 [0,1,0,0,0,0|2,1,0]=4 1397 B15R1.83 CCCCSCC(=O)Nc1ccccn1 62a_100020662008_100000210210 [0,1,0,0,0,0|2,1,0]=4 1398 B15R1.83 CCCCSCC(=O)Nc1ccncc1 62a_100000210211_100000754145 [0,1,0,0,0,0|2,1,0]=4 1399 B15R1.83 CCCCSCC(=O)Oc1ccccc1 62a_100000210211_100009813826 [0,1,0,0,0,0|1,1,0]=3 1400 B15R1.83 CCCCSCC(=O)Oc1ccccc1 62a_100009813826_100000210210 [0,1,0,0,0,0|1,1,0]=3 1401 B15R1.83 CCCCSC[C@@H](O)Cc1ccccc1 62a_100000210211_100000729385 [0,1,0,0,0,0|0,1,2]=4 1402 B15R1.83 CCCCSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000210210 [0,1,0,0,0,0|0,1,2]=4 1403 B15R1.83 CCCNCCC(=O)Nc1cccnc1 34a_100000748795_100000210303 [0,1,0,0,0,0|3,0,0]=4 1404 B15R1.83 CCCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215938 [0,1,0,0,0,0|2,0,0]=3 1405 B15R1.83 CCCOCCC(=O)Cc1ccccn1 1458a_100000233486_100011215938 [0,1,0,0,0,0|2,0,0]=3 1406 B15R1.83 CCCOCCC(=O)Cc1cccnc1 1458a_100000737805_100011215938 [0,1,0,0,0,0|2,0,0]=3 1407 B15R1.83 CCCOCCC(=O)Cc1cncnc1 1458a_100000721575_100011215938 [0,1,0,0,0,0|3,0,0]=4 1408 B15R1.83 CCCOCCC(=O)Nc1ccccc1 34a_100000210258_100000242058 [0,1,0,0,0,0|2,0,0]=3 1409 B15R1.83 CCCOCCN(C)Cc1ccccc1 2230a_100000186898_100011215938 [0,1,0,0,0,0|3,0,0]=4 1410 B15R1.83 CCCOCCN(C)Cc1ccccc1 269982a_100000186898_100011215938 [0,1,0,0,0,0|3,0,0]=4 1411 B15R1.83 CCCOCCN(C)Cc1ccccc1 34a_100000210258_100015196923 [0,1,0,0,0,0|3,0,0]=4 1412 B15R1.83 CCCSCCC(=O)Nc1ccccc1 62a_100000210303_100000242058 [0,1,0,0,0,0|2,0,0]=3 1413 B15R1.83 CCCSCCC(=O)Nc1cccnc1 62a_100000210303_200015187043 [0,1,0,0,0,0|3,0,0]=4 1414 B15R1.83 CCCSCCC(=O)Oc1ccccc1 62a_100000210303_200000035796 [0,1,0,0,0,0|2,0,0]=3 1415 B15R1.83 CCCSCCN(C)Cc1ccccc1 62a_100000210303_100015196923 [0,1,0,0,0,0|3,0,0]=4 1416 B15R1.83 CCNCCCC(=O)Nc1ccccc1 2230a_100015525214_100011194425 [0,1,0,0,0,0|2,0,0]=3 1417 B15R1.83 CCNCCCC(=O)Nc1ccccc1 34a_100000750157_100000210202 [0,1,0,0,0,0|2,0,0]=3 1418 B15R1.83 CCOCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100012232248 [0,1,0,0,0,0|2,0,0]=3 1419 B15R1.83 CCOCCCC(=O)Cc1ccccn1 1458a_100000233486_100012232248 [0,1,0,0,0,0|2,0,0]=3 1420 B15R1.83 CCOCCCC(=O)Cc1cccnc1 1458a_100000737805_100012232248 [0,1,0,0,0,0|2,0,0]=3 1421 B15R1.83 CCOCCCC(=O)Cc1cncnc1 1458a_100000721575_100012232248 [0,1,0,0,0,0|3,0,0]=4 1422 B15R1.83 CCOCCCC(=O)Nc1ccccc1 34a_100121572206_100011194425 [0,1,0,0,0,0|2,0,0]=3 1423 B15R1.83 CCOCCCN(C)Cc1ccccc1 2230a_100000186898_100012232248 [0,1,0,0,0,0|3,0,0]=4 1424 B15R1.83 CCOCCCN(C)Cc1ccccc1 269982a_100000186898_100012232248 [0,1,0,0,0,0|3,0,0]=4 1425 B15R1.83 CCOCCNC(=O)C[n+]1ccccc1 11a_100011200944_200000086051 [0,1,0,0,0,0|2,0,0]=3 1426 B15R1.83 CCOCCNC(=O)C[n+]1ccccc1 240690a_100011200944_200000086051 [0,1,0,0,0,0|2,0,0]=3 1427 B15R1.83 CCOCCNC(=O)C[n+]1ccccc1 527a_100011200944_200000086051 [0,1,0,0,0,0|2,0,0]=3 1428 B15R1.83 CCOCCNC(=O)Cc1ccccn1 11a_100011200944_100000233486 [0,1,0,0,0,0|2,0,0]=3 1429 B15R1.83 CCOCCNC(=O)Cc1cccnc1 11a_100011200944_100000737805 [0,1,0,0,0,0|2,0,0]=3 1430 B15R1.83 CCOCCNC(=O)Cc1cccnc1 240690a_100011200944_100000737805 [0,1,0,0,0,0|2,0,0]=3 1431 B15R1.83 CCOCCNC(=O)Cc1cccnc1 527a_100011200944_100000737805 [0,1,0,0,0,0|2,0,0]=3 1432 B15R1.83 CCOCCNC(=O)Cc1ccncc1 11a_100011200944_100011201483 [0,1,0,0,0,0|2,0,0]=3 1433 B15R1.83 CCOCCNC(=O)Cc1ccncc1 240690a_100011200944_100011201483 [0,1,0,0,0,0|2,0,0]=3 1434 B15R1.83 CCOCCNC(=O)Cc1cnccn1 11a_100011200944_100000726051 [0,1,0,0,0,0|3,0,0]=4 1435 B15R1.83 CCOCCNC(=O)Cc1cnccn1 240690a_100011200944_100000726051 [0,1,0,0,0,0|3,0,0]=4 1436 B15R1.83 CCOCCNC(=O)Cc1cnccn1 527a_100011200944_100000726051 [0,1,0,0,0,0|3,0,0]=4 1437 B15R1.83 CCOCCNC(=O)Cc1cncnc1 11a_100011200944_100000721575 [0,1,0,0,0,0|3,0,0]=4 1438 B15R1.83 CCOCCNC(=O)Cc1cncnc1 240690a_100011200944_100000721575 [0,1,0,0,0,0|3,0,0]=4 1439 B15R1.83 CCOCCNC(=O)Cc1cncnc1 527a_100011200944_100000721575 [0,1,0,0,0,0|3,0,0]=4 1440 B15R1.83 CCOCCNC(=O)Nc1ccccc1 2430a_100000106764_100011200944 [0,1,0,0,0,0|2,0,0]=3 1441 B15R1.83 CCOCCNC(C)Cc1ccccc1 34a_102516460346_200011218536 [0,1,0,0,0,0|2,0,1]=4 1442 B15R1.83 CCOCCOC(C)Cc1ccccc1 34a_100000210136_200011218536 [0,1,0,0,0,0|1,0,1]=3 1443 B15R1.83 CCOCCOC(C)Cc1ccccc1 34a_100000748627_100000210147 [0,1,0,0,0,0|1,0,1]=3 1444 B15R1.83 CCOCCOC(C)Cc1ccccc1 7a_100000210136_200011218536 [0,1,0,0,0,0|1,0,1]=3 1445 B15R1.83 CCOCCOC(C)Cc1ccccc1 7a_100000748627_100011215890 [0,1,0,0,0,0|1,0,1]=3 1446 B15R1.83 CCOCCSC(C)Cc1ccccc1 62a_100000210147_200011218536 [0,1,0,0,0,0|1,1,1]=4 1447 B15R1.83 CCOCCSC(C)Cc1ccccc1 62a_200011218536_100011215890 [0,1,0,0,0,0|1,1,1]=4 1448 B15R1.83 CCOCSCC(=O)Cc1ccccc1 62a_100000233483_100000739092 [0,1,0,0,0,0|1,1,0]=3 1449 B15R1.83 CCOCSCC(=O)Cc1ccccc1 62a_100000739092_100000233483 [0,1,0,0,0,0|1,1,0]=3 1450 B15R1.83 CCOCSCC(=O)Nc1ccccc1 62a_100000739092_100000182850 [0,1,0,0,0,0|2,1,0]=4 1451 B15R1.83 CCOCSCC(=O)Nc1ccccc1 62a_100012148978_100000739092 [0,1,0,0,0,0|2,1,0]=4 1452 B15R1.83 CCOCSCC(=O)Oc1ccccc1 62a_100000739092_100009813826 [0,1,0,0,0,0|2,1,0]=4 1453 B15R1.83 CCOCSCC(=O)Oc1ccccc1 62a_100009813826_100000739092 [0,1,0,0,0,0|2,1,0]=4 1454 B15R1.83 CCSCCCC(=O)Nc1ccccc1 62a_100000210202_100011194425 [0,1,0,0,0,0|2,0,0]=3 1455 B15R1.83 CCSCCNC(=O)C[n+]1ccccc1 11a_100000106463_200000086051 [0,1,0,0,0,0|2,0,0]=3 1456 B15R1.83 CCSCCNC(=O)C[n+]1ccccc1 240690a_100000106463_200000086051 [0,1,0,0,0,0|2,0,0]=3 1457 B15R1.83 CCSCCNC(=O)C[n+]1ccccc1 527a_100000106463_200000086051 [0,1,0,0,0,0|2,0,0]=3 1458 B15R1.83 CCSCCNC(=O)Cc1ccccn1 11a_100000106463_100000233486 [0,1,0,0,0,0|2,0,0]=3 1459 B15R1.83 CCSCCNC(=O)Cc1cccnc1 11a_100000106463_100000737805 [0,1,0,0,0,0|2,0,0]=3 1460 B15R1.83 CCSCCNC(=O)Cc1cccnc1 240690a_100000106463_100000737805 [0,1,0,0,0,0|2,0,0]=3 1461 B15R1.83 CCSCCNC(=O)Cc1cccnc1 527a_100000106463_100000737805 [0,1,0,0,0,0|2,0,0]=3 1462 B15R1.83 CCSCCNC(=O)Cc1ccncc1 11a_100000106463_100011201483 [0,1,0,0,0,0|2,0,0]=3 1463 B15R1.83 CCSCCNC(=O)Cc1ccncc1 240690a_100000106463_100011201483 [0,1,0,0,0,0|2,0,0]=3 1464 B15R1.83 CCSCCNC(=O)Cc1cnccn1 11a_100000106463_100000726051 [0,1,0,0,0,0|3,0,0]=4 1465 B15R1.83 CCSCCNC(=O)Cc1cnccn1 240690a_100000106463_100000726051 [0,1,0,0,0,0|3,0,0]=4 1466 B15R1.83 CCSCCNC(=O)Cc1cnccn1 527a_100000106463_100000726051 [0,1,0,0,0,0|3,0,0]=4 1467 B15R1.83 CCSCCNC(=O)Cc1cncnc1 11a_100000106463_100000721575 [0,1,0,0,0,0|3,0,0]=4 1468 B15R1.83 CCSCCNC(=O)Cc1cncnc1 240690a_100000106463_100000721575 [0,1,0,0,0,0|3,0,0]=4 1469 B15R1.83 CCSCCNC(=O)Cc1cncnc1 527a_100000106463_100000721575 [0,1,0,0,0,0|3,0,0]=4 1470 B15R1.83 CCSCCNC(=O)Nc1ccccc1 2430a_100000106764_100000106463 [0,1,0,0,0,0|2,0,0]=3 1471 B15R1.83 CCSCCOC(C)Cc1ccccc1 34a_100000212035_200011218536 [0,1,0,0,0,0|1,0,1]=3 1472 B15R1.83 CCSCCOC(C)Cc1ccccc1 34a_100000748627_100000757381 [0,1,0,0,0,0|1,0,1]=3 1473 B15R1.83 CCSCCOC(C)Cc1ccccc1 7a_100000212035_200011218536 [0,1,0,0,0,0|1,0,1]=3 1474 B15R1.83 CCSCCOC(C)Cc1ccccc1 7a_100000748627_100000757381 [0,1,0,0,0,0|1,0,1]=3 1475 B15R1.83 CCSCCSC(C)Cc1ccccc1 62a_100000757381_200011218536 [0,1,0,0,0,0|1,1,1]=4 1476 B15R1.83 CCSCCSC(C)Cc1ccccc1 62a_200011218536_100000757381 [0,1,0,0,0,0|1,1,1]=4 1477 B15R1.83 CN(CCCCCF)Cc1ccccc1 2230a_100000186898_100000729378 [0,1,0,0,0,0|3,0,0]=4 1478 B15R1.83 CN(CCCCCF)Cc1ccccc1 269982a_100000186898_100000729378 [0,1,0,0,0,0|3,0,0]=4 1479 B15R1.83 CN(CCCCCO)Cc1ccccc1 2230a_100000186898_100000746330 [0,1,0,0,0,0|3,0,0]=4 1480 B15R1.83 CN(CCCCCO)Cc1ccccc1 2230a_100000722520_100015291786 [0,1,0,0,0,0|3,0,0]=4 1481 B15R1.83 CN(CCCCCO)Cc1ccccc1 2230a_100011629535_200000210301 [0,1,0,0,0,0|3,0,0]=4 1482 B15R1.83 CN(CCCCCO)Cc1ccccc1 269982a_100000186898_100000746330 [0,1,0,0,0,0|3,0,0]=4 1483 B15R1.83 CN(CCCCCO)Cc1ccccc1 269982a_100000722520_100000211182 [0,1,0,0,0,0|3,0,0]=4 1484 B15R1.83 CN(CCCCCO)Cc1ccccc1 269982a_100011629535_200000210301 [0,1,0,0,0,0|3,0,0]=4 1485 B15R1.83 CN(CCCCCO)Cc1ccccc1 270004a_100000722520_100015611070 [0,1,0,0,0,0|3,0,0]=4 1486 B15R1.83 CN(CCCCCO)Cc1ccccc1 34a_100011629535_200000210301 [0,1,0,0,0,0|3,0,0]=4 1487 B15R1.83 CNCCCOC(C)Cc1ccccc1 34a_100000213112_200011218536 [0,1,0,0,0,0|1,0,1]=3 1488 B15R1.83 COCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000755781 [0,1,0,0,0,0|2,0,0]=3 1489 B15R1.83 COCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000755781 [0,1,0,0,0,0|2,0,0]=3 1490 B15R1.83 COCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000755781 [0,1,0,0,0,0|2,0,0]=3 1491 B15R1.83 COCCCCC(=O)Cc1cncnc1 1458a_100000721575_100000755781 [0,1,0,0,0,0|3,0,0]=4 1492 B15R1.83 COCCCCN(C)Cc1ccccc1 2230a_100000186898_100000730899 [0,1,0,0,0,0|3,0,0]=4 1493 B15R1.83 COCCCCN(C)Cc1ccccc1 269982a_100000186898_100000730899 [0,1,0,0,0,0|3,0,0]=4 1494 B15R1.83 COCCCNC(=O)C[n+]1ccccc1 240690a_100150723488_200000086051 [0,1,0,0,0,0|2,0,0]=3 1495 B15R1.83 COCCCNC(=O)C[n+]1ccccc1 527a_100150723488_200000086051 [0,1,0,0,0,0|2,0,0]=3 1496 B15R1.83 COCCCNC(=O)Cc1cccnc1 240690a_100150723488_100000737805 [0,1,0,0,0,0|2,0,0]=3 1497 B15R1.83 COCCCNC(=O)Cc1cccnc1 527a_100150723488_100000737805 [0,1,0,0,0,0|2,0,0]=3 1498 B15R1.83 COCCCNC(=O)Cc1ccncc1 240690a_100150723488_100011201483 [0,1,0,0,0,0|2,0,0]=3 1499 B15R1.83 COCCCNC(=O)Cc1cnccn1 240690a_100150723488_100000726051 [0,1,0,0,0,0|3,0,0]=4 1500 B15R1.83 COCCCNC(=O)Cc1cnccn1 527a_100150723488_100000726051 [0,1,0,0,0,0|3,0,0]=4 1501 B15R1.83 COCCCNC(=O)Cc1cncnc1 240690a_100150723488_100000721575 [0,1,0,0,0,0|3,0,0]=4 1502 B15R1.83 COCCCNC(=O)Cc1cncnc1 527a_100150723488_100000721575 [0,1,0,0,0,0|3,0,0]=4 1503 B15R1.83 COCCCNC(=O)Nc1ccccc1 2430a_100000106764_100150723488 [0,1,0,0,0,0|2,0,0]=3 1504 B15R1.83 COCCCNC(C)Cc1ccccc1 34a_100150723488_200011218536 [0,1,0,0,0,0|2,0,1]=4 1505 B15R1.83 COCCCOC(C)Cc1ccccc1 34a_100000740835_200011218536 [0,1,0,0,0,0|1,0,1]=3 1506 B15R1.83 COCCCOC(C)Cc1ccccc1 34a_100000748627_100000740836 [0,1,0,0,0,0|1,0,1]=3 1507 B15R1.83 COCCCOC(C)Cc1ccccc1 7a_100000748627_100000740836 [0,1,0,0,0,0|1,0,1]=3 1508 B15R1.83 COCCCSC(C)Cc1ccccc1 62a_100000709357_200011218536 [0,1,0,0,0,0|1,1,1]=4 1509 B15R1.83 COCCCSC(C)Cc1ccccc1 62a_200011218536_100000709357 [0,1,0,0,0,0|1,1,1]=4 1510 B15R1.83 COCCNCC(=O)Cc1ccccc1 2230a_100000209980_100000233483 [0,1,0,0,0,0|2,0,0]=3 1511 B15R1.83 COCCNCC(=O)Nc1ccccc1 2230a_100000209980_100000182850 [0,1,0,0,0,0|3,0,0]=4 1512 B15R1.83 COCCNCC(=O)Oc1ccccc1 2230a_100000209980_100009813826 [0,1,0,0,0,0|3,0,0]=4 1513 B15R1.83 COCCNNC(=O)C[n+]1ccccc1 22a_100000741390_200000086051 [0,1,0,0,0,0|3,0,0]=4 1514 B15R1.83 COCCNNC(=O)Cc1ccccn1 22a_100000741390_100000233486 [0,1,0,0,0,0|3,0,0]=4 1515 B15R1.83 COCCNNC(=O)Cc1cccnc1 22a_100000741390_100000737805 [0,1,0,0,0,0|3,0,0]=4 1516 B15R1.83 COCCNNC(=O)Cc1ccncc1 22a_100000741390_100011201483 [0,1,0,0,0,0|3,0,0]=4 1517 B15R1.83 COCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100011201679 [0,1,0,0,0,0|2,0,1]=4 1518 B15R1.83 COCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000233755 [0,1,0,0,0,0|2,0,1]=4 1519 B15R1.83 COCCOCC(=O)Cc1ccccc1 1458a_100000211095_100015291786 [0,1,0,0,0,0|1,0,0]=2 1520 B15R1.83 COCCOCC(=O)Cc1ccccn1 1458a_100000211095_100000721315 [0,1,0,0,0,0|2,0,0]=3 1521 B15R1.83 COCCOCC(=O)Cc1cccnc1 1458a_100000211095_100000733263 [0,1,0,0,0,0|2,0,0]=3 1522 B15R1.83 COCCOCC(=O)Cc1cccnn1 1458a_100000211095_100016990269 [0,1,0,0,0,0|3,0,0]=4 1523 B15R1.83 COCCOCC(=O)Cc1ccncc1 1458a_100000211095_100000705612 [0,1,0,0,0,0|2,0,0]=3 1524 B15R1.83 COCCOCC(=O)Cc1cnccn1 1458a_100000211095_100016995436 [0,1,0,0,0,0|3,0,0]=4 1525 B15R1.83 COCCOCC(=O)Cc1cncnc1 1458a_100000211095_100015196519 [0,1,0,0,0,0|3,0,0]=4 1526 B15R1.83 COCCOCC(=O)Cc1ncccn1 1458a_100000211095_100000703007 [0,1,0,0,0,0|3,0,0]=4 1527 B15R1.83 COCCOCC(=O)Nc1ccccc1 11a_100000106764_100000211095 [0,1,0,0,0,0|2,0,0]=3 1528 B15R1.83 COCCOCC(=O)Nc1ccccc1 1626a_100000106764_100000211095 [0,1,0,0,0,0|2,0,0]=3 1529 B15R1.83 COCCOCC(=O)Nc1ccccc1 22a_100000106764_100000211095 [0,1,0,0,0,0|2,0,0]=3 1530 B15R1.83 COCCOCC(=O)Nc1ccccc1 34a_100000210237_100000182850 [0,1,0,0,0,0|2,0,0]=3 1531 B15R1.83 COCCOCC(=O)Nc1ccccc1 34a_100000246334_100011201679 [0,1,0,0,0,0|2,0,0]=3 1532 B15R1.83 COCCOCC(=O)Nc1ccccc1 527a_100000106764_100000211095 [0,1,0,0,0,0|2,0,0]=3 1533 B15R1.83 COCCOCC(=O)Oc1ccccc1 34a_100000210237_100009813826 [0,1,0,0,0,0|2,0,0]=3 1534 B15R1.83 COCCOCC(C)Cc1ccccc1 34a_100012125295_100011201679 [0,1,0,0,0,0|2,0,1]=4 1535 B15R1.83 COCCOCC(C)Cc1ccccc1 7a_100012125295_100000233755 [0,1,0,0,0,0|2,0,1]=4 1536 B15R1.83 COCCOCC(N)Cc1ccccc1 34a_100000739027_100011201679 [0,1,0,0,0,0|2,0,1]=4 1537 B15R1.83 COCCOCN(C)Cc1ccccc1 2230a_100000186898_100000231047 [0,1,0,0,0,0|3,0,0]=4 1538 B15R1.83 COCCOCN(C)Cc1ccccc1 269982a_100000186898_100000231047 [0,1,0,0,0,0|3,0,0]=4 1539 B15R1.83 COCCOC[C@@H](O)Cc1ccccc1 34a_100000210237_100000729385 [0,1,0,0,0,0|1,0,2]=4 1540 B15R1.83 COCCSCC(=O)Cc1ccccc1 62a_100000233483_100000233755 [0,1,0,0,0,0|1,1,0]=3 1541 B15R1.83 COCCSCC(=O)Cc1ccccc1 62a_100000233755_100000233483 [0,1,0,0,0,0|1,1,0]=3 1542 B15R1.83 COCCSCC(=O)Nc1ccccc1 62a_100000233755_100000182850 [0,1,0,0,0,0|2,1,0]=4 1543 B15R1.83 COCCSCC(=O)Nc1ccccc1 62a_100012148978_100000233755 [0,1,0,0,0,0|2,1,0]=4 1544 B15R1.83 COCCSCC(=O)Oc1ccccc1 62a_100000233755_100009813826 [0,1,0,0,0,0|2,1,0]=4 1545 B15R1.83 COCCSCC(=O)Oc1ccccc1 62a_100009813826_100000233755 [0,1,0,0,0,0|2,1,0]=4 1546 B15R1.83 COCSCCC(=O)Nc1ccccc1 62a_100000766300_100000242058 [0,1,0,0,0,0|3,0,0]=4 1547 B15R1.83 COCSCCC(=O)Oc1ccccc1 62a_100000766300_200000035796 [0,1,0,0,0,0|3,0,0]=4 1548 B15R1.83 CSCCCNC(=O)C[n+]1ccccc1 11a_100000749238_200000086051 [0,1,0,0,0,0|2,0,0]=3 1549 B15R1.83 CSCCCNC(=O)C[n+]1ccccc1 240690a_100000749238_200000086051 [0,1,0,0,0,0|2,0,0]=3 1550 B15R1.83 CSCCCNC(=O)C[n+]1ccccc1 527a_100000749238_200000086051 [0,1,0,0,0,0|2,0,0]=3 1551 B15R1.83 CSCCCNC(=O)Cc1ccccn1 11a_100000749238_100000233486 [0,1,0,0,0,0|2,0,0]=3 1552 B15R1.83 CSCCCNC(=O)Cc1cccnc1 11a_100000749238_100000737805 [0,1,0,0,0,0|2,0,0]=3 1553 B15R1.83 CSCCCNC(=O)Cc1cccnc1 240690a_100000749238_100000737805 [0,1,0,0,0,0|2,0,0]=3 1554 B15R1.83 CSCCCNC(=O)Cc1cccnc1 527a_100000749238_100000737805 [0,1,0,0,0,0|2,0,0]=3 1555 B15R1.83 CSCCCNC(=O)Cc1ccncc1 11a_100000749238_100011201483 [0,1,0,0,0,0|2,0,0]=3 1556 B15R1.83 CSCCCNC(=O)Cc1ccncc1 240690a_100000749238_100011201483 [0,1,0,0,0,0|2,0,0]=3 1557 B15R1.83 CSCCCNC(=O)Cc1cnccn1 11a_100000749238_100000726051 [0,1,0,0,0,0|3,0,0]=4 1558 B15R1.83 CSCCCNC(=O)Cc1cnccn1 240690a_100000749238_100000726051 [0,1,0,0,0,0|3,0,0]=4 1559 B15R1.83 CSCCCNC(=O)Cc1cnccn1 527a_100000749238_100000726051 [0,1,0,0,0,0|3,0,0]=4 1560 B15R1.83 CSCCCNC(=O)Cc1cncnc1 11a_100000749238_100000721575 [0,1,0,0,0,0|3,0,0]=4 1561 B15R1.83 CSCCCNC(=O)Cc1cncnc1 240690a_100000749238_100000721575 [0,1,0,0,0,0|3,0,0]=4 1562 B15R1.83 CSCCCNC(=O)Cc1cncnc1 527a_100000749238_100000721575 [0,1,0,0,0,0|3,0,0]=4 1563 B15R1.83 CSCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000749238 [0,1,0,0,0,0|2,0,0]=3 1564 B15R1.83 CSCCCOC(C)Cc1ccccc1 34a_100000690336_200011218536 [0,1,0,0,0,0|1,0,1]=3 1565 B15R1.83 CSCCCOC(C)Cc1ccccc1 7a_100000690336_200011218536 [0,1,0,0,0,0|1,0,1]=3 1566 B15R1.83 CSCCNCC(=O)Cc1ccccc1 2230a_100020590264_100000233483 [0,1,0,0,0,0|2,0,0]=3 1567 B15R1.83 CSCCNCC(=O)Nc1ccccc1 2230a_100020590264_100000182850 [0,1,0,0,0,0|3,0,0]=4 1568 B15R1.83 CSCCNCC(=O)Oc1ccccc1 2230a_100020590264_100009813826 [0,1,0,0,0,0|3,0,0]=4 1569 B15R1.83 CSCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000212216 [0,1,0,0,0,0|2,0,1]=4 1570 B15R1.83 CSCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000212216 [0,1,0,0,0,0|2,0,1]=4 1571 B15R1.83 CSCCOCC(=O)Cc1ccccc1 7a_100000230434_100000233483 [0,1,0,0,0,0|1,0,0]=2 1572 B15R1.83 CSCCOCC(=O)Nc1ccccc1 34a_100000230434_100000182850 [0,1,0,0,0,0|2,0,0]=3 1573 B15R1.83 CSCCOCC(=O)Nc1ccccc1 34a_100000246334_100000212216 [0,1,0,0,0,0|2,0,0]=3 1574 B15R1.83 CSCCOCC(=O)Nc1ccccc1 7a_100000230434_100000182850 [0,1,0,0,0,0|2,0,0]=3 1575 B15R1.83 CSCCOCC(=O)Nc1ccccn1 7a_100000230434_100020662008 [0,1,0,0,0,0|3,0,0]=4 1576 B15R1.83 CSCCOCC(=O)Nc1ccncc1 7a_100000230434_100000754145 [0,1,0,0,0,0|3,0,0]=4 1577 B15R1.83 CSCCOCC(=O)Oc1ccccc1 34a_100000230434_100009813826 [0,1,0,0,0,0|2,0,0]=3 1578 B15R1.83 CSCCOCC(=O)Oc1ccccc1 7a_100000230434_100009813826 [0,1,0,0,0,0|2,0,0]=3 1579 B15R1.83 CSCCOCC(C)Cc1ccccc1 34a_100012125295_100000212216 [0,1,0,0,0,0|2,0,1]=4 1580 B15R1.83 CSCCOCC(C)Cc1ccccc1 7a_100012125295_100000212216 [0,1,0,0,0,0|2,0,1]=4 1581 B15R1.83 CSCCOCC(N)Cc1ccccc1 34a_100000739027_100000212216 [0,1,0,0,0,0|2,0,1]=4 1582 B15R1.83 CSCCOC[C@@H](O)Cc1ccccc1 34a_100000230434_100000729385 [0,1,0,0,0,0|1,0,2]=4 1583 B15R1.83 CSCCOC[C@@H](O)Cc1ccccc1 7a_100000230434_100000729385 [0,1,0,0,0,0|1,0,2]=4 1584 B15R1.83 CSCCSCC(=O)Cc1ccccc1 62a_100000212216_100000233483 [0,1,0,0,0,0|1,1,0]=3 1585 B15R1.83 CSCCSCC(=O)Cc1ccccc1 62a_100000233483_100000751147 [0,1,0,0,0,0|1,1,0]=3 1586 B15R1.83 CSCCSCC(=O)Nc1ccccc1 62a_100000212216_100000182850 [0,1,0,0,0,0|2,1,0]=4 1587 B15R1.83 CSCCSCC(=O)Nc1ccccc1 62a_100012148978_100000751147 [0,1,0,0,0,0|2,1,0]=4 1588 B15R1.83 CSCCSCC(=O)Oc1ccccc1 62a_100000212216_100009813826 [0,1,0,0,0,0|2,1,0]=4 1589 B15R1.83 CSCCSCC(=O)Oc1ccccc1 62a_100009813826_100000751147 [0,1,0,0,0,0|2,1,0]=4 1590 B15R1.83 CSCSCCC(=O)Nc1ccccc1 62a_100011218213_100000242058 [0,1,0,0,0,0|3,0,0]=4 1591 B15R1.83 CSCSCCC(=O)Oc1ccccc1 62a_100011218213_200000035796 [0,1,0,0,0,0|3,0,0]=4 1592 B15R1.83 N#CCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000211819 [0,1,0,0,0,0|2,0,1]=4 1593 B15R1.83 N#CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000211819 [0,1,0,0,0,0|2,0,1]=4 1594 B15R1.83 N#CCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000211819 [0,1,0,0,0,0|2,0,1]=4 1595 B15R1.83 N#CCCSCC(=O)Cc1ccccc1 62a_100000233483_100011215226 [0,1,0,0,0,0|1,1,1]=4 1596 B15R1.83 N#CCCSCC(=O)Cc1ccccc1 62a_100011215226_100000233483 [0,1,0,0,0,0|1,1,1]=4 1597 B15R1.83 NC(COCCCF)Cc1ccccc1 34a_100000739027_100011934791 [0,1,0,0,0,0|2,0,1]=4 1598 B15R1.83 NC(COCCCO)Cc1ccccc1 34a_100000739027_100000230001 [0,1,0,0,0,0|2,0,1]=4 1599 B15R1.83 NCCCOCC(=O)Nc1ccccc1 34a_100000182051_100000182850 [0,1,0,0,0,0|2,0,0]=3 1600 B15R1.83 NCCCOCC(=O)Oc1ccccc1 34a_100000182051_100009813826 [0,1,0,0,0,0|2,0,0]=3 1601 B15R1.83 NCCCOC[C@@H](O)Cc1ccccc1 34a_100000182051_100000729385 [0,1,0,0,0,0|1,0,2]=4 1602 B15R1.83 NCCOCCC(=O)Nc1ccccc1 34a_100000210304_100000242058 [0,1,0,0,0,0|3,0,0]=4 1603 B15R1.83 NOCCOCC(=O)Nc1ccccc1 34a_100000700252_100000182850 [0,1,0,0,0,0|3,0,0]=4 1604 B15R1.83 NOCCOCC(=O)Oc1ccccc1 34a_100000700252_100009813826 [0,1,0,0,0,0|3,0,0]=4 1605 B15R1.83 O=C(CCCCCF)C[n+]1ccccc1 1458a_200000086051_100000729378 [0,1,0,0,0,0|2,0,0]=3 1606 B15R1.83 O=C(CCCCCF)Cc1ccccn1 1458a_100000233486_100000729378 [0,1,0,0,0,0|2,0,0]=3 1607 B15R1.83 O=C(CCCCCF)Cc1cccnc1 1458a_100000737805_100000729378 [0,1,0,0,0,0|2,0,0]=3 1608 B15R1.83 O=C(CCCCCF)Cc1cncnc1 1458a_100000721575_100000729378 [0,1,0,0,0,0|3,0,0]=4 1609 B15R1.83 O=C(CCCCCO)C[n+]1ccccc1 1458a_200000086051_100000746330 [0,1,0,0,0,0|2,0,0]=3 1610 B15R1.83 O=C(CCCCCO)Cc1ccccc1 1458a_100102619762_100015291786 [0,1,0,0,0,0|1,0,0]=2 1611 B15R1.83 O=C(CCCCCO)Cc1ccccn1 1458a_100000233486_100000746330 [0,1,0,0,0,0|2,0,0]=3 1612 B15R1.83 O=C(CCCCCO)Cc1ccccn1 1458a_100102619762_100000721315 [0,1,0,0,0,0|2,0,0]=3 1613 B15R1.83 O=C(CCCCCO)Cc1cccnc1 1458a_100000737805_100000746330 [0,1,0,0,0,0|2,0,0]=3 1614 B15R1.83 O=C(CCCCCO)Cc1cccnc1 1458a_100102619762_100000733263 [0,1,0,0,0,0|2,0,0]=3 1615 B15R1.83 O=C(CCCCCO)Cc1cccnn1 1458a_100102619762_100016990269 [0,1,0,0,0,0|3,0,0]=4 1616 B15R1.83 O=C(CCCCCO)Cc1ccncc1 1458a_100102619762_100000705612 [0,1,0,0,0,0|2,0,0]=3 1617 B15R1.83 O=C(CCCCCO)Cc1cnccn1 1458a_100102619762_100016995436 [0,1,0,0,0,0|3,0,0]=4 1618 B15R1.83 O=C(CCCCCO)Cc1cncnc1 1458a_100000721575_100000746330 [0,1,0,0,0,0|3,0,0]=4 1619 B15R1.83 O=C(CCCCCO)Cc1cncnc1 1458a_100102619762_100015196519 [0,1,0,0,0,0|3,0,0]=4 1620 B15R1.83 O=C(CCCCCO)Cc1ncccn1 1458a_100102619762_100000703007 [0,1,0,0,0,0|3,0,0]=4 1621 B15R1.83 O=C(CCCCCO)Nc1ccccc1 22a_100000106764_100102619762 [0,1,0,0,0,0|2,0,0]=3 1622 B15R1.83 O=C(CCCNCF)Nc1ccccc1 34a_100000750157_100015361967 [0,1,0,0,0,0|3,0,0]=4 1623 B15R1.83 O=C(CCCSCF)Nc1ccccc1 62a_100015361967_100011194425 [0,1,0,0,0,0|3,0,0]=4 1624 B15R1.83 O=C(CCNCCF)Nc1ccccc1 34a_100000724931_100000242058 [0,1,0,0,0,0|3,0,0]=4 1625 B15R1.83 O=C(CCNCCO)Nc1ccccc1 2230a_100016997473_100000242058 [0,1,0,0,0,0|3,0,0]=4 1626 B15R1.83 O=C(CCNCCO)Nc1ccccc1 34a_100016990907_100000242058 [0,1,0,0,0,0|3,0,0]=4 1627 B15R1.83 O=C(CCNCCO)Oc1ccccc1 2230a_100016997473_200000035796 [0,1,0,0,0,0|3,0,0]=4 1628 B15R1.83 O=C(CCOCCBr)Nc1ccccc1 34a_100000211926_100000242058 [0,1,0,0,0,0|3,0,0]=4 1629 B15R1.83 O=C(CCOCCO)C[n+]1ccccc1 1458a_200000086051_100011215305 [0,1,0,0,0,0|3,0,0]=4 1630 B15R1.83 O=C(CCOCCO)Cc1ccccc1 1458a_100011229844_100015291786 [0,1,0,0,0,0|2,0,0]=3 1631 B15R1.83 O=C(CCOCCO)Cc1ccccn1 1458a_100000233486_100011215305 [0,1,0,0,0,0|3,0,0]=4 1632 B15R1.83 O=C(CCOCCO)Cc1ccccn1 1458a_100011229844_100000721315 [0,1,0,0,0,0|3,0,0]=4 1633 B15R1.83 O=C(CCOCCO)Cc1cccnc1 1458a_100000737805_100011215305 [0,1,0,0,0,0|3,0,0]=4 1634 B15R1.83 O=C(CCOCCO)Cc1cccnc1 1458a_100011229844_100000733263 [0,1,0,0,0,0|3,0,0]=4 1635 B15R1.83 O=C(CCOCCO)Cc1ccncc1 1458a_100011229844_100000705612 [0,1,0,0,0,0|3,0,0]=4 1636 B15R1.83 O=C(CCOCCO)Nc1ccccc1 1626a_100000106764_100011229844 [0,1,0,0,0,0|3,0,0]=4 1637 B15R1.83 O=C(CCOCCO)Nc1ccccc1 22a_100000106764_100011229844 [0,1,0,0,0,0|3,0,0]=4 1638 B15R1.83 O=C(CCSCCF)Nc1ccccc1 62a_100011217306_100000242058 [0,1,0,0,0,0|3,0,0]=4 1639 B15R1.83 O=C(CCSCCF)Oc1ccccc1 62a_100011217306_200000035796 [0,1,0,0,0,0|3,0,0]=4 1640 B15R1.83 O=C(CCSCCO)Nc1ccccc1 62a_100000211926_100000242058 [0,1,0,0,0,0|3,0,0]=4 1641 B15R1.83 O=C(CCSCCO)Oc1ccccc1 62a_100000211926_200000035796 [0,1,0,0,0,0|3,0,0]=4 1642 B15R1.83 O=C(CNCCCF)Cc1ccccc1 2230a_100015189416_100000233483 [0,1,0,0,0,0|2,0,0]=3 1643 B15R1.83 O=C(CNCCCF)Nc1ccccc1 2230a_100015189416_100000182850 [0,1,0,0,0,0|3,0,0]=4 1644 B15R1.83 O=C(CNCCCF)Nc1ccccc1 34a_100015189416_100000182850 [0,1,0,0,0,0|3,0,0]=4 1645 B15R1.83 O=C(CNCCCF)Oc1ccccc1 2230a_100015189416_100009813826 [0,1,0,0,0,0|3,0,0]=4 1646 B15R1.83 O=C(CNCCCF)Oc1ccccc1 34a_100015189416_100009813826 [0,1,0,0,0,0|3,0,0]=4 1647 B15R1.83 O=C(COCCCBr)Nc1ccccc1 34a_100011217188_100000182850 [0,1,0,0,0,0|2,0,0]=3 1648 B15R1.83 O=C(COCCCBr)Oc1ccccc1 34a_100011217188_100009813826 [0,1,0,0,0,0|2,0,0]=3 1649 B15R1.83 O=C(COCCCCl)Nc1ccccc1 34a_100000230001_100000182850 [0,1,0,0,0,0|2,0,0]=3 1650 B15R1.83 O=C(COCCCCl)Oc1ccccc1 34a_100000230001_100009813826 [0,1,0,0,0,0|2,0,0]=3 1651 B15R1.83 O=C(COCCCF)Nc1ccccc1 34a_100000246334_100011934791 [0,1,0,0,0,0|2,0,0]=3 1652 B15R1.83 O=C(COCCCF)Nc1ccccc1 34a_100000759539_100000182850 [0,1,0,0,0,0|2,0,0]=3 1653 B15R1.83 O=C(COCCCF)Oc1ccccc1 34a_100000759539_100009813826 [0,1,0,0,0,0|2,0,0]=3 1654 B15R1.83 O=C(COCCCO)Nc1ccccc1 34a_100000246334_100000230001 [0,1,0,0,0,0|2,0,0]=3 1655 B15R1.83 O=C(CSCCCF)Cc1ccccc1 62a_100000233483_100011934791 [0,1,0,0,0,0|1,1,0]=3 1656 B15R1.83 O=C(CSCCCF)Cc1ccccc1 62a_100011934791_100000233483 [0,1,0,0,0,0|1,1,0]=3 1657 B15R1.83 O=C(CSCCCF)Nc1ccccc1 62a_100011934791_100000182850 [0,1,0,0,0,0|2,1,0]=4 1658 B15R1.83 O=C(CSCCCF)Nc1ccccc1 62a_100012148978_100011934791 [0,1,0,0,0,0|2,1,0]=4 1659 B15R1.83 O=C(CSCCCF)Oc1ccccc1 62a_100009813826_100011934791 [0,1,0,0,0,0|2,1,0]=4 1660 B15R1.83 O=C(CSCCCF)Oc1ccccc1 62a_100011934791_100009813826 [0,1,0,0,0,0|2,1,0]=4 1661 B15R1.83 O=C(CSCCCO)Cc1ccccc1 62a_100000233483_100011215043 [0,1,0,0,0,0|1,1,0]=3 1662 B15R1.83 O=C(CSCCCO)Cc1ccccc1 62a_100011215043_100000233483 [0,1,0,0,0,0|1,1,0]=3 1663 B15R1.83 O=C(CSCCCO)Nc1ccccc1 62a_100011215043_100000182850 [0,1,0,0,0,0|2,1,0]=4 1664 B15R1.83 O=C(CSCCCO)Nc1ccccc1 62a_100012148978_100011215043 [0,1,0,0,0,0|2,1,0]=4 1665 B15R1.83 O=C(CSCCCO)Oc1ccccc1 62a_100009813826_100011215043 [0,1,0,0,0,0|2,1,0]=4 1666 B15R1.83 O=C(CSCCCO)Oc1ccccc1 62a_100011215043_100009813826 [0,1,0,0,0,0|2,1,0]=4 1667 B15R1.83 O=C(C[n+]1ccccc1)NCCCCO 240690a_100000750430_200000086051 [0,1,0,0,0,0|2,0,0]=3 1668 B15R1.83 O=C(C[n+]1ccccc1)NCCCCO 527a_100000750430_200000086051 [0,1,0,0,0,0|2,0,0]=3 1669 B15R1.83 O=C(Cc1cccnc1)NCCCCO 240690a_100000750430_100000737805 [0,1,0,0,0,0|2,0,0]=3 1670 B15R1.83 O=C(Cc1cccnc1)NCCCCO 527a_100000750430_100000737805 [0,1,0,0,0,0|2,0,0]=3 1671 B15R1.83 O=C(Cc1ccncc1)NCCCCO 240690a_100000750430_100011201483 [0,1,0,0,0,0|2,0,0]=3 1672 B15R1.83 O=C(Cc1cnccn1)NCCCCO 240690a_100000750430_100000726051 [0,1,0,0,0,0|3,0,0]=4 1673 B15R1.83 O=C(Cc1cnccn1)NCCCCO 527a_100000750430_100000726051 [0,1,0,0,0,0|3,0,0]=4 1674 B15R1.83 O=C(Cc1cncnc1)NCCCCO 240690a_100000750430_100000721575 [0,1,0,0,0,0|3,0,0]=4 1675 B15R1.83 O=C(Cc1cncnc1)NCCCCO 527a_100000750430_100000721575 [0,1,0,0,0,0|3,0,0]=4 1676 B15R1.83 O=C(NCCCCO)Nc1ccccc1 2430a_100000106764_100000750430 [0,1,0,0,0,0|2,0,0]=3 1677 B15R1.83 O[C@H](COCCCBr)Cc1ccccc1 34a_100011217188_100000729385 [0,1,0,0,0,0|1,0,2]=4 1678 B15R1.83 O[C@H](COCCCCl)Cc1ccccc1 34a_100000230001_100000729385 [0,1,0,0,0,0|1,0,2]=4 1679 B15R1.83 O[C@H](COCCCF)Cc1ccccc1 34a_100000759539_100000729385 [0,1,0,0,0,0|1,0,2]=4 1680 B15R1.83 [13CH3]N(CCCCCO)Cc1ccccc1 2230a_100011629535_200025704644 [0,1,0,0,0,0|3,0,0]=4 1681 B15R1.83 [13CH3]N(CCCCCO)Cc1ccccc1 269982a_100011629535_200025704644 [0,1,0,0,0,0|3,0,0]=4 1682 B15R1.83 [13CH3]N(CCCCCO)Cc1ccccc1 34a_100011629535_200025704644 [0,1,0,0,0,0|3,0,0]=4 1683 B15R1.83 [N-]=[N+]=NCCCC(=O)Cc1ccccc1 1458a_100010262590_100015291786 [0,1,0,0,0,0|3,0,0]=4 1684 B15R1.93 C#CCCCC(=O)C(C)c1ccccc1 1458a_100000690238_100000230085 [0,1,0,0,0,0|1,0,2]=4 1685 B15R1.93 C#CCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000731252 [0,1,0,0,0,0|1,0,2]=4 1686 B15R1.93 C#CCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000731252 [0,1,0,0,0,0|1,0,2]=4 1687 B15R1.93 C#CCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000731252 [0,1,0,0,0,0|1,0,2]=4 1688 B15R1.93 C#CCCNC(=O)C(F)c1ccccc1 11a_100000755551_100000698975 [0,1,0,0,0,0|1,0,2]=4 1689 B15R1.93 C#CCCNC(=O)C(F)c1ccccc1 1626a_100000755551_100000698975 [0,1,0,0,0,0|1,0,2]=4 1690 B15R1.93 C#CCCNC(=O)C(F)c1ccccc1 240690a_100000755551_100000698975 [0,1,0,0,0,0|1,0,2]=4 1691 B15R1.93 C#CCCNC(=O)C(F)c1ccccc1 527a_100000755551_100000698975 [0,1,0,0,0,0|1,0,2]=4 1692 B15R1.93 C#CCCNC(=O)[C@@H](C)c1ccccc1 11a_100000755551_100000751047 [0,1,0,0,0,0|1,0,2]=4 1693 B15R1.93 C#CCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000755551_100000751047 [0,1,0,0,0,0|1,0,2]=4 1694 B15R1.93 C#CCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000755551_100000751047 [0,1,0,0,0,0|1,0,2]=4 1695 B15R1.93 C#CCCNC(=O)[C@@H](C)c1ccccc1 527a_100000755551_100000751047 [0,1,0,0,0,0|1,0,2]=4 1696 B15R1.93 C#CCCNC(=O)[C@H](O)c1ccccc1 240690a_100000755551_100000684486 [0,1,0,0,0,0|1,0,2]=4 1697 B15R1.93 C=C(C(=O)CCCCC)c1ccccc1 1458a_100000065200_100000210326 [0,1,0,0,0,0|1,0,1]=3 1698 B15R1.93 C=C(C(=O)CCCCF)c1ccccc1 1458a_100000065200_100000729493 [0,1,0,0,0,0|2,0,1]=4 1699 B15R1.93 C=C(C(=O)CCCCO)c1ccccc1 1458a_100000065200_100000210776 [0,1,0,0,0,0|2,0,1]=4 1700 B15R1.93 C=C(C(=O)CCCOC)c1ccccc1 1458a_100000065200_100000740836 [0,1,0,0,0,0|2,0,1]=4 1701 B15R1.93 C=C(C(=O)CCOCC)c1ccccc1 1458a_100000065200_100011215890 [0,1,0,0,0,0|2,0,1]=4 1702 B15R1.93 C=C(C(=O)CCSCC)c1ccccc1 1458a_100000065200_100000757381 [0,1,0,0,0,0|2,0,1]=4 1703 B15R1.93 C=C(C(=O)NCCCC)c1ccccc1 1626a_100000102301_100000065200 [0,1,0,0,0,0|1,0,1]=3 1704 B15R1.93 C=C(C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000065200 [0,1,0,0,0,0|2,0,1]=4 1705 B15R1.93 C=C(C(=O)NCCOC)c1ccccc1 1626a_100000209980_100000065200 [0,1,0,0,0,0|2,0,1]=4 1706 B15R1.93 C=C(C(=O)NCCSC)c1ccccc1 1626a_100020590264_100000065200 [0,1,0,0,0,0|2,0,1]=4 1707 B15R1.93 C=C(C(=O)NNCCC)c1ccccc1 22a_100000740057_100000065200 [0,1,0,0,0,0|2,0,1]=4 1708 B15R1.93 C=CCCCC(=O)C(C)c1ccccc1 1458a_100000766728_100000230085 [0,1,0,0,0,0|1,0,2]=4 1709 B15R1.93 C=CCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000757094 [0,1,0,0,0,0|1,0,2]=4 1710 B15R1.93 C=CCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000757094 [0,1,0,0,0,0|1,0,2]=4 1711 B15R1.93 C=CCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000757094 [0,1,0,0,0,0|1,0,2]=4 1712 B15R1.93 C=CCCNC(=O)C(F)c1ccccc1 11a_100015191253_100000698975 [0,1,0,0,0,0|1,0,2]=4 1713 B15R1.93 C=CCCNC(=O)C(F)c1ccccc1 1626a_100015191253_100000698975 [0,1,0,0,0,0|1,0,2]=4 1714 B15R1.93 C=CCCNC(=O)C(F)c1ccccc1 240690a_100015191253_100000698975 [0,1,0,0,0,0|1,0,2]=4 1715 B15R1.93 C=CCCNC(=O)C(F)c1ccccc1 527a_100015191253_100000698975 [0,1,0,0,0,0|1,0,2]=4 1716 B15R1.93 C=CCCNC(=O)[C@@H](C)c1ccccc1 11a_100015191253_100000751047 [0,1,0,0,0,0|1,0,2]=4 1717 B15R1.93 C=CCCNC(=O)[C@@H](C)c1ccccc1 1626a_100015191253_100000751047 [0,1,0,0,0,0|1,0,2]=4 1718 B15R1.93 C=CCCNC(=O)[C@@H](C)c1ccccc1 240690a_100015191253_100000751047 [0,1,0,0,0,0|1,0,2]=4 1719 B15R1.93 C=CCCNC(=O)[C@@H](C)c1ccccc1 527a_100015191253_100000751047 [0,1,0,0,0,0|1,0,2]=4 1720 B15R1.93 C=CCCNC(=O)[C@H](O)c1ccccc1 240690a_100015191253_100000684486 [0,1,0,0,0,0|1,0,2]=4 1721 B15R1.93 CC#CCNC(=O)C(F)c1ccccc1 11a_100000685387_100000698975 [0,1,0,0,0,0|1,0,2]=4 1722 B15R1.93 CC#CCNC(=O)C(F)c1ccccc1 1626a_100000685387_100000698975 [0,1,0,0,0,0|1,0,2]=4 1723 B15R1.93 CC#CCNC(=O)C(F)c1ccccc1 527a_100000685387_100000698975 [0,1,0,0,0,0|1,0,2]=4 1724 B15R1.93 CC#CCNC(=O)[C@@H](C)c1ccccc1 11a_100000685387_100000751047 [0,1,0,0,0,0|1,0,2]=4 1725 B15R1.93 CC#CCNC(=O)[C@@H](C)c1ccccc1 1626a_100000685387_100000751047 [0,1,0,0,0,0|1,0,2]=4 1726 B15R1.93 CC#CCNC(=O)[C@@H](C)c1ccccc1 527a_100000685387_100000751047 [0,1,0,0,0,0|1,0,2]=4 1727 B15R1.93 CC(C(=O)CCCC#N)c1ccccc1 1458a_100000075515_100000230085 [0,1,0,0,0,0|2,0,1]=4 1728 B15R1.93 CC(C(=O)CCCCF)c1ccccn1 1458a_100000722050_100000729493 [0,1,0,0,0,0|3,0,0]=4 1729 B15R1.93 CC(C(=O)CCCCO)c1ccccc1 1458a_100000695505_100000230085 [0,1,0,0,0,0|2,0,0]=3 1730 B15R1.93 CC(C(=O)CCCCO)c1ccccn1 1458a_100000722050_100000210776 [0,1,0,0,0,0|3,0,0]=4 1731 B15R1.93 CC(C(=O)COCCO)c1ccccc1 1458a_100000708028_100000230085 [0,1,0,0,0,0|3,0,0]=4 1732 B15R1.93 CC(C(=O)NCCCF)c1ccccn1 11a_100015189416_100000722050 [0,1,0,0,0,0|3,0,0]=4 1733 B15R1.93 CC(C(=O)NCCCF)c1ccccn1 1626a_100015189416_100000722050 [0,1,0,0,0,0|3,0,0]=4 1734 B15R1.93 CC(C(=O)NCCCF)c1ccccn1 240690a_100015189416_100000722050 [0,1,0,0,0,0|3,0,0]=4 1735 B15R1.93 CC(C(=O)NCCCF)c1ccccn1 527a_100015189416_100000722050 [0,1,0,0,0,0|3,0,0]=4 1736 B15R1.93 CC(C(=O)NCCCO)c1ccccn1 240690a_100000182051_100000722050 [0,1,0,0,0,0|3,0,0]=4 1737 B15R1.93 CC(C(=O)NCCCO)c1ccccn1 527a_100000182051_100000722050 [0,1,0,0,0,0|3,0,0]=4 1738 B15R1.93 CC/C=C/CC(=O)C(C)c1ccccc1 1458a_100016274230_100000230085 [0,1,0,0,0,0|1,0,2]=4 1739 B15R1.93 CC/C=C\CC(=O)C(F)c1ccccc1 1458a_100000698975_100103147603 [0,1,0,0,0,0|1,0,2]=4 1740 B15R1.93 CC/C=C\CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100103147603 [0,1,0,0,0,0|1,0,2]=4 1741 B15R1.93 CC/C=C\CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100103147603 [0,1,0,0,0,0|1,0,2]=4 1742 B15R1.93 CCC#CCC(=O)C(F)c1ccccc1 1458a_100000698975_100009813939 [0,1,0,0,0,0|1,0,2]=4 1743 B15R1.93 CCC#CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100009813939 [0,1,0,0,0,0|1,0,2]=4 1744 B15R1.93 CCC#CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100009813939 [0,1,0,0,0,0|1,0,2]=4 1745 B15R1.93 CCCC#CC(=O)C(C)c1ccccc1 1458a_200011218047_100000230085 [0,1,0,0,0,0|1,0,1]=3 1746 B15R1.93 CCCC#CC(=O)N(C)c1ccccc1 22a_100000210012_200011218047 [0,1,0,0,0,0|2,0,1]=4 1747 B15R1.93 CCCC=CC(=O)C(C)c1ccccc1 1458a_100000212230_100000230085 [0,1,0,0,0,0|1,0,1]=3 1748 B15R1.93 CCCC=CC(=O)N(C)c1ccccc1 11a_100000210012_100000212230 [0,1,0,0,0,0|2,0,1]=4 1749 B15R1.93 CCCC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000212230 [0,1,0,0,0,0|2,0,1]=4 1750 B15R1.93 CCCC=CC(=O)N(C)c1ccccc1 22a_100000210012_100000212230 [0,1,0,0,0,0|2,0,1]=4 1751 B15R1.93 CCCCCC(=O)C(C)c1ccccc1 1458a_100000212188_100000230085 [0,1,0,0,0,0|1,0,0]=2 1752 B15R1.93 CCCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210326 [0,1,0,0,0,0|2,0,0]=3 1753 B15R1.93 CCCCCC(=O)C(C)c1cnccn1 1458a_100000212188_200000703233 [0,1,0,0,0,0|3,0,0]=4 1754 B15R1.93 CCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210326 [0,1,0,0,0,0|1,0,0]=2 1755 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000212188 [0,1,0,0,0,0|2,0,0]=3 1756 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000212188 [0,1,0,0,0,0|2,0,0]=3 1757 B15R1.93 CCCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000212188 [0,1,0,0,0,0|2,0,0]=3 1758 B15R1.93 CCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210326 [0,1,0,0,0,0|1,0,0]=2 1759 B15R1.93 CCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210326 [0,1,0,0,0,0|1,0,0]=2 1760 B15R1.93 CCCCCN(C)C(C)c1ccccc1 2230a_100000195388_100000210326 [0,1,0,0,0,0|3,0,0]=4 1761 B15R1.93 CCCCCN(C)C(C)c1ccccc1 2230a_100000223495_100000230085 [0,1,0,0,0,0|3,0,0]=4 1762 B15R1.93 CCCCCN(C)C(C)c1ccccc1 269982a_100000195388_100000210215 [0,1,0,0,0,0|3,0,0]=4 1763 B15R1.93 CCCCCN(C)C(C)c1ccccc1 269982a_100000223495_100000230085 [0,1,0,0,0,0|3,0,0]=4 1764 B15R1.93 CCCCNC(=O)C(C)c1ccccn1 11a_100000102301_100000722050 [0,1,0,0,0,0|2,0,0]=3 1765 B15R1.93 CCCCNC(=O)C(C)c1ccccn1 1626a_100000102301_100000722050 [0,1,0,0,0,0|2,0,0]=3 1766 B15R1.93 CCCCNC(=O)C(C)c1ccccn1 240690a_100000102301_100000722050 [0,1,0,0,0,0|2,0,0]=3 1767 B15R1.93 CCCCNC(=O)C(C)c1ccccn1 527a_100000102301_100000722050 [0,1,0,0,0,0|2,0,0]=3 1768 B15R1.93 CCCCNC(=O)C(C)c1ncccn1 11a_100000102301_100011934538 [0,1,0,0,0,0|3,0,0]=4 1769 B15R1.93 CCCCNC(=O)C(C)c1ncccn1 240690a_100000102301_100011934538 [0,1,0,0,0,0|3,0,0]=4 1770 B15R1.93 CCCCNC(=O)C(C)c1ncccn1 527a_100000102301_100011934538 [0,1,0,0,0,0|3,0,0]=4 1771 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 11a_100000102301_100000698975 [0,1,0,0,0,0|1,0,0]=2 1772 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 1626a_100000102301_100000698975 [0,1,0,0,0,0|1,0,0]=2 1773 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 240690a_100000102301_100000698975 [0,1,0,0,0,0|1,0,0]=2 1774 B15R1.93 CCCCNC(=O)C(F)c1ccccc1 527a_100000102301_100000698975 [0,1,0,0,0,0|1,0,0]=2 1775 B15R1.93 CCCCNC(=O)N(C)c1ccccc1 512a_100000102301_100000210012 [0,1,0,0,0,0|2,0,0]=3 1776 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000102301_100000751047 [0,1,0,0,0,0|1,0,0]=2 1777 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000102301_100000751047 [0,1,0,0,0,0|1,0,0]=2 1778 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000102301_100000751047 [0,1,0,0,0,0|1,0,0]=2 1779 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000102301_100000751047 [0,1,0,0,0,0|1,0,0]=2 1780 B15R1.93 CCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000102301_100000684486 [0,1,0,0,0,0|1,0,0]=2 1781 B15R1.93 CCCCOC(C)C(=O)c1ccccc1 7a_100000210227_100000239700 [0,1,0,0,0,0|1,0,2]=4 1782 B15R1.93 CCCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000210210 [0,1,0,0,0,0|1,0,1]=3 1783 B15R1.93 CCCNCC(=O)N(C)c1ccccc1 2230a_200000174886_100000210303 [0,1,0,0,0,0|3,0,0]=4 1784 B15R1.93 CCCNNC(=O)C(C)c1ccccn1 22a_100000740057_100000722050 [0,1,0,0,0,0|3,0,0]=4 1785 B15R1.93 CCCNNC(=O)C(F)c1ccccc1 22a_100000740057_100000698975 [0,1,0,0,0,0|2,0,0]=3 1786 B15R1.93 CCCNNC(=O)N(C)c1ccccc1 512a_100000740057_100000210012 [0,1,0,0,0,0|3,0,0]=4 1787 B15R1.93 CCCNNC(=O)[C@@H](C)c1ccccc1 22a_100000740057_100000751047 [0,1,0,0,0,0|2,0,0]=3 1788 B15R1.93 CCCNNC(=O)[C@H](O)c1ccccc1 22a_100000740057_100000684486 [0,1,0,0,0,0|2,0,0]=3 1789 B15R1.93 CCCOCC(=O)C(C)c1ccccc1 1458a_100000745993_100000230085 [0,1,0,0,0,0|2,0,0]=3 1790 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 11a_100000210012_100000745993 [0,1,0,0,0,0|3,0,0]=4 1791 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 1626a_100000210012_100000745993 [0,1,0,0,0,0|3,0,0]=4 1792 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 22a_100000210012_100000745993 [0,1,0,0,0,0|3,0,0]=4 1793 B15R1.93 CCCOCC(=O)N(C)c1ccccc1 34a_100000210258_100000183487 [0,1,0,0,0,0|3,0,0]=4 1794 B15R1.93 CCCSCC(=O)C(C)c1ccccc1 1458a_100000217233_100000230085 [0,1,0,0,0,0|2,0,0]=3 1795 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 11a_100000210012_100000217233 [0,1,0,0,0,0|3,0,0]=4 1796 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000217233 [0,1,0,0,0,0|3,0,0]=4 1797 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 22a_100000210012_100000217233 [0,1,0,0,0,0|3,0,0]=4 1798 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 62a_100000183487_100000210303 [0,1,0,0,0,0|3,0,0]=4 1799 B15R1.93 CCCSCC(=O)N(C)c1ccccc1 62a_100000210303_100000183487 [0,1,0,0,0,0|3,0,0]=4 1800 B15R1.93 CCNCCC(=O)N(C)c1ccccc1 2230a_100015525214_100000691765 [0,1,0,0,0,0|3,0,0]=4 1801 B15R1.93 CCOC=CC(=O)C(C)c1ccccc1 1458a_100016266692_100000230085 [0,1,0,0,0,0|2,0,1]=4 1802 B15R1.93 CCOCCC(=O)C(C)c1ccccc1 1458a_100000749530_100000230085 [0,1,0,0,0,0|2,0,0]=3 1803 B15R1.93 CCOCCC(=O)C(C)c1ccccn1 1458a_100000722050_100011215890 [0,1,0,0,0,0|3,0,0]=4 1804 B15R1.93 CCOCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215890 [0,1,0,0,0,0|2,0,0]=3 1805 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749530 [0,1,0,0,0,0|3,0,0]=4 1806 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749530 [0,1,0,0,0,0|3,0,0]=4 1807 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749530 [0,1,0,0,0,0|3,0,0]=4 1808 B15R1.93 CCOCCC(=O)N(C)c1ccccc1 34a_100121572206_100000691765 [0,1,0,0,0,0|3,0,0]=4 1809 B15R1.93 CCOCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011215890 [0,1,0,0,0,0|2,0,0]=3 1810 B15R1.93 CCOCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215890 [0,1,0,0,0,0|2,0,0]=3 1811 B15R1.93 CCSCCC(=O)C(C)c1ccccc1 1458a_100000230768_100000230085 [0,1,0,0,0,0|2,0,0]=3 1812 B15R1.93 CCSCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000757381 [0,1,0,0,0,0|3,0,0]=4 1813 B15R1.93 CCSCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000757381 [0,1,0,0,0,0|2,0,0]=3 1814 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 11a_100000210012_100000230768 [0,1,0,0,0,0|3,0,0]=4 1815 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000230768 [0,1,0,0,0,0|3,0,0]=4 1816 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 22a_100000210012_100000230768 [0,1,0,0,0,0|3,0,0]=4 1817 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 62a_100000210202_100000691765 [0,1,0,0,0,0|3,0,0]=4 1818 B15R1.93 CCSCCC(=O)N(C)c1ccccc1 62a_100000691765_100000210202 [0,1,0,0,0,0|3,0,0]=4 1819 B15R1.93 CCSCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000757381 [0,1,0,0,0,0|2,0,0]=3 1820 B15R1.93 CCSCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000757381 [0,1,0,0,0,0|2,0,0]=3 1821 B15R1.93 CN(C(=O)CCCCO)c1ccccc1 1626a_100000210012_100000695505 [0,1,0,0,0,0|3,0,0]=4 1822 B15R1.93 CN(C(=O)NCCCF)c1ccccc1 512a_100015189416_100000210012 [0,1,0,0,0,0|3,0,0]=4 1823 B15R1.93 COCC=CC(=O)C(C)c1ccccc1 1458a_100016285016_100000230085 [0,1,0,0,0,0|2,0,1]=4 1824 B15R1.93 COCCCC(=O)C(C)c1ccccc1 1458a_100000741012_100000230085 [0,1,0,0,0,0|2,0,0]=3 1825 B15R1.93 COCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000740836 [0,1,0,0,0,0|3,0,0]=4 1826 B15R1.93 COCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000740836 [0,1,0,0,0,0|2,0,0]=3 1827 B15R1.93 COCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000741012 [0,1,0,0,0,0|3,0,0]=4 1828 B15R1.93 COCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000741012 [0,1,0,0,0,0|3,0,0]=4 1829 B15R1.93 COCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000741012 [0,1,0,0,0,0|3,0,0]=4 1830 B15R1.93 COCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000740836 [0,1,0,0,0,0|2,0,0]=3 1831 B15R1.93 COCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000740836 [0,1,0,0,0,0|2,0,0]=3 1832 B15R1.93 COCCNC(=O)C(C)c1ccccn1 1626a_100000209980_100000722050 [0,1,0,0,0,0|3,0,0]=4 1833 B15R1.93 COCCNC(=O)C(C)c1ccccn1 240690a_100000209980_100000722050 [0,1,0,0,0,0|3,0,0]=4 1834 B15R1.93 COCCNC(=O)C(C)c1ccccn1 527a_100000209980_100000722050 [0,1,0,0,0,0|3,0,0]=4 1835 B15R1.93 COCCNC(=O)C(F)c1ccccc1 1626a_100000209980_100000698975 [0,1,0,0,0,0|2,0,0]=3 1836 B15R1.93 COCCNC(=O)C(F)c1ccccc1 240690a_100000209980_100000698975 [0,1,0,0,0,0|2,0,0]=3 1837 B15R1.93 COCCNC(=O)C(F)c1ccccc1 527a_100000209980_100000698975 [0,1,0,0,0,0|2,0,0]=3 1838 B15R1.93 COCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000209980_100000751047 [0,1,0,0,0,0|2,0,0]=3 1839 B15R1.93 COCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000209980_100000751047 [0,1,0,0,0,0|2,0,0]=3 1840 B15R1.93 COCCNC(=O)[C@@H](C)c1ccccc1 527a_100000209980_100000751047 [0,1,0,0,0,0|2,0,0]=3 1841 B15R1.93 COCCNC(=O)[C@H](O)c1ccccc1 240690a_100000209980_100000684486 [0,1,0,0,0,0|2,0,0]=3 1842 B15R1.93 COCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100011201679 [0,1,0,0,0,0|2,0,1]=4 1843 B15R1.93 CSCCCC(=O)C(C)c1ccccc1 1458a_100000173376_100000230085 [0,1,0,0,0,0|2,0,0]=3 1844 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000173376 [0,1,0,0,0,0|3,0,0]=4 1845 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000173376 [0,1,0,0,0,0|3,0,0]=4 1846 B15R1.93 CSCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000173376 [0,1,0,0,0,0|3,0,0]=4 1847 B15R1.93 CSCCNC(=O)C(C)c1ccccn1 11a_100020590264_100000722050 [0,1,0,0,0,0|3,0,0]=4 1848 B15R1.93 CSCCNC(=O)C(C)c1ccccn1 1626a_100020590264_100000722050 [0,1,0,0,0,0|3,0,0]=4 1849 B15R1.93 CSCCNC(=O)C(C)c1ccccn1 240690a_100020590264_100000722050 [0,1,0,0,0,0|3,0,0]=4 1850 B15R1.93 CSCCNC(=O)C(C)c1ccccn1 527a_100020590264_100000722050 [0,1,0,0,0,0|3,0,0]=4 1851 B15R1.93 CSCCNC(=O)C(F)c1ccccc1 11a_100020590264_100000698975 [0,1,0,0,0,0|2,0,0]=3 1852 B15R1.93 CSCCNC(=O)C(F)c1ccccc1 1626a_100020590264_100000698975 [0,1,0,0,0,0|2,0,0]=3 1853 B15R1.93 CSCCNC(=O)C(F)c1ccccc1 240690a_100020590264_100000698975 [0,1,0,0,0,0|2,0,0]=3 1854 B15R1.93 CSCCNC(=O)C(F)c1ccccc1 527a_100020590264_100000698975 [0,1,0,0,0,0|2,0,0]=3 1855 B15R1.93 CSCCNC(=O)N(C)c1ccccc1 512a_100020590264_100000210012 [0,1,0,0,0,0|3,0,0]=4 1856 B15R1.93 CSCCNC(=O)[C@@H](C)c1ccccc1 11a_100020590264_100000751047 [0,1,0,0,0,0|2,0,0]=3 1857 B15R1.93 CSCCNC(=O)[C@@H](C)c1ccccc1 1626a_100020590264_100000751047 [0,1,0,0,0,0|2,0,0]=3 1858 B15R1.93 CSCCNC(=O)[C@@H](C)c1ccccc1 240690a_100020590264_100000751047 [0,1,0,0,0,0|2,0,0]=3 1859 B15R1.93 CSCCNC(=O)[C@@H](C)c1ccccc1 527a_100020590264_100000751047 [0,1,0,0,0,0|2,0,0]=3 1860 B15R1.93 CSCCNC(=O)[C@H](O)c1ccccc1 240690a_100020590264_100000684486 [0,1,0,0,0,0|2,0,0]=3 1861 B15R1.93 CSCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000212216 [0,1,0,0,0,0|2,0,1]=4 1862 B15R1.93 C[C@H](C(=O)CCCC#N)c1ccccc1 1458a_100000751047_100000211468 [0,1,0,0,0,0|2,0,1]=4 1863 B15R1.93 C[C@H](C(=O)CCCCF)c1ccccc1 1458a_100000751047_100000729493 [0,1,0,0,0,0|2,0,0]=3 1864 B15R1.93 C[C@H](C(=O)CCCCO)c1ccccc1 1458a_100000751047_100000210776 [0,1,0,0,0,0|2,0,0]=3 1865 B15R1.93 C[C@H](C(=O)NCCC#N)c1ccccc1 11a_100000720768_100000751047 [0,1,0,0,0,0|2,0,1]=4 1866 B15R1.93 C[C@H](C(=O)NCCC#N)c1ccccc1 1626a_100000720768_100000751047 [0,1,0,0,0,0|2,0,1]=4 1867 B15R1.93 C[C@H](C(=O)NCCC#N)c1ccccc1 240690a_100000720768_100000751047 [0,1,0,0,0,0|2,0,1]=4 1868 B15R1.93 C[C@H](C(=O)NCCC#N)c1ccccc1 527a_100000720768_100000751047 [0,1,0,0,0,0|2,0,1]=4 1869 B15R1.93 C[C@H](C(=O)NCCCF)c1ccccc1 11a_100015189416_100000751047 [0,1,0,0,0,0|2,0,0]=3 1870 B15R1.93 C[C@H](C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000751047 [0,1,0,0,0,0|2,0,0]=3 1871 B15R1.93 C[C@H](C(=O)NCCCF)c1ccccc1 240690a_100015189416_100000751047 [0,1,0,0,0,0|2,0,0]=3 1872 B15R1.93 C[C@H](C(=O)NCCCF)c1ccccc1 527a_100015189416_100000751047 [0,1,0,0,0,0|2,0,0]=3 1873 B15R1.93 C[C@H](C(=O)NCCCO)c1ccccc1 240690a_100000182051_100000751047 [0,1,0,0,0,0|2,0,0]=3 1874 B15R1.93 C[C@H](C(=O)NCCCO)c1ccccc1 527a_100000182051_100000751047 [0,1,0,0,0,0|2,0,0]=3 1875 B15R1.93 C[C@H](C(=O)NNCCO)c1ccccc1 22a_100000210001_100000751047 [0,1,0,0,0,0|3,0,0]=4 1876 B15R1.93 C[C@H](OCCCF)[C@@H](N)c1ccccc1 34a_100134616770_100011934791 [0,1,0,0,0,0|2,0,1]=4 1877 B15R1.93 C[C@H](OCCCO)[C@@H](N)c1ccccc1 34a_100134616770_100000230001 [0,1,0,0,0,0|2,0,1]=4 1878 B15R1.93 N#CCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000211468 [0,1,0,0,0,0|2,0,1]=4 1879 B15R1.93 N#CCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000211468 [0,1,0,0,0,0|2,0,1]=4 1880 B15R1.93 N#CCCNC(=O)C(F)c1ccccc1 11a_100000720768_100000698975 [0,1,0,0,0,0|2,0,1]=4 1881 B15R1.93 N#CCCNC(=O)C(F)c1ccccc1 1626a_100000720768_100000698975 [0,1,0,0,0,0|2,0,1]=4 1882 B15R1.93 N#CCCNC(=O)C(F)c1ccccc1 240690a_100000720768_100000698975 [0,1,0,0,0,0|2,0,1]=4 1883 B15R1.93 N#CCCNC(=O)C(F)c1ccccc1 527a_100000720768_100000698975 [0,1,0,0,0,0|2,0,1]=4 1884 B15R1.93 N#CCCNC(=O)[C@H](O)c1ccccc1 240690a_100000720768_100000684486 [0,1,0,0,0,0|2,0,1]=4 1885 B15R1.93 O=C(CCCCF)C(F)c1ccccc1 1458a_100000698975_100000729493 [0,1,0,0,0,0|2,0,0]=3 1886 B15R1.93 O=C(CCCCF)[C@H](O)c1ccccc1 1458a_100000684486_100000729493 [0,1,0,0,0,0|2,0,0]=3 1887 B15R1.93 O=C(CCCCO)C(F)c1ccccc1 1458a_100000698975_100000210776 [0,1,0,0,0,0|2,0,0]=3 1888 B15R1.93 O=C(CCCCO)[C@H](O)c1ccccc1 1458a_100000684486_100000210776 [0,1,0,0,0,0|2,0,0]=3 1889 B15R1.93 O=C(NCCCF)C(F)c1ccccc1 11a_100015189416_100000698975 [0,1,0,0,0,0|2,0,0]=3 1890 B15R1.93 O=C(NCCCF)C(F)c1ccccc1 1626a_100015189416_100000698975 [0,1,0,0,0,0|2,0,0]=3 1891 B15R1.93 O=C(NCCCF)C(F)c1ccccc1 240690a_100015189416_100000698975 [0,1,0,0,0,0|2,0,0]=3 1892 B15R1.93 O=C(NCCCF)C(F)c1ccccc1 527a_100015189416_100000698975 [0,1,0,0,0,0|2,0,0]=3 1893 B15R1.93 O=C(NCCCF)[C@H](O)c1ccccc1 240690a_100015189416_100000684486 [0,1,0,0,0,0|2,0,0]=3 1894 B15R1.93 O=C(NCCCO)C(F)c1ccccc1 240690a_100000182051_100000698975 [0,1,0,0,0,0|2,0,0]=3 1895 B15R1.93 O=C(NCCCO)C(F)c1ccccc1 527a_100000182051_100000698975 [0,1,0,0,0,0|2,0,0]=3 1896 B15R1.93 O=C(NCCCO)[C@H](O)c1ccccc1 240690a_100000182051_100000684486 [0,1,0,0,0,0|2,0,0]=3 1897 B15R1.93 O=C(NNCCO)C(F)c1ccccc1 22a_100000210001_100000698975 [0,1,0,0,0,0|3,0,0]=4 1898 B15R1.93 O=C(NNCCO)[C@H](O)c1ccccc1 22a_100000210001_100000684486 [0,1,0,0,0,0|3,0,0]=4 1899 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000731252 [0,1,0,0,0,0|1,0,2]=4 1900 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000690238_100000189115 [0,1,0,0,0,0|1,0,2]=4 1901 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000731252 [0,1,0,0,0,0|1,0,2]=4 1902 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)C 1458a_100000690238_100000210814 [0,1,0,0,0,0|1,0,2]=4 1903 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000731252 [0,1,0,0,0,0|1,0,2]=4 1904 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000690238_100000694040 [0,1,0,0,0,0|1,0,2]=4 1905 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000731252 [0,1,0,0,0,0|1,0,2]=4 1906 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)F 1458a_100000690238_100000198546 [0,1,0,0,0,0|1,0,2]=4 1907 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000731252 [0,1,0,0,0,0|1,0,2]=4 1908 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)I 1458a_100000690238_100000189116 [0,1,0,0,0,0|1,0,2]=4 1909 B15R1.128 C#CCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000731252 [0,1,0,0,0,0|1,0,2]=4 1910 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 11a_100000755551_100000198978 [0,1,0,0,0,0|1,0,2]=4 1911 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 240690a_100000755551_100000198978 [0,1,0,0,0,0|1,0,2]=4 1912 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Br 527a_100000755551_100000198978 [0,1,0,0,0,0|1,0,2]=4 1913 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 11a_100000755551_100000212244 [0,1,0,0,0,0|1,0,2]=4 1914 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 240690a_100000755551_100000212244 [0,1,0,0,0,0|1,0,2]=4 1915 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)C 527a_100000755551_100000212244 [0,1,0,0,0,0|1,0,2]=4 1916 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 11a_100000755551_100000211027 [0,1,0,0,0,0|1,0,2]=4 1917 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000755551_100000211027 [0,1,0,0,0,0|1,0,2]=4 1918 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)Cl 527a_100000755551_100000211027 [0,1,0,0,0,0|1,0,2]=4 1919 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 11a_100000755551_100000210951 [0,1,0,0,0,0|1,0,2]=4 1920 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 1626a_100000755551_100000210951 [0,1,0,0,0,0|1,0,2]=4 1921 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 240690a_100000755551_100000210951 [0,1,0,0,0,0|1,0,2]=4 1922 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)F 527a_100000755551_100000210951 [0,1,0,0,0,0|1,0,2]=4 1923 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 11a_100000755551_100000688869 [0,1,0,0,0,0|1,0,2]=4 1924 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 1626a_100000755551_100000688869 [0,1,0,0,0,0|1,0,2]=4 1925 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 240690a_100000755551_100000688869 [0,1,0,0,0,0|1,0,2]=4 1926 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)I 527a_100000755551_100000688869 [0,1,0,0,0,0|1,0,2]=4 1927 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 1626a_100000755551_100000198540 [0,1,0,0,0,0|1,0,2]=4 1928 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 240690a_100000755551_100000198540 [0,1,0,0,0,0|1,0,2]=4 1929 B15R1.128 C#CCCNC(=O)Cc1ccc(cc1)O 527a_100000755551_100000198540 [0,1,0,0,0,0|1,0,2]=4 1930 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000757094 [0,1,0,0,0,0|1,0,2]=4 1931 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000766728_100000189115 [0,1,0,0,0,0|1,0,2]=4 1932 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000757094 [0,1,0,0,0,0|1,0,2]=4 1933 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)C 1458a_100000766728_100000210814 [0,1,0,0,0,0|1,0,2]=4 1934 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000757094 [0,1,0,0,0,0|1,0,2]=4 1935 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000766728_100000694040 [0,1,0,0,0,0|1,0,2]=4 1936 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000757094 [0,1,0,0,0,0|1,0,2]=4 1937 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)F 1458a_100000766728_100000198546 [0,1,0,0,0,0|1,0,2]=4 1938 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000757094 [0,1,0,0,0,0|1,0,2]=4 1939 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)I 1458a_100000766728_100000189116 [0,1,0,0,0,0|1,0,2]=4 1940 B15R1.128 C=CCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000757094 [0,1,0,0,0,0|1,0,2]=4 1941 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 11a_100015191253_100000198978 [0,1,0,0,0,0|1,0,2]=4 1942 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 240690a_100015191253_100000198978 [0,1,0,0,0,0|1,0,2]=4 1943 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Br 527a_100015191253_100000198978 [0,1,0,0,0,0|1,0,2]=4 1944 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 11a_100015191253_100000212244 [0,1,0,0,0,0|1,0,2]=4 1945 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 240690a_100015191253_100000212244 [0,1,0,0,0,0|1,0,2]=4 1946 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)C 527a_100015191253_100000212244 [0,1,0,0,0,0|1,0,2]=4 1947 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 11a_100015191253_100000211027 [0,1,0,0,0,0|1,0,2]=4 1948 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100015191253_100000211027 [0,1,0,0,0,0|1,0,2]=4 1949 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)Cl 527a_100015191253_100000211027 [0,1,0,0,0,0|1,0,2]=4 1950 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 11a_100015191253_100000210951 [0,1,0,0,0,0|1,0,2]=4 1951 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 1626a_100015191253_100000210951 [0,1,0,0,0,0|1,0,2]=4 1952 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 240690a_100015191253_100000210951 [0,1,0,0,0,0|1,0,2]=4 1953 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)F 527a_100015191253_100000210951 [0,1,0,0,0,0|1,0,2]=4 1954 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 11a_100015191253_100000688869 [0,1,0,0,0,0|1,0,2]=4 1955 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 1626a_100015191253_100000688869 [0,1,0,0,0,0|1,0,2]=4 1956 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 240690a_100015191253_100000688869 [0,1,0,0,0,0|1,0,2]=4 1957 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)I 527a_100015191253_100000688869 [0,1,0,0,0,0|1,0,2]=4 1958 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 1626a_100015191253_100000198540 [0,1,0,0,0,0|1,0,2]=4 1959 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 240690a_100015191253_100000198540 [0,1,0,0,0,0|1,0,2]=4 1960 B15R1.128 C=CCCNC(=O)Cc1ccc(cc1)O 527a_100015191253_100000198540 [0,1,0,0,0,0|1,0,2]=4 1961 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Br 11a_100000685387_100000198978 [0,1,0,0,0,0|1,0,2]=4 1962 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Br 527a_100000685387_100000198978 [0,1,0,0,0,0|1,0,2]=4 1963 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)C 11a_100000685387_100000212244 [0,1,0,0,0,0|1,0,2]=4 1964 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)C 527a_100000685387_100000212244 [0,1,0,0,0,0|1,0,2]=4 1965 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Cl 11a_100000685387_100000211027 [0,1,0,0,0,0|1,0,2]=4 1966 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)Cl 527a_100000685387_100000211027 [0,1,0,0,0,0|1,0,2]=4 1967 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)F 11a_100000685387_100000210951 [0,1,0,0,0,0|1,0,2]=4 1968 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)F 1626a_100000685387_100000210951 [0,1,0,0,0,0|1,0,2]=4 1969 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)F 527a_100000685387_100000210951 [0,1,0,0,0,0|1,0,2]=4 1970 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)I 11a_100000685387_100000688869 [0,1,0,0,0,0|1,0,2]=4 1971 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)I 1626a_100000685387_100000688869 [0,1,0,0,0,0|1,0,2]=4 1972 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)I 527a_100000685387_100000688869 [0,1,0,0,0,0|1,0,2]=4 1973 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)O 1626a_100000685387_100000198540 [0,1,0,0,0,0|1,0,2]=4 1974 B15R1.128 CC#CCNC(=O)Cc1ccc(cc1)O 527a_100000685387_100000198540 [0,1,0,0,0,0|1,0,2]=4 1975 B15R1.128 CC(Cc1ccc(cc1)F)OCCCF 34a_100011351027_100011934791 [0,1,0,0,0,0|2,0,1]=4 1976 B15R1.128 CC(Cc1ccc(cc1)F)OCCCF 7a_100011351027_100011934791 [0,1,0,0,0,0|2,0,1]=4 1977 B15R1.128 CC(Cc1ccc(cc1)F)OCCCO 34a_100011351027_100000230001 [0,1,0,0,0,0|2,0,1]=4 1978 B15R1.128 CC(Cc1ccc(cc1)F)OCCCO 7a_100011351027_100011215043 [0,1,0,0,0,0|2,0,1]=4 1979 B15R1.128 CC/C=C/CC(=O)Cc1ccc(cc1)Br 1458a_100016274230_100000189115 [0,1,0,0,0,0|1,0,2]=4 1980 B15R1.128 CC/C=C/CC(=O)Cc1ccc(cc1)C 1458a_100016274230_100000210814 [0,1,0,0,0,0|1,0,2]=4 1981 B15R1.128 CC/C=C/CC(=O)Cc1ccc(cc1)Cl 1458a_100016274230_100000694040 [0,1,0,0,0,0|1,0,2]=4 1982 B15R1.128 CC/C=C/CC(=O)Cc1ccc(cc1)F 1458a_100016274230_100000198546 [0,1,0,0,0,0|1,0,2]=4 1983 B15R1.128 CC/C=C/CC(=O)Cc1ccc(cc1)I 1458a_100016274230_100000189116 [0,1,0,0,0,0|1,0,2]=4 1984 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100103147603 [0,1,0,0,0,0|1,0,2]=4 1985 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100103147603 [0,1,0,0,0,0|1,0,2]=4 1986 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100103147603 [0,1,0,0,0,0|1,0,2]=4 1987 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100103147603 [0,1,0,0,0,0|1,0,2]=4 1988 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100103147603 [0,1,0,0,0,0|1,0,2]=4 1989 B15R1.128 CC/C=C\CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100103147603 [0,1,0,0,0,0|1,0,2]=4 1990 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100009813939 [0,1,0,0,0,0|1,0,2]=4 1991 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100009813939 [0,1,0,0,0,0|1,0,2]=4 1992 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100009813939 [0,1,0,0,0,0|1,0,2]=4 1993 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100009813939 [0,1,0,0,0,0|1,0,2]=4 1994 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100009813939 [0,1,0,0,0,0|1,0,2]=4 1995 B15R1.128 CCC#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100009813939 [0,1,0,0,0,0|1,0,2]=4 1996 B15R1.128 CCC=NNC(=O)Cc1ccc(cc1)C 4a_100000189221_100000210100 [0,1,0,0,0,0|2,0,1]=4 1997 B15R1.128 CCC=NNC(=O)Cc1ccc(cc1)Cl 4a_100000181177_100000210100 [0,1,0,0,0,0|2,0,1]=4 1998 B15R1.128 CCC=NNC(=O)Cc1ccc(cc1)F 4a_100000181394_100000210100 [0,1,0,0,0,0|2,0,1]=4 1999 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)Br 1458a_200011218047_100000189115 [0,1,0,0,0,0|1,0,1]=3 2000 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)C 1458a_200011218047_100000210814 [0,1,0,0,0,0|1,0,1]=3 2001 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)Cl 1458a_200011218047_100000694040 [0,1,0,0,0,0|1,0,1]=3 2002 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)F 1458a_200011218047_100000198546 [0,1,0,0,0,0|1,0,1]=3 2003 B15R1.128 CCCC#CC(=O)Cc1ccc(cc1)I 1458a_200011218047_100000189116 [0,1,0,0,0,0|1,0,1]=3 2004 B15R1.128 CCCC#CC(=O)Cc1ccc(cn1)Br 1458a_200011218047_100000702658 [0,1,0,0,0,0|2,0,1]=4 2005 B15R1.128 CCCC#CC(=O)Cc1ccc(cn1)C 1458a_200011218047_100000691093 [0,1,0,0,0,0|2,0,1]=4 2006 B15R1.128 CCCC#CC(=O)Cc1ccc(cn1)Cl 1458a_200011218047_100012066911 [0,1,0,0,0,0|2,0,1]=4 2007 B15R1.128 CCCC#CC(=O)Cc1ccc(cn1)F 1458a_200011218047_100000703193 [0,1,0,0,0,0|2,0,1]=4 2008 B15R1.128 CCCC#CC(=O)Cc1ccc(nc1)Br 1458a_200011218047_100009831999 [0,1,0,0,0,0|2,0,1]=4 2009 B15R1.128 CCCC#CC(=O)Cc1ccc(nc1)C 1458a_200011218047_100016987292 [0,1,0,0,0,0|2,0,1]=4 2010 B15R1.128 CCCC#CC(=O)Cc1ccc(nc1)Cl 1458a_200011218047_100000735431 [0,1,0,0,0,0|2,0,1]=4 2011 B15R1.128 CCCC#CC(=O)Cc1ccc(nc1)F 1458a_200011218047_100009820150 [0,1,0,0,0,0|2,0,1]=4 2012 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)Br 22a_100000210018_200011218047 [0,1,0,0,0,0|2,0,1]=4 2013 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)C 22a_100000124888_200011218047 [0,1,0,0,0,0|2,0,1]=4 2014 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_200011218047 [0,1,0,0,0,0|2,0,1]=4 2015 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)F 22a_100000185862_200011218047 [0,1,0,0,0,0|2,0,1]=4 2016 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)I 22a_100000185761_200011218047 [0,1,0,0,0,0|2,0,1]=4 2017 B15R1.128 CCCC#CC(=O)Nc1ccc(cc1)O 22a_100000185829_200011218047 [0,1,0,0,0,0|2,0,1]=4 2018 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)Br 1458a_100000212230_100000189115 [0,1,0,0,0,0|1,0,1]=3 2019 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)C 1458a_100000212230_100000210814 [0,1,0,0,0,0|1,0,1]=3 2020 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000212230_100000694040 [0,1,0,0,0,0|1,0,1]=3 2021 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)F 1458a_100000212230_100000198546 [0,1,0,0,0,0|1,0,1]=3 2022 B15R1.128 CCCC=CC(=O)Cc1ccc(cc1)I 1458a_100000212230_100000189116 [0,1,0,0,0,0|1,0,1]=3 2023 B15R1.128 CCCC=CC(=O)Cc1ccc(cn1)Br 1458a_100000212230_100000702658 [0,1,0,0,0,0|2,0,1]=4 2024 B15R1.128 CCCC=CC(=O)Cc1ccc(cn1)C 1458a_100000212230_100000691093 [0,1,0,0,0,0|2,0,1]=4 2025 B15R1.128 CCCC=CC(=O)Cc1ccc(cn1)Cl 1458a_100000212230_100012066911 [0,1,0,0,0,0|2,0,1]=4 2026 B15R1.128 CCCC=CC(=O)Cc1ccc(cn1)F 1458a_100000212230_100000703193 [0,1,0,0,0,0|2,0,1]=4 2027 B15R1.128 CCCC=CC(=O)Cc1ccc(nc1)Br 1458a_100000212230_100009831999 [0,1,0,0,0,0|2,0,1]=4 2028 B15R1.128 CCCC=CC(=O)Cc1ccc(nc1)C 1458a_100000212230_100016987292 [0,1,0,0,0,0|2,0,1]=4 2029 B15R1.128 CCCC=CC(=O)Cc1ccc(nc1)Cl 1458a_100000212230_100000735431 [0,1,0,0,0,0|2,0,1]=4 2030 B15R1.128 CCCC=CC(=O)Cc1ccc(nc1)F 1458a_100000212230_100009820150 [0,1,0,0,0,0|2,0,1]=4 2031 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000212230 [0,1,0,0,0,0|2,0,1]=4 2032 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000212230 [0,1,0,0,0,0|2,0,1]=4 2033 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000212230 [0,1,0,0,0,0|2,0,1]=4 2034 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)C 11a_100000124888_100000212230 [0,1,0,0,0,0|2,0,1]=4 2035 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000212230 [0,1,0,0,0,0|2,0,1]=4 2036 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000212230 [0,1,0,0,0,0|2,0,1]=4 2037 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212230 [0,1,0,0,0,0|2,0,1]=4 2038 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212230 [0,1,0,0,0,0|2,0,1]=4 2039 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212230 [0,1,0,0,0,0|2,0,1]=4 2040 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)F 11a_100000185862_100000212230 [0,1,0,0,0,0|2,0,1]=4 2041 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000212230 [0,1,0,0,0,0|2,0,1]=4 2042 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000212230 [0,1,0,0,0,0|2,0,1]=4 2043 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)I 11a_100000185761_100000212230 [0,1,0,0,0,0|2,0,1]=4 2044 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000212230 [0,1,0,0,0,0|2,0,1]=4 2045 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000212230 [0,1,0,0,0,0|2,0,1]=4 2046 B15R1.128 CCCC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000212230 [0,1,0,0,0,0|2,0,1]=4 2047 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210326 [0,1,0,0,0,0|1,0,0]=2 2048 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000212188_100000189115 [0,1,0,0,0,0|1,0,0]=2 2049 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212188_100000210814 [0,1,0,0,0,0|1,0,0]=2 2050 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210326 [0,1,0,0,0,0|1,0,0]=2 2051 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210326 [0,1,0,0,0,0|1,0,0]=2 2052 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000212188_100000694040 [0,1,0,0,0,0|1,0,0]=2 2053 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210326 [0,1,0,0,0,0|1,0,0]=2 2054 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000212188_100000198546 [0,1,0,0,0,0|1,0,0]=2 2055 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000212188_100000189116 [0,1,0,0,0,0|1,0,0]=2 2056 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210326 [0,1,0,0,0,0|1,0,0]=2 2057 B15R1.128 CCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210326 [0,1,0,0,0,0|1,0,0]=2 2058 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Br 1458a_100000212188_100000702658 [0,1,0,0,0,0|2,0,0]=3 2059 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210326 [0,1,0,0,0,0|2,0,0]=3 2060 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)C 1458a_100000212188_100000691093 [0,1,0,0,0,0|2,0,0]=3 2061 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210326 [0,1,0,0,0,0|2,0,0]=3 2062 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000212188_100012066911 [0,1,0,0,0,0|2,0,0]=3 2063 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210326 [0,1,0,0,0,0|2,0,0]=3 2064 B15R1.128 CCCCCC(=O)Cc1ccc(cn1)F 1458a_100000212188_100000703193 [0,1,0,0,0,0|2,0,0]=3 2065 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Br 1458a_100000212188_100009831999 [0,1,0,0,0,0|2,0,0]=3 2066 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210326 [0,1,0,0,0,0|2,0,0]=3 2067 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)C 1458a_100000212188_100016987292 [0,1,0,0,0,0|2,0,0]=3 2068 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210326 [0,1,0,0,0,0|2,0,0]=3 2069 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210326 [0,1,0,0,0,0|2,0,0]=3 2070 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000212188_100000735431 [0,1,0,0,0,0|2,0,0]=3 2071 B15R1.128 CCCCCC(=O)Cc1ccc(nc1)F 1458a_100000212188_100009820150 [0,1,0,0,0,0|2,0,0]=3 2072 B15R1.128 CCCCCC(=O)Cc1ccc(nn1)Cl 1458a_100000212188_100016992710 [0,1,0,0,0,0|3,0,0]=4 2073 B15R1.128 CCCCCC(=O)Cc1cnc(cn1)C 1458a_100000212188_100000752025 [0,1,0,0,0,0|3,0,0]=4 2074 B15R1.128 CCCCCC(=O)Cc1ncc(cn1)Br 1458a_100000212188_100010064664 [0,1,0,0,0,0|3,0,0]=4 2075 B15R1.128 CCCCCC(=O)Cc1ncc(cn1)C 1458a_100000212188_100000685645 [0,1,0,0,0,0|3,0,0]=4 2076 B15R1.128 CCCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210326 [0,1,0,0,0,0|2,0,0]=3 2077 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000212188 [0,1,0,0,0,0|2,0,0]=3 2078 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000212188 [0,1,0,0,0,0|2,0,0]=3 2079 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000212188 [0,1,0,0,0,0|2,0,0]=3 2080 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000212188 [0,1,0,0,0,0|2,0,0]=3 2081 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000212188 [0,1,0,0,0,0|2,0,0]=3 2082 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000212188 [0,1,0,0,0,0|2,0,0]=3 2083 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000212188 [0,1,0,0,0,0|2,0,0]=3 2084 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000212188 [0,1,0,0,0,0|2,0,0]=3 2085 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000212188 [0,1,0,0,0,0|2,0,0]=3 2086 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000212188 [0,1,0,0,0,0|2,0,0]=3 2087 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000212188 [0,1,0,0,0,0|2,0,0]=3 2088 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000212188 [0,1,0,0,0,0|2,0,0]=3 2089 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000212188 [0,1,0,0,0,0|2,0,0]=3 2090 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000212188 [0,1,0,0,0,0|2,0,0]=3 2091 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000212188 [0,1,0,0,0,0|2,0,0]=3 2092 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000212188 [0,1,0,0,0,0|2,0,0]=3 2093 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000212188 [0,1,0,0,0,0|2,0,0]=3 2094 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000212188 [0,1,0,0,0,0|2,0,0]=3 2095 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000212188 [0,1,0,0,0,0|2,0,0]=3 2096 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000212188 [0,1,0,0,0,0|2,0,0]=3 2097 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000212188 [0,1,0,0,0,0|2,0,0]=3 2098 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210326 [0,1,0,0,0,0|3,0,0]=4 2099 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 2230a_100000223495_100011217064 [0,1,0,0,0,0|3,0,0]=4 2100 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000210215 [0,1,0,0,0,0|3,0,0]=4 2101 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 269982a_100000223495_100011217064 [0,1,0,0,0,0|3,0,0]=4 2102 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 26a_100000223495_100000185759 [0,1,0,0,0,0|3,0,0]=4 2103 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Br 270004a_100000223495_100000186029 [0,1,0,0,0,0|3,0,0]=4 2104 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 2230a_100000223495_100000210814 [0,1,0,0,0,0|3,0,0]=4 2105 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210326 [0,1,0,0,0,0|3,0,0]=4 2106 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 269982a_100000223495_100000210814 [0,1,0,0,0,0|3,0,0]=4 2107 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000210215 [0,1,0,0,0,0|3,0,0]=4 2108 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 26a_100000223495_200020625495 [0,1,0,0,0,0|3,0,0]=4 2109 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 270004a_100000223495_100000211033 [0,1,0,0,0,0|3,0,0]=4 2110 B15R1.128 CCCCCN(C)Cc1ccc(cc1)C 34a_100000744650_100000718602 [0,1,0,0,0,0|3,0,0]=4 2111 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210326 [0,1,0,0,0,0|3,0,0]=4 2112 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 2230a_100000189089_200000210301 [0,1,0,0,0,0|3,0,0]=4 2113 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 2230a_100000223495_100000694040 [0,1,0,0,0,0|3,0,0]=4 2114 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000210215 [0,1,0,0,0,0|3,0,0]=4 2115 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 269982a_100000189089_200000210301 [0,1,0,0,0,0|3,0,0]=4 2116 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 269982a_100000223495_100000187161 [0,1,0,0,0,0|3,0,0]=4 2117 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 270004a_100000223495_100000189385 [0,1,0,0,0,0|3,0,0]=4 2118 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000718602 [0,1,0,0,0,0|3,0,0]=4 2119 B15R1.128 CCCCCN(C)Cc1ccc(cc1)Cl 34a_100000189089_200000210301 [0,1,0,0,0,0|3,0,0]=4 2120 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 2230a_100000180876_200000210301 [0,1,0,0,0,0|3,0,0]=4 2121 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210326 [0,1,0,0,0,0|3,0,0]=4 2122 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 2230a_100000223495_100000198546 [0,1,0,0,0,0|3,0,0]=4 2123 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 269982a_100000180876_200000210301 [0,1,0,0,0,0|3,0,0]=4 2124 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000210215 [0,1,0,0,0,0|3,0,0]=4 2125 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 269982a_100000223495_100000198546 [0,1,0,0,0,0|3,0,0]=4 2126 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 270004a_100000223495_100000210084 [0,1,0,0,0,0|3,0,0]=4 2127 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 34a_100000180876_200000210301 [0,1,0,0,0,0|3,0,0]=4 2128 B15R1.128 CCCCCN(C)Cc1ccc(cc1)F 34a_100000184576_100000718602 [0,1,0,0,0,0|3,0,0]=4 2129 B15R1.128 CCCCCN(C)Cc1ccc(cc1)I 2230a_100000223495_100000189116 [0,1,0,0,0,0|3,0,0]=4 2130 B15R1.128 CCCCCN(C)Cc1ccc(cc1)I 269982a_100000223495_100000189116 [0,1,0,0,0,0|3,0,0]=4 2131 B15R1.128 CCCCCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210326 [0,1,0,0,0,0|3,0,0]=4 2132 B15R1.128 CCCCCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000210215 [0,1,0,0,0,0|3,0,0]=4 2133 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)Cl 2230a_100000189089_200025704644 [0,1,0,0,0,0|3,0,0]=4 2134 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)Cl 269982a_100000189089_200025704644 [0,1,0,0,0,0|3,0,0]=4 2135 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)Cl 34a_100000189089_200025704644 [0,1,0,0,0,0|3,0,0]=4 2136 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)F 2230a_100000180876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2137 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)F 269982a_100000180876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2138 B15R1.128 CCCCCN([13CH3])Cc1ccc(cc1)F 34a_100000180876_200025704644 [0,1,0,0,0,0|3,0,0]=4 2139 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 11a_100000102301_100000198978 [0,1,0,0,0,0|1,0,0]=2 2140 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000102301_100000198978 [0,1,0,0,0,0|1,0,0]=2 2141 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br 527a_100000102301_100000198978 [0,1,0,0,0,0|1,0,0]=2 2142 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 11a_100000102301_100000212244 [0,1,0,0,0,0|1,0,0]=2 2143 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 240690a_100000102301_100000212244 [0,1,0,0,0,0|1,0,0]=2 2144 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)C 527a_100000102301_100000212244 [0,1,0,0,0,0|1,0,0]=2 2145 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000102301_100000211027 [0,1,0,0,0,0|1,0,0]=2 2146 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000102301_100000211027 [0,1,0,0,0,0|1,0,0]=2 2147 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000102301_100000211027 [0,1,0,0,0,0|1,0,0]=2 2148 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 11a_100000102301_100000210951 [0,1,0,0,0,0|1,0,0]=2 2149 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 1626a_100000102301_100000210951 [0,1,0,0,0,0|1,0,0]=2 2150 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 240690a_100000102301_100000210951 [0,1,0,0,0,0|1,0,0]=2 2151 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)F 527a_100000102301_100000210951 [0,1,0,0,0,0|1,0,0]=2 2152 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 11a_100000102301_100000688869 [0,1,0,0,0,0|1,0,0]=2 2153 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 1626a_100000102301_100000688869 [0,1,0,0,0,0|1,0,0]=2 2154 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 240690a_100000102301_100000688869 [0,1,0,0,0,0|1,0,0]=2 2155 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)I 527a_100000102301_100000688869 [0,1,0,0,0,0|1,0,0]=2 2156 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 1626a_100000102301_100000198540 [0,1,0,0,0,0|1,0,0]=2 2157 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 240690a_100000102301_100000198540 [0,1,0,0,0,0|1,0,0]=2 2158 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)O 527a_100000102301_100000198540 [0,1,0,0,0,0|1,0,0]=2 2159 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Br 11a_100000102301_100020629044 [0,1,0,0,0,0|2,0,0]=3 2160 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Br 240690a_100000102301_100020629044 [0,1,0,0,0,0|2,0,0]=3 2161 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)C 11a_100000102301_100025705728 [0,1,0,0,0,0|2,0,0]=3 2162 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)C 1626a_100000102301_100025705728 [0,1,0,0,0,0|2,0,0]=3 2163 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)C 240690a_100000102301_100025705728 [0,1,0,0,0,0|2,0,0]=3 2164 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 11a_100000102301_100000728320 [0,1,0,0,0,0|2,0,0]=3 2165 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000102301_100000728320 [0,1,0,0,0,0|2,0,0]=3 2166 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000102301_100000728320 [0,1,0,0,0,0|2,0,0]=3 2167 B15R1.128 CCCCNC(=O)Cc1ccc(cn1)Cl 527a_100000102301_100000728320 [0,1,0,0,0,0|2,0,0]=3 2168 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Br 11a_100000102301_100010067268 [0,1,0,0,0,0|2,0,0]=3 2169 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Br 240690a_100000102301_100010067268 [0,1,0,0,0,0|2,0,0]=3 2170 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Br 527a_100000102301_100010067268 [0,1,0,0,0,0|2,0,0]=3 2171 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C 11a_100000102301_100000740413 [0,1,0,0,0,0|2,0,0]=3 2172 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C 1626a_100000102301_100000740413 [0,1,0,0,0,0|2,0,0]=3 2173 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C 240690a_100000102301_100000740413 [0,1,0,0,0,0|2,0,0]=3 2174 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)C 527a_100000102301_100000740413 [0,1,0,0,0,0|2,0,0]=3 2175 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 11a_100000102301_100000061944 [0,1,0,0,0,0|2,0,0]=3 2176 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000102301_100000061944 [0,1,0,0,0,0|2,0,0]=3 2177 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000102301_100000061944 [0,1,0,0,0,0|2,0,0]=3 2178 B15R1.128 CCCCNC(=O)Cc1ccc(nc1)Cl 527a_100000102301_100000061944 [0,1,0,0,0,0|2,0,0]=3 2179 B15R1.128 CCCCNC(=O)Cc1ncc(cn1)Br 240690a_100000102301_100012357043 [0,1,0,0,0,0|3,0,0]=4 2180 B15R1.128 CCCCNC(=O)Cn1ccc(=O)cc1 11a_100000102301_200000238563 [0,1,0,0,0,0|2,0,0]=3 2181 B15R1.128 CCCCNC(=O)Cn1ccc(=O)cc1 1626a_100000102301_200000238563 [0,1,0,0,0,0|2,0,0]=3 2182 B15R1.128 CCCCNC(=O)Cn1ccc(=O)cc1 240690a_100000102301_200000238563 [0,1,0,0,0,0|2,0,0]=3 2183 B15R1.128 CCCCNC(=O)Cn1ccc(=O)cc1 527a_100000102301_200000238563 [0,1,0,0,0,0|2,0,0]=3 2184 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000102301 [0,1,0,0,0,0|2,0,0]=3 2185 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000102301 [0,1,0,0,0,0|2,0,0]=3 2186 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000102301 [0,1,0,0,0,0|2,0,0]=3 2187 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000102301 [0,1,0,0,0,0|2,0,0]=3 2188 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000102301 [0,1,0,0,0,0|2,0,0]=3 2189 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000102301 [0,1,0,0,0,0|2,0,0]=3 2190 B15R1.128 CCCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200000163291 [0,1,0,0,0,0|2,0,0]=3 2191 B15R1.128 CCCCNC(C)Cc1ccc(cc1)Br 270004a_100000102301_100000691760 [0,1,0,0,0,0|2,0,1]=4 2192 B15R1.128 CCCCNC(C)Cc1ccc(cc1)C 270004a_100000102301_100000751045 [0,1,0,0,0,0|2,0,1]=4 2193 B15R1.128 CCCCNC(C)Cc1ccc(cc1)Cl 270004a_100000102301_100000747806 [0,1,0,0,0,0|2,0,1]=4 2194 B15R1.128 CCCCNC(C)Cc1ccc(cc1)F 270004a_100000102301_100000745281 [0,1,0,0,0,0|2,0,1]=4 2195 B15R1.128 CCCCNC(C)Cc1ccc(cc1)O 2230a_100102634573_100000210211 [0,1,0,0,0,0|2,0,1]=4 2196 B15R1.128 CCCCNC(C)Cc1ccc(cc1)O 270004a_100000102301_100011218180 [0,1,0,0,0,0|2,0,1]=4 2197 B15R1.128 CCCCNC(C)Cc1ccc(cc1)O 34a_100102634573_100000210210 [0,1,0,0,0,0|2,0,1]=4 2198 B15R1.128 CCCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000210210 [0,1,0,0,0,0|1,0,1]=3 2199 B15R1.128 CCCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000210211 [0,1,0,0,0,0|1,0,1]=3 2200 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210303 [0,1,0,0,0,0|3,0,0]=4 2201 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210303 [0,1,0,0,0,0|3,0,0]=4 2202 B15R1.128 CCCNCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210303 [0,1,0,0,0,0|3,0,0]=4 2203 B15R1.128 CCCNN=C(C)Cc1ccc(cc1)C 4a_100000740057_100000751045 [0,1,0,0,0,0|3,0,0]=4 2204 B15R1.128 CCCNN=C(C)Cc1ccc(cc1)Cl 4a_100000740057_100000747806 [0,1,0,0,0,0|3,0,0]=4 2205 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)Br 22a_100000740057_100000198978 [0,1,0,0,0,0|2,0,0]=3 2206 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)C 22a_100000740057_100000212244 [0,1,0,0,0,0|2,0,0]=3 2207 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)Cl 22a_100000740057_100000211027 [0,1,0,0,0,0|2,0,0]=3 2208 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)F 22a_100000740057_100000210951 [0,1,0,0,0,0|2,0,0]=3 2209 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)I 22a_100000740057_100000688869 [0,1,0,0,0,0|2,0,0]=3 2210 B15R1.128 CCCNNC(=O)Cc1ccc(cc1)O 22a_100000740057_100000198540 [0,1,0,0,0,0|2,0,0]=3 2211 B15R1.128 CCCNNC(=O)Cc1ccc(cn1)Br 22a_100000740057_100020629044 [0,1,0,0,0,0|3,0,0]=4 2212 B15R1.128 CCCNNC(=O)Cc1ccc(cn1)C 22a_100000740057_100025705728 [0,1,0,0,0,0|3,0,0]=4 2213 B15R1.128 CCCNNC(=O)Cc1ccc(cn1)Cl 22a_100000740057_100000728320 [0,1,0,0,0,0|3,0,0]=4 2214 B15R1.128 CCCNNC(=O)Cc1ccc(nc1)Br 22a_100000740057_100010067268 [0,1,0,0,0,0|3,0,0]=4 2215 B15R1.128 CCCNNC(=O)Cc1ccc(nc1)C 22a_100000740057_100000740413 [0,1,0,0,0,0|3,0,0]=4 2216 B15R1.128 CCCNNC(=O)Cc1ccc(nc1)Cl 22a_100000740057_100000061944 [0,1,0,0,0,0|3,0,0]=4 2217 B15R1.128 CCCNNC(=O)Cn1ccc(=O)cc1 22a_100000740057_200000238563 [0,1,0,0,0,0|3,0,0]=4 2218 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)Br 1458a_100000745993_100000189115 [0,1,0,0,0,0|2,0,0]=3 2219 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)C 1458a_100000745993_100000210814 [0,1,0,0,0,0|2,0,0]=3 2220 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000745993_100000694040 [0,1,0,0,0,0|2,0,0]=3 2221 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)F 1458a_100000745993_100000198546 [0,1,0,0,0,0|2,0,0]=3 2222 B15R1.128 CCCOCC(=O)Cc1ccc(cc1)I 1458a_100000745993_100000189116 [0,1,0,0,0,0|2,0,0]=3 2223 B15R1.128 CCCOCC(=O)Cc1ccc(cn1)Br 1458a_100000745993_100000702658 [0,1,0,0,0,0|3,0,0]=4 2224 B15R1.128 CCCOCC(=O)Cc1ccc(cn1)C 1458a_100000745993_100000691093 [0,1,0,0,0,0|3,0,0]=4 2225 B15R1.128 CCCOCC(=O)Cc1ccc(cn1)Cl 1458a_100000745993_100012066911 [0,1,0,0,0,0|3,0,0]=4 2226 B15R1.128 CCCOCC(=O)Cc1ccc(cn1)F 1458a_100000745993_100000703193 [0,1,0,0,0,0|3,0,0]=4 2227 B15R1.128 CCCOCC(=O)Cc1ccc(nc1)Br 1458a_100000745993_100009831999 [0,1,0,0,0,0|3,0,0]=4 2228 B15R1.128 CCCOCC(=O)Cc1ccc(nc1)C 1458a_100000745993_100016987292 [0,1,0,0,0,0|3,0,0]=4 2229 B15R1.128 CCCOCC(=O)Cc1ccc(nc1)Cl 1458a_100000745993_100000735431 [0,1,0,0,0,0|3,0,0]=4 2230 B15R1.128 CCCOCC(=O)Cc1ccc(nc1)F 1458a_100000745993_100009820150 [0,1,0,0,0,0|3,0,0]=4 2231 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000745993 [0,1,0,0,0,0|3,0,0]=4 2232 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000745993 [0,1,0,0,0,0|3,0,0]=4 2233 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000745993 [0,1,0,0,0,0|3,0,0]=4 2234 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 34a_100000210258_100000183692 [0,1,0,0,0,0|3,0,0]=4 2235 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000745993 [0,1,0,0,0,0|3,0,0]=4 2236 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000745993 [0,1,0,0,0,0|3,0,0]=4 2237 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000745993 [0,1,0,0,0,0|3,0,0]=4 2238 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000745993 [0,1,0,0,0,0|3,0,0]=4 2239 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 34a_100000210258_100000182914 [0,1,0,0,0,0|3,0,0]=4 2240 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000745993 [0,1,0,0,0,0|3,0,0]=4 2241 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000745993 [0,1,0,0,0,0|3,0,0]=4 2242 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000745993 [0,1,0,0,0,0|3,0,0]=4 2243 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000745993 [0,1,0,0,0,0|3,0,0]=4 2244 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210258_100000182960 [0,1,0,0,0,0|3,0,0]=4 2245 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000745993 [0,1,0,0,0,0|3,0,0]=4 2246 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000745993 [0,1,0,0,0,0|3,0,0]=4 2247 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000745993 [0,1,0,0,0,0|3,0,0]=4 2248 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000745993 [0,1,0,0,0,0|3,0,0]=4 2249 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 34a_100000210258_100000181725 [0,1,0,0,0,0|3,0,0]=4 2250 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000745993 [0,1,0,0,0,0|3,0,0]=4 2251 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000745993 [0,1,0,0,0,0|3,0,0]=4 2252 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000745993 [0,1,0,0,0,0|3,0,0]=4 2253 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000745993 [0,1,0,0,0,0|3,0,0]=4 2254 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 34a_100000210258_100000183000 [0,1,0,0,0,0|3,0,0]=4 2255 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000745993 [0,1,0,0,0,0|3,0,0]=4 2256 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000210303 [0,1,0,0,0,0|3,0,0]=4 2257 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000745993 [0,1,0,0,0,0|3,0,0]=4 2258 B15R1.128 CCCOCC(=O)Nc1ccc(cc1)O 34a_100000210258_100000233757 [0,1,0,0,0,0|3,0,0]=4 2259 B15R1.128 CCCOCC(=O)Oc1ccc(cc1)Br 34a_100000210258_200010760497 [0,1,0,0,0,0|3,0,0]=4 2260 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)Br 1458a_100000217233_100000189115 [0,1,0,0,0,0|2,0,0]=3 2261 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)C 1458a_100000217233_100000210814 [0,1,0,0,0,0|2,0,0]=3 2262 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000217233_100000694040 [0,1,0,0,0,0|2,0,0]=3 2263 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)F 1458a_100000217233_100000198546 [0,1,0,0,0,0|2,0,0]=3 2264 B15R1.128 CCCSCC(=O)Cc1ccc(cc1)I 1458a_100000217233_100000189116 [0,1,0,0,0,0|2,0,0]=3 2265 B15R1.128 CCCSCC(=O)Cc1ccc(cn1)Br 1458a_100000217233_100000702658 [0,1,0,0,0,0|3,0,0]=4 2266 B15R1.128 CCCSCC(=O)Cc1ccc(cn1)C 1458a_100000217233_100000691093 [0,1,0,0,0,0|3,0,0]=4 2267 B15R1.128 CCCSCC(=O)Cc1ccc(cn1)Cl 1458a_100000217233_100012066911 [0,1,0,0,0,0|3,0,0]=4 2268 B15R1.128 CCCSCC(=O)Cc1ccc(cn1)F 1458a_100000217233_100000703193 [0,1,0,0,0,0|3,0,0]=4 2269 B15R1.128 CCCSCC(=O)Cc1ccc(nc1)Br 1458a_100000217233_100009831999 [0,1,0,0,0,0|3,0,0]=4 2270 B15R1.128 CCCSCC(=O)Cc1ccc(nc1)C 1458a_100000217233_100016987292 [0,1,0,0,0,0|3,0,0]=4 2271 B15R1.128 CCCSCC(=O)Cc1ccc(nc1)Cl 1458a_100000217233_100000735431 [0,1,0,0,0,0|3,0,0]=4 2272 B15R1.128 CCCSCC(=O)Cc1ccc(nc1)F 1458a_100000217233_100009820150 [0,1,0,0,0,0|3,0,0]=4 2273 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000217233 [0,1,0,0,0,0|3,0,0]=4 2274 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000217233 [0,1,0,0,0,0|3,0,0]=4 2275 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000217233 [0,1,0,0,0,0|3,0,0]=4 2276 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000217233 [0,1,0,0,0,0|3,0,0]=4 2277 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_100000210303 [0,1,0,0,0,0|3,0,0]=4 2278 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Br 62a_100000210303_100000183692 [0,1,0,0,0,0|3,0,0]=4 2279 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000217233 [0,1,0,0,0,0|3,0,0]=4 2280 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000217233 [0,1,0,0,0,0|3,0,0]=4 2281 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000217233 [0,1,0,0,0,0|3,0,0]=4 2282 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000217233 [0,1,0,0,0,0|3,0,0]=4 2283 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)C 62a_100000210303_100000182914 [0,1,0,0,0,0|3,0,0]=4 2284 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000217233 [0,1,0,0,0,0|3,0,0]=4 2285 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000217233 [0,1,0,0,0,0|3,0,0]=4 2286 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000217233 [0,1,0,0,0,0|3,0,0]=4 2287 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000217233 [0,1,0,0,0,0|3,0,0]=4 2288 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210303_100000182960 [0,1,0,0,0,0|3,0,0]=4 2289 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210303 [0,1,0,0,0,0|3,0,0]=4 2290 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000217233 [0,1,0,0,0,0|3,0,0]=4 2291 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000217233 [0,1,0,0,0,0|3,0,0]=4 2292 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000217233 [0,1,0,0,0,0|3,0,0]=4 2293 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000217233 [0,1,0,0,0,0|3,0,0]=4 2294 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 62a_100000210303_100000181725 [0,1,0,0,0,0|3,0,0]=4 2295 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)F 62a_200000243717_100000210303 [0,1,0,0,0,0|3,0,0]=4 2296 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000217233 [0,1,0,0,0,0|3,0,0]=4 2297 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000217233 [0,1,0,0,0,0|3,0,0]=4 2298 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000217233 [0,1,0,0,0,0|3,0,0]=4 2299 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000217233 [0,1,0,0,0,0|3,0,0]=4 2300 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 62a_100000183000_100000210303 [0,1,0,0,0,0|3,0,0]=4 2301 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)I 62a_100000210303_100000183000 [0,1,0,0,0,0|3,0,0]=4 2302 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000217233 [0,1,0,0,0,0|3,0,0]=4 2303 B15R1.128 CCCSCC(=O)Nc1ccc(cc1)O 62a_100000210303_100000233757 [0,1,0,0,0,0|3,0,0]=4 2304 B15R1.128 CCCSCC(=O)Oc1ccc(cc1)Br 62a_100000210303_200010760497 [0,1,0,0,0,0|3,0,0]=4 2305 B15R1.128 CCCSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_100000210303 [0,1,0,0,0,0|3,0,0]=4 2306 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 2230a_100000743120_100000210202 [0,1,0,0,0,0|3,0,0]=4 2307 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 2230a_100015525214_100000740023 [0,1,0,0,0,0|3,0,0]=4 2308 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Br 34a_100000743120_100000210202 [0,1,0,0,0,0|3,0,0]=4 2309 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)C 2230a_100015525214_200000187088 [0,1,0,0,0,0|3,0,0]=4 2310 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)C 34a_100015187665_100000210202 [0,1,0,0,0,0|3,0,0]=4 2311 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)Cl 2230a_100015525214_100000188356 [0,1,0,0,0,0|3,0,0]=4 2312 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 2230a_100015184513_100000210202 [0,1,0,0,0,0|3,0,0]=4 2313 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 2230a_100015525214_100000736363 [0,1,0,0,0,0|3,0,0]=4 2314 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)F 34a_100015184513_100000210202 [0,1,0,0,0,0|3,0,0]=4 2315 B15R1.128 CCNCCC(=O)Nc1ccc(cc1)O 2230a_100015525214_100011302330 [0,1,0,0,0,0|3,0,0]=4 2316 B15R1.128 CCOC=CC(=O)Cc1ccc(cc1)Br 1458a_100016266692_100000189115 [0,1,0,0,0,0|2,0,1]=4 2317 B15R1.128 CCOC=CC(=O)Cc1ccc(cc1)C 1458a_100016266692_100000210814 [0,1,0,0,0,0|2,0,1]=4 2318 B15R1.128 CCOC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016266692_100000694040 [0,1,0,0,0,0|2,0,1]=4 2319 B15R1.128 CCOC=CC(=O)Cc1ccc(cc1)F 1458a_100016266692_100000198546 [0,1,0,0,0,0|2,0,1]=4 2320 B15R1.128 CCOC=CC(=O)Cc1ccc(cc1)I 1458a_100016266692_100000189116 [0,1,0,0,0,0|2,0,1]=4 2321 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215890 [0,1,0,0,0,0|2,0,0]=3 2322 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Br 1458a_100000749530_100000189115 [0,1,0,0,0,0|2,0,0]=3 2323 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011215890 [0,1,0,0,0,0|2,0,0]=3 2324 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)C 1458a_100000749530_100000210814 [0,1,0,0,0,0|2,0,0]=3 2325 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215890 [0,1,0,0,0,0|2,0,0]=3 2326 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749530_100000694040 [0,1,0,0,0,0|2,0,0]=3 2327 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215890 [0,1,0,0,0,0|2,0,0]=3 2328 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)F 1458a_100000749530_100000198546 [0,1,0,0,0,0|2,0,0]=3 2329 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215890 [0,1,0,0,0,0|2,0,0]=3 2330 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)I 1458a_100000749530_100000189116 [0,1,0,0,0,0|2,0,0]=3 2331 B15R1.128 CCOCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215890 [0,1,0,0,0,0|2,0,0]=3 2332 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)Br 1458a_100000749530_100000702658 [0,1,0,0,0,0|3,0,0]=4 2333 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100011215890 [0,1,0,0,0,0|3,0,0]=4 2334 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)C 1458a_100000749530_100000691093 [0,1,0,0,0,0|3,0,0]=4 2335 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100011215890 [0,1,0,0,0,0|3,0,0]=4 2336 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100011215890 [0,1,0,0,0,0|3,0,0]=4 2337 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)Cl 1458a_100000749530_100012066911 [0,1,0,0,0,0|3,0,0]=4 2338 B15R1.128 CCOCCC(=O)Cc1ccc(cn1)F 1458a_100000749530_100000703193 [0,1,0,0,0,0|3,0,0]=4 2339 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)Br 1458a_100000749530_100009831999 [0,1,0,0,0,0|3,0,0]=4 2340 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100011215890 [0,1,0,0,0,0|3,0,0]=4 2341 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100011215890 [0,1,0,0,0,0|3,0,0]=4 2342 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)C 1458a_100000749530_100016987292 [0,1,0,0,0,0|3,0,0]=4 2343 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100011215890 [0,1,0,0,0,0|3,0,0]=4 2344 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)Cl 1458a_100000749530_100000735431 [0,1,0,0,0,0|3,0,0]=4 2345 B15R1.128 CCOCCC(=O)Cc1ccc(nc1)F 1458a_100000749530_100009820150 [0,1,0,0,0,0|3,0,0]=4 2346 B15R1.128 CCOCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100011215890 [0,1,0,0,0,0|3,0,0]=4 2347 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000749530 [0,1,0,0,0,0|3,0,0]=4 2348 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000749530 [0,1,0,0,0,0|3,0,0]=4 2349 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000749530 [0,1,0,0,0,0|3,0,0]=4 2350 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 34a_100121572206_100000740023 [0,1,0,0,0,0|3,0,0]=4 2351 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000749530 [0,1,0,0,0,0|3,0,0]=4 2352 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000749530 [0,1,0,0,0,0|3,0,0]=4 2353 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000749530 [0,1,0,0,0,0|3,0,0]=4 2354 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000749530 [0,1,0,0,0,0|3,0,0]=4 2355 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 34a_100121572206_200000187088 [0,1,0,0,0,0|3,0,0]=4 2356 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 34a_200009859269_100000210202 [0,1,0,0,0,0|3,0,0]=4 2357 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000749530 [0,1,0,0,0,0|3,0,0]=4 2358 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)C 7a_200009859269_100000210202 [0,1,0,0,0,0|3,0,0]=4 2359 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749530 [0,1,0,0,0,0|3,0,0]=4 2360 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749530 [0,1,0,0,0,0|3,0,0]=4 2361 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749530 [0,1,0,0,0,0|3,0,0]=4 2362 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749530 [0,1,0,0,0,0|3,0,0]=4 2363 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000749530 [0,1,0,0,0,0|3,0,0]=4 2364 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000749530 [0,1,0,0,0,0|3,0,0]=4 2365 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000749530 [0,1,0,0,0,0|3,0,0]=4 2366 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000749530 [0,1,0,0,0,0|3,0,0]=4 2367 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000749530 [0,1,0,0,0,0|3,0,0]=4 2368 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000749530 [0,1,0,0,0,0|3,0,0]=4 2369 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000749530 [0,1,0,0,0,0|3,0,0]=4 2370 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000749530 [0,1,0,0,0,0|3,0,0]=4 2371 B15R1.128 CCOCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000749530 [0,1,0,0,0,0|3,0,0]=4 2372 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000757381 [0,1,0,0,0,0|2,0,0]=3 2373 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Br 1458a_100000230768_100000189115 [0,1,0,0,0,0|2,0,0]=3 2374 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000757381 [0,1,0,0,0,0|2,0,0]=3 2375 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)C 1458a_100000230768_100000210814 [0,1,0,0,0,0|2,0,0]=3 2376 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000757381 [0,1,0,0,0,0|2,0,0]=3 2377 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000230768_100000694040 [0,1,0,0,0,0|2,0,0]=3 2378 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000757381 [0,1,0,0,0,0|2,0,0]=3 2379 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)F 1458a_100000230768_100000198546 [0,1,0,0,0,0|2,0,0]=3 2380 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)I 1458a_100000230768_100000189116 [0,1,0,0,0,0|2,0,0]=3 2381 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000757381 [0,1,0,0,0,0|2,0,0]=3 2382 B15R1.128 CCSCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000757381 [0,1,0,0,0,0|2,0,0]=3 2383 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)Br 1458a_100000230768_100000702658 [0,1,0,0,0,0|3,0,0]=4 2384 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000757381 [0,1,0,0,0,0|3,0,0]=4 2385 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)C 1458a_100000230768_100000691093 [0,1,0,0,0,0|3,0,0]=4 2386 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000757381 [0,1,0,0,0,0|3,0,0]=4 2387 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)Cl 1458a_100000230768_100012066911 [0,1,0,0,0,0|3,0,0]=4 2388 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000757381 [0,1,0,0,0,0|3,0,0]=4 2389 B15R1.128 CCSCCC(=O)Cc1ccc(cn1)F 1458a_100000230768_100000703193 [0,1,0,0,0,0|3,0,0]=4 2390 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)Br 1458a_100000230768_100009831999 [0,1,0,0,0,0|3,0,0]=4 2391 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000757381 [0,1,0,0,0,0|3,0,0]=4 2392 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)C 1458a_100000230768_100016987292 [0,1,0,0,0,0|3,0,0]=4 2393 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000757381 [0,1,0,0,0,0|3,0,0]=4 2394 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000757381 [0,1,0,0,0,0|3,0,0]=4 2395 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)Cl 1458a_100000230768_100000735431 [0,1,0,0,0,0|3,0,0]=4 2396 B15R1.128 CCSCCC(=O)Cc1ccc(nc1)F 1458a_100000230768_100009820150 [0,1,0,0,0,0|3,0,0]=4 2397 B15R1.128 CCSCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000757381 [0,1,0,0,0,0|3,0,0]=4 2398 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000230768 [0,1,0,0,0,0|3,0,0]=4 2399 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000230768 [0,1,0,0,0,0|3,0,0]=4 2400 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000230768 [0,1,0,0,0,0|3,0,0]=4 2401 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000230768 [0,1,0,0,0,0|3,0,0]=4 2402 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 62a_100000210202_100000740023 [0,1,0,0,0,0|3,0,0]=4 2403 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Br 62a_100011219129_100000210202 [0,1,0,0,0,0|3,0,0]=4 2404 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000230768 [0,1,0,0,0,0|3,0,0]=4 2405 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000230768 [0,1,0,0,0,0|3,0,0]=4 2406 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000230768 [0,1,0,0,0,0|3,0,0]=4 2407 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000230768 [0,1,0,0,0,0|3,0,0]=4 2408 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)C 62a_100000210202_200000187088 [0,1,0,0,0,0|3,0,0]=4 2409 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000230768 [0,1,0,0,0,0|3,0,0]=4 2410 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000230768 [0,1,0,0,0,0|3,0,0]=4 2411 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000230768 [0,1,0,0,0,0|3,0,0]=4 2412 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000230768 [0,1,0,0,0,0|3,0,0]=4 2413 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)Cl 62a_100000210202_100000188356 [0,1,0,0,0,0|3,0,0]=4 2414 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000230768 [0,1,0,0,0,0|3,0,0]=4 2415 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000230768 [0,1,0,0,0,0|3,0,0]=4 2416 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000230768 [0,1,0,0,0,0|3,0,0]=4 2417 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000230768 [0,1,0,0,0,0|3,0,0]=4 2418 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)F 62a_100000210202_100000736363 [0,1,0,0,0,0|3,0,0]=4 2419 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000230768 [0,1,0,0,0,0|3,0,0]=4 2420 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000230768 [0,1,0,0,0,0|3,0,0]=4 2421 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000230768 [0,1,0,0,0,0|3,0,0]=4 2422 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000230768 [0,1,0,0,0,0|3,0,0]=4 2423 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000230768 [0,1,0,0,0,0|3,0,0]=4 2424 B15R1.128 CCSCCC(=O)Nc1ccc(cc1)O 62a_100000210202_100011302330 [0,1,0,0,0,0|3,0,0]=4 2425 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)Br 34a_100102657272_100000190511 [0,1,0,0,0,0|3,0,0]=4 2426 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)Br 7a_106832991635_100000190511 [0,1,0,0,0,0|3,0,0]=4 2427 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 2230a_106832991635_200011194843 [0,1,0,0,0,0|3,0,0]=4 2428 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 34a_100102657272_200011194843 [0,1,0,0,0,0|3,0,0]=4 2429 B15R1.128 CNCCCC(=O)Nc1ccc(cc1)C 7a_106832991635_200011194843 [0,1,0,0,0,0|3,0,0]=4 2430 B15R1.128 CNCCNC(=O)Nc1ccc(cc1)F 2230a_106832991635_100000163319 [0,1,0,0,0,0|3,0,0]=4 2431 B15R1.128 CNCCNC(=O)Nc1ccc(cc1)F 7a_106832991635_100000163319 [0,1,0,0,0,0|3,0,0]=4 2432 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)Br 1458a_100016285016_100000189115 [0,1,0,0,0,0|2,0,1]=4 2433 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)C 1458a_100016285016_100000210814 [0,1,0,0,0,0|2,0,1]=4 2434 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016285016_100000694040 [0,1,0,0,0,0|2,0,1]=4 2435 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)F 1458a_100016285016_100000198546 [0,1,0,0,0,0|2,0,1]=4 2436 B15R1.128 COCC=CC(=O)Cc1ccc(cc1)I 1458a_100016285016_100000189116 [0,1,0,0,0,0|2,0,1]=4 2437 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000740836 [0,1,0,0,0,0|2,0,0]=3 2438 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Br 1458a_100000741012_100000189115 [0,1,0,0,0,0|2,0,0]=3 2439 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000740836 [0,1,0,0,0,0|2,0,0]=3 2440 B15R1.128 COCCCC(=O)Cc1ccc(cc1)C 1458a_100000741012_100000210814 [0,1,0,0,0,0|2,0,0]=3 2441 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000740836 [0,1,0,0,0,0|2,0,0]=3 2442 B15R1.128 COCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000741012_100000694040 [0,1,0,0,0,0|2,0,0]=3 2443 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000740836 [0,1,0,0,0,0|2,0,0]=3 2444 B15R1.128 COCCCC(=O)Cc1ccc(cc1)F 1458a_100000741012_100000198546 [0,1,0,0,0,0|2,0,0]=3 2445 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000740836 [0,1,0,0,0,0|2,0,0]=3 2446 B15R1.128 COCCCC(=O)Cc1ccc(cc1)I 1458a_100000741012_100000189116 [0,1,0,0,0,0|2,0,0]=3 2447 B15R1.128 COCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000740836 [0,1,0,0,0,0|2,0,0]=3 2448 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Br 1458a_100000741012_100000702658 [0,1,0,0,0,0|3,0,0]=4 2449 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000740836 [0,1,0,0,0,0|3,0,0]=4 2450 B15R1.128 COCCCC(=O)Cc1ccc(cn1)C 1458a_100000741012_100000691093 [0,1,0,0,0,0|3,0,0]=4 2451 B15R1.128 COCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000740836 [0,1,0,0,0,0|3,0,0]=4 2452 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000740836 [0,1,0,0,0,0|3,0,0]=4 2453 B15R1.128 COCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000741012_100012066911 [0,1,0,0,0,0|3,0,0]=4 2454 B15R1.128 COCCCC(=O)Cc1ccc(cn1)F 1458a_100000741012_100000703193 [0,1,0,0,0,0|3,0,0]=4 2455 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Br 1458a_100000741012_100009831999 [0,1,0,0,0,0|3,0,0]=4 2456 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000740836 [0,1,0,0,0,0|3,0,0]=4 2457 B15R1.128 COCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000740836 [0,1,0,0,0,0|3,0,0]=4 2458 B15R1.128 COCCCC(=O)Cc1ccc(nc1)C 1458a_100000741012_100016987292 [0,1,0,0,0,0|3,0,0]=4 2459 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000740836 [0,1,0,0,0,0|3,0,0]=4 2460 B15R1.128 COCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000741012_100000735431 [0,1,0,0,0,0|3,0,0]=4 2461 B15R1.128 COCCCC(=O)Cc1ccc(nc1)F 1458a_100000741012_100009820150 [0,1,0,0,0,0|3,0,0]=4 2462 B15R1.128 COCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000740836 [0,1,0,0,0,0|3,0,0]=4 2463 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000741012 [0,1,0,0,0,0|3,0,0]=4 2464 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000741012 [0,1,0,0,0,0|3,0,0]=4 2465 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000741012 [0,1,0,0,0,0|3,0,0]=4 2466 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000190511 [0,1,0,0,0,0|3,0,0]=4 2467 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000741012 [0,1,0,0,0,0|3,0,0]=4 2468 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000741012 [0,1,0,0,0,0|3,0,0]=4 2469 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000741012 [0,1,0,0,0,0|3,0,0]=4 2470 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000741012 [0,1,0,0,0,0|3,0,0]=4 2471 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 34a_100138415774_200011194843 [0,1,0,0,0,0|3,0,0]=4 2472 B15R1.128 COCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000741012 [0,1,0,0,0,0|3,0,0]=4 2473 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000741012 [0,1,0,0,0,0|3,0,0]=4 2474 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000741012 [0,1,0,0,0,0|3,0,0]=4 2475 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000741012 [0,1,0,0,0,0|3,0,0]=4 2476 B15R1.128 COCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000741012 [0,1,0,0,0,0|3,0,0]=4 2477 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000741012 [0,1,0,0,0,0|3,0,0]=4 2478 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000741012 [0,1,0,0,0,0|3,0,0]=4 2479 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000741012 [0,1,0,0,0,0|3,0,0]=4 2480 B15R1.128 COCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000741012 [0,1,0,0,0,0|3,0,0]=4 2481 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000741012 [0,1,0,0,0,0|3,0,0]=4 2482 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000741012 [0,1,0,0,0,0|3,0,0]=4 2483 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000741012 [0,1,0,0,0,0|3,0,0]=4 2484 B15R1.128 COCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000741012 [0,1,0,0,0,0|3,0,0]=4 2485 B15R1.128 COCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000741012 [0,1,0,0,0,0|3,0,0]=4 2486 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Br 240690a_100000209980_100000198978 [0,1,0,0,0,0|2,0,0]=3 2487 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Br 527a_100000209980_100000198978 [0,1,0,0,0,0|2,0,0]=3 2488 B15R1.128 COCCNC(=O)Cc1ccc(cc1)C 240690a_100000209980_100000212244 [0,1,0,0,0,0|2,0,0]=3 2489 B15R1.128 COCCNC(=O)Cc1ccc(cc1)C 527a_100000209980_100000212244 [0,1,0,0,0,0|2,0,0]=3 2490 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000209980_100000211027 [0,1,0,0,0,0|2,0,0]=3 2491 B15R1.128 COCCNC(=O)Cc1ccc(cc1)Cl 527a_100000209980_100000211027 [0,1,0,0,0,0|2,0,0]=3 2492 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 1626a_100000209980_100000210951 [0,1,0,0,0,0|2,0,0]=3 2493 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 240690a_100000209980_100000210951 [0,1,0,0,0,0|2,0,0]=3 2494 B15R1.128 COCCNC(=O)Cc1ccc(cc1)F 527a_100000209980_100000210951 [0,1,0,0,0,0|2,0,0]=3 2495 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 1626a_100000209980_100000688869 [0,1,0,0,0,0|2,0,0]=3 2496 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 240690a_100000209980_100000688869 [0,1,0,0,0,0|2,0,0]=3 2497 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I 527a_100000209980_100000688869 [0,1,0,0,0,0|2,0,0]=3 2498 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 1626a_100000209980_100000198540 [0,1,0,0,0,0|2,0,0]=3 2499 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 240690a_100000209980_100000198540 [0,1,0,0,0,0|2,0,0]=3 2500 B15R1.128 COCCNC(=O)Cc1ccc(cc1)O 527a_100000209980_100000198540 [0,1,0,0,0,0|2,0,0]=3 2501 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Br 240690a_100000209980_100020629044 [0,1,0,0,0,0|3,0,0]=4 2502 B15R1.128 COCCNC(=O)Cc1ccc(cn1)C 1626a_100000209980_100025705728 [0,1,0,0,0,0|3,0,0]=4 2503 B15R1.128 COCCNC(=O)Cc1ccc(cn1)C 240690a_100000209980_100025705728 [0,1,0,0,0,0|3,0,0]=4 2504 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000209980_100000728320 [0,1,0,0,0,0|3,0,0]=4 2505 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000209980_100000728320 [0,1,0,0,0,0|3,0,0]=4 2506 B15R1.128 COCCNC(=O)Cc1ccc(cn1)Cl 527a_100000209980_100000728320 [0,1,0,0,0,0|3,0,0]=4 2507 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Br 240690a_100000209980_100010067268 [0,1,0,0,0,0|3,0,0]=4 2508 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Br 527a_100000209980_100010067268 [0,1,0,0,0,0|3,0,0]=4 2509 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 1626a_100000209980_100000740413 [0,1,0,0,0,0|3,0,0]=4 2510 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 240690a_100000209980_100000740413 [0,1,0,0,0,0|3,0,0]=4 2511 B15R1.128 COCCNC(=O)Cc1ccc(nc1)C 527a_100000209980_100000740413 [0,1,0,0,0,0|3,0,0]=4 2512 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000209980_100000061944 [0,1,0,0,0,0|3,0,0]=4 2513 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000209980_100000061944 [0,1,0,0,0,0|3,0,0]=4 2514 B15R1.128 COCCNC(=O)Cc1ccc(nc1)Cl 527a_100000209980_100000061944 [0,1,0,0,0,0|3,0,0]=4 2515 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 1626a_100000209980_200000238563 [0,1,0,0,0,0|3,0,0]=4 2516 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 240690a_100000209980_200000238563 [0,1,0,0,0,0|3,0,0]=4 2517 B15R1.128 COCCNC(=O)Cn1ccc(=O)cc1 527a_100000209980_200000238563 [0,1,0,0,0,0|3,0,0]=4 2518 B15R1.128 COCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000209980 [0,1,0,0,0,0|3,0,0]=4 2519 B15R1.128 COCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000209980 [0,1,0,0,0,0|3,0,0]=4 2520 B15R1.128 COCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000209980 [0,1,0,0,0,0|3,0,0]=4 2521 B15R1.128 COCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000209980 [0,1,0,0,0,0|3,0,0]=4 2522 B15R1.128 COCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000209980 [0,1,0,0,0,0|3,0,0]=4 2523 B15R1.128 COCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000209980 [0,1,0,0,0,0|3,0,0]=4 2524 B15R1.128 COCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200009814598 [0,1,0,0,0,0|3,0,0]=4 2525 B15R1.128 COCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100011201679 [0,1,0,0,0,0|2,0,1]=4 2526 B15R1.128 COCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000233755 [0,1,0,0,0,0|2,0,1]=4 2527 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)Br 1458a_100000173376_100000189115 [0,1,0,0,0,0|2,0,0]=3 2528 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)C 1458a_100000173376_100000210814 [0,1,0,0,0,0|2,0,0]=3 2529 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000173376_100000694040 [0,1,0,0,0,0|2,0,0]=3 2530 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)F 1458a_100000173376_100000198546 [0,1,0,0,0,0|2,0,0]=3 2531 B15R1.128 CSCCCC(=O)Cc1ccc(cc1)I 1458a_100000173376_100000189116 [0,1,0,0,0,0|2,0,0]=3 2532 B15R1.128 CSCCCC(=O)Cc1ccc(cn1)Br 1458a_100000173376_100000702658 [0,1,0,0,0,0|3,0,0]=4 2533 B15R1.128 CSCCCC(=O)Cc1ccc(cn1)C 1458a_100000173376_100000691093 [0,1,0,0,0,0|3,0,0]=4 2534 B15R1.128 CSCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000173376_100012066911 [0,1,0,0,0,0|3,0,0]=4 2535 B15R1.128 CSCCCC(=O)Cc1ccc(cn1)F 1458a_100000173376_100000703193 [0,1,0,0,0,0|3,0,0]=4 2536 B15R1.128 CSCCCC(=O)Cc1ccc(nc1)Br 1458a_100000173376_100009831999 [0,1,0,0,0,0|3,0,0]=4 2537 B15R1.128 CSCCCC(=O)Cc1ccc(nc1)C 1458a_100000173376_100016987292 [0,1,0,0,0,0|3,0,0]=4 2538 B15R1.128 CSCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000173376_100000735431 [0,1,0,0,0,0|3,0,0]=4 2539 B15R1.128 CSCCCC(=O)Cc1ccc(nc1)F 1458a_100000173376_100009820150 [0,1,0,0,0,0|3,0,0]=4 2540 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000173376 [0,1,0,0,0,0|3,0,0]=4 2541 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000173376 [0,1,0,0,0,0|3,0,0]=4 2542 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000173376 [0,1,0,0,0,0|3,0,0]=4 2543 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000173376 [0,1,0,0,0,0|3,0,0]=4 2544 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Br 62a_200000210301_100000190511 [0,1,0,0,0,0|3,0,0]=4 2545 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000173376 [0,1,0,0,0,0|3,0,0]=4 2546 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000173376 [0,1,0,0,0,0|3,0,0]=4 2547 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000173376 [0,1,0,0,0,0|3,0,0]=4 2548 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000173376 [0,1,0,0,0,0|3,0,0]=4 2549 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)C 62a_200000210301_200011194843 [0,1,0,0,0,0|3,0,0]=4 2550 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000173376 [0,1,0,0,0,0|3,0,0]=4 2551 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000173376 [0,1,0,0,0,0|3,0,0]=4 2552 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000173376 [0,1,0,0,0,0|3,0,0]=4 2553 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000173376 [0,1,0,0,0,0|3,0,0]=4 2554 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000173376 [0,1,0,0,0,0|3,0,0]=4 2555 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000173376 [0,1,0,0,0,0|3,0,0]=4 2556 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000173376 [0,1,0,0,0,0|3,0,0]=4 2557 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000173376 [0,1,0,0,0,0|3,0,0]=4 2558 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000173376 [0,1,0,0,0,0|3,0,0]=4 2559 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000173376 [0,1,0,0,0,0|3,0,0]=4 2560 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000173376 [0,1,0,0,0,0|3,0,0]=4 2561 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000173376 [0,1,0,0,0,0|3,0,0]=4 2562 B15R1.128 CSCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000173376 [0,1,0,0,0,0|3,0,0]=4 2563 B15R1.128 CSCCCC(=O)Oc1ccc(cc1)F 62a_200000210301_100000010882 [0,1,0,0,0,0|3,0,0]=4 2564 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 11a_100020590264_100000198978 [0,1,0,0,0,0|2,0,0]=3 2565 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 240690a_100020590264_100000198978 [0,1,0,0,0,0|2,0,0]=3 2566 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Br 527a_100020590264_100000198978 [0,1,0,0,0,0|2,0,0]=3 2567 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 11a_100020590264_100000212244 [0,1,0,0,0,0|2,0,0]=3 2568 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 240690a_100020590264_100000212244 [0,1,0,0,0,0|2,0,0]=3 2569 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)C 527a_100020590264_100000212244 [0,1,0,0,0,0|2,0,0]=3 2570 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 11a_100020590264_100000211027 [0,1,0,0,0,0|2,0,0]=3 2571 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 240690a_100020590264_100000211027 [0,1,0,0,0,0|2,0,0]=3 2572 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl 527a_100020590264_100000211027 [0,1,0,0,0,0|2,0,0]=3 2573 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 11a_100020590264_100000210951 [0,1,0,0,0,0|2,0,0]=3 2574 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 1626a_100020590264_100000210951 [0,1,0,0,0,0|2,0,0]=3 2575 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 240690a_100020590264_100000210951 [0,1,0,0,0,0|2,0,0]=3 2576 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)F 527a_100020590264_100000210951 [0,1,0,0,0,0|2,0,0]=3 2577 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 11a_100020590264_100000688869 [0,1,0,0,0,0|2,0,0]=3 2578 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 1626a_100020590264_100000688869 [0,1,0,0,0,0|2,0,0]=3 2579 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 240690a_100020590264_100000688869 [0,1,0,0,0,0|2,0,0]=3 2580 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)I 527a_100020590264_100000688869 [0,1,0,0,0,0|2,0,0]=3 2581 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 1626a_100020590264_100000198540 [0,1,0,0,0,0|2,0,0]=3 2582 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 240690a_100020590264_100000198540 [0,1,0,0,0,0|2,0,0]=3 2583 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O 527a_100020590264_100000198540 [0,1,0,0,0,0|2,0,0]=3 2584 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Br 11a_100020590264_100020629044 [0,1,0,0,0,0|3,0,0]=4 2585 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Br 240690a_100020590264_100020629044 [0,1,0,0,0,0|3,0,0]=4 2586 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)C 11a_100020590264_100025705728 [0,1,0,0,0,0|3,0,0]=4 2587 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)C 1626a_100020590264_100025705728 [0,1,0,0,0,0|3,0,0]=4 2588 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)C 240690a_100020590264_100025705728 [0,1,0,0,0,0|3,0,0]=4 2589 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 11a_100020590264_100000728320 [0,1,0,0,0,0|3,0,0]=4 2590 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 1626a_100020590264_100000728320 [0,1,0,0,0,0|3,0,0]=4 2591 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 240690a_100020590264_100000728320 [0,1,0,0,0,0|3,0,0]=4 2592 B15R1.128 CSCCNC(=O)Cc1ccc(cn1)Cl 527a_100020590264_100000728320 [0,1,0,0,0,0|3,0,0]=4 2593 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Br 11a_100020590264_100010067268 [0,1,0,0,0,0|3,0,0]=4 2594 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Br 240690a_100020590264_100010067268 [0,1,0,0,0,0|3,0,0]=4 2595 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Br 527a_100020590264_100010067268 [0,1,0,0,0,0|3,0,0]=4 2596 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C 11a_100020590264_100000740413 [0,1,0,0,0,0|3,0,0]=4 2597 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C 1626a_100020590264_100000740413 [0,1,0,0,0,0|3,0,0]=4 2598 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C 240690a_100020590264_100000740413 [0,1,0,0,0,0|3,0,0]=4 2599 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)C 527a_100020590264_100000740413 [0,1,0,0,0,0|3,0,0]=4 2600 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 11a_100020590264_100000061944 [0,1,0,0,0,0|3,0,0]=4 2601 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 1626a_100020590264_100000061944 [0,1,0,0,0,0|3,0,0]=4 2602 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 240690a_100020590264_100000061944 [0,1,0,0,0,0|3,0,0]=4 2603 B15R1.128 CSCCNC(=O)Cc1ccc(nc1)Cl 527a_100020590264_100000061944 [0,1,0,0,0,0|3,0,0]=4 2604 B15R1.128 CSCCNC(=O)Cn1ccc(=O)cc1 11a_100020590264_200000238563 [0,1,0,0,0,0|3,0,0]=4 2605 B15R1.128 CSCCNC(=O)Cn1ccc(=O)cc1 1626a_100020590264_200000238563 [0,1,0,0,0,0|3,0,0]=4 2606 B15R1.128 CSCCNC(=O)Cn1ccc(=O)cc1 240690a_100020590264_200000238563 [0,1,0,0,0,0|3,0,0]=4 2607 B15R1.128 CSCCNC(=O)Cn1ccc(=O)cc1 527a_100020590264_200000238563 [0,1,0,0,0,0|3,0,0]=4 2608 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020590264 [0,1,0,0,0,0|3,0,0]=4 2609 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020590264 [0,1,0,0,0,0|3,0,0]=4 2610 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020590264 [0,1,0,0,0,0|3,0,0]=4 2611 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020590264 [0,1,0,0,0,0|3,0,0]=4 2612 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)F 62a_200000210301_100000163319 [0,1,0,0,0,0|3,0,0]=4 2613 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020590264 [0,1,0,0,0,0|3,0,0]=4 2614 B15R1.128 CSCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020590264 [0,1,0,0,0,0|3,0,0]=4 2615 B15R1.128 CSCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000212216 [0,1,0,0,0,0|2,0,1]=4 2616 B15R1.128 CSCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000212216 [0,1,0,0,0,0|2,0,1]=4 2617 B15R1.128 Cc1ccc(cc1)CC(=O)CCCC#N 1458a_100000075515_100000210814 [0,1,0,0,0,0|2,0,1]=4 2618 B15R1.128 Cc1ccc(cc1)CC(=O)CCCC#N 1458a_100000212244_100000211468 [0,1,0,0,0,0|2,0,1]=4 2619 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCF 1458a_100000212244_100000729493 [0,1,0,0,0,0|2,0,0]=3 2620 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000212244_100000210776 [0,1,0,0,0,0|2,0,0]=3 2621 B15R1.128 Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000210814 [0,1,0,0,0,0|2,0,0]=3 2622 B15R1.128 Cc1ccc(cc1)CC(=O)COCCO 1458a_100000708028_100000210814 [0,1,0,0,0,0|3,0,0]=4 2623 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 11a_100000720768_100000212244 [0,1,0,0,0,0|2,0,1]=4 2624 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 240690a_100000720768_100000212244 [0,1,0,0,0,0|2,0,1]=4 2625 B15R1.128 Cc1ccc(cc1)CC(=O)NCCC#N 527a_100000720768_100000212244 [0,1,0,0,0,0|2,0,1]=4 2626 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_100000212244 [0,1,0,0,0,0|2,0,0]=3 2627 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_100000212244 [0,1,0,0,0,0|2,0,0]=3 2628 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_100000212244 [0,1,0,0,0,0|2,0,0]=3 2629 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_100000212244 [0,1,0,0,0,0|2,0,0]=3 2630 B15R1.128 Cc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_100000212244 [0,1,0,0,0,0|2,0,0]=3 2631 B15R1.128 Cc1ccc(cc1)CC(=O)NNCCO 22a_100000210001_100000212244 [0,1,0,0,0,0|3,0,0]=4 2632 B15R1.128 Cc1ccc(cc1)NC(=O)CCCCO 1626a_100000124888_100000695505 [0,1,0,0,0,0|3,0,0]=4 2633 B15R1.128 Cc1ccc(cc1)NC(=O)CCCS[13CH3] 62a_200025704644_200011194843 [0,1,0,0,0,0|3,0,0]=4 2634 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCF 2430a_100000124888_100015189416 [0,1,0,0,0,0|3,0,0]=4 2635 B15R1.128 Cc1ccc(cc1)NC(=O)NCCCO 2430a_100000124888_100000182051 [0,1,0,0,0,0|3,0,0]=4 2636 B15R1.128 Cc1ccc(cn1)CC(=O)CCCCF 1458a_100000740413_100000729493 [0,1,0,0,0,0|3,0,0]=4 2637 B15R1.128 Cc1ccc(cn1)CC(=O)CCCCO 1458a_100000695505_100016987292 [0,1,0,0,0,0|3,0,0]=4 2638 B15R1.128 Cc1ccc(cn1)CC(=O)CCCCO 1458a_100000740413_100000210776 [0,1,0,0,0,0|3,0,0]=4 2639 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCF 11a_100015189416_100000740413 [0,1,0,0,0,0|3,0,0]=4 2640 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCF 1626a_100015189416_100000740413 [0,1,0,0,0,0|3,0,0]=4 2641 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCF 240690a_100015189416_100000740413 [0,1,0,0,0,0|3,0,0]=4 2642 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCF 527a_100015189416_100000740413 [0,1,0,0,0,0|3,0,0]=4 2643 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO 240690a_100000182051_100000740413 [0,1,0,0,0,0|3,0,0]=4 2644 B15R1.128 Cc1ccc(cn1)CC(=O)NCCCO 527a_100000182051_100000740413 [0,1,0,0,0,0|3,0,0]=4 2645 B15R1.128 Cc1ccc(nc1)CC(=O)CCCCF 1458a_100025705728_100000729493 [0,1,0,0,0,0|3,0,0]=4 2646 B15R1.128 Cc1ccc(nc1)CC(=O)CCCCO 1458a_100000695505_100000691093 [0,1,0,0,0,0|3,0,0]=4 2647 B15R1.128 Cc1ccc(nc1)CC(=O)CCCCO 1458a_100025705728_100000210776 [0,1,0,0,0,0|3,0,0]=4 2648 B15R1.128 Cc1ccc(nc1)CC(=O)NCCCF 11a_100015189416_100025705728 [0,1,0,0,0,0|3,0,0]=4 2649 B15R1.128 Cc1ccc(nc1)CC(=O)NCCCF 1626a_100015189416_100025705728 [0,1,0,0,0,0|3,0,0]=4 2650 B15R1.128 Cc1ccc(nc1)CC(=O)NCCCF 240690a_100015189416_100025705728 [0,1,0,0,0,0|3,0,0]=4 2651 B15R1.128 Cc1ccc(nc1)CC(=O)NCCCO 240690a_100000182051_100025705728 [0,1,0,0,0,0|3,0,0]=4 2652 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000075515_100000189115 [0,1,0,0,0,0|2,0,1]=4 2653 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000211468 [0,1,0,0,0,0|2,0,1]=4 2654 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000075515_100000694040 [0,1,0,0,0,0|2,0,1]=4 2655 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000211468 [0,1,0,0,0,0|2,0,1]=4 2656 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)F 1458a_100000075515_100000198546 [0,1,0,0,0,0|2,0,1]=4 2657 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000211468 [0,1,0,0,0,0|2,0,1]=4 2658 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)I 1458a_100000075515_100000189116 [0,1,0,0,0,0|2,0,1]=4 2659 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000211468 [0,1,0,0,0,0|2,0,1]=4 2660 B15R1.128 N#CCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000211468 [0,1,0,0,0,0|2,0,1]=4 2661 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 11a_100000720768_100000198978 [0,1,0,0,0,0|2,0,1]=4 2662 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 240690a_100000720768_100000198978 [0,1,0,0,0,0|2,0,1]=4 2663 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Br 527a_100000720768_100000198978 [0,1,0,0,0,0|2,0,1]=4 2664 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 11a_100000720768_100000211027 [0,1,0,0,0,0|2,0,1]=4 2665 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000720768_100000211027 [0,1,0,0,0,0|2,0,1]=4 2666 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)Cl 527a_100000720768_100000211027 [0,1,0,0,0,0|2,0,1]=4 2667 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 11a_100000720768_100000210951 [0,1,0,0,0,0|2,0,1]=4 2668 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 1626a_100000720768_100000210951 [0,1,0,0,0,0|2,0,1]=4 2669 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 240690a_100000720768_100000210951 [0,1,0,0,0,0|2,0,1]=4 2670 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)F 527a_100000720768_100000210951 [0,1,0,0,0,0|2,0,1]=4 2671 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 11a_100000720768_100000688869 [0,1,0,0,0,0|2,0,1]=4 2672 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 1626a_100000720768_100000688869 [0,1,0,0,0,0|2,0,1]=4 2673 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 240690a_100000720768_100000688869 [0,1,0,0,0,0|2,0,1]=4 2674 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)I 527a_100000720768_100000688869 [0,1,0,0,0,0|2,0,1]=4 2675 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 1626a_100000720768_100000198540 [0,1,0,0,0,0|2,0,1]=4 2676 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 240690a_100000720768_100000198540 [0,1,0,0,0,0|2,0,1]=4 2677 B15R1.128 N#CCCNC(=O)Cc1ccc(cc1)O 527a_100000720768_100000198540 [0,1,0,0,0,0|2,0,1]=4 2678 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)Br 1458a_100000198978_100000729493 [0,1,0,0,0,0|2,0,0]=3 2679 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100000729493 [0,1,0,0,0,0|2,0,0]=3 2680 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)F 1458a_100000210951_100000729493 [0,1,0,0,0,0|2,0,0]=3 2681 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)I 1458a_100000688869_100000729493 [0,1,0,0,0,0|2,0,0]=3 2682 B15R1.128 O=C(CCCCF)Cc1ccc(cc1)O 1458a_100000198540_100000729493 [0,1,0,0,0,0|2,0,0]=3 2683 B15R1.128 O=C(CCCCF)Cc1ccc(cn1)Br 1458a_100020629044_100000729493 [0,1,0,0,0,0|3,0,0]=4 2684 B15R1.128 O=C(CCCCF)Cc1ccc(cn1)Cl 1458a_100000728320_100000729493 [0,1,0,0,0,0|3,0,0]=4 2685 B15R1.128 O=C(CCCCF)Cc1ccc(nc1)Br 1458a_100010067268_100000729493 [0,1,0,0,0,0|3,0,0]=4 2686 B15R1.128 O=C(CCCCF)Cc1ccc(nc1)Cl 1458a_100000061944_100000729493 [0,1,0,0,0,0|3,0,0]=4 2687 B15R1.128 O=C(CCCCF)Cn1ccc(=O)cc1 1458a_200000238563_100000729493 [0,1,0,0,0,0|3,0,0]=4 2688 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000198978_100000210776 [0,1,0,0,0,0|2,0,0]=3 2689 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Br 1458a_100000695505_100000189115 [0,1,0,0,0,0|2,0,0]=3 2690 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000210776 [0,1,0,0,0,0|2,0,0]=3 2691 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)Cl 1458a_100000695505_100000694040 [0,1,0,0,0,0|2,0,0]=3 2692 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000210951_100000210776 [0,1,0,0,0,0|2,0,0]=3 2693 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)F 1458a_100000695505_100000198546 [0,1,0,0,0,0|2,0,0]=3 2694 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000688869_100000210776 [0,1,0,0,0,0|2,0,0]=3 2695 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)I 1458a_100000695505_100000189116 [0,1,0,0,0,0|2,0,0]=3 2696 B15R1.128 O=C(CCCCO)Cc1ccc(cc1)O 1458a_100000198540_100000210776 [0,1,0,0,0,0|2,0,0]=3 2697 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Br 1458a_100000695505_100000702658 [0,1,0,0,0,0|3,0,0]=4 2698 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Br 1458a_100020629044_100000210776 [0,1,0,0,0,0|3,0,0]=4 2699 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Cl 1458a_100000695505_100012066911 [0,1,0,0,0,0|3,0,0]=4 2700 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)Cl 1458a_100000728320_100000210776 [0,1,0,0,0,0|3,0,0]=4 2701 B15R1.128 O=C(CCCCO)Cc1ccc(cn1)F 1458a_100000695505_100000703193 [0,1,0,0,0,0|3,0,0]=4 2702 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Br 1458a_100000695505_100009831999 [0,1,0,0,0,0|3,0,0]=4 2703 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Br 1458a_100010067268_100000210776 [0,1,0,0,0,0|3,0,0]=4 2704 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Cl 1458a_100000061944_100000210776 [0,1,0,0,0,0|3,0,0]=4 2705 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)Cl 1458a_100000695505_100000735431 [0,1,0,0,0,0|3,0,0]=4 2706 B15R1.128 O=C(CCCCO)Cc1ccc(nc1)F 1458a_100000695505_100009820150 [0,1,0,0,0,0|3,0,0]=4 2707 B15R1.128 O=C(CCCCO)Cn1ccc(=O)cc1 1458a_200000238563_100000210776 [0,1,0,0,0,0|3,0,0]=4 2708 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Br 1626a_100000210018_100000695505 [0,1,0,0,0,0|3,0,0]=4 2709 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)Cl 1626a_100000210052_100000695505 [0,1,0,0,0,0|3,0,0]=4 2710 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)F 1626a_100000185862_100000695505 [0,1,0,0,0,0|3,0,0]=4 2711 B15R1.128 O=C(CCCCO)Nc1ccc(cc1)I 1626a_100000185761_100000695505 [0,1,0,0,0,0|3,0,0]=4 2712 B15R1.128 O=C(COCCO)Cc1ccc(cc1)Br 1458a_100000708028_100000189115 [0,1,0,0,0,0|3,0,0]=4 2713 B15R1.128 O=C(COCCO)Cc1ccc(cc1)Cl 1458a_100000708028_100000694040 [0,1,0,0,0,0|3,0,0]=4 2714 B15R1.128 O=C(COCCO)Cc1ccc(cc1)F 1458a_100000708028_100000198546 [0,1,0,0,0,0|3,0,0]=4 2715 B15R1.128 O=C(COCCO)Cc1ccc(cc1)I 1458a_100000708028_100000189116 [0,1,0,0,0,0|3,0,0]=4 2716 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 11a_100015189416_100000198978 [0,1,0,0,0,0|2,0,0]=3 2717 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 240690a_100015189416_100000198978 [0,1,0,0,0,0|2,0,0]=3 2718 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCF 527a_100015189416_100000198978 [0,1,0,0,0,0|2,0,0]=3 2719 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO 240690a_100000182051_100000198978 [0,1,0,0,0,0|2,0,0]=3 2720 B15R1.128 O=C(Cc1ccc(cc1)Br)NCCCO 527a_100000182051_100000198978 [0,1,0,0,0,0|2,0,0]=3 2721 B15R1.128 O=C(Cc1ccc(cc1)Br)NNCCO 22a_100000210001_100000198978 [0,1,0,0,0,0|3,0,0]=4 2722 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 11a_100015189416_100000211027 [0,1,0,0,0,0|2,0,0]=3 2723 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 240690a_100015189416_100000211027 [0,1,0,0,0,0|2,0,0]=3 2724 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCF 527a_100015189416_100000211027 [0,1,0,0,0,0|2,0,0]=3 2725 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO 240690a_100000182051_100000211027 [0,1,0,0,0,0|2,0,0]=3 2726 B15R1.128 O=C(Cc1ccc(cc1)Cl)NCCCO 527a_100000182051_100000211027 [0,1,0,0,0,0|2,0,0]=3 2727 B15R1.128 O=C(Cc1ccc(cc1)Cl)NNCCO 22a_100000210001_100000211027 [0,1,0,0,0,0|3,0,0]=4 2728 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 11a_100015189416_100000210951 [0,1,0,0,0,0|2,0,0]=3 2729 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 1626a_100015189416_100000210951 [0,1,0,0,0,0|2,0,0]=3 2730 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 240690a_100015189416_100000210951 [0,1,0,0,0,0|2,0,0]=3 2731 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCF 527a_100015189416_100000210951 [0,1,0,0,0,0|2,0,0]=3 2732 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO 240690a_100000182051_100000210951 [0,1,0,0,0,0|2,0,0]=3 2733 B15R1.128 O=C(Cc1ccc(cc1)F)NCCCO 527a_100000182051_100000210951 [0,1,0,0,0,0|2,0,0]=3 2734 B15R1.128 O=C(Cc1ccc(cc1)F)NNCCO 22a_100000210001_100000210951 [0,1,0,0,0,0|3,0,0]=4 2735 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 11a_100015189416_100000688869 [0,1,0,0,0,0|2,0,0]=3 2736 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 1626a_100015189416_100000688869 [0,1,0,0,0,0|2,0,0]=3 2737 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 240690a_100015189416_100000688869 [0,1,0,0,0,0|2,0,0]=3 2738 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCF 527a_100015189416_100000688869 [0,1,0,0,0,0|2,0,0]=3 2739 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCO 240690a_100000182051_100000688869 [0,1,0,0,0,0|2,0,0]=3 2740 B15R1.128 O=C(Cc1ccc(cc1)I)NCCCO 527a_100000182051_100000688869 [0,1,0,0,0,0|2,0,0]=3 2741 B15R1.128 O=C(Cc1ccc(cc1)I)NNCCO 22a_100000210001_100000688869 [0,1,0,0,0,0|3,0,0]=4 2742 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 1626a_100015189416_100000198540 [0,1,0,0,0,0|2,0,0]=3 2743 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 240690a_100015189416_100000198540 [0,1,0,0,0,0|2,0,0]=3 2744 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCF 527a_100015189416_100000198540 [0,1,0,0,0,0|2,0,0]=3 2745 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO 240690a_100000182051_100000198540 [0,1,0,0,0,0|2,0,0]=3 2746 B15R1.128 O=C(Cc1ccc(cc1)O)NCCCO 527a_100000182051_100000198540 [0,1,0,0,0,0|2,0,0]=3 2747 B15R1.128 O=C(Cc1ccc(cc1)O)NNCCO 22a_100000210001_100000198540 [0,1,0,0,0,0|3,0,0]=4 2748 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCF 11a_100015189416_100020629044 [0,1,0,0,0,0|3,0,0]=4 2749 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCF 240690a_100015189416_100020629044 [0,1,0,0,0,0|3,0,0]=4 2750 B15R1.128 O=C(Cc1ccc(cn1)Br)NCCCO 240690a_100000182051_100020629044 [0,1,0,0,0,0|3,0,0]=4 2751 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 11a_100015189416_100000728320 [0,1,0,0,0,0|3,0,0]=4 2752 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 1626a_100015189416_100000728320 [0,1,0,0,0,0|3,0,0]=4 2753 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 240690a_100015189416_100000728320 [0,1,0,0,0,0|3,0,0]=4 2754 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCF 527a_100015189416_100000728320 [0,1,0,0,0,0|3,0,0]=4 2755 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO 240690a_100000182051_100000728320 [0,1,0,0,0,0|3,0,0]=4 2756 B15R1.128 O=C(Cc1ccc(cn1)Cl)NCCCO 527a_100000182051_100000728320 [0,1,0,0,0,0|3,0,0]=4 2757 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCF 11a_100015189416_100010067268 [0,1,0,0,0,0|3,0,0]=4 2758 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCF 240690a_100015189416_100010067268 [0,1,0,0,0,0|3,0,0]=4 2759 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCF 527a_100015189416_100010067268 [0,1,0,0,0,0|3,0,0]=4 2760 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO 240690a_100000182051_100010067268 [0,1,0,0,0,0|3,0,0]=4 2761 B15R1.128 O=C(Cc1ccc(nc1)Br)NCCCO 527a_100000182051_100010067268 [0,1,0,0,0,0|3,0,0]=4 2762 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 11a_100015189416_100000061944 [0,1,0,0,0,0|3,0,0]=4 2763 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 1626a_100015189416_100000061944 [0,1,0,0,0,0|3,0,0]=4 2764 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 240690a_100015189416_100000061944 [0,1,0,0,0,0|3,0,0]=4 2765 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCF 527a_100015189416_100000061944 [0,1,0,0,0,0|3,0,0]=4 2766 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCO 240690a_100000182051_100000061944 [0,1,0,0,0,0|3,0,0]=4 2767 B15R1.128 O=C(Cc1ccc(nc1)Cl)NCCCO 527a_100000182051_100000061944 [0,1,0,0,0,0|3,0,0]=4 2768 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCF 11a_100015189416_200000238563 [0,1,0,0,0,0|3,0,0]=4 2769 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCF 1626a_100015189416_200000238563 [0,1,0,0,0,0|3,0,0]=4 2770 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCF 240690a_100015189416_200000238563 [0,1,0,0,0,0|3,0,0]=4 2771 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCF 527a_100015189416_200000238563 [0,1,0,0,0,0|3,0,0]=4 2772 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCO 240690a_100000182051_200000238563 [0,1,0,0,0,0|3,0,0]=4 2773 B15R1.128 O=C(Cn1ccc(=O)cc1)NCCCO 527a_100000182051_200000238563 [0,1,0,0,0,0|3,0,0]=4 2774 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)Br 2430a_100000210018_100015189416 [0,1,0,0,0,0|3,0,0]=4 2775 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)Cl 2430a_100000210052_100015189416 [0,1,0,0,0,0|3,0,0]=4 2776 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)F 2430a_100000185862_100015189416 [0,1,0,0,0,0|3,0,0]=4 2777 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)I 2430a_100000185761_100015189416 [0,1,0,0,0,0|3,0,0]=4 2778 B15R1.128 O=C(NCCCF)Nc1ccc(cc1)O 2430a_100000185829_100015189416 [0,1,0,0,0,0|3,0,0]=4 2779 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Br 2430a_100000210018_100000182051 [0,1,0,0,0,0|3,0,0]=4 2780 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)Cl 2430a_100000210052_100000182051 [0,1,0,0,0,0|3,0,0]=4 2781 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)F 2430a_100000185862_100000182051 [0,1,0,0,0,0|3,0,0]=4 2782 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)I 2430a_100000185761_100000182051 [0,1,0,0,0,0|3,0,0]=4 2783 B15R1.128 O=C(NCCCO)Nc1ccc(cc1)O 2430a_100000185829_100000182051 [0,1,0,0,0,0|3,0,0]=4 2784 B15R1.128 [13CH3]SCCCC(=O)Nc1ccc(cc1)Br 62a_200025704644_100000190511 [0,1,0,0,0,0|3,0,0]=4 2785 B15R1.128 [13CH3]SCCCC(=O)Oc1ccc(cc1)F 62a_200025704644_100000010882 [0,1,0,0,0,0|3,0,0]=4 2786 B15R1.128 [13CH3]SCCNC(=O)Nc1ccc(cc1)F 62a_200025704644_100000163319 [0,1,0,0,0,0|3,0,0]=4 2787 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)Br 1458a_100000690238_100000211773 [0,1,0,0,0,0|1,0,2]=4 2788 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000731252 [0,1,0,0,0,0|1,0,2]=4 2789 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)C 1458a_100000690238_100000211840 [0,1,0,0,0,0|1,0,2]=4 2790 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000731252 [0,1,0,0,0,0|1,0,2]=4 2791 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000690238_100000181238 [0,1,0,0,0,0|1,0,2]=4 2792 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000731252 [0,1,0,0,0,0|1,0,2]=4 2793 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000731252 [0,1,0,0,0,0|1,0,2]=4 2794 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)F 1458a_100000690238_100000230114 [0,1,0,0,0,0|1,0,2]=4 2795 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000731252 [0,1,0,0,0,0|1,0,2]=4 2796 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)I 1458a_100000690238_100011218688 [0,1,0,0,0,0|1,0,2]=4 2797 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)O 1458a_100000690238_100011660834 [0,1,0,0,0,0|1,0,2]=4 2798 B15R1.129 C#CCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000731252 [0,1,0,0,0,0|1,0,2]=4 2799 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Br 11a_100000755551_100000747190 [0,1,0,0,0,0|1,0,2]=4 2800 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Br 240690a_100000755551_100000747190 [0,1,0,0,0,0|1,0,2]=4 2801 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Br 527a_100000755551_100000747190 [0,1,0,0,0,0|1,0,2]=4 2802 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C 11a_100000755551_100011206899 [0,1,0,0,0,0|1,0,2]=4 2803 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C 1626a_100000755551_100011206899 [0,1,0,0,0,0|1,0,2]=4 2804 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C 240690a_100000755551_100011206899 [0,1,0,0,0,0|1,0,2]=4 2805 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)C 527a_100000755551_100011206899 [0,1,0,0,0,0|1,0,2]=4 2806 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl 11a_100000755551_100000749307 [0,1,0,0,0,0|1,0,2]=4 2807 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl 1626a_100000755551_100000749307 [0,1,0,0,0,0|1,0,2]=4 2808 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl 240690a_100000755551_100000749307 [0,1,0,0,0,0|1,0,2]=4 2809 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)Cl 527a_100000755551_100000749307 [0,1,0,0,0,0|1,0,2]=4 2810 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F 11a_100000755551_100000211661 [0,1,0,0,0,0|1,0,2]=4 2811 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F 1626a_100000755551_100000211661 [0,1,0,0,0,0|1,0,2]=4 2812 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F 240690a_100000755551_100000211661 [0,1,0,0,0,0|1,0,2]=4 2813 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)F 527a_100000755551_100000211661 [0,1,0,0,0,0|1,0,2]=4 2814 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)I 11a_100000755551_100000238430 [0,1,0,0,0,0|1,0,2]=4 2815 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)I 1626a_100000755551_100000238430 [0,1,0,0,0,0|1,0,2]=4 2816 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)I 240690a_100000755551_100000238430 [0,1,0,0,0,0|1,0,2]=4 2817 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)I 527a_100000755551_100000238430 [0,1,0,0,0,0|1,0,2]=4 2818 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)O 240690a_100000755551_100000745134 [0,1,0,0,0,0|1,0,2]=4 2819 B15R1.129 C#CCCNC(=O)Cc1cccc(c1)O 527a_100000755551_100000745134 [0,1,0,0,0,0|1,0,2]=4 2820 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000757094 [0,1,0,0,0,0|1,0,2]=4 2821 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)Br 1458a_100000766728_100000211773 [0,1,0,0,0,0|1,0,2]=4 2822 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)C 1458a_100000766728_100000211840 [0,1,0,0,0,0|1,0,2]=4 2823 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000757094 [0,1,0,0,0,0|1,0,2]=4 2824 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000757094 [0,1,0,0,0,0|1,0,2]=4 2825 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000766728_100000181238 [0,1,0,0,0,0|1,0,2]=4 2826 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000757094 [0,1,0,0,0,0|1,0,2]=4 2827 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)F 1458a_100000766728_100000230114 [0,1,0,0,0,0|1,0,2]=4 2828 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000757094 [0,1,0,0,0,0|1,0,2]=4 2829 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)I 1458a_100000766728_100011218688 [0,1,0,0,0,0|1,0,2]=4 2830 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000757094 [0,1,0,0,0,0|1,0,2]=4 2831 B15R1.129 C=CCCCC(=O)Cc1cccc(c1)O 1458a_100000766728_100011660834 [0,1,0,0,0,0|1,0,2]=4 2832 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Br 11a_100015191253_100000747190 [0,1,0,0,0,0|1,0,2]=4 2833 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Br 240690a_100015191253_100000747190 [0,1,0,0,0,0|1,0,2]=4 2834 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Br 527a_100015191253_100000747190 [0,1,0,0,0,0|1,0,2]=4 2835 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C 11a_100015191253_100011206899 [0,1,0,0,0,0|1,0,2]=4 2836 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C 1626a_100015191253_100011206899 [0,1,0,0,0,0|1,0,2]=4 2837 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C 240690a_100015191253_100011206899 [0,1,0,0,0,0|1,0,2]=4 2838 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)C 527a_100015191253_100011206899 [0,1,0,0,0,0|1,0,2]=4 2839 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl 11a_100015191253_100000749307 [0,1,0,0,0,0|1,0,2]=4 2840 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl 1626a_100015191253_100000749307 [0,1,0,0,0,0|1,0,2]=4 2841 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl 240690a_100015191253_100000749307 [0,1,0,0,0,0|1,0,2]=4 2842 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)Cl 527a_100015191253_100000749307 [0,1,0,0,0,0|1,0,2]=4 2843 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F 11a_100015191253_100000211661 [0,1,0,0,0,0|1,0,2]=4 2844 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F 1626a_100015191253_100000211661 [0,1,0,0,0,0|1,0,2]=4 2845 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F 240690a_100015191253_100000211661 [0,1,0,0,0,0|1,0,2]=4 2846 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)F 527a_100015191253_100000211661 [0,1,0,0,0,0|1,0,2]=4 2847 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)I 11a_100015191253_100000238430 [0,1,0,0,0,0|1,0,2]=4 2848 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)I 1626a_100015191253_100000238430 [0,1,0,0,0,0|1,0,2]=4 2849 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)I 240690a_100015191253_100000238430 [0,1,0,0,0,0|1,0,2]=4 2850 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)I 527a_100015191253_100000238430 [0,1,0,0,0,0|1,0,2]=4 2851 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)O 240690a_100015191253_100000745134 [0,1,0,0,0,0|1,0,2]=4 2852 B15R1.129 C=CCCNC(=O)Cc1cccc(c1)O 527a_100015191253_100000745134 [0,1,0,0,0,0|1,0,2]=4 2853 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)Br 11a_100000685387_100000747190 [0,1,0,0,0,0|1,0,2]=4 2854 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)Br 527a_100000685387_100000747190 [0,1,0,0,0,0|1,0,2]=4 2855 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)C 11a_100000685387_100011206899 [0,1,0,0,0,0|1,0,2]=4 2856 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)C 1626a_100000685387_100011206899 [0,1,0,0,0,0|1,0,2]=4 2857 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)C 527a_100000685387_100011206899 [0,1,0,0,0,0|1,0,2]=4 2858 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)Cl 11a_100000685387_100000749307 [0,1,0,0,0,0|1,0,2]=4 2859 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)Cl 1626a_100000685387_100000749307 [0,1,0,0,0,0|1,0,2]=4 2860 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)Cl 527a_100000685387_100000749307 [0,1,0,0,0,0|1,0,2]=4 2861 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)F 11a_100000685387_100000211661 [0,1,0,0,0,0|1,0,2]=4 2862 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)F 1626a_100000685387_100000211661 [0,1,0,0,0,0|1,0,2]=4 2863 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)F 527a_100000685387_100000211661 [0,1,0,0,0,0|1,0,2]=4 2864 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)I 11a_100000685387_100000238430 [0,1,0,0,0,0|1,0,2]=4 2865 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)I 1626a_100000685387_100000238430 [0,1,0,0,0,0|1,0,2]=4 2866 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)I 527a_100000685387_100000238430 [0,1,0,0,0,0|1,0,2]=4 2867 B15R1.129 CC#CCNC(=O)Cc1cccc(c1)O 527a_100000685387_100000745134 [0,1,0,0,0,0|1,0,2]=4 2868 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)Br 1458a_100016274230_100000211773 [0,1,0,0,0,0|1,0,2]=4 2869 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)C 1458a_100016274230_100000211840 [0,1,0,0,0,0|1,0,2]=4 2870 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)Cl 1458a_100016274230_100000181238 [0,1,0,0,0,0|1,0,2]=4 2871 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)F 1458a_100016274230_100000230114 [0,1,0,0,0,0|1,0,2]=4 2872 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)I 1458a_100016274230_100011218688 [0,1,0,0,0,0|1,0,2]=4 2873 B15R1.129 CC/C=C/CC(=O)Cc1cccc(c1)O 1458a_100016274230_100011660834 [0,1,0,0,0,0|1,0,2]=4 2874 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)Br 1458a_100000747190_100103147603 [0,1,0,0,0,0|1,0,2]=4 2875 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)C 1458a_100011206899_100103147603 [0,1,0,0,0,0|1,0,2]=4 2876 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100103147603 [0,1,0,0,0,0|1,0,2]=4 2877 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)F 1458a_100000211661_100103147603 [0,1,0,0,0,0|1,0,2]=4 2878 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)I 1458a_100000238430_100103147603 [0,1,0,0,0,0|1,0,2]=4 2879 B15R1.129 CC/C=C\CC(=O)Cc1cccc(c1)O 1458a_100000745134_100103147603 [0,1,0,0,0,0|1,0,2]=4 2880 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100009813939 [0,1,0,0,0,0|1,0,2]=4 2881 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100009813939 [0,1,0,0,0,0|1,0,2]=4 2882 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100009813939 [0,1,0,0,0,0|1,0,2]=4 2883 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100009813939 [0,1,0,0,0,0|1,0,2]=4 2884 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100009813939 [0,1,0,0,0,0|1,0,2]=4 2885 B15R1.129 CCC#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100009813939 [0,1,0,0,0,0|1,0,2]=4 2886 B15R1.129 CCC=NNC(=O)Cc1cccc(c1)C 4a_100011661631_100000210100 [0,1,0,0,0,0|2,0,1]=4 2887 B15R1.129 CCC=NNC(=O)Cc1cccc(c1)Cl 4a_100011203430_100000210100 [0,1,0,0,0,0|2,0,1]=4 2888 B15R1.129 CCC=NNC(=O)Cc1cccc(c1)F 4a_100000189928_100000210100 [0,1,0,0,0,0|2,0,1]=4 2889 B15R1.129 CCCC#CC(=O)Cc1cc(ccn1)Br 1458a_200011218047_100010173614 [0,1,0,0,0,0|2,0,1]=4 2890 B15R1.129 CCCC#CC(=O)Cc1cc(ccn1)C 1458a_200011218047_100000718516 [0,1,0,0,0,0|2,0,1]=4 2891 B15R1.129 CCCC#CC(=O)Cc1cc(ccn1)Cl 1458a_200011218047_100016988179 [0,1,0,0,0,0|2,0,1]=4 2892 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)Br 1458a_200011218047_100000211773 [0,1,0,0,0,0|1,0,1]=3 2893 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)C 1458a_200011218047_100000211840 [0,1,0,0,0,0|1,0,1]=3 2894 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)Cl 1458a_200011218047_100000181238 [0,1,0,0,0,0|1,0,1]=3 2895 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)F 1458a_200011218047_100000230114 [0,1,0,0,0,0|1,0,1]=3 2896 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)I 1458a_200011218047_100011218688 [0,1,0,0,0,0|1,0,1]=3 2897 B15R1.129 CCCC#CC(=O)Cc1cccc(c1)O 1458a_200011218047_100011660834 [0,1,0,0,0,0|1,0,1]=3 2898 B15R1.129 CCCC#CC(=O)Cc1cccc(n1)Br 1458a_200011218047_100009889011 [0,1,0,0,0,0|2,0,1]=4 2899 B15R1.129 CCCC#CC(=O)Cc1cccc(n1)C 1458a_200011218047_100000757606 [0,1,0,0,0,0|2,0,1]=4 2900 B15R1.129 CCCC#CC(=O)Cc1cccc(n1)Cl 1458a_200011218047_100000086093 [0,1,0,0,0,0|2,0,1]=4 2901 B15R1.129 CCCC#CC(=O)Cc1cccc(n1)F 1458a_200011218047_100009819644 [0,1,0,0,0,0|2,0,1]=4 2902 B15R1.129 CCCC#CC(=O)Cc1ccnc(c1)Br 1458a_200011218047_100010243470 [0,1,0,0,0,0|2,0,1]=4 2903 B15R1.129 CCCC#CC(=O)Cc1ccnc(c1)C 1458a_200011218047_200020672517 [0,1,0,0,0,0|2,0,1]=4 2904 B15R1.129 CCCC#CC(=O)Cc1ccnc(c1)Cl 1458a_200011218047_100000764220 [0,1,0,0,0,0|2,0,1]=4 2905 B15R1.129 CCCC#CC(=O)Cc1cncc(c1)Br 1458a_200011218047_100011740620 [0,1,0,0,0,0|2,0,1]=4 2906 B15R1.129 CCCC#CC(=O)Cc1cncc(c1)C 1458a_200011218047_100000716715 [0,1,0,0,0,0|2,0,1]=4 2907 B15R1.129 CCCC#CC(=O)Cc1cncc(c1)Cl 1458a_200011218047_100016992070 [0,1,0,0,0,0|2,0,1]=4 2908 B15R1.129 CCCC#CC(=O)Cc1cncc(c1)F 1458a_200011218047_100000725299 [0,1,0,0,0,0|2,0,1]=4 2909 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)Br 22a_100000210019_200011218047 [0,1,0,0,0,0|2,0,1]=4 2910 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)C 22a_100000188690_200011218047 [0,1,0,0,0,0|2,0,1]=4 2911 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)Cl 22a_100000185859_200011218047 [0,1,0,0,0,0|2,0,1]=4 2912 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)F 22a_100000210047_200011218047 [0,1,0,0,0,0|2,0,1]=4 2913 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)I 22a_100000211102_200011218047 [0,1,0,0,0,0|2,0,1]=4 2914 B15R1.129 CCCC#CC(=O)Nc1cccc(c1)O 22a_100000210217_200011218047 [0,1,0,0,0,0|2,0,1]=4 2915 B15R1.129 CCCC=CC(=O)Cc1cc(ccn1)Br 1458a_100000212230_100010173614 [0,1,0,0,0,0|2,0,1]=4 2916 B15R1.129 CCCC=CC(=O)Cc1cc(ccn1)C 1458a_100000212230_100000718516 [0,1,0,0,0,0|2,0,1]=4 2917 B15R1.129 CCCC=CC(=O)Cc1cc(ccn1)Cl 1458a_100000212230_100016988179 [0,1,0,0,0,0|2,0,1]=4 2918 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)Br 1458a_100000212230_100000211773 [0,1,0,0,0,0|1,0,1]=3 2919 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)C 1458a_100000212230_100000211840 [0,1,0,0,0,0|1,0,1]=3 2920 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)Cl 1458a_100000212230_100000181238 [0,1,0,0,0,0|1,0,1]=3 2921 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)F 1458a_100000212230_100000230114 [0,1,0,0,0,0|1,0,1]=3 2922 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)I 1458a_100000212230_100011218688 [0,1,0,0,0,0|1,0,1]=3 2923 B15R1.129 CCCC=CC(=O)Cc1cccc(c1)O 1458a_100000212230_100011660834 [0,1,0,0,0,0|1,0,1]=3 2924 B15R1.129 CCCC=CC(=O)Cc1cccc(n1)Br 1458a_100000212230_100009889011 [0,1,0,0,0,0|2,0,1]=4 2925 B15R1.129 CCCC=CC(=O)Cc1cccc(n1)C 1458a_100000212230_100000757606 [0,1,0,0,0,0|2,0,1]=4 2926 B15R1.129 CCCC=CC(=O)Cc1cccc(n1)Cl 1458a_100000212230_100000086093 [0,1,0,0,0,0|2,0,1]=4 2927 B15R1.129 CCCC=CC(=O)Cc1cccc(n1)F 1458a_100000212230_100009819644 [0,1,0,0,0,0|2,0,1]=4 2928 B15R1.129 CCCC=CC(=O)Cc1ccnc(c1)Br 1458a_100000212230_100010243470 [0,1,0,0,0,0|2,0,1]=4 2929 B15R1.129 CCCC=CC(=O)Cc1ccnc(c1)C 1458a_100000212230_200020672517 [0,1,0,0,0,0|2,0,1]=4 2930 B15R1.129 CCCC=CC(=O)Cc1ccnc(c1)Cl 1458a_100000212230_100000764220 [0,1,0,0,0,0|2,0,1]=4 2931 B15R1.129 CCCC=CC(=O)Cc1cncc(c1)Br 1458a_100000212230_100011740620 [0,1,0,0,0,0|2,0,1]=4 2932 B15R1.129 CCCC=CC(=O)Cc1cncc(c1)C 1458a_100000212230_100000716715 [0,1,0,0,0,0|2,0,1]=4 2933 B15R1.129 CCCC=CC(=O)Cc1cncc(c1)Cl 1458a_100000212230_100016992070 [0,1,0,0,0,0|2,0,1]=4 2934 B15R1.129 CCCC=CC(=O)Cc1cncc(c1)F 1458a_100000212230_100000725299 [0,1,0,0,0,0|2,0,1]=4 2935 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000212230 [0,1,0,0,0,0|2,0,1]=4 2936 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000212230 [0,1,0,0,0,0|2,0,1]=4 2937 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000212230 [0,1,0,0,0,0|2,0,1]=4 2938 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)C 11a_100000188690_100000212230 [0,1,0,0,0,0|2,0,1]=4 2939 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000212230 [0,1,0,0,0,0|2,0,1]=4 2940 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000212230 [0,1,0,0,0,0|2,0,1]=4 2941 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000212230 [0,1,0,0,0,0|2,0,1]=4 2942 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000212230 [0,1,0,0,0,0|2,0,1]=4 2943 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000212230 [0,1,0,0,0,0|2,0,1]=4 2944 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)F 11a_100000210047_100000212230 [0,1,0,0,0,0|2,0,1]=4 2945 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000212230 [0,1,0,0,0,0|2,0,1]=4 2946 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000212230 [0,1,0,0,0,0|2,0,1]=4 2947 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)I 11a_100000211102_100000212230 [0,1,0,0,0,0|2,0,1]=4 2948 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000212230 [0,1,0,0,0,0|2,0,1]=4 2949 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000212230 [0,1,0,0,0,0|2,0,1]=4 2950 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000212230 [0,1,0,0,0,0|2,0,1]=4 2951 B15R1.129 CCCC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000212230 [0,1,0,0,0,0|2,0,1]=4 2952 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)Br 1458a_100000212188_100010173614 [0,1,0,0,0,0|2,0,0]=3 2953 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)C 1458a_100000212188_100000718516 [0,1,0,0,0,0|2,0,0]=3 2954 B15R1.129 CCCCCC(=O)Cc1cc(ccn1)Cl 1458a_100000212188_100016988179 [0,1,0,0,0,0|2,0,0]=3 2955 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000212188_100000211773 [0,1,0,0,0,0|1,0,0]=2 2956 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210326 [0,1,0,0,0,0|1,0,0]=2 2957 B15R1.129 CCCCCC(=O)Cc1cccc(c1)C 1458a_100000212188_100000211840 [0,1,0,0,0,0|1,0,0]=2 2958 B15R1.129 CCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210326 [0,1,0,0,0,0|1,0,0]=2 2959 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000212188_100000181238 [0,1,0,0,0,0|1,0,0]=2 2960 B15R1.129 CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210326 [0,1,0,0,0,0|1,0,0]=2 2961 B15R1.129 CCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210326 [0,1,0,0,0,0|1,0,0]=2 2962 B15R1.129 CCCCCC(=O)Cc1cccc(c1)F 1458a_100000212188_100000230114 [0,1,0,0,0,0|1,0,0]=2 2963 B15R1.129 CCCCCC(=O)Cc1cccc(c1)I 1458a_100000212188_100011218688 [0,1,0,0,0,0|1,0,0]=2 2964 B15R1.129 CCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210326 [0,1,0,0,0,0|1,0,0]=2 2965 B15R1.129 CCCCCC(=O)Cc1cccc(c1)O 1458a_100000212188_100011660834 [0,1,0,0,0,0|1,0,0]=2 2966 B15R1.129 CCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210326 [0,1,0,0,0,0|1,0,0]=2 2967 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Br 1458a_100000212188_100009889011 [0,1,0,0,0,0|2,0,0]=3 2968 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210326 [0,1,0,0,0,0|2,0,0]=3 2969 B15R1.129 CCCCCC(=O)Cc1cccc(n1)C 1458a_100000212188_100000757606 [0,1,0,0,0,0|2,0,0]=3 2970 B15R1.129 CCCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210326 [0,1,0,0,0,0|2,0,0]=3 2971 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210326 [0,1,0,0,0,0|2,0,0]=3 2972 B15R1.129 CCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000212188_100000086093 [0,1,0,0,0,0|2,0,0]=3 2973 B15R1.129 CCCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210326 [0,1,0,0,0,0|2,0,0]=3 2974 B15R1.129 CCCCCC(=O)Cc1cccc(n1)F 1458a_100000212188_100009819644 [0,1,0,0,0,0|2,0,0]=3 2975 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Br 1458a_100000212188_100010243470 [0,1,0,0,0,0|2,0,0]=3 2976 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210326 [0,1,0,0,0,0|2,0,0]=3 2977 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)C 1458a_100000212188_200020672517 [0,1,0,0,0,0|2,0,0]=3 2978 B15R1.129 CCCCCC(=O)Cc1ccnc(c1)Cl 1458a_100000212188_100000764220 [0,1,0,0,0,0|2,0,0]=3 2979 B15R1.129 CCCCCC(=O)Cc1ccnc(n1)Cl 1458a_100000212188_100000099655 [0,1,0,0,0,0|3,0,0]=4 2980 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Br 1458a_100000212188_100011740620 [0,1,0,0,0,0|2,0,0]=3 2981 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210326 [0,1,0,0,0,0|2,0,0]=3 2982 B15R1.129 CCCCCC(=O)Cc1cncc(c1)C 1458a_100000212188_100000716715 [0,1,0,0,0,0|2,0,0]=3 2983 B15R1.129 CCCCCC(=O)Cc1cncc(c1)Cl 1458a_100000212188_100016992070 [0,1,0,0,0,0|2,0,0]=3 2984 B15R1.129 CCCCCC(=O)Cc1cncc(c1)F 1458a_100000212188_100000725299 [0,1,0,0,0,0|2,0,0]=3 2985 B15R1.129 CCCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210326 [0,1,0,0,0,0|2,0,0]=3 2986 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000212188 [0,1,0,0,0,0|2,0,0]=3 2987 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000212188 [0,1,0,0,0,0|2,0,0]=3 2988 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000212188 [0,1,0,0,0,0|2,0,0]=3 2989 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000212188 [0,1,0,0,0,0|2,0,0]=3 2990 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000212188 [0,1,0,0,0,0|2,0,0]=3 2991 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000212188 [0,1,0,0,0,0|2,0,0]=3 2992 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000212188 [0,1,0,0,0,0|2,0,0]=3 2993 B15R1.129 CCCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000212188 [0,1,0,0,0,0|2,0,0]=3 2994 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000212188 [0,1,0,0,0,0|2,0,0]=3 2995 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000212188 [0,1,0,0,0,0|2,0,0]=3 2996 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000212188 [0,1,0,0,0,0|2,0,0]=3 2997 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000212188 [0,1,0,0,0,0|2,0,0]=3 2998 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000212188 [0,1,0,0,0,0|2,0,0]=3 2999 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000212188 [0,1,0,0,0,0|2,0,0]=3 3000 B15R1.129 CCCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000212188 [0,1,0,0,0,0|2,0,0]=3 3001 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000212188 [0,1,0,0,0,0|2,0,0]=3 3002 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000212188 [0,1,0,0,0,0|2,0,0]=3 3003 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000212188 [0,1,0,0,0,0|2,0,0]=3 3004 B15R1.129 CCCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000212188 [0,1,0,0,0,0|2,0,0]=3 3005 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000212188 [0,1,0,0,0,0|2,0,0]=3 3006 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000212188 [0,1,0,0,0,0|2,0,0]=3 3007 B15R1.129 CCCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000212188 [0,1,0,0,0,0|2,0,0]=3 3008 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 2230a_100000187585_100000210326 [0,1,0,0,0,0|3,0,0]=4 3009 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 2230a_100000223495_100000698116 [0,1,0,0,0,0|3,0,0]=4 3010 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 269982a_100000187585_100000210215 [0,1,0,0,0,0|3,0,0]=4 3011 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 269982a_100000223495_100000211773 [0,1,0,0,0,0|3,0,0]=4 3012 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 26a_100000223495_100000210342 [0,1,0,0,0,0|3,0,0]=4 3013 B15R1.129 CCCCCN(C)Cc1cccc(c1)Br 270004a_100000223495_100000210085 [0,1,0,0,0,0|3,0,0]=4 3014 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 2230a_100000223495_100000211840 [0,1,0,0,0,0|3,0,0]=4 3015 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 2230a_102495364743_100000210326 [0,1,0,0,0,0|3,0,0]=4 3016 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 269982a_100000223495_100000211840 [0,1,0,0,0,0|3,0,0]=4 3017 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 269982a_102495364743_100000210215 [0,1,0,0,0,0|3,0,0]=4 3018 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 270004a_100000223495_100000211157 [0,1,0,0,0,0|3,0,0]=4 3019 B15R1.129 CCCCCN(C)Cc1cccc(c1)C 34a_102495364743_100000718602 [0,1,0,0,0,0|3,0,0]=4 3020 B15R1.129 CCCCCN(C)Cc1cccc(c1)Cl 2230a_100000223495_100000181238 [0,1,0,0,0,0|3,0,0]=4 3021 B15R1.129 CCCCCN(C)Cc1cccc(c1)Cl 2230a_100020629429_100000210326 [0,1,0,0,0,0|3,0,0]=4 3022 B15R1.129 CCCCCN(C)Cc1cccc(c1)Cl 269982a_100000223495_100000181238 [0,1,0,0,0,0|3,0,0]=4 3023 B15R1.129 CCCCCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100000210215 [0,1,0,0,0,0|3,0,0]=4 3024 B15R1.129 CCCCCN(C)Cc1cccc(c1)Cl 270004a_100000223495_100000210801 [0,1,0,0,0,0|3,0,0]=4 3025 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 2230a_100000184398_100000210326 [0,1,0,0,0,0|3,0,0]=4 3026 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 2230a_100000223495_100000230114 [0,1,0,0,0,0|3,0,0]=4 3027 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 269982a_100000184398_100000210215 [0,1,0,0,0,0|3,0,0]=4 3028 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 269982a_100000223495_100000230114 [0,1,0,0,0,0|3,0,0]=4 3029 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 270004a_100000223495_100000210812 [0,1,0,0,0,0|3,0,0]=4 3030 B15R1.129 CCCCCN(C)Cc1cccc(c1)F 34a_100000184398_100000718602 [0,1,0,0,0,0|3,0,0]=4 3031 B15R1.129 CCCCCN(C)Cc1cccc(c1)I 2230a_100000223495_100011218688 [0,1,0,0,0,0|3,0,0]=4 3032 B15R1.129 CCCCCN(C)Cc1cccc(c1)I 269982a_100000223495_100011218688 [0,1,0,0,0,0|3,0,0]=4 3033 B15R1.129 CCCCCN(C)Cc1cccc(c1)I 270004a_100000223495_100000014684 [0,1,0,0,0,0|3,0,0]=4 3034 B15R1.129 CCCCCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210326 [0,1,0,0,0,0|3,0,0]=4 3035 B15R1.129 CCCCCN(C)Cc1cccc(c1)O 2230a_100000223495_100011660834 [0,1,0,0,0,0|3,0,0]=4 3036 B15R1.129 CCCCCN(C)Cc1cccc(c1)O 269982a_100000207540_100000210215 [0,1,0,0,0,0|3,0,0]=4 3037 B15R1.129 CCCCCN(C)Cc1cccc(c1)O 269982a_100000223495_100000084143 [0,1,0,0,0,0|3,0,0]=4 3038 B15R1.129 CCCCCN(C)Cc1cccc(c1)O 270004a_100000223495_100000188321 [0,1,0,0,0,0|3,0,0]=4 3039 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 11a_100000102301_100000747190 [0,1,0,0,0,0|1,0,0]=2 3040 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 240690a_100000102301_100000747190 [0,1,0,0,0,0|1,0,0]=2 3041 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Br 527a_100000102301_100000747190 [0,1,0,0,0,0|1,0,0]=2 3042 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 11a_100000102301_100011206899 [0,1,0,0,0,0|1,0,0]=2 3043 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 1626a_100000102301_100011206899 [0,1,0,0,0,0|1,0,0]=2 3044 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 240690a_100000102301_100011206899 [0,1,0,0,0,0|1,0,0]=2 3045 B15R1.129 CCCCNC(=O)Cc1cccc(c1)C 527a_100000102301_100011206899 [0,1,0,0,0,0|1,0,0]=2 3046 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 11a_100000102301_100000749307 [0,1,0,0,0,0|1,0,0]=2 3047 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000102301_100000749307 [0,1,0,0,0,0|1,0,0]=2 3048 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000102301_100000749307 [0,1,0,0,0,0|1,0,0]=2 3049 B15R1.129 CCCCNC(=O)Cc1cccc(c1)Cl 527a_100000102301_100000749307 [0,1,0,0,0,0|1,0,0]=2 3050 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 11a_100000102301_100000211661 [0,1,0,0,0,0|1,0,0]=2 3051 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 1626a_100000102301_100000211661 [0,1,0,0,0,0|1,0,0]=2 3052 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 240690a_100000102301_100000211661 [0,1,0,0,0,0|1,0,0]=2 3053 B15R1.129 CCCCNC(=O)Cc1cccc(c1)F 527a_100000102301_100000211661 [0,1,0,0,0,0|1,0,0]=2 3054 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 11a_100000102301_100000238430 [0,1,0,0,0,0|1,0,0]=2 3055 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 1626a_100000102301_100000238430 [0,1,0,0,0,0|1,0,0]=2 3056 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 240690a_100000102301_100000238430 [0,1,0,0,0,0|1,0,0]=2 3057 B15R1.129 CCCCNC(=O)Cc1cccc(c1)I 527a_100000102301_100000238430 [0,1,0,0,0,0|1,0,0]=2 3058 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O 240690a_100000102301_100000745134 [0,1,0,0,0,0|1,0,0]=2 3059 B15R1.129 CCCCNC(=O)Cc1cccc(c1)O 527a_100000102301_100000745134 [0,1,0,0,0,0|1,0,0]=2 3060 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Br 11a_100000102301_100010201708 [0,1,0,0,0,0|2,0,0]=3 3061 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Br 240690a_100000102301_100010201708 [0,1,0,0,0,0|2,0,0]=3 3062 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Br 527a_100000102301_100010201708 [0,1,0,0,0,0|2,0,0]=3 3063 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C 11a_100000102301_100012001110 [0,1,0,0,0,0|2,0,0]=3 3064 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C 1626a_100000102301_100012001110 [0,1,0,0,0,0|2,0,0]=3 3065 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C 240690a_100000102301_100012001110 [0,1,0,0,0,0|2,0,0]=3 3066 B15R1.129 CCCCNC(=O)Cc1cccc(n1)C 527a_100000102301_100012001110 [0,1,0,0,0,0|2,0,0]=3 3067 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Cl 11a_100000102301_100000090259 [0,1,0,0,0,0|2,0,0]=3 3068 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Cl 1626a_100000102301_100000090259 [0,1,0,0,0,0|2,0,0]=3 3069 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Cl 240690a_100000102301_100000090259 [0,1,0,0,0,0|2,0,0]=3 3070 B15R1.129 CCCCNC(=O)Cc1cccc(n1)F 11a_100000102301_100000096803 [0,1,0,0,0,0|2,0,0]=3 3071 B15R1.129 CCCCNC(=O)Cc1cccc(n1)F 1626a_100000102301_100000096803 [0,1,0,0,0,0|2,0,0]=3 3072 B15R1.129 CCCCNC(=O)Cc1cccc(n1)F 240690a_100000102301_100000096803 [0,1,0,0,0,0|2,0,0]=3 3073 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Br 11a_100000102301_100010126891 [0,1,0,0,0,0|2,0,0]=3 3074 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Br 240690a_100000102301_100010126891 [0,1,0,0,0,0|2,0,0]=3 3075 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Br 527a_100000102301_100010126891 [0,1,0,0,0,0|2,0,0]=3 3076 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Cl 11a_100000102301_100000085289 [0,1,0,0,0,0|2,0,0]=3 3077 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Cl 1626a_100000102301_100000085289 [0,1,0,0,0,0|2,0,0]=3 3078 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Cl 240690a_100000102301_100000085289 [0,1,0,0,0,0|2,0,0]=3 3079 B15R1.129 CCCCNC(=O)Cc1ccnc(c1)Cl 527a_100000102301_100000085289 [0,1,0,0,0,0|2,0,0]=3 3080 B15R1.129 CCCCNC(=O)Cc1cncc(c1)Br 11a_100000102301_100000239331 [0,1,0,0,0,0|2,0,0]=3 3081 B15R1.129 CCCCNC(=O)Cc1cncc(c1)Br 240690a_100000102301_100000239331 [0,1,0,0,0,0|2,0,0]=3 3082 B15R1.129 CCCCNC(=O)Cc1cncc(c1)Br 527a_100000102301_100000239331 [0,1,0,0,0,0|2,0,0]=3 3083 B15R1.129 CCCCNC(=O)Cc1cncc(c1)F 11a_100000102301_100011667516 [0,1,0,0,0,0|2,0,0]=3 3084 B15R1.129 CCCCNC(=O)Cc1cncc(c1)F 240690a_100000102301_100011667516 [0,1,0,0,0,0|2,0,0]=3 3085 B15R1.129 CCCCNC(=O)Cc1cncc(c1)F 527a_100000102301_100011667516 [0,1,0,0,0,0|2,0,0]=3 3086 B15R1.129 CCCCNC(=O)Cc1cncc(n1)Cl 11a_100000102301_100000095580 [0,1,0,0,0,0|3,0,0]=4 3087 B15R1.129 CCCCNC(=O)Cc1cncc(n1)Cl 1626a_100000102301_100000095580 [0,1,0,0,0,0|3,0,0]=4 3088 B15R1.129 CCCCNC(=O)Cc1cncc(n1)Cl 240690a_100000102301_100000095580 [0,1,0,0,0,0|3,0,0]=4 3089 B15R1.129 CCCCNC(=O)Cc1cncc(n1)Cl 527a_100000102301_100000095580 [0,1,0,0,0,0|3,0,0]=4 3090 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000102301 [0,1,0,0,0,0|2,0,0]=3 3091 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000102301 [0,1,0,0,0,0|2,0,0]=3 3092 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000102301 [0,1,0,0,0,0|2,0,0]=3 3093 B15R1.129 CCCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100000102301 [0,1,0,0,0,0|2,0,0]=3 3094 B15R1.129 CCCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000102301 [0,1,0,0,0,0|2,0,0]=3 3095 B15R1.129 CCCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000102301 [0,1,0,0,0,0|2,0,0]=3 3096 B15R1.129 CCCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000102301 [0,1,0,0,0,0|2,0,0]=3 3097 B15R1.129 CCCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000102301 [0,1,0,0,0,0|2,0,0]=3 3098 B15R1.129 CCCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000102301 [0,1,0,0,0,0|2,0,0]=3 3099 B15R1.129 CCCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000102301 [0,1,0,0,0,0|2,0,0]=3 3100 B15R1.129 CCCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000102301 [0,1,0,0,0,0|2,0,0]=3 3101 B15R1.129 CCCCNC(C)Cc1cccc(c1)Br 270004a_100000102301_100000689217 [0,1,0,0,0,0|2,0,1]=4 3102 B15R1.129 CCCCNC(C)Cc1cccc(c1)Cl 270004a_100000102301_100000727212 [0,1,0,0,0,0|2,0,1]=4 3103 B15R1.129 CCCCNC(C)Cc1cccc(c1)F 270004a_100000102301_100000687711 [0,1,0,0,0,0|2,0,1]=4 3104 B15R1.129 CCCCOC(C)Cc1cccc(n1)C 34a_200015421231_100000210210 [0,1,0,0,0,0|2,0,1]=4 3105 B15R1.129 CCCNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_100000210303 [0,1,0,0,0,0|3,0,0]=4 3106 B15R1.129 CCCNCC(=O)Nc1cccc(c1)F 2230a_100000168492_100000210303 [0,1,0,0,0,0|3,0,0]=4 3107 B15R1.129 CCCNCC(=O)Nc1cccc(c1)F 34a_100000168492_100000210303 [0,1,0,0,0,0|3,0,0]=4 3108 B15R1.129 CCCNNC(=O)Cc1cccc(c1)Br 22a_100000740057_100000747190 [0,1,0,0,0,0|2,0,0]=3 3109 B15R1.129 CCCNNC(=O)Cc1cccc(c1)C 22a_100000740057_100011206899 [0,1,0,0,0,0|2,0,0]=3 3110 B15R1.129 CCCNNC(=O)Cc1cccc(c1)Cl 22a_100000740057_100000749307 [0,1,0,0,0,0|2,0,0]=3 3111 B15R1.129 CCCNNC(=O)Cc1cccc(c1)F 22a_100000740057_100000211661 [0,1,0,0,0,0|2,0,0]=3 3112 B15R1.129 CCCNNC(=O)Cc1cccc(c1)I 22a_100000740057_100000238430 [0,1,0,0,0,0|2,0,0]=3 3113 B15R1.129 CCCNNC(=O)Cc1cccc(c1)O 22a_100000740057_100000745134 [0,1,0,0,0,0|2,0,0]=3 3114 B15R1.129 CCCNNC(=O)Cc1cccc(n1)Br 22a_100000740057_100010201708 [0,1,0,0,0,0|3,0,0]=4 3115 B15R1.129 CCCNNC(=O)Cc1cccc(n1)C 22a_100000740057_100012001110 [0,1,0,0,0,0|3,0,0]=4 3116 B15R1.129 CCCNNC(=O)Cc1cccc(n1)Cl 22a_100000740057_100000090259 [0,1,0,0,0,0|3,0,0]=4 3117 B15R1.129 CCCNNC(=O)Cc1ccnc(c1)Br 22a_100000740057_100010126891 [0,1,0,0,0,0|3,0,0]=4 3118 B15R1.129 CCCNNC(=O)Cc1ccnc(c1)Cl 22a_100000740057_100000085289 [0,1,0,0,0,0|3,0,0]=4 3119 B15R1.129 CCCNNC(=O)Cc1cncc(c1)Br 22a_100000740057_100000239331 [0,1,0,0,0,0|3,0,0]=4 3120 B15R1.129 CCCNNC(=O)Cc1cncc(c1)F 22a_100000740057_100011667516 [0,1,0,0,0,0|3,0,0]=4 3121 B15R1.129 CCCNNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000740057 [0,1,0,0,0,0|3,0,0]=4 3122 B15R1.129 CCCNNC(=O)Nc1cccc(c1)C 512a_100000188690_100000740057 [0,1,0,0,0,0|3,0,0]=4 3123 B15R1.129 CCCNNC(=O)Nc1cccc(c1)F 512a_100000210047_100000740057 [0,1,0,0,0,0|3,0,0]=4 3124 B15R1.129 CCCNNC(=O)Nc1cccc(c1)I 512a_100000211102_100000740057 [0,1,0,0,0,0|3,0,0]=4 3125 B15R1.129 CCCNNC(=O)Nc1cccc(c1)O 512a_100000210217_100000740057 [0,1,0,0,0,0|3,0,0]=4 3126 B15R1.129 CCCOCC(=O)Cc1cc(ccn1)Br 1458a_100000745993_100010173614 [0,1,0,0,0,0|3,0,0]=4 3127 B15R1.129 CCCOCC(=O)Cc1cc(ccn1)C 1458a_100000745993_100000718516 [0,1,0,0,0,0|3,0,0]=4 3128 B15R1.129 CCCOCC(=O)Cc1cc(ccn1)Cl 1458a_100000745993_100016988179 [0,1,0,0,0,0|3,0,0]=4 3129 B15R1.129 CCCOCC(=O)Cc1cccc(c1)Br 1458a_100000745993_100000211773 [0,1,0,0,0,0|2,0,0]=3 3130 B15R1.129 CCCOCC(=O)Cc1cccc(c1)C 1458a_100000745993_100000211840 [0,1,0,0,0,0|2,0,0]=3 3131 B15R1.129 CCCOCC(=O)Cc1cccc(c1)Cl 1458a_100000745993_100000181238 [0,1,0,0,0,0|2,0,0]=3 3132 B15R1.129 CCCOCC(=O)Cc1cccc(c1)F 1458a_100000745993_100000230114 [0,1,0,0,0,0|2,0,0]=3 3133 B15R1.129 CCCOCC(=O)Cc1cccc(c1)I 1458a_100000745993_100011218688 [0,1,0,0,0,0|2,0,0]=3 3134 B15R1.129 CCCOCC(=O)Cc1cccc(c1)O 1458a_100000745993_100011660834 [0,1,0,0,0,0|2,0,0]=3 3135 B15R1.129 CCCOCC(=O)Cc1cccc(n1)Br 1458a_100000745993_100009889011 [0,1,0,0,0,0|3,0,0]=4 3136 B15R1.129 CCCOCC(=O)Cc1cccc(n1)C 1458a_100000745993_100000757606 [0,1,0,0,0,0|3,0,0]=4 3137 B15R1.129 CCCOCC(=O)Cc1cccc(n1)Cl 1458a_100000745993_100000086093 [0,1,0,0,0,0|3,0,0]=4 3138 B15R1.129 CCCOCC(=O)Cc1cccc(n1)F 1458a_100000745993_100009819644 [0,1,0,0,0,0|3,0,0]=4 3139 B15R1.129 CCCOCC(=O)Cc1ccnc(c1)Br 1458a_100000745993_100010243470 [0,1,0,0,0,0|3,0,0]=4 3140 B15R1.129 CCCOCC(=O)Cc1ccnc(c1)C 1458a_100000745993_200020672517 [0,1,0,0,0,0|3,0,0]=4 3141 B15R1.129 CCCOCC(=O)Cc1ccnc(c1)Cl 1458a_100000745993_100000764220 [0,1,0,0,0,0|3,0,0]=4 3142 B15R1.129 CCCOCC(=O)Cc1cncc(c1)Br 1458a_100000745993_100011740620 [0,1,0,0,0,0|3,0,0]=4 3143 B15R1.129 CCCOCC(=O)Cc1cncc(c1)C 1458a_100000745993_100000716715 [0,1,0,0,0,0|3,0,0]=4 3144 B15R1.129 CCCOCC(=O)Cc1cncc(c1)Cl 1458a_100000745993_100016992070 [0,1,0,0,0,0|3,0,0]=4 3145 B15R1.129 CCCOCC(=O)Cc1cncc(c1)F 1458a_100000745993_100000725299 [0,1,0,0,0,0|3,0,0]=4 3146 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000745993 [0,1,0,0,0,0|3,0,0]=4 3147 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000745993 [0,1,0,0,0,0|3,0,0]=4 3148 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000745993 [0,1,0,0,0,0|3,0,0]=4 3149 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 34a_100000210258_100000183509 [0,1,0,0,0,0|3,0,0]=4 3150 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000745993 [0,1,0,0,0,0|3,0,0]=4 3151 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 11a_100000188690_100000745993 [0,1,0,0,0,0|3,0,0]=4 3152 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000745993 [0,1,0,0,0,0|3,0,0]=4 3153 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 22a_100000188690_100000745993 [0,1,0,0,0,0|3,0,0]=4 3154 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 34a_100000210258_100000182861 [0,1,0,0,0,0|3,0,0]=4 3155 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100000210303 [0,1,0,0,0,0|3,0,0]=4 3156 B15R1.129 CCCOCC(=O)Nc1cccc(c1)C 527a_100000188690_100000745993 [0,1,0,0,0,0|3,0,0]=4 3157 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000745993 [0,1,0,0,0,0|3,0,0]=4 3158 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000745993 [0,1,0,0,0,0|3,0,0]=4 3159 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000745993 [0,1,0,0,0,0|3,0,0]=4 3160 B15R1.129 CCCOCC(=O)Nc1cccc(c1)Cl 34a_100000210258_100000182995 [0,1,0,0,0,0|3,0,0]=4 3161 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 11a_100000210047_100000745993 [0,1,0,0,0,0|3,0,0]=4 3162 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000745993 [0,1,0,0,0,0|3,0,0]=4 3163 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 22a_100000210047_100000745993 [0,1,0,0,0,0|3,0,0]=4 3164 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 34a_100000210258_100000183335 [0,1,0,0,0,0|3,0,0]=4 3165 B15R1.129 CCCOCC(=O)Nc1cccc(c1)F 527a_100000210047_100000745993 [0,1,0,0,0,0|3,0,0]=4 3166 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 11a_100000211102_100000745993 [0,1,0,0,0,0|3,0,0]=4 3167 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000745993 [0,1,0,0,0,0|3,0,0]=4 3168 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 22a_100000211102_100000745993 [0,1,0,0,0,0|3,0,0]=4 3169 B15R1.129 CCCOCC(=O)Nc1cccc(c1)I 527a_100000211102_100000745993 [0,1,0,0,0,0|3,0,0]=4 3170 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000745993 [0,1,0,0,0,0|3,0,0]=4 3171 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 22a_100000210217_100000745993 [0,1,0,0,0,0|3,0,0]=4 3172 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 34a_100000210258_100011236192 [0,1,0,0,0,0|3,0,0]=4 3173 B15R1.129 CCCOCC(=O)Nc1cccc(c1)O 527a_100000210217_100000745993 [0,1,0,0,0,0|3,0,0]=4 3174 B15R1.129 CCCSCC(=O)Cc1cc(ccn1)Br 1458a_100000217233_100010173614 [0,1,0,0,0,0|3,0,0]=4 3175 B15R1.129 CCCSCC(=O)Cc1cc(ccn1)C 1458a_100000217233_100000718516 [0,1,0,0,0,0|3,0,0]=4 3176 B15R1.129 CCCSCC(=O)Cc1cc(ccn1)Cl 1458a_100000217233_100016988179 [0,1,0,0,0,0|3,0,0]=4 3177 B15R1.129 CCCSCC(=O)Cc1cccc(c1)Br 1458a_100000217233_100000211773 [0,1,0,0,0,0|2,0,0]=3 3178 B15R1.129 CCCSCC(=O)Cc1cccc(c1)C 1458a_100000217233_100000211840 [0,1,0,0,0,0|2,0,0]=3 3179 B15R1.129 CCCSCC(=O)Cc1cccc(c1)Cl 1458a_100000217233_100000181238 [0,1,0,0,0,0|2,0,0]=3 3180 B15R1.129 CCCSCC(=O)Cc1cccc(c1)F 1458a_100000217233_100000230114 [0,1,0,0,0,0|2,0,0]=3 3181 B15R1.129 CCCSCC(=O)Cc1cccc(c1)I 1458a_100000217233_100011218688 [0,1,0,0,0,0|2,0,0]=3 3182 B15R1.129 CCCSCC(=O)Cc1cccc(c1)O 1458a_100000217233_100011660834 [0,1,0,0,0,0|2,0,0]=3 3183 B15R1.129 CCCSCC(=O)Cc1cccc(n1)Br 1458a_100000217233_100009889011 [0,1,0,0,0,0|3,0,0]=4 3184 B15R1.129 CCCSCC(=O)Cc1cccc(n1)C 1458a_100000217233_100000757606 [0,1,0,0,0,0|3,0,0]=4 3185 B15R1.129 CCCSCC(=O)Cc1cccc(n1)Cl 1458a_100000217233_100000086093 [0,1,0,0,0,0|3,0,0]=4 3186 B15R1.129 CCCSCC(=O)Cc1cccc(n1)F 1458a_100000217233_100009819644 [0,1,0,0,0,0|3,0,0]=4 3187 B15R1.129 CCCSCC(=O)Cc1ccnc(c1)Br 1458a_100000217233_100010243470 [0,1,0,0,0,0|3,0,0]=4 3188 B15R1.129 CCCSCC(=O)Cc1ccnc(c1)C 1458a_100000217233_200020672517 [0,1,0,0,0,0|3,0,0]=4 3189 B15R1.129 CCCSCC(=O)Cc1ccnc(c1)Cl 1458a_100000217233_100000764220 [0,1,0,0,0,0|3,0,0]=4 3190 B15R1.129 CCCSCC(=O)Cc1cncc(c1)Br 1458a_100000217233_100011740620 [0,1,0,0,0,0|3,0,0]=4 3191 B15R1.129 CCCSCC(=O)Cc1cncc(c1)C 1458a_100000217233_100000716715 [0,1,0,0,0,0|3,0,0]=4 3192 B15R1.129 CCCSCC(=O)Cc1cncc(c1)Cl 1458a_100000217233_100016992070 [0,1,0,0,0,0|3,0,0]=4 3193 B15R1.129 CCCSCC(=O)Cc1cncc(c1)F 1458a_100000217233_100000725299 [0,1,0,0,0,0|3,0,0]=4 3194 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000217233 [0,1,0,0,0,0|3,0,0]=4 3195 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000217233 [0,1,0,0,0,0|3,0,0]=4 3196 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000217233 [0,1,0,0,0,0|3,0,0]=4 3197 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000217233 [0,1,0,0,0,0|3,0,0]=4 3198 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 62a_100000183509_100000210303 [0,1,0,0,0,0|3,0,0]=4 3199 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Br 62a_100000210303_100000183509 [0,1,0,0,0,0|3,0,0]=4 3200 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000217233 [0,1,0,0,0,0|3,0,0]=4 3201 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000217233 [0,1,0,0,0,0|3,0,0]=4 3202 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000217233 [0,1,0,0,0,0|3,0,0]=4 3203 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000217233 [0,1,0,0,0,0|3,0,0]=4 3204 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 62a_100000210303_100000182861 [0,1,0,0,0,0|3,0,0]=4 3205 B15R1.129 CCCSCC(=O)Nc1cccc(c1)C 62a_100000243722_100000210303 [0,1,0,0,0,0|3,0,0]=4 3206 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000217233 [0,1,0,0,0,0|3,0,0]=4 3207 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000217233 [0,1,0,0,0,0|3,0,0]=4 3208 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000217233 [0,1,0,0,0,0|3,0,0]=4 3209 B15R1.129 CCCSCC(=O)Nc1cccc(c1)Cl 62a_100000210303_100000182995 [0,1,0,0,0,0|3,0,0]=4 3210 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000217233 [0,1,0,0,0,0|3,0,0]=4 3211 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000217233 [0,1,0,0,0,0|3,0,0]=4 3212 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000217233 [0,1,0,0,0,0|3,0,0]=4 3213 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000217233 [0,1,0,0,0,0|3,0,0]=4 3214 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 62a_100000183335_100000210303 [0,1,0,0,0,0|3,0,0]=4 3215 B15R1.129 CCCSCC(=O)Nc1cccc(c1)F 62a_100000210303_100000183335 [0,1,0,0,0,0|3,0,0]=4 3216 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000217233 [0,1,0,0,0,0|3,0,0]=4 3217 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000217233 [0,1,0,0,0,0|3,0,0]=4 3218 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000217233 [0,1,0,0,0,0|3,0,0]=4 3219 B15R1.129 CCCSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000217233 [0,1,0,0,0,0|3,0,0]=4 3220 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000217233 [0,1,0,0,0,0|3,0,0]=4 3221 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000217233 [0,1,0,0,0,0|3,0,0]=4 3222 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000217233 [0,1,0,0,0,0|3,0,0]=4 3223 B15R1.129 CCCSCC(=O)Nc1cccc(c1)O 62a_100000210303_100011236192 [0,1,0,0,0,0|3,0,0]=4 3224 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 2230a_100015525214_100011194834 [0,1,0,0,0,0|3,0,0]=4 3225 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 2230a_200015186421_100000210202 [0,1,0,0,0,0|3,0,0]=4 3226 B15R1.129 CCNCCC(=O)Nc1cccc(c1)C 34a_200015186421_100000210202 [0,1,0,0,0,0|3,0,0]=4 3227 B15R1.129 CCNCCC(=O)Nc1cccc(c1)Cl 2230a_100015525214_100000242061 [0,1,0,0,0,0|3,0,0]=4 3228 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 2230a_100015185233_100000210202 [0,1,0,0,0,0|3,0,0]=4 3229 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 2230a_100015525214_100000242062 [0,1,0,0,0,0|3,0,0]=4 3230 B15R1.129 CCNCCC(=O)Nc1cccc(c1)F 34a_100015185233_100000210202 [0,1,0,0,0,0|3,0,0]=4 3231 B15R1.129 CCNCCC(=O)Nc1cccc(c1)O 2230a_100015525214_200011436826 [0,1,0,0,0,0|3,0,0]=4 3232 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)Br 1458a_100016266692_100000211773 [0,1,0,0,0,0|2,0,1]=4 3233 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)C 1458a_100016266692_100000211840 [0,1,0,0,0,0|2,0,1]=4 3234 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)Cl 1458a_100016266692_100000181238 [0,1,0,0,0,0|2,0,1]=4 3235 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)F 1458a_100016266692_100000230114 [0,1,0,0,0,0|2,0,1]=4 3236 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)I 1458a_100016266692_100011218688 [0,1,0,0,0,0|2,0,1]=4 3237 B15R1.129 CCOC=CC(=O)Cc1cccc(c1)O 1458a_100016266692_100011660834 [0,1,0,0,0,0|2,0,1]=4 3238 B15R1.129 CCOCCC(=O)Cc1cc(ccn1)Br 1458a_100000749530_100010173614 [0,1,0,0,0,0|3,0,0]=4 3239 B15R1.129 CCOCCC(=O)Cc1cc(ccn1)C 1458a_100000749530_100000718516 [0,1,0,0,0,0|3,0,0]=4 3240 B15R1.129 CCOCCC(=O)Cc1cc(ccn1)Cl 1458a_100000749530_100016988179 [0,1,0,0,0,0|3,0,0]=4 3241 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215890 [0,1,0,0,0,0|2,0,0]=3 3242 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Br 1458a_100000749530_100000211773 [0,1,0,0,0,0|2,0,0]=3 3243 B15R1.129 CCOCCC(=O)Cc1cccc(c1)C 1458a_100000749530_100000211840 [0,1,0,0,0,0|2,0,0]=3 3244 B15R1.129 CCOCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011215890 [0,1,0,0,0,0|2,0,0]=3 3245 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215890 [0,1,0,0,0,0|2,0,0]=3 3246 B15R1.129 CCOCCC(=O)Cc1cccc(c1)Cl 1458a_100000749530_100000181238 [0,1,0,0,0,0|2,0,0]=3 3247 B15R1.129 CCOCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215890 [0,1,0,0,0,0|2,0,0]=3 3248 B15R1.129 CCOCCC(=O)Cc1cccc(c1)F 1458a_100000749530_100000230114 [0,1,0,0,0,0|2,0,0]=3 3249 B15R1.129 CCOCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215890 [0,1,0,0,0,0|2,0,0]=3 3250 B15R1.129 CCOCCC(=O)Cc1cccc(c1)I 1458a_100000749530_100011218688 [0,1,0,0,0,0|2,0,0]=3 3251 B15R1.129 CCOCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215890 [0,1,0,0,0,0|2,0,0]=3 3252 B15R1.129 CCOCCC(=O)Cc1cccc(c1)O 1458a_100000749530_100011660834 [0,1,0,0,0,0|2,0,0]=3 3253 B15R1.129 CCOCCC(=O)Cc1cccc(n1)Br 1458a_100000749530_100009889011 [0,1,0,0,0,0|3,0,0]=4 3254 B15R1.129 CCOCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100011215890 [0,1,0,0,0,0|3,0,0]=4 3255 B15R1.129 CCOCCC(=O)Cc1cccc(n1)C 1458a_100000749530_100000757606 [0,1,0,0,0,0|3,0,0]=4 3256 B15R1.129 CCOCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100011215890 [0,1,0,0,0,0|3,0,0]=4 3257 B15R1.129 CCOCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100011215890 [0,1,0,0,0,0|3,0,0]=4 3258 B15R1.129 CCOCCC(=O)Cc1cccc(n1)Cl 1458a_100000749530_100000086093 [0,1,0,0,0,0|3,0,0]=4 3259 B15R1.129 CCOCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100011215890 [0,1,0,0,0,0|3,0,0]=4 3260 B15R1.129 CCOCCC(=O)Cc1cccc(n1)F 1458a_100000749530_100009819644 [0,1,0,0,0,0|3,0,0]=4 3261 B15R1.129 CCOCCC(=O)Cc1ccnc(c1)Br 1458a_100000749530_100010243470 [0,1,0,0,0,0|3,0,0]=4 3262 B15R1.129 CCOCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100011215890 [0,1,0,0,0,0|3,0,0]=4 3263 B15R1.129 CCOCCC(=O)Cc1ccnc(c1)C 1458a_100000749530_200020672517 [0,1,0,0,0,0|3,0,0]=4 3264 B15R1.129 CCOCCC(=O)Cc1ccnc(c1)Cl 1458a_100000749530_100000764220 [0,1,0,0,0,0|3,0,0]=4 3265 B15R1.129 CCOCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100011215890 [0,1,0,0,0,0|3,0,0]=4 3266 B15R1.129 CCOCCC(=O)Cc1cncc(c1)Br 1458a_100000749530_100011740620 [0,1,0,0,0,0|3,0,0]=4 3267 B15R1.129 CCOCCC(=O)Cc1cncc(c1)C 1458a_100000749530_100000716715 [0,1,0,0,0,0|3,0,0]=4 3268 B15R1.129 CCOCCC(=O)Cc1cncc(c1)Cl 1458a_100000749530_100016992070 [0,1,0,0,0,0|3,0,0]=4 3269 B15R1.129 CCOCCC(=O)Cc1cncc(c1)F 1458a_100000749530_100000725299 [0,1,0,0,0,0|3,0,0]=4 3270 B15R1.129 CCOCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100011215890 [0,1,0,0,0,0|3,0,0]=4 3271 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000749530 [0,1,0,0,0,0|3,0,0]=4 3272 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000749530 [0,1,0,0,0,0|3,0,0]=4 3273 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000749530 [0,1,0,0,0,0|3,0,0]=4 3274 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000749530 [0,1,0,0,0,0|3,0,0]=4 3275 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000749530 [0,1,0,0,0,0|3,0,0]=4 3276 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000749530 [0,1,0,0,0,0|3,0,0]=4 3277 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000749530 [0,1,0,0,0,0|3,0,0]=4 3278 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 34a_100121572206_100011194834 [0,1,0,0,0,0|3,0,0]=4 3279 B15R1.129 CCOCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000749530 [0,1,0,0,0,0|3,0,0]=4 3280 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000749530 [0,1,0,0,0,0|3,0,0]=4 3281 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000749530 [0,1,0,0,0,0|3,0,0]=4 3282 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000749530 [0,1,0,0,0,0|3,0,0]=4 3283 B15R1.129 CCOCCC(=O)Nc1cccc(c1)Cl 34a_100121572206_100000242061 [0,1,0,0,0,0|3,0,0]=4 3284 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000749530 [0,1,0,0,0,0|3,0,0]=4 3285 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000749530 [0,1,0,0,0,0|3,0,0]=4 3286 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000749530 [0,1,0,0,0,0|3,0,0]=4 3287 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 34a_100121572206_100000242062 [0,1,0,0,0,0|3,0,0]=4 3288 B15R1.129 CCOCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000749530 [0,1,0,0,0,0|3,0,0]=4 3289 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000749530 [0,1,0,0,0,0|3,0,0]=4 3290 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000749530 [0,1,0,0,0,0|3,0,0]=4 3291 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000749530 [0,1,0,0,0,0|3,0,0]=4 3292 B15R1.129 CCOCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000749530 [0,1,0,0,0,0|3,0,0]=4 3293 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000749530 [0,1,0,0,0,0|3,0,0]=4 3294 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000749530 [0,1,0,0,0,0|3,0,0]=4 3295 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 34a_100121572206_200011436826 [0,1,0,0,0,0|3,0,0]=4 3296 B15R1.129 CCOCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000749530 [0,1,0,0,0,0|3,0,0]=4 3297 B15R1.129 CCSCCC(=O)Cc1cc(ccn1)Br 1458a_100000230768_100010173614 [0,1,0,0,0,0|3,0,0]=4 3298 B15R1.129 CCSCCC(=O)Cc1cc(ccn1)C 1458a_100000230768_100000718516 [0,1,0,0,0,0|3,0,0]=4 3299 B15R1.129 CCSCCC(=O)Cc1cc(ccn1)Cl 1458a_100000230768_100016988179 [0,1,0,0,0,0|3,0,0]=4 3300 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Br 1458a_100000230768_100000211773 [0,1,0,0,0,0|2,0,0]=3 3301 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000757381 [0,1,0,0,0,0|2,0,0]=3 3302 B15R1.129 CCSCCC(=O)Cc1cccc(c1)C 1458a_100000230768_100000211840 [0,1,0,0,0,0|2,0,0]=3 3303 B15R1.129 CCSCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000757381 [0,1,0,0,0,0|2,0,0]=3 3304 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Cl 1458a_100000230768_100000181238 [0,1,0,0,0,0|2,0,0]=3 3305 B15R1.129 CCSCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000757381 [0,1,0,0,0,0|2,0,0]=3 3306 B15R1.129 CCSCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000757381 [0,1,0,0,0,0|2,0,0]=3 3307 B15R1.129 CCSCCC(=O)Cc1cccc(c1)F 1458a_100000230768_100000230114 [0,1,0,0,0,0|2,0,0]=3 3308 B15R1.129 CCSCCC(=O)Cc1cccc(c1)I 1458a_100000230768_100011218688 [0,1,0,0,0,0|2,0,0]=3 3309 B15R1.129 CCSCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000757381 [0,1,0,0,0,0|2,0,0]=3 3310 B15R1.129 CCSCCC(=O)Cc1cccc(c1)O 1458a_100000230768_100011660834 [0,1,0,0,0,0|2,0,0]=3 3311 B15R1.129 CCSCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000757381 [0,1,0,0,0,0|2,0,0]=3 3312 B15R1.129 CCSCCC(=O)Cc1cccc(n1)Br 1458a_100000230768_100009889011 [0,1,0,0,0,0|3,0,0]=4 3313 B15R1.129 CCSCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000757381 [0,1,0,0,0,0|3,0,0]=4 3314 B15R1.129 CCSCCC(=O)Cc1cccc(n1)C 1458a_100000230768_100000757606 [0,1,0,0,0,0|3,0,0]=4 3315 B15R1.129 CCSCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000757381 [0,1,0,0,0,0|3,0,0]=4 3316 B15R1.129 CCSCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000757381 [0,1,0,0,0,0|3,0,0]=4 3317 B15R1.129 CCSCCC(=O)Cc1cccc(n1)Cl 1458a_100000230768_100000086093 [0,1,0,0,0,0|3,0,0]=4 3318 B15R1.129 CCSCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000757381 [0,1,0,0,0,0|3,0,0]=4 3319 B15R1.129 CCSCCC(=O)Cc1cccc(n1)F 1458a_100000230768_100009819644 [0,1,0,0,0,0|3,0,0]=4 3320 B15R1.129 CCSCCC(=O)Cc1ccnc(c1)Br 1458a_100000230768_100010243470 [0,1,0,0,0,0|3,0,0]=4 3321 B15R1.129 CCSCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000757381 [0,1,0,0,0,0|3,0,0]=4 3322 B15R1.129 CCSCCC(=O)Cc1ccnc(c1)C 1458a_100000230768_200020672517 [0,1,0,0,0,0|3,0,0]=4 3323 B15R1.129 CCSCCC(=O)Cc1ccnc(c1)Cl 1458a_100000230768_100000764220 [0,1,0,0,0,0|3,0,0]=4 3324 B15R1.129 CCSCCC(=O)Cc1cncc(c1)Br 1458a_100000230768_100011740620 [0,1,0,0,0,0|3,0,0]=4 3325 B15R1.129 CCSCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000757381 [0,1,0,0,0,0|3,0,0]=4 3326 B15R1.129 CCSCCC(=O)Cc1cncc(c1)C 1458a_100000230768_100000716715 [0,1,0,0,0,0|3,0,0]=4 3327 B15R1.129 CCSCCC(=O)Cc1cncc(c1)Cl 1458a_100000230768_100016992070 [0,1,0,0,0,0|3,0,0]=4 3328 B15R1.129 CCSCCC(=O)Cc1cncc(c1)F 1458a_100000230768_100000725299 [0,1,0,0,0,0|3,0,0]=4 3329 B15R1.129 CCSCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000757381 [0,1,0,0,0,0|3,0,0]=4 3330 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000230768 [0,1,0,0,0,0|3,0,0]=4 3331 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000230768 [0,1,0,0,0,0|3,0,0]=4 3332 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000230768 [0,1,0,0,0,0|3,0,0]=4 3333 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000230768 [0,1,0,0,0,0|3,0,0]=4 3334 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000230768 [0,1,0,0,0,0|3,0,0]=4 3335 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000230768 [0,1,0,0,0,0|3,0,0]=4 3336 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000230768 [0,1,0,0,0,0|3,0,0]=4 3337 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000230768 [0,1,0,0,0,0|3,0,0]=4 3338 B15R1.129 CCSCCC(=O)Nc1cccc(c1)C 62a_100000210202_100011194834 [0,1,0,0,0,0|3,0,0]=4 3339 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000230768 [0,1,0,0,0,0|3,0,0]=4 3340 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000230768 [0,1,0,0,0,0|3,0,0]=4 3341 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000230768 [0,1,0,0,0,0|3,0,0]=4 3342 B15R1.129 CCSCCC(=O)Nc1cccc(c1)Cl 62a_100000210202_100000242061 [0,1,0,0,0,0|3,0,0]=4 3343 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000230768 [0,1,0,0,0,0|3,0,0]=4 3344 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000230768 [0,1,0,0,0,0|3,0,0]=4 3345 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000230768 [0,1,0,0,0,0|3,0,0]=4 3346 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000230768 [0,1,0,0,0,0|3,0,0]=4 3347 B15R1.129 CCSCCC(=O)Nc1cccc(c1)F 62a_100000210202_100000242062 [0,1,0,0,0,0|3,0,0]=4 3348 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000230768 [0,1,0,0,0,0|3,0,0]=4 3349 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000230768 [0,1,0,0,0,0|3,0,0]=4 3350 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000230768 [0,1,0,0,0,0|3,0,0]=4 3351 B15R1.129 CCSCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000230768 [0,1,0,0,0,0|3,0,0]=4 3352 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000230768 [0,1,0,0,0,0|3,0,0]=4 3353 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000230768 [0,1,0,0,0,0|3,0,0]=4 3354 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000230768 [0,1,0,0,0,0|3,0,0]=4 3355 B15R1.129 CCSCCC(=O)Nc1cccc(c1)O 62a_100000210202_200011436826 [0,1,0,0,0,0|3,0,0]=4 3356 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 2230a_106832991635_100000184976 [0,1,0,0,0,0|3,0,0]=4 3357 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 34a_100102657272_100000184976 [0,1,0,0,0,0|3,0,0]=4 3358 B15R1.129 CNCCCC(=O)Nc1cccc(c1)C 7a_106832991635_100000184976 [0,1,0,0,0,0|3,0,0]=4 3359 B15R1.129 CNCCCC(=O)Nc1cccc(c1)Cl 2230a_114873766722_200000210301 [0,1,0,0,0,0|3,0,0]=4 3360 B15R1.129 CNCCCC(=O)Nc1cccc(c1)Cl 34a_114873766722_200000210301 [0,1,0,0,0,0|3,0,0]=4 3361 B15R1.129 CNCCNC(=O)Cc1cccc(c1)F 2230a_106430523477_200000210301 [0,1,0,0,0,0|2,0,0]=3 3362 B15R1.129 CNCCNC(=O)Cc1cccc(c1)F 34a_106430523477_200000210301 [0,1,0,0,0,0|2,0,0]=3 3363 B15R1.129 CNCCNC(=O)Nc1cccc(c1)F 2230a_106832991635_100000163364 [0,1,0,0,0,0|3,0,0]=4 3364 B15R1.129 CNCCNC(=O)Nc1cccc(c1)F 7a_106832991635_100000163364 [0,1,0,0,0,0|3,0,0]=4 3365 B15R1.129 CNCCOC(=O)Nc1cccc(c1)Br 34a_100102657272_100015757870 [0,1,0,0,0,0|2,0,0]=3 3366 B15R1.129 CNCCOC(=O)Nc1cccc(c1)Br 7a_106832991635_100015757870 [0,1,0,0,0,0|2,0,0]=3 3367 B15R1.129 COCC=CC(=O)Cc1cccc(c1)Br 1458a_100016285016_100000211773 [0,1,0,0,0,0|2,0,1]=4 3368 B15R1.129 COCC=CC(=O)Cc1cccc(c1)C 1458a_100016285016_100000211840 [0,1,0,0,0,0|2,0,1]=4 3369 B15R1.129 COCC=CC(=O)Cc1cccc(c1)Cl 1458a_100016285016_100000181238 [0,1,0,0,0,0|2,0,1]=4 3370 B15R1.129 COCC=CC(=O)Cc1cccc(c1)F 1458a_100016285016_100000230114 [0,1,0,0,0,0|2,0,1]=4 3371 B15R1.129 COCC=CC(=O)Cc1cccc(c1)I 1458a_100016285016_100011218688 [0,1,0,0,0,0|2,0,1]=4 3372 B15R1.129 COCC=CC(=O)Cc1cccc(c1)O 1458a_100016285016_100011660834 [0,1,0,0,0,0|2,0,1]=4 3373 B15R1.129 COCCCC(=O)Cc1cc(ccn1)Br 1458a_100000741012_100010173614 [0,1,0,0,0,0|3,0,0]=4 3374 B15R1.129 COCCCC(=O)Cc1cc(ccn1)C 1458a_100000741012_100000718516 [0,1,0,0,0,0|3,0,0]=4 3375 B15R1.129 COCCCC(=O)Cc1cc(ccn1)Cl 1458a_100000741012_100016988179 [0,1,0,0,0,0|3,0,0]=4 3376 B15R1.129 COCCCC(=O)Cc1cccc(c1)Br 1458a_100000741012_100000211773 [0,1,0,0,0,0|2,0,0]=3 3377 B15R1.129 COCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000740836 [0,1,0,0,0,0|2,0,0]=3 3378 B15R1.129 COCCCC(=O)Cc1cccc(c1)C 1458a_100000741012_100000211840 [0,1,0,0,0,0|2,0,0]=3 3379 B15R1.129 COCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000740836 [0,1,0,0,0,0|2,0,0]=3 3380 B15R1.129 COCCCC(=O)Cc1cccc(c1)Cl 1458a_100000741012_100000181238 [0,1,0,0,0,0|2,0,0]=3 3381 B15R1.129 COCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000740836 [0,1,0,0,0,0|2,0,0]=3 3382 B15R1.129 COCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000740836 [0,1,0,0,0,0|2,0,0]=3 3383 B15R1.129 COCCCC(=O)Cc1cccc(c1)F 1458a_100000741012_100000230114 [0,1,0,0,0,0|2,0,0]=3 3384 B15R1.129 COCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000740836 [0,1,0,0,0,0|2,0,0]=3 3385 B15R1.129 COCCCC(=O)Cc1cccc(c1)I 1458a_100000741012_100011218688 [0,1,0,0,0,0|2,0,0]=3 3386 B15R1.129 COCCCC(=O)Cc1cccc(c1)O 1458a_100000741012_100011660834 [0,1,0,0,0,0|2,0,0]=3 3387 B15R1.129 COCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000740836 [0,1,0,0,0,0|2,0,0]=3 3388 B15R1.129 COCCCC(=O)Cc1cccc(n1)Br 1458a_100000741012_100009889011 [0,1,0,0,0,0|3,0,0]=4 3389 B15R1.129 COCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000740836 [0,1,0,0,0,0|3,0,0]=4 3390 B15R1.129 COCCCC(=O)Cc1cccc(n1)C 1458a_100000741012_100000757606 [0,1,0,0,0,0|3,0,0]=4 3391 B15R1.129 COCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000740836 [0,1,0,0,0,0|3,0,0]=4 3392 B15R1.129 COCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000740836 [0,1,0,0,0,0|3,0,0]=4 3393 B15R1.129 COCCCC(=O)Cc1cccc(n1)Cl 1458a_100000741012_100000086093 [0,1,0,0,0,0|3,0,0]=4 3394 B15R1.129 COCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000740836 [0,1,0,0,0,0|3,0,0]=4 3395 B15R1.129 COCCCC(=O)Cc1cccc(n1)F 1458a_100000741012_100009819644 [0,1,0,0,0,0|3,0,0]=4 3396 B15R1.129 COCCCC(=O)Cc1ccnc(c1)Br 1458a_100000741012_100010243470 [0,1,0,0,0,0|3,0,0]=4 3397 B15R1.129 COCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000740836 [0,1,0,0,0,0|3,0,0]=4 3398 B15R1.129 COCCCC(=O)Cc1ccnc(c1)C 1458a_100000741012_200020672517 [0,1,0,0,0,0|3,0,0]=4 3399 B15R1.129 COCCCC(=O)Cc1ccnc(c1)Cl 1458a_100000741012_100000764220 [0,1,0,0,0,0|3,0,0]=4 3400 B15R1.129 COCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000740836 [0,1,0,0,0,0|3,0,0]=4 3401 B15R1.129 COCCCC(=O)Cc1cncc(c1)Br 1458a_100000741012_100011740620 [0,1,0,0,0,0|3,0,0]=4 3402 B15R1.129 COCCCC(=O)Cc1cncc(c1)C 1458a_100000741012_100000716715 [0,1,0,0,0,0|3,0,0]=4 3403 B15R1.129 COCCCC(=O)Cc1cncc(c1)Cl 1458a_100000741012_100016992070 [0,1,0,0,0,0|3,0,0]=4 3404 B15R1.129 COCCCC(=O)Cc1cncc(c1)F 1458a_100000741012_100000725299 [0,1,0,0,0,0|3,0,0]=4 3405 B15R1.129 COCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000740836 [0,1,0,0,0,0|3,0,0]=4 3406 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000741012 [0,1,0,0,0,0|3,0,0]=4 3407 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000741012 [0,1,0,0,0,0|3,0,0]=4 3408 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000741012 [0,1,0,0,0,0|3,0,0]=4 3409 B15R1.129 COCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000741012 [0,1,0,0,0,0|3,0,0]=4 3410 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000741012 [0,1,0,0,0,0|3,0,0]=4 3411 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000741012 [0,1,0,0,0,0|3,0,0]=4 3412 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000741012 [0,1,0,0,0,0|3,0,0]=4 3413 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 34a_100138415774_100000184976 [0,1,0,0,0,0|3,0,0]=4 3414 B15R1.129 COCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000741012 [0,1,0,0,0,0|3,0,0]=4 3415 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000741012 [0,1,0,0,0,0|3,0,0]=4 3416 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000741012 [0,1,0,0,0,0|3,0,0]=4 3417 B15R1.129 COCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000741012 [0,1,0,0,0,0|3,0,0]=4 3418 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000741012 [0,1,0,0,0,0|3,0,0]=4 3419 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000741012 [0,1,0,0,0,0|3,0,0]=4 3420 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000741012 [0,1,0,0,0,0|3,0,0]=4 3421 B15R1.129 COCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000741012 [0,1,0,0,0,0|3,0,0]=4 3422 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000741012 [0,1,0,0,0,0|3,0,0]=4 3423 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000741012 [0,1,0,0,0,0|3,0,0]=4 3424 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000741012 [0,1,0,0,0,0|3,0,0]=4 3425 B15R1.129 COCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000741012 [0,1,0,0,0,0|3,0,0]=4 3426 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000741012 [0,1,0,0,0,0|3,0,0]=4 3427 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000741012 [0,1,0,0,0,0|3,0,0]=4 3428 B15R1.129 COCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000741012 [0,1,0,0,0,0|3,0,0]=4 3429 B15R1.129 COCCNC(=O)Cc1cccc(c1)Br 240690a_100000209980_100000747190 [0,1,0,0,0,0|2,0,0]=3 3430 B15R1.129 COCCNC(=O)Cc1cccc(c1)Br 527a_100000209980_100000747190 [0,1,0,0,0,0|2,0,0]=3 3431 B15R1.129 COCCNC(=O)Cc1cccc(c1)C 1626a_100000209980_100011206899 [0,1,0,0,0,0|2,0,0]=3 3432 B15R1.129 COCCNC(=O)Cc1cccc(c1)C 240690a_100000209980_100011206899 [0,1,0,0,0,0|2,0,0]=3 3433 B15R1.129 COCCNC(=O)Cc1cccc(c1)C 527a_100000209980_100011206899 [0,1,0,0,0,0|2,0,0]=3 3434 B15R1.129 COCCNC(=O)Cc1cccc(c1)Cl 1626a_100000209980_100000749307 [0,1,0,0,0,0|2,0,0]=3 3435 B15R1.129 COCCNC(=O)Cc1cccc(c1)Cl 240690a_100000209980_100000749307 [0,1,0,0,0,0|2,0,0]=3 3436 B15R1.129 COCCNC(=O)Cc1cccc(c1)Cl 527a_100000209980_100000749307 [0,1,0,0,0,0|2,0,0]=3 3437 B15R1.129 COCCNC(=O)Cc1cccc(c1)F 1626a_100000209980_100000211661 [0,1,0,0,0,0|2,0,0]=3 3438 B15R1.129 COCCNC(=O)Cc1cccc(c1)F 240690a_100000209980_100000211661 [0,1,0,0,0,0|2,0,0]=3 3439 B15R1.129 COCCNC(=O)Cc1cccc(c1)F 527a_100000209980_100000211661 [0,1,0,0,0,0|2,0,0]=3 3440 B15R1.129 COCCNC(=O)Cc1cccc(c1)I 1626a_100000209980_100000238430 [0,1,0,0,0,0|2,0,0]=3 3441 B15R1.129 COCCNC(=O)Cc1cccc(c1)I 240690a_100000209980_100000238430 [0,1,0,0,0,0|2,0,0]=3 3442 B15R1.129 COCCNC(=O)Cc1cccc(c1)I 527a_100000209980_100000238430 [0,1,0,0,0,0|2,0,0]=3 3443 B15R1.129 COCCNC(=O)Cc1cccc(c1)O 240690a_100000209980_100000745134 [0,1,0,0,0,0|2,0,0]=3 3444 B15R1.129 COCCNC(=O)Cc1cccc(c1)O 527a_100000209980_100000745134 [0,1,0,0,0,0|2,0,0]=3 3445 B15R1.129 COCCNC(=O)Cc1cccc(n1)Br 240690a_100000209980_100010201708 [0,1,0,0,0,0|3,0,0]=4 3446 B15R1.129 COCCNC(=O)Cc1cccc(n1)Br 527a_100000209980_100010201708 [0,1,0,0,0,0|3,0,0]=4 3447 B15R1.129 COCCNC(=O)Cc1cccc(n1)C 1626a_100000209980_100012001110 [0,1,0,0,0,0|3,0,0]=4 3448 B15R1.129 COCCNC(=O)Cc1cccc(n1)C 240690a_100000209980_100012001110 [0,1,0,0,0,0|3,0,0]=4 3449 B15R1.129 COCCNC(=O)Cc1cccc(n1)C 527a_100000209980_100012001110 [0,1,0,0,0,0|3,0,0]=4 3450 B15R1.129 COCCNC(=O)Cc1cccc(n1)Cl 1626a_100000209980_100000090259 [0,1,0,0,0,0|3,0,0]=4 3451 B15R1.129 COCCNC(=O)Cc1cccc(n1)Cl 240690a_100000209980_100000090259 [0,1,0,0,0,0|3,0,0]=4 3452 B15R1.129 COCCNC(=O)Cc1cccc(n1)F 1626a_100000209980_100000096803 [0,1,0,0,0,0|3,0,0]=4 3453 B15R1.129 COCCNC(=O)Cc1cccc(n1)F 240690a_100000209980_100000096803 [0,1,0,0,0,0|3,0,0]=4 3454 B15R1.129 COCCNC(=O)Cc1ccnc(c1)Br 240690a_100000209980_100010126891 [0,1,0,0,0,0|3,0,0]=4 3455 B15R1.129 COCCNC(=O)Cc1ccnc(c1)Br 527a_100000209980_100010126891 [0,1,0,0,0,0|3,0,0]=4 3456 B15R1.129 COCCNC(=O)Cc1ccnc(c1)Cl 1626a_100000209980_100000085289 [0,1,0,0,0,0|3,0,0]=4 3457 B15R1.129 COCCNC(=O)Cc1ccnc(c1)Cl 240690a_100000209980_100000085289 [0,1,0,0,0,0|3,0,0]=4 3458 B15R1.129 COCCNC(=O)Cc1ccnc(c1)Cl 527a_100000209980_100000085289 [0,1,0,0,0,0|3,0,0]=4 3459 B15R1.129 COCCNC(=O)Cc1cncc(c1)Br 240690a_100000209980_100000239331 [0,1,0,0,0,0|3,0,0]=4 3460 B15R1.129 COCCNC(=O)Cc1cncc(c1)Br 527a_100000209980_100000239331 [0,1,0,0,0,0|3,0,0]=4 3461 B15R1.129 COCCNC(=O)Cc1cncc(c1)F 240690a_100000209980_100011667516 [0,1,0,0,0,0|3,0,0]=4 3462 B15R1.129 COCCNC(=O)Cc1cncc(c1)F 527a_100000209980_100011667516 [0,1,0,0,0,0|3,0,0]=4 3463 B15R1.129 COCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000209980 [0,1,0,0,0,0|3,0,0]=4 3464 B15R1.129 COCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000209980 [0,1,0,0,0,0|3,0,0]=4 3465 B15R1.129 COCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000209980 [0,1,0,0,0,0|3,0,0]=4 3466 B15R1.129 COCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000209980 [0,1,0,0,0,0|3,0,0]=4 3467 B15R1.129 COCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000209980 [0,1,0,0,0,0|3,0,0]=4 3468 B15R1.129 COCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000209980 [0,1,0,0,0,0|3,0,0]=4 3469 B15R1.129 COCCOC(=O)Nc1cccc(c1)Br 34a_100138415774_100015757870 [0,1,0,0,0,0|2,0,0]=3 3470 B15R1.129 CSCCCC(=O)Cc1cc(ccn1)Br 1458a_100000173376_100010173614 [0,1,0,0,0,0|3,0,0]=4 3471 B15R1.129 CSCCCC(=O)Cc1cc(ccn1)C 1458a_100000173376_100000718516 [0,1,0,0,0,0|3,0,0]=4 3472 B15R1.129 CSCCCC(=O)Cc1cc(ccn1)Cl 1458a_100000173376_100016988179 [0,1,0,0,0,0|3,0,0]=4 3473 B15R1.129 CSCCCC(=O)Cc1cccc(c1)Br 1458a_100000173376_100000211773 [0,1,0,0,0,0|2,0,0]=3 3474 B15R1.129 CSCCCC(=O)Cc1cccc(c1)C 1458a_100000173376_100000211840 [0,1,0,0,0,0|2,0,0]=3 3475 B15R1.129 CSCCCC(=O)Cc1cccc(c1)Cl 1458a_100000173376_100000181238 [0,1,0,0,0,0|2,0,0]=3 3476 B15R1.129 CSCCCC(=O)Cc1cccc(c1)F 1458a_100000173376_100000230114 [0,1,0,0,0,0|2,0,0]=3 3477 B15R1.129 CSCCCC(=O)Cc1cccc(c1)I 1458a_100000173376_100011218688 [0,1,0,0,0,0|2,0,0]=3 3478 B15R1.129 CSCCCC(=O)Cc1cccc(c1)O 1458a_100000173376_100011660834 [0,1,0,0,0,0|2,0,0]=3 3479 B15R1.129 CSCCCC(=O)Cc1cccc(n1)Br 1458a_100000173376_100009889011 [0,1,0,0,0,0|3,0,0]=4 3480 B15R1.129 CSCCCC(=O)Cc1cccc(n1)C 1458a_100000173376_100000757606 [0,1,0,0,0,0|3,0,0]=4 3481 B15R1.129 CSCCCC(=O)Cc1cccc(n1)Cl 1458a_100000173376_100000086093 [0,1,0,0,0,0|3,0,0]=4 3482 B15R1.129 CSCCCC(=O)Cc1cccc(n1)F 1458a_100000173376_100009819644 [0,1,0,0,0,0|3,0,0]=4 3483 B15R1.129 CSCCCC(=O)Cc1ccnc(c1)Br 1458a_100000173376_100010243470 [0,1,0,0,0,0|3,0,0]=4 3484 B15R1.129 CSCCCC(=O)Cc1ccnc(c1)C 1458a_100000173376_200020672517 [0,1,0,0,0,0|3,0,0]=4 3485 B15R1.129 CSCCCC(=O)Cc1ccnc(c1)Cl 1458a_100000173376_100000764220 [0,1,0,0,0,0|3,0,0]=4 3486 B15R1.129 CSCCCC(=O)Cc1cncc(c1)Br 1458a_100000173376_100011740620 [0,1,0,0,0,0|3,0,0]=4 3487 B15R1.129 CSCCCC(=O)Cc1cncc(c1)C 1458a_100000173376_100000716715 [0,1,0,0,0,0|3,0,0]=4 3488 B15R1.129 CSCCCC(=O)Cc1cncc(c1)Cl 1458a_100000173376_100016992070 [0,1,0,0,0,0|3,0,0]=4 3489 B15R1.129 CSCCCC(=O)Cc1cncc(c1)F 1458a_100000173376_100000725299 [0,1,0,0,0,0|3,0,0]=4 3490 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000173376 [0,1,0,0,0,0|3,0,0]=4 3491 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000173376 [0,1,0,0,0,0|3,0,0]=4 3492 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000173376 [0,1,0,0,0,0|3,0,0]=4 3493 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000173376 [0,1,0,0,0,0|3,0,0]=4 3494 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000173376 [0,1,0,0,0,0|3,0,0]=4 3495 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000173376 [0,1,0,0,0,0|3,0,0]=4 3496 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000173376 [0,1,0,0,0,0|3,0,0]=4 3497 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000173376 [0,1,0,0,0,0|3,0,0]=4 3498 B15R1.129 CSCCCC(=O)Nc1cccc(c1)C 62a_200000210301_100000184976 [0,1,0,0,0,0|3,0,0]=4 3499 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000173376 [0,1,0,0,0,0|3,0,0]=4 3500 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000173376 [0,1,0,0,0,0|3,0,0]=4 3501 B15R1.129 CSCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000173376 [0,1,0,0,0,0|3,0,0]=4 3502 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000173376 [0,1,0,0,0,0|3,0,0]=4 3503 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000173376 [0,1,0,0,0,0|3,0,0]=4 3504 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000173376 [0,1,0,0,0,0|3,0,0]=4 3505 B15R1.129 CSCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000173376 [0,1,0,0,0,0|3,0,0]=4 3506 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000173376 [0,1,0,0,0,0|3,0,0]=4 3507 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000173376 [0,1,0,0,0,0|3,0,0]=4 3508 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000173376 [0,1,0,0,0,0|3,0,0]=4 3509 B15R1.129 CSCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000173376 [0,1,0,0,0,0|3,0,0]=4 3510 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000173376 [0,1,0,0,0,0|3,0,0]=4 3511 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000173376 [0,1,0,0,0,0|3,0,0]=4 3512 B15R1.129 CSCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000173376 [0,1,0,0,0,0|3,0,0]=4 3513 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Br 11a_100020590264_100000747190 [0,1,0,0,0,0|2,0,0]=3 3514 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Br 240690a_100020590264_100000747190 [0,1,0,0,0,0|2,0,0]=3 3515 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Br 527a_100020590264_100000747190 [0,1,0,0,0,0|2,0,0]=3 3516 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C 11a_100020590264_100011206899 [0,1,0,0,0,0|2,0,0]=3 3517 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C 1626a_100020590264_100011206899 [0,1,0,0,0,0|2,0,0]=3 3518 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C 240690a_100020590264_100011206899 [0,1,0,0,0,0|2,0,0]=3 3519 B15R1.129 CSCCNC(=O)Cc1cccc(c1)C 527a_100020590264_100011206899 [0,1,0,0,0,0|2,0,0]=3 3520 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl 11a_100020590264_100000749307 [0,1,0,0,0,0|2,0,0]=3 3521 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl 1626a_100020590264_100000749307 [0,1,0,0,0,0|2,0,0]=3 3522 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl 240690a_100020590264_100000749307 [0,1,0,0,0,0|2,0,0]=3 3523 B15R1.129 CSCCNC(=O)Cc1cccc(c1)Cl 527a_100020590264_100000749307 [0,1,0,0,0,0|2,0,0]=3 3524 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F 11a_100020590264_100000211661 [0,1,0,0,0,0|2,0,0]=3 3525 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F 1626a_100020590264_100000211661 [0,1,0,0,0,0|2,0,0]=3 3526 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F 240690a_100020590264_100000211661 [0,1,0,0,0,0|2,0,0]=3 3527 B15R1.129 CSCCNC(=O)Cc1cccc(c1)F 527a_100020590264_100000211661 [0,1,0,0,0,0|2,0,0]=3 3528 B15R1.129 CSCCNC(=O)Cc1cccc(c1)I 11a_100020590264_100000238430 [0,1,0,0,0,0|2,0,0]=3 3529 B15R1.129 CSCCNC(=O)Cc1cccc(c1)I 1626a_100020590264_100000238430 [0,1,0,0,0,0|2,0,0]=3 3530 B15R1.129 CSCCNC(=O)Cc1cccc(c1)I 240690a_100020590264_100000238430 [0,1,0,0,0,0|2,0,0]=3 3531 B15R1.129 CSCCNC(=O)Cc1cccc(c1)I 527a_100020590264_100000238430 [0,1,0,0,0,0|2,0,0]=3 3532 B15R1.129 CSCCNC(=O)Cc1cccc(c1)O 240690a_100020590264_100000745134 [0,1,0,0,0,0|2,0,0]=3 3533 B15R1.129 CSCCNC(=O)Cc1cccc(c1)O 527a_100020590264_100000745134 [0,1,0,0,0,0|2,0,0]=3 3534 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Br 11a_100020590264_100010201708 [0,1,0,0,0,0|3,0,0]=4 3535 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Br 240690a_100020590264_100010201708 [0,1,0,0,0,0|3,0,0]=4 3536 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Br 527a_100020590264_100010201708 [0,1,0,0,0,0|3,0,0]=4 3537 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C 11a_100020590264_100012001110 [0,1,0,0,0,0|3,0,0]=4 3538 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C 1626a_100020590264_100012001110 [0,1,0,0,0,0|3,0,0]=4 3539 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C 240690a_100020590264_100012001110 [0,1,0,0,0,0|3,0,0]=4 3540 B15R1.129 CSCCNC(=O)Cc1cccc(n1)C 527a_100020590264_100012001110 [0,1,0,0,0,0|3,0,0]=4 3541 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Cl 11a_100020590264_100000090259 [0,1,0,0,0,0|3,0,0]=4 3542 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Cl 1626a_100020590264_100000090259 [0,1,0,0,0,0|3,0,0]=4 3543 B15R1.129 CSCCNC(=O)Cc1cccc(n1)Cl 240690a_100020590264_100000090259 [0,1,0,0,0,0|3,0,0]=4 3544 B15R1.129 CSCCNC(=O)Cc1cccc(n1)F 11a_100020590264_100000096803 [0,1,0,0,0,0|3,0,0]=4 3545 B15R1.129 CSCCNC(=O)Cc1cccc(n1)F 1626a_100020590264_100000096803 [0,1,0,0,0,0|3,0,0]=4 3546 B15R1.129 CSCCNC(=O)Cc1cccc(n1)F 240690a_100020590264_100000096803 [0,1,0,0,0,0|3,0,0]=4 3547 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Br 11a_100020590264_100010126891 [0,1,0,0,0,0|3,0,0]=4 3548 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Br 240690a_100020590264_100010126891 [0,1,0,0,0,0|3,0,0]=4 3549 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Br 527a_100020590264_100010126891 [0,1,0,0,0,0|3,0,0]=4 3550 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Cl 11a_100020590264_100000085289 [0,1,0,0,0,0|3,0,0]=4 3551 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Cl 1626a_100020590264_100000085289 [0,1,0,0,0,0|3,0,0]=4 3552 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Cl 240690a_100020590264_100000085289 [0,1,0,0,0,0|3,0,0]=4 3553 B15R1.129 CSCCNC(=O)Cc1ccnc(c1)Cl 527a_100020590264_100000085289 [0,1,0,0,0,0|3,0,0]=4 3554 B15R1.129 CSCCNC(=O)Cc1cncc(c1)Br 11a_100020590264_100000239331 [0,1,0,0,0,0|3,0,0]=4 3555 B15R1.129 CSCCNC(=O)Cc1cncc(c1)Br 240690a_100020590264_100000239331 [0,1,0,0,0,0|3,0,0]=4 3556 B15R1.129 CSCCNC(=O)Cc1cncc(c1)Br 527a_100020590264_100000239331 [0,1,0,0,0,0|3,0,0]=4 3557 B15R1.129 CSCCNC(=O)Cc1cncc(c1)F 11a_100020590264_100011667516 [0,1,0,0,0,0|3,0,0]=4 3558 B15R1.129 CSCCNC(=O)Cc1cncc(c1)F 240690a_100020590264_100011667516 [0,1,0,0,0,0|3,0,0]=4 3559 B15R1.129 CSCCNC(=O)Cc1cncc(c1)F 527a_100020590264_100011667516 [0,1,0,0,0,0|3,0,0]=4 3560 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100020590264 [0,1,0,0,0,0|3,0,0]=4 3561 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100020590264 [0,1,0,0,0,0|3,0,0]=4 3562 B15R1.129 CSCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100020590264 [0,1,0,0,0,0|3,0,0]=4 3563 B15R1.129 CSCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100020590264 [0,1,0,0,0,0|3,0,0]=4 3564 B15R1.129 CSCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100020590264 [0,1,0,0,0,0|3,0,0]=4 3565 B15R1.129 CSCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100020590264 [0,1,0,0,0,0|3,0,0]=4 3566 B15R1.129 CSCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100020590264 [0,1,0,0,0,0|3,0,0]=4 3567 B15R1.129 CSCCNC(=O)Nc1cccc(c1)F 62a_200000210301_100000163364 [0,1,0,0,0,0|3,0,0]=4 3568 B15R1.129 CSCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100020590264 [0,1,0,0,0,0|3,0,0]=4 3569 B15R1.129 CSCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100020590264 [0,1,0,0,0,0|3,0,0]=4 3570 B15R1.129 CSCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100020590264 [0,1,0,0,0,0|3,0,0]=4 3571 B15R1.129 CSCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100020590264 [0,1,0,0,0,0|3,0,0]=4 3572 B15R1.129 CSCCOC(=O)Nc1cccc(c1)Br 62a_200000210301_100015757870 [0,1,0,0,0,0|2,0,0]=3 3573 B15R1.129 Cc1cc(ccn1)CC(=O)CCCCO 1458a_100000695505_200020672517 [0,1,0,0,0,0|3,0,0]=4 3574 B15R1.129 Cc1cccc(c1)CC(=O)CCCC#N 1458a_100000075515_100000211840 [0,1,0,0,0,0|2,0,1]=4 3575 B15R1.129 Cc1cccc(c1)CC(=O)CCCC#N 1458a_100011206899_100000211468 [0,1,0,0,0,0|2,0,1]=4 3576 B15R1.129 Cc1cccc(c1)CC(=O)CCCCF 1458a_100011206899_100000729493 [0,1,0,0,0,0|2,0,0]=3 3577 B15R1.129 Cc1cccc(c1)CC(=O)CCCCO 1458a_100000695505_100000211840 [0,1,0,0,0,0|2,0,0]=3 3578 B15R1.129 Cc1cccc(c1)CC(=O)CCCCO 1458a_100011206899_100000210776 [0,1,0,0,0,0|2,0,0]=3 3579 B15R1.129 Cc1cccc(c1)CC(=O)COCCO 1458a_100000708028_100000211840 [0,1,0,0,0,0|3,0,0]=4 3580 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N 11a_100000720768_100011206899 [0,1,0,0,0,0|2,0,1]=4 3581 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N 1626a_100000720768_100011206899 [0,1,0,0,0,0|2,0,1]=4 3582 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N 240690a_100000720768_100011206899 [0,1,0,0,0,0|2,0,1]=4 3583 B15R1.129 Cc1cccc(c1)CC(=O)NCCC#N 527a_100000720768_100011206899 [0,1,0,0,0,0|2,0,1]=4 3584 B15R1.129 Cc1cccc(c1)CC(=O)NCCCF 11a_100015189416_100011206899 [0,1,0,0,0,0|2,0,0]=3 3585 B15R1.129 Cc1cccc(c1)CC(=O)NCCCF 1626a_100015189416_100011206899 [0,1,0,0,0,0|2,0,0]=3 3586 B15R1.129 Cc1cccc(c1)CC(=O)NCCCF 240690a_100015189416_100011206899 [0,1,0,0,0,0|2,0,0]=3 3587 B15R1.129 Cc1cccc(c1)CC(=O)NCCCF 527a_100015189416_100011206899 [0,1,0,0,0,0|2,0,0]=3 3588 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO 240690a_100000182051_100011206899 [0,1,0,0,0,0|2,0,0]=3 3589 B15R1.129 Cc1cccc(c1)CC(=O)NCCCO 527a_100000182051_100011206899 [0,1,0,0,0,0|2,0,0]=3 3590 B15R1.129 Cc1cccc(c1)CC(=O)NNCCO 22a_100000210001_100011206899 [0,1,0,0,0,0|3,0,0]=4 3591 B15R1.129 Cc1cccc(c1)NC(=O)CCCCO 1626a_100000188690_100000695505 [0,1,0,0,0,0|3,0,0]=4 3592 B15R1.129 Cc1cccc(c1)NC(=O)CCCS[13CH3] 62a_200025704644_100000184976 [0,1,0,0,0,0|3,0,0]=4 3593 B15R1.129 Cc1cccc(c1)NC(=O)NCCCF 2430a_100000188690_100015189416 [0,1,0,0,0,0|3,0,0]=4 3594 B15R1.129 Cc1cccc(c1)NC(=O)NCCCF 512a_100000188690_100015189416 [0,1,0,0,0,0|3,0,0]=4 3595 B15R1.129 Cc1cccc(c1)NC(=O)NCCCO 2430a_100000188690_100000182051 [0,1,0,0,0,0|3,0,0]=4 3596 B15R1.129 Cc1cccc(c1)NC(=O)NCCCO 512a_100000188690_100000182051 [0,1,0,0,0,0|3,0,0]=4 3597 B15R1.129 Cc1cccc(n1)CC(=O)CCCCF 1458a_100012001110_100000729493 [0,1,0,0,0,0|3,0,0]=4 3598 B15R1.129 Cc1cccc(n1)CC(=O)CCCCO 1458a_100000695505_100000757606 [0,1,0,0,0,0|3,0,0]=4 3599 B15R1.129 Cc1cccc(n1)CC(=O)CCCCO 1458a_100012001110_100000210776 [0,1,0,0,0,0|3,0,0]=4 3600 B15R1.129 Cc1cccc(n1)CC(=O)NCCCF 11a_100015189416_100012001110 [0,1,0,0,0,0|3,0,0]=4 3601 B15R1.129 Cc1cccc(n1)CC(=O)NCCCF 1626a_100015189416_100012001110 [0,1,0,0,0,0|3,0,0]=4 3602 B15R1.129 Cc1cccc(n1)CC(=O)NCCCF 240690a_100015189416_100012001110 [0,1,0,0,0,0|3,0,0]=4 3603 B15R1.129 Cc1cccc(n1)CC(=O)NCCCF 527a_100015189416_100012001110 [0,1,0,0,0,0|3,0,0]=4 3604 B15R1.129 Cc1cccc(n1)CC(=O)NCCCO 240690a_100000182051_100012001110 [0,1,0,0,0,0|3,0,0]=4 3605 B15R1.129 Cc1cccc(n1)CC(=O)NCCCO 527a_100000182051_100012001110 [0,1,0,0,0,0|3,0,0]=4 3606 B15R1.129 Cc1ccnc(c1)CC(=O)CCCCO 1458a_100000695505_100000718516 [0,1,0,0,0,0|3,0,0]=4 3607 B15R1.129 Cc1cncc(c1)CC(=O)CCCCO 1458a_100000695505_100000716715 [0,1,0,0,0,0|3,0,0]=4 3608 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)Br 1458a_100000075515_100000211773 [0,1,0,0,0,0|2,0,1]=4 3609 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000211468 [0,1,0,0,0,0|2,0,1]=4 3610 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000075515_100000181238 [0,1,0,0,0,0|2,0,1]=4 3611 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000211468 [0,1,0,0,0,0|2,0,1]=4 3612 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)F 1458a_100000075515_100000230114 [0,1,0,0,0,0|2,0,1]=4 3613 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000211468 [0,1,0,0,0,0|2,0,1]=4 3614 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)I 1458a_100000075515_100011218688 [0,1,0,0,0,0|2,0,1]=4 3615 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000211468 [0,1,0,0,0,0|2,0,1]=4 3616 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)O 1458a_100000075515_100011660834 [0,1,0,0,0,0|2,0,1]=4 3617 B15R1.129 N#CCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000211468 [0,1,0,0,0,0|2,0,1]=4 3618 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Br 11a_100000720768_100000747190 [0,1,0,0,0,0|2,0,1]=4 3619 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Br 240690a_100000720768_100000747190 [0,1,0,0,0,0|2,0,1]=4 3620 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Br 527a_100000720768_100000747190 [0,1,0,0,0,0|2,0,1]=4 3621 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl 11a_100000720768_100000749307 [0,1,0,0,0,0|2,0,1]=4 3622 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl 1626a_100000720768_100000749307 [0,1,0,0,0,0|2,0,1]=4 3623 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl 240690a_100000720768_100000749307 [0,1,0,0,0,0|2,0,1]=4 3624 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)Cl 527a_100000720768_100000749307 [0,1,0,0,0,0|2,0,1]=4 3625 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F 11a_100000720768_100000211661 [0,1,0,0,0,0|2,0,1]=4 3626 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F 1626a_100000720768_100000211661 [0,1,0,0,0,0|2,0,1]=4 3627 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F 240690a_100000720768_100000211661 [0,1,0,0,0,0|2,0,1]=4 3628 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)F 527a_100000720768_100000211661 [0,1,0,0,0,0|2,0,1]=4 3629 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)I 11a_100000720768_100000238430 [0,1,0,0,0,0|2,0,1]=4 3630 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)I 1626a_100000720768_100000238430 [0,1,0,0,0,0|2,0,1]=4 3631 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)I 240690a_100000720768_100000238430 [0,1,0,0,0,0|2,0,1]=4 3632 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)I 527a_100000720768_100000238430 [0,1,0,0,0,0|2,0,1]=4 3633 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)O 240690a_100000720768_100000745134 [0,1,0,0,0,0|2,0,1]=4 3634 B15R1.129 N#CCCNC(=O)Cc1cccc(c1)O 527a_100000720768_100000745134 [0,1,0,0,0,0|2,0,1]=4 3635 B15R1.129 O=C(CCCCF)Cc1cccc(c1)Br 1458a_100000747190_100000729493 [0,1,0,0,0,0|2,0,0]=3 3636 B15R1.129 O=C(CCCCF)Cc1cccc(c1)Cl 1458a_100000749307_100000729493 [0,1,0,0,0,0|2,0,0]=3 3637 B15R1.129 O=C(CCCCF)Cc1cccc(c1)F 1458a_100000211661_100000729493 [0,1,0,0,0,0|2,0,0]=3 3638 B15R1.129 O=C(CCCCF)Cc1cccc(c1)I 1458a_100000238430_100000729493 [0,1,0,0,0,0|2,0,0]=3 3639 B15R1.129 O=C(CCCCF)Cc1cccc(c1)O 1458a_100000745134_100000729493 [0,1,0,0,0,0|2,0,0]=3 3640 B15R1.129 O=C(CCCCF)Cc1cccc(n1)Br 1458a_100010201708_100000729493 [0,1,0,0,0,0|3,0,0]=4 3641 B15R1.129 O=C(CCCCF)Cc1cccc(n1)Cl 1458a_100000090259_100000729493 [0,1,0,0,0,0|3,0,0]=4 3642 B15R1.129 O=C(CCCCF)Cc1cccc(n1)F 1458a_100000096803_100000729493 [0,1,0,0,0,0|3,0,0]=4 3643 B15R1.129 O=C(CCCCF)Cc1ccnc(c1)Br 1458a_100010126891_100000729493 [0,1,0,0,0,0|3,0,0]=4 3644 B15R1.129 O=C(CCCCF)Cc1cncc(c1)Br 1458a_100000239331_100000729493 [0,1,0,0,0,0|3,0,0]=4 3645 B15R1.129 O=C(CCCCF)Cc1cncc(c1)F 1458a_100011667516_100000729493 [0,1,0,0,0,0|3,0,0]=4 3646 B15R1.129 O=C(CCCCO)Cc1cc(ccn1)Br 1458a_100000695505_100010173614 [0,1,0,0,0,0|3,0,0]=4 3647 B15R1.129 O=C(CCCCO)Cc1cc(ccn1)Cl 1458a_100000695505_100016988179 [0,1,0,0,0,0|3,0,0]=4 3648 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Br 1458a_100000695505_100000211773 [0,1,0,0,0,0|2,0,0]=3 3649 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Br 1458a_100000747190_100000210776 [0,1,0,0,0,0|2,0,0]=3 3650 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Cl 1458a_100000695505_100000181238 [0,1,0,0,0,0|2,0,0]=3 3651 B15R1.129 O=C(CCCCO)Cc1cccc(c1)Cl 1458a_100000749307_100000210776 [0,1,0,0,0,0|2,0,0]=3 3652 B15R1.129 O=C(CCCCO)Cc1cccc(c1)F 1458a_100000211661_100000210776 [0,1,0,0,0,0|2,0,0]=3 3653 B15R1.129 O=C(CCCCO)Cc1cccc(c1)F 1458a_100000695505_100000230114 [0,1,0,0,0,0|2,0,0]=3 3654 B15R1.129 O=C(CCCCO)Cc1cccc(c1)I 1458a_100000238430_100000210776 [0,1,0,0,0,0|2,0,0]=3 3655 B15R1.129 O=C(CCCCO)Cc1cccc(c1)I 1458a_100000695505_100011218688 [0,1,0,0,0,0|2,0,0]=3 3656 B15R1.129 O=C(CCCCO)Cc1cccc(c1)O 1458a_100000695505_100011660834 [0,1,0,0,0,0|2,0,0]=3 3657 B15R1.129 O=C(CCCCO)Cc1cccc(c1)O 1458a_100000745134_100000210776 [0,1,0,0,0,0|2,0,0]=3 3658 B15R1.129 O=C(CCCCO)Cc1cccc(n1)Br 1458a_100000695505_100009889011 [0,1,0,0,0,0|3,0,0]=4 3659 B15R1.129 O=C(CCCCO)Cc1cccc(n1)Br 1458a_100010201708_100000210776 [0,1,0,0,0,0|3,0,0]=4 3660 B15R1.129 O=C(CCCCO)Cc1cccc(n1)Cl 1458a_100000090259_100000210776 [0,1,0,0,0,0|3,0,0]=4 3661 B15R1.129 O=C(CCCCO)Cc1cccc(n1)Cl 1458a_100000695505_100000086093 [0,1,0,0,0,0|3,0,0]=4 3662 B15R1.129 O=C(CCCCO)Cc1cccc(n1)F 1458a_100000096803_100000210776 [0,1,0,0,0,0|3,0,0]=4 3663 B15R1.129 O=C(CCCCO)Cc1cccc(n1)F 1458a_100000695505_100009819644 [0,1,0,0,0,0|3,0,0]=4 3664 B15R1.129 O=C(CCCCO)Cc1ccnc(c1)Br 1458a_100000695505_100010243470 [0,1,0,0,0,0|3,0,0]=4 3665 B15R1.129 O=C(CCCCO)Cc1ccnc(c1)Br 1458a_100010126891_100000210776 [0,1,0,0,0,0|3,0,0]=4 3666 B15R1.129 O=C(CCCCO)Cc1ccnc(c1)Cl 1458a_100000695505_100000764220 [0,1,0,0,0,0|3,0,0]=4 3667 B15R1.129 O=C(CCCCO)Cc1cncc(c1)Br 1458a_100000239331_100000210776 [0,1,0,0,0,0|3,0,0]=4 3668 B15R1.129 O=C(CCCCO)Cc1cncc(c1)Br 1458a_100000695505_100011740620 [0,1,0,0,0,0|3,0,0]=4 3669 B15R1.129 O=C(CCCCO)Cc1cncc(c1)Cl 1458a_100000695505_100016992070 [0,1,0,0,0,0|3,0,0]=4 3670 B15R1.129 O=C(CCCCO)Cc1cncc(c1)F 1458a_100000695505_100000725299 [0,1,0,0,0,0|3,0,0]=4 3671 B15R1.129 O=C(CCCCO)Cc1cncc(c1)F 1458a_100011667516_100000210776 [0,1,0,0,0,0|3,0,0]=4 3672 B15R1.129 O=C(CCCCO)Nc1cccc(c1)Br 1626a_100000210019_100000695505 [0,1,0,0,0,0|3,0,0]=4 3673 B15R1.129 O=C(CCCCO)Nc1cccc(c1)Cl 1626a_100000185859_100000695505 [0,1,0,0,0,0|3,0,0]=4 3674 B15R1.129 O=C(CCCCO)Nc1cccc(c1)F 1626a_100000210047_100000695505 [0,1,0,0,0,0|3,0,0]=4 3675 B15R1.129 O=C(CCCCO)Nc1cccc(c1)I 1626a_100000211102_100000695505 [0,1,0,0,0,0|3,0,0]=4 3676 B15R1.129 O=C(CCCCO)Nc1cccc(c1)O 1626a_100000210217_100000695505 [0,1,0,0,0,0|3,0,0]=4 3677 B15R1.129 O=C(COCCO)Cc1cccc(c1)Br 1458a_100000708028_100000211773 [0,1,0,0,0,0|3,0,0]=4 3678 B15R1.129 O=C(COCCO)Cc1cccc(c1)Cl 1458a_100000708028_100000181238 [0,1,0,0,0,0|3,0,0]=4 3679 B15R1.129 O=C(COCCO)Cc1cccc(c1)F 1458a_100000708028_100000230114 [0,1,0,0,0,0|3,0,0]=4 3680 B15R1.129 O=C(COCCO)Cc1cccc(c1)I 1458a_100000708028_100011218688 [0,1,0,0,0,0|3,0,0]=4 3681 B15R1.129 O=C(COCCO)Cc1cccc(c1)O 1458a_100000708028_100011660834 [0,1,0,0,0,0|3,0,0]=4 3682 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCF 11a_100015189416_100000747190 [0,1,0,0,0,0|2,0,0]=3 3683 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCF 240690a_100015189416_100000747190 [0,1,0,0,0,0|2,0,0]=3 3684 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCF 527a_100015189416_100000747190 [0,1,0,0,0,0|2,0,0]=3 3685 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO 240690a_100000182051_100000747190 [0,1,0,0,0,0|2,0,0]=3 3686 B15R1.129 O=C(Cc1cccc(c1)Br)NCCCO 527a_100000182051_100000747190 [0,1,0,0,0,0|2,0,0]=3 3687 B15R1.129 O=C(Cc1cccc(c1)Br)NNCCO 22a_100000210001_100000747190 [0,1,0,0,0,0|3,0,0]=4 3688 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCF 11a_100015189416_100000749307 [0,1,0,0,0,0|2,0,0]=3 3689 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCF 1626a_100015189416_100000749307 [0,1,0,0,0,0|2,0,0]=3 3690 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCF 240690a_100015189416_100000749307 [0,1,0,0,0,0|2,0,0]=3 3691 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCF 527a_100015189416_100000749307 [0,1,0,0,0,0|2,0,0]=3 3692 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO 240690a_100000182051_100000749307 [0,1,0,0,0,0|2,0,0]=3 3693 B15R1.129 O=C(Cc1cccc(c1)Cl)NCCCO 527a_100000182051_100000749307 [0,1,0,0,0,0|2,0,0]=3 3694 B15R1.129 O=C(Cc1cccc(c1)Cl)NNCCO 22a_100000210001_100000749307 [0,1,0,0,0,0|3,0,0]=4 3695 B15R1.129 O=C(Cc1cccc(c1)F)NCCCF 11a_100015189416_100000211661 [0,1,0,0,0,0|2,0,0]=3 3696 B15R1.129 O=C(Cc1cccc(c1)F)NCCCF 1626a_100015189416_100000211661 [0,1,0,0,0,0|2,0,0]=3 3697 B15R1.129 O=C(Cc1cccc(c1)F)NCCCF 240690a_100015189416_100000211661 [0,1,0,0,0,0|2,0,0]=3 3698 B15R1.129 O=C(Cc1cccc(c1)F)NCCCF 527a_100015189416_100000211661 [0,1,0,0,0,0|2,0,0]=3 3699 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO 240690a_100000182051_100000211661 [0,1,0,0,0,0|2,0,0]=3 3700 B15R1.129 O=C(Cc1cccc(c1)F)NCCCO 527a_100000182051_100000211661 [0,1,0,0,0,0|2,0,0]=3 3701 B15R1.129 O=C(Cc1cccc(c1)F)NNCCO 22a_100000210001_100000211661 [0,1,0,0,0,0|3,0,0]=4 3702 B15R1.129 O=C(Cc1cccc(c1)I)NCCCF 11a_100015189416_100000238430 [0,1,0,0,0,0|2,0,0]=3 3703 B15R1.129 O=C(Cc1cccc(c1)I)NCCCF 1626a_100015189416_100000238430 [0,1,0,0,0,0|2,0,0]=3 3704 B15R1.129 O=C(Cc1cccc(c1)I)NCCCF 240690a_100015189416_100000238430 [0,1,0,0,0,0|2,0,0]=3 3705 B15R1.129 O=C(Cc1cccc(c1)I)NCCCF 527a_100015189416_100000238430 [0,1,0,0,0,0|2,0,0]=3 3706 B15R1.129 O=C(Cc1cccc(c1)I)NCCCO 240690a_100000182051_100000238430 [0,1,0,0,0,0|2,0,0]=3 3707 B15R1.129 O=C(Cc1cccc(c1)I)NCCCO 527a_100000182051_100000238430 [0,1,0,0,0,0|2,0,0]=3 3708 B15R1.129 O=C(Cc1cccc(c1)I)NNCCO 22a_100000210001_100000238430 [0,1,0,0,0,0|3,0,0]=4 3709 B15R1.129 O=C(Cc1cccc(c1)O)NCCCF 240690a_100015189416_100000745134 [0,1,0,0,0,0|2,0,0]=3 3710 B15R1.129 O=C(Cc1cccc(c1)O)NCCCF 527a_100015189416_100000745134 [0,1,0,0,0,0|2,0,0]=3 3711 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO 240690a_100000182051_100000745134 [0,1,0,0,0,0|2,0,0]=3 3712 B15R1.129 O=C(Cc1cccc(c1)O)NCCCO 527a_100000182051_100000745134 [0,1,0,0,0,0|2,0,0]=3 3713 B15R1.129 O=C(Cc1cccc(c1)O)NNCCO 22a_100000210001_100000745134 [0,1,0,0,0,0|3,0,0]=4 3714 B15R1.129 O=C(Cc1cccc(n1)Br)NCCCF 11a_100015189416_100010201708 [0,1,0,0,0,0|3,0,0]=4 3715 B15R1.129 O=C(Cc1cccc(n1)Br)NCCCF 240690a_100015189416_100010201708 [0,1,0,0,0,0|3,0,0]=4 3716 B15R1.129 O=C(Cc1cccc(n1)Br)NCCCF 527a_100015189416_100010201708 [0,1,0,0,0,0|3,0,0]=4 3717 B15R1.129 O=C(Cc1cccc(n1)Br)NCCCO 240690a_100000182051_100010201708 [0,1,0,0,0,0|3,0,0]=4 3718 B15R1.129 O=C(Cc1cccc(n1)Br)NCCCO 527a_100000182051_100010201708 [0,1,0,0,0,0|3,0,0]=4 3719 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCF 11a_100015189416_100000090259 [0,1,0,0,0,0|3,0,0]=4 3720 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCF 1626a_100015189416_100000090259 [0,1,0,0,0,0|3,0,0]=4 3721 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCF 240690a_100015189416_100000090259 [0,1,0,0,0,0|3,0,0]=4 3722 B15R1.129 O=C(Cc1cccc(n1)Cl)NCCCO 240690a_100000182051_100000090259 [0,1,0,0,0,0|3,0,0]=4 3723 B15R1.129 O=C(Cc1cccc(n1)F)NCCCF 11a_100015189416_100000096803 [0,1,0,0,0,0|3,0,0]=4 3724 B15R1.129 O=C(Cc1cccc(n1)F)NCCCF 1626a_100015189416_100000096803 [0,1,0,0,0,0|3,0,0]=4 3725 B15R1.129 O=C(Cc1cccc(n1)F)NCCCF 240690a_100015189416_100000096803 [0,1,0,0,0,0|3,0,0]=4 3726 B15R1.129 O=C(Cc1cccc(n1)F)NCCCO 240690a_100000182051_100000096803 [0,1,0,0,0,0|3,0,0]=4 3727 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCF 11a_100015189416_100010126891 [0,1,0,0,0,0|3,0,0]=4 3728 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCF 240690a_100015189416_100010126891 [0,1,0,0,0,0|3,0,0]=4 3729 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCF 527a_100015189416_100010126891 [0,1,0,0,0,0|3,0,0]=4 3730 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCO 240690a_100000182051_100010126891 [0,1,0,0,0,0|3,0,0]=4 3731 B15R1.129 O=C(Cc1ccnc(c1)Br)NCCCO 527a_100000182051_100010126891 [0,1,0,0,0,0|3,0,0]=4 3732 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCF 11a_100015189416_100000085289 [0,1,0,0,0,0|3,0,0]=4 3733 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCF 1626a_100015189416_100000085289 [0,1,0,0,0,0|3,0,0]=4 3734 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCF 240690a_100015189416_100000085289 [0,1,0,0,0,0|3,0,0]=4 3735 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCF 527a_100015189416_100000085289 [0,1,0,0,0,0|3,0,0]=4 3736 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCO 240690a_100000182051_100000085289 [0,1,0,0,0,0|3,0,0]=4 3737 B15R1.129 O=C(Cc1ccnc(c1)Cl)NCCCO 527a_100000182051_100000085289 [0,1,0,0,0,0|3,0,0]=4 3738 B15R1.129 O=C(Cc1cncc(c1)Br)NCCCF 11a_100015189416_100000239331 [0,1,0,0,0,0|3,0,0]=4 3739 B15R1.129 O=C(Cc1cncc(c1)Br)NCCCF 240690a_100015189416_100000239331 [0,1,0,0,0,0|3,0,0]=4 3740 B15R1.129 O=C(Cc1cncc(c1)Br)NCCCF 527a_100015189416_100000239331 [0,1,0,0,0,0|3,0,0]=4 3741 B15R1.129 O=C(Cc1cncc(c1)Br)NCCCO 240690a_100000182051_100000239331 [0,1,0,0,0,0|3,0,0]=4 3742 B15R1.129 O=C(Cc1cncc(c1)Br)NCCCO 527a_100000182051_100000239331 [0,1,0,0,0,0|3,0,0]=4 3743 B15R1.129 O=C(Cc1cncc(c1)F)NCCCF 11a_100015189416_100011667516 [0,1,0,0,0,0|3,0,0]=4 3744 B15R1.129 O=C(Cc1cncc(c1)F)NCCCF 240690a_100015189416_100011667516 [0,1,0,0,0,0|3,0,0]=4 3745 B15R1.129 O=C(Cc1cncc(c1)F)NCCCF 527a_100015189416_100011667516 [0,1,0,0,0,0|3,0,0]=4 3746 B15R1.129 O=C(Cc1cncc(c1)F)NCCCO 240690a_100000182051_100011667516 [0,1,0,0,0,0|3,0,0]=4 3747 B15R1.129 O=C(Cc1cncc(c1)F)NCCCO 527a_100000182051_100011667516 [0,1,0,0,0,0|3,0,0]=4 3748 B15R1.129 O=C(NCCCF)Nc1cccc(c1)Br 2430a_100000210019_100015189416 [0,1,0,0,0,0|3,0,0]=4 3749 B15R1.129 O=C(NCCCF)Nc1cccc(c1)Br 512a_100000210019_100015189416 [0,1,0,0,0,0|3,0,0]=4 3750 B15R1.129 O=C(NCCCF)Nc1cccc(c1)Cl 2430a_100000185859_100015189416 [0,1,0,0,0,0|3,0,0]=4 3751 B15R1.129 O=C(NCCCF)Nc1cccc(c1)F 2430a_100000210047_100015189416 [0,1,0,0,0,0|3,0,0]=4 3752 B15R1.129 O=C(NCCCF)Nc1cccc(c1)F 512a_100000210047_100015189416 [0,1,0,0,0,0|3,0,0]=4 3753 B15R1.129 O=C(NCCCF)Nc1cccc(c1)I 2430a_100000211102_100015189416 [0,1,0,0,0,0|3,0,0]=4 3754 B15R1.129 O=C(NCCCF)Nc1cccc(c1)I 512a_100000211102_100015189416 [0,1,0,0,0,0|3,0,0]=4 3755 B15R1.129 O=C(NCCCF)Nc1cccc(c1)O 2430a_100000210217_100015189416 [0,1,0,0,0,0|3,0,0]=4 3756 B15R1.129 O=C(NCCCF)Nc1cccc(c1)O 512a_100000210217_100015189416 [0,1,0,0,0,0|3,0,0]=4 3757 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Br 2430a_100000210019_100000182051 [0,1,0,0,0,0|3,0,0]=4 3758 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Br 512a_100000210019_100000182051 [0,1,0,0,0,0|3,0,0]=4 3759 B15R1.129 O=C(NCCCO)Nc1cccc(c1)Cl 2430a_100000185859_100000182051 [0,1,0,0,0,0|3,0,0]=4 3760 B15R1.129 O=C(NCCCO)Nc1cccc(c1)F 2430a_100000210047_100000182051 [0,1,0,0,0,0|3,0,0]=4 3761 B15R1.129 O=C(NCCCO)Nc1cccc(c1)F 512a_100000210047_100000182051 [0,1,0,0,0,0|3,0,0]=4 3762 B15R1.129 O=C(NCCCO)Nc1cccc(c1)I 2430a_100000211102_100000182051 [0,1,0,0,0,0|3,0,0]=4 3763 B15R1.129 O=C(NCCCO)Nc1cccc(c1)I 512a_100000211102_100000182051 [0,1,0,0,0,0|3,0,0]=4 3764 B15R1.129 O=C(NCCCO)Nc1cccc(c1)O 2430a_100000210217_100000182051 [0,1,0,0,0,0|3,0,0]=4 3765 B15R1.129 O=C(NCCCO)Nc1cccc(c1)O 512a_100000210217_100000182051 [0,1,0,0,0,0|3,0,0]=4 3766 B15R1.129 [13CH3]NCCCC(=O)Nc1cccc(c1)Cl 2230a_114873766722_200025704644 [0,1,0,0,0,0|3,0,0]=4 3767 B15R1.129 [13CH3]NCCCC(=O)Nc1cccc(c1)Cl 34a_114873766722_200025704644 [0,1,0,0,0,0|3,0,0]=4 3768 B15R1.129 [13CH3]NCCNC(=O)Cc1cccc(c1)F 2230a_106430523477_200025704644 [0,1,0,0,0,0|2,0,0]=3 3769 B15R1.129 [13CH3]NCCNC(=O)Cc1cccc(c1)F 34a_106430523477_200025704644 [0,1,0,0,0,0|2,0,0]=3 3770 B15R1.129 [13CH3]SCCNC(=O)Nc1cccc(c1)F 62a_200025704644_100000163364 [0,1,0,0,0,0|3,0,0]=4 3771 B15R1.129 [13CH3]SCCOC(=O)Nc1cccc(c1)Br 62a_200025704644_100015757870 [0,1,0,0,0,0|2,0,0]=3 3772 B15R1.551 C=C(Cc1ccccc1)C(=O)NCCC 11a_100020643023_100000066491 [0,1,0,0,0,0|3,0,0]=4 3773 B15R1.551 C=C(Cc1ccccc1)C(=O)NCCC 1626a_100020643023_100000066491 [0,1,0,0,0,0|3,0,0]=4 3774 B15R1.551 CCC/C=C(\C)/C(=O)Cc1ccccc1 1458a_200020648666_100015291786 [0,1,0,0,0,0|1,0,1]=3 3775 B15R1.551 CCC/C=C(\C)/C(=O)Cc1ccccn1 1458a_200020648666_100000721315 [0,1,0,0,0,0|2,0,1]=4 3776 B15R1.551 CCC/C=C(\C)/C(=O)Cc1cccnc1 1458a_200020648666_100000733263 [0,1,0,0,0,0|2,0,1]=4 3777 B15R1.551 CCC/C=C(\C)/C(=O)Cc1ccncc1 1458a_200020648666_100000705612 [0,1,0,0,0,0|2,0,1]=4 3778 B15R1.551 CCC/C=C(\C)/C(=O)Nc1ccccc1 11a_100000106764_200020648666 [0,1,0,0,0,0|2,0,1]=4 3779 B15R1.551 CCC/C=C(\C)/C(=O)Nc1ccccc1 1626a_100000106764_200020648666 [0,1,0,0,0,0|2,0,1]=4 3780 B15R1.551 CCC/C=C(\C)/C(=O)Nc1ccccc1 22a_100000106764_200020648666 [0,1,0,0,0,0|2,0,1]=4 3781 B15R1.551 CCCCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210211 [0,1,0,0,0,0|2,0,1]=4 3782 B15R1.551 CCCCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210211 [0,1,0,0,0,0|2,0,1]=4 3783 B15R1.551 CCCCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210211 [0,1,0,0,0,0|2,0,1]=4 3784 B15R1.551 CCCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210211 [0,1,0,0,0,0|2,0,0]=3 3785 B15R1.551 CCCCC(=O)C(C)Cc1ccccc1 1458a_100000210183_200011218536 [0,1,0,0,0,0|2,0,1]=4 3786 B15R1.551 CCCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210211 [0,1,0,0,0,0|2,0,1]=4 3787 B15R1.551 CCCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210183 [0,1,0,0,0,0|3,0,0]=4 3788 B15R1.551 CCCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210183 [0,1,0,0,0,0|3,0,0]=4 3789 B15R1.551 CCCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210183 [0,1,0,0,0,0|3,0,0]=4 3790 B15R1.551 CCCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210183 [0,1,0,0,0,0|3,0,0]=4 3791 B15R1.551 CCCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210211 [0,1,0,0,0,0|1,0,2]=4 3792 B15R1.551 CCCCC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_200011215066 [0,1,0,0,0,0|2,0,0]=3 3793 B15R1.551 CCCCC(C)C(=O)Cc1ccccc1 1458a_100000725509_100015291786 [0,1,0,0,0,0|1,0,0]=2 3794 B15R1.551 CCCCC(C)C(=O)Cc1ccccn1 1458a_100000233486_200011215066 [0,1,0,0,0,0|2,0,0]=3 3795 B15R1.551 CCCCC(C)C(=O)Cc1ccccn1 1458a_100000725509_100000721315 [0,1,0,0,0,0|2,0,0]=3 3796 B15R1.551 CCCCC(C)C(=O)Cc1cccnc1 1458a_100000725509_100000733263 [0,1,0,0,0,0|2,0,0]=3 3797 B15R1.551 CCCCC(C)C(=O)Cc1cccnc1 1458a_100000737805_200011215066 [0,1,0,0,0,0|2,0,0]=3 3798 B15R1.551 CCCCC(C)C(=O)Cc1cccnn1 1458a_100000725509_100016990269 [0,1,0,0,0,0|3,0,0]=4 3799 B15R1.551 CCCCC(C)C(=O)Cc1ccncc1 1458a_100000725509_100000705612 [0,1,0,0,0,0|2,0,0]=3 3800 B15R1.551 CCCCC(C)C(=O)Cc1cnccn1 1458a_100000725509_100016995436 [0,1,0,0,0,0|3,0,0]=4 3801 B15R1.551 CCCCC(C)C(=O)Cc1cncnc1 1458a_100000721575_200011215066 [0,1,0,0,0,0|3,0,0]=4 3802 B15R1.551 CCCCC(C)C(=O)Cc1cncnc1 1458a_100000725509_100015196519 [0,1,0,0,0,0|3,0,0]=4 3803 B15R1.551 CCCCC(C)C(=O)Cc1ncccn1 1458a_100000725509_100000703007 [0,1,0,0,0,0|3,0,0]=4 3804 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 11a_100000106764_100000725509 [0,1,0,0,0,0|2,0,0]=3 3805 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000725509 [0,1,0,0,0,0|2,0,0]=3 3806 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 22a_100000106764_100000725509 [0,1,0,0,0,0|2,0,0]=3 3807 B15R1.551 CCCCC(C)C(=O)Nc1ccccc1 527a_100000106764_100000725509 [0,1,0,0,0,0|2,0,0]=3 3808 B15R1.551 CCCCC(C)N(C)Cc1ccccc1 2230a_100000186898_200011215066 [0,1,0,0,0,0|3,0,0]=4 3809 B15R1.551 CCCCC(C)N(C)Cc1ccccc1 269982a_100000186898_200011215066 [0,1,0,0,0,0|3,0,0]=4 3810 B15R1.551 CCCCC(C)N(C)Cc1ccccc1 270004a_100000186898_100000210087 [0,1,0,0,0,0|3,0,0]=4 3811 B15R1.551 CCCCC(O)C(=O)Cc1ccccc1 1458a_100000720857_100015291786 [0,1,0,0,0,0|1,0,0]=2 3812 B15R1.551 CCCCC(O)C(=O)Cc1ccccn1 1458a_100000720857_100000721315 [0,1,0,0,0,0|2,0,0]=3 3813 B15R1.551 CCCCC(O)C(=O)Cc1cccnc1 1458a_100000720857_100000733263 [0,1,0,0,0,0|2,0,0]=3 3814 B15R1.551 CCCCC(O)C(=O)Cc1cccnn1 1458a_100000720857_100016990269 [0,1,0,0,0,0|3,0,0]=4 3815 B15R1.551 CCCCC(O)C(=O)Cc1ccncc1 1458a_100000720857_100000705612 [0,1,0,0,0,0|2,0,0]=3 3816 B15R1.551 CCCCC(O)C(=O)Cc1cnccn1 1458a_100000720857_100016995436 [0,1,0,0,0,0|3,0,0]=4 3817 B15R1.551 CCCCC(O)C(=O)Cc1cncnc1 1458a_100000720857_100015196519 [0,1,0,0,0,0|3,0,0]=4 3818 B15R1.551 CCCCC(O)C(=O)Cc1ncccn1 1458a_100000720857_100000703007 [0,1,0,0,0,0|3,0,0]=4 3819 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 22a_100000106764_100000720857 [0,1,0,0,0,0|2,0,0]=3 3820 B15R1.551 CCCCC(O)C(=O)Nc1ccccc1 527a_100000106764_100000720857 [0,1,0,0,0,0|2,0,0]=3 3821 B15R1.551 CCCCN(C)C(=O)C[n+]1ccccc1 11a_100000207549_200000086051 [0,1,0,0,0,0|2,0,0]=3 3822 B15R1.551 CCCCN(C)C(=O)C[n+]1ccccc1 240690a_100000207549_200000086051 [0,1,0,0,0,0|2,0,0]=3 3823 B15R1.551 CCCCN(C)C(=O)C[n+]1ccccc1 527a_100000207549_200000086051 [0,1,0,0,0,0|2,0,0]=3 3824 B15R1.551 CCCCN(C)C(=O)Cc1ccccn1 11a_100000207549_100000233486 [0,1,0,0,0,0|2,0,0]=3 3825 B15R1.551 CCCCN(C)C(=O)Cc1cccnc1 11a_100000207549_100000737805 [0,1,0,0,0,0|2,0,0]=3 3826 B15R1.551 CCCCN(C)C(=O)Cc1cccnc1 240690a_100000207549_100000737805 [0,1,0,0,0,0|2,0,0]=3 3827 B15R1.551 CCCCN(C)C(=O)Cc1cccnc1 527a_100000207549_100000737805 [0,1,0,0,0,0|2,0,0]=3 3828 B15R1.551 CCCCN(C)C(=O)Cc1ccncc1 11a_100000207549_100011201483 [0,1,0,0,0,0|2,0,0]=3 3829 B15R1.551 CCCCN(C)C(=O)Cc1ccncc1 240690a_100000207549_100011201483 [0,1,0,0,0,0|2,0,0]=3 3830 B15R1.551 CCCCN(C)C(=O)Cc1cnccn1 11a_100000207549_100000726051 [0,1,0,0,0,0|3,0,0]=4 3831 B15R1.551 CCCCN(C)C(=O)Cc1cnccn1 240690a_100000207549_100000726051 [0,1,0,0,0,0|3,0,0]=4 3832 B15R1.551 CCCCN(C)C(=O)Cc1cnccn1 527a_100000207549_100000726051 [0,1,0,0,0,0|3,0,0]=4 3833 B15R1.551 CCCCN(C)C(=O)Cc1cncnc1 11a_100000207549_100000721575 [0,1,0,0,0,0|3,0,0]=4 3834 B15R1.551 CCCCN(C)C(=O)Cc1cncnc1 240690a_100000207549_100000721575 [0,1,0,0,0,0|3,0,0]=4 3835 B15R1.551 CCCCN(C)C(=O)Cc1cncnc1 527a_100000207549_100000721575 [0,1,0,0,0,0|3,0,0]=4 3836 B15R1.551 CCCCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000207549 [0,1,0,0,0,0|2,0,0]=3 3837 B15R1.551 CCCCN(C)C(C)Cc1ccccc1 269982a_100000207549_200011218536 [0,1,0,0,0,0|2,0,1]=4 3838 B15R1.551 CCCNC(=O)C(=O)Cc1ccccc1 1458a_200011297150_100015291786 [0,1,0,0,0,0|2,0,0]=3 3839 B15R1.551 CCCNC(=O)C(=O)Cc1ccccn1 1458a_200011297150_100000721315 [0,1,0,0,0,0|3,0,0]=4 3840 B15R1.551 CCCNC(=O)C(=O)Cc1cccnc1 1458a_200011297150_100000733263 [0,1,0,0,0,0|3,0,0]=4 3841 B15R1.551 CCCNC(=O)C(=O)Cc1ccncc1 1458a_200011297150_100000705612 [0,1,0,0,0,0|3,0,0]=4 3842 B15R1.551 CCCNC(=O)C(=O)Nc1ccccc1 1626a_100000106764_200011297150 [0,1,0,0,0,0|3,0,0]=4 3843 B15R1.551 CCCNC(=O)C(=O)Nc1ccccc1 22a_100000106764_200011297150 [0,1,0,0,0,0|3,0,0]=4 3844 B15R1.551 CCCNC(=O)C(=O)Nc1ccccc1 240690a_100020643023_100000738435 [0,1,0,0,0,0|3,0,0]=4 3845 B15R1.551 CCCNC(=O)C(=O)Nc1ccccc1 527a_100000106764_200011297150 [0,1,0,0,0,0|3,0,0]=4 3846 B15R1.551 CCCNC(C)C(=O)Nc1ccccc1 2230a_100000754830_100000210303 [0,1,0,0,0,0|3,0,0]=4 3847 B15R1.551 CCCNC(C)C(=O)Nc1ccccc1 34a_100000754830_100000210303 [0,1,0,0,0,0|3,0,0]=4 3848 B15R1.551 CCCOC(C)C(=O)Nc1ccccc1 34a_100000210258_100000183986 [0,1,0,0,0,0|3,0,0]=4 3849 B15R1.551 CCCSC(C)C(=O)Nc1ccccc1 62a_100000183986_100000210303 [0,1,0,0,0,0|3,0,0]=4 3850 B15R1.551 CCCSC(C)C(=O)Nc1ccccc1 62a_100000210303_100000183986 [0,1,0,0,0,0|3,0,0]=4 3851 B15R1.551 CN(CCCO)C(=O)C[n+]1ccccc1 240690a_100000213112_200000086051 [0,1,0,0,0,0|3,0,0]=4 3852 B15R1.551 CN(CCCO)C(=O)C[n+]1ccccc1 527a_100000213112_200000086051 [0,1,0,0,0,0|3,0,0]=4 3853 B15R1.551 CN(CCCO)C(=O)Cc1cccnc1 240690a_100000213112_100000737805 [0,1,0,0,0,0|3,0,0]=4 3854 B15R1.551 CN(CCCO)C(=O)Cc1cccnc1 527a_100000213112_100000737805 [0,1,0,0,0,0|3,0,0]=4 3855 B15R1.551 CN(CCCO)C(=O)Cc1ccncc1 240690a_100000213112_100011201483 [0,1,0,0,0,0|3,0,0]=4 3856 B15R1.551 CN(CCCO)C(=O)Nc1ccccc1 2430a_100000106764_100000213112 [0,1,0,0,0,0|3,0,0]=4 3857 B15R1.551 COCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000233755 [0,1,0,0,0,0|3,0,0]=4 3858 B15R1.551 COCCN(C)C(=O)C[n+]1ccccc1 11a_100000743101_200000086051 [0,1,0,0,0,0|3,0,0]=4 3859 B15R1.551 COCCN(C)C(=O)C[n+]1ccccc1 240690a_100000743101_200000086051 [0,1,0,0,0,0|3,0,0]=4 3860 B15R1.551 COCCN(C)C(=O)C[n+]1ccccc1 527a_100000743101_200000086051 [0,1,0,0,0,0|3,0,0]=4 3861 B15R1.551 COCCN(C)C(=O)Cc1ccccn1 11a_100000743101_100000233486 [0,1,0,0,0,0|3,0,0]=4 3862 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 11a_100000743101_100000737805 [0,1,0,0,0,0|3,0,0]=4 3863 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 240690a_100000743101_100000737805 [0,1,0,0,0,0|3,0,0]=4 3864 B15R1.551 COCCN(C)C(=O)Cc1cccnc1 527a_100000743101_100000737805 [0,1,0,0,0,0|3,0,0]=4 3865 B15R1.551 COCCN(C)C(=O)Cc1ccncc1 11a_100000743101_100011201483 [0,1,0,0,0,0|3,0,0]=4 3866 B15R1.551 COCCN(C)C(=O)Cc1ccncc1 240690a_100000743101_100011201483 [0,1,0,0,0,0|3,0,0]=4 3867 B15R1.551 COCCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000743101 [0,1,0,0,0,0|3,0,0]=4 3868 B15R1.551 CSCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000751147 [0,1,0,0,0,0|3,0,0]=4 3869 B15R1.551 CSCCC(O)C(=O)Cc1ccccc1 1458a_100000685904_100015291786 [0,1,0,0,0,0|2,0,0]=3 3870 B15R1.551 CSCCC(O)C(=O)Cc1ccccn1 1458a_100000685904_100000721315 [0,1,0,0,0,0|3,0,0]=4 3871 B15R1.551 CSCCC(O)C(=O)Cc1cccnc1 1458a_100000685904_100000733263 [0,1,0,0,0,0|3,0,0]=4 3872 B15R1.551 CSCCC(O)C(=O)Cc1ccncc1 1458a_100000685904_100000705612 [0,1,0,0,0,0|3,0,0]=4 3873 B15R1.551 CSCCC(O)C(=O)Nc1ccccc1 22a_100000106764_100000685904 [0,1,0,0,0,0|3,0,0]=4 3874 B15R1.551 CSCCN(C)C(=O)C[n+]1ccccc1 11a_100000686725_200000086051 [0,1,0,0,0,0|3,0,0]=4 3875 B15R1.551 CSCCN(C)C(=O)C[n+]1ccccc1 240690a_100000686725_200000086051 [0,1,0,0,0,0|3,0,0]=4 3876 B15R1.551 CSCCN(C)C(=O)C[n+]1ccccc1 527a_100000686725_200000086051 [0,1,0,0,0,0|3,0,0]=4 3877 B15R1.551 CSCCN(C)C(=O)Cc1ccccn1 11a_100000686725_100000233486 [0,1,0,0,0,0|3,0,0]=4 3878 B15R1.551 CSCCN(C)C(=O)Cc1cccnc1 11a_100000686725_100000737805 [0,1,0,0,0,0|3,0,0]=4 3879 B15R1.551 CSCCN(C)C(=O)Cc1cccnc1 240690a_100000686725_100000737805 [0,1,0,0,0,0|3,0,0]=4 3880 B15R1.551 CSCCN(C)C(=O)Cc1cccnc1 527a_100000686725_100000737805 [0,1,0,0,0,0|3,0,0]=4 3881 B15R1.551 CSCCN(C)C(=O)Cc1ccncc1 11a_100000686725_100011201483 [0,1,0,0,0,0|3,0,0]=4 3882 B15R1.551 CSCCN(C)C(=O)Cc1ccncc1 240690a_100000686725_100011201483 [0,1,0,0,0,0|3,0,0]=4 3883 B15R1.551 CSCCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000686725 [0,1,0,0,0,0|3,0,0]=4 3884 B15R1.551 O=C(CCCF)C(=O)Nc1ccccc1 1458a_100000738435_100011934791 [0,1,0,0,0,0|3,0,0]=4 3885 B15R1.551 O=C(CCCO)C(=O)Nc1ccccc1 1458a_100000738435_100011215043 [0,1,0,0,0,0|3,0,0]=4 3886 B15R1.809 C=C(CCC)CC(=O)Cc1ccccc1 1458a_100000138376_100015291786 [0,1,0,0,0,0|1,0,1]=3 3887 B15R1.809 C=C(CCC)CC(=O)Cc1ccccn1 1458a_100000138376_100000721315 [0,1,0,0,0,0|2,0,1]=4 3888 B15R1.809 C=C(CCC)CC(=O)Cc1cccnc1 1458a_100000138376_100000733263 [0,1,0,0,0,0|2,0,1]=4 3889 B15R1.809 C=C(CCC)CC(=O)Cc1ccncc1 1458a_100000138376_100000705612 [0,1,0,0,0,0|2,0,1]=4 3890 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 11a_100000106764_100000138376 [0,1,0,0,0,0|2,0,1]=4 3891 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 22a_100000106764_100000138376 [0,1,0,0,0,0|2,0,1]=4 3892 B15R1.809 C=C(CCC)CC(=O)Nc1ccccc1 527a_100000106764_100000138376 [0,1,0,0,0,0|2,0,1]=4 3893 B15R1.809 CC(CCBr)OC(C)Cc1ccccc1 34a_100012276601_200011218536 [0,1,0,0,0,0|2,0,1]=4 3894 B15R1.809 CC(CCO)OC(C)Cc1ccccc1 34a_100000748627_100009893172 [0,1,0,0,0,0|2,0,1]=4 3895 B15R1.809 CC(CCO)OC(C)Cc1ccccc1 7a_100000748627_100009893172 [0,1,0,0,0,0|2,0,1]=4 3896 B15R1.809 CCCC(=CC(=O)Cc1ccccc1)C 1458a_100020676950_100015291786 [0,1,0,0,0,0|1,0,1]=3 3897 B15R1.809 CCCC(=CC(=O)Cc1ccccn1)C 1458a_100020676950_100000721315 [0,1,0,0,0,0|2,0,1]=4 3898 B15R1.809 CCCC(=CC(=O)Cc1cccnc1)C 1458a_100020676950_100000733263 [0,1,0,0,0,0|2,0,1]=4 3899 B15R1.809 CCCC(=CC(=O)Cc1ccncc1)C 1458a_100020676950_100000705612 [0,1,0,0,0,0|2,0,1]=4 3900 B15R1.809 CCCC(=CC(=O)Nc1ccccc1)C 11a_100000106764_100020676950 [0,1,0,0,0,0|2,0,1]=4 3901 B15R1.809 CCCC(=CC(=O)Nc1ccccc1)C 1626a_100000106764_100020676950 [0,1,0,0,0,0|2,0,1]=4 3902 B15R1.809 CCCC(=CC(=O)Nc1ccccc1)C 22a_100000106764_100020676950 [0,1,0,0,0,0|2,0,1]=4 3903 B15R1.809 CCCC(=O)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000747444 [0,1,0,0,0,0|2,0,1]=4 3904 B15R1.809 CCCC(=O)CC(=O)Cc1ccccc1 1458a_100000211992_100000233483 [0,1,0,0,0,0|1,0,1]=3 3905 B15R1.809 CCCC(=O)CC(=O)Cc1ccccn1 1458a_100000233486_100000747444 [0,1,0,0,0,0|2,0,1]=4 3906 B15R1.809 CCCC(=O)CC(=O)Cc1cccnc1 1458a_100000737805_100000747444 [0,1,0,0,0,0|2,0,1]=4 3907 B15R1.809 CCCC(=O)CC(=O)Nc1ccccc1 1458a_100000211992_100000182850 [0,1,0,0,0,0|2,0,1]=4 3908 B15R1.809 CCCC(=O)CC(=O)Oc1ccccc1 1458a_100000211992_100009813826 [0,1,0,0,0,0|2,0,1]=4 3909 B15R1.809 CCCC(C)CC(=O)C[n+]1ccccc1 1458a_200000086051_100011216630 [0,1,0,0,0,0|2,0,0]=3 3910 B15R1.809 CCCC(C)CC(=O)Cc1ccccc1 1458a_100000748435_100015291786 [0,1,0,0,0,0|1,0,0]=2 3911 B15R1.809 CCCC(C)CC(=O)Cc1ccccn1 1458a_100000233486_100011216630 [0,1,0,0,0,0|2,0,0]=3 3912 B15R1.809 CCCC(C)CC(=O)Cc1ccccn1 1458a_100000748435_100000721315 [0,1,0,0,0,0|2,0,0]=3 3913 B15R1.809 CCCC(C)CC(=O)Cc1cccnc1 1458a_100000737805_100011216630 [0,1,0,0,0,0|2,0,0]=3 3914 B15R1.809 CCCC(C)CC(=O)Cc1cccnc1 1458a_100000748435_100000733263 [0,1,0,0,0,0|2,0,0]=3 3915 B15R1.809 CCCC(C)CC(=O)Cc1cccnn1 1458a_100000748435_100016990269 [0,1,0,0,0,0|3,0,0]=4 3916 B15R1.809 CCCC(C)CC(=O)Cc1ccncc1 1458a_100000748435_100000705612 [0,1,0,0,0,0|2,0,0]=3 3917 B15R1.809 CCCC(C)CC(=O)Cc1cnccn1 1458a_100000748435_100016995436 [0,1,0,0,0,0|3,0,0]=4 3918 B15R1.809 CCCC(C)CC(=O)Cc1cncnc1 1458a_100000721575_100011216630 [0,1,0,0,0,0|3,0,0]=4 3919 B15R1.809 CCCC(C)CC(=O)Cc1cncnc1 1458a_100000748435_100015196519 [0,1,0,0,0,0|3,0,0]=4 3920 B15R1.809 CCCC(C)CC(=O)Cc1ncccn1 1458a_100000748435_100000703007 [0,1,0,0,0,0|3,0,0]=4 3921 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 11a_100000106764_100000748435 [0,1,0,0,0,0|2,0,0]=3 3922 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000748435 [0,1,0,0,0,0|2,0,0]=3 3923 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 22a_100000106764_100000748435 [0,1,0,0,0,0|2,0,0]=3 3924 B15R1.809 CCCC(C)CC(=O)Nc1ccccc1 527a_100000106764_100000748435 [0,1,0,0,0,0|2,0,0]=3 3925 B15R1.809 CCCC(C)CN(C)Cc1ccccc1 2230a_100000186898_100011216630 [0,1,0,0,0,0|3,0,0]=4 3926 B15R1.809 CCCC(C)CN(C)Cc1ccccc1 269982a_100000186898_100011216630 [0,1,0,0,0,0|3,0,0]=4 3927 B15R1.809 CCCC(C)CN(C)Cc1ccccc1 270004a_100000186898_100000243154 [0,1,0,0,0,0|3,0,0]=4 3928 B15R1.809 CCCC(C)NC(=O)C[n+]1ccccc1 11a_100000741246_200000086051 [0,1,0,0,0,0|2,0,0]=3 3929 B15R1.809 CCCC(C)NC(=O)C[n+]1ccccc1 240690a_100000741246_200000086051 [0,1,0,0,0,0|2,0,0]=3 3930 B15R1.809 CCCC(C)NC(=O)C[n+]1ccccc1 527a_100000741246_200000086051 [0,1,0,0,0,0|2,0,0]=3 3931 B15R1.809 CCCC(C)NC(=O)Cc1ccccn1 11a_100000741246_100000233486 [0,1,0,0,0,0|2,0,0]=3 3932 B15R1.809 CCCC(C)NC(=O)Cc1cccnc1 11a_100000741246_100000737805 [0,1,0,0,0,0|2,0,0]=3 3933 B15R1.809 CCCC(C)NC(=O)Cc1cccnc1 240690a_100000741246_100000737805 [0,1,0,0,0,0|2,0,0]=3 3934 B15R1.809 CCCC(C)NC(=O)Cc1cccnc1 527a_100000741246_100000737805 [0,1,0,0,0,0|2,0,0]=3 3935 B15R1.809 CCCC(C)NC(=O)Cc1ccncc1 11a_100000741246_100011201483 [0,1,0,0,0,0|2,0,0]=3 3936 B15R1.809 CCCC(C)NC(=O)Cc1ccncc1 240690a_100000741246_100011201483 [0,1,0,0,0,0|2,0,0]=3 3937 B15R1.809 CCCC(C)NC(=O)Cc1cnccn1 11a_100000741246_100000726051 [0,1,0,0,0,0|3,0,0]=4 3938 B15R1.809 CCCC(C)NC(=O)Cc1cnccn1 240690a_100000741246_100000726051 [0,1,0,0,0,0|3,0,0]=4 3939 B15R1.809 CCCC(C)NC(=O)Cc1cnccn1 527a_100000741246_100000726051 [0,1,0,0,0,0|3,0,0]=4 3940 B15R1.809 CCCC(C)NC(=O)Cc1cncnc1 11a_100000741246_100000721575 [0,1,0,0,0,0|3,0,0]=4 3941 B15R1.809 CCCC(C)NC(=O)Cc1cncnc1 240690a_100000741246_100000721575 [0,1,0,0,0,0|3,0,0]=4 3942 B15R1.809 CCCC(C)NC(=O)Cc1cncnc1 527a_100000741246_100000721575 [0,1,0,0,0,0|3,0,0]=4 3943 B15R1.809 CCCC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000741246 [0,1,0,0,0,0|2,0,0]=3 3944 B15R1.809 CCCC(C)OC(C)Cc1ccccc1 34a_100000748627_100000766640 [0,1,0,0,0,0|1,0,1]=3 3945 B15R1.809 CCCC(C)OC(C)Cc1ccccc1 34a_100000764384_200011218536 [0,1,0,0,0,0|1,0,1]=3 3946 B15R1.809 CCCC(C)OC(C)Cc1ccccc1 7a_100000748627_100000766640 [0,1,0,0,0,0|1,0,1]=3 3947 B15R1.809 CCCC(C)OC(C)Cc1ccccc1 7a_100000764384_200011218536 [0,1,0,0,0,0|1,0,1]=3 3948 B15R1.809 CCCC(C)SC(C)Cc1ccccc1 62a_100000766640_200011218536 [0,1,0,0,0,0|1,1,1]=4 3949 B15R1.809 CCCC(C)SC(C)Cc1ccccc1 62a_200011218536_100000766640 [0,1,0,0,0,0|1,1,1]=4 3950 B15R1.809 CCCN(C)CC(=O)Cc1ccccc1 2230a_100000747261_100000233483 [0,1,0,0,0,0|2,0,0]=3 3951 B15R1.809 CCCN(C)CC(=O)Cc1ccccc1 269982a_100000747261_100000233483 [0,1,0,0,0,0|2,0,0]=3 3952 B15R1.809 CCCN(C)CC(=O)Nc1ccccc1 2230a_100000747261_100000182850 [0,1,0,0,0,0|3,0,0]=4 3953 B15R1.809 CCCN(C)CC(=O)Nc1ccccc1 269982a_100000747261_100000182850 [0,1,0,0,0,0|3,0,0]=4 3954 B15R1.809 CCCN(C)CC(=O)Oc1ccccc1 2230a_100000747261_100009813826 [0,1,0,0,0,0|3,0,0]=4 3955 B15R1.809 CCCN(C)CC(=O)Oc1ccccc1 269982a_100000747261_100009813826 [0,1,0,0,0,0|3,0,0]=4 3956 B15R1.809 CCCS(=O)CC(=O)Cc1ccccc1 1458a_100011387404_100015291786 [0,1,0,0,0,0|2,0,0]=3 3957 B15R1.809 CCCS(=O)CC(=O)Cc1ccccn1 1458a_100011387404_100000721315 [0,1,0,0,0,0|3,0,0]=4 3958 B15R1.809 CCCS(=O)CC(=O)Cc1cccnc1 1458a_100011387404_100000733263 [0,1,0,0,0,0|3,0,0]=4 3959 B15R1.809 CCCS(=O)CC(=O)Cc1ccncc1 1458a_100011387404_100000705612 [0,1,0,0,0,0|3,0,0]=4 3960 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 11a_100000106764_100011387404 [0,1,0,0,0,0|3,0,0]=4 3961 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 1626a_100000106764_100011387404 [0,1,0,0,0,0|3,0,0]=4 3962 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 22a_100000106764_100011387404 [0,1,0,0,0,0|3,0,0]=4 3963 B15R1.809 CCCS(=O)CC(=O)Nc1ccccc1 527a_100000106764_100011387404 [0,1,0,0,0,0|3,0,0]=4 3964 B15R1.809 CCOC(=O)CC(=O)Cc1ccccc1 1458a_100000243816_100015291786 [0,1,0,0,0,0|2,0,1]=4 3965 B15R1.809 CCSC(C)CC(=O)Cc1ccccc1 1458a_200011311441_100015291786 [0,1,0,0,0,0|2,0,0]=3 3966 B15R1.809 CCSC(C)CC(=O)Cc1ccccn1 1458a_200011311441_100000721315 [0,1,0,0,0,0|3,0,0]=4 3967 B15R1.809 CCSC(C)CC(=O)Cc1cccnc1 1458a_200011311441_100000733263 [0,1,0,0,0,0|3,0,0]=4 3968 B15R1.809 CCSC(C)CC(=O)Cc1ccncc1 1458a_200011311441_100000705612 [0,1,0,0,0,0|3,0,0]=4 3969 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 11a_100000106764_200011311441 [0,1,0,0,0,0|3,0,0]=4 3970 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 1626a_100000106764_200011311441 [0,1,0,0,0,0|3,0,0]=4 3971 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 22a_100000106764_200011311441 [0,1,0,0,0,0|3,0,0]=4 3972 B15R1.809 CCSC(C)CC(=O)Nc1ccccc1 527a_100000106764_200011311441 [0,1,0,0,0,0|3,0,0]=4 3973 B15R1.809 CN(CCO)CC(=O)Cc1ccccc1 2230a_100000210263_100000233483 [0,1,0,0,0,0|3,0,0]=4 3974 B15R1.809 CN(CCO)CC(=O)Cc1ccccc1 269982a_100000210263_100000233483 [0,1,0,0,0,0|3,0,0]=4 3975 B15R1.809 CNCC(=O)NC(=O)Cc1ccccc1 2230a_106832991635_100000010274 [0,1,0,0,0,0|2,0,1]=4 3976 B15R1.809 CNCC(=O)NC(=O)Cc1ccccc1 7a_106832991635_100000010274 [0,1,0,0,0,0|2,0,1]=4 3977 B15R1.809 COCC(=O)CC(=O)Cc1ccccc1 1458a_100000210968_100000233483 [0,1,0,0,0,0|2,0,1]=4 3978 B15R1.809 COCC(C)OC(C)Cc1ccccc1 34a_100000748627_100000765312 [0,1,0,0,0,0|2,0,1]=4 3979 B15R1.809 COCC(C)OC(C)Cc1ccccc1 7a_100000748627_100000765312 [0,1,0,0,0,0|2,0,1]=4 3980 B15R1.809 COC[C@@H](C)NC(=O)C[n+]1ccccc1 11a_100000764878_200000086051 [0,1,0,0,0,0|3,0,0]=4 3981 B15R1.809 COC[C@@H](C)NC(=O)C[n+]1ccccc1 240690a_100000764878_200000086051 [0,1,0,0,0,0|3,0,0]=4 3982 B15R1.809 COC[C@@H](C)NC(=O)C[n+]1ccccc1 527a_100000764878_200000086051 [0,1,0,0,0,0|3,0,0]=4 3983 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccccn1 11a_100000764878_100000233486 [0,1,0,0,0,0|3,0,0]=4 3984 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 11a_100000764878_100000737805 [0,1,0,0,0,0|3,0,0]=4 3985 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 240690a_100000764878_100000737805 [0,1,0,0,0,0|3,0,0]=4 3986 B15R1.809 COC[C@@H](C)NC(=O)Cc1cccnc1 527a_100000764878_100000737805 [0,1,0,0,0,0|3,0,0]=4 3987 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccncc1 11a_100000764878_100011201483 [0,1,0,0,0,0|3,0,0]=4 3988 B15R1.809 COC[C@@H](C)NC(=O)Cc1ccncc1 240690a_100000764878_100011201483 [0,1,0,0,0,0|3,0,0]=4 3989 B15R1.809 COC[C@@H](C)NC(=O)Nc1ccccc1 2430a_100000106764_100000764878 [0,1,0,0,0,0|3,0,0]=4 3990 B15R1.809 COC[C@@H](C)OC(C)Cc1ccccc1 34a_100011934205_200011218536 [0,1,0,0,0,0|2,0,1]=4 3991 B15R1.809 CSCC(=O)CC(=O)Cc1ccccc1 1458a_100000184570_100000233483 [0,1,0,0,0,0|2,0,1]=4 3992 B15R1.809 CSCC(=O)NC(=O)Cc1ccccc1 62a_200000210301_100000010274 [0,1,0,0,0,0|2,0,1]=4 3993 B15R1.809 C[C@H](CCO)NC(=O)C[n+]1ccccc1 240690a_100000706166_200000086051 [0,1,0,0,0,0|3,0,0]=4 3994 B15R1.809 C[C@H](CCO)NC(=O)C[n+]1ccccc1 527a_100000706166_200000086051 [0,1,0,0,0,0|3,0,0]=4 3995 B15R1.809 C[C@H](CCO)NC(=O)Cc1cccnc1 240690a_100000706166_100000737805 [0,1,0,0,0,0|3,0,0]=4 3996 B15R1.809 C[C@H](CCO)NC(=O)Cc1cccnc1 527a_100000706166_100000737805 [0,1,0,0,0,0|3,0,0]=4 3997 B15R1.809 C[C@H](CCO)NC(=O)Cc1ccncc1 240690a_100000706166_100011201483 [0,1,0,0,0,0|3,0,0]=4 3998 B15R1.809 C[C@H](CCO)NC(=O)Nc1ccccc1 2430a_100000106764_100000706166 [0,1,0,0,0,0|3,0,0]=4 3999 B15R1.809 O=C(CCO)CC(=O)Cc1ccccc1 1458a_100011216618_100000233483 [0,1,0,0,0,0|2,0,1]=4 4000 B15R1.809 [13CH3]SCC(=O)NC(=O)Cc1ccccc1 62a_200025704644_100000010274 [0,1,0,0,0,0|2,0,1]=4 4001 B15R1.964 CC(CF)OCC(=O)Cc1ccccc1 7a_100016041109_100000233483 [0,1,0,0,0,0|3,0,0]=4 4002 B15R1.964 CC(CN)COC(C)Cc1ccccc1 34a_100000744482_200011218536 [0,1,0,0,0,0|2,0,1]=4 4003 B15R1.964 CC(CO)CNC(=O)C[n+]1ccccc1 240690a_100000744482_200000086051 [0,1,0,0,0,0|3,0,0]=4 4004 B15R1.964 CC(CO)CNC(=O)C[n+]1ccccc1 527a_100000744482_200000086051 [0,1,0,0,0,0|3,0,0]=4 4005 B15R1.964 CC(CO)CNC(=O)Cc1cccnc1 240690a_100000744482_100000737805 [0,1,0,0,0,0|3,0,0]=4 4006 B15R1.964 CC(CO)CNC(=O)Cc1cccnc1 527a_100000744482_100000737805 [0,1,0,0,0,0|3,0,0]=4 4007 B15R1.964 CC(CO)CNC(=O)Cc1ccncc1 240690a_100000744482_100011201483 [0,1,0,0,0,0|3,0,0]=4 4008 B15R1.964 CC(CO)CNC(=O)Nc1ccccc1 2430a_100000106764_100000744482 [0,1,0,0,0,0|3,0,0]=4 4009 B15R1.964 CC(CO)SCC(=O)Cc1ccccc1 62a_100012180447_100000233483 [0,1,0,0,0,0|3,0,0]=4 4010 B15R1.964 CC(Cc1ccccc1)OCC(Cl)CCl 34a_100000033668_200011218536 [0,1,0,0,0,0|2,0,1]=4 4011 B15R1.964 CC(Cc1ccccc1)OCC(O)CO 34a_100000748627_100011219619 [0,1,0,0,0,0|2,0,1]=4 4012 B15R1.964 CC(Cc1ccccc1)OCC(O)CO 7a_100000748627_100011219619 [0,1,0,0,0,0|2,0,1]=4 4013 B15R1.964 CC(Cc1ccccc1)OC[C@@H](C)CO 34a_100000748627_100000059175 [0,1,0,0,0,0|2,0,1]=4 4014 B15R1.964 CC(Cc1ccccc1)OC[C@@H](C)CO 7a_100000748627_100000059175 [0,1,0,0,0,0|2,0,1]=4 4015 B15R1.964 CC(Cc1ccccc1)OC[C@@H](O)CF 34a_100000748627_100015614560 [0,1,0,0,0,0|2,0,1]=4 4016 B15R1.964 CC(Cc1ccccc1)OC[C@@H](O)CF 7a_100000748627_100015614560 [0,1,0,0,0,0|2,0,1]=4 4017 B15R1.964 CC(Cc1ccccc1)OC[C@@H](O)CO 34a_100000748627_100009815848 [0,1,0,0,0,0|2,0,1]=4 4018 B15R1.964 CC(Cc1ccccc1)OC[C@@H](O)CO 7a_100000748627_100009815848 [0,1,0,0,0,0|2,0,1]=4 4019 B15R1.964 CC(Cc1ccccc1)OC[C@H](F)CN 34a_100015665980_200011218536 [0,1,0,0,0,0|2,0,1]=4 4020 B15R1.964 CCC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_100000210202 [0,1,0,0,0,0|2,0,1]=4 4021 B15R1.964 CCC(=O)CCC(=O)Nc1ccccc1 1458a_100000210414_100000242058 [0,1,0,0,0,0|2,0,1]=4 4022 B15R1.964 CCC(=O)CCC(=O)Oc1ccccc1 1458a_100000210414_200000035796 [0,1,0,0,0,0|2,0,1]=4 4023 B15R1.964 CCC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_100000210202 [0,1,0,0,0,0|1,0,1]=3 4024 B15R1.964 CCC(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_100000210202 [0,1,0,0,0,0|2,0,1]=4 4025 B15R1.964 CCC(=O)COC(C)Cc1ccccc1 34a_100000725409_200011218536 [0,1,0,0,0,0|1,0,2]=4 4026 B15R1.964 CCC(=O)COC(C)Cc1ccccc1 7a_100000748627_100000747405 [0,1,0,0,0,0|1,0,2]=4 4027 B15R1.964 CCC(=O)NCC(=O)Cc1ccccc1 1458a_100000194589_100015291786 [0,1,0,0,0,0|2,0,1]=4 4028 B15R1.964 CCC(=O)NNC(=O)Cc1ccccc1 22a_100000182964_100000210414 [0,1,0,0,0,0|2,0,1]=4 4029 B15R1.964 CCC(C)CCC(=O)Cc1ccccc1 1458a_100000701222_100015291786 [0,1,0,0,0,0|1,0,0]=2 4030 B15R1.964 CCC(C)CCC(=O)Cc1ccccn1 1458a_100000701222_100000721315 [0,1,0,0,0,0|2,0,0]=3 4031 B15R1.964 CCC(C)CCC(=O)Cc1cccnc1 1458a_100000701222_100000733263 [0,1,0,0,0,0|2,0,0]=3 4032 B15R1.964 CCC(C)CCC(=O)Cc1cccnn1 1458a_100000701222_100016990269 [0,1,0,0,0,0|3,0,0]=4 4033 B15R1.964 CCC(C)CCC(=O)Cc1ccncc1 1458a_100000701222_100000705612 [0,1,0,0,0,0|2,0,0]=3 4034 B15R1.964 CCC(C)CCC(=O)Cc1cnccn1 1458a_100000701222_100016995436 [0,1,0,0,0,0|3,0,0]=4 4035 B15R1.964 CCC(C)CCC(=O)Cc1cncnc1 1458a_100000701222_100015196519 [0,1,0,0,0,0|3,0,0]=4 4036 B15R1.964 CCC(C)CCC(=O)Cc1ncccn1 1458a_100000701222_100000703007 [0,1,0,0,0,0|3,0,0]=4 4037 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000701222 [0,1,0,0,0,0|2,0,0]=3 4038 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000701222 [0,1,0,0,0,0|2,0,0]=3 4039 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000701222 [0,1,0,0,0,0|2,0,0]=3 4040 B15R1.964 CCC(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000701222 [0,1,0,0,0,0|2,0,0]=3 4041 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 11a_100020588543_200000086051 [0,1,0,0,0,0|2,0,0]=3 4042 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 240690a_100020588543_200000086051 [0,1,0,0,0,0|2,0,0]=3 4043 B15R1.964 CCC(C)CNC(=O)C[n+]1ccccc1 527a_100020588543_200000086051 [0,1,0,0,0,0|2,0,0]=3 4044 B15R1.964 CCC(C)CNC(=O)Cc1ccccn1 11a_100020588543_100000233486 [0,1,0,0,0,0|2,0,0]=3 4045 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 11a_100020588543_100000737805 [0,1,0,0,0,0|2,0,0]=3 4046 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 240690a_100020588543_100000737805 [0,1,0,0,0,0|2,0,0]=3 4047 B15R1.964 CCC(C)CNC(=O)Cc1cccnc1 527a_100020588543_100000737805 [0,1,0,0,0,0|2,0,0]=3 4048 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 11a_100020588543_100011201483 [0,1,0,0,0,0|2,0,0]=3 4049 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 240690a_100020588543_100011201483 [0,1,0,0,0,0|2,0,0]=3 4050 B15R1.964 CCC(C)CNC(=O)Cc1cnccn1 11a_100020588543_100000726051 [0,1,0,0,0,0|3,0,0]=4 4051 B15R1.964 CCC(C)CNC(=O)Cc1cnccn1 240690a_100020588543_100000726051 [0,1,0,0,0,0|3,0,0]=4 4052 B15R1.964 CCC(C)CNC(=O)Cc1cnccn1 527a_100020588543_100000726051 [0,1,0,0,0,0|3,0,0]=4 4053 B15R1.964 CCC(C)CNC(=O)Cc1cncnc1 11a_100020588543_100000721575 [0,1,0,0,0,0|3,0,0]=4 4054 B15R1.964 CCC(C)CNC(=O)Cc1cncnc1 240690a_100020588543_100000721575 [0,1,0,0,0,0|3,0,0]=4 4055 B15R1.964 CCC(C)CNC(=O)Cc1cncnc1 527a_100020588543_100000721575 [0,1,0,0,0,0|3,0,0]=4 4056 B15R1.964 CCC(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100020588543 [0,1,0,0,0,0|2,0,0]=3 4057 B15R1.964 CCC(C)COC(C)Cc1ccccc1 34a_100000748627_100000748023 [0,1,0,0,0,0|1,0,1]=3 4058 B15R1.964 CCC(C)COC(C)Cc1ccccc1 7a_100000748627_100000748023 [0,1,0,0,0,0|1,0,1]=3 4059 B15R1.964 CCC(C)CSC(C)Cc1ccccc1 62a_100000748023_200011218536 [0,1,0,0,0,0|1,1,1]=4 4060 B15R1.964 CCC(C)CSC(C)Cc1ccccc1 62a_200011218536_100000748023 [0,1,0,0,0,0|1,1,1]=4 4061 B15R1.964 CCC(C)NCC(=O)Cc1ccccc1 2230a_100000209981_100000233483 [0,1,0,0,0,0|2,0,0]=3 4062 B15R1.964 CCC(C)NCC(=O)Nc1ccccc1 2230a_100000209981_100000182850 [0,1,0,0,0,0|3,0,0]=4 4063 B15R1.964 CCC(C)NCC(=O)Oc1ccccc1 2230a_100000209981_100009813826 [0,1,0,0,0,0|3,0,0]=4 4064 B15R1.964 CCC(C)NNC(=O)C[n+]1ccccc1 22a_100000718999_200000086051 [0,1,0,0,0,0|3,0,0]=4 4065 B15R1.964 CCC(C)NNC(=O)Cc1ccccn1 22a_100000718999_100000233486 [0,1,0,0,0,0|3,0,0]=4 4066 B15R1.964 CCC(C)NNC(=O)Cc1cccnc1 22a_100000718999_100000737805 [0,1,0,0,0,0|3,0,0]=4 4067 B15R1.964 CCC(C)NNC(=O)Cc1ccncc1 22a_100000718999_100011201483 [0,1,0,0,0,0|3,0,0]=4 4068 B15R1.964 CCC(C)OCC(=O)Cc1ccccc1 7a_100000210228_100000233483 [0,1,0,0,0,0|2,0,0]=3 4069 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100011215416 [0,1,0,0,0,0|3,0,0]=4 4070 B15R1.964 CCC(C)OCC(=O)Nc1ccccc1 7a_100000210228_100000182850 [0,1,0,0,0,0|3,0,0]=4 4071 B15R1.964 CCC(C)OCC(=O)Oc1ccccc1 7a_100000210228_100009813826 [0,1,0,0,0,0|3,0,0]=4 4072 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000758301 [0,1,0,0,0,0|2,0,0]=3 4073 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 62a_100000758301_100000233483 [0,1,0,0,0,0|2,0,0]=3 4074 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100000758301_100000182850 [0,1,0,0,0,0|3,0,0]=4 4075 B15R1.964 CCC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000758301 [0,1,0,0,0,0|3,0,0]=4 4076 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100000758301_100009813826 [0,1,0,0,0,0|3,0,0]=4 4077 B15R1.964 CCC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000758301 [0,1,0,0,0,0|3,0,0]=4 4078 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 1626a_100000106764_203496584001 [0,1,0,0,0,0|2,0,0]=3 4079 B15R1.964 CCC(O)CCC(=O)Nc1ccccc1 22a_100000106764_203496584001 [0,1,0,0,0,0|2,0,0]=3 4080 B15R1.964 CCC(O)CNC(=O)C[n+]1ccccc1 11a_100011218483_200000086051 [0,1,0,0,0,0|2,0,0]=3 4081 B15R1.964 CCC(O)CNC(=O)C[n+]1ccccc1 240690a_100011218483_200000086051 [0,1,0,0,0,0|2,0,0]=3 4082 B15R1.964 CCC(O)CNC(=O)C[n+]1ccccc1 527a_100011218483_200000086051 [0,1,0,0,0,0|2,0,0]=3 4083 B15R1.964 CCC(O)CNC(=O)Cc1ccccn1 11a_100011218483_100000233486 [0,1,0,0,0,0|2,0,0]=3 4084 B15R1.964 CCC(O)CNC(=O)Cc1cccnc1 11a_100011218483_100000737805 [0,1,0,0,0,0|2,0,0]=3 4085 B15R1.964 CCC(O)CNC(=O)Cc1cccnc1 240690a_100011218483_100000737805 [0,1,0,0,0,0|2,0,0]=3 4086 B15R1.964 CCC(O)CNC(=O)Cc1cccnc1 527a_100011218483_100000737805 [0,1,0,0,0,0|2,0,0]=3 4087 B15R1.964 CCC(O)CNC(=O)Cc1ccncc1 11a_100011218483_100011201483 [0,1,0,0,0,0|2,0,0]=3 4088 B15R1.964 CCC(O)CNC(=O)Cc1ccncc1 240690a_100011218483_100011201483 [0,1,0,0,0,0|2,0,0]=3 4089 B15R1.964 CCC(O)CNC(=O)Cc1cnccn1 11a_100011218483_100000726051 [0,1,0,0,0,0|3,0,0]=4 4090 B15R1.964 CCC(O)CNC(=O)Cc1cnccn1 240690a_100011218483_100000726051 [0,1,0,0,0,0|3,0,0]=4 4091 B15R1.964 CCC(O)CNC(=O)Cc1cnccn1 527a_100011218483_100000726051 [0,1,0,0,0,0|3,0,0]=4 4092 B15R1.964 CCC(O)CNC(=O)Cc1cncnc1 11a_100011218483_100000721575 [0,1,0,0,0,0|3,0,0]=4 4093 B15R1.964 CCC(O)CNC(=O)Cc1cncnc1 240690a_100011218483_100000721575 [0,1,0,0,0,0|3,0,0]=4 4094 B15R1.964 CCC(O)CNC(=O)Cc1cncnc1 527a_100011218483_100000721575 [0,1,0,0,0,0|3,0,0]=4 4095 B15R1.964 CCC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100011218483 [0,1,0,0,0,0|2,0,0]=3 4096 B15R1.964 CCC(O)COC(C)Cc1ccccc1 34a_100000748627_100011218378 [0,1,0,0,0,0|1,0,1]=3 4097 B15R1.964 CCC(O)COC(C)Cc1ccccc1 7a_100000748627_100011218378 [0,1,0,0,0,0|1,0,1]=3 4098 B15R1.964 CCC(O)CSC(C)Cc1ccccc1 62a_100011218378_200011218536 [0,1,0,0,0,0|1,1,1]=4 4099 B15R1.964 CCC(O)CSC(C)Cc1ccccc1 62a_200011218536_100011218378 [0,1,0,0,0,0|1,1,1]=4 4100 B15R1.964 CCN(C)CCC(=O)Cc1ccccc1 1458a_100000755305_100015291786 [0,1,0,0,0,0|2,0,0]=3 4101 B15R1.964 CCN(C)CCC(=O)Cc1ccccn1 1458a_100000755305_100000721315 [0,1,0,0,0,0|3,0,0]=4 4102 B15R1.964 CCN(C)CCC(=O)Cc1cccnc1 1458a_100000755305_100000733263 [0,1,0,0,0,0|3,0,0]=4 4103 B15R1.964 CCN(C)CCC(=O)Cc1ccncc1 1458a_100000755305_100000705612 [0,1,0,0,0,0|3,0,0]=4 4104 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 2230a_100000225621_100000242058 [0,1,0,0,0,0|3,0,0]=4 4105 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000755305 [0,1,0,0,0,0|3,0,0]=4 4106 B15R1.964 CCN(C)CCC(=O)Nc1ccccc1 269982a_100000225621_100000242058 [0,1,0,0,0,0|3,0,0]=4 4107 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 2230a_100000225621_200000035796 [0,1,0,0,0,0|3,0,0]=4 4108 B15R1.964 CCN(C)CCC(=O)Oc1ccccc1 269982a_100000225621_200000035796 [0,1,0,0,0,0|3,0,0]=4 4109 B15R1.964 CCS(=O)CCC(=O)Cc1ccccc1 1458a_100011387550_100015291786 [0,1,0,0,0,0|2,0,0]=3 4110 B15R1.964 CCS(=O)CCC(=O)Cc1ccccn1 1458a_100011387550_100000721315 [0,1,0,0,0,0|3,0,0]=4 4111 B15R1.964 CCS(=O)CCC(=O)Cc1cccnc1 1458a_100011387550_100000733263 [0,1,0,0,0,0|3,0,0]=4 4112 B15R1.964 CCS(=O)CCC(=O)Cc1ccncc1 1458a_100011387550_100000705612 [0,1,0,0,0,0|3,0,0]=4 4113 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 11a_100000106764_100011387550 [0,1,0,0,0,0|3,0,0]=4 4114 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 1626a_100000106764_100011387550 [0,1,0,0,0,0|3,0,0]=4 4115 B15R1.964 CCS(=O)CCC(=O)Nc1ccccc1 527a_100000106764_100011387550 [0,1,0,0,0,0|3,0,0]=4 4116 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 34a_100000748627_100009816398 [0,1,0,0,0,0|1,0,1]=3 4117 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 7a_100000748627_100009816398 [0,1,0,0,0,0|1,0,1]=3 4118 B15R1.964 CC[C@H](C)COC(C)Cc1ccccc1 7a_100009816381_200011218536 [0,1,0,0,0,0|1,0,1]=3 4119 B15R1.964 CC[C@H](C)CSC(C)Cc1ccccc1 62a_100009816398_200011218536 [0,1,0,0,0,0|1,1,1]=4 4120 B15R1.964 CC[C@H](C)CSC(C)Cc1ccccc1 62a_200011218536_100009816398 [0,1,0,0,0,0|1,1,1]=4 4121 B15R1.964 CNC(=O)CCC(=O)Cc1ccccc1 1458a_100011309844_100015291786 [0,1,0,0,0,0|2,0,1]=4 4122 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 11a_106832991635_100000184600 [0,1,0,0,0,0|2,0,1]=4 4123 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 240690a_100102657272_100000184600 [0,1,0,0,0,0|2,0,1]=4 4124 B15R1.964 CNC(=O)CNC(=O)Cc1ccccc1 527a_100102657272_100000184600 [0,1,0,0,0,0|2,0,1]=4 4125 B15R1.964 COC(=O)CCC(=O)Cc1ccccc1 1458a_100000187943_100015291786 [0,1,0,0,0,0|2,0,1]=4 4126 B15R1.964 COC(C)COC(C)Cc1ccccc1 34a_100000690652_200011218536 [0,1,0,0,0,0|2,0,1]=4 4127 B15R1.964 COC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100009879195 [0,1,0,0,0,0|3,0,0]=4 4128 B15R1.964 COC(C)SCC(=O)Cc1ccccc1 62a_100009879195_100000233483 [0,1,0,0,0,0|3,0,0]=4 4129 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 11a_100020591295_200000086051 [0,1,0,0,0,0|3,0,0]=4 4130 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 240690a_100020591295_200000086051 [0,1,0,0,0,0|3,0,0]=4 4131 B15R1.964 CO[C@H](C)CNC(=O)C[n+]1ccccc1 527a_100020591295_200000086051 [0,1,0,0,0,0|3,0,0]=4 4132 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccccn1 11a_100020591295_100000233486 [0,1,0,0,0,0|3,0,0]=4 4133 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 11a_100020591295_100000737805 [0,1,0,0,0,0|3,0,0]=4 4134 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 240690a_100020591295_100000737805 [0,1,0,0,0,0|3,0,0]=4 4135 B15R1.964 CO[C@H](C)CNC(=O)Cc1cccnc1 527a_100020591295_100000737805 [0,1,0,0,0,0|3,0,0]=4 4136 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 11a_100020591295_100011201483 [0,1,0,0,0,0|3,0,0]=4 4137 B15R1.964 CO[C@H](C)CNC(=O)Cc1ccncc1 240690a_100020591295_100011201483 [0,1,0,0,0,0|3,0,0]=4 4138 B15R1.964 CO[C@H](C)CNC(=O)Nc1ccccc1 2430a_100000106764_100020591295 [0,1,0,0,0,0|3,0,0]=4 4139 B15R1.964 C[C@H](CO)NCC(=O)Cc1ccccc1 2230a_100000737577_100000233483 [0,1,0,0,0,0|3,0,0]=4 4140 B15R1.964 C[C@H](CO)SCC(=O)Cc1ccccc1 62a_100000233483_100016084084 [0,1,0,0,0,0|3,0,0]=4 4141 B15R1.964 C[C@H](CO)SCC(=O)Cc1ccccc1 62a_100016084084_100000233483 [0,1,0,0,0,0|3,0,0]=4 4142 B15R1.964 O=C(CF)CNC(=O)Cc1ccccc1 1458a_100000184600_100015361967 [0,1,0,0,0,0|2,0,1]=4 4143 B15R1.964 O=C(C[n+]1ccccc1)NC[C@@H](F)CO 240690a_100015665980_200000086051 [0,1,0,0,0,0|3,0,0]=4 4144 B15R1.964 O=C(C[n+]1ccccc1)NC[C@@H](F)CO 527a_100015665980_200000086051 [0,1,0,0,0,0|3,0,0]=4 4145 B15R1.964 O=C(C[n+]1ccccc1)NC[C@H](O)CO 240690a_100020644852_200000086051 [0,1,0,0,0,0|3,0,0]=4 4146 B15R1.964 O=C(C[n+]1ccccc1)NC[C@H](O)CO 527a_100020644852_200000086051 [0,1,0,0,0,0|3,0,0]=4 4147 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO 240690a_100015665980_100000737805 [0,1,0,0,0,0|3,0,0]=4 4148 B15R1.964 O=C(Cc1cccnc1)NC[C@@H](F)CO 527a_100015665980_100000737805 [0,1,0,0,0,0|3,0,0]=4 4149 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO 240690a_100020644852_100000737805 [0,1,0,0,0,0|3,0,0]=4 4150 B15R1.964 O=C(Cc1cccnc1)NC[C@H](O)CO 527a_100020644852_100000737805 [0,1,0,0,0,0|3,0,0]=4 4151 B15R1.964 O=C(Cc1ccncc1)NC[C@@H](F)CO 240690a_100015665980_100011201483 [0,1,0,0,0,0|3,0,0]=4 4152 B15R1.964 O=C(Cc1ccncc1)NC[C@H](O)CO 240690a_100020644852_100011201483 [0,1,0,0,0,0|3,0,0]=4 4153 B15R1.964 O=C(NC[C@@H](F)CO)Nc1ccccc1 2430a_100000106764_100015665980 [0,1,0,0,0,0|3,0,0]=4 4154 B15R1.964 O=C(NC[C@H](O)CO)Nc1ccccc1 2430a_100000106764_100020644852 [0,1,0,0,0,0|3,0,0]=4 4155 B15R1.1035 C#CC(Cc1ccccc1)OCCCC 34a_100000685211_100000210210 [0,1,0,0,0,0|1,0,1]=3 4156 B15R1.1035 C#CC(Cc1ccccc1)OCCCC 7a_100000685211_100000210211 [0,1,0,0,0,0|1,0,1]=3 4157 B15R1.1035 C#CC(Cc1ccccc1)OCCCF 34a_100000685211_100011934791 [0,1,0,0,0,0|2,0,1]=4 4158 B15R1.1035 C#CC(Cc1ccccc1)OCCCF 7a_100000685211_100011934791 [0,1,0,0,0,0|2,0,1]=4 4159 B15R1.1035 C#CC(Cc1ccccc1)OCCCO 34a_100000685211_100000230001 [0,1,0,0,0,0|2,0,1]=4 4160 B15R1.1035 C#CC(Cc1ccccc1)OCCCO 7a_100000685211_100011215043 [0,1,0,0,0,0|2,0,1]=4 4161 B15R1.1035 C#CC(Cc1ccccc1)OCCOC 34a_100000685211_100011201679 [0,1,0,0,0,0|2,0,1]=4 4162 B15R1.1035 C#CC(Cc1ccccc1)OCCOC 7a_100000685211_100000233755 [0,1,0,0,0,0|2,0,1]=4 4163 B15R1.1035 C#CC(Cc1ccccc1)OCCSC 34a_100000685211_100000212216 [0,1,0,0,0,0|2,0,1]=4 4164 B15R1.1035 C#CC(Cc1ccccc1)OCCSC 7a_100000685211_100000212216 [0,1,0,0,0,0|2,0,1]=4 4165 B15R1.1035 CCC(Cc1ccccc1)OCCCF 7a_100000760156_100011934791 [0,1,0,0,0,0|2,0,1]=4 4166 B15R1.1035 CCC(Cc1ccccc1)OCCCO 7a_100000760156_100011215043 [0,1,0,0,0,0|2,0,1]=4 4167 B15R1.1035 CCC(Cc1ccccc1)OCCOC 7a_100000760156_100000233755 [0,1,0,0,0,0|2,0,1]=4 4168 B15R1.1035 CCC(Cc1ccccc1)OCCSC 7a_100000760156_100000212216 [0,1,0,0,0,0|2,0,1]=4 4169 B15R1.1035 CCCCCN(CC)Cc1ccccc1 2230a_100000186914_100000210326 [0,1,0,0,0,0|3,0,0]=4 4170 B15R1.1035 CCCCCN(CC)Cc1ccccc1 269982a_100000186914_100000210215 [0,1,0,0,0,0|3,0,0]=4 4171 B15R1.1035 CCCCNC(C#N)Cc1ccccc1 2230a_100000746547_100000210211 [0,1,0,0,0,0|2,0,1]=4 4172 B15R1.1035 CCCCNC(C#N)Cc1ccccc1 7a_106832991798_100000183401 [0,1,0,0,0,0|2,0,1]=4 4173 B15R1.1035 CCCCNC(CC)Cc1ccccc1 270004a_100000102301_100000212045 [0,1,0,0,0,0|2,0,1]=4 4174 B15R1.1035 CCCCNC(CO)Cc1ccccc1 2230a_100000739027_100000210211 [0,1,0,0,0,0|1,0,2]=4 4175 B15R1.1035 CCCCOC(C#N)Cc1ccccc1 7a_100000210227_100000183401 [0,1,0,0,0,0|1,0,1]=3 4176 B15R1.1035 CCCCOC(CC)Cc1ccccc1 7a_100000760156_100000210211 [0,1,0,0,0,0|1,0,1]=3 4177 B15R1.1035 CCCCOC(CN)Cc1ccccc1 34a_100000752270_100000210210 [0,1,0,0,0,0|1,0,1]=3 4178 B15R1.1035 CCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210211 [0,1,0,0,0,0|1,0,1]=3 4179 B15R1.1035 CCCCSC(C#N)Cc1ccccc1 62a_100000183401_100000210210 [0,1,0,0,0,0|1,1,1]=4 4180 B15R1.1035 CCCCSC(C#N)Cc1ccccc1 62a_100000210211_100000183401 [0,1,0,0,0,0|1,1,1]=4 4181 B15R1.1035 CCCNN=C(CC)Cc1ccccc1 4a_100000740057_100000212045 [0,1,0,0,0,0|3,0,0]=4 4182 B15R1.1035 COCCOC(CN)Cc1ccccc1 34a_100000752270_100011201679 [0,1,0,0,0,0|2,0,1]=4 4183 B15R1.1035 COCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000233755 [0,1,0,0,0,0|2,0,1]=4 4184 B15R1.1035 CSCCOC(C#N)Cc1ccccc1 7a_100000230434_100000183401 [0,1,0,0,0,0|2,0,1]=4 4185 B15R1.1035 CSCCOC(CN)Cc1ccccc1 34a_100000752270_100000212216 [0,1,0,0,0,0|2,0,1]=4 4186 B15R1.1035 CSCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000212216 [0,1,0,0,0,0|2,0,1]=4 4187 B15R1.1035 FCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100011934791 [0,1,0,0,0,0|2,0,1]=4 4188 B15R1.1035 NCC(Cc1ccccc1)OCCCF 34a_100000752270_100011934791 [0,1,0,0,0,0|2,0,1]=4 4189 B15R1.1035 NCC(Cc1ccccc1)OCCCO 34a_100000752270_100000230001 [0,1,0,0,0,0|2,0,1]=4 4190 B15R1.1035 OCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100011215043 [0,1,0,0,0,0|2,0,1]=4 4191 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 34a_100000748627_100000730704 [0,1,0,0,0,0|1,0,2]=4 4192 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 34a_100000764851_200011218536 [0,1,0,0,0,0|1,0,2]=4 4193 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 7a_100000748627_100000730704 [0,1,0,0,0,0|1,0,2]=4 4194 B15R1.1081 C=C(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100000211660 [0,1,0,0,0,0|2,0,1]=4 4195 B15R1.1081 C=C(C)CSCC(=O)Cc1ccccc1 62a_100000748629_100000233483 [0,1,0,0,0,0|2,0,1]=4 4196 B15R1.1081 CC(=O)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215641 [0,1,0,0,0,0|2,0,1]=4 4197 B15R1.1081 CC(=O)CCCC(=O)Cc1ccccn1 1458a_100000233486_100011215641 [0,1,0,0,0,0|2,0,1]=4 4198 B15R1.1081 CC(=O)CCCC(=O)Cc1cccnc1 1458a_100000737805_100011215641 [0,1,0,0,0,0|2,0,1]=4 4199 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_100000070787_100011194425 [0,1,0,0,0,0|2,0,1]=4 4200 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200000210301 [0,1,0,0,0,0|2,0,1]=4 4201 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 34a_100000759926_200011218536 [0,1,0,0,0,0|1,0,2]=4 4202 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 7a_100000748627_100000053229 [0,1,0,0,0,0|1,0,2]=4 4203 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 7a_100000759926_200011218536 [0,1,0,0,0,0|1,0,2]=4 4204 B15R1.1081 CC(=O)NCCC(=O)Cc1ccccc1 1458a_100000183196_100015291786 [0,1,0,0,0,0|2,0,1]=4 4205 B15R1.1081 CC(=O)SCCC(=O)Cc1ccccc1 1458a_100000048949_100015291786 [0,1,0,0,0,0|2,0,1]=4 4206 B15R1.1081 CC(Br)CCOC(C)Cc1ccccc1 34a_100009893172_200011218536 [0,1,0,0,0,0|1,0,1]=3 4207 B15R1.1081 CC(Br)COCC(=O)Nc1ccccc1 34a_100012180447_100000182850 [0,1,0,0,0,0|3,0,0]=4 4208 B15R1.1081 CC(Br)COCC(=O)Oc1ccccc1 34a_100012180447_100009813826 [0,1,0,0,0,0|3,0,0]=4 4209 B15R1.1081 CC(C)/C=C/CC(=O)Cc1ccccc1 1458a_100016292215_100015291786 [0,1,0,0,0,0|1,0,2]=4 4210 B15R1.1081 CC(C)C=NNC(=O)Cc1ccccc1 4a_100000182964_100000210432 [0,1,0,0,0,0|2,0,1]=4 4211 B15R1.1081 CC(C)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011214892 [0,1,0,0,0,0|2,0,0]=3 4212 B15R1.1081 CC(C)CCCC(=O)Cc1ccccc1 1458a_100011216857_100015291786 [0,1,0,0,0,0|1,0,0]=2 4213 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100000233486_100011214892 [0,1,0,0,0,0|2,0,0]=3 4214 B15R1.1081 CC(C)CCCC(=O)Cc1ccccn1 1458a_100011216857_100000721315 [0,1,0,0,0,0|2,0,0]=3 4215 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100000737805_100011214892 [0,1,0,0,0,0|2,0,0]=3 4216 B15R1.1081 CC(C)CCCC(=O)Cc1cccnc1 1458a_100011216857_100000733263 [0,1,0,0,0,0|2,0,0]=3 4217 B15R1.1081 CC(C)CCCC(=O)Cc1cccnn1 1458a_100011216857_100016990269 [0,1,0,0,0,0|3,0,0]=4 4218 B15R1.1081 CC(C)CCCC(=O)Cc1ccncc1 1458a_100011216857_100000705612 [0,1,0,0,0,0|2,0,0]=3 4219 B15R1.1081 CC(C)CCCC(=O)Cc1cnccn1 1458a_100011216857_100016995436 [0,1,0,0,0,0|3,0,0]=4 4220 B15R1.1081 CC(C)CCCC(=O)Cc1cncnc1 1458a_100000721575_100011214892 [0,1,0,0,0,0|3,0,0]=4 4221 B15R1.1081 CC(C)CCCC(=O)Cc1cncnc1 1458a_100011216857_100015196519 [0,1,0,0,0,0|3,0,0]=4 4222 B15R1.1081 CC(C)CCCC(=O)Cc1ncccn1 1458a_100011216857_100000703007 [0,1,0,0,0,0|3,0,0]=4 4223 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100011216857 [0,1,0,0,0,0|2,0,0]=3 4224 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 1626a_100000106764_100011216857 [0,1,0,0,0,0|2,0,0]=3 4225 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100011216857 [0,1,0,0,0,0|2,0,0]=3 4226 B15R1.1081 CC(C)CCCC(=O)Nc1ccccc1 527a_100000106764_100011216857 [0,1,0,0,0,0|2,0,0]=3 4227 B15R1.1081 CC(C)CCCN(C)Cc1ccccc1 2230a_100000186898_100011214892 [0,1,0,0,0,0|3,0,0]=4 4228 B15R1.1081 CC(C)CCCN(C)Cc1ccccc1 269982a_100000186898_100011214892 [0,1,0,0,0,0|3,0,0]=4 4229 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 11a_100000210545_200000086051 [0,1,0,0,0,0|2,0,0]=3 4230 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 240690a_100000210545_200000086051 [0,1,0,0,0,0|2,0,0]=3 4231 B15R1.1081 CC(C)CCNC(=O)C[n+]1ccccc1 527a_100000210545_200000086051 [0,1,0,0,0,0|2,0,0]=3 4232 B15R1.1081 CC(C)CCNC(=O)Cc1ccccn1 11a_100000210545_100000233486 [0,1,0,0,0,0|2,0,0]=3 4233 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 11a_100000210545_100000737805 [0,1,0,0,0,0|2,0,0]=3 4234 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 240690a_100000210545_100000737805 [0,1,0,0,0,0|2,0,0]=3 4235 B15R1.1081 CC(C)CCNC(=O)Cc1cccnc1 527a_100000210545_100000737805 [0,1,0,0,0,0|2,0,0]=3 4236 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 11a_100000210545_100011201483 [0,1,0,0,0,0|2,0,0]=3 4237 B15R1.1081 CC(C)CCNC(=O)Cc1ccncc1 240690a_100000210545_100011201483 [0,1,0,0,0,0|2,0,0]=3 4238 B15R1.1081 CC(C)CCNC(=O)Cc1cnccn1 11a_100000210545_100000726051 [0,1,0,0,0,0|3,0,0]=4 4239 B15R1.1081 CC(C)CCNC(=O)Cc1cnccn1 240690a_100000210545_100000726051 [0,1,0,0,0,0|3,0,0]=4 4240 B15R1.1081 CC(C)CCNC(=O)Cc1cnccn1 527a_100000210545_100000726051 [0,1,0,0,0,0|3,0,0]=4 4241 B15R1.1081 CC(C)CCNC(=O)Cc1cncnc1 11a_100000210545_100000721575 [0,1,0,0,0,0|3,0,0]=4 4242 B15R1.1081 CC(C)CCNC(=O)Cc1cncnc1 240690a_100000210545_100000721575 [0,1,0,0,0,0|3,0,0]=4 4243 B15R1.1081 CC(C)CCNC(=O)Cc1cncnc1 527a_100000210545_100000721575 [0,1,0,0,0,0|3,0,0]=4 4244 B15R1.1081 CC(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000210545 [0,1,0,0,0,0|2,0,0]=3 4245 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 34a_100000210254_200011218536 [0,1,0,0,0,0|1,0,1]=3 4246 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 34a_100000748627_100000210312 [0,1,0,0,0,0|1,0,1]=3 4247 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 7a_100000210254_200011218536 [0,1,0,0,0,0|1,0,1]=3 4248 B15R1.1081 CC(C)CCOC(C)Cc1ccccc1 7a_100000748627_100000210626 [0,1,0,0,0,0|1,0,1]=3 4249 B15R1.1081 CC(C)CCSC(C)Cc1ccccc1 62a_100000210312_200011218536 [0,1,0,0,0,0|1,1,1]=4 4250 B15R1.1081 CC(C)CCSC(C)Cc1ccccc1 62a_200011218536_100000210312 [0,1,0,0,0,0|1,1,1]=4 4251 B15R1.1081 CC(C)CNCC(=O)Cc1ccccc1 2230a_100000210953_100000233483 [0,1,0,0,0,0|2,0,0]=3 4252 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 2230a_100000210953_100000182850 [0,1,0,0,0,0|3,0,0]=4 4253 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 270004a_100000742222_100000210432 [0,1,0,0,0,0|3,0,0]=4 4254 B15R1.1081 CC(C)CNCC(=O)Nc1ccccc1 34a_100000210953_100000182850 [0,1,0,0,0,0|3,0,0]=4 4255 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 2230a_100000210953_100009813826 [0,1,0,0,0,0|3,0,0]=4 4256 B15R1.1081 CC(C)CNCC(=O)Oc1ccccc1 34a_100000210953_100009813826 [0,1,0,0,0,0|3,0,0]=4 4257 B15R1.1081 CC(C)CNNC(=O)C[n+]1ccccc1 22a_100000696102_200000086051 [0,1,0,0,0,0|3,0,0]=4 4258 B15R1.1081 CC(C)CNNC(=O)Cc1ccccn1 22a_100000696102_100000233486 [0,1,0,0,0,0|3,0,0]=4 4259 B15R1.1081 CC(C)CNNC(=O)Cc1cccnc1 22a_100000696102_100000737805 [0,1,0,0,0,0|3,0,0]=4 4260 B15R1.1081 CC(C)CNNC(=O)Cc1ccncc1 22a_100000696102_100011201483 [0,1,0,0,0,0|3,0,0]=4 4261 B15R1.1081 CC(C)COCC(=O)Cc1ccccc1 1458a_100011223364_100015291786 [0,1,0,0,0,0|2,0,0]=3 4262 B15R1.1081 CC(C)COCC(=O)Cc1ccccn1 1458a_100011223364_100000721315 [0,1,0,0,0,0|3,0,0]=4 4263 B15R1.1081 CC(C)COCC(=O)Cc1cccnc1 1458a_100011223364_100000733263 [0,1,0,0,0,0|3,0,0]=4 4264 B15R1.1081 CC(C)COCC(=O)Cc1ccncc1 1458a_100011223364_100000705612 [0,1,0,0,0,0|3,0,0]=4 4265 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 11a_100000106764_100011223364 [0,1,0,0,0,0|3,0,0]=4 4266 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 1626a_100000106764_100011223364 [0,1,0,0,0,0|3,0,0]=4 4267 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 22a_100000106764_100011223364 [0,1,0,0,0,0|3,0,0]=4 4268 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000210257_100000182850 [0,1,0,0,0,0|3,0,0]=4 4269 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 34a_100000246334_100000210624 [0,1,0,0,0,0|3,0,0]=4 4270 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 527a_100000106764_100011223364 [0,1,0,0,0,0|3,0,0]=4 4271 B15R1.1081 CC(C)COCC(=O)Oc1ccccc1 34a_100000210257_100009813826 [0,1,0,0,0,0|3,0,0]=4 4272 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000210624_100000233483 [0,1,0,0,0,0|2,0,0]=3 4273 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100000210760 [0,1,0,0,0,0|2,0,0]=3 4274 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100000210624_100000182850 [0,1,0,0,0,0|3,0,0]=4 4275 B15R1.1081 CC(C)CSCC(=O)Nc1ccccc1 62a_100012148978_100000210760 [0,1,0,0,0,0|3,0,0]=4 4276 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100000210624_100009813826 [0,1,0,0,0,0|3,0,0]=4 4277 B15R1.1081 CC(C)CSCC(=O)Oc1ccccc1 62a_100009813826_100000210760 [0,1,0,0,0,0|3,0,0]=4 4278 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 2230a_100138425928_100000242058 [0,1,0,0,0,0|3,0,0]=4 4279 B15R1.1081 CC(C)NCCC(=O)Nc1ccccc1 34a_100138425928_100000242058 [0,1,0,0,0,0|3,0,0]=4 4280 B15R1.1081 CC(C)NCCC(=O)Oc1ccccc1 2230a_100138425928_200000035796 [0,1,0,0,0,0|3,0,0]=4 4281 B15R1.1081 CC(C)OCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000211751 [0,1,0,0,0,0|3,0,0]=4 4282 B15R1.1081 CC(C)OCCC(=O)Cc1ccccn1 1458a_100000233486_100000211751 [0,1,0,0,0,0|3,0,0]=4 4283 B15R1.1081 CC(C)OCCC(=O)Cc1cccnc1 1458a_100000737805_100000211751 [0,1,0,0,0,0|3,0,0]=4 4284 B15R1.1081 CC(C)OCCC(=O)Nc1ccccc1 34a_100000212225_100000242058 [0,1,0,0,0,0|3,0,0]=4 4285 B15R1.1081 CC(C)OCOC(C)Cc1ccccc1 34a_100000748627_100000709892 [0,1,0,0,0,0|2,0,1]=4 4286 B15R1.1081 CC(C)SCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000730970 [0,1,0,0,0,0|3,0,0]=4 4287 B15R1.1081 CC(C)SCCC(=O)Cc1ccccn1 1458a_100000233486_100000730970 [0,1,0,0,0,0|3,0,0]=4 4288 B15R1.1081 CC(C)SCCC(=O)Cc1cccnc1 1458a_100000737805_100000730970 [0,1,0,0,0,0|3,0,0]=4 4289 B15R1.1081 CC(C)SCCC(=O)Nc1ccccc1 62a_100000210206_100000242058 [0,1,0,0,0,0|3,0,0]=4 4290 B15R1.1081 CC(C)SCCC(=O)Oc1ccccc1 62a_100000210206_200000035796 [0,1,0,0,0,0|3,0,0]=4 4291 B15R1.1081 CC(Cc1ccccc1)OCCC(F)F 34a_100103093639_200011218536 [0,1,0,0,0,0|2,0,1]=4 4292 B15R1.1081 CC(Cc1ccccc1)OCCN(C)C 7a_100000748627_100000755713 [0,1,0,0,0,0|2,0,1]=4 4293 B15R1.1081 CC(Cc1ccccc1)OCC[C@@H](C)N 34a_100000706166_200011218536 [0,1,0,0,0,0|1,0,1]=3 4294 B15R1.1081 CC(F)COCC(=O)Nc1ccccc1 34a_100015925927_100000182850 [0,1,0,0,0,0|3,0,0]=4 4295 B15R1.1081 CC(F)COCC(=O)Oc1ccccc1 34a_100015925927_100009813826 [0,1,0,0,0,0|3,0,0]=4 4296 B15R1.1081 CC(O)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_200000718107 [0,1,0,0,0,0|2,0,0]=3 4297 B15R1.1081 CC(O)CCCC(=O)Cc1ccccn1 1458a_100000233486_200000718107 [0,1,0,0,0,0|2,0,0]=3 4298 B15R1.1081 CC(O)CCCC(=O)Cc1cccnc1 1458a_100000737805_200000718107 [0,1,0,0,0,0|2,0,0]=3 4299 B15R1.1081 CC(O)CCCC(=O)Cc1cncnc1 1458a_100000721575_200000718107 [0,1,0,0,0,0|3,0,0]=4 4300 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 1626a_100000106764_100000761597 [0,1,0,0,0,0|2,0,0]=3 4301 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 22a_100000106764_100000761597 [0,1,0,0,0,0|2,0,0]=3 4302 B15R1.1081 CC(O)CCCC(=O)Nc1ccccc1 527a_100000106764_100000761597 [0,1,0,0,0,0|2,0,0]=3 4303 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 2230a_100000186898_200000718107 [0,1,0,0,0,0|3,0,0]=4 4304 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 269982a_100000186898_200000718107 [0,1,0,0,0,0|3,0,0]=4 4305 B15R1.1081 CC(O)CCNC(=O)C[n+]1ccccc1 240690a_200000755665_200000086051 [0,1,0,0,0,0|2,0,0]=3 4306 B15R1.1081 CC(O)CCNC(=O)C[n+]1ccccc1 527a_200000755665_200000086051 [0,1,0,0,0,0|2,0,0]=3 4307 B15R1.1081 CC(O)CCNC(=O)Cc1cccnc1 240690a_200000755665_100000737805 [0,1,0,0,0,0|2,0,0]=3 4308 B15R1.1081 CC(O)CCNC(=O)Cc1cccnc1 527a_200000755665_100000737805 [0,1,0,0,0,0|2,0,0]=3 4309 B15R1.1081 CC(O)CCNC(=O)Cc1ccncc1 240690a_200000755665_100011201483 [0,1,0,0,0,0|2,0,0]=3 4310 B15R1.1081 CC(O)CCNC(=O)Cc1cnccn1 240690a_200000755665_100000726051 [0,1,0,0,0,0|3,0,0]=4 4311 B15R1.1081 CC(O)CCNC(=O)Cc1cnccn1 527a_200000755665_100000726051 [0,1,0,0,0,0|3,0,0]=4 4312 B15R1.1081 CC(O)CCNC(=O)Cc1cncnc1 240690a_200000755665_100000721575 [0,1,0,0,0,0|3,0,0]=4 4313 B15R1.1081 CC(O)CCNC(=O)Cc1cncnc1 527a_200000755665_100000721575 [0,1,0,0,0,0|3,0,0]=4 4314 B15R1.1081 CC(O)CCNC(=O)Nc1ccccc1 2430a_100000106764_200000755665 [0,1,0,0,0,0|2,0,0]=3 4315 B15R1.1081 CC(O)CCOC(C)Cc1ccccc1 34a_100000748627_100012276601 [0,1,0,0,0,0|1,0,1]=3 4316 B15R1.1081 CC(O)CCOC(C)Cc1ccccc1 7a_100000748627_100012276601 [0,1,0,0,0,0|1,0,1]=3 4317 B15R1.1081 CC(O)CCSC(C)Cc1ccccc1 62a_100012276601_200011218536 [0,1,0,0,0,0|1,1,1]=4 4318 B15R1.1081 CC(O)CCSC(C)Cc1ccccc1 62a_200011218536_100012276601 [0,1,0,0,0,0|1,1,1]=4 4319 B15R1.1081 CC(O)CNCC(=O)Cc1ccccc1 2230a_100000210904_100000233483 [0,1,0,0,0,0|2,0,0]=3 4320 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 2230a_100000210904_100000182850 [0,1,0,0,0,0|3,0,0]=4 4321 B15R1.1081 CC(O)CNCC(=O)Nc1ccccc1 34a_100000210904_100000182850 [0,1,0,0,0,0|3,0,0]=4 4322 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 2230a_100000210904_100009813826 [0,1,0,0,0,0|3,0,0]=4 4323 B15R1.1081 CC(O)CNCC(=O)Oc1ccccc1 34a_100000210904_100009813826 [0,1,0,0,0,0|3,0,0]=4 4324 B15R1.1081 CC(O)CNNC(=O)C[n+]1ccccc1 22a_200000730056_200000086051 [0,1,0,0,0,0|3,0,0]=4 4325 B15R1.1081 CC(O)CNNC(=O)Cc1ccccn1 22a_200000730056_100000233486 [0,1,0,0,0,0|3,0,0]=4 4326 B15R1.1081 CC(O)CNNC(=O)Cc1cccnc1 22a_200000730056_100000737805 [0,1,0,0,0,0|3,0,0]=4 4327 B15R1.1081 CC(O)CNNC(=O)Cc1ccncc1 22a_200000730056_100011201483 [0,1,0,0,0,0|3,0,0]=4 4328 B15R1.1081 CC(O)COCC(=O)Nc1ccccc1 34a_100000246334_100011218427 [0,1,0,0,0,0|3,0,0]=4 4329 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100000233483_100011218427 [0,1,0,0,0,0|2,0,0]=3 4330 B15R1.1081 CC(O)CSCC(=O)Cc1ccccc1 62a_100011218427_100000233483 [0,1,0,0,0,0|2,0,0]=3 4331 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100011218427_100000182850 [0,1,0,0,0,0|3,0,0]=4 4332 B15R1.1081 CC(O)CSCC(=O)Nc1ccccc1 62a_100012148978_100011218427 [0,1,0,0,0,0|3,0,0]=4 4333 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100009813826_100011218427 [0,1,0,0,0,0|3,0,0]=4 4334 B15R1.1081 CC(O)CSCC(=O)Oc1ccccc1 62a_100011218427_100009813826 [0,1,0,0,0,0|3,0,0]=4 4335 B15R1.1081 CN(C)CC=CC(=O)Cc1ccccc1 1458a_100000754359_100015291786 [0,1,0,0,0,0|2,0,1]=4 4336 B15R1.1081 CN(C)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000695564 [0,1,0,0,0,0|3,0,0]=4 4337 B15R1.1081 CN(C)CCCC(=O)Cc1ccccn1 1458a_100000233486_100000695564 [0,1,0,0,0,0|3,0,0]=4 4338 B15R1.1081 CN(C)CCCC(=O)Cc1cccnc1 1458a_100000737805_100000695564 [0,1,0,0,0,0|3,0,0]=4 4339 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 11a_100000106764_100000740757 [0,1,0,0,0,0|3,0,0]=4 4340 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 2230a_100102631434_100011194425 [0,1,0,0,0,0|3,0,0]=4 4341 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 22a_100000106764_100000740757 [0,1,0,0,0,0|3,0,0]=4 4342 B15R1.1081 CN(C)CCCC(=O)Nc1ccccc1 269982a_100102631434_100011194425 [0,1,0,0,0,0|3,0,0]=4 4343 B15R1.1081 CN(C)CCNC(=O)C[n+]1ccccc1 240690a_100000210585_200000086051 [0,1,0,0,0,0|3,0,0]=4 4344 B15R1.1081 CN(C)CCNC(=O)C[n+]1ccccc1 527a_100000210585_200000086051 [0,1,0,0,0,0|3,0,0]=4 4345 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 240690a_100000210585_100000737805 [0,1,0,0,0,0|3,0,0]=4 4346 B15R1.1081 CN(C)CCNC(=O)Cc1cccnc1 527a_100000210585_100000737805 [0,1,0,0,0,0|3,0,0]=4 4347 B15R1.1081 CN(C)CCNC(=O)Cc1ccncc1 240690a_100000210585_100011201483 [0,1,0,0,0,0|3,0,0]=4 4348 B15R1.1081 CN(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000210585 [0,1,0,0,0,0|3,0,0]=4 4349 B15R1.1081 C[C@@H](Cl)COCC(=O)Nc1ccccc1 34a_100016084084_100000182850 [0,1,0,0,0,0|3,0,0]=4 4350 B15R1.1081 C[C@@H](Cl)COCC(=O)Oc1ccccc1 34a_100016084084_100009813826 [0,1,0,0,0,0|3,0,0]=4 4351 B15R1.1081 C[C@@H](N)COCC(=O)Nc1ccccc1 34a_100000737577_100000182850 [0,1,0,0,0,0|3,0,0]=4 4352 B15R1.1081 C[C@@H](N)COCC(=O)Oc1ccccc1 34a_100000737577_100009813826 [0,1,0,0,0,0|3,0,0]=4 4353 B15R1.1081 C[C@@H](O)COCC(=O)Nc1ccccc1 34a_100000246334_100009817552 [0,1,0,0,0,0|3,0,0]=4 4354 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100000233483_100009817552 [0,1,0,0,0,0|2,0,0]=3 4355 B15R1.1081 C[C@@H](O)CSCC(=O)Cc1ccccc1 62a_100009817552_100000233483 [0,1,0,0,0,0|2,0,0]=3 4356 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100009817552_100000182850 [0,1,0,0,0,0|3,0,0]=4 4357 B15R1.1081 C[C@@H](O)CSCC(=O)Nc1ccccc1 62a_100012148978_100009817552 [0,1,0,0,0,0|3,0,0]=4 4358 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009813826_100009817552 [0,1,0,0,0,0|3,0,0]=4 4359 B15R1.1081 C[C@@H](O)CSCC(=O)Oc1ccccc1 62a_100009817552_100009813826 [0,1,0,0,0,0|3,0,0]=4 4360 B15R1.1081 O=C(CCC[N+](=O)[O-])Cc1ccccc1 1458a_100016109205_100015291786 [0,1,0,0,0,0|3,0,0]=4 4361 B15R1.1081 O=C(CSCC(F)F)Cc1ccccc1 62a_100000233483_100011934356 [0,1,0,0,0,0|3,0,0]=4 4362 B15R1.1081 O=C(CSCC(F)F)Cc1ccccc1 62a_100011934356_100000233483 [0,1,0,0,0,0|3,0,0]=4 4363 B15R1.1081 [13CH3]C(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200025704644 [0,1,0,0,0,0|2,0,1]=4 4364 B15R1.1409 C#CCCCC(=O)Cc1ccccc1Br 1458a_100000690238_100000184730 [0,1,0,0,0,0|1,0,2]=4 4365 B15R1.1409 C#CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000731252 [0,1,0,0,0,0|1,0,2]=4 4366 B15R1.1409 C#CCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000731252 [0,1,0,0,0,0|1,0,2]=4 4367 B15R1.1409 C#CCCCC(=O)Cc1ccccc1C 1458a_100000690238_100000211839 [0,1,0,0,0,0|1,0,2]=4 4368 B15R1.1409 C#CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000731252 [0,1,0,0,0,0|1,0,2]=4 4369 B15R1.1409 C#CCCCC(=O)Cc1ccccc1Cl 1458a_100000690238_100000187162 [0,1,0,0,0,0|1,0,2]=4 4370 B15R1.1409 C#CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000731252 [0,1,0,0,0,0|1,0,2]=4 4371 B15R1.1409 C#CCCCC(=O)Cc1ccccc1F 1458a_100000690238_100000187165 [0,1,0,0,0,0|1,0,2]=4 4372 B15R1.1409 C#CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000731252 [0,1,0,0,0,0|1,0,2]=4 4373 B15R1.1409 C#CCCCC(=O)Cc1ccccc1I 1458a_100000690238_100011216222 [0,1,0,0,0,0|1,0,2]=4 4374 B15R1.1409 C#CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000731252 [0,1,0,0,0,0|1,0,2]=4 4375 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Br 11a_100000755551_100000751119 [0,1,0,0,0,0|1,0,2]=4 4376 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Br 240690a_100000755551_100000751119 [0,1,0,0,0,0|1,0,2]=4 4377 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Br 527a_100000755551_100000751119 [0,1,0,0,0,0|1,0,2]=4 4378 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C 11a_100000755551_100000212180 [0,1,0,0,0,0|1,0,2]=4 4379 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C 1626a_100000755551_100000212180 [0,1,0,0,0,0|1,0,2]=4 4380 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C 240690a_100000755551_100000212180 [0,1,0,0,0,0|1,0,2]=4 4381 B15R1.1409 C#CCCNC(=O)Cc1ccccc1C 527a_100000755551_100000212180 [0,1,0,0,0,0|1,0,2]=4 4382 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl 11a_100000755551_100000183793 [0,1,0,0,0,0|1,0,2]=4 4383 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl 1626a_100000755551_100000183793 [0,1,0,0,0,0|1,0,2]=4 4384 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl 240690a_100000755551_100000183793 [0,1,0,0,0,0|1,0,2]=4 4385 B15R1.1409 C#CCCNC(=O)Cc1ccccc1Cl 527a_100000755551_100000183793 [0,1,0,0,0,0|1,0,2]=4 4386 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F 11a_100000755551_100000212012 [0,1,0,0,0,0|1,0,2]=4 4387 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F 1626a_100000755551_100000212012 [0,1,0,0,0,0|1,0,2]=4 4388 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F 240690a_100000755551_100000212012 [0,1,0,0,0,0|1,0,2]=4 4389 B15R1.1409 C#CCCNC(=O)Cc1ccccc1F 527a_100000755551_100000212012 [0,1,0,0,0,0|1,0,2]=4 4390 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I 11a_100000755551_100000036491 [0,1,0,0,0,0|1,0,2]=4 4391 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I 1626a_100000755551_100000036491 [0,1,0,0,0,0|1,0,2]=4 4392 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I 240690a_100000755551_100000036491 [0,1,0,0,0,0|1,0,2]=4 4393 B15R1.1409 C#CCCNC(=O)Cc1ccccc1I 527a_100000755551_100000036491 [0,1,0,0,0,0|1,0,2]=4 4394 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O 240690a_100000755551_100000743006 [0,1,0,0,0,0|1,0,2]=4 4395 B15R1.1409 C#CCCNC(=O)Cc1ccccc1O 527a_100000755551_100000743006 [0,1,0,0,0,0|1,0,2]=4 4396 B15R1.1409 C=CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000757094 [0,1,0,0,0,0|1,0,2]=4 4397 B15R1.1409 C=CCCCC(=O)Cc1ccccc1Br 1458a_100000766728_100000184730 [0,1,0,0,0,0|1,0,2]=4 4398 B15R1.1409 C=CCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000757094 [0,1,0,0,0,0|1,0,2]=4 4399 B15R1.1409 C=CCCCC(=O)Cc1ccccc1C 1458a_100000766728_100000211839 [0,1,0,0,0,0|1,0,2]=4 4400 B15R1.1409 C=CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000757094 [0,1,0,0,0,0|1,0,2]=4 4401 B15R1.1409 C=CCCCC(=O)Cc1ccccc1Cl 1458a_100000766728_100000187162 [0,1,0,0,0,0|1,0,2]=4 4402 B15R1.1409 C=CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000757094 [0,1,0,0,0,0|1,0,2]=4 4403 B15R1.1409 C=CCCCC(=O)Cc1ccccc1F 1458a_100000766728_100000187165 [0,1,0,0,0,0|1,0,2]=4 4404 B15R1.1409 C=CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000757094 [0,1,0,0,0,0|1,0,2]=4 4405 B15R1.1409 C=CCCCC(=O)Cc1ccccc1I 1458a_100000766728_100011216222 [0,1,0,0,0,0|1,0,2]=4 4406 B15R1.1409 C=CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000757094 [0,1,0,0,0,0|1,0,2]=4 4407 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Br 11a_100015191253_100000751119 [0,1,0,0,0,0|1,0,2]=4 4408 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Br 240690a_100015191253_100000751119 [0,1,0,0,0,0|1,0,2]=4 4409 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Br 527a_100015191253_100000751119 [0,1,0,0,0,0|1,0,2]=4 4410 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C 11a_100015191253_100000212180 [0,1,0,0,0,0|1,0,2]=4 4411 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C 1626a_100015191253_100000212180 [0,1,0,0,0,0|1,0,2]=4 4412 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C 240690a_100015191253_100000212180 [0,1,0,0,0,0|1,0,2]=4 4413 B15R1.1409 C=CCCNC(=O)Cc1ccccc1C 527a_100015191253_100000212180 [0,1,0,0,0,0|1,0,2]=4 4414 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl 11a_100015191253_100000183793 [0,1,0,0,0,0|1,0,2]=4 4415 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl 1626a_100015191253_100000183793 [0,1,0,0,0,0|1,0,2]=4 4416 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl 240690a_100015191253_100000183793 [0,1,0,0,0,0|1,0,2]=4 4417 B15R1.1409 C=CCCNC(=O)Cc1ccccc1Cl 527a_100015191253_100000183793 [0,1,0,0,0,0|1,0,2]=4 4418 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F 11a_100015191253_100000212012 [0,1,0,0,0,0|1,0,2]=4 4419 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F 1626a_100015191253_100000212012 [0,1,0,0,0,0|1,0,2]=4 4420 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F 240690a_100015191253_100000212012 [0,1,0,0,0,0|1,0,2]=4 4421 B15R1.1409 C=CCCNC(=O)Cc1ccccc1F 527a_100015191253_100000212012 [0,1,0,0,0,0|1,0,2]=4 4422 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I 11a_100015191253_100000036491 [0,1,0,0,0,0|1,0,2]=4 4423 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I 1626a_100015191253_100000036491 [0,1,0,0,0,0|1,0,2]=4 4424 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I 240690a_100015191253_100000036491 [0,1,0,0,0,0|1,0,2]=4 4425 B15R1.1409 C=CCCNC(=O)Cc1ccccc1I 527a_100015191253_100000036491 [0,1,0,0,0,0|1,0,2]=4 4426 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O 240690a_100015191253_100000743006 [0,1,0,0,0,0|1,0,2]=4 4427 B15R1.1409 C=CCCNC(=O)Cc1ccccc1O 527a_100015191253_100000743006 [0,1,0,0,0,0|1,0,2]=4 4428 B15R1.1409 CC#CCNC(=O)Cc1ccccc1Br 11a_100000685387_100000751119 [0,1,0,0,0,0|1,0,2]=4 4429 B15R1.1409 CC#CCNC(=O)Cc1ccccc1Br 527a_100000685387_100000751119 [0,1,0,0,0,0|1,0,2]=4 4430 B15R1.1409 CC#CCNC(=O)Cc1ccccc1C 11a_100000685387_100000212180 [0,1,0,0,0,0|1,0,2]=4 4431 B15R1.1409 CC#CCNC(=O)Cc1ccccc1C 1626a_100000685387_100000212180 [0,1,0,0,0,0|1,0,2]=4 4432 B15R1.1409 CC#CCNC(=O)Cc1ccccc1C 527a_100000685387_100000212180 [0,1,0,0,0,0|1,0,2]=4 4433 B15R1.1409 CC#CCNC(=O)Cc1ccccc1Cl 11a_100000685387_100000183793 [0,1,0,0,0,0|1,0,2]=4 4434 B15R1.1409 CC#CCNC(=O)Cc1ccccc1Cl 1626a_100000685387_100000183793 [0,1,0,0,0,0|1,0,2]=4 4435 B15R1.1409 CC#CCNC(=O)Cc1ccccc1Cl 527a_100000685387_100000183793 [0,1,0,0,0,0|1,0,2]=4 4436 B15R1.1409 CC#CCNC(=O)Cc1ccccc1F 11a_100000685387_100000212012 [0,1,0,0,0,0|1,0,2]=4 4437 B15R1.1409 CC#CCNC(=O)Cc1ccccc1F 1626a_100000685387_100000212012 [0,1,0,0,0,0|1,0,2]=4 4438 B15R1.1409 CC#CCNC(=O)Cc1ccccc1F 527a_100000685387_100000212012 [0,1,0,0,0,0|1,0,2]=4 4439 B15R1.1409 CC#CCNC(=O)Cc1ccccc1I 11a_100000685387_100000036491 [0,1,0,0,0,0|1,0,2]=4 4440 B15R1.1409 CC#CCNC(=O)Cc1ccccc1I 1626a_100000685387_100000036491 [0,1,0,0,0,0|1,0,2]=4 4441 B15R1.1409 CC#CCNC(=O)Cc1ccccc1I 527a_100000685387_100000036491 [0,1,0,0,0,0|1,0,2]=4 4442 B15R1.1409 CC#CCNC(=O)Cc1ccccc1O 527a_100000685387_100000743006 [0,1,0,0,0,0|1,0,2]=4 4443 B15R1.1409 CC/C=C/CC(=O)Cc1ccccc1Br 1458a_100016274230_100000184730 [0,1,0,0,0,0|1,0,2]=4 4444 B15R1.1409 CC/C=C/CC(=O)Cc1ccccc1C 1458a_100016274230_100000211839 [0,1,0,0,0,0|1,0,2]=4 4445 B15R1.1409 CC/C=C/CC(=O)Cc1ccccc1Cl 1458a_100016274230_100000187162 [0,1,0,0,0,0|1,0,2]=4 4446 B15R1.1409 CC/C=C/CC(=O)Cc1ccccc1F 1458a_100016274230_100000187165 [0,1,0,0,0,0|1,0,2]=4 4447 B15R1.1409 CC/C=C/CC(=O)Cc1ccccc1I 1458a_100016274230_100011216222 [0,1,0,0,0,0|1,0,2]=4 4448 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1Br 1458a_100000751119_100103147603 [0,1,0,0,0,0|1,0,2]=4 4449 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1C 1458a_100000212180_100103147603 [0,1,0,0,0,0|1,0,2]=4 4450 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1Cl 1458a_100000183793_100103147603 [0,1,0,0,0,0|1,0,2]=4 4451 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1F 1458a_100000212012_100103147603 [0,1,0,0,0,0|1,0,2]=4 4452 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1I 1458a_100000036491_100103147603 [0,1,0,0,0,0|1,0,2]=4 4453 B15R1.1409 CC/C=C\CC(=O)Cc1ccccc1O 1458a_100000743006_100103147603 [0,1,0,0,0,0|1,0,2]=4 4454 B15R1.1409 CCC#CCC(=O)Cc1ccccc1Br 1458a_100000751119_100009813939 [0,1,0,0,0,0|1,0,2]=4 4455 B15R1.1409 CCC#CCC(=O)Cc1ccccc1C 1458a_100000212180_100009813939 [0,1,0,0,0,0|1,0,2]=4 4456 B15R1.1409 CCC#CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100009813939 [0,1,0,0,0,0|1,0,2]=4 4457 B15R1.1409 CCC#CCC(=O)Cc1ccccc1F 1458a_100000212012_100009813939 [0,1,0,0,0,0|1,0,2]=4 4458 B15R1.1409 CCC#CCC(=O)Cc1ccccc1I 1458a_100000036491_100009813939 [0,1,0,0,0,0|1,0,2]=4 4459 B15R1.1409 CCC#CCC(=O)Cc1ccccc1O 1458a_100000743006_100009813939 [0,1,0,0,0,0|1,0,2]=4 4460 B15R1.1409 CCC=NNC(=O)Cc1ccccc1Br 4a_200010210069_100000210100 [0,1,0,0,0,0|2,0,1]=4 4461 B15R1.1409 CCC=NNC(=O)Cc1ccccc1Cl 4a_100000189918_100000210100 [0,1,0,0,0,0|2,0,1]=4 4462 B15R1.1409 CCC=NNC(=O)Cc1ccccc1F 4a_100000190036_100000210100 [0,1,0,0,0,0|2,0,1]=4 4463 B15R1.1409 CCCC#CC(=O)Cc1ccccc1Br 1458a_200011218047_100000184730 [0,1,0,0,0,0|1,0,1]=3 4464 B15R1.1409 CCCC#CC(=O)Cc1ccccc1C 1458a_200011218047_100000211839 [0,1,0,0,0,0|1,0,1]=3 4465 B15R1.1409 CCCC#CC(=O)Cc1ccccc1Cl 1458a_200011218047_100000187162 [0,1,0,0,0,0|1,0,1]=3 4466 B15R1.1409 CCCC#CC(=O)Cc1ccccc1F 1458a_200011218047_100000187165 [0,1,0,0,0,0|1,0,1]=3 4467 B15R1.1409 CCCC#CC(=O)Cc1ccccc1I 1458a_200011218047_100011216222 [0,1,0,0,0,0|1,0,1]=3 4468 B15R1.1409 CCCC#CC(=O)Cc1cccnc1Br 1458a_200011218047_100010140945 [0,1,0,0,0,0|2,0,1]=4 4469 B15R1.1409 CCCC#CC(=O)Cc1cccnc1C 1458a_200011218047_100000732876 [0,1,0,0,0,0|2,0,1]=4 4470 B15R1.1409 CCCC#CC(=O)Cc1cccnc1Cl 1458a_200011218047_100000045678 [0,1,0,0,0,0|2,0,1]=4 4471 B15R1.1409 CCCC#CC(=O)Cc1cccnc1F 1458a_200011218047_100000099810 [0,1,0,0,0,0|2,0,1]=4 4472 B15R1.1409 CCCC#CC(=O)Cc1ccncc1C 1458a_200011218047_100020672808 [0,1,0,0,0,0|2,0,1]=4 4473 B15R1.1409 CCCC#CC(=O)Cc1ccncc1Cl 1458a_200011218047_100000763264 [0,1,0,0,0,0|2,0,1]=4 4474 B15R1.1409 CCCC#CC(=O)Cc1cnccc1C 1458a_200011218047_100000690890 [0,1,0,0,0,0|2,0,1]=4 4475 B15R1.1409 CCCC#CC(=O)Cc1ncccc1Br 1458a_200011218047_100025702911 [0,1,0,0,0,0|2,0,1]=4 4476 B15R1.1409 CCCC#CC(=O)Cc1ncccc1C 1458a_200011218047_100000696600 [0,1,0,0,0,0|2,0,1]=4 4477 B15R1.1409 CCCC#CC(=O)Cc1ncccc1Cl 1458a_200011218047_100000099807 [0,1,0,0,0,0|2,0,1]=4 4478 B15R1.1409 CCCC#CC(=O)Cc1ncccc1F 1458a_200011218047_100000104219 [0,1,0,0,0,0|2,0,1]=4 4479 B15R1.1409 CCCC#CC(=O)Cc1ncccc1O 1458a_200011218047_200020655725 [0,1,0,0,0,0|2,0,1]=4 4480 B15R1.1409 CCCC#CC(=O)Nc1ccccc1C 22a_100015192222_200011218047 [0,1,0,0,0,0|2,0,1]=4 4481 B15R1.1409 CCCC#CC(=O)Nc1ccccc1Cl 22a_100000185783_200011218047 [0,1,0,0,0,0|2,0,1]=4 4482 B15R1.1409 CCCC#CC(=O)Nc1ccccc1F 22a_100000210422_200011218047 [0,1,0,0,0,0|2,0,1]=4 4483 B15R1.1409 CCCC#CC(=O)Nc1ccccc1O 22a_100000185747_200011218047 [0,1,0,0,0,0|2,0,1]=4 4484 B15R1.1409 CCCC=CC(=O)Cc1ccccc1Br 1458a_100000212230_100000184730 [0,1,0,0,0,0|1,0,1]=3 4485 B15R1.1409 CCCC=CC(=O)Cc1ccccc1C 1458a_100000212230_100000211839 [0,1,0,0,0,0|1,0,1]=3 4486 B15R1.1409 CCCC=CC(=O)Cc1ccccc1Cl 1458a_100000212230_100000187162 [0,1,0,0,0,0|1,0,1]=3 4487 B15R1.1409 CCCC=CC(=O)Cc1ccccc1F 1458a_100000212230_100000187165 [0,1,0,0,0,0|1,0,1]=3 4488 B15R1.1409 CCCC=CC(=O)Cc1ccccc1I 1458a_100000212230_100011216222 [0,1,0,0,0,0|1,0,1]=3 4489 B15R1.1409 CCCC=CC(=O)Cc1cccnc1Br 1458a_100000212230_100010140945 [0,1,0,0,0,0|2,0,1]=4 4490 B15R1.1409 CCCC=CC(=O)Cc1cccnc1C 1458a_100000212230_100000732876 [0,1,0,0,0,0|2,0,1]=4 4491 B15R1.1409 CCCC=CC(=O)Cc1cccnc1Cl 1458a_100000212230_100000045678 [0,1,0,0,0,0|2,0,1]=4 4492 B15R1.1409 CCCC=CC(=O)Cc1cccnc1F 1458a_100000212230_100000099810 [0,1,0,0,0,0|2,0,1]=4 4493 B15R1.1409 CCCC=CC(=O)Cc1ccncc1C 1458a_100000212230_100020672808 [0,1,0,0,0,0|2,0,1]=4 4494 B15R1.1409 CCCC=CC(=O)Cc1ccncc1Cl 1458a_100000212230_100000763264 [0,1,0,0,0,0|2,0,1]=4 4495 B15R1.1409 CCCC=CC(=O)Cc1cnccc1C 1458a_100000212230_100000690890 [0,1,0,0,0,0|2,0,1]=4 4496 B15R1.1409 CCCC=CC(=O)Cc1ncccc1Br 1458a_100000212230_100025702911 [0,1,0,0,0,0|2,0,1]=4 4497 B15R1.1409 CCCC=CC(=O)Cc1ncccc1C 1458a_100000212230_100000696600 [0,1,0,0,0,0|2,0,1]=4 4498 B15R1.1409 CCCC=CC(=O)Cc1ncccc1Cl 1458a_100000212230_100000099807 [0,1,0,0,0,0|2,0,1]=4 4499 B15R1.1409 CCCC=CC(=O)Cc1ncccc1F 1458a_100000212230_100000104219 [0,1,0,0,0,0|2,0,1]=4 4500 B15R1.1409 CCCC=CC(=O)Cc1ncccc1O 1458a_100000212230_200020655725 [0,1,0,0,0,0|2,0,1]=4 4501 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Br 11a_100000210017_100000212230 [0,1,0,0,0,0|2,0,1]=4 4502 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000212230 [0,1,0,0,0,0|2,0,1]=4 4503 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 11a_100015192222_100000212230 [0,1,0,0,0,0|2,0,1]=4 4504 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 1626a_100015192222_100000212230 [0,1,0,0,0,0|2,0,1]=4 4505 B15R1.1409 CCCC=CC(=O)Nc1ccccc1C 22a_100015192222_100000212230 [0,1,0,0,0,0|2,0,1]=4 4506 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100000212230 [0,1,0,0,0,0|2,0,1]=4 4507 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212230 [0,1,0,0,0,0|2,0,1]=4 4508 B15R1.1409 CCCC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000212230 [0,1,0,0,0,0|2,0,1]=4 4509 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 11a_100000210422_100000212230 [0,1,0,0,0,0|2,0,1]=4 4510 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 1626a_100000210422_100000212230 [0,1,0,0,0,0|2,0,1]=4 4511 B15R1.1409 CCCC=CC(=O)Nc1ccccc1F 22a_100000210422_100000212230 [0,1,0,0,0,0|2,0,1]=4 4512 B15R1.1409 CCCC=CC(=O)Nc1ccccc1I 11a_100000210053_100000212230 [0,1,0,0,0,0|2,0,1]=4 4513 B15R1.1409 CCCC=CC(=O)Nc1ccccc1I 1626a_100000210053_100000212230 [0,1,0,0,0,0|2,0,1]=4 4514 B15R1.1409 CCCC=CC(=O)Nc1ccccc1O 22a_100000185747_100000212230 [0,1,0,0,0,0|2,0,1]=4 4515 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000212188_100000184730 [0,1,0,0,0,0|1,0,0]=2 4516 B15R1.1409 CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210326 [0,1,0,0,0,0|1,0,0]=2 4517 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210326 [0,1,0,0,0,0|1,0,0]=2 4518 B15R1.1409 CCCCCC(=O)Cc1ccccc1C 1458a_100000212188_100000211839 [0,1,0,0,0,0|1,0,0]=2 4519 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210326 [0,1,0,0,0,0|1,0,0]=2 4520 B15R1.1409 CCCCCC(=O)Cc1ccccc1Cl 1458a_100000212188_100000187162 [0,1,0,0,0,0|1,0,0]=2 4521 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210326 [0,1,0,0,0,0|1,0,0]=2 4522 B15R1.1409 CCCCCC(=O)Cc1ccccc1F 1458a_100000212188_100000187165 [0,1,0,0,0,0|1,0,0]=2 4523 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210326 [0,1,0,0,0,0|1,0,0]=2 4524 B15R1.1409 CCCCCC(=O)Cc1ccccc1I 1458a_100000212188_100011216222 [0,1,0,0,0,0|1,0,0]=2 4525 B15R1.1409 CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210326 [0,1,0,0,0,0|1,0,0]=2 4526 B15R1.1409 CCCCCC(=O)Cc1cccnc1Br 1458a_100000212188_100010140945 [0,1,0,0,0,0|2,0,0]=3 4527 B15R1.1409 CCCCCC(=O)Cc1cccnc1C 1458a_100000212188_100000732876 [0,1,0,0,0,0|2,0,0]=3 4528 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210326 [0,1,0,0,0,0|2,0,0]=3 4529 B15R1.1409 CCCCCC(=O)Cc1cccnc1Cl 1458a_100000212188_100000045678 [0,1,0,0,0,0|2,0,0]=3 4530 B15R1.1409 CCCCCC(=O)Cc1cccnc1F 1458a_100000212188_100000099810 [0,1,0,0,0,0|2,0,0]=3 4531 B15R1.1409 CCCCCC(=O)Cc1ccncc1C 1458a_100000212188_100020672808 [0,1,0,0,0,0|2,0,0]=3 4532 B15R1.1409 CCCCCC(=O)Cc1ccncc1Cl 1458a_100000212188_100000763264 [0,1,0,0,0,0|2,0,0]=3 4533 B15R1.1409 CCCCCC(=O)Cc1cnccc1C 1458a_100000212188_100000690890 [0,1,0,0,0,0|2,0,0]=3 4534 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_100000212188_100025702911 [0,1,0,0,0,0|2,0,0]=3 4535 B15R1.1409 CCCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210326 [0,1,0,0,0,0|2,0,0]=3 4536 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_100000212188_100000696600 [0,1,0,0,0,0|2,0,0]=3 4537 B15R1.1409 CCCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210326 [0,1,0,0,0,0|2,0,0]=3 4538 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100000212188_100000099807 [0,1,0,0,0,0|2,0,0]=3 4539 B15R1.1409 CCCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210326 [0,1,0,0,0,0|2,0,0]=3 4540 B15R1.1409 CCCCCC(=O)Cc1ncccc1F 1458a_100000212188_100000104219 [0,1,0,0,0,0|2,0,0]=3 4541 B15R1.1409 CCCCCC(=O)Cc1ncccc1O 1458a_100000212188_200020655725 [0,1,0,0,0,0|2,0,0]=3 4542 B15R1.1409 CCCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210326 [0,1,0,0,0,0|2,0,0]=3 4543 B15R1.1409 CCCCCC(=O)Cn1cccnc1=O 1458a_100000738077_100000210326 [0,1,0,0,0,0|3,0,0]=4 4544 B15R1.1409 CCCCCC(=O)Cn1ncccc1=O 1458a_100000238584_100000210326 [0,1,0,0,0,0|3,0,0]=4 4545 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000212188 [0,1,0,0,0,0|2,0,0]=3 4546 B15R1.1409 CCCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000212188 [0,1,0,0,0,0|2,0,0]=3 4547 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 11a_100015192222_100000212188 [0,1,0,0,0,0|2,0,0]=3 4548 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000212188 [0,1,0,0,0,0|2,0,0]=3 4549 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 22a_100015192222_100000212188 [0,1,0,0,0,0|2,0,0]=3 4550 B15R1.1409 CCCCCC(=O)Nc1ccccc1C 527a_100015192222_100000212188 [0,1,0,0,0,0|2,0,0]=3 4551 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000212188 [0,1,0,0,0,0|2,0,0]=3 4552 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000212188 [0,1,0,0,0,0|2,0,0]=3 4553 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000212188 [0,1,0,0,0,0|2,0,0]=3 4554 B15R1.1409 CCCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000212188 [0,1,0,0,0,0|2,0,0]=3 4555 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 11a_100000210422_100000212188 [0,1,0,0,0,0|2,0,0]=3 4556 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000212188 [0,1,0,0,0,0|2,0,0]=3 4557 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 22a_100000210422_100000212188 [0,1,0,0,0,0|2,0,0]=3 4558 B15R1.1409 CCCCCC(=O)Nc1ccccc1F 527a_100000210422_100000212188 [0,1,0,0,0,0|2,0,0]=3 4559 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 11a_100000210053_100000212188 [0,1,0,0,0,0|2,0,0]=3 4560 B15R1.1409 CCCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000212188 [0,1,0,0,0,0|2,0,0]=3 4561 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 22a_100000185747_100000212188 [0,1,0,0,0,0|2,0,0]=3 4562 B15R1.1409 CCCCCC(=O)Nc1ccccc1O 527a_100000185747_100000212188 [0,1,0,0,0,0|2,0,0]=3 4563 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 2230a_100000184654_100000210326 [0,1,0,0,0,0|3,0,0]=4 4564 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 2230a_100000223495_100000184730 [0,1,0,0,0,0|3,0,0]=4 4565 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 269982a_100000184654_100000210215 [0,1,0,0,0,0|3,0,0]=4 4566 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 269982a_100000223495_100000184730 [0,1,0,0,0,0|3,0,0]=4 4567 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 26a_100000223495_100000181306 [0,1,0,0,0,0|3,0,0]=4 4568 B15R1.1409 CCCCCN(C)Cc1ccccc1Br 270004a_100000223495_100000211189 [0,1,0,0,0,0|3,0,0]=4 4569 B15R1.1409 CCCCCN(C)Cc1ccccc1C 2230a_100000184421_100000210326 [0,1,0,0,0,0|3,0,0]=4 4570 B15R1.1409 CCCCCN(C)Cc1ccccc1C 2230a_100000223495_100000211839 [0,1,0,0,0,0|3,0,0]=4 4571 B15R1.1409 CCCCCN(C)Cc1ccccc1C 269982a_100000184421_100000210215 [0,1,0,0,0,0|3,0,0]=4 4572 B15R1.1409 CCCCCN(C)Cc1ccccc1C 269982a_100000223495_100000211839 [0,1,0,0,0,0|3,0,0]=4 4573 B15R1.1409 CCCCCN(C)Cc1ccccc1C 270004a_100000223495_100000211143 [0,1,0,0,0,0|3,0,0]=4 4574 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210326 [0,1,0,0,0,0|3,0,0]=4 4575 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 2230a_100000223495_100000187162 [0,1,0,0,0,0|3,0,0]=4 4576 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 269982a_100000184507_100000210215 [0,1,0,0,0,0|3,0,0]=4 4577 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 269982a_100000223495_100000187162 [0,1,0,0,0,0|3,0,0]=4 4578 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 26a_100000223495_100000210172 [0,1,0,0,0,0|3,0,0]=4 4579 B15R1.1409 CCCCCN(C)Cc1ccccc1Cl 270004a_100000223495_100000210073 [0,1,0,0,0,0|3,0,0]=4 4580 B15R1.1409 CCCCCN(C)Cc1ccccc1F 2230a_100000223495_100000211605 [0,1,0,0,0,0|3,0,0]=4 4581 B15R1.1409 CCCCCN(C)Cc1ccccc1F 2230a_100000742528_100000210326 [0,1,0,0,0,0|3,0,0]=4 4582 B15R1.1409 CCCCCN(C)Cc1ccccc1F 269982a_100000223495_100000211605 [0,1,0,0,0,0|3,0,0]=4 4583 B15R1.1409 CCCCCN(C)Cc1ccccc1F 269982a_100000742528_100000210215 [0,1,0,0,0,0|3,0,0]=4 4584 B15R1.1409 CCCCCN(C)Cc1ccccc1F 270004a_100000223495_100000210811 [0,1,0,0,0,0|3,0,0]=4 4585 B15R1.1409 CCCCCN(C)Cc1ccccc1F 34a_100000742528_100000718602 [0,1,0,0,0,0|3,0,0]=4 4586 B15R1.1409 CCCCCN(C)Cc1ccccc1I 2230a_100000223495_100011215278 [0,1,0,0,0,0|3,0,0]=4 4587 B15R1.1409 CCCCCN(C)Cc1ccccc1I 269982a_100000223495_100011215278 [0,1,0,0,0,0|3,0,0]=4 4588 B15R1.1409 CCCCCN(C)Cc1ccccc1I 270004a_100000223495_100000010305 [0,1,0,0,0,0|3,0,0]=4 4589 B15R1.1409 CCCCCN(C)Cc1ccccc1O 2230a_100015189988_100000210326 [0,1,0,0,0,0|3,0,0]=4 4590 B15R1.1409 CCCCCN(C)Cc1ccccc1O 269982a_100015189988_100000210215 [0,1,0,0,0,0|3,0,0]=4 4591 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 11a_100000102301_100000751119 [0,1,0,0,0,0|1,0,0]=2 4592 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 240690a_100000102301_100000751119 [0,1,0,0,0,0|1,0,0]=2 4593 B15R1.1409 CCCCNC(=O)Cc1ccccc1Br 527a_100000102301_100000751119 [0,1,0,0,0,0|1,0,0]=2 4594 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 11a_100000102301_100000212180 [0,1,0,0,0,0|1,0,0]=2 4595 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 1626a_100000102301_100000212180 [0,1,0,0,0,0|1,0,0]=2 4596 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 240690a_100000102301_100000212180 [0,1,0,0,0,0|1,0,0]=2 4597 B15R1.1409 CCCCNC(=O)Cc1ccccc1C 527a_100000102301_100000212180 [0,1,0,0,0,0|1,0,0]=2 4598 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 11a_100000102301_100000183793 [0,1,0,0,0,0|1,0,0]=2 4599 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 1626a_100000102301_100000183793 [0,1,0,0,0,0|1,0,0]=2 4600 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 240690a_100000102301_100000183793 [0,1,0,0,0,0|1,0,0]=2 4601 B15R1.1409 CCCCNC(=O)Cc1ccccc1Cl 527a_100000102301_100000183793 [0,1,0,0,0,0|1,0,0]=2 4602 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 11a_100000102301_100000212012 [0,1,0,0,0,0|1,0,0]=2 4603 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 1626a_100000102301_100000212012 [0,1,0,0,0,0|1,0,0]=2 4604 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 240690a_100000102301_100000212012 [0,1,0,0,0,0|1,0,0]=2 4605 B15R1.1409 CCCCNC(=O)Cc1ccccc1F 527a_100000102301_100000212012 [0,1,0,0,0,0|1,0,0]=2 4606 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 11a_100000102301_100000036491 [0,1,0,0,0,0|1,0,0]=2 4607 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 1626a_100000102301_100000036491 [0,1,0,0,0,0|1,0,0]=2 4608 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 240690a_100000102301_100000036491 [0,1,0,0,0,0|1,0,0]=2 4609 B15R1.1409 CCCCNC(=O)Cc1ccccc1I 527a_100000102301_100000036491 [0,1,0,0,0,0|1,0,0]=2 4610 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 240690a_100000102301_100000743006 [0,1,0,0,0,0|1,0,0]=2 4611 B15R1.1409 CCCCNC(=O)Cc1ccccc1O 527a_100000102301_100000743006 [0,1,0,0,0,0|1,0,0]=2 4612 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 11a_100000102301_100000093521 [0,1,0,0,0,0|2,0,0]=3 4613 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 1626a_100000102301_100000093521 [0,1,0,0,0,0|2,0,0]=3 4614 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 240690a_100000102301_100000093521 [0,1,0,0,0,0|2,0,0]=3 4615 B15R1.1409 CCCCNC(=O)Cc1cccnc1Cl 527a_100000102301_100000093521 [0,1,0,0,0,0|2,0,0]=3 4616 B15R1.1409 CCCCNC(=O)Cc1ncccc1Br 11a_100000102301_200012357574 [0,1,0,0,0,0|2,0,0]=3 4617 B15R1.1409 CCCCNC(=O)Cc1ncccc1Br 240690a_100000102301_200012357574 [0,1,0,0,0,0|2,0,0]=3 4618 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 11a_100000102301_200000722269 [0,1,0,0,0,0|2,0,0]=3 4619 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 1626a_100000102301_200000722269 [0,1,0,0,0,0|2,0,0]=3 4620 B15R1.1409 CCCCNC(=O)Cc1ncccc1C 240690a_100000102301_200000722269 [0,1,0,0,0,0|2,0,0]=3 4621 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 11a_100000102301_100011998755 [0,1,0,0,0,0|2,0,0]=3 4622 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 240690a_100000102301_100011998755 [0,1,0,0,0,0|2,0,0]=3 4623 B15R1.1409 CCCCNC(=O)Cc1ncccc1Cl 527a_100000102301_100011998755 [0,1,0,0,0,0|2,0,0]=3 4624 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 1626a_100000102301_100000189665 [0,1,0,0,0,0|2,0,0]=3 4625 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 240690a_100000102301_100000189665 [0,1,0,0,0,0|2,0,0]=3 4626 B15R1.1409 CCCCNC(=O)Cn1ccccc1=O 527a_100000102301_100000189665 [0,1,0,0,0,0|2,0,0]=3 4627 B15R1.1409 CCCCNC(=O)Cn1cccnc1=O 1626a_100000102301_100000738077 [0,1,0,0,0,0|3,0,0]=4 4628 B15R1.1409 CCCCNC(=O)Cn1cccnc1=O 240690a_100000102301_100000738077 [0,1,0,0,0,0|3,0,0]=4 4629 B15R1.1409 CCCCNC(=O)Cn1ncccc1=O 11a_100000102301_100000238584 [0,1,0,0,0,0|3,0,0]=4 4630 B15R1.1409 CCCCNC(=O)Cn1ncccc1=O 1626a_100000102301_100000238584 [0,1,0,0,0,0|3,0,0]=4 4631 B15R1.1409 CCCCNC(=O)Cn1ncccc1=O 240690a_100000102301_100000238584 [0,1,0,0,0,0|3,0,0]=4 4632 B15R1.1409 CCCCNC(=O)Cn1ncccc1=O 527a_100000102301_100000238584 [0,1,0,0,0,0|3,0,0]=4 4633 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000102301 [0,1,0,0,0,0|2,0,0]=3 4634 B15R1.1409 CCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000102301 [0,1,0,0,0,0|2,0,0]=3 4635 B15R1.1409 CCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000102301 [0,1,0,0,0,0|2,0,0]=3 4636 B15R1.1409 CCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000102301 [0,1,0,0,0,0|2,0,0]=3 4637 B15R1.1409 CCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000102301 [0,1,0,0,0,0|2,0,0]=3 4638 B15R1.1409 CCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000102301 [0,1,0,0,0,0|2,0,0]=3 4639 B15R1.1409 CCCCNC(C)Cc1ccccc1Br 270004a_100000102301_100011350739 [0,1,0,0,0,0|2,0,1]=4 4640 B15R1.1409 CCCCNC(C)Cc1ccccc1C 270004a_100000102301_200000764500 [0,1,0,0,0,0|2,0,1]=4 4641 B15R1.1409 CCCCNC(C)Cc1ccccc1Cl 270004a_100000102301_100000758791 [0,1,0,0,0,0|2,0,1]=4 4642 B15R1.1409 CCCCNC(C)Cc1ccccc1F 270004a_100000102301_100000709178 [0,1,0,0,0,0|2,0,1]=4 4643 B15R1.1409 CCCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210303 [0,1,0,0,0,0|3,0,0]=4 4644 B15R1.1409 CCCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210303 [0,1,0,0,0,0|3,0,0]=4 4645 B15R1.1409 CCCNN=C(C)Cc1ccccc1Cl 4a_100000740057_100000758791 [0,1,0,0,0,0|3,0,0]=4 4646 B15R1.1409 CCCNNC(=O)Cc1ccccc1Br 22a_100000740057_100000751119 [0,1,0,0,0,0|2,0,0]=3 4647 B15R1.1409 CCCNNC(=O)Cc1ccccc1C 22a_100000740057_100000212180 [0,1,0,0,0,0|2,0,0]=3 4648 B15R1.1409 CCCNNC(=O)Cc1ccccc1Cl 22a_100000740057_100000183793 [0,1,0,0,0,0|2,0,0]=3 4649 B15R1.1409 CCCNNC(=O)Cc1ccccc1F 22a_100000740057_100000212012 [0,1,0,0,0,0|2,0,0]=3 4650 B15R1.1409 CCCNNC(=O)Cc1ccccc1I 22a_100000740057_100000036491 [0,1,0,0,0,0|2,0,0]=3 4651 B15R1.1409 CCCNNC(=O)Cc1ccccc1O 22a_100000740057_100000743006 [0,1,0,0,0,0|2,0,0]=3 4652 B15R1.1409 CCCNNC(=O)Cc1cccnc1Cl 22a_100000740057_100000093521 [0,1,0,0,0,0|3,0,0]=4 4653 B15R1.1409 CCCNNC(=O)Cc1ncccc1Br 22a_100000740057_200012357574 [0,1,0,0,0,0|3,0,0]=4 4654 B15R1.1409 CCCNNC(=O)Cn1ccccc1=O 22a_100000740057_100000189665 [0,1,0,0,0,0|3,0,0]=4 4655 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 1458a_100000745993_100000184730 [0,1,0,0,0,0|2,0,0]=3 4656 B15R1.1409 CCCOCC(=O)Cc1ccccc1Br 34a_100000210258_100000700504 [0,1,0,0,0,0|2,0,0]=3 4657 B15R1.1409 CCCOCC(=O)Cc1ccccc1C 1458a_100000745993_100000211839 [0,1,0,0,0,0|2,0,0]=3 4658 B15R1.1409 CCCOCC(=O)Cc1ccccc1Cl 1458a_100000745993_100000187162 [0,1,0,0,0,0|2,0,0]=3 4659 B15R1.1409 CCCOCC(=O)Cc1ccccc1F 1458a_100000745993_100000187165 [0,1,0,0,0,0|2,0,0]=3 4660 B15R1.1409 CCCOCC(=O)Cc1ccccc1I 1458a_100000745993_100011216222 [0,1,0,0,0,0|2,0,0]=3 4661 B15R1.1409 CCCOCC(=O)Cc1cccnc1Br 1458a_100000745993_100010140945 [0,1,0,0,0,0|3,0,0]=4 4662 B15R1.1409 CCCOCC(=O)Cc1cccnc1C 1458a_100000745993_100000732876 [0,1,0,0,0,0|3,0,0]=4 4663 B15R1.1409 CCCOCC(=O)Cc1cccnc1Cl 1458a_100000745993_100000045678 [0,1,0,0,0,0|3,0,0]=4 4664 B15R1.1409 CCCOCC(=O)Cc1cccnc1F 1458a_100000745993_100000099810 [0,1,0,0,0,0|3,0,0]=4 4665 B15R1.1409 CCCOCC(=O)Cc1ccncc1C 1458a_100000745993_100020672808 [0,1,0,0,0,0|3,0,0]=4 4666 B15R1.1409 CCCOCC(=O)Cc1ccncc1Cl 1458a_100000745993_100000763264 [0,1,0,0,0,0|3,0,0]=4 4667 B15R1.1409 CCCOCC(=O)Cc1cnccc1C 1458a_100000745993_100000690890 [0,1,0,0,0,0|3,0,0]=4 4668 B15R1.1409 CCCOCC(=O)Cc1ncccc1Br 1458a_100000745993_100025702911 [0,1,0,0,0,0|3,0,0]=4 4669 B15R1.1409 CCCOCC(=O)Cc1ncccc1C 1458a_100000745993_100000696600 [0,1,0,0,0,0|3,0,0]=4 4670 B15R1.1409 CCCOCC(=O)Cc1ncccc1Cl 1458a_100000745993_100000099807 [0,1,0,0,0,0|3,0,0]=4 4671 B15R1.1409 CCCOCC(=O)Cc1ncccc1F 1458a_100000745993_100000104219 [0,1,0,0,0,0|3,0,0]=4 4672 B15R1.1409 CCCOCC(=O)Cc1ncccc1O 1458a_100000745993_200020655725 [0,1,0,0,0,0|3,0,0]=4 4673 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000745993 [0,1,0,0,0,0|3,0,0]=4 4674 B15R1.1409 CCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000745993 [0,1,0,0,0,0|3,0,0]=4 4675 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000745993 [0,1,0,0,0,0|3,0,0]=4 4676 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000745993 [0,1,0,0,0,0|3,0,0]=4 4677 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000745993 [0,1,0,0,0,0|3,0,0]=4 4678 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 34a_100000210258_100000183529 [0,1,0,0,0,0|3,0,0]=4 4679 B15R1.1409 CCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000745993 [0,1,0,0,0,0|3,0,0]=4 4680 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000745993 [0,1,0,0,0,0|3,0,0]=4 4681 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000745993 [0,1,0,0,0,0|3,0,0]=4 4682 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000745993 [0,1,0,0,0,0|3,0,0]=4 4683 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 34a_100000210258_100000182448 [0,1,0,0,0,0|3,0,0]=4 4684 B15R1.1409 CCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000745993 [0,1,0,0,0,0|3,0,0]=4 4685 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000745993 [0,1,0,0,0,0|3,0,0]=4 4686 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000745993 [0,1,0,0,0,0|3,0,0]=4 4687 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000745993 [0,1,0,0,0,0|3,0,0]=4 4688 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 34a_100000210258_100000243840 [0,1,0,0,0,0|3,0,0]=4 4689 B15R1.1409 CCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000745993 [0,1,0,0,0,0|3,0,0]=4 4690 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000745993 [0,1,0,0,0,0|3,0,0]=4 4691 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000745993 [0,1,0,0,0,0|3,0,0]=4 4692 B15R1.1409 CCCOCC(=O)Nc1ccccc1I 34a_100000210258_100000180142 [0,1,0,0,0,0|3,0,0]=4 4693 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000745993 [0,1,0,0,0,0|3,0,0]=4 4694 B15R1.1409 CCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000745993 [0,1,0,0,0,0|3,0,0]=4 4695 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 1458a_100000217233_100000184730 [0,1,0,0,0,0|2,0,0]=3 4696 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000210303_100000700504 [0,1,0,0,0,0|2,0,0]=3 4697 B15R1.1409 CCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210303 [0,1,0,0,0,0|2,0,0]=3 4698 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 1458a_100000217233_100000211839 [0,1,0,0,0,0|2,0,0]=3 4699 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100000210303_100011223134 [0,1,0,0,0,0|2,0,0]=3 4700 B15R1.1409 CCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210303 [0,1,0,0,0,0|2,0,0]=3 4701 B15R1.1409 CCCSCC(=O)Cc1ccccc1Cl 1458a_100000217233_100000187162 [0,1,0,0,0,0|2,0,0]=3 4702 B15R1.1409 CCCSCC(=O)Cc1ccccc1F 1458a_100000217233_100000187165 [0,1,0,0,0,0|2,0,0]=3 4703 B15R1.1409 CCCSCC(=O)Cc1ccccc1I 1458a_100000217233_100011216222 [0,1,0,0,0,0|2,0,0]=3 4704 B15R1.1409 CCCSCC(=O)Cc1cccnc1Br 1458a_100000217233_100010140945 [0,1,0,0,0,0|3,0,0]=4 4705 B15R1.1409 CCCSCC(=O)Cc1cccnc1C 1458a_100000217233_100000732876 [0,1,0,0,0,0|3,0,0]=4 4706 B15R1.1409 CCCSCC(=O)Cc1cccnc1Cl 1458a_100000217233_100000045678 [0,1,0,0,0,0|3,0,0]=4 4707 B15R1.1409 CCCSCC(=O)Cc1cccnc1F 1458a_100000217233_100000099810 [0,1,0,0,0,0|3,0,0]=4 4708 B15R1.1409 CCCSCC(=O)Cc1ccncc1C 1458a_100000217233_100020672808 [0,1,0,0,0,0|3,0,0]=4 4709 B15R1.1409 CCCSCC(=O)Cc1ccncc1Cl 1458a_100000217233_100000763264 [0,1,0,0,0,0|3,0,0]=4 4710 B15R1.1409 CCCSCC(=O)Cc1cnccc1C 1458a_100000217233_100000690890 [0,1,0,0,0,0|3,0,0]=4 4711 B15R1.1409 CCCSCC(=O)Cc1ncccc1Br 1458a_100000217233_100025702911 [0,1,0,0,0,0|3,0,0]=4 4712 B15R1.1409 CCCSCC(=O)Cc1ncccc1C 1458a_100000217233_100000696600 [0,1,0,0,0,0|3,0,0]=4 4713 B15R1.1409 CCCSCC(=O)Cc1ncccc1Cl 1458a_100000217233_100000099807 [0,1,0,0,0,0|3,0,0]=4 4714 B15R1.1409 CCCSCC(=O)Cc1ncccc1F 1458a_100000217233_100000104219 [0,1,0,0,0,0|3,0,0]=4 4715 B15R1.1409 CCCSCC(=O)Cc1ncccc1O 1458a_100000217233_200020655725 [0,1,0,0,0,0|3,0,0]=4 4716 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000217233 [0,1,0,0,0,0|3,0,0]=4 4717 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000217233 [0,1,0,0,0,0|3,0,0]=4 4718 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210303 [0,1,0,0,0,0|3,0,0]=4 4719 B15R1.1409 CCCSCC(=O)Nc1ccccc1Br 62a_100000210303_100000182372 [0,1,0,0,0,0|3,0,0]=4 4720 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 11a_100015192222_100000217233 [0,1,0,0,0,0|3,0,0]=4 4721 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000217233 [0,1,0,0,0,0|3,0,0]=4 4722 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 22a_100015192222_100000217233 [0,1,0,0,0,0|3,0,0]=4 4723 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 527a_100015192222_100000217233 [0,1,0,0,0,0|3,0,0]=4 4724 B15R1.1409 CCCSCC(=O)Nc1ccccc1C 62a_100000210303_100000183529 [0,1,0,0,0,0|3,0,0]=4 4725 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000217233 [0,1,0,0,0,0|3,0,0]=4 4726 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000217233 [0,1,0,0,0,0|3,0,0]=4 4727 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000217233 [0,1,0,0,0,0|3,0,0]=4 4728 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000217233 [0,1,0,0,0,0|3,0,0]=4 4729 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_100000210303_100000182448 [0,1,0,0,0,0|3,0,0]=4 4730 B15R1.1409 CCCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210303 [0,1,0,0,0,0|3,0,0]=4 4731 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 11a_100000210422_100000217233 [0,1,0,0,0,0|3,0,0]=4 4732 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000217233 [0,1,0,0,0,0|3,0,0]=4 4733 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 22a_100000210422_100000217233 [0,1,0,0,0,0|3,0,0]=4 4734 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 527a_100000210422_100000217233 [0,1,0,0,0,0|3,0,0]=4 4735 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210303 [0,1,0,0,0,0|3,0,0]=4 4736 B15R1.1409 CCCSCC(=O)Nc1ccccc1F 62a_100000210303_100000182988 [0,1,0,0,0,0|3,0,0]=4 4737 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 11a_100000210053_100000217233 [0,1,0,0,0,0|3,0,0]=4 4738 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000217233 [0,1,0,0,0,0|3,0,0]=4 4739 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210303 [0,1,0,0,0,0|3,0,0]=4 4740 B15R1.1409 CCCSCC(=O)Nc1ccccc1I 62a_100000210303_100000180142 [0,1,0,0,0,0|3,0,0]=4 4741 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 22a_100000185747_100000217233 [0,1,0,0,0,0|3,0,0]=4 4742 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 527a_100000185747_100000217233 [0,1,0,0,0,0|3,0,0]=4 4743 B15R1.1409 CCCSCC(=O)Nc1ccccc1O 62a_100000210303_100000014494 [0,1,0,0,0,0|3,0,0]=4 4744 B15R1.1409 CCNCCC(=O)Nc1ccccc1Br 2230a_100015525214_100000181489 [0,1,0,0,0,0|3,0,0]=4 4745 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_100015525214_200011206476 [0,1,0,0,0,0|3,0,0]=4 4746 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 2230a_200015185780_100000210202 [0,1,0,0,0,0|3,0,0]=4 4747 B15R1.1409 CCNCCC(=O)Nc1ccccc1C 34a_200015185780_100000210202 [0,1,0,0,0,0|3,0,0]=4 4748 B15R1.1409 CCNCCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000242055 [0,1,0,0,0,0|3,0,0]=4 4749 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015185137_100000210202 [0,1,0,0,0,0|3,0,0]=4 4750 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 2230a_100015525214_100000242066 [0,1,0,0,0,0|3,0,0]=4 4751 B15R1.1409 CCNCCC(=O)Nc1ccccc1F 34a_100015185137_100000210202 [0,1,0,0,0,0|3,0,0]=4 4752 B15R1.1409 CCOC=CC(=O)Cc1ccccc1Br 1458a_100016266692_100000184730 [0,1,0,0,0,0|2,0,1]=4 4753 B15R1.1409 CCOC=CC(=O)Cc1ccccc1C 1458a_100016266692_100000211839 [0,1,0,0,0,0|2,0,1]=4 4754 B15R1.1409 CCOC=CC(=O)Cc1ccccc1Cl 1458a_100016266692_100000187162 [0,1,0,0,0,0|2,0,1]=4 4755 B15R1.1409 CCOC=CC(=O)Cc1ccccc1F 1458a_100016266692_100000187165 [0,1,0,0,0,0|2,0,1]=4 4756 B15R1.1409 CCOC=CC(=O)Cc1ccccc1I 1458a_100016266692_100011216222 [0,1,0,0,0,0|2,0,1]=4 4757 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000749530_100000184730 [0,1,0,0,0,0|2,0,0]=3 4758 B15R1.1409 CCOCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215890 [0,1,0,0,0,0|2,0,0]=3 4759 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215890 [0,1,0,0,0,0|2,0,0]=3 4760 B15R1.1409 CCOCCC(=O)Cc1ccccc1C 1458a_100000749530_100000211839 [0,1,0,0,0,0|2,0,0]=3 4761 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215890 [0,1,0,0,0,0|2,0,0]=3 4762 B15R1.1409 CCOCCC(=O)Cc1ccccc1Cl 1458a_100000749530_100000187162 [0,1,0,0,0,0|2,0,0]=3 4763 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215890 [0,1,0,0,0,0|2,0,0]=3 4764 B15R1.1409 CCOCCC(=O)Cc1ccccc1F 1458a_100000749530_100000187165 [0,1,0,0,0,0|2,0,0]=3 4765 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215890 [0,1,0,0,0,0|2,0,0]=3 4766 B15R1.1409 CCOCCC(=O)Cc1ccccc1I 1458a_100000749530_100011216222 [0,1,0,0,0,0|2,0,0]=3 4767 B15R1.1409 CCOCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215890 [0,1,0,0,0,0|2,0,0]=3 4768 B15R1.1409 CCOCCC(=O)Cc1cccnc1Br 1458a_100000749530_100010140945 [0,1,0,0,0,0|3,0,0]=4 4769 B15R1.1409 CCOCCC(=O)Cc1cccnc1C 1458a_100000749530_100000732876 [0,1,0,0,0,0|3,0,0]=4 4770 B15R1.1409 CCOCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100011215890 [0,1,0,0,0,0|3,0,0]=4 4771 B15R1.1409 CCOCCC(=O)Cc1cccnc1Cl 1458a_100000749530_100000045678 [0,1,0,0,0,0|3,0,0]=4 4772 B15R1.1409 CCOCCC(=O)Cc1cccnc1F 1458a_100000749530_100000099810 [0,1,0,0,0,0|3,0,0]=4 4773 B15R1.1409 CCOCCC(=O)Cc1ccncc1C 1458a_100000749530_100020672808 [0,1,0,0,0,0|3,0,0]=4 4774 B15R1.1409 CCOCCC(=O)Cc1ccncc1Cl 1458a_100000749530_100000763264 [0,1,0,0,0,0|3,0,0]=4 4775 B15R1.1409 CCOCCC(=O)Cc1cnccc1C 1458a_100000749530_100000690890 [0,1,0,0,0,0|3,0,0]=4 4776 B15R1.1409 CCOCCC(=O)Cc1ncccc1Br 1458a_100000749530_100025702911 [0,1,0,0,0,0|3,0,0]=4 4777 B15R1.1409 CCOCCC(=O)Cc1ncccc1Br 1458a_200012357574_100011215890 [0,1,0,0,0,0|3,0,0]=4 4778 B15R1.1409 CCOCCC(=O)Cc1ncccc1C 1458a_100000749530_100000696600 [0,1,0,0,0,0|3,0,0]=4 4779 B15R1.1409 CCOCCC(=O)Cc1ncccc1C 1458a_200000722269_100011215890 [0,1,0,0,0,0|3,0,0]=4 4780 B15R1.1409 CCOCCC(=O)Cc1ncccc1Cl 1458a_100000749530_100000099807 [0,1,0,0,0,0|3,0,0]=4 4781 B15R1.1409 CCOCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100011215890 [0,1,0,0,0,0|3,0,0]=4 4782 B15R1.1409 CCOCCC(=O)Cc1ncccc1F 1458a_100000749530_100000104219 [0,1,0,0,0,0|3,0,0]=4 4783 B15R1.1409 CCOCCC(=O)Cc1ncccc1O 1458a_100000749530_200020655725 [0,1,0,0,0,0|3,0,0]=4 4784 B15R1.1409 CCOCCC(=O)Cn1ccccc1=O 1458a_100000189665_100011215890 [0,1,0,0,0,0|3,0,0]=4 4785 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749530 [0,1,0,0,0,0|3,0,0]=4 4786 B15R1.1409 CCOCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749530 [0,1,0,0,0,0|3,0,0]=4 4787 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 11a_100015192222_100000749530 [0,1,0,0,0,0|3,0,0]=4 4788 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749530 [0,1,0,0,0,0|3,0,0]=4 4789 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 22a_100015192222_100000749530 [0,1,0,0,0,0|3,0,0]=4 4790 B15R1.1409 CCOCCC(=O)Nc1ccccc1C 527a_100015192222_100000749530 [0,1,0,0,0,0|3,0,0]=4 4791 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749530 [0,1,0,0,0,0|3,0,0]=4 4792 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749530 [0,1,0,0,0,0|3,0,0]=4 4793 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749530 [0,1,0,0,0,0|3,0,0]=4 4794 B15R1.1409 CCOCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749530 [0,1,0,0,0,0|3,0,0]=4 4795 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 11a_100000210422_100000749530 [0,1,0,0,0,0|3,0,0]=4 4796 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749530 [0,1,0,0,0,0|3,0,0]=4 4797 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 22a_100000210422_100000749530 [0,1,0,0,0,0|3,0,0]=4 4798 B15R1.1409 CCOCCC(=O)Nc1ccccc1F 527a_100000210422_100000749530 [0,1,0,0,0,0|3,0,0]=4 4799 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 11a_100000210053_100000749530 [0,1,0,0,0,0|3,0,0]=4 4800 B15R1.1409 CCOCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749530 [0,1,0,0,0,0|3,0,0]=4 4801 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 22a_100000185747_100000749530 [0,1,0,0,0,0|3,0,0]=4 4802 B15R1.1409 CCOCCC(=O)Nc1ccccc1O 527a_100000185747_100000749530 [0,1,0,0,0,0|3,0,0]=4 4803 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000230768_100000184730 [0,1,0,0,0,0|2,0,0]=3 4804 B15R1.1409 CCSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000757381 [0,1,0,0,0,0|2,0,0]=3 4805 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000757381 [0,1,0,0,0,0|2,0,0]=3 4806 B15R1.1409 CCSCCC(=O)Cc1ccccc1C 1458a_100000230768_100000211839 [0,1,0,0,0,0|2,0,0]=3 4807 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000757381 [0,1,0,0,0,0|2,0,0]=3 4808 B15R1.1409 CCSCCC(=O)Cc1ccccc1Cl 1458a_100000230768_100000187162 [0,1,0,0,0,0|2,0,0]=3 4809 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000757381 [0,1,0,0,0,0|2,0,0]=3 4810 B15R1.1409 CCSCCC(=O)Cc1ccccc1F 1458a_100000230768_100000187165 [0,1,0,0,0,0|2,0,0]=3 4811 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000757381 [0,1,0,0,0,0|2,0,0]=3 4812 B15R1.1409 CCSCCC(=O)Cc1ccccc1I 1458a_100000230768_100011216222 [0,1,0,0,0,0|2,0,0]=3 4813 B15R1.1409 CCSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000757381 [0,1,0,0,0,0|2,0,0]=3 4814 B15R1.1409 CCSCCC(=O)Cc1cccnc1Br 1458a_100000230768_100010140945 [0,1,0,0,0,0|3,0,0]=4 4815 B15R1.1409 CCSCCC(=O)Cc1cccnc1C 1458a_100000230768_100000732876 [0,1,0,0,0,0|3,0,0]=4 4816 B15R1.1409 CCSCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000757381 [0,1,0,0,0,0|3,0,0]=4 4817 B15R1.1409 CCSCCC(=O)Cc1cccnc1Cl 1458a_100000230768_100000045678 [0,1,0,0,0,0|3,0,0]=4 4818 B15R1.1409 CCSCCC(=O)Cc1cccnc1F 1458a_100000230768_100000099810 [0,1,0,0,0,0|3,0,0]=4 4819 B15R1.1409 CCSCCC(=O)Cc1ccncc1C 1458a_100000230768_100020672808 [0,1,0,0,0,0|3,0,0]=4 4820 B15R1.1409 CCSCCC(=O)Cc1ccncc1Cl 1458a_100000230768_100000763264 [0,1,0,0,0,0|3,0,0]=4 4821 B15R1.1409 CCSCCC(=O)Cc1cnccc1C 1458a_100000230768_100000690890 [0,1,0,0,0,0|3,0,0]=4 4822 B15R1.1409 CCSCCC(=O)Cc1ncccc1Br 1458a_100000230768_100025702911 [0,1,0,0,0,0|3,0,0]=4 4823 B15R1.1409 CCSCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000757381 [0,1,0,0,0,0|3,0,0]=4 4824 B15R1.1409 CCSCCC(=O)Cc1ncccc1C 1458a_100000230768_100000696600 [0,1,0,0,0,0|3,0,0]=4 4825 B15R1.1409 CCSCCC(=O)Cc1ncccc1C 1458a_200000722269_100000757381 [0,1,0,0,0,0|3,0,0]=4 4826 B15R1.1409 CCSCCC(=O)Cc1ncccc1Cl 1458a_100000230768_100000099807 [0,1,0,0,0,0|3,0,0]=4 4827 B15R1.1409 CCSCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000757381 [0,1,0,0,0,0|3,0,0]=4 4828 B15R1.1409 CCSCCC(=O)Cc1ncccc1F 1458a_100000230768_100000104219 [0,1,0,0,0,0|3,0,0]=4 4829 B15R1.1409 CCSCCC(=O)Cc1ncccc1O 1458a_100000230768_200020655725 [0,1,0,0,0,0|3,0,0]=4 4830 B15R1.1409 CCSCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000757381 [0,1,0,0,0,0|3,0,0]=4 4831 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 11a_100000210017_100000230768 [0,1,0,0,0,0|3,0,0]=4 4832 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000230768 [0,1,0,0,0,0|3,0,0]=4 4833 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000181489_100000210202 [0,1,0,0,0,0|3,0,0]=4 4834 B15R1.1409 CCSCCC(=O)Nc1ccccc1Br 62a_100000210202_100000181489 [0,1,0,0,0,0|3,0,0]=4 4835 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 11a_100015192222_100000230768 [0,1,0,0,0,0|3,0,0]=4 4836 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 1626a_100015192222_100000230768 [0,1,0,0,0,0|3,0,0]=4 4837 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 22a_100015192222_100000230768 [0,1,0,0,0,0|3,0,0]=4 4838 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 527a_100015192222_100000230768 [0,1,0,0,0,0|3,0,0]=4 4839 B15R1.1409 CCSCCC(=O)Nc1ccccc1C 62a_100000210202_200011206476 [0,1,0,0,0,0|3,0,0]=4 4840 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230768 [0,1,0,0,0,0|3,0,0]=4 4841 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230768 [0,1,0,0,0,0|3,0,0]=4 4842 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230768 [0,1,0,0,0,0|3,0,0]=4 4843 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230768 [0,1,0,0,0,0|3,0,0]=4 4844 B15R1.1409 CCSCCC(=O)Nc1ccccc1Cl 62a_100000210202_100000242055 [0,1,0,0,0,0|3,0,0]=4 4845 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 11a_100000210422_100000230768 [0,1,0,0,0,0|3,0,0]=4 4846 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 1626a_100000210422_100000230768 [0,1,0,0,0,0|3,0,0]=4 4847 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 22a_100000210422_100000230768 [0,1,0,0,0,0|3,0,0]=4 4848 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 527a_100000210422_100000230768 [0,1,0,0,0,0|3,0,0]=4 4849 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100000210202_100000242066 [0,1,0,0,0,0|3,0,0]=4 4850 B15R1.1409 CCSCCC(=O)Nc1ccccc1F 62a_100011216740_100000210202 [0,1,0,0,0,0|3,0,0]=4 4851 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 11a_100000210053_100000230768 [0,1,0,0,0,0|3,0,0]=4 4852 B15R1.1409 CCSCCC(=O)Nc1ccccc1I 1626a_100000210053_100000230768 [0,1,0,0,0,0|3,0,0]=4 4853 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 22a_100000185747_100000230768 [0,1,0,0,0,0|3,0,0]=4 4854 B15R1.1409 CCSCCC(=O)Nc1ccccc1O 527a_100000185747_100000230768 [0,1,0,0,0,0|3,0,0]=4 4855 B15R1.1409 CNCCOC(=O)Nc1ccccc1Br 34a_100102657272_100020589338 [0,1,0,0,0,0|2,0,0]=3 4856 B15R1.1409 CNCCOC(=O)Nc1ccccc1Br 7a_106832991635_100020589338 [0,1,0,0,0,0|2,0,0]=3 4857 B15R1.1409 CNCCOC(=O)Nc1ccccc1Cl 34a_100102657272_200000178450 [0,1,0,0,0,0|2,0,0]=3 4858 B15R1.1409 CNCCOC(=O)Nc1ccccc1Cl 7a_106832991635_200000178450 [0,1,0,0,0,0|2,0,0]=3 4859 B15R1.1409 COCC=CC(=O)Cc1ccccc1Br 1458a_100016285016_100000184730 [0,1,0,0,0,0|2,0,1]=4 4860 B15R1.1409 COCC=CC(=O)Cc1ccccc1C 1458a_100016285016_100000211839 [0,1,0,0,0,0|2,0,1]=4 4861 B15R1.1409 COCC=CC(=O)Cc1ccccc1Cl 1458a_100016285016_100000187162 [0,1,0,0,0,0|2,0,1]=4 4862 B15R1.1409 COCC=CC(=O)Cc1ccccc1F 1458a_100016285016_100000187165 [0,1,0,0,0,0|2,0,1]=4 4863 B15R1.1409 COCC=CC(=O)Cc1ccccc1I 1458a_100016285016_100011216222 [0,1,0,0,0,0|2,0,1]=4 4864 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000741012_100000184730 [0,1,0,0,0,0|2,0,0]=3 4865 B15R1.1409 COCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000740836 [0,1,0,0,0,0|2,0,0]=3 4866 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000740836 [0,1,0,0,0,0|2,0,0]=3 4867 B15R1.1409 COCCCC(=O)Cc1ccccc1C 1458a_100000741012_100000211839 [0,1,0,0,0,0|2,0,0]=3 4868 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000740836 [0,1,0,0,0,0|2,0,0]=3 4869 B15R1.1409 COCCCC(=O)Cc1ccccc1Cl 1458a_100000741012_100000187162 [0,1,0,0,0,0|2,0,0]=3 4870 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000740836 [0,1,0,0,0,0|2,0,0]=3 4871 B15R1.1409 COCCCC(=O)Cc1ccccc1F 1458a_100000741012_100000187165 [0,1,0,0,0,0|2,0,0]=3 4872 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000740836 [0,1,0,0,0,0|2,0,0]=3 4873 B15R1.1409 COCCCC(=O)Cc1ccccc1I 1458a_100000741012_100011216222 [0,1,0,0,0,0|2,0,0]=3 4874 B15R1.1409 COCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000740836 [0,1,0,0,0,0|2,0,0]=3 4875 B15R1.1409 COCCCC(=O)Cc1cccnc1Br 1458a_100000741012_100010140945 [0,1,0,0,0,0|3,0,0]=4 4876 B15R1.1409 COCCCC(=O)Cc1cccnc1C 1458a_100000741012_100000732876 [0,1,0,0,0,0|3,0,0]=4 4877 B15R1.1409 COCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000740836 [0,1,0,0,0,0|3,0,0]=4 4878 B15R1.1409 COCCCC(=O)Cc1cccnc1Cl 1458a_100000741012_100000045678 [0,1,0,0,0,0|3,0,0]=4 4879 B15R1.1409 COCCCC(=O)Cc1cccnc1F 1458a_100000741012_100000099810 [0,1,0,0,0,0|3,0,0]=4 4880 B15R1.1409 COCCCC(=O)Cc1ccncc1C 1458a_100000741012_100020672808 [0,1,0,0,0,0|3,0,0]=4 4881 B15R1.1409 COCCCC(=O)Cc1ccncc1Cl 1458a_100000741012_100000763264 [0,1,0,0,0,0|3,0,0]=4 4882 B15R1.1409 COCCCC(=O)Cc1cnccc1C 1458a_100000741012_100000690890 [0,1,0,0,0,0|3,0,0]=4 4883 B15R1.1409 COCCCC(=O)Cc1ncccc1Br 1458a_100000741012_100025702911 [0,1,0,0,0,0|3,0,0]=4 4884 B15R1.1409 COCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000740836 [0,1,0,0,0,0|3,0,0]=4 4885 B15R1.1409 COCCCC(=O)Cc1ncccc1C 1458a_100000741012_100000696600 [0,1,0,0,0,0|3,0,0]=4 4886 B15R1.1409 COCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000740836 [0,1,0,0,0,0|3,0,0]=4 4887 B15R1.1409 COCCCC(=O)Cc1ncccc1Cl 1458a_100000741012_100000099807 [0,1,0,0,0,0|3,0,0]=4 4888 B15R1.1409 COCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000740836 [0,1,0,0,0,0|3,0,0]=4 4889 B15R1.1409 COCCCC(=O)Cc1ncccc1F 1458a_100000741012_100000104219 [0,1,0,0,0,0|3,0,0]=4 4890 B15R1.1409 COCCCC(=O)Cc1ncccc1O 1458a_100000741012_200020655725 [0,1,0,0,0,0|3,0,0]=4 4891 B15R1.1409 COCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000740836 [0,1,0,0,0,0|3,0,0]=4 4892 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000741012 [0,1,0,0,0,0|3,0,0]=4 4893 B15R1.1409 COCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000741012 [0,1,0,0,0,0|3,0,0]=4 4894 B15R1.1409 COCCCC(=O)Nc1ccccc1C 11a_100015192222_100000741012 [0,1,0,0,0,0|3,0,0]=4 4895 B15R1.1409 COCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000741012 [0,1,0,0,0,0|3,0,0]=4 4896 B15R1.1409 COCCCC(=O)Nc1ccccc1C 22a_100015192222_100000741012 [0,1,0,0,0,0|3,0,0]=4 4897 B15R1.1409 COCCCC(=O)Nc1ccccc1C 527a_100015192222_100000741012 [0,1,0,0,0,0|3,0,0]=4 4898 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000741012 [0,1,0,0,0,0|3,0,0]=4 4899 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000741012 [0,1,0,0,0,0|3,0,0]=4 4900 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000741012 [0,1,0,0,0,0|3,0,0]=4 4901 B15R1.1409 COCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000741012 [0,1,0,0,0,0|3,0,0]=4 4902 B15R1.1409 COCCCC(=O)Nc1ccccc1F 11a_100000210422_100000741012 [0,1,0,0,0,0|3,0,0]=4 4903 B15R1.1409 COCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000741012 [0,1,0,0,0,0|3,0,0]=4 4904 B15R1.1409 COCCCC(=O)Nc1ccccc1F 22a_100000210422_100000741012 [0,1,0,0,0,0|3,0,0]=4 4905 B15R1.1409 COCCCC(=O)Nc1ccccc1F 527a_100000210422_100000741012 [0,1,0,0,0,0|3,0,0]=4 4906 B15R1.1409 COCCCC(=O)Nc1ccccc1I 11a_100000210053_100000741012 [0,1,0,0,0,0|3,0,0]=4 4907 B15R1.1409 COCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000741012 [0,1,0,0,0,0|3,0,0]=4 4908 B15R1.1409 COCCCC(=O)Nc1ccccc1O 22a_100000185747_100000741012 [0,1,0,0,0,0|3,0,0]=4 4909 B15R1.1409 COCCCC(=O)Nc1ccccc1O 527a_100000185747_100000741012 [0,1,0,0,0,0|3,0,0]=4 4910 B15R1.1409 COCCNC(=O)Cc1ccccc1Br 240690a_100000209980_100000751119 [0,1,0,0,0,0|2,0,0]=3 4911 B15R1.1409 COCCNC(=O)Cc1ccccc1Br 527a_100000209980_100000751119 [0,1,0,0,0,0|2,0,0]=3 4912 B15R1.1409 COCCNC(=O)Cc1ccccc1C 1626a_100000209980_100000212180 [0,1,0,0,0,0|2,0,0]=3 4913 B15R1.1409 COCCNC(=O)Cc1ccccc1C 240690a_100000209980_100000212180 [0,1,0,0,0,0|2,0,0]=3 4914 B15R1.1409 COCCNC(=O)Cc1ccccc1C 527a_100000209980_100000212180 [0,1,0,0,0,0|2,0,0]=3 4915 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 1626a_100000209980_100000183793 [0,1,0,0,0,0|2,0,0]=3 4916 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 240690a_100000209980_100000183793 [0,1,0,0,0,0|2,0,0]=3 4917 B15R1.1409 COCCNC(=O)Cc1ccccc1Cl 527a_100000209980_100000183793 [0,1,0,0,0,0|2,0,0]=3 4918 B15R1.1409 COCCNC(=O)Cc1ccccc1F 1626a_100000209980_100000212012 [0,1,0,0,0,0|2,0,0]=3 4919 B15R1.1409 COCCNC(=O)Cc1ccccc1F 240690a_100000209980_100000212012 [0,1,0,0,0,0|2,0,0]=3 4920 B15R1.1409 COCCNC(=O)Cc1ccccc1F 527a_100000209980_100000212012 [0,1,0,0,0,0|2,0,0]=3 4921 B15R1.1409 COCCNC(=O)Cc1ccccc1I 1626a_100000209980_100000036491 [0,1,0,0,0,0|2,0,0]=3 4922 B15R1.1409 COCCNC(=O)Cc1ccccc1I 240690a_100000209980_100000036491 [0,1,0,0,0,0|2,0,0]=3 4923 B15R1.1409 COCCNC(=O)Cc1ccccc1I 527a_100000209980_100000036491 [0,1,0,0,0,0|2,0,0]=3 4924 B15R1.1409 COCCNC(=O)Cc1ccccc1O 240690a_100000209980_100000743006 [0,1,0,0,0,0|2,0,0]=3 4925 B15R1.1409 COCCNC(=O)Cc1ccccc1O 527a_100000209980_100000743006 [0,1,0,0,0,0|2,0,0]=3 4926 B15R1.1409 COCCNC(=O)Cc1cccnc1Cl 1626a_100000209980_100000093521 [0,1,0,0,0,0|3,0,0]=4 4927 B15R1.1409 COCCNC(=O)Cc1cccnc1Cl 240690a_100000209980_100000093521 [0,1,0,0,0,0|3,0,0]=4 4928 B15R1.1409 COCCNC(=O)Cc1cccnc1Cl 527a_100000209980_100000093521 [0,1,0,0,0,0|3,0,0]=4 4929 B15R1.1409 COCCNC(=O)Cc1ncccc1Br 240690a_100000209980_200012357574 [0,1,0,0,0,0|3,0,0]=4 4930 B15R1.1409 COCCNC(=O)Cc1ncccc1C 1626a_100000209980_200000722269 [0,1,0,0,0,0|3,0,0]=4 4931 B15R1.1409 COCCNC(=O)Cc1ncccc1C 240690a_100000209980_200000722269 [0,1,0,0,0,0|3,0,0]=4 4932 B15R1.1409 COCCNC(=O)Cc1ncccc1Cl 240690a_100000209980_100011998755 [0,1,0,0,0,0|3,0,0]=4 4933 B15R1.1409 COCCNC(=O)Cc1ncccc1Cl 527a_100000209980_100011998755 [0,1,0,0,0,0|3,0,0]=4 4934 B15R1.1409 COCCNC(=O)Cn1ccccc1=O 1626a_100000209980_100000189665 [0,1,0,0,0,0|3,0,0]=4 4935 B15R1.1409 COCCNC(=O)Cn1ccccc1=O 240690a_100000209980_100000189665 [0,1,0,0,0,0|3,0,0]=4 4936 B15R1.1409 COCCNC(=O)Cn1ccccc1=O 527a_100000209980_100000189665 [0,1,0,0,0,0|3,0,0]=4 4937 B15R1.1409 COCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000209980 [0,1,0,0,0,0|3,0,0]=4 4938 B15R1.1409 COCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000209980 [0,1,0,0,0,0|3,0,0]=4 4939 B15R1.1409 COCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000209980 [0,1,0,0,0,0|3,0,0]=4 4940 B15R1.1409 COCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000209980 [0,1,0,0,0,0|3,0,0]=4 4941 B15R1.1409 COCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000209980 [0,1,0,0,0,0|3,0,0]=4 4942 B15R1.1409 COCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000209980 [0,1,0,0,0,0|3,0,0]=4 4943 B15R1.1409 COCCOC(=O)Nc1ccccc1Br 34a_100138415774_100020589338 [0,1,0,0,0,0|2,0,0]=3 4944 B15R1.1409 COCCOC(=O)Nc1ccccc1Cl 34a_100138415774_200000178450 [0,1,0,0,0,0|2,0,0]=3 4945 B15R1.1409 COCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000766300 [0,1,0,0,0,0|3,0,0]=4 4946 B15R1.1409 COCSCC(=O)Cc1ccccc1Br 62a_100000766300_100000700504 [0,1,0,0,0,0|3,0,0]=4 4947 B15R1.1409 COCSCC(=O)Cc1ccccc1C 62a_100000766300_100011223134 [0,1,0,0,0,0|3,0,0]=4 4948 B15R1.1409 COCSCC(=O)Cc1ccccc1C 62a_100011223134_100000766300 [0,1,0,0,0,0|3,0,0]=4 4949 B15R1.1409 CSCCCC(=O)Cc1ccccc1Br 1458a_100000173376_100000184730 [0,1,0,0,0,0|2,0,0]=3 4950 B15R1.1409 CSCCCC(=O)Cc1ccccc1C 1458a_100000173376_100000211839 [0,1,0,0,0,0|2,0,0]=3 4951 B15R1.1409 CSCCCC(=O)Cc1ccccc1Cl 1458a_100000173376_100000187162 [0,1,0,0,0,0|2,0,0]=3 4952 B15R1.1409 CSCCCC(=O)Cc1ccccc1F 1458a_100000173376_100000187165 [0,1,0,0,0,0|2,0,0]=3 4953 B15R1.1409 CSCCCC(=O)Cc1ccccc1I 1458a_100000173376_100011216222 [0,1,0,0,0,0|2,0,0]=3 4954 B15R1.1409 CSCCCC(=O)Cc1cccnc1Br 1458a_100000173376_100010140945 [0,1,0,0,0,0|3,0,0]=4 4955 B15R1.1409 CSCCCC(=O)Cc1cccnc1C 1458a_100000173376_100000732876 [0,1,0,0,0,0|3,0,0]=4 4956 B15R1.1409 CSCCCC(=O)Cc1cccnc1Cl 1458a_100000173376_100000045678 [0,1,0,0,0,0|3,0,0]=4 4957 B15R1.1409 CSCCCC(=O)Cc1cccnc1F 1458a_100000173376_100000099810 [0,1,0,0,0,0|3,0,0]=4 4958 B15R1.1409 CSCCCC(=O)Cc1ccncc1C 1458a_100000173376_100020672808 [0,1,0,0,0,0|3,0,0]=4 4959 B15R1.1409 CSCCCC(=O)Cc1ccncc1Cl 1458a_100000173376_100000763264 [0,1,0,0,0,0|3,0,0]=4 4960 B15R1.1409 CSCCCC(=O)Cc1cnccc1C 1458a_100000173376_100000690890 [0,1,0,0,0,0|3,0,0]=4 4961 B15R1.1409 CSCCCC(=O)Cc1ncccc1Br 1458a_100000173376_100025702911 [0,1,0,0,0,0|3,0,0]=4 4962 B15R1.1409 CSCCCC(=O)Cc1ncccc1C 1458a_100000173376_100000696600 [0,1,0,0,0,0|3,0,0]=4 4963 B15R1.1409 CSCCCC(=O)Cc1ncccc1Cl 1458a_100000173376_100000099807 [0,1,0,0,0,0|3,0,0]=4 4964 B15R1.1409 CSCCCC(=O)Cc1ncccc1F 1458a_100000173376_100000104219 [0,1,0,0,0,0|3,0,0]=4 4965 B15R1.1409 CSCCCC(=O)Cc1ncccc1O 1458a_100000173376_200020655725 [0,1,0,0,0,0|3,0,0]=4 4966 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000173376 [0,1,0,0,0,0|3,0,0]=4 4967 B15R1.1409 CSCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000173376 [0,1,0,0,0,0|3,0,0]=4 4968 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 11a_100015192222_100000173376 [0,1,0,0,0,0|3,0,0]=4 4969 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000173376 [0,1,0,0,0,0|3,0,0]=4 4970 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 22a_100015192222_100000173376 [0,1,0,0,0,0|3,0,0]=4 4971 B15R1.1409 CSCCCC(=O)Nc1ccccc1C 527a_100015192222_100000173376 [0,1,0,0,0,0|3,0,0]=4 4972 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000173376 [0,1,0,0,0,0|3,0,0]=4 4973 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000173376 [0,1,0,0,0,0|3,0,0]=4 4974 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000173376 [0,1,0,0,0,0|3,0,0]=4 4975 B15R1.1409 CSCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000173376 [0,1,0,0,0,0|3,0,0]=4 4976 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 11a_100000210422_100000173376 [0,1,0,0,0,0|3,0,0]=4 4977 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000173376 [0,1,0,0,0,0|3,0,0]=4 4978 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 22a_100000210422_100000173376 [0,1,0,0,0,0|3,0,0]=4 4979 B15R1.1409 CSCCCC(=O)Nc1ccccc1F 527a_100000210422_100000173376 [0,1,0,0,0,0|3,0,0]=4 4980 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 11a_100000210053_100000173376 [0,1,0,0,0,0|3,0,0]=4 4981 B15R1.1409 CSCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000173376 [0,1,0,0,0,0|3,0,0]=4 4982 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 22a_100000185747_100000173376 [0,1,0,0,0,0|3,0,0]=4 4983 B15R1.1409 CSCCCC(=O)Nc1ccccc1O 527a_100000185747_100000173376 [0,1,0,0,0,0|3,0,0]=4 4984 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 11a_100020590264_100000751119 [0,1,0,0,0,0|2,0,0]=3 4985 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 240690a_100020590264_100000751119 [0,1,0,0,0,0|2,0,0]=3 4986 B15R1.1409 CSCCNC(=O)Cc1ccccc1Br 527a_100020590264_100000751119 [0,1,0,0,0,0|2,0,0]=3 4987 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 11a_100020590264_100000212180 [0,1,0,0,0,0|2,0,0]=3 4988 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 1626a_100020590264_100000212180 [0,1,0,0,0,0|2,0,0]=3 4989 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 240690a_100020590264_100000212180 [0,1,0,0,0,0|2,0,0]=3 4990 B15R1.1409 CSCCNC(=O)Cc1ccccc1C 527a_100020590264_100000212180 [0,1,0,0,0,0|2,0,0]=3 4991 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 11a_100020590264_100000183793 [0,1,0,0,0,0|2,0,0]=3 4992 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 1626a_100020590264_100000183793 [0,1,0,0,0,0|2,0,0]=3 4993 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 240690a_100020590264_100000183793 [0,1,0,0,0,0|2,0,0]=3 4994 B15R1.1409 CSCCNC(=O)Cc1ccccc1Cl 527a_100020590264_100000183793 [0,1,0,0,0,0|2,0,0]=3 4995 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 11a_100020590264_100000212012 [0,1,0,0,0,0|2,0,0]=3 4996 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 1626a_100020590264_100000212012 [0,1,0,0,0,0|2,0,0]=3 4997 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 240690a_100020590264_100000212012 [0,1,0,0,0,0|2,0,0]=3 4998 B15R1.1409 CSCCNC(=O)Cc1ccccc1F 527a_100020590264_100000212012 [0,1,0,0,0,0|2,0,0]=3 4999 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 11a_100020590264_100000036491 [0,1,0,0,0,0|2,0,0]=3 5000 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 1626a_100020590264_100000036491 [0,1,0,0,0,0|2,0,0]=3 5001 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 240690a_100020590264_100000036491 [0,1,0,0,0,0|2,0,0]=3 5002 B15R1.1409 CSCCNC(=O)Cc1ccccc1I 527a_100020590264_100000036491 [0,1,0,0,0,0|2,0,0]=3 5003 B15R1.1409 CSCCNC(=O)Cc1ccccc1O 240690a_100020590264_100000743006 [0,1,0,0,0,0|2,0,0]=3 5004 B15R1.1409 CSCCNC(=O)Cc1ccccc1O 527a_100020590264_100000743006 [0,1,0,0,0,0|2,0,0]=3 5005 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl 11a_100020590264_100000093521 [0,1,0,0,0,0|3,0,0]=4 5006 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl 1626a_100020590264_100000093521 [0,1,0,0,0,0|3,0,0]=4 5007 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl 240690a_100020590264_100000093521 [0,1,0,0,0,0|3,0,0]=4 5008 B15R1.1409 CSCCNC(=O)Cc1cccnc1Cl 527a_100020590264_100000093521 [0,1,0,0,0,0|3,0,0]=4 5009 B15R1.1409 CSCCNC(=O)Cc1ncccc1Br 11a_100020590264_200012357574 [0,1,0,0,0,0|3,0,0]=4 5010 B15R1.1409 CSCCNC(=O)Cc1ncccc1Br 240690a_100020590264_200012357574 [0,1,0,0,0,0|3,0,0]=4 5011 B15R1.1409 CSCCNC(=O)Cc1ncccc1C 11a_100020590264_200000722269 [0,1,0,0,0,0|3,0,0]=4 5012 B15R1.1409 CSCCNC(=O)Cc1ncccc1C 1626a_100020590264_200000722269 [0,1,0,0,0,0|3,0,0]=4 5013 B15R1.1409 CSCCNC(=O)Cc1ncccc1C 240690a_100020590264_200000722269 [0,1,0,0,0,0|3,0,0]=4 5014 B15R1.1409 CSCCNC(=O)Cc1ncccc1Cl 11a_100020590264_100011998755 [0,1,0,0,0,0|3,0,0]=4 5015 B15R1.1409 CSCCNC(=O)Cc1ncccc1Cl 240690a_100020590264_100011998755 [0,1,0,0,0,0|3,0,0]=4 5016 B15R1.1409 CSCCNC(=O)Cc1ncccc1Cl 527a_100020590264_100011998755 [0,1,0,0,0,0|3,0,0]=4 5017 B15R1.1409 CSCCNC(=O)Cn1ccccc1=O 1626a_100020590264_100000189665 [0,1,0,0,0,0|3,0,0]=4 5018 B15R1.1409 CSCCNC(=O)Cn1ccccc1=O 240690a_100020590264_100000189665 [0,1,0,0,0,0|3,0,0]=4 5019 B15R1.1409 CSCCNC(=O)Cn1ccccc1=O 527a_100020590264_100000189665 [0,1,0,0,0,0|3,0,0]=4 5020 B15R1.1409 CSCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100020590264 [0,1,0,0,0,0|3,0,0]=4 5021 B15R1.1409 CSCCNC(=O)Nc1ccccc1C 2430a_100015192222_100020590264 [0,1,0,0,0,0|3,0,0]=4 5022 B15R1.1409 CSCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020590264 [0,1,0,0,0,0|3,0,0]=4 5023 B15R1.1409 CSCCNC(=O)Nc1ccccc1F 2430a_100000210422_100020590264 [0,1,0,0,0,0|3,0,0]=4 5024 B15R1.1409 CSCCNC(=O)Nc1ccccc1I 2430a_100000210053_100020590264 [0,1,0,0,0,0|3,0,0]=4 5025 B15R1.1409 CSCCNC(=O)Nc1ccccc1O 2430a_100000185747_100020590264 [0,1,0,0,0,0|3,0,0]=4 5026 B15R1.1409 CSCCOC(=O)Nc1ccccc1Br 62a_100020589338_200000210301 [0,1,0,0,0,0|2,0,0]=3 5027 B15R1.1409 CSCCOC(=O)Nc1ccccc1Br 62a_200000210301_100020589338 [0,1,0,0,0,0|2,0,0]=3 5028 B15R1.1409 CSCCOC(=O)Nc1ccccc1Cl 62a_200000210301_200000178450 [0,1,0,0,0,0|2,0,0]=3 5029 B15R1.1409 CSCSCC(=O)Cc1ccccc1Br 62a_100000700504_100011218213 [0,1,0,0,0,0|3,0,0]=4 5030 B15R1.1409 CSCSCC(=O)Cc1ccccc1Br 62a_100011218213_100000700504 [0,1,0,0,0,0|3,0,0]=4 5031 B15R1.1409 CSCSCC(=O)Cc1ccccc1C 62a_100011218213_100011223134 [0,1,0,0,0,0|3,0,0]=4 5032 B15R1.1409 CSCSCC(=O)Cc1ccccc1C 62a_100011223134_100011218213 [0,1,0,0,0,0|3,0,0]=4 5033 B15R1.1409 Cc1ccccc1CC(=O)CCCC#N 1458a_100000075515_100000211839 [0,1,0,0,0,0|2,0,1]=4 5034 B15R1.1409 Cc1ccccc1CC(=O)CCCC#N 1458a_100000212180_100000211468 [0,1,0,0,0,0|2,0,1]=4 5035 B15R1.1409 Cc1ccccc1CC(=O)CCCCF 1458a_100000212180_100000729493 [0,1,0,0,0,0|2,0,0]=3 5036 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000212180_100000210776 [0,1,0,0,0,0|2,0,0]=3 5037 B15R1.1409 Cc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000211839 [0,1,0,0,0,0|2,0,0]=3 5038 B15R1.1409 Cc1ccccc1CC(=O)CNCCO 2230a_100016997473_100011223134 [0,1,0,0,0,0|3,0,0]=4 5039 B15R1.1409 Cc1ccccc1CC(=O)COCCO 1458a_100000708028_100000211839 [0,1,0,0,0,0|3,0,0]=4 5040 B15R1.1409 Cc1ccccc1CC(=O)CSCCF 62a_100011217306_100011223134 [0,1,0,0,0,0|3,0,0]=4 5041 B15R1.1409 Cc1ccccc1CC(=O)CSCCF 62a_100011223134_100011217306 [0,1,0,0,0,0|3,0,0]=4 5042 B15R1.1409 Cc1ccccc1CC(=O)CSCCO 62a_100000211926_100011223134 [0,1,0,0,0,0|3,0,0]=4 5043 B15R1.1409 Cc1ccccc1CC(=O)CSCCO 62a_100011223134_100000211926 [0,1,0,0,0,0|3,0,0]=4 5044 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N 11a_100000720768_100000212180 [0,1,0,0,0,0|2,0,1]=4 5045 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N 1626a_100000720768_100000212180 [0,1,0,0,0,0|2,0,1]=4 5046 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N 240690a_100000720768_100000212180 [0,1,0,0,0,0|2,0,1]=4 5047 B15R1.1409 Cc1ccccc1CC(=O)NCCC#N 527a_100000720768_100000212180 [0,1,0,0,0,0|2,0,1]=4 5048 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 11a_100015189416_100000212180 [0,1,0,0,0,0|2,0,0]=3 5049 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 1626a_100015189416_100000212180 [0,1,0,0,0,0|2,0,0]=3 5050 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 240690a_100015189416_100000212180 [0,1,0,0,0,0|2,0,0]=3 5051 B15R1.1409 Cc1ccccc1CC(=O)NCCCF 527a_100015189416_100000212180 [0,1,0,0,0,0|2,0,0]=3 5052 B15R1.1409 Cc1ccccc1CC(=O)NCCCO 240690a_100000182051_100000212180 [0,1,0,0,0,0|2,0,0]=3 5053 B15R1.1409 Cc1ccccc1CC(=O)NCCCO 527a_100000182051_100000212180 [0,1,0,0,0,0|2,0,0]=3 5054 B15R1.1409 Cc1ccccc1CC(=O)NNCCO 22a_100000210001_100000212180 [0,1,0,0,0,0|3,0,0]=4 5055 B15R1.1409 Cc1ccccc1NC(=O)CCCCO 1626a_100015192222_100000695505 [0,1,0,0,0,0|3,0,0]=4 5056 B15R1.1409 Cc1ccccc1NC(=O)NCCCF 2430a_100015192222_100015189416 [0,1,0,0,0,0|3,0,0]=4 5057 B15R1.1409 Cc1ccccc1NC(=O)NCCCO 2430a_100015192222_100000182051 [0,1,0,0,0,0|3,0,0]=4 5058 B15R1.1409 Cc1cccnc1CC(=O)CCCCF 1458a_200000722269_100000729493 [0,1,0,0,0,0|3,0,0]=4 5059 B15R1.1409 Cc1cccnc1CC(=O)CCCCO 1458a_100000695505_100000696600 [0,1,0,0,0,0|3,0,0]=4 5060 B15R1.1409 Cc1cccnc1CC(=O)CCCCO 1458a_200000722269_100000210776 [0,1,0,0,0,0|3,0,0]=4 5061 B15R1.1409 Cc1cccnc1CC(=O)NCCCF 11a_100015189416_200000722269 [0,1,0,0,0,0|3,0,0]=4 5062 B15R1.1409 Cc1cccnc1CC(=O)NCCCF 1626a_100015189416_200000722269 [0,1,0,0,0,0|3,0,0]=4 5063 B15R1.1409 Cc1cccnc1CC(=O)NCCCF 240690a_100015189416_200000722269 [0,1,0,0,0,0|3,0,0]=4 5064 B15R1.1409 Cc1cccnc1CC(=O)NCCCO 240690a_100000182051_200000722269 [0,1,0,0,0,0|3,0,0]=4 5065 B15R1.1409 Cc1ccncc1CC(=O)CCCCO 1458a_100000695505_100000690890 [0,1,0,0,0,0|3,0,0]=4 5066 B15R1.1409 Cc1cnccc1CC(=O)CCCCO 1458a_100000695505_100020672808 [0,1,0,0,0,0|3,0,0]=4 5067 B15R1.1409 Cc1ncccc1CC(=O)CCCCO 1458a_100000695505_100000732876 [0,1,0,0,0,0|3,0,0]=4 5068 B15R1.1409 N#CCCCC(=O)Cc1ccccc1Br 1458a_100000075515_100000184730 [0,1,0,0,0,0|2,0,1]=4 5069 B15R1.1409 N#CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000211468 [0,1,0,0,0,0|2,0,1]=4 5070 B15R1.1409 N#CCCCC(=O)Cc1ccccc1Cl 1458a_100000075515_100000187162 [0,1,0,0,0,0|2,0,1]=4 5071 B15R1.1409 N#CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000211468 [0,1,0,0,0,0|2,0,1]=4 5072 B15R1.1409 N#CCCCC(=O)Cc1ccccc1F 1458a_100000075515_100000187165 [0,1,0,0,0,0|2,0,1]=4 5073 B15R1.1409 N#CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000211468 [0,1,0,0,0,0|2,0,1]=4 5074 B15R1.1409 N#CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000211468 [0,1,0,0,0,0|2,0,1]=4 5075 B15R1.1409 N#CCCCC(=O)Cc1ccccc1I 1458a_100000075515_100011216222 [0,1,0,0,0,0|2,0,1]=4 5076 B15R1.1409 N#CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211468 [0,1,0,0,0,0|2,0,1]=4 5077 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Br 11a_100000720768_100000751119 [0,1,0,0,0,0|2,0,1]=4 5078 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Br 240690a_100000720768_100000751119 [0,1,0,0,0,0|2,0,1]=4 5079 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Br 527a_100000720768_100000751119 [0,1,0,0,0,0|2,0,1]=4 5080 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl 11a_100000720768_100000183793 [0,1,0,0,0,0|2,0,1]=4 5081 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl 1626a_100000720768_100000183793 [0,1,0,0,0,0|2,0,1]=4 5082 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl 240690a_100000720768_100000183793 [0,1,0,0,0,0|2,0,1]=4 5083 B15R1.1409 N#CCCNC(=O)Cc1ccccc1Cl 527a_100000720768_100000183793 [0,1,0,0,0,0|2,0,1]=4 5084 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F 11a_100000720768_100000212012 [0,1,0,0,0,0|2,0,1]=4 5085 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F 1626a_100000720768_100000212012 [0,1,0,0,0,0|2,0,1]=4 5086 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F 240690a_100000720768_100000212012 [0,1,0,0,0,0|2,0,1]=4 5087 B15R1.1409 N#CCCNC(=O)Cc1ccccc1F 527a_100000720768_100000212012 [0,1,0,0,0,0|2,0,1]=4 5088 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I 11a_100000720768_100000036491 [0,1,0,0,0,0|2,0,1]=4 5089 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I 1626a_100000720768_100000036491 [0,1,0,0,0,0|2,0,1]=4 5090 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I 240690a_100000720768_100000036491 [0,1,0,0,0,0|2,0,1]=4 5091 B15R1.1409 N#CCCNC(=O)Cc1ccccc1I 527a_100000720768_100000036491 [0,1,0,0,0,0|2,0,1]=4 5092 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O 240690a_100000720768_100000743006 [0,1,0,0,0,0|2,0,1]=4 5093 B15R1.1409 N#CCCNC(=O)Cc1ccccc1O 527a_100000720768_100000743006 [0,1,0,0,0,0|2,0,1]=4 5094 B15R1.1409 NCCOCC(=O)Cc1ccccc1Br 34a_100000210304_100000700504 [0,1,0,0,0,0|3,0,0]=4 5095 B15R1.1409 O=C(CCCCF)Cc1ccccc1Br 1458a_100000751119_100000729493 [0,1,0,0,0,0|2,0,0]=3 5096 B15R1.1409 O=C(CCCCF)Cc1ccccc1Cl 1458a_100000183793_100000729493 [0,1,0,0,0,0|2,0,0]=3 5097 B15R1.1409 O=C(CCCCF)Cc1ccccc1F 1458a_100000212012_100000729493 [0,1,0,0,0,0|2,0,0]=3 5098 B15R1.1409 O=C(CCCCF)Cc1ccccc1I 1458a_100000036491_100000729493 [0,1,0,0,0,0|2,0,0]=3 5099 B15R1.1409 O=C(CCCCF)Cc1ccccc1O 1458a_100000743006_100000729493 [0,1,0,0,0,0|2,0,0]=3 5100 B15R1.1409 O=C(CCCCF)Cc1cccnc1Cl 1458a_100000093521_100000729493 [0,1,0,0,0,0|3,0,0]=4 5101 B15R1.1409 O=C(CCCCF)Cc1ncccc1Br 1458a_200012357574_100000729493 [0,1,0,0,0,0|3,0,0]=4 5102 B15R1.1409 O=C(CCCCF)Cc1ncccc1Cl 1458a_100011998755_100000729493 [0,1,0,0,0,0|3,0,0]=4 5103 B15R1.1409 O=C(CCCCF)Cn1ccccc1=O 1458a_100000189665_100000729493 [0,1,0,0,0,0|3,0,0]=4 5104 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000695505_100000184730 [0,1,0,0,0,0|2,0,0]=3 5105 B15R1.1409 O=C(CCCCO)Cc1ccccc1Br 1458a_100000751119_100000210776 [0,1,0,0,0,0|2,0,0]=3 5106 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000183793_100000210776 [0,1,0,0,0,0|2,0,0]=3 5107 B15R1.1409 O=C(CCCCO)Cc1ccccc1Cl 1458a_100000695505_100000187162 [0,1,0,0,0,0|2,0,0]=3 5108 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000212012_100000210776 [0,1,0,0,0,0|2,0,0]=3 5109 B15R1.1409 O=C(CCCCO)Cc1ccccc1F 1458a_100000695505_100000187165 [0,1,0,0,0,0|2,0,0]=3 5110 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000036491_100000210776 [0,1,0,0,0,0|2,0,0]=3 5111 B15R1.1409 O=C(CCCCO)Cc1ccccc1I 1458a_100000695505_100011216222 [0,1,0,0,0,0|2,0,0]=3 5112 B15R1.1409 O=C(CCCCO)Cc1ccccc1O 1458a_100000743006_100000210776 [0,1,0,0,0,0|2,0,0]=3 5113 B15R1.1409 O=C(CCCCO)Cc1cccnc1Br 1458a_100000695505_100010140945 [0,1,0,0,0,0|3,0,0]=4 5114 B15R1.1409 O=C(CCCCO)Cc1cccnc1Cl 1458a_100000093521_100000210776 [0,1,0,0,0,0|3,0,0]=4 5115 B15R1.1409 O=C(CCCCO)Cc1cccnc1Cl 1458a_100000695505_100000045678 [0,1,0,0,0,0|3,0,0]=4 5116 B15R1.1409 O=C(CCCCO)Cc1cccnc1F 1458a_100000695505_100000099810 [0,1,0,0,0,0|3,0,0]=4 5117 B15R1.1409 O=C(CCCCO)Cc1ccncc1Cl 1458a_100000695505_100000763264 [0,1,0,0,0,0|3,0,0]=4 5118 B15R1.1409 O=C(CCCCO)Cc1ncccc1Br 1458a_100000695505_100025702911 [0,1,0,0,0,0|3,0,0]=4 5119 B15R1.1409 O=C(CCCCO)Cc1ncccc1Br 1458a_200012357574_100000210776 [0,1,0,0,0,0|3,0,0]=4 5120 B15R1.1409 O=C(CCCCO)Cc1ncccc1Cl 1458a_100000695505_100000099807 [0,1,0,0,0,0|3,0,0]=4 5121 B15R1.1409 O=C(CCCCO)Cc1ncccc1Cl 1458a_100011998755_100000210776 [0,1,0,0,0,0|3,0,0]=4 5122 B15R1.1409 O=C(CCCCO)Cc1ncccc1F 1458a_100000695505_100000104219 [0,1,0,0,0,0|3,0,0]=4 5123 B15R1.1409 O=C(CCCCO)Cc1ncccc1O 1458a_100000695505_200020655725 [0,1,0,0,0,0|3,0,0]=4 5124 B15R1.1409 O=C(CCCCO)Cn1ccccc1=O 1458a_100000189665_100000210776 [0,1,0,0,0,0|3,0,0]=4 5125 B15R1.1409 O=C(CCCCO)Nc1ccccc1Br 1626a_100000210017_100000695505 [0,1,0,0,0,0|3,0,0]=4 5126 B15R1.1409 O=C(CCCCO)Nc1ccccc1Cl 1626a_100000185783_100000695505 [0,1,0,0,0,0|3,0,0]=4 5127 B15R1.1409 O=C(CCCCO)Nc1ccccc1F 1626a_100000210422_100000695505 [0,1,0,0,0,0|3,0,0]=4 5128 B15R1.1409 O=C(CCCCO)Nc1ccccc1I 1626a_100000210053_100000695505 [0,1,0,0,0,0|3,0,0]=4 5129 B15R1.1409 O=C(CNCCF)Cc1ccccc1Br 34a_100000724931_100000700504 [0,1,0,0,0,0|3,0,0]=4 5130 B15R1.1409 O=C(CNCCO)Cc1ccccc1Br 2230a_100016997473_100000700504 [0,1,0,0,0,0|3,0,0]=4 5131 B15R1.1409 O=C(CNCCO)Cc1ccccc1Br 34a_100016990907_100000700504 [0,1,0,0,0,0|3,0,0]=4 5132 B15R1.1409 O=C(COCCBr)Cc1ccccc1Br 34a_100000211926_100000700504 [0,1,0,0,0,0|3,0,0]=4 5133 B15R1.1409 O=C(COCCO)Cc1ccccc1Br 1458a_100000708028_100000184730 [0,1,0,0,0,0|3,0,0]=4 5134 B15R1.1409 O=C(COCCO)Cc1ccccc1Cl 1458a_100000708028_100000187162 [0,1,0,0,0,0|3,0,0]=4 5135 B15R1.1409 O=C(COCCO)Cc1ccccc1F 1458a_100000708028_100000187165 [0,1,0,0,0,0|3,0,0]=4 5136 B15R1.1409 O=C(COCCO)Cc1ccccc1I 1458a_100000708028_100011216222 [0,1,0,0,0,0|3,0,0]=4 5137 B15R1.1409 O=C(CSCCF)Cc1ccccc1Br 62a_100000700504_100011217306 [0,1,0,0,0,0|3,0,0]=4 5138 B15R1.1409 O=C(CSCCF)Cc1ccccc1Br 62a_100011217306_100000700504 [0,1,0,0,0,0|3,0,0]=4 5139 B15R1.1409 O=C(CSCCO)Cc1ccccc1Br 62a_100000211926_100000700504 [0,1,0,0,0,0|3,0,0]=4 5140 B15R1.1409 O=C(CSCCO)Cc1ccccc1Br 62a_100000700504_100000211926 [0,1,0,0,0,0|3,0,0]=4 5141 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 11a_100015189416_100000751119 [0,1,0,0,0,0|2,0,0]=3 5142 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 240690a_100015189416_100000751119 [0,1,0,0,0,0|2,0,0]=3 5143 B15R1.1409 O=C(Cc1ccccc1Br)NCCCF 527a_100015189416_100000751119 [0,1,0,0,0,0|2,0,0]=3 5144 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO 240690a_100000182051_100000751119 [0,1,0,0,0,0|2,0,0]=3 5145 B15R1.1409 O=C(Cc1ccccc1Br)NCCCO 527a_100000182051_100000751119 [0,1,0,0,0,0|2,0,0]=3 5146 B15R1.1409 O=C(Cc1ccccc1Br)NNCCO 22a_100000210001_100000751119 [0,1,0,0,0,0|3,0,0]=4 5147 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 11a_100015189416_100000183793 [0,1,0,0,0,0|2,0,0]=3 5148 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 1626a_100015189416_100000183793 [0,1,0,0,0,0|2,0,0]=3 5149 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 240690a_100015189416_100000183793 [0,1,0,0,0,0|2,0,0]=3 5150 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCF 527a_100015189416_100000183793 [0,1,0,0,0,0|2,0,0]=3 5151 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO 240690a_100000182051_100000183793 [0,1,0,0,0,0|2,0,0]=3 5152 B15R1.1409 O=C(Cc1ccccc1Cl)NCCCO 527a_100000182051_100000183793 [0,1,0,0,0,0|2,0,0]=3 5153 B15R1.1409 O=C(Cc1ccccc1Cl)NNCCO 22a_100000210001_100000183793 [0,1,0,0,0,0|3,0,0]=4 5154 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 11a_100015189416_100000212012 [0,1,0,0,0,0|2,0,0]=3 5155 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 1626a_100015189416_100000212012 [0,1,0,0,0,0|2,0,0]=3 5156 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 240690a_100015189416_100000212012 [0,1,0,0,0,0|2,0,0]=3 5157 B15R1.1409 O=C(Cc1ccccc1F)NCCCF 527a_100015189416_100000212012 [0,1,0,0,0,0|2,0,0]=3 5158 B15R1.1409 O=C(Cc1ccccc1F)NCCCO 240690a_100000182051_100000212012 [0,1,0,0,0,0|2,0,0]=3 5159 B15R1.1409 O=C(Cc1ccccc1F)NCCCO 527a_100000182051_100000212012 [0,1,0,0,0,0|2,0,0]=3 5160 B15R1.1409 O=C(Cc1ccccc1F)NNCCO 22a_100000210001_100000212012 [0,1,0,0,0,0|3,0,0]=4 5161 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 11a_100015189416_100000036491 [0,1,0,0,0,0|2,0,0]=3 5162 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 1626a_100015189416_100000036491 [0,1,0,0,0,0|2,0,0]=3 5163 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 240690a_100015189416_100000036491 [0,1,0,0,0,0|2,0,0]=3 5164 B15R1.1409 O=C(Cc1ccccc1I)NCCCF 527a_100015189416_100000036491 [0,1,0,0,0,0|2,0,0]=3 5165 B15R1.1409 O=C(Cc1ccccc1I)NCCCO 240690a_100000182051_100000036491 [0,1,0,0,0,0|2,0,0]=3 5166 B15R1.1409 O=C(Cc1ccccc1I)NCCCO 527a_100000182051_100000036491 [0,1,0,0,0,0|2,0,0]=3 5167 B15R1.1409 O=C(Cc1ccccc1I)NNCCO 22a_100000210001_100000036491 [0,1,0,0,0,0|3,0,0]=4 5168 B15R1.1409 O=C(Cc1ccccc1O)NCCCF 240690a_100015189416_100000743006 [0,1,0,0,0,0|2,0,0]=3 5169 B15R1.1409 O=C(Cc1ccccc1O)NCCCF 527a_100015189416_100000743006 [0,1,0,0,0,0|2,0,0]=3 5170 B15R1.1409 O=C(Cc1ccccc1O)NCCCO 240690a_100000182051_100000743006 [0,1,0,0,0,0|2,0,0]=3 5171 B15R1.1409 O=C(Cc1ccccc1O)NCCCO 527a_100000182051_100000743006 [0,1,0,0,0,0|2,0,0]=3 5172 B15R1.1409 O=C(Cc1ccccc1O)NNCCO 22a_100000210001_100000743006 [0,1,0,0,0,0|3,0,0]=4 5173 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCF 11a_100015189416_100000093521 [0,1,0,0,0,0|3,0,0]=4 5174 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCF 1626a_100015189416_100000093521 [0,1,0,0,0,0|3,0,0]=4 5175 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCF 240690a_100015189416_100000093521 [0,1,0,0,0,0|3,0,0]=4 5176 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCF 527a_100015189416_100000093521 [0,1,0,0,0,0|3,0,0]=4 5177 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCO 240690a_100000182051_100000093521 [0,1,0,0,0,0|3,0,0]=4 5178 B15R1.1409 O=C(Cc1cccnc1Cl)NCCCO 527a_100000182051_100000093521 [0,1,0,0,0,0|3,0,0]=4 5179 B15R1.1409 O=C(Cc1ncccc1Br)NCCCF 11a_100015189416_200012357574 [0,1,0,0,0,0|3,0,0]=4 5180 B15R1.1409 O=C(Cc1ncccc1Br)NCCCF 240690a_100015189416_200012357574 [0,1,0,0,0,0|3,0,0]=4 5181 B15R1.1409 O=C(Cc1ncccc1Br)NCCCO 240690a_100000182051_200012357574 [0,1,0,0,0,0|3,0,0]=4 5182 B15R1.1409 O=C(Cc1ncccc1Cl)NCCCF 11a_100015189416_100011998755 [0,1,0,0,0,0|3,0,0]=4 5183 B15R1.1409 O=C(Cc1ncccc1Cl)NCCCF 240690a_100015189416_100011998755 [0,1,0,0,0,0|3,0,0]=4 5184 B15R1.1409 O=C(Cc1ncccc1Cl)NCCCF 527a_100015189416_100011998755 [0,1,0,0,0,0|3,0,0]=4 5185 B15R1.1409 O=C(Cc1ncccc1Cl)NCCCO 240690a_100000182051_100011998755 [0,1,0,0,0,0|3,0,0]=4 5186 B15R1.1409 O=C(Cc1ncccc1Cl)NCCCO 527a_100000182051_100011998755 [0,1,0,0,0,0|3,0,0]=4 5187 B15R1.1409 O=C(Cn1ccccc1=O)NCCCF 1626a_100015189416_100000189665 [0,1,0,0,0,0|3,0,0]=4 5188 B15R1.1409 O=C(Cn1ccccc1=O)NCCCF 240690a_100015189416_100000189665 [0,1,0,0,0,0|3,0,0]=4 5189 B15R1.1409 O=C(Cn1ccccc1=O)NCCCF 527a_100015189416_100000189665 [0,1,0,0,0,0|3,0,0]=4 5190 B15R1.1409 O=C(Cn1ccccc1=O)NCCCO 240690a_100000182051_100000189665 [0,1,0,0,0,0|3,0,0]=4 5191 B15R1.1409 O=C(Cn1ccccc1=O)NCCCO 527a_100000182051_100000189665 [0,1,0,0,0,0|3,0,0]=4 5192 B15R1.1409 O=C(NCCCF)Nc1ccccc1Br 2430a_100000210017_100015189416 [0,1,0,0,0,0|3,0,0]=4 5193 B15R1.1409 O=C(NCCCF)Nc1ccccc1Cl 2430a_100000185783_100015189416 [0,1,0,0,0,0|3,0,0]=4 5194 B15R1.1409 O=C(NCCCF)Nc1ccccc1F 2430a_100000210422_100015189416 [0,1,0,0,0,0|3,0,0]=4 5195 B15R1.1409 O=C(NCCCF)Nc1ccccc1I 2430a_100000210053_100015189416 [0,1,0,0,0,0|3,0,0]=4 5196 B15R1.1409 O=C(NCCCF)Nc1ccccc1O 2430a_100000185747_100015189416 [0,1,0,0,0,0|3,0,0]=4 5197 B15R1.1409 O=C(NCCCO)Nc1ccccc1Br 2430a_100000210017_100000182051 [0,1,0,0,0,0|3,0,0]=4 5198 B15R1.1409 O=C(NCCCO)Nc1ccccc1Cl 2430a_100000185783_100000182051 [0,1,0,0,0,0|3,0,0]=4 5199 B15R1.1409 O=C(NCCCO)Nc1ccccc1F 2430a_100000210422_100000182051 [0,1,0,0,0,0|3,0,0]=4 5200 B15R1.1409 O=C(NCCCO)Nc1ccccc1I 2430a_100000210053_100000182051 [0,1,0,0,0,0|3,0,0]=4 5201 B15R1.1409 O=C(NCCCO)Nc1ccccc1O 2430a_100000185747_100000182051 [0,1,0,0,0,0|3,0,0]=4 5202 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Br 62a_100020589338_200025704644 [0,1,0,0,0,0|2,0,0]=3 5203 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Br 62a_200025704644_100020589338 [0,1,0,0,0,0|2,0,0]=3 5204 B15R1.1409 [13CH3]SCCOC(=O)Nc1ccccc1Cl 62a_200025704644_200000178450 [0,1,0,0,0,0|2,0,0]=3 5205 B15R1.2074 CC(C)(Cc1ccccc1)OCCCF 7a_100011215222_100011934791 [0,1,0,0,0,0|2,0,1]=4 5206 B15R1.2074 CC(C)(Cc1ccccc1)OCCCO 7a_100011215222_100011215043 [0,1,0,0,0,0|2,0,1]=4 5207 B15R1.2074 CCCCCS(=O)(=O)Nc1ccccc1 20a_100000106764_100000753860 [0,1,0,0,0,0|3,0,0]=4 5208 B15R1.2074 CCCCCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000753860 [0,1,0,0,0,0|3,0,0]=4 5209 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 270084a_100000102301_100000211737 [0,1,0,0,0,0|2,0,0]=3 5210 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 274078a_100000102301_100000211737 [0,1,0,0,0,0|2,0,0]=3 5211 B15R1.2074 CCCCNS(=O)(=O)Cc1ccccc1 40a_100000102301_100000235865 [0,1,0,0,0,0|2,0,0]=3 5212 B15R1.2074 CCCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000210211 [0,1,0,0,0,0|1,0,1]=3 5213 B15R1.2074 CCCCOC(F)(F)Oc1ccccc1 7a_100000210227_200000057402 [0,1,0,0,0,0|2,0,1]=4 5214 B15R1.2074 CCCNNS(=O)(=O)Cc1ccccc1 40a_100000740057_100000235865 [0,1,0,0,0,0|3,0,0]=4 5215 B15R1.2074 COCCNS(=O)(=O)Cc1ccccc1 270084a_100000209980_100000211737 [0,1,0,0,0,0|3,0,0]=4 5216 B15R1.2074 COCCNS(=O)(=O)Cc1ccccc1 274078a_100000209980_100000211737 [0,1,0,0,0,0|3,0,0]=4 5217 B15R1.2074 COCCNS(=O)(=O)Cc1ccccc1 40a_100000209980_100000235865 [0,1,0,0,0,0|3,0,0]=4 5218 B15R1.2074 COCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000233755 [0,1,0,0,0,0|2,0,1]=4 5219 B15R1.2074 CSCCNS(=O)(=O)Cc1ccccc1 270084a_100020590264_100000211737 [0,1,0,0,0,0|3,0,0]=4 5220 B15R1.2074 CSCCNS(=O)(=O)Cc1ccccc1 274078a_100020590264_100000211737 [0,1,0,0,0,0|3,0,0]=4 5221 B15R1.2074 CSCCNS(=O)(=O)Cc1ccccc1 40a_100020590264_100000235865 [0,1,0,0,0,0|3,0,0]=4 5222 B15R1.2074 CSCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000212216 [0,1,0,0,0,0|2,0,1]=4 5223 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCF 270084a_100015189416_100000211737 [0,1,0,0,0,0|3,0,0]=4 5224 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCF 274078a_100015189416_100000211737 [0,1,0,0,0,0|3,0,0]=4 5225 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCF 40a_100015189416_100000235865 [0,1,0,0,0,0|3,0,0]=4 5226 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO 270084a_100000182051_100000211737 [0,1,0,0,0,0|3,0,0]=4 5227 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO 274078a_100000182051_100000211737 [0,1,0,0,0,0|3,0,0]=4 5228 B15R1.2074 O=S(=O)(Cc1ccccc1)NCCCO 40a_100000182051_100000235865 [0,1,0,0,0,0|3,0,0]=4 5229 B13R0.195 C=CC=CC(=O)CC(=O)CCCCC 1458a_100016291481_200012276598 [0,0,1,0,0,0|2,0,0]=3 5230 B13R0.195 C=CC=CC(=O)CC(=O)NCCCC 1458a_100016291481_100000182744 [0,0,1,0,0,0|2,0,0]=3 5231 B13R0.195 C=CC=CC(=O)CC(=O)NCCOC 1458a_100016291481_100000183275 [0,0,1,0,0,0|3,0,0]=4 5232 B13R0.195 C=CC=CC(=O)CC(=O)OCCCC 1458a_100016291481_100000211628 [0,0,1,0,0,0|1,0,0]=2 5233 B13R0.195 C=CC=CC(=O)CC(=O)OCCOC 1458a_100016291481_200000040189 [0,0,1,0,0,0|2,0,0]=3 5234 B13R0.195 C=CCCC(=O)CC(=O)OCCCC 1458a_100000749702_100000211628 [0,0,1,0,0,0|1,0,2]=4 5235 B13R0.195 CC=CCC(=O)CC(=O)OCCCC 1458a_100121576822_100000211628 [0,0,1,0,0,0|1,0,2]=4 5236 B13R0.195 CCC=CC(=O)CC(=O)OCCCC 1458a_100000212282_100000211628 [0,0,1,0,0,0|1,0,2]=4 5237 B13R0.195 CCCCOC(=O)CC(=O)C=COC 1458a_100016268678_100000211628 [0,0,1,0,0,0|2,0,1]=4 5238 B15R2.31 CN1CCOC(C1)Cc2ccccc2 2230a_100000697294_200000210301 [0,0,0,1,0,0|2,0,1]=4 5239 B15R2.31 CN1CCOC(C1)Cc2ccccc2 269982a_100000697294_200000210301 [0,0,0,1,0,0|2,0,1]=4 5240 B15R2.31 CN1CCOC(C1)Cc2ccccc2 34a_100000697294_200000210301 [0,0,0,1,0,0|2,0,1]=4 5241 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccc2 2230a_100000717927_100015291786 [0,0,0,1,0,0|3,0,0]=4 5242 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccc2 269982a_100000717927_100000211182 [0,0,0,1,0,0|3,0,0]=4 5243 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccc2 270004a_100000717927_100015611070 [0,0,0,1,0,0|3,0,0]=4 5244 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccc2 34a_100000717927_100015291786 [0,0,0,1,0,0|3,0,0]=4 5245 B15R2.31 [13CH3]N1CCOC(C1)Cc2ccccc2 2230a_100000697294_200025704644 [0,0,0,1,0,0|2,0,1]=4 5246 B15R2.31 [13CH3]N1CCOC(C1)Cc2ccccc2 269982a_100000697294_200025704644 [0,0,0,1,0,0|2,0,1]=4 5247 B15R2.31 [13CH3]N1CCOC(C1)Cc2ccccc2 34a_100000697294_200025704644 [0,0,0,1,0,0|2,0,1]=4 5248 B15R2.64 CC(Cc1ccccc1)N2CCCC2 269982a_100000188435_200011218536 [0,0,0,1,0,0|2,0,1]=4 5249 B15R2.64 CN(Cc1ccccc1)C2CCCC2 2230a_100000186898_100000179811 [0,0,0,1,0,0|3,0,0]=4 5250 B15R2.64 CN(Cc1ccccc1)C2CCCC2 2230a_100000207505_100015291786 [0,0,0,1,0,0|3,0,0]=4 5251 B15R2.64 CN(Cc1ccccc1)C2CCCC2 269982a_100000186898_100000179811 [0,0,0,1,0,0|3,0,0]=4 5252 B15R2.64 CN(Cc1ccccc1)C2CCCC2 269982a_100000207505_100000211182 [0,0,0,1,0,0|3,0,0]=4 5253 B15R2.64 CN(Cc1ccccc1)C2CCCC2 270004a_100000186898_100000210133 [0,0,0,1,0,0|3,0,0]=4 5254 B15R2.64 CN(Cc1ccccc1)C2CCCC2 270004a_100000207505_100015611070 [0,0,0,1,0,0|3,0,0]=4 5255 B15R2.64 CN(Cc1ccccc1)C2CCCC2 34a_100000207505_100015291786 [0,0,0,1,0,0|3,0,0]=4 5256 B15R2.64 O=C(C[n+]1ccccc1)C2CCCC2 1458a_200000086051_100000179811 [0,0,0,1,0,0|2,0,0]=3 5257 B15R2.64 O=C(C[n+]1ccccc1)C2CCOC2 1458a_200000086051_100000690089 [0,0,0,1,0,0|3,0,0]=4 5258 B15R2.64 O=C(C[n+]1ccccc1)N2CCCC2 240690a_100000188435_200000086051 [0,0,0,1,0,0|2,0,0]=3 5259 B15R2.64 O=C(C[n+]1ccccc1)N2CCCC2 527a_100000188435_200000086051 [0,0,0,1,0,0|2,0,0]=3 5260 B15R2.64 O=C(C[n+]1ccccc1)N2CCSC2 11a_100011215254_200000086051 [0,0,0,1,0,0|3,0,0]=4 5261 B15R2.64 O=C(C[n+]1ccccc1)N2CCSC2 240690a_100011215254_200000086051 [0,0,0,1,0,0|3,0,0]=4 5262 B15R2.64 O=C(C[n+]1ccccc1)N2CCSC2 527a_100011215254_200000086051 [0,0,0,1,0,0|3,0,0]=4 5263 B15R2.64 O=C(Cc1ccccc1)C2=CCCC2 1458a_100000038896_100015291786 [0,0,0,1,0,0|1,0,1]=3 5264 B15R2.64 O=C(Cc1ccccc1)C2=CCOC2 1458a_100000139269_100015291786 [0,0,0,1,0,0|2,0,1]=4 5265 B15R2.64 O=C(Cc1ccccc1)C2=COCC2 1458a_100000750620_100015291786 [0,0,0,1,0,0|2,0,1]=4 5266 B15R2.64 O=C(Cc1ccccc1)C2CC=CC2 1458a_100000759439_100015291786 [0,0,0,1,0,0|1,0,2]=4 5267 B15R2.64 O=C(Cc1ccccc1)C2CCCC2 1458a_100000210718_100015291786 [0,0,0,1,0,0|1,0,0]=2 5268 B15R2.64 O=C(Cc1ccccc1)C2CCCS2 1458a_100012002731_100015291786 [0,0,0,1,0,0|2,0,0]=3 5269 B15R2.64 O=C(Cc1ccccc1)C2CCOC2 1458a_100011219752_100015291786 [0,0,0,1,0,0|2,0,0]=3 5270 B15R2.64 O=C(Cc1ccccc1)[C@@H]2CCCO2 1458a_100000686382_100015291786 [0,0,0,1,0,0|2,0,0]=3 5271 B15R2.64 O=C(Cc1ccccn1)C2=CCCC2 1458a_100000038896_100000721315 [0,0,0,1,0,0|2,0,1]=4 5272 B15R2.64 O=C(Cc1ccccn1)C2CCCC2 1458a_100000210718_100000721315 [0,0,0,1,0,0|2,0,0]=3 5273 B15R2.64 O=C(Cc1ccccn1)C2CCCC2 1458a_100000233486_100000179811 [0,0,0,1,0,0|2,0,0]=3 5274 B15R2.64 O=C(Cc1ccccn1)C2CCCS2 1458a_100012002731_100000721315 [0,0,0,1,0,0|3,0,0]=4 5275 B15R2.64 O=C(Cc1ccccn1)C2CCOC2 1458a_100000233486_100000690089 [0,0,0,1,0,0|3,0,0]=4 5276 B15R2.64 O=C(Cc1ccccn1)C2CCOC2 1458a_100011219752_100000721315 [0,0,0,1,0,0|3,0,0]=4 5277 B15R2.64 O=C(Cc1ccccn1)N2CCSC2 11a_100011215254_100000233486 [0,0,0,1,0,0|3,0,0]=4 5278 B15R2.64 O=C(Cc1ccccn1)[C@@H]2CCCO2 1458a_100000686382_100000721315 [0,0,0,1,0,0|3,0,0]=4 5279 B15R2.64 O=C(Cc1cccnc1)C2=CCCC2 1458a_100000038896_100000733263 [0,0,0,1,0,0|2,0,1]=4 5280 B15R2.64 O=C(Cc1cccnc1)C2CCCC2 1458a_100000210718_100000733263 [0,0,0,1,0,0|2,0,0]=3 5281 B15R2.64 O=C(Cc1cccnc1)C2CCCC2 1458a_100000737805_100000179811 [0,0,0,1,0,0|2,0,0]=3 5282 B15R2.64 O=C(Cc1cccnc1)C2CCCS2 1458a_100012002731_100000733263 [0,0,0,1,0,0|3,0,0]=4 5283 B15R2.64 O=C(Cc1cccnc1)C2CCOC2 1458a_100000737805_100000690089 [0,0,0,1,0,0|3,0,0]=4 5284 B15R2.64 O=C(Cc1cccnc1)C2CCOC2 1458a_100011219752_100000733263 [0,0,0,1,0,0|3,0,0]=4 5285 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 240690a_100000188435_100000737805 [0,0,0,1,0,0|2,0,0]=3 5286 B15R2.64 O=C(Cc1cccnc1)N2CCCC2 527a_100000188435_100000737805 [0,0,0,1,0,0|2,0,0]=3 5287 B15R2.64 O=C(Cc1cccnc1)N2CCSC2 11a_100011215254_100000737805 [0,0,0,1,0,0|3,0,0]=4 5288 B15R2.64 O=C(Cc1cccnc1)N2CCSC2 240690a_100011215254_100000737805 [0,0,0,1,0,0|3,0,0]=4 5289 B15R2.64 O=C(Cc1cccnc1)N2CCSC2 527a_100011215254_100000737805 [0,0,0,1,0,0|3,0,0]=4 5290 B15R2.64 O=C(Cc1cccnc1)[C@@H]2CCCO2 1458a_100000686382_100000733263 [0,0,0,1,0,0|3,0,0]=4 5291 B15R2.64 O=C(Cc1cccnn1)C2CCCC2 1458a_100000210718_100016990269 [0,0,0,1,0,0|3,0,0]=4 5292 B15R2.64 O=C(Cc1ccncc1)C2=CCCC2 1458a_100000038896_100000705612 [0,0,0,1,0,0|2,0,1]=4 5293 B15R2.64 O=C(Cc1ccncc1)C2CCCC2 1458a_100000210718_100000705612 [0,0,0,1,0,0|2,0,0]=3 5294 B15R2.64 O=C(Cc1ccncc1)C2CCCS2 1458a_100012002731_100000705612 [0,0,0,1,0,0|3,0,0]=4 5295 B15R2.64 O=C(Cc1ccncc1)C2CCOC2 1458a_100011219752_100000705612 [0,0,0,1,0,0|3,0,0]=4 5296 B15R2.64 O=C(Cc1ccncc1)N2CCCC2 240690a_100000188435_100011201483 [0,0,0,1,0,0|2,0,0]=3 5297 B15R2.64 O=C(Cc1ccncc1)N2CCSC2 11a_100011215254_100011201483 [0,0,0,1,0,0|3,0,0]=4 5298 B15R2.64 O=C(Cc1ccncc1)N2CCSC2 240690a_100011215254_100011201483 [0,0,0,1,0,0|3,0,0]=4 5299 B15R2.64 O=C(Cc1ccncc1)[C@@H]2CCCO2 1458a_100000686382_100000705612 [0,0,0,1,0,0|3,0,0]=4 5300 B15R2.64 O=C(Cc1cnccn1)C2CCCC2 1458a_100000210718_100016995436 [0,0,0,1,0,0|3,0,0]=4 5301 B15R2.64 O=C(Cc1cnccn1)N2CCCC2 240690a_100000188435_100000726051 [0,0,0,1,0,0|3,0,0]=4 5302 B15R2.64 O=C(Cc1cnccn1)N2CCCC2 527a_100000188435_100000726051 [0,0,0,1,0,0|3,0,0]=4 5303 B15R2.64 O=C(Cc1cncnc1)C2CCCC2 1458a_100000210718_100015196519 [0,0,0,1,0,0|3,0,0]=4 5304 B15R2.64 O=C(Cc1cncnc1)C2CCCC2 1458a_100000721575_100000179811 [0,0,0,1,0,0|3,0,0]=4 5305 B15R2.64 O=C(Cc1cncnc1)N2CCCC2 240690a_100000188435_100000721575 [0,0,0,1,0,0|3,0,0]=4 5306 B15R2.64 O=C(Cc1cncnc1)N2CCCC2 527a_100000188435_100000721575 [0,0,0,1,0,0|3,0,0]=4 5307 B15R2.64 O=C(Cc1ncccn1)C2CCCC2 1458a_100000210718_100000703007 [0,0,0,1,0,0|3,0,0]=4 5308 B15R2.64 O=C(Nc1ccccc1)C2=CCCC2 11a_100000106764_100000038896 [0,0,0,1,0,0|2,0,1]=4 5309 B15R2.64 O=C(Nc1ccccc1)C2=CCCC2 1626a_100000106764_100000038896 [0,0,0,1,0,0|2,0,1]=4 5310 B15R2.64 O=C(Nc1ccccc1)C2=CCCC2 22a_100000106764_100000038896 [0,0,0,1,0,0|2,0,1]=4 5311 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 11a_100000106764_100000210718 [0,0,0,1,0,0|2,0,0]=3 5312 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 1626a_100000106764_100000210718 [0,0,0,1,0,0|2,0,0]=3 5313 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 22a_100000106764_100000210718 [0,0,0,1,0,0|2,0,0]=3 5314 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 527a_100000106764_100000210718 [0,0,0,1,0,0|2,0,0]=3 5315 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 11a_100000106764_100012002731 [0,0,0,1,0,0|3,0,0]=4 5316 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 1626a_100000106764_100012002731 [0,0,0,1,0,0|3,0,0]=4 5317 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 22a_100000106764_100012002731 [0,0,0,1,0,0|3,0,0]=4 5318 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 527a_100000106764_100012002731 [0,0,0,1,0,0|3,0,0]=4 5319 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 11a_100000106764_100011219752 [0,0,0,1,0,0|3,0,0]=4 5320 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 1626a_100000106764_100011219752 [0,0,0,1,0,0|3,0,0]=4 5321 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 22a_100000106764_100011219752 [0,0,0,1,0,0|3,0,0]=4 5322 B15R2.64 O=C(Nc1ccccc1)C2CCOC2 527a_100000106764_100011219752 [0,0,0,1,0,0|3,0,0]=4 5323 B15R2.64 O=C(Nc1ccccc1)N2CCCC2 2430a_100000106764_100000188435 [0,0,0,1,0,0|2,0,0]=3 5324 B15R2.64 O=C(Nc1ccccc1)N2CCSC2 2430a_100000106764_100011215254 [0,0,0,1,0,0|3,0,0]=4 5325 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 11a_100000106764_100000686382 [0,0,0,1,0,0|3,0,0]=4 5326 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 1626a_100000106764_100000686382 [0,0,0,1,0,0|3,0,0]=4 5327 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 22a_100000106764_100000686382 [0,0,0,1,0,0|3,0,0]=4 5328 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 527a_100000106764_100000686382 [0,0,0,1,0,0|3,0,0]=4 5329 B15R2.78 CCCCN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100000210211 [0,0,0,1,0,0|2,0,1]=4 5330 B15R2.78 CCCCN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000210211 [0,0,0,1,0,0|2,0,1]=4 5331 B15R2.78 CCCCN1C[C@@H]1Cc2ccccc2 34a_100016998360_100000210210 [0,0,0,1,0,0|2,0,1]=4 5332 B15R2.491 O=C(C[n+]1ccccc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_200000086051 [0,0,0,1,0,0|3,0,0]=4 5333 B15R2.491 O=C(C[n+]1ccccc1)N[C@@H]2C[C@@H]2F 527a_100015190264_200000086051 [0,0,0,1,0,0|3,0,0]=4 5334 B15R2.491 O=C(C[n+]1ccccc1)N[C@@H]2C[C@H]2F 11a_100025746932_200000086051 [0,0,0,1,0,0|3,0,0]=4 5335 B15R2.491 O=C(C[n+]1ccccc1)N[C@@H]2C[C@H]2F 240690a_100025746932_200000086051 [0,0,0,1,0,0|3,0,0]=4 5336 B15R2.491 O=C(C[n+]1ccccc1)N[C@@H]2C[C@H]2F 527a_100025746932_200000086051 [0,0,0,1,0,0|3,0,0]=4 5337 B15R2.491 O=C(Cc1ccccn1)N[C@@H]2C[C@H]2F 11a_100025746932_100000233486 [0,0,0,1,0,0|3,0,0]=4 5338 B15R2.491 O=C(Cc1cccnc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000737805 [0,0,0,1,0,0|3,0,0]=4 5339 B15R2.491 O=C(Cc1cccnc1)N[C@@H]2C[C@@H]2F 527a_100015190264_100000737805 [0,0,0,1,0,0|3,0,0]=4 5340 B15R2.491 O=C(Cc1cccnc1)N[C@@H]2C[C@H]2F 11a_100025746932_100000737805 [0,0,0,1,0,0|3,0,0]=4 5341 B15R2.491 O=C(Cc1cccnc1)N[C@@H]2C[C@H]2F 240690a_100025746932_100000737805 [0,0,0,1,0,0|3,0,0]=4 5342 B15R2.491 O=C(Cc1cccnc1)N[C@@H]2C[C@H]2F 527a_100025746932_100000737805 [0,0,0,1,0,0|3,0,0]=4 5343 B15R2.491 O=C(Cc1ccncc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_100011201483 [0,0,0,1,0,0|3,0,0]=4 5344 B15R2.491 O=C(Cc1ccncc1)N[C@@H]2C[C@H]2F 11a_100025746932_100011201483 [0,0,0,1,0,0|3,0,0]=4 5345 B15R2.491 O=C(Cc1ccncc1)N[C@@H]2C[C@H]2F 240690a_100025746932_100011201483 [0,0,0,1,0,0|3,0,0]=4 5346 B15R2.491 O=C(Nc1ccccc1)N[C@@H]2C[C@@H]2F 2430a_100000106764_100015190264 [0,0,0,1,0,0|3,0,0]=4 5347 B15R2.491 O=C(Nc1ccccc1)N[C@@H]2C[C@H]2F 2430a_100000106764_100025746932 [0,0,0,1,0,0|3,0,0]=4 5348 B15R2.541 CN1CCNC(=O)C1c2ccccc2 2230a_100102954019_200000210301 [0,0,0,1,0,0|2,0,0]=3 5349 B15R2.541 CN1CCNC(=O)C1c2ccccc2 269982a_100102954019_200000210301 [0,0,0,1,0,0|2,0,0]=3 5350 B15R2.541 [13CH3]N1CCNC(=O)C1c2ccccc2 2230a_100102954019_200025704644 [0,0,0,1,0,0|2,0,0]=3 5351 B15R2.541 [13CH3]N1CCNC(=O)C1c2ccccc2 269982a_100102954019_200025704644 [0,0,0,1,0,0|2,0,0]=3 5352 B15R2.1122 CC1CCN1C(=O)C[n+]2ccccc2 11a_100000755817_200000086051 [0,0,0,1,0,0|2,0,0]=3 5353 B15R2.1122 CC1CCN1C(=O)C[n+]2ccccc2 240690a_100000755817_200000086051 [0,0,0,1,0,0|2,0,0]=3 5354 B15R2.1122 CC1CCN1C(=O)C[n+]2ccccc2 527a_100000755817_200000086051 [0,0,0,1,0,0|2,0,0]=3 5355 B15R2.1122 CC1CCN1C(=O)Cc2ccccn2 11a_100000755817_100000233486 [0,0,0,1,0,0|2,0,0]=3 5356 B15R2.1122 CC1CCN1C(=O)Cc2cccnc2 11a_100000755817_100000737805 [0,0,0,1,0,0|2,0,0]=3 5357 B15R2.1122 CC1CCN1C(=O)Cc2cccnc2 240690a_100000755817_100000737805 [0,0,0,1,0,0|2,0,0]=3 5358 B15R2.1122 CC1CCN1C(=O)Cc2cccnc2 527a_100000755817_100000737805 [0,0,0,1,0,0|2,0,0]=3 5359 B15R2.1122 CC1CCN1C(=O)Cc2ccncc2 11a_100000755817_100011201483 [0,0,0,1,0,0|2,0,0]=3 5360 B15R2.1122 CC1CCN1C(=O)Cc2ccncc2 240690a_100000755817_100011201483 [0,0,0,1,0,0|2,0,0]=3 5361 B15R2.1122 CC1CCN1C(=O)Cc2cnccn2 11a_100000755817_100000726051 [0,0,0,1,0,0|3,0,0]=4 5362 B15R2.1122 CC1CCN1C(=O)Cc2cnccn2 240690a_100000755817_100000726051 [0,0,0,1,0,0|3,0,0]=4 5363 B15R2.1122 CC1CCN1C(=O)Cc2cnccn2 527a_100000755817_100000726051 [0,0,0,1,0,0|3,0,0]=4 5364 B15R2.1122 CC1CCN1C(=O)Cc2cncnc2 11a_100000755817_100000721575 [0,0,0,1,0,0|3,0,0]=4 5365 B15R2.1122 CC1CCN1C(=O)Cc2cncnc2 240690a_100000755817_100000721575 [0,0,0,1,0,0|3,0,0]=4 5366 B15R2.1122 CC1CCN1C(=O)Cc2cncnc2 527a_100000755817_100000721575 [0,0,0,1,0,0|3,0,0]=4 5367 B15R2.1122 CC1CCN1C(=O)Nc2ccccc2 2430a_100000106764_100000755817 [0,0,0,1,0,0|2,0,0]=3 5368 B15R2.1122 CC1CCN1C(C)Cc2ccccc2 269982a_100000755817_200011218536 [0,0,0,1,0,0|2,0,1]=4 5369 B15R2.1122 CC1CCN1C(C)Cc2ccccc2 34a_100000755817_200011218536 [0,0,0,1,0,0|2,0,1]=4 5370 B15R2.1256 CC(Cc1ccccc1)NCC2CC2 34a_100000735609_200011218536 [0,0,0,1,0,0|2,0,1]=4 5371 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 34a_100000211283_200011218536 [0,0,0,1,0,0|1,0,1]=3 5372 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 34a_100000748627_100000742324 [0,0,0,1,0,0|1,0,1]=3 5373 B15R2.1256 CC(Cc1ccccc1)OCC2CC2 7a_100000748627_100000742324 [0,0,0,1,0,0|1,0,1]=3 5374 B15R2.1256 CC(Cc1ccccc1)OCC2CO2 34a_100000748627_102125554688 [0,0,0,1,0,0|2,0,1]=4 5375 B15R2.1256 CC(Cc1ccccc1)OCC2CO2 7a_100000748627_102125554688 [0,0,0,1,0,0|2,0,1]=4 5376 B15R2.1256 CC(Cc1ccccc1)OCC2CS2 7a_100000748627_100000031435 [0,0,0,1,0,0|2,0,1]=4 5377 B15R2.1256 CC(Cc1ccccc1)OC[C@@H]2CO2 34a_100000757423_200011218536 [0,0,0,1,0,0|2,0,1]=4 5378 B15R2.1256 CC(Cc1ccccc1)OC[C@@H]2CO2 7a_100000748627_100000745022 [0,0,0,1,0,0|2,0,1]=4 5379 B15R2.1256 CC(Cc1ccccc1)SCC2CC2 62a_100000756562_200011218536 [0,0,0,1,0,0|1,1,1]=4 5380 B15R2.1256 CC(Cc1ccccc1)SCC2CC2 62a_200011218536_100000742324 [0,0,0,1,0,0|1,1,1]=4 5381 B15R2.1256 CN(CCC1CC1)Cc2ccccc2 2230a_100000186898_100000694398 [0,0,0,1,0,0|3,0,0]=4 5382 B15R2.1256 CN(CCC1CC1)Cc2ccccc2 269982a_100000186898_100000694398 [0,0,0,1,0,0|3,0,0]=4 5383 B15R2.1256 O=C(C=CC1CC1)Cc2ccccc2 1458a_100102529529_100015291786 [0,0,0,1,0,0|1,0,1]=3 5384 B15R2.1256 O=C(C=CC1CC1)Cc2ccccn2 1458a_100102529529_100000721315 [0,0,0,1,0,0|2,0,1]=4 5385 B15R2.1256 O=C(C=CC1CC1)Cc2cccnc2 1458a_100102529529_100000733263 [0,0,0,1,0,0|2,0,1]=4 5386 B15R2.1256 O=C(C=CC1CC1)Cc2ccncc2 1458a_100102529529_100000705612 [0,0,0,1,0,0|2,0,1]=4 5387 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 11a_100000106764_100102529529 [0,0,0,1,0,0|2,0,1]=4 5388 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 1626a_100000106764_100102529529 [0,0,0,1,0,0|2,0,1]=4 5389 B15R2.1256 O=C(C=CC1CC1)Nc2ccccc2 22a_100000106764_100102529529 [0,0,0,1,0,0|2,0,1]=4 5390 B15R2.1256 O=C(CCC1CC1)C[n+]2ccccc2 1458a_200000086051_100000694398 [0,0,0,1,0,0|2,0,0]=3 5391 B15R2.1256 O=C(CCC1CC1)Cc2ccccc2 1458a_100000756386_100015291786 [0,0,0,1,0,0|1,0,0]=2 5392 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000233486_100000694398 [0,0,0,1,0,0|2,0,0]=3 5393 B15R2.1256 O=C(CCC1CC1)Cc2ccccn2 1458a_100000756386_100000721315 [0,0,0,1,0,0|2,0,0]=3 5394 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000737805_100000694398 [0,0,0,1,0,0|2,0,0]=3 5395 B15R2.1256 O=C(CCC1CC1)Cc2cccnc2 1458a_100000756386_100000733263 [0,0,0,1,0,0|2,0,0]=3 5396 B15R2.1256 O=C(CCC1CC1)Cc2cccnn2 1458a_100000756386_100016990269 [0,0,0,1,0,0|3,0,0]=4 5397 B15R2.1256 O=C(CCC1CC1)Cc2ccncc2 1458a_100000756386_100000705612 [0,0,0,1,0,0|2,0,0]=3 5398 B15R2.1256 O=C(CCC1CC1)Cc2cnccn2 1458a_100000756386_100016995436 [0,0,0,1,0,0|3,0,0]=4 5399 B15R2.1256 O=C(CCC1CC1)Cc2cncnc2 1458a_100000721575_100000694398 [0,0,0,1,0,0|3,0,0]=4 5400 B15R2.1256 O=C(CCC1CC1)Cc2cncnc2 1458a_100000756386_100015196519 [0,0,0,1,0,0|3,0,0]=4 5401 B15R2.1256 O=C(CCC1CC1)Cc2ncccn2 1458a_100000756386_100000703007 [0,0,0,1,0,0|3,0,0]=4 5402 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 11a_100000106764_100000756386 [0,0,0,1,0,0|2,0,0]=3 5403 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 1626a_100000106764_100000756386 [0,0,0,1,0,0|2,0,0]=3 5404 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 22a_100000106764_100000756386 [0,0,0,1,0,0|2,0,0]=3 5405 B15R2.1256 O=C(CCC1CC1)Nc2ccccc2 527a_100000106764_100000756386 [0,0,0,1,0,0|2,0,0]=3 5406 B15R2.1256 O=C(CCC1CO1)C[n+]2ccccc2 1458a_200000086051_100000732470 [0,0,0,1,0,0|3,0,0]=4 5407 B15R2.1256 O=C(CCC1CO1)Cc2ccccn2 1458a_100000233486_100000732470 [0,0,0,1,0,0|3,0,0]=4 5408 B15R2.1256 O=C(CCC1CO1)Cc2cccnc2 1458a_100000737805_100000732470 [0,0,0,1,0,0|3,0,0]=4 5409 B15R2.1256 O=C(CNC1CC1)Nc2ccccc2 34a_100000212008_100000182850 [0,0,0,1,0,0|3,0,0]=4 5410 B15R2.1256 O=C(CNC1CC1)Oc2ccccc2 34a_100000212008_100009813826 [0,0,0,1,0,0|3,0,0]=4 5411 B15R2.1256 O=C(COC1CC1)Nc2ccccc2 34a_100000246334_100000211595 [0,0,0,1,0,0|3,0,0]=4 5412 B15R2.1256 O=C(CSC1CC1)Cc2ccccc2 62a_100000233483_100000211595 [0,0,0,1,0,0|2,0,0]=3 5413 B15R2.1256 O=C(CSC1CC1)Nc2ccccc2 62a_100012148978_100000211595 [0,0,0,1,0,0|3,0,0]=4 5414 B15R2.1256 O=C(CSC1CC1)Oc2ccccc2 62a_100009813826_100000211595 [0,0,0,1,0,0|3,0,0]=4 5415 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 11a_100000735609_200000086051 [0,0,0,1,0,0|2,0,0]=3 5416 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 240690a_100000735609_200000086051 [0,0,0,1,0,0|2,0,0]=3 5417 B15R2.1256 O=C(C[n+]1ccccc1)NCC2CC2 527a_100000735609_200000086051 [0,0,0,1,0,0|2,0,0]=3 5418 B15R2.1256 O=C(C[n+]1ccccc1)NNC2CC2 22a_100000701032_200000086051 [0,0,0,1,0,0|3,0,0]=4 5419 B15R2.1256 O=C(Cc1ccccn1)NCC2CC2 11a_100000735609_100000233486 [0,0,0,1,0,0|2,0,0]=3 5420 B15R2.1256 O=C(Cc1ccccn1)NNC2CC2 22a_100000701032_100000233486 [0,0,0,1,0,0|3,0,0]=4 5421 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 11a_100000735609_100000737805 [0,0,0,1,0,0|2,0,0]=3 5422 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 240690a_100000735609_100000737805 [0,0,0,1,0,0|2,0,0]=3 5423 B15R2.1256 O=C(Cc1cccnc1)NCC2CC2 527a_100000735609_100000737805 [0,0,0,1,0,0|2,0,0]=3 5424 B15R2.1256 O=C(Cc1cccnc1)NNC2CC2 22a_100000701032_100000737805 [0,0,0,1,0,0|3,0,0]=4 5425 B15R2.1256 O=C(Cc1ccncc1)NCC2CC2 11a_100000735609_100011201483 [0,0,0,1,0,0|2,0,0]=3 5426 B15R2.1256 O=C(Cc1ccncc1)NCC2CC2 240690a_100000735609_100011201483 [0,0,0,1,0,0|2,0,0]=3 5427 B15R2.1256 O=C(Cc1ccncc1)NNC2CC2 22a_100000701032_100011201483 [0,0,0,1,0,0|3,0,0]=4 5428 B15R2.1256 O=C(Cc1cnccn1)NCC2CC2 11a_100000735609_100000726051 [0,0,0,1,0,0|3,0,0]=4 5429 B15R2.1256 O=C(Cc1cnccn1)NCC2CC2 240690a_100000735609_100000726051 [0,0,0,1,0,0|3,0,0]=4 5430 B15R2.1256 O=C(Cc1cnccn1)NCC2CC2 527a_100000735609_100000726051 [0,0,0,1,0,0|3,0,0]=4 5431 B15R2.1256 O=C(Cc1cncnc1)NCC2CC2 11a_100000735609_100000721575 [0,0,0,1,0,0|3,0,0]=4 5432 B15R2.1256 O=C(Cc1cncnc1)NCC2CC2 240690a_100000735609_100000721575 [0,0,0,1,0,0|3,0,0]=4 5433 B15R2.1256 O=C(Cc1cncnc1)NCC2CC2 527a_100000735609_100000721575 [0,0,0,1,0,0|3,0,0]=4 5434 B15R2.1256 O=C(NCC1CC1)Nc2ccccc2 2430a_100000106764_100000735609 [0,0,0,1,0,0|2,0,0]=3 5435 B15R2.1262 CCCCN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100000210211 [0,0,0,1,0,0|2,0,1]=4 5436 B15R2.1262 CCCCN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000210210 [0,0,0,1,0,0|2,0,1]=4 5437 B15R2.1435 CCCCc1c(oc2c1cccc2)C 271570a_100020621405_200010236113 [0,0,0,1,0,0|3,0,0]=4 5438 B15R2.1435 CCCCc1c(sc2c1cccc2)C 271570a_100020621405_100010002616 [0,0,0,1,0,0|3,0,0]=4 5439 B15R2.1435 CCCSC1C(=O)Nc2c1cccc2 62a_100000210303_200009996675 [0,0,0,1,0,0|3,0,0]=4 5440 B15R2.1435 CNCCn1c(=O)[nH]c2c1cccc2 2230a_106832991635_203549783246 [0,0,0,1,0,0|3,0,0]=4 5441 B15R2.1435 CNCCn1c(=O)[nH]c2c1cccc2 7a_106832991635_203549783246 [0,0,0,1,0,0|3,0,0]=4 5442 B15R2.1690 CCC1CC1C(=O)Cc2ccccc2 1458a_200011661523_100015291786 [0,0,0,1,0,0|1,0,0]=2 5443 B15R2.1690 CCC1CC1C(=O)Cc2ccccn2 1458a_200011661523_100000721315 [0,0,0,1,0,0|2,0,0]=3 5444 B15R2.1690 CCC1CC1C(=O)Cc2cccnc2 1458a_200011661523_100000733263 [0,0,0,1,0,0|2,0,0]=3 5445 B15R2.1690 CCC1CC1C(=O)Cc2cccnn2 1458a_200011661523_100016990269 [0,0,0,1,0,0|3,0,0]=4 5446 B15R2.1690 CCC1CC1C(=O)Cc2ccncc2 1458a_200011661523_100000705612 [0,0,0,1,0,0|2,0,0]=3 5447 B15R2.1690 CCC1CC1C(=O)Cc2cnccn2 1458a_200011661523_100016995436 [0,0,0,1,0,0|3,0,0]=4 5448 B15R2.1690 CCC1CC1C(=O)Cc2cncnc2 1458a_200011661523_100015196519 [0,0,0,1,0,0|3,0,0]=4 5449 B15R2.1690 CCC1CC1C(=O)Cc2ncccn2 1458a_200011661523_100000703007 [0,0,0,1,0,0|3,0,0]=4 5450 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 11a_100000106764_200011661523 [0,0,0,1,0,0|2,0,0]=3 5451 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 1626a_100000106764_200011661523 [0,0,0,1,0,0|2,0,0]=3 5452 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 22a_100000106764_200011661523 [0,0,0,1,0,0|2,0,0]=3 5453 B15R2.1690 CCC1CC1C(=O)Nc2ccccc2 527a_100000106764_200011661523 [0,0,0,1,0,0|2,0,0]=3 5454 B15R2.1690 N#C[C@@H]1C[C@H]1C(=O)Cc2ccccc2 1458a_100015294237_100015291786 [0,0,0,1,0,0|2,0,1]=4 5455 B15R2.2167 c1ccc(cc1)CN2CCCCCC2 2230a_100000185865_100015291786 [0,0,0,1,0,0|3,0,0]=4 5456 B15R2.2167 c1ccc(cc1)CN2CCCCCC2 269982a_100000185865_100000211182 [0,0,0,1,0,0|3,0,0]=4 5457 B15R2.2167 c1ccc(cc1)CN2CCCCCC2 270004a_100000185865_100015611070 [0,0,0,1,0,0|3,0,0]=4 5458 B15R2.2167 c1ccc(cc1)CN2CCCCCC2 34a_100000185865_100015291786 [0,0,0,1,0,0|3,0,0]=4 5459 B15R2.2203 BrCCCOC1Cc2ccccc2C1 34a_100011217188_100000753484 [0,0,0,1,0,0|2,0,1]=4 5460 B15R2.2203 CCCCCN1Cc2ccccc2C1 2230a_100000752595_100000210326 [0,0,0,1,0,0|3,0,0]=4 5461 B15R2.2203 CCCCCN1Cc2ccccc2C1 269982a_100000752595_100000210215 [0,0,0,1,0,0|3,0,0]=4 5462 B15R2.2203 CCCCCN1Cc2ccccc2C1 34a_100000752595_100000718602 [0,0,0,1,0,0|3,0,0]=4 5463 B15R2.2203 CCCCNC1Cc2ccccc2C1 2230a_100000753258_100000210211 [0,0,0,1,0,0|2,0,1]=4 5464 B15R2.2203 CCCCNC1Cc2ccccc2C1 34a_100000753258_100000210210 [0,0,0,1,0,0|2,0,1]=4 5465 B15R2.2203 CCCCNC1Cc2ccccc2C1 7a_106832991798_100000753484 [0,0,0,1,0,0|2,0,1]=4 5466 B15R2.2203 CCCCNc1nc2ccccc2[nH]1 27a_100000102301_100009814255 [0,0,0,1,0,0|3,0,0]=4 5467 B15R2.2203 CCCCNc1nc2ccccc2s1 27a_100000102301_100000751744 [0,0,0,1,0,0|2,1,0]=4 5468 B15R2.2203 CCCCOC1Cc2ccccc2C1 34a_100000210227_100000753484 [0,0,0,1,0,0|1,0,1]=3 5469 B15R2.2203 CCCCOC1Cc2ccccc2C1 34a_100011215286_100000210210 [0,0,0,1,0,0|1,0,1]=3 5470 B15R2.2203 CCCCOC1Cc2ccccc2C1 7a_100000210227_100000753484 [0,0,0,1,0,0|1,0,1]=3 5471 B15R2.2203 CCCCSC1Cc2ccccc2C1 62a_100000210211_100000753484 [0,0,0,1,0,0|1,1,1]=4 5472 B15R2.2203 CCCCSc1cc2ccccc2[nH]1 62a_100000210211_100010232065 [0,0,0,1,0,0|1,1,1]=4 5473 B15R2.2203 CCCCSc1cc2ccccc2o1 62a_100000210211_100010159458 [0,0,0,1,0,0|0,1,2]=4 5474 B15R2.2203 CCCCSc1cc2ccccc2s1 62a_100000210211_100009816949 [0,0,0,1,0,0|0,2,1]=4 5475 B15R2.2203 CCCCSc1nc2ccccc2[nH]1 62a_100000210211_100009814255 [0,0,0,1,0,0|2,1,0]=4 5476 B15R2.2203 CCCCSc1nc2ccccc2s1 62a_100000210211_100000751744 [0,0,0,1,0,0|1,2,0]=4 5477 B15R2.2203 CCCNN=C1Cc2ccccc2C1 4a_100000740057_100000211675 [0,0,0,1,0,0|3,0,0]=4 5478 B15R2.2203 COCCOC1Cc2ccccc2C1 34a_100000210237_100000753484 [0,0,0,1,0,0|2,0,1]=4 5479 B15R2.2203 COCCOC1Cc2ccccc2C1 34a_100011215286_100011201679 [0,0,0,1,0,0|2,0,1]=4 5480 B15R2.2203 CSCCOC1Cc2ccccc2C1 34a_100000230434_100000753484 [0,0,0,1,0,0|2,0,1]=4 5481 B15R2.2203 CSCCOC1Cc2ccccc2C1 34a_100011215286_100000212216 [0,0,0,1,0,0|2,0,1]=4 5482 B15R2.2203 CSCCOC1Cc2ccccc2C1 7a_100000230434_100000753484 [0,0,0,1,0,0|2,0,1]=4 5483 B15R2.2203 ClCCCOC1Cc2ccccc2C1 34a_100000230001_100000753484 [0,0,0,1,0,0|2,0,1]=4 5484 B15R2.2203 FCCCOC1Cc2ccccc2C1 34a_100000759539_100000753484 [0,0,0,1,0,0|2,0,1]=4 5485 B15R2.2203 FCCCOC1Cc2ccccc2C1 34a_100011215286_100011934791 [0,0,0,1,0,0|2,0,1]=4 5486 B15R2.2203 NCCCOC1Cc2ccccc2C1 34a_100000182051_100000753484 [0,0,0,1,0,0|2,0,1]=4 5487 B15R2.2203 OCCCOC1Cc2ccccc2C1 34a_100011215286_100000230001 [0,0,0,1,0,0|2,0,1]=4 5488 B15R2.16446 CC(Cc1ccccc1)NC2CCC2 34a_100000749019_200011218536 [0,0,0,1,0,0|2,0,1]=4 5489 B15R2.16446 CC(Cc1ccccc1)OC2CCC2 34a_100000748187_200011218536 [0,0,0,1,0,0|1,0,1]=3 5490 B15R2.16446 CC(Cc1ccccc1)OC2CCC2 34a_100000748627_100000749161 [0,0,0,1,0,0|1,0,1]=3 5491 B15R2.16446 CC(Cc1ccccc1)OC2COC2 34a_100000748627_100009818527 [0,0,0,1,0,0|2,0,1]=4 5492 B15R2.16446 CC(Cc1ccccc1)OC2COC2 7a_100000748627_100009818527 [0,0,0,1,0,0|2,0,1]=4 5493 B15R2.16446 CC(Cc1ccccc1)OC2CSC2 7a_100000072292_200011218536 [0,0,0,1,0,0|2,0,1]=4 5494 B15R2.16446 CC(Cc1ccccc1)SC2CCC2 62a_200011218536_100000749161 [0,0,0,1,0,0|1,1,1]=4 5495 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 2230a_100000186898_100000763275 [0,0,0,1,0,0|3,0,0]=4 5496 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 2230a_106354213860_200000210301 [0,0,0,1,0,0|3,0,0]=4 5497 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 2230a_200000750244_100015291786 [0,0,0,1,0,0|3,0,0]=4 5498 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 269982a_100000186898_100000763275 [0,0,0,1,0,0|3,0,0]=4 5499 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 269982a_106354213860_200000210301 [0,0,0,1,0,0|3,0,0]=4 5500 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 269982a_200000750244_100000211182 [0,0,0,1,0,0|3,0,0]=4 5501 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 270004a_200000750244_100015611070 [0,0,0,1,0,0|3,0,0]=4 5502 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 34a_106354213860_200000210301 [0,0,0,1,0,0|3,0,0]=4 5503 B15R2.16446 CN(Cc1ccccc1)CC2CCC2 34a_200000750244_100015291786 [0,0,0,1,0,0|3,0,0]=4 5504 B15R2.16446 O=C(C=C1CCC1)Cc2ccccc2 1458a_100000686340_100015291786 [0,0,0,1,0,0|1,0,1]=3 5505 B15R2.16446 O=C(C=C1CCC1)Cc2ccccn2 1458a_100000686340_100000721315 [0,0,0,1,0,0|2,0,1]=4 5506 B15R2.16446 O=C(C=C1CCC1)Cc2cccnc2 1458a_100000686340_100000733263 [0,0,0,1,0,0|2,0,1]=4 5507 B15R2.16446 O=C(C=C1CCC1)Cc2ccncc2 1458a_100000686340_100000705612 [0,0,0,1,0,0|2,0,1]=4 5508 B15R2.16446 O=C(C=C1CCC1)Nc2ccccc2 11a_100000106764_100000686340 [0,0,0,1,0,0|2,0,1]=4 5509 B15R2.16446 O=C(C=C1CCC1)Nc2ccccc2 22a_100000106764_100000686340 [0,0,0,1,0,0|2,0,1]=4 5510 B15R2.16446 O=C(CC1CCC1)C[n+]2ccccc2 1458a_200000086051_100000763275 [0,0,0,1,0,0|2,0,0]=3 5511 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 11a_100000106764_100000763092 [0,0,0,1,0,0|2,0,0]=3 5512 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 1626a_100000106764_100000763092 [0,0,0,1,0,0|2,0,0]=3 5513 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 22a_100000106764_100000763092 [0,0,0,1,0,0|2,0,0]=3 5514 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 527a_100000106764_100000763092 [0,0,0,1,0,0|2,0,0]=3 5515 B15R2.16446 O=C(CC1CCO1)C[n+]2ccccc2 1458a_200000086051_100000103362 [0,0,0,1,0,0|3,0,0]=4 5516 B15R2.16446 O=C(CC1COC1)C[n+]2ccccc2 1458a_200000086051_100010264016 [0,0,0,1,0,0|3,0,0]=4 5517 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 11a_100000106764_100000687760 [0,0,0,1,0,0|3,0,0]=4 5518 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 1626a_100000106764_100000687760 [0,0,0,1,0,0|3,0,0]=4 5519 B15R2.16446 O=C(CC1COC1)Nc2ccccc2 22a_100000106764_100000687760 [0,0,0,1,0,0|3,0,0]=4 5520 B15R2.16446 O=C(CN1CCC1)Nc2ccccc2 269982a_100000754969_100000182850 [0,0,0,1,0,0|3,0,0]=4 5521 B15R2.16446 O=C(CN1CCC1)Oc2ccccc2 269982a_100000754969_100009813826 [0,0,0,1,0,0|3,0,0]=4 5522 B15R2.16446 O=C(C[n+]1ccccc1)NC2CCC2 11a_100000749019_200000086051 [0,0,0,1,0,0|2,0,0]=3 5523 B15R2.16446 O=C(C[n+]1ccccc1)NC2CCC2 240690a_100000749019_200000086051 [0,0,0,1,0,0|2,0,0]=3 5524 B15R2.16446 O=C(C[n+]1ccccc1)NC2CCC2 527a_100000749019_200000086051 [0,0,0,1,0,0|2,0,0]=3 5525 B15R2.16446 O=C(C[n+]1ccccc1)NC2COC2 11a_100016991112_200000086051 [0,0,0,1,0,0|3,0,0]=4 5526 B15R2.16446 O=C(C[n+]1ccccc1)NC2COC2 240690a_100016991112_200000086051 [0,0,0,1,0,0|3,0,0]=4 5527 B15R2.16446 O=C(C[n+]1ccccc1)NC2COC2 527a_100016991112_200000086051 [0,0,0,1,0,0|3,0,0]=4 5528 B15R2.16446 O=C(C[n+]1ccccc1)NC2CSC2 11a_100016994217_200000086051 [0,0,0,1,0,0|3,0,0]=4 5529 B15R2.16446 O=C(C[n+]1ccccc1)NC2CSC2 240690a_100016994217_200000086051 [0,0,0,1,0,0|3,0,0]=4 5530 B15R2.16446 O=C(C[n+]1ccccc1)NC2CSC2 527a_100016994217_200000086051 [0,0,0,1,0,0|3,0,0]=4 5531 B15R2.16446 O=C(Cc1ccccc1)CC2CCC2 1458a_100000763092_100015291786 [0,0,0,1,0,0|1,0,0]=2 5532 B15R2.16446 O=C(Cc1ccccc1)CC2COC2 1458a_100000687760_100015291786 [0,0,0,1,0,0|2,0,0]=3 5533 B15R2.16446 O=C(Cc1ccccc1)CN2CCC2 269982a_100000754969_100000233483 [0,0,0,1,0,0|2,0,0]=3 5534 B15R2.16446 O=C(Cc1ccccn1)CC2CCC2 1458a_100000233486_100000763275 [0,0,0,1,0,0|2,0,0]=3 5535 B15R2.16446 O=C(Cc1ccccn1)CC2CCC2 1458a_100000763092_100000721315 [0,0,0,1,0,0|2,0,0]=3 5536 B15R2.16446 O=C(Cc1ccccn1)CC2CCO2 1458a_100000233486_100000103362 [0,0,0,1,0,0|3,0,0]=4 5537 B15R2.16446 O=C(Cc1ccccn1)CC2COC2 1458a_100000233486_100010264016 [0,0,0,1,0,0|3,0,0]=4 5538 B15R2.16446 O=C(Cc1ccccn1)CC2COC2 1458a_100000687760_100000721315 [0,0,0,1,0,0|3,0,0]=4 5539 B15R2.16446 O=C(Cc1ccccn1)NC2CCC2 11a_100000749019_100000233486 [0,0,0,1,0,0|2,0,0]=3 5540 B15R2.16446 O=C(Cc1ccccn1)NC2COC2 11a_100016991112_100000233486 [0,0,0,1,0,0|3,0,0]=4 5541 B15R2.16446 O=C(Cc1ccccn1)NC2CSC2 11a_100016994217_100000233486 [0,0,0,1,0,0|3,0,0]=4 5542 B15R2.16446 O=C(Cc1cccnc1)CC2CCC2 1458a_100000737805_100000763275 [0,0,0,1,0,0|2,0,0]=3 5543 B15R2.16446 O=C(Cc1cccnc1)CC2CCC2 1458a_100000763092_100000733263 [0,0,0,1,0,0|2,0,0]=3 5544 B15R2.16446 O=C(Cc1cccnc1)CC2CCO2 1458a_100000737805_100000103362 [0,0,0,1,0,0|3,0,0]=4 5545 B15R2.16446 O=C(Cc1cccnc1)CC2COC2 1458a_100000687760_100000733263 [0,0,0,1,0,0|3,0,0]=4 5546 B15R2.16446 O=C(Cc1cccnc1)CC2COC2 1458a_100000737805_100010264016 [0,0,0,1,0,0|3,0,0]=4 5547 B15R2.16446 O=C(Cc1cccnc1)NC2CCC2 11a_100000749019_100000737805 [0,0,0,1,0,0|2,0,0]=3 5548 B15R2.16446 O=C(Cc1cccnc1)NC2CCC2 240690a_100000749019_100000737805 [0,0,0,1,0,0|2,0,0]=3 5549 B15R2.16446 O=C(Cc1cccnc1)NC2CCC2 527a_100000749019_100000737805 [0,0,0,1,0,0|2,0,0]=3 5550 B15R2.16446 O=C(Cc1cccnc1)NC2COC2 11a_100016991112_100000737805 [0,0,0,1,0,0|3,0,0]=4 5551 B15R2.16446 O=C(Cc1cccnc1)NC2COC2 240690a_100016991112_100000737805 [0,0,0,1,0,0|3,0,0]=4 5552 B15R2.16446 O=C(Cc1cccnc1)NC2COC2 527a_100016991112_100000737805 [0,0,0,1,0,0|3,0,0]=4 5553 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 11a_100016994217_100000737805 [0,0,0,1,0,0|3,0,0]=4 5554 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 240690a_100016994217_100000737805 [0,0,0,1,0,0|3,0,0]=4 5555 B15R2.16446 O=C(Cc1cccnc1)NC2CSC2 527a_100016994217_100000737805 [0,0,0,1,0,0|3,0,0]=4 5556 B15R2.16446 O=C(Cc1cccnn1)CC2CCC2 1458a_100000763092_100016990269 [0,0,0,1,0,0|3,0,0]=4 5557 B15R2.16446 O=C(Cc1ccncc1)CC2CCC2 1458a_100000763092_100000705612 [0,0,0,1,0,0|2,0,0]=3 5558 B15R2.16446 O=C(Cc1ccncc1)CC2COC2 1458a_100000687760_100000705612 [0,0,0,1,0,0|3,0,0]=4 5559 B15R2.16446 O=C(Cc1ccncc1)NC2CCC2 11a_100000749019_100011201483 [0,0,0,1,0,0|2,0,0]=3 5560 B15R2.16446 O=C(Cc1ccncc1)NC2CCC2 240690a_100000749019_100011201483 [0,0,0,1,0,0|2,0,0]=3 5561 B15R2.16446 O=C(Cc1ccncc1)NC2COC2 11a_100016991112_100011201483 [0,0,0,1,0,0|3,0,0]=4 5562 B15R2.16446 O=C(Cc1ccncc1)NC2COC2 240690a_100016991112_100011201483 [0,0,0,1,0,0|3,0,0]=4 5563 B15R2.16446 O=C(Cc1ccncc1)NC2CSC2 11a_100016994217_100011201483 [0,0,0,1,0,0|3,0,0]=4 5564 B15R2.16446 O=C(Cc1ccncc1)NC2CSC2 240690a_100016994217_100011201483 [0,0,0,1,0,0|3,0,0]=4 5565 B15R2.16446 O=C(Cc1cnccn1)CC2CCC2 1458a_100000763092_100016995436 [0,0,0,1,0,0|3,0,0]=4 5566 B15R2.16446 O=C(Cc1cnccn1)NC2CCC2 11a_100000749019_100000726051 [0,0,0,1,0,0|3,0,0]=4 5567 B15R2.16446 O=C(Cc1cnccn1)NC2CCC2 240690a_100000749019_100000726051 [0,0,0,1,0,0|3,0,0]=4 5568 B15R2.16446 O=C(Cc1cnccn1)NC2CCC2 527a_100000749019_100000726051 [0,0,0,1,0,0|3,0,0]=4 5569 B15R2.16446 O=C(Cc1cncnc1)CC2CCC2 1458a_100000721575_100000763275 [0,0,0,1,0,0|3,0,0]=4 5570 B15R2.16446 O=C(Cc1cncnc1)CC2CCC2 1458a_100000763092_100015196519 [0,0,0,1,0,0|3,0,0]=4 5571 B15R2.16446 O=C(Cc1cncnc1)NC2CCC2 11a_100000749019_100000721575 [0,0,0,1,0,0|3,0,0]=4 5572 B15R2.16446 O=C(Cc1cncnc1)NC2CCC2 240690a_100000749019_100000721575 [0,0,0,1,0,0|3,0,0]=4 5573 B15R2.16446 O=C(Cc1cncnc1)NC2CCC2 527a_100000749019_100000721575 [0,0,0,1,0,0|3,0,0]=4 5574 B15R2.16446 O=C(Cc1ncccn1)CC2CCC2 1458a_100000763092_100000703007 [0,0,0,1,0,0|3,0,0]=4 5575 B15R2.16446 O=C(Nc1ccccc1)NC2CCC2 2430a_100000106764_100000749019 [0,0,0,1,0,0|2,0,0]=3 5576 B15R2.16446 O=C(Nc1ccccc1)NC2COC2 2430a_100000106764_100016991112 [0,0,0,1,0,0|3,0,0]=4 5577 B15R2.16446 O=C(Nc1ccccc1)NC2CSC2 2430a_100000106764_100016994217 [0,0,0,1,0,0|3,0,0]=4 5578 B15R2.16446 [13CH3]N(Cc1ccccc1)CC2CCC2 2230a_106354213860_200025704644 [0,0,0,1,0,0|3,0,0]=4 5579 B15R2.16446 [13CH3]N(Cc1ccccc1)CC2CCC2 269982a_106354213860_200025704644 [0,0,0,1,0,0|3,0,0]=4 5580 B15R2.16446 [13CH3]N(Cc1ccccc1)CC2CCC2 34a_106354213860_200025704644 [0,0,0,1,0,0|3,0,0]=4 5581 B13R1.24 C#CCCCC(=O)c1ccccc1 1458a_100000185807_100000731252 [0,0,0,0,1,0|1,0,2]=4 5582 B13R1.24 C#CCCNC(=O)c1ccccc1 11a_100000755551_100000185807 [0,0,0,0,1,0|1,0,2]=4 5583 B13R1.24 C#CCCNC(=O)c1ccccc1 1626a_100000755551_100000185807 [0,0,0,0,1,0|1,0,2]=4 5584 B13R1.24 C#CCCNC(=O)c1ccccc1 240690a_100000755551_100000185807 [0,0,0,0,1,0|1,0,2]=4 5585 B13R1.24 C#CCCNC(=O)c1ccccc1 527a_100000755551_100000185807 [0,0,0,0,1,0|1,0,2]=4 5586 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [0,0,0,0,1,0|1,0,2]=4 5587 B13R1.24 C=CCCNC(=O)c1ccccc1 11a_100015191253_100000185807 [0,0,0,0,1,0|1,0,2]=4 5588 B13R1.24 C=CCCNC(=O)c1ccccc1 1626a_100015191253_100000185807 [0,0,0,0,1,0|1,0,2]=4 5589 B13R1.24 C=CCCNC(=O)c1ccccc1 240690a_100015191253_100000185807 [0,0,0,0,1,0|1,0,2]=4 5590 B13R1.24 C=CCCNC(=O)c1ccccc1 527a_100015191253_100000185807 [0,0,0,0,1,0|1,0,2]=4 5591 B13R1.24 CC#CCNC(=O)c1ccccc1 11a_100000685387_100000185807 [0,0,0,0,1,0|1,0,2]=4 5592 B13R1.24 CC#CCNC(=O)c1ccccc1 1626a_100000685387_100000185807 [0,0,0,0,1,0|1,0,2]=4 5593 B13R1.24 CC#CCNC(=O)c1ccccc1 527a_100000685387_100000185807 [0,0,0,0,1,0|1,0,2]=4 5594 B13R1.24 CC(OCCCBr)c1ccccc1 34a_100011217188_100000211855 [0,0,0,0,1,0|2,0,1]=4 5595 B13R1.24 CC(OCCCCl)c1ccccc1 34a_100000230001_100000211855 [0,0,0,0,1,0|2,0,1]=4 5596 B13R1.24 CC(OCCCF)c1ccccc1 34a_100000759539_100000211855 [0,0,0,0,1,0|2,0,1]=4 5597 B13R1.24 CC(OCCCN)c1ccccc1 34a_100000182051_100000211855 [0,0,0,0,1,0|2,0,1]=4 5598 B13R1.24 CC/C=C\CC(=O)c1ccccc1 1458a_100000185807_100103147603 [0,0,0,0,1,0|1,0,2]=4 5599 B13R1.24 CCC#CCC(=O)c1ccccc1 1458a_100000185807_100009813939 [0,0,0,0,1,0|1,0,2]=4 5600 B13R1.24 CCC=NNC(=O)c1ccccc1 4a_100000184135_100000210100 [0,0,0,0,1,0|2,0,1]=4 5601 B13R1.24 CCCCCC(=O)c1ccccc1 1458a_100000185807_100000210326 [0,0,0,0,1,0|1,0,0]=2 5602 B13R1.24 CCCCCN(C)c1ccccc1 2230a_100000210012_100000210326 [0,0,0,0,1,0|3,0,0]=4 5603 B13R1.24 CCCCCN(C)c1ccccc1 2230a_200000219563_200000210301 [0,0,0,0,1,0|3,0,0]=4 5604 B13R1.24 CCCCCN(C)c1ccccc1 269982a_100000210012_100000210215 [0,0,0,0,1,0|3,0,0]=4 5605 B13R1.24 CCCCCN(C)c1ccccc1 269982a_200000219563_200000210301 [0,0,0,0,1,0|3,0,0]=4 5606 B13R1.24 CCCCCN(C)c1ccccc1 34a_100000210012_100000718602 [0,0,0,0,1,0|3,0,0]=4 5607 B13R1.24 CCCCCN(C)c1ccccc1 34a_200000219563_200000210301 [0,0,0,0,1,0|3,0,0]=4 5608 B13R1.24 CCCCCN(C)c1ccccc1 7a_200000219563_200000210301 [0,0,0,0,1,0|3,0,0]=4 5609 B13R1.24 CCCCCN([13CH3])c1ccccc1 2230a_200000219563_200025704644 [0,0,0,0,1,0|3,0,0]=4 5610 B13R1.24 CCCCCN([13CH3])c1ccccc1 269982a_200000219563_200025704644 [0,0,0,0,1,0|3,0,0]=4 5611 B13R1.24 CCCCCN([13CH3])c1ccccc1 34a_200000219563_200025704644 [0,0,0,0,1,0|3,0,0]=4 5612 B13R1.24 CCCCCN([13CH3])c1ccccc1 7a_200000219563_200025704644 [0,0,0,0,1,0|3,0,0]=4 5613 B13R1.24 CCCCNC(=O)c1ccccc1 11a_100000102301_100000185807 [0,0,0,0,1,0|1,0,0]=2 5614 B13R1.24 CCCCNC(=O)c1ccccc1 1626a_100000102301_100000185807 [0,0,0,0,1,0|1,0,0]=2 5615 B13R1.24 CCCCNC(=O)c1ccccc1 240690a_100000102301_100000185807 [0,0,0,0,1,0|1,0,0]=2 5616 B13R1.24 CCCCNC(=O)c1ccccc1 527a_100000102301_100000185807 [0,0,0,0,1,0|1,0,0]=2 5617 B13R1.24 CCCCNC(C)c1ccccc1 2230a_100000102301_100000230085 [0,0,0,0,1,0|2,0,1]=4 5618 B13R1.24 CCCCNC(C)c1ccccc1 269862a_100000102301_100000185851 [0,0,0,0,1,0|2,0,1]=4 5619 B13R1.24 CCCCNC(C)c1ccccc1 7a_106832991798_100000230085 [0,0,0,0,1,0|2,0,1]=4 5620 B13R1.24 CCCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210211 [0,0,0,0,1,0|2,0,1]=4 5621 B13R1.24 CCCCOC(C)c1ccccc1 34a_100000210227_100000211855 [0,0,0,0,1,0|1,0,1]=3 5622 B13R1.24 CCCCOC(C)c1ccccc1 7a_100000210227_100000230085 [0,0,0,0,1,0|1,0,1]=3 5623 B13R1.24 CCCCO[C@H](C)c1ccccc1 34a_100000761318_100000210210 [0,0,0,0,1,0|1,0,1]=3 5624 B13R1.24 CCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210211 [0,0,0,0,1,0|1,0,1]=3 5625 B13R1.24 CCCCSC(C)c1ccccc1 62a_100000210211_100000230085 [0,0,0,0,1,0|1,1,1]=4 5626 B13R1.24 CCCCSC(C)c1ccccc1 62a_100000230085_100000210210 [0,0,0,0,1,0|1,1,1]=4 5627 B13R1.24 CCCNN=C(C)c1ccccc1 4a_100000740057_100000185851 [0,0,0,0,1,0|3,0,0]=4 5628 B13R1.24 CCCNNC(=O)c1ccccc1 22a_100000740057_100000185807 [0,0,0,0,1,0|2,0,0]=3 5629 B13R1.24 CCCOCC(=O)c1ccccn1 34a_100000210258_100000027445 [0,0,0,0,1,0|3,0,0]=4 5630 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000210303_100000211460 [0,0,0,0,1,0|2,0,0]=3 5631 B13R1.24 CCCSCC(=O)c1ccccc1 62a_100000211460_100000210303 [0,0,0,0,1,0|2,0,0]=3 5632 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000027445_100000210303 [0,0,0,0,1,0|3,0,0]=4 5633 B13R1.24 CCCSCC(=O)c1ccccn1 62a_100000210303_100000027445 [0,0,0,0,1,0|3,0,0]=4 5634 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000210303_100000757877 [0,0,0,0,1,0|3,0,0]=4 5635 B13R1.24 CCCSCC(=O)c1cccnc1 62a_100000757877_100000210303 [0,0,0,0,1,0|3,0,0]=4 5636 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000027454_100000210303 [0,0,0,0,1,0|3,0,0]=4 5637 B13R1.24 CCCSCC(=O)c1ccncc1 62a_100000210303_100000027454 [0,0,0,0,1,0|3,0,0]=4 5638 B13R1.24 CCCSCS(=O)c1ccccc1 62a_100000210303_100000031784 [0,0,0,0,1,0|3,0,0]=4 5639 B13R1.24 CCNCCC(=O)c1ccccc1 2230a_100015525214_100000750707 [0,0,0,0,1,0|2,0,0]=3 5640 B13R1.24 CCNCCS(=O)c1ccccc1 2230a_100015525214_100000740319 [0,0,0,0,1,0|3,0,0]=4 5641 B13R1.24 CCOCCC(=O)c1ccccc1 1458a_100000185807_100011215890 [0,0,0,0,1,0|2,0,0]=3 5642 B13R1.24 CCSCCC(=O)c1ccccc1 1458a_100000185807_100000757381 [0,0,0,0,1,0|2,0,0]=3 5643 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000210202_100000750707 [0,0,0,0,1,0|2,0,0]=3 5644 B13R1.24 CCSCCC(=O)c1ccccc1 62a_100000750707_100000210202 [0,0,0,0,1,0|2,0,0]=3 5645 B13R1.24 CCSCCS(=O)c1ccccc1 62a_100000210202_100000740319 [0,0,0,0,1,0|3,0,0]=4 5646 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000073877_100000210202 [0,0,0,0,1,0|1,0,0]=2 5647 B13R1.24 CCSCOC(=O)c1ccccc1 62a_100000210202_100000073877 [0,0,0,0,1,0|1,0,0]=2 5648 B13R1.24 CNCCCC(=O)c1ccccc1 2230a_106832991635_100000211006 [0,0,0,0,1,0|2,0,0]=3 5649 B13R1.24 CNCCCC(=O)c1ccccc1 7a_106832991635_100000211006 [0,0,0,0,1,0|2,0,0]=3 5650 B13R1.24 CNCCNC(=O)c1ccccc1 2230a_100000736134_200000210301 [0,0,0,0,1,0|2,0,0]=3 5651 B13R1.24 CNCCNC(=O)c1ccccc1 7a_106832991635_200011215302 [0,0,0,0,1,0|2,0,0]=3 5652 B13R1.24 CNCCNC(=O)c1ccncc1 2230a_200011198449_200000210301 [0,0,0,0,1,0|3,0,0]=4 5653 B13R1.24 CNCCOC(=O)c1ccccc1 34a_100102657272_100009812718 [0,0,0,0,1,0|1,0,0]=2 5654 B13R1.24 CNCCOC(=O)c1ccccc1 7a_106832991635_100000184176 [0,0,0,0,1,0|1,0,0]=2 5655 B13R1.24 COCCCC(=O)c1ccccc1 1458a_100000185807_100000740836 [0,0,0,0,1,0|2,0,0]=3 5656 B13R1.24 COCCNC(=O)c1ccccc1 1626a_100000209980_100000185807 [0,0,0,0,1,0|2,0,0]=3 5657 B13R1.24 COCCNC(=O)c1ccccc1 240690a_100000209980_100000185807 [0,0,0,0,1,0|2,0,0]=3 5658 B13R1.24 COCCNC(=O)c1ccccc1 34a_200000158897_200000210301 [0,0,0,0,1,0|2,0,0]=3 5659 B13R1.24 COCCNC(=O)c1ccccc1 527a_100000209980_100000185807 [0,0,0,0,1,0|2,0,0]=3 5660 B13R1.24 COCCNC(=O)c1ccccc1 7a_200000158897_200000210301 [0,0,0,0,1,0|2,0,0]=3 5661 B13R1.24 COCCOC(=O)c1ccccc1 34a_100138415774_100009812718 [0,0,0,0,1,0|1,0,0]=2 5662 B13R1.24 COCCOC(=O)c1ccccc1 7a_100000025465_200000210301 [0,0,0,0,1,0|1,0,0]=2 5663 B13R1.24 COCCOC(C)c1ccccc1 34a_100000210237_100000211855 [0,0,0,0,1,0|2,0,1]=4 5664 B13R1.24 COCCO[C@H](C)c1ccccc1 34a_100000761318_100011201679 [0,0,0,0,1,0|2,0,1]=4 5665 B13R1.24 COCCO[C@H](C)c1ccccc1 7a_100000761318_100000233755 [0,0,0,0,1,0|2,0,1]=4 5666 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000211460_100000766300 [0,0,0,0,1,0|3,0,0]=4 5667 B13R1.24 COCSCC(=O)c1ccccc1 62a_100000766300_100000211460 [0,0,0,0,1,0|3,0,0]=4 5668 B13R1.24 CSCCCC(=O)c1ccccc1 62a_100000211006_200000210301 [0,0,0,0,1,0|2,0,0]=3 5669 B13R1.24 CSCCCC(=O)c1ccccc1 62a_200000210301_100000211006 [0,0,0,0,1,0|2,0,0]=3 5670 B13R1.24 CSCCNC(=O)c1ccccc1 11a_100020590264_100000185807 [0,0,0,0,1,0|2,0,0]=3 5671 B13R1.24 CSCCNC(=O)c1ccccc1 1626a_100020590264_100000185807 [0,0,0,0,1,0|2,0,0]=3 5672 B13R1.24 CSCCNC(=O)c1ccccc1 240690a_100020590264_100000185807 [0,0,0,0,1,0|2,0,0]=3 5673 B13R1.24 CSCCNC(=O)c1ccccc1 527a_100020590264_100000185807 [0,0,0,0,1,0|2,0,0]=3 5674 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200000210301_200011215302 [0,0,0,0,1,0|2,0,0]=3 5675 B13R1.24 CSCCNC(=O)c1ccccc1 62a_200011215302_200000210301 [0,0,0,0,1,0|2,0,0]=3 5676 B13R1.24 CSCCOC(=O)c1ccccc1 62a_100009812718_200000210301 [0,0,0,0,1,0|1,0,0]=2 5677 B13R1.24 CSCCOC(=O)c1ccccc1 62a_200000210301_100009812718 [0,0,0,0,1,0|1,0,0]=2 5678 B13R1.24 CSCCOC(C)c1ccccc1 34a_100000230434_100000211855 [0,0,0,0,1,0|2,0,1]=4 5679 B13R1.24 CSCCOC(C)c1ccccc1 7a_100000230434_100000230085 [0,0,0,0,1,0|2,0,1]=4 5680 B13R1.24 CSCCO[C@H](C)c1ccccc1 34a_100000761318_100000212216 [0,0,0,0,1,0|2,0,1]=4 5681 B13R1.24 CSCCO[C@H](C)c1ccccc1 7a_100000761318_100000212216 [0,0,0,0,1,0|2,0,1]=4 5682 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100000211460_100011218213 [0,0,0,0,1,0|3,0,0]=4 5683 B13R1.24 CSCSCC(=O)c1ccccc1 62a_100011218213_100000211460 [0,0,0,0,1,0|3,0,0]=4 5684 B13R1.24 C[C@@H](OCCCF)c1ccccc1 34a_100000761318_100011934791 [0,0,0,0,1,0|2,0,1]=4 5685 B13R1.24 C[C@@H](OCCCF)c1ccccc1 7a_100000761318_100011934791 [0,0,0,0,1,0|2,0,1]=4 5686 B13R1.24 C[C@@H](OCCCO)c1ccccc1 34a_100000761318_100000230001 [0,0,0,0,1,0|2,0,1]=4 5687 B13R1.24 C[C@@H](OCCCO)c1ccccc1 7a_100000761318_100011215043 [0,0,0,0,1,0|2,0,1]=4 5688 B13R1.24 N#CCCCC(=O)c1ccccc1 1458a_100000185807_100000211468 [0,0,0,0,1,0|2,0,1]=4 5689 B13R1.24 N#CCCNC(=O)c1ccccc1 11a_100000720768_100000185807 [0,0,0,0,1,0|2,0,1]=4 5690 B13R1.24 N#CCCNC(=O)c1ccccc1 1626a_100000720768_100000185807 [0,0,0,0,1,0|2,0,1]=4 5691 B13R1.24 N#CCCNC(=O)c1ccccc1 240690a_100000720768_100000185807 [0,0,0,0,1,0|2,0,1]=4 5692 B13R1.24 N#CCCNC(=O)c1ccccc1 527a_100000720768_100000185807 [0,0,0,0,1,0|2,0,1]=4 5693 B13R1.24 O=C(CCCCF)c1ccccc1 1458a_100000185807_100000729493 [0,0,0,0,1,0|2,0,0]=3 5694 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [0,0,0,0,1,0|2,0,0]=3 5695 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100000750707_100015361967 [0,0,0,0,1,0|3,0,0]=4 5696 B13R1.24 O=C(CCSCF)c1ccccc1 62a_100015361967_100000750707 [0,0,0,0,1,0|3,0,0]=4 5697 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100000211460_100011217306 [0,0,0,0,1,0|3,0,0]=4 5698 B13R1.24 O=C(CSCCF)c1ccccc1 62a_100011217306_100000211460 [0,0,0,0,1,0|3,0,0]=4 5699 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211460_100000211926 [0,0,0,0,1,0|3,0,0]=4 5700 B13R1.24 O=C(CSCCO)c1ccccc1 62a_100000211926_100000211460 [0,0,0,0,1,0|3,0,0]=4 5701 B13R1.24 O=C(NCCCF)c1ccccc1 11a_100015189416_100000185807 [0,0,0,0,1,0|2,0,0]=3 5702 B13R1.24 O=C(NCCCF)c1ccccc1 1626a_100015189416_100000185807 [0,0,0,0,1,0|2,0,0]=3 5703 B13R1.24 O=C(NCCCF)c1ccccc1 240690a_100015189416_100000185807 [0,0,0,0,1,0|2,0,0]=3 5704 B13R1.24 O=C(NCCCF)c1ccccc1 527a_100015189416_100000185807 [0,0,0,0,1,0|2,0,0]=3 5705 B13R1.24 O=C(NCCCO)c1ccccc1 240690a_100000182051_100000185807 [0,0,0,0,1,0|2,0,0]=3 5706 B13R1.24 O=C(NCCCO)c1ccccc1 527a_100000182051_100000185807 [0,0,0,0,1,0|2,0,0]=3 5707 B13R1.24 O=C(NNCCO)c1ccccc1 22a_100000210001_100000185807 [0,0,0,0,1,0|3,0,0]=4 5708 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100000073877_100015361967 [0,0,0,0,1,0|2,0,0]=3 5709 B13R1.24 O=C(OCSCF)c1ccccc1 62a_100015361967_100000073877 [0,0,0,0,1,0|2,0,0]=3 5710 B13R1.24 [13CH3]NCCNC(=O)c1ccccc1 2230a_100000736134_200025704644 [0,0,0,0,1,0|2,0,0]=3 5711 B13R1.24 [13CH3]NCCNC(=O)c1ccncc1 2230a_200011198449_200025704644 [0,0,0,0,1,0|3,0,0]=4 5712 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 34a_200000158897_200025704644 [0,0,0,0,1,0|2,0,0]=3 5713 B13R1.24 [13CH3]OCCNC(=O)c1ccccc1 7a_200000158897_200025704644 [0,0,0,0,1,0|2,0,0]=3 5714 B13R1.24 [13CH3]OCCOC(=O)c1ccccc1 7a_100000025465_200025704644 [0,0,0,0,1,0|1,0,0]=2 5715 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_100000211006_200025704644 [0,0,0,0,1,0|2,0,0]=3 5716 B13R1.24 [13CH3]SCCCC(=O)c1ccccc1 62a_200025704644_100000211006 [0,0,0,0,1,0|2,0,0]=3 5717 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200011215302_200025704644 [0,0,0,0,1,0|2,0,0]=3 5718 B13R1.24 [13CH3]SCCNC(=O)c1ccccc1 62a_200025704644_200011215302 [0,0,0,0,1,0|2,0,0]=3 5719 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_100009812718_200025704644 [0,0,0,0,1,0|1,0,0]=2 5720 B13R1.24 [13CH3]SCCOC(=O)c1ccccc1 62a_200025704644_100009812718 [0,0,0,0,1,0|1,0,0]=2 5721 B13R1.156 CCCC#CC(=O)Cc1ccsc1 1458a_200011218047_100011233845 [0,0,0,0,1,0|2,0,1]=4 5722 B13R1.156 CCCC=CC(=O)Cc1ccsc1 1458a_100000212230_100011233845 [0,0,0,0,1,0|2,0,1]=4 5723 B13R1.156 CCCCCC(=O)Cc1c[nH]cn1 1458a_100000212188_100000707719 [0,0,0,0,1,0|3,0,0]=4 5724 B13R1.156 CCCCCC(=O)Cc1c[nH]cn1 1458a_100015291406_100000210326 [0,0,0,0,1,0|3,0,0]=4 5725 B13R1.156 CCCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210326 [0,0,0,0,1,0|2,0,0]=3 5726 B13R1.156 CCCCCC(=O)Cc1ccco1 1458a_100011217309_100000210326 [0,0,0,0,1,0|2,0,0]=3 5727 B13R1.156 CCCCCC(=O)Cc1cccs1 1458a_100000210189_100000210326 [0,0,0,0,1,0|2,0,0]=3 5728 B13R1.156 CCCCCC(=O)Cc1ccn[nH]1 1458a_100000212188_100000728653 [0,0,0,0,1,0|3,0,0]=4 5729 B13R1.156 CCCCCC(=O)Cc1ccn[nH]1 1458a_100000752941_100000210326 [0,0,0,0,1,0|3,0,0]=4 5730 B13R1.156 CCCCCC(=O)Cc1ccoc1 1458a_100000684892_100000210326 [0,0,0,0,1,0|2,0,0]=3 5731 B13R1.156 CCCCCC(=O)Cc1ccon1 1458a_100000212188_100000234950 [0,0,0,0,1,0|3,0,0]=4 5732 B13R1.156 CCCCCC(=O)Cc1ccsc1 1458a_100000184062_100000210326 [0,0,0,0,1,0|2,0,0]=3 5733 B13R1.156 CCCCCC(=O)Cc1ccsc1 1458a_100000212188_100011233845 [0,0,0,0,1,0|2,0,0]=3 5734 B13R1.156 CCCCCC(=O)Cc1cncs1 1458a_100000212188_100015185245 [0,0,0,0,1,0|3,0,0]=4 5735 B13R1.156 CCCCCC(=O)Cc1cscn1 1458a_100000212188_100000205941 [0,0,0,0,1,0|3,0,0]=4 5736 B13R1.156 CCCCCC(=O)Cc1cscn1 1458a_100011438297_100000210326 [0,0,0,0,1,0|3,0,0]=4 5737 B13R1.156 CCCCCC(=O)Cc1ncco1 1458a_100000212188_103436540062 [0,0,0,0,1,0|3,0,0]=4 5738 B13R1.156 CCCCCC(=O)Cc1nccs1 1458a_100000212188_100015184050 [0,0,0,0,1,0|3,0,0]=4 5739 B13R1.156 CCCCCC(=O)Cn1cccc1 1458a_100011196272_100000210326 [0,0,0,0,1,0|2,0,0]=3 5740 B13R1.156 CCCCCC(=O)Cn1cccn1 1458a_100000233772_100000210326 [0,0,0,0,1,0|3,0,0]=4 5741 B13R1.156 CCCCCC(=O)Cn1ccnc1 1458a_100000739072_100000210326 [0,0,0,0,1,0|3,0,0]=4 5742 B13R1.156 CCCCNC(=O)Cc1c[nH]cn1 240690a_100000102301_100015291406 [0,0,0,0,1,0|3,0,0]=4 5743 B13R1.156 CCCCNC(=O)Cc1ccc[nH]1 11a_100000102301_100000238377 [0,0,0,0,1,0|2,0,0]=3 5744 B13R1.156 CCCCNC(=O)Cc1ccc[nH]1 240690a_100000102301_100000238377 [0,0,0,0,1,0|2,0,0]=3 5745 B13R1.156 CCCCNC(=O)Cc1ccc[nH]1 527a_100000102301_100000238377 [0,0,0,0,1,0|2,0,0]=3 5746 B13R1.156 CCCCNC(=O)Cc1ccco1 11a_100000102301_100011217309 [0,0,0,0,1,0|2,0,0]=3 5747 B13R1.156 CCCCNC(=O)Cc1ccco1 527a_100000102301_100011217309 [0,0,0,0,1,0|2,0,0]=3 5748 B13R1.156 CCCCNC(=O)Cc1cccs1 11a_100000102301_100000210189 [0,0,0,0,1,0|2,0,0]=3 5749 B13R1.156 CCCCNC(=O)Cc1cccs1 1626a_100000102301_100000210189 [0,0,0,0,1,0|2,0,0]=3 5750 B13R1.156 CCCCNC(=O)Cc1cccs1 240690a_100000102301_100000210189 [0,0,0,0,1,0|2,0,0]=3 5751 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 11a_100000102301_100000752941 [0,0,0,0,1,0|3,0,0]=4 5752 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 1626a_100000102301_100000752941 [0,0,0,0,1,0|3,0,0]=4 5753 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 240690a_100000102301_100000752941 [0,0,0,0,1,0|3,0,0]=4 5754 B13R1.156 CCCCNC(=O)Cc1ccn[nH]1 527a_100000102301_100000752941 [0,0,0,0,1,0|3,0,0]=4 5755 B13R1.156 CCCCNC(=O)Cc1ccoc1 11a_100000102301_100000684892 [0,0,0,0,1,0|2,0,0]=3 5756 B13R1.156 CCCCNC(=O)Cc1ccoc1 1626a_100000102301_100000684892 [0,0,0,0,1,0|2,0,0]=3 5757 B13R1.156 CCCCNC(=O)Cc1ccoc1 240690a_100000102301_100000684892 [0,0,0,0,1,0|2,0,0]=3 5758 B13R1.156 CCCCNC(=O)Cc1ccoc1 527a_100000102301_100000684892 [0,0,0,0,1,0|2,0,0]=3 5759 B13R1.156 CCCCNC(=O)Cc1ccsc1 11a_100000102301_100000184062 [0,0,0,0,1,0|2,0,0]=3 5760 B13R1.156 CCCCNC(=O)Cc1ccsc1 1626a_100000102301_100000184062 [0,0,0,0,1,0|2,0,0]=3 5761 B13R1.156 CCCCNC(=O)Cc1ccsc1 240690a_100000102301_100000184062 [0,0,0,0,1,0|2,0,0]=3 5762 B13R1.156 CCCCNC(=O)Cc1ccsc1 527a_100000102301_100000184062 [0,0,0,0,1,0|2,0,0]=3 5763 B13R1.156 CCCCNC(=O)Cc1cscn1 11a_100000102301_100011438297 [0,0,0,0,1,0|3,0,0]=4 5764 B13R1.156 CCCCNC(=O)Cc1cscn1 1626a_100000102301_100011438297 [0,0,0,0,1,0|3,0,0]=4 5765 B13R1.156 CCCCNC(=O)Cc1cscn1 240690a_100000102301_100011438297 [0,0,0,0,1,0|3,0,0]=4 5766 B13R1.156 CCCCNC(=O)Cc1cscn1 527a_100000102301_100011438297 [0,0,0,0,1,0|3,0,0]=4 5767 B13R1.156 CCCCNC(=O)Cn1cccc1 11a_100000102301_100011196272 [0,0,0,0,1,0|2,0,0]=3 5768 B13R1.156 CCCCNC(=O)Cn1cccc1 1626a_100000102301_100011196272 [0,0,0,0,1,0|2,0,0]=3 5769 B13R1.156 CCCCNC(=O)Cn1cccc1 527a_100000102301_100011196272 [0,0,0,0,1,0|2,0,0]=3 5770 B13R1.156 CCCCNC(=O)Cn1cccn1 11a_100000102301_100000233772 [0,0,0,0,1,0|3,0,0]=4 5771 B13R1.156 CCCCNC(=O)Cn1cccn1 1626a_100000102301_100000233772 [0,0,0,0,1,0|3,0,0]=4 5772 B13R1.156 CCCCNC(=O)Cn1cccn1 240690a_100000102301_100000233772 [0,0,0,0,1,0|3,0,0]=4 5773 B13R1.156 CCCCNC(=O)Cn1cccn1 527a_100000102301_100000233772 [0,0,0,0,1,0|3,0,0]=4 5774 B13R1.156 CCCCNC(=O)Cn1ccnc1 11a_100000102301_100000739072 [0,0,0,0,1,0|3,0,0]=4 5775 B13R1.156 CCCCNC(=O)Cn1ccnc1 1626a_100000102301_100000739072 [0,0,0,0,1,0|3,0,0]=4 5776 B13R1.156 CCCCNC(=O)Cn1ccnc1 240690a_100000102301_100000739072 [0,0,0,0,1,0|3,0,0]=4 5777 B13R1.156 CCCCOC(=O)CN1CC=CC1 269982a_100015195280_100000211628 [0,0,0,0,1,0|1,0,2]=4 5778 B13R1.156 CCCCOC(C)Cc1ccco1 34a_100011803939_100000210210 [0,0,0,0,1,0|2,0,1]=4 5779 B13R1.156 CCCCOC(C)Cc1ccco1 7a_100011803939_100000210211 [0,0,0,0,1,0|2,0,1]=4 5780 B13R1.156 CCCNNC(=O)Cc1ccc[nH]1 22a_100000740057_100000238377 [0,0,0,0,1,0|3,0,0]=4 5781 B13R1.156 CCCNNC(=O)Cc1ccco1 22a_100000740057_100011217309 [0,0,0,0,1,0|3,0,0]=4 5782 B13R1.156 CCCNNC(=O)Cc1cccs1 22a_100000740057_100000210189 [0,0,0,0,1,0|3,0,0]=4 5783 B13R1.156 CCCNNC(=O)Cc1ccoc1 22a_100000740057_100000684892 [0,0,0,0,1,0|3,0,0]=4 5784 B13R1.156 CCCNNC(=O)Cc1ccsc1 22a_100000740057_100000184062 [0,0,0,0,1,0|3,0,0]=4 5785 B13R1.156 CCCNNC(=O)Cn1cccc1 22a_100000740057_100011196272 [0,0,0,0,1,0|3,0,0]=4 5786 B13R1.156 CCCOCC(=O)Cc1ccsc1 1458a_100000745993_100011233845 [0,0,0,0,1,0|3,0,0]=4 5787 B13R1.156 CCCSCC(=O)Cc1ccsc1 1458a_100000217233_100011233845 [0,0,0,0,1,0|3,0,0]=4 5788 B13R1.156 CCOCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100011215890 [0,0,0,0,1,0|3,0,0]=4 5789 B13R1.156 CCOCCC(=O)Cc1ccco1 1458a_100011217309_100011215890 [0,0,0,0,1,0|3,0,0]=4 5790 B13R1.156 CCOCCC(=O)Cc1cccs1 1458a_100000210189_100011215890 [0,0,0,0,1,0|3,0,0]=4 5791 B13R1.156 CCOCCC(=O)Cc1ccoc1 1458a_100000684892_100011215890 [0,0,0,0,1,0|3,0,0]=4 5792 B13R1.156 CCOCCC(=O)Cc1ccsc1 1458a_100000184062_100011215890 [0,0,0,0,1,0|3,0,0]=4 5793 B13R1.156 CCOCCC(=O)Cc1ccsc1 1458a_100000749530_100011233845 [0,0,0,0,1,0|3,0,0]=4 5794 B13R1.156 CCOCCC(=O)Cn1cccc1 1458a_100011196272_100011215890 [0,0,0,0,1,0|3,0,0]=4 5795 B13R1.156 CCSCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000757381 [0,0,0,0,1,0|3,0,0]=4 5796 B13R1.156 CCSCCC(=O)Cc1ccco1 1458a_100011217309_100000757381 [0,0,0,0,1,0|3,0,0]=4 5797 B13R1.156 CCSCCC(=O)Cc1cccs1 1458a_100000210189_100000757381 [0,0,0,0,1,0|3,0,0]=4 5798 B13R1.156 CCSCCC(=O)Cc1ccoc1 1458a_100000684892_100000757381 [0,0,0,0,1,0|3,0,0]=4 5799 B13R1.156 CCSCCC(=O)Cc1ccsc1 1458a_100000184062_100000757381 [0,0,0,0,1,0|3,0,0]=4 5800 B13R1.156 CCSCCC(=O)Cc1ccsc1 1458a_100000230768_100011233845 [0,0,0,0,1,0|3,0,0]=4 5801 B13R1.156 CCSCCC(=O)Cn1cccc1 1458a_100011196272_100000757381 [0,0,0,0,1,0|3,0,0]=4 5802 B13R1.156 COCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000740836 [0,0,0,0,1,0|3,0,0]=4 5803 B13R1.156 COCCCC(=O)Cc1ccco1 1458a_100011217309_100000740836 [0,0,0,0,1,0|3,0,0]=4 5804 B13R1.156 COCCCC(=O)Cc1cccs1 1458a_100000210189_100000740836 [0,0,0,0,1,0|3,0,0]=4 5805 B13R1.156 COCCCC(=O)Cc1ccoc1 1458a_100000684892_100000740836 [0,0,0,0,1,0|3,0,0]=4 5806 B13R1.156 COCCCC(=O)Cc1ccsc1 1458a_100000184062_100000740836 [0,0,0,0,1,0|3,0,0]=4 5807 B13R1.156 COCCCC(=O)Cc1ccsc1 1458a_100000741012_100011233845 [0,0,0,0,1,0|3,0,0]=4 5808 B13R1.156 COCCCC(=O)Cn1cccc1 1458a_100011196272_100000740836 [0,0,0,0,1,0|3,0,0]=4 5809 B13R1.156 COCCNC(=O)Cc1ccc[nH]1 240690a_100000209980_100000238377 [0,0,0,0,1,0|3,0,0]=4 5810 B13R1.156 COCCNC(=O)Cc1ccc[nH]1 527a_100000209980_100000238377 [0,0,0,0,1,0|3,0,0]=4 5811 B13R1.156 COCCNC(=O)Cc1ccco1 527a_100000209980_100011217309 [0,0,0,0,1,0|3,0,0]=4 5812 B13R1.156 COCCNC(=O)Cc1cccs1 1626a_100000209980_100000210189 [0,0,0,0,1,0|3,0,0]=4 5813 B13R1.156 COCCNC(=O)Cc1cccs1 240690a_100000209980_100000210189 [0,0,0,0,1,0|3,0,0]=4 5814 B13R1.156 COCCNC(=O)Cc1ccoc1 1626a_100000209980_100000684892 [0,0,0,0,1,0|3,0,0]=4 5815 B13R1.156 COCCNC(=O)Cc1ccoc1 240690a_100000209980_100000684892 [0,0,0,0,1,0|3,0,0]=4 5816 B13R1.156 COCCNC(=O)Cc1ccoc1 527a_100000209980_100000684892 [0,0,0,0,1,0|3,0,0]=4 5817 B13R1.156 COCCNC(=O)Cc1ccsc1 1626a_100000209980_100000184062 [0,0,0,0,1,0|3,0,0]=4 5818 B13R1.156 COCCNC(=O)Cc1ccsc1 240690a_100000209980_100000184062 [0,0,0,0,1,0|3,0,0]=4 5819 B13R1.156 COCCNC(=O)Cc1ccsc1 527a_100000209980_100000184062 [0,0,0,0,1,0|3,0,0]=4 5820 B13R1.156 COCCNC(=O)Cn1cccc1 1626a_100000209980_100011196272 [0,0,0,0,1,0|3,0,0]=4 5821 B13R1.156 COCCNC(=O)Cn1cccc1 527a_100000209980_100011196272 [0,0,0,0,1,0|3,0,0]=4 5822 B13R1.156 CSCCCC(=O)Cc1ccsc1 1458a_100000173376_100011233845 [0,0,0,0,1,0|3,0,0]=4 5823 B13R1.156 CSCCNC(=O)Cc1ccc[nH]1 11a_100020590264_100000238377 [0,0,0,0,1,0|3,0,0]=4 5824 B13R1.156 CSCCNC(=O)Cc1ccc[nH]1 240690a_100020590264_100000238377 [0,0,0,0,1,0|3,0,0]=4 5825 B13R1.156 CSCCNC(=O)Cc1ccc[nH]1 527a_100020590264_100000238377 [0,0,0,0,1,0|3,0,0]=4 5826 B13R1.156 CSCCNC(=O)Cc1ccco1 11a_100020590264_100011217309 [0,0,0,0,1,0|3,0,0]=4 5827 B13R1.156 CSCCNC(=O)Cc1ccco1 527a_100020590264_100011217309 [0,0,0,0,1,0|3,0,0]=4 5828 B13R1.156 CSCCNC(=O)Cc1cccs1 11a_100020590264_100000210189 [0,0,0,0,1,0|3,0,0]=4 5829 B13R1.156 CSCCNC(=O)Cc1cccs1 1626a_100020590264_100000210189 [0,0,0,0,1,0|3,0,0]=4 5830 B13R1.156 CSCCNC(=O)Cc1cccs1 240690a_100020590264_100000210189 [0,0,0,0,1,0|3,0,0]=4 5831 B13R1.156 CSCCNC(=O)Cc1ccoc1 11a_100020590264_100000684892 [0,0,0,0,1,0|3,0,0]=4 5832 B13R1.156 CSCCNC(=O)Cc1ccoc1 1626a_100020590264_100000684892 [0,0,0,0,1,0|3,0,0]=4 5833 B13R1.156 CSCCNC(=O)Cc1ccoc1 240690a_100020590264_100000684892 [0,0,0,0,1,0|3,0,0]=4 5834 B13R1.156 CSCCNC(=O)Cc1ccoc1 527a_100020590264_100000684892 [0,0,0,0,1,0|3,0,0]=4 5835 B13R1.156 CSCCNC(=O)Cc1ccsc1 11a_100020590264_100000184062 [0,0,0,0,1,0|3,0,0]=4 5836 B13R1.156 CSCCNC(=O)Cc1ccsc1 1626a_100020590264_100000184062 [0,0,0,0,1,0|3,0,0]=4 5837 B13R1.156 CSCCNC(=O)Cc1ccsc1 240690a_100020590264_100000184062 [0,0,0,0,1,0|3,0,0]=4 5838 B13R1.156 CSCCNC(=O)Cc1ccsc1 527a_100020590264_100000184062 [0,0,0,0,1,0|3,0,0]=4 5839 B13R1.156 CSCCNC(=O)Cn1cccc1 11a_100020590264_100011196272 [0,0,0,0,1,0|3,0,0]=4 5840 B13R1.156 CSCCNC(=O)Cn1cccc1 1626a_100020590264_100011196272 [0,0,0,0,1,0|3,0,0]=4 5841 B13R1.156 CSCCNC(=O)Cn1cccc1 527a_100020590264_100011196272 [0,0,0,0,1,0|3,0,0]=4 5842 B13R1.156 O=C(CCCCF)Cc1ccc[nH]1 1458a_100000238377_100000729493 [0,0,0,0,1,0|3,0,0]=4 5843 B13R1.156 O=C(CCCCF)Cc1ccco1 1458a_100011217309_100000729493 [0,0,0,0,1,0|3,0,0]=4 5844 B13R1.156 O=C(CCCCF)Cc1cccs1 1458a_100000210189_100000729493 [0,0,0,0,1,0|3,0,0]=4 5845 B13R1.156 O=C(CCCCF)Cc1ccoc1 1458a_100000684892_100000729493 [0,0,0,0,1,0|3,0,0]=4 5846 B13R1.156 O=C(CCCCF)Cc1ccsc1 1458a_100000184062_100000729493 [0,0,0,0,1,0|3,0,0]=4 5847 B13R1.156 O=C(CCCCF)Cn1cccc1 1458a_100011196272_100000729493 [0,0,0,0,1,0|3,0,0]=4 5848 B13R1.156 O=C(CCCCO)Cc1ccc[nH]1 1458a_100000238377_100000210776 [0,0,0,0,1,0|3,0,0]=4 5849 B13R1.156 O=C(CCCCO)Cc1ccco1 1458a_100011217309_100000210776 [0,0,0,0,1,0|3,0,0]=4 5850 B13R1.156 O=C(CCCCO)Cc1cccs1 1458a_100000210189_100000210776 [0,0,0,0,1,0|3,0,0]=4 5851 B13R1.156 O=C(CCCCO)Cc1ccoc1 1458a_100000684892_100000210776 [0,0,0,0,1,0|3,0,0]=4 5852 B13R1.156 O=C(CCCCO)Cc1ccsc1 1458a_100000184062_100000210776 [0,0,0,0,1,0|3,0,0]=4 5853 B13R1.156 O=C(CCCCO)Cc1ccsc1 1458a_100000695505_100011233845 [0,0,0,0,1,0|3,0,0]=4 5854 B13R1.156 O=C(CCCCO)Cn1cccc1 1458a_100011196272_100000210776 [0,0,0,0,1,0|3,0,0]=4 5855 B13R1.156 O=C(Cc1ccc[nH]1)NCCCF 11a_100015189416_100000238377 [0,0,0,0,1,0|3,0,0]=4 5856 B13R1.156 O=C(Cc1ccc[nH]1)NCCCF 240690a_100015189416_100000238377 [0,0,0,0,1,0|3,0,0]=4 5857 B13R1.156 O=C(Cc1ccc[nH]1)NCCCF 527a_100015189416_100000238377 [0,0,0,0,1,0|3,0,0]=4 5858 B13R1.156 O=C(Cc1ccc[nH]1)NCCCO 240690a_100000182051_100000238377 [0,0,0,0,1,0|3,0,0]=4 5859 B13R1.156 O=C(Cc1ccc[nH]1)NCCCO 527a_100000182051_100000238377 [0,0,0,0,1,0|3,0,0]=4 5860 B13R1.156 O=C(Cc1ccco1)NCCCF 11a_100015189416_100011217309 [0,0,0,0,1,0|3,0,0]=4 5861 B13R1.156 O=C(Cc1ccco1)NCCCF 527a_100015189416_100011217309 [0,0,0,0,1,0|3,0,0]=4 5862 B13R1.156 O=C(Cc1ccco1)NCCCO 527a_100000182051_100011217309 [0,0,0,0,1,0|3,0,0]=4 5863 B13R1.156 O=C(Cc1cccs1)NCCCF 11a_100015189416_100000210189 [0,0,0,0,1,0|3,0,0]=4 5864 B13R1.156 O=C(Cc1cccs1)NCCCF 1626a_100015189416_100000210189 [0,0,0,0,1,0|3,0,0]=4 5865 B13R1.156 O=C(Cc1cccs1)NCCCF 240690a_100015189416_100000210189 [0,0,0,0,1,0|3,0,0]=4 5866 B13R1.156 O=C(Cc1cccs1)NCCCO 240690a_100000182051_100000210189 [0,0,0,0,1,0|3,0,0]=4 5867 B13R1.156 O=C(Cc1ccoc1)NCCCF 11a_100015189416_100000684892 [0,0,0,0,1,0|3,0,0]=4 5868 B13R1.156 O=C(Cc1ccoc1)NCCCF 1626a_100015189416_100000684892 [0,0,0,0,1,0|3,0,0]=4 5869 B13R1.156 O=C(Cc1ccoc1)NCCCF 240690a_100015189416_100000684892 [0,0,0,0,1,0|3,0,0]=4 5870 B13R1.156 O=C(Cc1ccoc1)NCCCF 527a_100015189416_100000684892 [0,0,0,0,1,0|3,0,0]=4 5871 B13R1.156 O=C(Cc1ccoc1)NCCCO 240690a_100000182051_100000684892 [0,0,0,0,1,0|3,0,0]=4 5872 B13R1.156 O=C(Cc1ccoc1)NCCCO 527a_100000182051_100000684892 [0,0,0,0,1,0|3,0,0]=4 5873 B13R1.156 O=C(Cc1ccsc1)NCCCF 11a_100015189416_100000184062 [0,0,0,0,1,0|3,0,0]=4 5874 B13R1.156 O=C(Cc1ccsc1)NCCCF 1626a_100015189416_100000184062 [0,0,0,0,1,0|3,0,0]=4 5875 B13R1.156 O=C(Cc1ccsc1)NCCCF 240690a_100015189416_100000184062 [0,0,0,0,1,0|3,0,0]=4 5876 B13R1.156 O=C(Cc1ccsc1)NCCCF 527a_100015189416_100000184062 [0,0,0,0,1,0|3,0,0]=4 5877 B13R1.156 O=C(Cc1ccsc1)NCCCO 240690a_100000182051_100000184062 [0,0,0,0,1,0|3,0,0]=4 5878 B13R1.156 O=C(Cc1ccsc1)NCCCO 527a_100000182051_100000184062 [0,0,0,0,1,0|3,0,0]=4 5879 B13R1.156 O=C(Cn1cccc1)NCCCF 11a_100015189416_100011196272 [0,0,0,0,1,0|3,0,0]=4 5880 B13R1.156 O=C(Cn1cccc1)NCCCF 1626a_100015189416_100011196272 [0,0,0,0,1,0|3,0,0]=4 5881 B13R1.156 O=C(Cn1cccc1)NCCCF 527a_100015189416_100011196272 [0,0,0,0,1,0|3,0,0]=4 5882 B13R1.156 O=C(Cn1cccc1)NCCCO 527a_100000182051_100011196272 [0,0,0,0,1,0|3,0,0]=4 5883 B15R1.78 C#CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000731252 [0,0,0,0,0,1|1,0,2]=4 5884 B15R1.78 C#CCCCC(=O)CCc1ccccc1 1458a_100000690238_100000765856 [0,0,0,0,0,1|1,0,2]=4 5885 B15R1.78 C#CCCCC(=O)COc1ccccc1 1458a_100000186222_100000731252 [0,0,0,0,0,1|1,0,2]=4 5886 B15R1.78 C#CCCCC(=O)CSc1ccccc1 1458a_100000211596_100000731252 [0,0,0,0,0,1|1,0,2]=4 5887 B15R1.78 C#CCCCC(=O)NCc1ccccc1 11a_100015324214_100000690238 [0,0,0,0,0,1|1,0,2]=4 5888 B15R1.78 C#CCCCC(=O)NCc1ccccc1 1626a_100015324214_100000690238 [0,0,0,0,0,1|1,0,2]=4 5889 B15R1.78 C#CCCCC(=O)NCc1ccccc1 240690a_100015324214_100000690238 [0,0,0,0,0,1|1,0,2]=4 5890 B15R1.78 C#CCCCC(=O)NCc1ccccc1 527a_100015324214_100000690238 [0,0,0,0,0,1|1,0,2]=4 5891 B15R1.78 C#CCCNC(=O)CCc1ccccc1 11a_100000755551_100000185753 [0,0,0,0,0,1|1,0,2]=4 5892 B15R1.78 C#CCCNC(=O)CCc1ccccc1 1626a_100000755551_100000185753 [0,0,0,0,0,1|1,0,2]=4 5893 B15R1.78 C#CCCNC(=O)CCc1ccccc1 240690a_100000755551_100000185753 [0,0,0,0,0,1|1,0,2]=4 5894 B15R1.78 C#CCCNC(=O)CCc1ccccc1 527a_100000755551_100000185753 [0,0,0,0,0,1|1,0,2]=4 5895 B15R1.78 C#CCCNC(=O)COc1ccccc1 11a_100000755551_100000186222 [0,0,0,0,0,1|1,0,2]=4 5896 B15R1.78 C#CCCNC(=O)COc1ccccc1 1626a_100000755551_100000186222 [0,0,0,0,0,1|1,0,2]=4 5897 B15R1.78 C#CCCNC(=O)COc1ccccc1 240690a_100000755551_100000186222 [0,0,0,0,0,1|1,0,2]=4 5898 B15R1.78 C#CCCNC(=O)COc1ccccc1 527a_100000755551_100000186222 [0,0,0,0,0,1|1,0,2]=4 5899 B15R1.78 C#CCCNC(=O)CSc1ccccc1 11a_100000755551_100000211596 [0,0,0,0,0,1|1,0,2]=4 5900 B15R1.78 C#CCCNC(=O)CSc1ccccc1 1626a_100000755551_100000211596 [0,0,0,0,0,1|1,0,2]=4 5901 B15R1.78 C#CCCNC(=O)CSc1ccccc1 240690a_100000755551_100000211596 [0,0,0,0,0,1|1,0,2]=4 5902 B15R1.78 C#CCCNC(=O)CSc1ccccc1 527a_100000755551_100000211596 [0,0,0,0,0,1|1,0,2]=4 5903 B15R1.78 C#CCCNC(=O)NCc1ccccc1 2708a_100000755551_100015324214 [0,0,0,0,0,1|1,0,2]=4 5904 B15R1.78 C#CCCNC(=O)NCc1ccccc1 2708a_100015324214_100000755551 [0,0,0,0,0,1|1,0,2]=4 5905 B15R1.78 C#CCCNC(=O)NCc1ccccc1 273464a_100000755551_100015324214 [0,0,0,0,0,1|1,0,2]=4 5906 B15R1.78 C#CCCNC(=O)NCc1ccccc1 273464a_100015324214_100000755551 [0,0,0,0,0,1|1,0,2]=4 5907 B15R1.78 C#CCCNC(=O)NCc1ccccc1 512a_100000755551_100015324214 [0,0,0,0,0,1|1,0,2]=4 5908 B15R1.78 C#CCCNC(=O)NCc1ccccc1 512a_100015324214_100000755551 [0,0,0,0,0,1|1,0,2]=4 5909 B15R1.78 C=CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000757094 [0,0,0,0,0,1|1,0,2]=4 5910 B15R1.78 C=CCCCC(=O)CCc1ccccc1 1458a_100000766728_100000765856 [0,0,0,0,0,1|1,0,2]=4 5911 B15R1.78 C=CCCCC(=O)COc1ccccc1 1458a_100000186222_100000757094 [0,0,0,0,0,1|1,0,2]=4 5912 B15R1.78 C=CCCCC(=O)CSc1ccccc1 1458a_100000211596_100000757094 [0,0,0,0,0,1|1,0,2]=4 5913 B15R1.78 C=CCCCC(=O)NCc1ccccc1 11a_100015324214_100000766728 [0,0,0,0,0,1|1,0,2]=4 5914 B15R1.78 C=CCCCC(=O)NCc1ccccc1 1626a_100015324214_100000766728 [0,0,0,0,0,1|1,0,2]=4 5915 B15R1.78 C=CCCCC(=O)NCc1ccccc1 240690a_100015324214_100000766728 [0,0,0,0,0,1|1,0,2]=4 5916 B15R1.78 C=CCCCC(=O)NCc1ccccc1 527a_100015324214_100000766728 [0,0,0,0,0,1|1,0,2]=4 5917 B15R1.78 C=CCCNC(=O)CCc1ccccc1 11a_100015191253_100000185753 [0,0,0,0,0,1|1,0,2]=4 5918 B15R1.78 C=CCCNC(=O)CCc1ccccc1 1626a_100015191253_100000185753 [0,0,0,0,0,1|1,0,2]=4 5919 B15R1.78 C=CCCNC(=O)CCc1ccccc1 240690a_100015191253_100000185753 [0,0,0,0,0,1|1,0,2]=4 5920 B15R1.78 C=CCCNC(=O)CCc1ccccc1 527a_100015191253_100000185753 [0,0,0,0,0,1|1,0,2]=4 5921 B15R1.78 C=CCCNC(=O)COc1ccccc1 11a_100015191253_100000186222 [0,0,0,0,0,1|1,0,2]=4 5922 B15R1.78 C=CCCNC(=O)COc1ccccc1 1626a_100015191253_100000186222 [0,0,0,0,0,1|1,0,2]=4 5923 B15R1.78 C=CCCNC(=O)COc1ccccc1 240690a_100015191253_100000186222 [0,0,0,0,0,1|1,0,2]=4 5924 B15R1.78 C=CCCNC(=O)COc1ccccc1 527a_100015191253_100000186222 [0,0,0,0,0,1|1,0,2]=4 5925 B15R1.78 C=CCCNC(=O)CSc1ccccc1 11a_100015191253_100000211596 [0,0,0,0,0,1|1,0,2]=4 5926 B15R1.78 C=CCCNC(=O)CSc1ccccc1 1626a_100015191253_100000211596 [0,0,0,0,0,1|1,0,2]=4 5927 B15R1.78 C=CCCNC(=O)CSc1ccccc1 240690a_100015191253_100000211596 [0,0,0,0,0,1|1,0,2]=4 5928 B15R1.78 C=CCCNC(=O)CSc1ccccc1 527a_100015191253_100000211596 [0,0,0,0,0,1|1,0,2]=4 5929 B15R1.78 C=CCCNC(=O)NCc1ccccc1 2708a_100015191253_100015324214 [0,0,0,0,0,1|1,0,2]=4 5930 B15R1.78 C=CCCNC(=O)NCc1ccccc1 2708a_100015324214_100015191253 [0,0,0,0,0,1|1,0,2]=4 5931 B15R1.78 C=CCCNC(=O)NCc1ccccc1 273464a_100015191253_100015324214 [0,0,0,0,0,1|1,0,2]=4 5932 B15R1.78 C=CCCNC(=O)NCc1ccccc1 273464a_100015324214_100015191253 [0,0,0,0,0,1|1,0,2]=4 5933 B15R1.78 C=CCCNC(=O)NCc1ccccc1 512a_100015191253_100015324214 [0,0,0,0,0,1|1,0,2]=4 5934 B15R1.78 C=CCCNC(=O)NCc1ccccc1 512a_100015324214_100015191253 [0,0,0,0,0,1|1,0,2]=4 5935 B15R1.78 CC#CCNC(=O)CCc1ccccc1 11a_100000685387_100000185753 [0,0,0,0,0,1|1,0,2]=4 5936 B15R1.78 CC#CCNC(=O)CCc1ccccc1 1626a_100000685387_100000185753 [0,0,0,0,0,1|1,0,2]=4 5937 B15R1.78 CC#CCNC(=O)CCc1ccccc1 527a_100000685387_100000185753 [0,0,0,0,0,1|1,0,2]=4 5938 B15R1.78 CC#CCNC(=O)COc1ccccc1 11a_100000685387_100000186222 [0,0,0,0,0,1|1,0,2]=4 5939 B15R1.78 CC#CCNC(=O)COc1ccccc1 1626a_100000685387_100000186222 [0,0,0,0,0,1|1,0,2]=4 5940 B15R1.78 CC#CCNC(=O)COc1ccccc1 527a_100000685387_100000186222 [0,0,0,0,0,1|1,0,2]=4 5941 B15R1.78 CC#CCNC(=O)CSc1ccccc1 11a_100000685387_100000211596 [0,0,0,0,0,1|1,0,2]=4 5942 B15R1.78 CC#CCNC(=O)CSc1ccccc1 1626a_100000685387_100000211596 [0,0,0,0,0,1|1,0,2]=4 5943 B15R1.78 CC#CCNC(=O)CSc1ccccc1 527a_100000685387_100000211596 [0,0,0,0,0,1|1,0,2]=4 5944 B15R1.78 CC#CCNC(=O)NCc1ccccc1 2708a_100015324214_100000685387 [0,0,0,0,0,1|1,0,2]=4 5945 B15R1.78 CC#CCNC(=O)NCc1ccccc1 273464a_100000685387_100015324214 [0,0,0,0,0,1|1,0,2]=4 5946 B15R1.78 CC#CCNC(=O)NCc1ccccc1 273464a_100015324214_100000685387 [0,0,0,0,0,1|1,0,2]=4 5947 B15R1.78 CC#CCNC(=O)NCc1ccccc1 512a_100000685387_100015324214 [0,0,0,0,0,1|1,0,2]=4 5948 B15R1.78 CC#CCNC(=O)NCc1ccccc1 512a_100015324214_100000685387 [0,0,0,0,0,1|1,0,2]=4 5949 B15R1.78 CC(COc1ccccc1)OCCCF 34a_100000210911_100011934791 [0,0,0,0,0,1|2,0,1]=4 5950 B15R1.78 CC(COc1ccccc1)OCCCF 7a_100000210911_100011934791 [0,0,0,0,0,1|2,0,1]=4 5951 B15R1.78 CC(COc1ccccc1)OCCCO 34a_100000210911_100000230001 [0,0,0,0,0,1|2,0,1]=4 5952 B15R1.78 CC(COc1ccccc1)OCCCO 7a_100000210911_100011215043 [0,0,0,0,0,1|2,0,1]=4 5953 B15R1.78 CC/C=C/CC(=O)CCc1ccccc1 1458a_100016274230_100000765856 [0,0,0,0,0,1|1,0,2]=4 5954 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 11a_100015324214_100016274230 [0,0,0,0,0,1|1,0,2]=4 5955 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 1626a_100015324214_100016274230 [0,0,0,0,0,1|1,0,2]=4 5956 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 240690a_100015324214_100016274230 [0,0,0,0,0,1|1,0,2]=4 5957 B15R1.78 CC/C=C/CC(=O)NCc1ccccc1 527a_100015324214_100016274230 [0,0,0,0,0,1|1,0,2]=4 5958 B15R1.78 CC/C=C\CC(=O)CCc1ccccc1 1458a_100000185753_100103147603 [0,0,0,0,0,1|1,0,2]=4 5959 B15R1.78 CC/C=C\CC(=O)COc1ccccc1 1458a_100000186222_100103147603 [0,0,0,0,0,1|1,0,2]=4 5960 B15R1.78 CC/C=C\CC(=O)CSc1ccccc1 1458a_100000211596_100103147603 [0,0,0,0,0,1|1,0,2]=4 5961 B15R1.78 CCC#CCC(=O)CCc1ccccc1 1458a_100000185753_100009813939 [0,0,0,0,0,1|1,0,2]=4 5962 B15R1.78 CCC#CCC(=O)COc1ccccc1 1458a_100000186222_100009813939 [0,0,0,0,0,1|1,0,2]=4 5963 B15R1.78 CCC#CCC(=O)CSc1ccccc1 1458a_100000211596_100009813939 [0,0,0,0,0,1|1,0,2]=4 5964 B15R1.78 CCC=NNC(=O)CCc1ccccc1 4a_100000189782_100000210100 [0,0,0,0,0,1|2,0,1]=4 5965 B15R1.78 CCC=NNC(=O)COc1ccccc1 4a_100000186219_100000210100 [0,0,0,0,0,1|2,0,1]=4 5966 B15R1.78 CCCC#CC(=O)CCc1ccccc1 1458a_200011218047_100000765856 [0,0,0,0,0,1|1,0,1]=3 5967 B15R1.78 CCCC#CC(=O)CCc1ccccn1 1458a_200011218047_100015183660 [0,0,0,0,0,1|2,0,1]=4 5968 B15R1.78 CCCC#CC(=O)CCc1cccnc1 1458a_200011218047_200011713674 [0,0,0,0,0,1|2,0,1]=4 5969 B15R1.78 CCCC#CC(=O)CCc1ccncc1 1458a_200011218047_100000723409 [0,0,0,0,0,1|2,0,1]=4 5970 B15R1.78 CCCC#CC(=O)NCc1ccccc1 240690a_100015324214_200011218047 [0,0,0,0,0,1|1,0,1]=3 5971 B15R1.78 CCCC#CC(=O)NCc1ccccn1 240690a_100000210449_200011218047 [0,0,0,0,0,1|2,0,1]=4 5972 B15R1.78 CCCC#CC(=O)NCc1cccnc1 240690a_100000210453_200011218047 [0,0,0,0,0,1|2,0,1]=4 5973 B15R1.78 CCCC#CC(=O)NCc1ccncc1 240690a_100000210450_200011218047 [0,0,0,0,0,1|2,0,1]=4 5974 B15R1.78 CCCC#CC(=O)NNc1ccccc1 22a_100015195140_200011218047 [0,0,0,0,0,1|2,0,1]=4 5975 B15R1.78 CCCC=CC(=O)CCc1ccccc1 1458a_100000212230_100000765856 [0,0,0,0,0,1|1,0,1]=3 5976 B15R1.78 CCCC=CC(=O)CCc1ccccn1 1458a_100000212230_100015183660 [0,0,0,0,0,1|2,0,1]=4 5977 B15R1.78 CCCC=CC(=O)CCc1cccnc1 1458a_100000212230_200011713674 [0,0,0,0,0,1|2,0,1]=4 5978 B15R1.78 CCCC=CC(=O)CCc1ccncc1 1458a_100000212230_100000723409 [0,0,0,0,0,1|2,0,1]=4 5979 B15R1.78 CCCC=CC(=O)NCc1ccccc1 11a_100015324214_100000212230 [0,0,0,0,0,1|1,0,1]=3 5980 B15R1.78 CCCC=CC(=O)NCc1ccccc1 1626a_100015324214_100000212230 [0,0,0,0,0,1|1,0,1]=3 5981 B15R1.78 CCCC=CC(=O)NCc1ccccc1 240690a_100015324214_100000212230 [0,0,0,0,0,1|1,0,1]=3 5982 B15R1.78 CCCC=CC(=O)NCc1ccccn1 11a_100000210449_100000212230 [0,0,0,0,0,1|2,0,1]=4 5983 B15R1.78 CCCC=CC(=O)NCc1ccccn1 1626a_100000210449_100000212230 [0,0,0,0,0,1|2,0,1]=4 5984 B15R1.78 CCCC=CC(=O)NCc1ccccn1 240690a_100000210449_100000212230 [0,0,0,0,0,1|2,0,1]=4 5985 B15R1.78 CCCC=CC(=O)NCc1cccnc1 11a_100000210453_100000212230 [0,0,0,0,0,1|2,0,1]=4 5986 B15R1.78 CCCC=CC(=O)NCc1cccnc1 240690a_100000210453_100000212230 [0,0,0,0,0,1|2,0,1]=4 5987 B15R1.78 CCCC=CC(=O)NCc1ccncc1 11a_100000210450_100000212230 [0,0,0,0,0,1|2,0,1]=4 5988 B15R1.78 CCCC=CC(=O)NCc1ccncc1 1626a_100000210450_100000212230 [0,0,0,0,0,1|2,0,1]=4 5989 B15R1.78 CCCC=CC(=O)NCc1ccncc1 240690a_100000210450_100000212230 [0,0,0,0,0,1|2,0,1]=4 5990 B15R1.78 CCCC=CC(=O)NNc1ccccc1 22a_100015195140_100000212230 [0,0,0,0,0,1|2,0,1]=4 5991 B15R1.78 CCCCCC(=NNc1ccccc1)C 4a_100015195140_100000211708 [0,0,0,0,0,1|3,0,0]=4 5992 B15R1.78 CCCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210326 [0,0,0,0,0,1|1,0,1]=3 5993 B15R1.78 CCCCCC(=O)C#Cc1ccccn1 1458a_102125277312_100000210326 [0,0,0,0,0,1|2,0,1]=4 5994 B15R1.78 CCCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210326 [0,0,0,0,0,1|1,0,1]=3 5995 B15R1.78 CCCCCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210326 [0,0,0,0,0,1|2,0,1]=4 5996 B15R1.78 CCCCCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210326 [0,0,0,0,0,1|2,0,1]=4 5997 B15R1.78 CCCCCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210326 [0,0,0,0,0,1|2,0,1]=4 5998 B15R1.78 CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210326 [0,0,0,0,0,1|1,0,0]=2 5999 B15R1.78 CCCCCC(=O)CCc1ccccc1 1458a_100000212188_100000765856 [0,0,0,0,0,1|1,0,0]=2 6000 B15R1.78 CCCCCC(=O)CCc1ccccn1 1458a_100000212188_100015183660 [0,0,0,0,0,1|2,0,0]=3 6001 B15R1.78 CCCCCC(=O)CCc1ccccn1 1458a_100015195070_100000210326 [0,0,0,0,0,1|2,0,0]=3 6002 B15R1.78 CCCCCC(=O)CCc1cccnc1 1458a_100000198484_100000210326 [0,0,0,0,0,1|2,0,0]=3 6003 B15R1.78 CCCCCC(=O)CCc1cccnc1 1458a_100000212188_200011713674 [0,0,0,0,0,1|2,0,0]=3 6004 B15R1.78 CCCCCC(=O)CCc1ccncc1 1458a_100000212188_100000723409 [0,0,0,0,0,1|2,0,0]=3 6005 B15R1.78 CCCCCC(=O)CCc1ccncc1 1458a_100011225043_100000210326 [0,0,0,0,0,1|2,0,0]=3 6006 B15R1.78 CCCCCC(=O)CNc1ccccc1 34a_100000106764_200012276598 [0,0,0,0,0,1|1,0,0]=2 6007 B15R1.78 CCCCCC(=O)COc1ccccc1 1458a_100000186222_100000210326 [0,0,0,0,0,1|1,0,0]=2 6008 B15R1.78 CCCCCC(=O)COc1ccccc1 34a_100000210340_200012276598 [0,0,0,0,0,1|1,0,0]=2 6009 B15R1.78 CCCCCC(=O)COc1ccccc1 7a_100000210340_200012276598 [0,0,0,0,0,1|1,0,0]=2 6010 B15R1.78 CCCCCC(=O)COc1ccccn1 1458a_100102699861_100000210326 [0,0,0,0,0,1|2,0,0]=3 6011 B15R1.78 CCCCCC(=O)COc1cccnc1 1458a_100015207166_100000210326 [0,0,0,0,0,1|2,0,0]=3 6012 B15R1.78 CCCCCC(=O)COc1cccnc1 34a_100000210849_200012276598 [0,0,0,0,0,1|2,0,0]=3 6013 B15R1.78 CCCCCC(=O)COc1cccnc1 7a_100000210849_200012276598 [0,0,0,0,0,1|2,0,0]=3 6014 B15R1.78 CCCCCC(=O)COc1ccncc1 34a_100000212176_200012276598 [0,0,0,0,0,1|2,0,0]=3 6015 B15R1.78 CCCCCC(=O)COc1ccnnc1 34a_100015204005_200012276598 [0,0,0,0,0,1|3,0,0]=4 6016 B15R1.78 CCCCCC(=O)COc1cncnc1 7a_100000754086_200012276598 [0,0,0,0,0,1|3,0,0]=4 6017 B15R1.78 CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100000210326 [0,0,0,0,0,1|1,0,0]=2 6018 B15R1.78 CCCCCC(=O)CSc1ccccc1 62a_100000719477_200012276598 [0,0,0,0,0,1|1,0,0]=2 6019 B15R1.78 CCCCCC(=O)CSc1ccccc1 62a_200012276598_100000041952 [0,0,0,0,0,1|1,0,0]=2 6020 B15R1.78 CCCCCC(=O)CSc1ccccn1 1458a_100000156281_100000210326 [0,0,0,0,0,1|2,0,0]=3 6021 B15R1.78 CCCCCC(=O)CSc1ccccn1 62a_100011216584_200012276598 [0,0,0,0,0,1|2,0,0]=3 6022 B15R1.78 CCCCCC(=O)CSc1ccccn1 62a_200012276598_100011216584 [0,0,0,0,0,1|2,0,0]=3 6023 B15R1.78 CCCCCC(=O)CSc1cccnc1 62a_100000210063_200012276598 [0,0,0,0,0,1|2,0,0]=3 6024 B15R1.78 CCCCCC(=O)CSc1cccnc1 62a_200012276598_100000210063 [0,0,0,0,0,1|2,0,0]=3 6025 B15R1.78 CCCCCC(=O)CSc1cccnn1 62a_100016991348_200012276598 [0,0,0,0,0,1|3,0,0]=4 6026 B15R1.78 CCCCCC(=O)CSc1cccnn1 62a_200012276598_100016991348 [0,0,0,0,0,1|3,0,0]=4 6027 B15R1.78 CCCCCC(=O)CSc1ccncc1 1458a_100000211328_100000210326 [0,0,0,0,0,1|2,0,0]=3 6028 B15R1.78 CCCCCC(=O)CSc1ccncc1 62a_100000728582_200012276598 [0,0,0,0,0,1|2,0,0]=3 6029 B15R1.78 CCCCCC(=O)CSc1ccncc1 62a_200012276598_100000728582 [0,0,0,0,0,1|2,0,0]=3 6030 B15R1.78 CCCCCC(=O)CSc1ccncn1 62a_100000703185_200012276598 [0,0,0,0,0,1|3,0,0]=4 6031 B15R1.78 CCCCCC(=O)CSc1ccncn1 62a_200012276598_100000703185 [0,0,0,0,0,1|3,0,0]=4 6032 B15R1.78 CCCCCC(=O)CSc1ccnnc1 62a_100000732662_200012276598 [0,0,0,0,0,1|3,0,0]=4 6033 B15R1.78 CCCCCC(=O)CSc1ccnnc1 62a_200012276598_100000732662 [0,0,0,0,0,1|3,0,0]=4 6034 B15R1.78 CCCCCC(=O)CSc1cnccn1 62a_100000211759_200012276598 [0,0,0,0,0,1|3,0,0]=4 6035 B15R1.78 CCCCCC(=O)CSc1cnccn1 62a_200012276598_100000211759 [0,0,0,0,0,1|3,0,0]=4 6036 B15R1.78 CCCCCC(=O)CSc1cncnc1 62a_100011206942_200012276598 [0,0,0,0,0,1|3,0,0]=4 6037 B15R1.78 CCCCCC(=O)CSc1cncnc1 62a_200012276598_100011206942 [0,0,0,0,0,1|3,0,0]=4 6038 B15R1.78 CCCCCC(=O)CSc1ncccn1 62a_100000211032_200012276598 [0,0,0,0,0,1|3,0,0]=4 6039 B15R1.78 CCCCCC(=O)CSc1ncccn1 62a_200012276598_100000211032 [0,0,0,0,0,1|3,0,0]=4 6040 B15R1.78 CCCCCC(=O)NCc1ccccc1 11a_100015324214_100000212188 [0,0,0,0,0,1|1,0,0]=2 6041 B15R1.78 CCCCCC(=O)NCc1ccccc1 1626a_100015324214_100000212188 [0,0,0,0,0,1|1,0,0]=2 6042 B15R1.78 CCCCCC(=O)NCc1ccccc1 240690a_100015324214_100000212188 [0,0,0,0,0,1|1,0,0]=2 6043 B15R1.78 CCCCCC(=O)NCc1ccccc1 527a_100015324214_100000212188 [0,0,0,0,0,1|1,0,0]=2 6044 B15R1.78 CCCCCC(=O)NCc1ccccn1 11a_100000210449_100000212188 [0,0,0,0,0,1|2,0,0]=3 6045 B15R1.78 CCCCCC(=O)NCc1ccccn1 1626a_100000210449_100000212188 [0,0,0,0,0,1|2,0,0]=3 6046 B15R1.78 CCCCCC(=O)NCc1ccccn1 240690a_100000210449_100000212188 [0,0,0,0,0,1|2,0,0]=3 6047 B15R1.78 CCCCCC(=O)NCc1ccccn1 527a_100000210449_100000212188 [0,0,0,0,0,1|2,0,0]=3 6048 B15R1.78 CCCCCC(=O)NCc1cccnc1 11a_100000210453_100000212188 [0,0,0,0,0,1|2,0,0]=3 6049 B15R1.78 CCCCCC(=O)NCc1cccnc1 240690a_100000210453_100000212188 [0,0,0,0,0,1|2,0,0]=3 6050 B15R1.78 CCCCCC(=O)NCc1cccnc1 527a_100000210453_100000212188 [0,0,0,0,0,1|2,0,0]=3 6051 B15R1.78 CCCCCC(=O)NCc1cccnn1 11a_100159270163_100000212188 [0,0,0,0,0,1|3,0,0]=4 6052 B15R1.78 CCCCCC(=O)NCc1cccnn1 240690a_100159270163_100000212188 [0,0,0,0,0,1|3,0,0]=4 6053 B15R1.78 CCCCCC(=O)NCc1cccnn1 527a_100159270163_100000212188 [0,0,0,0,0,1|3,0,0]=4 6054 B15R1.78 CCCCCC(=O)NCc1ccncc1 11a_100000210450_100000212188 [0,0,0,0,0,1|2,0,0]=3 6055 B15R1.78 CCCCCC(=O)NCc1ccncc1 1626a_100000210450_100000212188 [0,0,0,0,0,1|2,0,0]=3 6056 B15R1.78 CCCCCC(=O)NCc1ccncc1 240690a_100000210450_100000212188 [0,0,0,0,0,1|2,0,0]=3 6057 B15R1.78 CCCCCC(=O)NCc1ccncc1 527a_100000210450_100000212188 [0,0,0,0,0,1|2,0,0]=3 6058 B15R1.78 CCCCCC(=O)NCc1ccncn1 11a_100000736019_100000212188 [0,0,0,0,0,1|3,0,0]=4 6059 B15R1.78 CCCCCC(=O)NCc1ccncn1 240690a_100000736019_100000212188 [0,0,0,0,0,1|3,0,0]=4 6060 B15R1.78 CCCCCC(=O)NCc1ccncn1 527a_100000736019_100000212188 [0,0,0,0,0,1|3,0,0]=4 6061 B15R1.78 CCCCCC(=O)NCc1cnccn1 11a_100000737960_100000212188 [0,0,0,0,0,1|3,0,0]=4 6062 B15R1.78 CCCCCC(=O)NCc1cnccn1 240690a_100000737960_100000212188 [0,0,0,0,0,1|3,0,0]=4 6063 B15R1.78 CCCCCC(=O)NCc1cnccn1 527a_100000737960_100000212188 [0,0,0,0,0,1|3,0,0]=4 6064 B15R1.78 CCCCCC(=O)NCc1cncnc1 11a_100011243677_100000212188 [0,0,0,0,0,1|3,0,0]=4 6065 B15R1.78 CCCCCC(=O)NCc1cncnc1 240690a_100011243677_100000212188 [0,0,0,0,0,1|3,0,0]=4 6066 B15R1.78 CCCCCC(=O)NCc1cncnc1 527a_100011243677_100000212188 [0,0,0,0,0,1|3,0,0]=4 6067 B15R1.78 CCCCCC(=O)NCc1ncccn1 11a_100015189908_100000212188 [0,0,0,0,0,1|3,0,0]=4 6068 B15R1.78 CCCCCC(=O)NCc1ncccn1 240690a_100015189908_100000212188 [0,0,0,0,0,1|3,0,0]=4 6069 B15R1.78 CCCCCC(=O)NCc1ncccn1 527a_100015189908_100000212188 [0,0,0,0,0,1|3,0,0]=4 6070 B15R1.78 CCCCCC(=O)NNc1ccccc1 22a_100015195140_100000212188 [0,0,0,0,0,1|2,0,0]=3 6071 B15R1.78 CCCCCC(=O)NNc1ccccn1 22a_100000183288_100000212188 [0,0,0,0,0,1|3,0,0]=4 6072 B15R1.78 CCCCCC(=O)NNc1cccnc1 22a_100000728903_100000212188 [0,0,0,0,0,1|3,0,0]=4 6073 B15R1.78 CCCCCC(=O)NNc1ccncc1 22a_100000698918_100000212188 [0,0,0,0,0,1|3,0,0]=4 6074 B15R1.78 CCCCCC(C)NCc1ccccc1 207a_100000211957_100015611070 [0,0,0,0,0,1|2,0,1]=4 6075 B15R1.78 CCCCCC(C)NCc1ccccc1 2230a_100000211957_100015291786 [0,0,0,0,0,1|2,0,1]=4 6076 B15R1.78 CCCCCC(C)NCc1ccccc1 2230a_100015324214_200011218191 [0,0,0,0,0,1|2,0,1]=4 6077 B15R1.78 CCCCCC(C)NCc1ccccc1 270004a_100000211957_100015611070 [0,0,0,0,0,1|2,0,1]=4 6078 B15R1.78 CCCCCC(C)NCc1ccccc1 270004a_100015324214_100000211708 [0,0,0,0,0,1|2,0,1]=4 6079 B15R1.78 CCCCCC(C)NCc1ccccc1 34a_100015324214_200011218191 [0,0,0,0,0,1|2,0,1]=4 6080 B15R1.78 CCCCCC(C)OCc1ccccc1 34a_100000210790_200011218191 [0,0,0,0,0,1|2,0,1]=4 6081 B15R1.78 CCCCCC(C)OCc1ccccc1 34a_100011215632_100015291786 [0,0,0,0,0,1|2,0,1]=4 6082 B15R1.78 CCCCCC(C)OCc1ccccc1 7a_100000210790_200011218191 [0,0,0,0,0,1|2,0,1]=4 6083 B15R1.78 CCCCCC(C)OCc1ccccc1 7a_100011215632_100000211182 [0,0,0,0,0,1|2,0,1]=4 6084 B15R1.78 CCCCCC(C)SCc1ccccc1 62a_100000211182_200011218191 [0,0,0,0,0,1|2,0,1]=4 6085 B15R1.78 CCCCCC(C)SCc1ccccc1 62a_200011218191_100015291786 [0,0,0,0,0,1|2,0,1]=4 6086 B15R1.78 CCCCCN(C)CCc1ccccc1 2230a_100000207497_100000210326 [0,0,0,0,0,1|3,0,0]=4 6087 B15R1.78 CCCCCN(C)CCc1ccccc1 2230a_100000223495_100000765856 [0,0,0,0,0,1|3,0,0]=4 6088 B15R1.78 CCCCCN(C)CCc1ccccc1 269982a_100000207497_100000210215 [0,0,0,0,0,1|3,0,0]=4 6089 B15R1.78 CCCCCN(C)CCc1ccccc1 269982a_100000223495_100000765856 [0,0,0,0,0,1|3,0,0]=4 6090 B15R1.78 CCCCCN(C)CSc1ccccc1 2230a_100000223495_100011218342 [0,0,0,0,0,1|3,0,0]=4 6091 B15R1.78 CCCCCN(C)CSc1ccccc1 269982a_100000223495_100011218342 [0,0,0,0,0,1|3,0,0]=4 6092 B15R1.78 CCCCNC(=O)C#Cc1ccccc1 240690a_100000102301_100000736102 [0,0,0,0,0,1|1,0,1]=3 6093 B15R1.78 CCCCNC(=O)C=Cc1ccccc1 11a_100000102301_100000210462 [0,0,0,0,0,1|1,0,1]=3 6094 B15R1.78 CCCCNC(=O)C=Cc1ccccc1 1626a_100000102301_100000210462 [0,0,0,0,0,1|1,0,1]=3 6095 B15R1.78 CCCCNC(=O)C=Cc1ccccn1 11a_100000102301_100000740811 [0,0,0,0,0,1|2,0,1]=4 6096 B15R1.78 CCCCNC(=O)C=Cc1ccccn1 240690a_100000102301_100000740811 [0,0,0,0,0,1|2,0,1]=4 6097 B15R1.78 CCCCNC(=O)C=Cc1cccnc1 11a_100000102301_100000735890 [0,0,0,0,0,1|2,0,1]=4 6098 B15R1.78 CCCCNC(=O)C=Cc1cccnc1 240690a_100000102301_100000735890 [0,0,0,0,0,1|2,0,1]=4 6099 B15R1.78 CCCCNC(=O)C=Cc1ccncc1 240690a_100000102301_100000682801 [0,0,0,0,0,1|2,0,1]=4 6100 B15R1.78 CCCCNC(=O)CCc1ccccc1 11a_100000102301_100000185753 [0,0,0,0,0,1|1,0,0]=2 6101 B15R1.78 CCCCNC(=O)CCc1ccccc1 1626a_100000102301_100000185753 [0,0,0,0,0,1|1,0,0]=2 6102 B15R1.78 CCCCNC(=O)CCc1ccccc1 240690a_100000102301_100000185753 [0,0,0,0,0,1|1,0,0]=2 6103 B15R1.78 CCCCNC(=O)CCc1ccccc1 527a_100000102301_100000185753 [0,0,0,0,0,1|1,0,0]=2 6104 B15R1.78 CCCCNC(=O)CCc1ccccn1 11a_100000102301_100015195070 [0,0,0,0,0,1|2,0,0]=3 6105 B15R1.78 CCCCNC(=O)CCc1ccccn1 240690a_100000102301_100015195070 [0,0,0,0,0,1|2,0,0]=3 6106 B15R1.78 CCCCNC(=O)CCc1ccccn1 527a_100000102301_100015195070 [0,0,0,0,0,1|2,0,0]=3 6107 B15R1.78 CCCCNC(=O)CCc1cccnc1 11a_100000102301_100000198484 [0,0,0,0,0,1|2,0,0]=3 6108 B15R1.78 CCCCNC(=O)CCc1cccnc1 1626a_100000102301_100000198484 [0,0,0,0,0,1|2,0,0]=3 6109 B15R1.78 CCCCNC(=O)CCc1cccnc1 240690a_100000102301_100000198484 [0,0,0,0,0,1|2,0,0]=3 6110 B15R1.78 CCCCNC(=O)CCc1cccnc1 527a_100000102301_100000198484 [0,0,0,0,0,1|2,0,0]=3 6111 B15R1.78 CCCCNC(=O)CCc1ccncc1 11a_100000102301_100011225043 [0,0,0,0,0,1|2,0,0]=3 6112 B15R1.78 CCCCNC(=O)CCc1ccncc1 240690a_100000102301_100011225043 [0,0,0,0,0,1|2,0,0]=3 6113 B15R1.78 CCCCNC(=O)CCc1ccncc1 527a_100000102301_100011225043 [0,0,0,0,0,1|2,0,0]=3 6114 B15R1.78 CCCCNC(=O)CNc1ccccc1 34a_100000106764_100000182744 [0,0,0,0,0,1|1,0,0]=2 6115 B15R1.78 CCCCNC(=O)COc1ccccc1 11a_100000102301_100000186222 [0,0,0,0,0,1|1,0,0]=2 6116 B15R1.78 CCCCNC(=O)COc1ccccc1 1626a_100000102301_100000186222 [0,0,0,0,0,1|1,0,0]=2 6117 B15R1.78 CCCCNC(=O)COc1ccccc1 240690a_100000102301_100000186222 [0,0,0,0,0,1|1,0,0]=2 6118 B15R1.78 CCCCNC(=O)COc1ccccc1 34a_100000210340_100000182744 [0,0,0,0,0,1|1,0,0]=2 6119 B15R1.78 CCCCNC(=O)COc1ccccc1 527a_100000102301_100000186222 [0,0,0,0,0,1|1,0,0]=2 6120 B15R1.78 CCCCNC(=O)COc1ccccc1 7a_100000210340_100000182744 [0,0,0,0,0,1|1,0,0]=2 6121 B15R1.78 CCCCNC(=O)COc1ccccn1 1626a_100000102301_100102699861 [0,0,0,0,0,1|2,0,0]=3 6122 B15R1.78 CCCCNC(=O)COc1ccccn1 240690a_100000102301_100102699861 [0,0,0,0,0,1|2,0,0]=3 6123 B15R1.78 CCCCNC(=O)COc1ccccn1 527a_100000102301_100102699861 [0,0,0,0,0,1|2,0,0]=3 6124 B15R1.78 CCCCNC(=O)COc1cccnc1 11a_100000102301_100015207166 [0,0,0,0,0,1|2,0,0]=3 6125 B15R1.78 CCCCNC(=O)COc1cccnc1 1626a_100000102301_100015207166 [0,0,0,0,0,1|2,0,0]=3 6126 B15R1.78 CCCCNC(=O)COc1cccnc1 240690a_100000102301_100015207166 [0,0,0,0,0,1|2,0,0]=3 6127 B15R1.78 CCCCNC(=O)COc1cccnc1 34a_100000210849_100000182744 [0,0,0,0,0,1|2,0,0]=3 6128 B15R1.78 CCCCNC(=O)COc1cccnc1 527a_100000102301_100015207166 [0,0,0,0,0,1|2,0,0]=3 6129 B15R1.78 CCCCNC(=O)COc1cccnc1 7a_100000210849_100000182744 [0,0,0,0,0,1|2,0,0]=3 6130 B15R1.78 CCCCNC(=O)COc1ccncc1 34a_100000212176_100000182744 [0,0,0,0,0,1|2,0,0]=3 6131 B15R1.78 CCCCNC(=O)COc1ccnnc1 34a_100015204005_100000182744 [0,0,0,0,0,1|3,0,0]=4 6132 B15R1.78 CCCCNC(=O)COc1cncnc1 7a_100000754086_100000182744 [0,0,0,0,0,1|3,0,0]=4 6133 B15R1.78 CCCCNC(=O)CSc1ccccc1 11a_100000102301_100000211596 [0,0,0,0,0,1|1,0,0]=2 6134 B15R1.78 CCCCNC(=O)CSc1ccccc1 1626a_100000102301_100000211596 [0,0,0,0,0,1|1,0,0]=2 6135 B15R1.78 CCCCNC(=O)CSc1ccccc1 240690a_100000102301_100000211596 [0,0,0,0,0,1|1,0,0]=2 6136 B15R1.78 CCCCNC(=O)CSc1ccccc1 527a_100000102301_100000211596 [0,0,0,0,0,1|1,0,0]=2 6137 B15R1.78 CCCCNC(=O)CSc1ccccc1 62a_100000182744_100000041952 [0,0,0,0,0,1|1,0,0]=2 6138 B15R1.78 CCCCNC(=O)CSc1ccccc1 62a_100000719477_100000182744 [0,0,0,0,0,1|1,0,0]=2 6139 B15R1.78 CCCCNC(=O)CSc1ccccn1 11a_100000102301_100000156281 [0,0,0,0,0,1|2,0,0]=3 6140 B15R1.78 CCCCNC(=O)CSc1ccccn1 240690a_100000102301_100000156281 [0,0,0,0,0,1|2,0,0]=3 6141 B15R1.78 CCCCNC(=O)CSc1ccccn1 527a_100000102301_100000156281 [0,0,0,0,0,1|2,0,0]=3 6142 B15R1.78 CCCCNC(=O)CSc1ccccn1 62a_100000182744_100011216584 [0,0,0,0,0,1|2,0,0]=3 6143 B15R1.78 CCCCNC(=O)CSc1ccccn1 62a_100011216584_100000182744 [0,0,0,0,0,1|2,0,0]=3 6144 B15R1.78 CCCCNC(=O)CSc1cccnc1 62a_100000182744_100000210063 [0,0,0,0,0,1|2,0,0]=3 6145 B15R1.78 CCCCNC(=O)CSc1cccnc1 62a_100000210063_100000182744 [0,0,0,0,0,1|2,0,0]=3 6146 B15R1.78 CCCCNC(=O)CSc1cccnn1 62a_100000182744_100016991348 [0,0,0,0,0,1|3,0,0]=4 6147 B15R1.78 CCCCNC(=O)CSc1cccnn1 62a_100016991348_100000182744 [0,0,0,0,0,1|3,0,0]=4 6148 B15R1.78 CCCCNC(=O)CSc1ccncc1 11a_100000102301_100000211328 [0,0,0,0,0,1|2,0,0]=3 6149 B15R1.78 CCCCNC(=O)CSc1ccncc1 1626a_100000102301_100000211328 [0,0,0,0,0,1|2,0,0]=3 6150 B15R1.78 CCCCNC(=O)CSc1ccncc1 240690a_100000102301_100000211328 [0,0,0,0,0,1|2,0,0]=3 6151 B15R1.78 CCCCNC(=O)CSc1ccncc1 527a_100000102301_100000211328 [0,0,0,0,0,1|2,0,0]=3 6152 B15R1.78 CCCCNC(=O)CSc1ccncc1 62a_100000182744_100000728582 [0,0,0,0,0,1|2,0,0]=3 6153 B15R1.78 CCCCNC(=O)CSc1ccncc1 62a_100000728582_100000182744 [0,0,0,0,0,1|2,0,0]=3 6154 B15R1.78 CCCCNC(=O)CSc1ccncn1 62a_100000182744_100000703185 [0,0,0,0,0,1|3,0,0]=4 6155 B15R1.78 CCCCNC(=O)CSc1ccncn1 62a_100000703185_100000182744 [0,0,0,0,0,1|3,0,0]=4 6156 B15R1.78 CCCCNC(=O)CSc1ccnnc1 62a_100000182744_100000732662 [0,0,0,0,0,1|3,0,0]=4 6157 B15R1.78 CCCCNC(=O)CSc1ccnnc1 62a_100000732662_100000182744 [0,0,0,0,0,1|3,0,0]=4 6158 B15R1.78 CCCCNC(=O)CSc1cnccn1 62a_100000182744_100000211759 [0,0,0,0,0,1|3,0,0]=4 6159 B15R1.78 CCCCNC(=O)CSc1cnccn1 62a_100000211759_100000182744 [0,0,0,0,0,1|3,0,0]=4 6160 B15R1.78 CCCCNC(=O)CSc1cncnc1 62a_100000182744_100011206942 [0,0,0,0,0,1|3,0,0]=4 6161 B15R1.78 CCCCNC(=O)CSc1cncnc1 62a_100011206942_100000182744 [0,0,0,0,0,1|3,0,0]=4 6162 B15R1.78 CCCCNC(=O)CSc1ncccn1 240690a_100000102301_200000156282 [0,0,0,0,0,1|3,0,0]=4 6163 B15R1.78 CCCCNC(=O)CSc1ncccn1 62a_100000182744_100000211032 [0,0,0,0,0,1|3,0,0]=4 6164 B15R1.78 CCCCNC(=O)CSc1ncccn1 62a_100000211032_100000182744 [0,0,0,0,0,1|3,0,0]=4 6165 B15R1.78 CCCCNC(=O)NCc1ccccc1 2708a_100000102301_100015324214 [0,0,0,0,0,1|1,0,0]=2 6166 B15R1.78 CCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000102301 [0,0,0,0,0,1|1,0,0]=2 6167 B15R1.78 CCCCNC(=O)NCc1ccccc1 273464a_100000102301_100015324214 [0,0,0,0,0,1|1,0,0]=2 6168 B15R1.78 CCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000102301 [0,0,0,0,0,1|1,0,0]=2 6169 B15R1.78 CCCCNC(=O)NCc1ccccc1 512a_100000102301_100015324214 [0,0,0,0,0,1|1,0,0]=2 6170 B15R1.78 CCCCNC(=O)NCc1ccccc1 512a_100015324214_100000102301 [0,0,0,0,0,1|1,0,0]=2 6171 B15R1.78 CCCCNC(=O)NCc1ccccn1 2708a_100000102301_100000210449 [0,0,0,0,0,1|2,0,0]=3 6172 B15R1.78 CCCCNC(=O)NCc1ccccn1 2708a_100000210449_100000102301 [0,0,0,0,0,1|2,0,0]=3 6173 B15R1.78 CCCCNC(=O)NCc1ccccn1 273464a_100000102301_100000210449 [0,0,0,0,0,1|2,0,0]=3 6174 B15R1.78 CCCCNC(=O)NCc1ccccn1 273464a_100000210449_100000102301 [0,0,0,0,0,1|2,0,0]=3 6175 B15R1.78 CCCCNC(=O)NCc1ccccn1 512a_100000102301_100000210449 [0,0,0,0,0,1|2,0,0]=3 6176 B15R1.78 CCCCNC(=O)NCc1cccnc1 2708a_100000102301_100000210453 [0,0,0,0,0,1|2,0,0]=3 6177 B15R1.78 CCCCNC(=O)NCc1cccnc1 2708a_100000210453_100000102301 [0,0,0,0,0,1|2,0,0]=3 6178 B15R1.78 CCCCNC(=O)NCc1cccnc1 273464a_100000102301_100000210453 [0,0,0,0,0,1|2,0,0]=3 6179 B15R1.78 CCCCNC(=O)NCc1cccnc1 273464a_100000210453_100000102301 [0,0,0,0,0,1|2,0,0]=3 6180 B15R1.78 CCCCNC(=O)NCc1cccnc1 512a_100000102301_100000210453 [0,0,0,0,0,1|2,0,0]=3 6181 B15R1.78 CCCCNC(=O)NCc1cccnc1 512a_100000210453_100000102301 [0,0,0,0,0,1|2,0,0]=3 6182 B15R1.78 CCCCNC(=O)NCc1cccnn1 2708a_100000102301_100159270163 [0,0,0,0,0,1|3,0,0]=4 6183 B15R1.78 CCCCNC(=O)NCc1cccnn1 2708a_100159270163_100000102301 [0,0,0,0,0,1|3,0,0]=4 6184 B15R1.78 CCCCNC(=O)NCc1cccnn1 273464a_100000102301_100159270163 [0,0,0,0,0,1|3,0,0]=4 6185 B15R1.78 CCCCNC(=O)NCc1cccnn1 273464a_100159270163_100000102301 [0,0,0,0,0,1|3,0,0]=4 6186 B15R1.78 CCCCNC(=O)NCc1cccnn1 512a_100000102301_100159270163 [0,0,0,0,0,1|3,0,0]=4 6187 B15R1.78 CCCCNC(=O)NCc1cccnn1 512a_100159270163_100000102301 [0,0,0,0,0,1|3,0,0]=4 6188 B15R1.78 CCCCNC(=O)NCc1ccncc1 2708a_100000102301_100000210450 [0,0,0,0,0,1|2,0,0]=3 6189 B15R1.78 CCCCNC(=O)NCc1ccncc1 2708a_100000210450_100000102301 [0,0,0,0,0,1|2,0,0]=3 6190 B15R1.78 CCCCNC(=O)NCc1ccncc1 273464a_100000102301_100000210450 [0,0,0,0,0,1|2,0,0]=3 6191 B15R1.78 CCCCNC(=O)NCc1ccncc1 273464a_100000210450_100000102301 [0,0,0,0,0,1|2,0,0]=3 6192 B15R1.78 CCCCNC(=O)NCc1ccncc1 512a_100000102301_100000210450 [0,0,0,0,0,1|2,0,0]=3 6193 B15R1.78 CCCCNC(=O)NCc1ccncn1 2708a_100000102301_100000736019 [0,0,0,0,0,1|3,0,0]=4 6194 B15R1.78 CCCCNC(=O)NCc1ccncn1 273464a_100000102301_100000736019 [0,0,0,0,0,1|3,0,0]=4 6195 B15R1.78 CCCCNC(=O)NCc1ccncn1 512a_100000102301_100000736019 [0,0,0,0,0,1|3,0,0]=4 6196 B15R1.78 CCCCNC(=O)NCc1ccncn1 512a_100000736019_100000102301 [0,0,0,0,0,1|3,0,0]=4 6197 B15R1.78 CCCCNC(=O)NCc1cnccn1 2708a_100000102301_100000737960 [0,0,0,0,0,1|3,0,0]=4 6198 B15R1.78 CCCCNC(=O)NCc1cnccn1 2708a_100000737960_100000102301 [0,0,0,0,0,1|3,0,0]=4 6199 B15R1.78 CCCCNC(=O)NCc1cnccn1 273464a_100000102301_100000737960 [0,0,0,0,0,1|3,0,0]=4 6200 B15R1.78 CCCCNC(=O)NCc1cnccn1 273464a_100000737960_100000102301 [0,0,0,0,0,1|3,0,0]=4 6201 B15R1.78 CCCCNC(=O)NCc1cnccn1 512a_100000102301_100000737960 [0,0,0,0,0,1|3,0,0]=4 6202 B15R1.78 CCCCNC(=O)NCc1cnccn1 512a_100000737960_100000102301 [0,0,0,0,0,1|3,0,0]=4 6203 B15R1.78 CCCCNC(=O)NCc1cncnc1 2708a_100000102301_100011243677 [0,0,0,0,0,1|3,0,0]=4 6204 B15R1.78 CCCCNC(=O)NCc1cncnc1 2708a_100011243677_100000102301 [0,0,0,0,0,1|3,0,0]=4 6205 B15R1.78 CCCCNC(=O)NCc1cncnc1 273464a_100000102301_100011243677 [0,0,0,0,0,1|3,0,0]=4 6206 B15R1.78 CCCCNC(=O)NCc1cncnc1 273464a_100011243677_100000102301 [0,0,0,0,0,1|3,0,0]=4 6207 B15R1.78 CCCCNC(=O)NCc1cncnc1 512a_100000102301_100011243677 [0,0,0,0,0,1|3,0,0]=4 6208 B15R1.78 CCCCNC(=O)NCc1cncnc1 512a_100011243677_100000102301 [0,0,0,0,0,1|3,0,0]=4 6209 B15R1.78 CCCCNC(=O)NCc1ncccn1 2708a_100000102301_100015189908 [0,0,0,0,0,1|3,0,0]=4 6210 B15R1.78 CCCCNC(=O)NCc1ncccn1 2708a_100015189908_100000102301 [0,0,0,0,0,1|3,0,0]=4 6211 B15R1.78 CCCCNC(=O)NCc1ncccn1 273464a_100000102301_100015189908 [0,0,0,0,0,1|3,0,0]=4 6212 B15R1.78 CCCCNC(=O)NCc1ncccn1 273464a_100015189908_100000102301 [0,0,0,0,0,1|3,0,0]=4 6213 B15R1.78 CCCCNC(=O)NCc1ncccn1 512a_100000102301_100015189908 [0,0,0,0,0,1|3,0,0]=4 6214 B15R1.78 CCCCNC(=O)NCc1ncccn1 512a_100015189908_100000102301 [0,0,0,0,0,1|3,0,0]=4 6215 B15R1.78 CCCCNC(=O)NNc1ccccc1 273464a_100000102301_100015195140 [0,0,0,0,0,1|2,0,0]=3 6216 B15R1.78 CCCCNC(=O)NNc1ccccc1 512a_100000102301_100015195140 [0,0,0,0,0,1|2,0,0]=3 6217 B15R1.78 CCCCNC(=O)NNc1ccccn1 273464a_100000102301_100000183288 [0,0,0,0,0,1|3,0,0]=4 6218 B15R1.78 CCCCNC(=O)NNc1ccccn1 512a_100000102301_100000183288 [0,0,0,0,0,1|3,0,0]=4 6219 B15R1.78 CCCCNC(=O)NNc1cccnc1 273464a_100000102301_100000728903 [0,0,0,0,0,1|3,0,0]=4 6220 B15R1.78 CCCCNC(=O)NNc1cccnc1 512a_100000102301_100000728903 [0,0,0,0,0,1|3,0,0]=4 6221 B15R1.78 CCCCNC(=O)NNc1ccncc1 273464a_100000102301_100000698918 [0,0,0,0,0,1|3,0,0]=4 6222 B15R1.78 CCCCNC(=O)NNc1ccncc1 512a_100000102301_100000698918 [0,0,0,0,0,1|3,0,0]=4 6223 B15R1.78 CCCCNC(C)CCc1ccccc1 2230a_100000210798_100000210211 [0,0,0,0,0,1|2,0,1]=4 6224 B15R1.78 CCCCNC(C)CCc1ccccc1 270004a_100000102301_100000210092 [0,0,0,0,0,1|2,0,1]=4 6225 B15R1.78 CCCCNC(C)CCc1ccccc1 34a_100000210798_100000210210 [0,0,0,0,0,1|2,0,1]=4 6226 B15R1.78 CCCCNC(C)COc1ccccc1 2230a_100000746794_100000210211 [0,0,0,0,0,1|2,0,1]=4 6227 B15R1.78 CCCCNC(C)COc1ccccc1 270004a_100000102301_100000150576 [0,0,0,0,0,1|2,0,1]=4 6228 B15R1.78 CCCCNC(C)COc1ccccc1 34a_100000746794_100000210210 [0,0,0,0,0,1|2,0,1]=4 6229 B15R1.78 CCCCNC(C)CSc1ccccc1 270004a_100000102301_100000150717 [0,0,0,0,0,1|2,0,1]=4 6230 B15R1.78 CCCCOC(=O)CNc1ccccc1 34a_100000106764_100000211628 [0,0,0,0,0,1|0,0,0]=1 6231 B15R1.78 CCCCOC(=O)COc1ccccc1 34a_100000210340_100000211628 [0,0,0,0,0,1|0,0,0]=1 6232 B15R1.78 CCCCOC(=O)COc1ccccc1 7a_100000210340_100000211628 [0,0,0,0,0,1|0,0,0]=1 6233 B15R1.78 CCCCOC(=O)COc1cccnc1 34a_100000210849_100000211628 [0,0,0,0,0,1|1,0,0]=2 6234 B15R1.78 CCCCOC(=O)COc1cccnc1 7a_100000210849_100000211628 [0,0,0,0,0,1|1,0,0]=2 6235 B15R1.78 CCCCOC(=O)COc1ccncc1 34a_100000212176_100000211628 [0,0,0,0,0,1|1,0,0]=2 6236 B15R1.78 CCCCOC(=O)COc1ccnnc1 34a_100015204005_100000211628 [0,0,0,0,0,1|2,0,0]=3 6237 B15R1.78 CCCCOC(=O)COc1cncnc1 7a_100000754086_100000211628 [0,0,0,0,0,1|2,0,0]=3 6238 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000211628_100000041952 [0,0,0,0,0,1|0,0,0]=1 6239 B15R1.78 CCCCOC(=O)CSc1ccccc1 62a_100000719477_100000211628 [0,0,0,0,0,1|0,0,0]=1 6240 B15R1.78 CCCCOC(=O)CSc1ccccn1 62a_100000211628_100011216584 [0,0,0,0,0,1|1,0,0]=2 6241 B15R1.78 CCCCOC(=O)CSc1ccccn1 62a_100011216584_100000211628 [0,0,0,0,0,1|1,0,0]=2 6242 B15R1.78 CCCCOC(=O)CSc1cccnc1 62a_100000210063_100000211628 [0,0,0,0,0,1|1,0,0]=2 6243 B15R1.78 CCCCOC(=O)CSc1cccnc1 62a_100000211628_100000210063 [0,0,0,0,0,1|1,0,0]=2 6244 B15R1.78 CCCCOC(=O)CSc1cccnn1 62a_100000211628_100016991348 [0,0,0,0,0,1|2,0,0]=3 6245 B15R1.78 CCCCOC(=O)CSc1cccnn1 62a_100016991348_100000211628 [0,0,0,0,0,1|2,0,0]=3 6246 B15R1.78 CCCCOC(=O)CSc1ccncc1 62a_100000211628_100000728582 [0,0,0,0,0,1|1,0,0]=2 6247 B15R1.78 CCCCOC(=O)CSc1ccncc1 62a_100000728582_100000211628 [0,0,0,0,0,1|1,0,0]=2 6248 B15R1.78 CCCCOC(=O)CSc1ccncn1 62a_100000211628_100000703185 [0,0,0,0,0,1|2,0,0]=3 6249 B15R1.78 CCCCOC(=O)CSc1ccncn1 62a_100000703185_100000211628 [0,0,0,0,0,1|2,0,0]=3 6250 B15R1.78 CCCCOC(=O)CSc1ccnnc1 62a_100000211628_100000732662 [0,0,0,0,0,1|2,0,0]=3 6251 B15R1.78 CCCCOC(=O)CSc1ccnnc1 62a_100000732662_100000211628 [0,0,0,0,0,1|2,0,0]=3 6252 B15R1.78 CCCCOC(=O)CSc1cnccn1 62a_100000211628_100000211759 [0,0,0,0,0,1|2,0,0]=3 6253 B15R1.78 CCCCOC(=O)CSc1cnccn1 62a_100000211759_100000211628 [0,0,0,0,0,1|2,0,0]=3 6254 B15R1.78 CCCCOC(=O)CSc1cncnc1 62a_100000211628_100011206942 [0,0,0,0,0,1|2,0,0]=3 6255 B15R1.78 CCCCOC(=O)CSc1cncnc1 62a_100011206942_100000211628 [0,0,0,0,0,1|2,0,0]=3 6256 B15R1.78 CCCCOC(=O)CSc1cnnnc1 62a_100000211628_100009846058 [0,0,0,0,0,1|3,0,0]=4 6257 B15R1.78 CCCCOC(=O)CSc1cnnnc1 62a_100009846058_100000211628 [0,0,0,0,0,1|3,0,0]=4 6258 B15R1.78 CCCCOC(=O)CSc1ncccn1 62a_100000211032_100000211628 [0,0,0,0,0,1|2,0,0]=3 6259 B15R1.78 CCCCOC(=O)CSc1ncccn1 62a_100000211628_100000211032 [0,0,0,0,0,1|2,0,0]=3 6260 B15R1.78 CCCCOC(C)C#Cc1ccccc1 34a_200000065209_100000210210 [0,0,0,0,0,1|1,0,2]=4 6261 B15R1.78 CCCCOC(C)C#Cc1ccccc1 7a_200000065209_100000210211 [0,0,0,0,0,1|1,0,2]=4 6262 B15R1.78 CCCCOC(C)COc1ccccc1 34a_100000210911_100000210210 [0,0,0,0,0,1|1,0,1]=3 6263 B15R1.78 CCCCOC(C)COc1ccccc1 7a_100000210911_100000210211 [0,0,0,0,0,1|1,0,1]=3 6264 B15R1.78 CCCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000210210 [0,0,0,0,0,1|1,0,1]=3 6265 B15R1.78 CCCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000210211 [0,0,0,0,0,1|1,0,1]=3 6266 B15R1.78 CCCNCC(=O)NCc1ccccc1 2230a_100000739245_100000210303 [0,0,0,0,0,1|2,0,0]=3 6267 B15R1.78 CCCNN=C(C)CCc1ccccc1 4a_100000740057_100000210092 [0,0,0,0,0,1|3,0,0]=4 6268 B15R1.78 CCCNN=C(C)COc1ccccc1 4a_100000740057_100000150576 [0,0,0,0,0,1|3,0,0]=4 6269 B15R1.78 CCCNN=C(C)CSc1ccccc1 4a_100000740057_100000150717 [0,0,0,0,0,1|3,0,0]=4 6270 B15R1.78 CCCNNC(=O)C#Cc1ccccc1 22a_100000740057_100000736102 [0,0,0,0,0,1|2,0,1]=4 6271 B15R1.78 CCCNNC(=O)C=Cc1ccccc1 22a_100000740057_100000210462 [0,0,0,0,0,1|2,0,1]=4 6272 B15R1.78 CCCNNC(=O)CCc1ccccc1 22a_100000740057_100000185753 [0,0,0,0,0,1|2,0,0]=3 6273 B15R1.78 CCCNNC(=O)CCc1ccccn1 22a_100000740057_100015195070 [0,0,0,0,0,1|3,0,0]=4 6274 B15R1.78 CCCNNC(=O)CCc1cccnc1 22a_100000740057_100000198484 [0,0,0,0,0,1|3,0,0]=4 6275 B15R1.78 CCCNNC(=O)CCc1ccncc1 22a_100000740057_100011225043 [0,0,0,0,0,1|3,0,0]=4 6276 B15R1.78 CCCNNC(=O)COc1ccccc1 22a_100000740057_100000186222 [0,0,0,0,0,1|2,0,0]=3 6277 B15R1.78 CCCNNC(=O)COc1ccccn1 22a_100000740057_100102699861 [0,0,0,0,0,1|3,0,0]=4 6278 B15R1.78 CCCNNC(=O)COc1cccnc1 22a_100000740057_100015207166 [0,0,0,0,0,1|3,0,0]=4 6279 B15R1.78 CCCNNC(=O)CSc1ccccc1 22a_100000740057_100000211596 [0,0,0,0,0,1|2,0,0]=3 6280 B15R1.78 CCCNNC(=O)CSc1ccccn1 22a_100000740057_100000156281 [0,0,0,0,0,1|3,0,0]=4 6281 B15R1.78 CCCNNC(=O)CSc1ccncc1 22a_100000740057_100000211328 [0,0,0,0,0,1|3,0,0]=4 6282 B15R1.78 CCCNNC(=O)NCc1ccccc1 273464a_100015324214_100000740057 [0,0,0,0,0,1|2,0,0]=3 6283 B15R1.78 CCCNNC(=O)NCc1ccccc1 512a_100000740057_100015324214 [0,0,0,0,0,1|2,0,0]=3 6284 B15R1.78 CCCNNC(=O)NCc1ccccc1 512a_100015324214_100000740057 [0,0,0,0,0,1|2,0,0]=3 6285 B15R1.78 CCCNNC(=O)NCc1ccccn1 273464a_100000210449_100000740057 [0,0,0,0,0,1|3,0,0]=4 6286 B15R1.78 CCCNNC(=O)NCc1ccccn1 512a_100000740057_100000210449 [0,0,0,0,0,1|3,0,0]=4 6287 B15R1.78 CCCNNC(=O)NCc1cccnc1 273464a_100000210453_100000740057 [0,0,0,0,0,1|3,0,0]=4 6288 B15R1.78 CCCNNC(=O)NCc1cccnc1 512a_100000210453_100000740057 [0,0,0,0,0,1|3,0,0]=4 6289 B15R1.78 CCCNNC(=O)NCc1cccnc1 512a_100000740057_100000210453 [0,0,0,0,0,1|3,0,0]=4 6290 B15R1.78 CCCNNC(=O)NCc1ccncc1 273464a_100000210450_100000740057 [0,0,0,0,0,1|3,0,0]=4 6291 B15R1.78 CCCNNC(=O)NCc1ccncc1 512a_100000740057_100000210450 [0,0,0,0,0,1|3,0,0]=4 6292 B15R1.78 CCCNNC(=O)NNc1ccccc1 512a_100000740057_100015195140 [0,0,0,0,0,1|3,0,0]=4 6293 B15R1.78 CCCOCC(=O)CCc1ccccc1 1458a_100000745993_100000765856 [0,0,0,0,0,1|2,0,0]=3 6294 B15R1.78 CCCOCC(=O)CCc1ccccc1 34a_100000210258_100012361361 [0,0,0,0,0,1|2,0,0]=3 6295 B15R1.78 CCCOCC(=O)CCc1ccccn1 1458a_100000745993_100015183660 [0,0,0,0,0,1|3,0,0]=4 6296 B15R1.78 CCCOCC(=O)CCc1cccnc1 1458a_100000745993_200011713674 [0,0,0,0,0,1|3,0,0]=4 6297 B15R1.78 CCCOCC(=O)CCc1ccncc1 1458a_100000745993_100000723409 [0,0,0,0,0,1|3,0,0]=4 6298 B15R1.78 CCCOCC(=O)NCc1ccccc1 11a_100015324214_100000745993 [0,0,0,0,0,1|2,0,0]=3 6299 B15R1.78 CCCOCC(=O)NCc1ccccc1 1626a_100015324214_100000745993 [0,0,0,0,0,1|2,0,0]=3 6300 B15R1.78 CCCOCC(=O)NCc1ccccc1 240690a_100015324214_100000745993 [0,0,0,0,0,1|2,0,0]=3 6301 B15R1.78 CCCOCC(=O)NCc1ccccc1 34a_100000210258_100000183539 [0,0,0,0,0,1|2,0,0]=3 6302 B15R1.78 CCCOCC(=O)NCc1ccccc1 527a_100015324214_100000745993 [0,0,0,0,0,1|2,0,0]=3 6303 B15R1.78 CCCOCC(=O)NCc1ccccn1 11a_100000210449_100000745993 [0,0,0,0,0,1|3,0,0]=4 6304 B15R1.78 CCCOCC(=O)NCc1ccccn1 1626a_100000210449_100000745993 [0,0,0,0,0,1|3,0,0]=4 6305 B15R1.78 CCCOCC(=O)NCc1ccccn1 240690a_100000210449_100000745993 [0,0,0,0,0,1|3,0,0]=4 6306 B15R1.78 CCCOCC(=O)NCc1ccccn1 34a_100000210258_100000684169 [0,0,0,0,0,1|3,0,0]=4 6307 B15R1.78 CCCOCC(=O)NCc1ccccn1 527a_100000210449_100000745993 [0,0,0,0,0,1|3,0,0]=4 6308 B15R1.78 CCCOCC(=O)NCc1cccnc1 11a_100000210453_100000745993 [0,0,0,0,0,1|3,0,0]=4 6309 B15R1.78 CCCOCC(=O)NCc1cccnc1 240690a_100000210453_100000745993 [0,0,0,0,0,1|3,0,0]=4 6310 B15R1.78 CCCOCC(=O)NCc1cccnc1 527a_100000210453_100000745993 [0,0,0,0,0,1|3,0,0]=4 6311 B15R1.78 CCCOCC(=O)NCc1ccncc1 11a_100000210450_100000745993 [0,0,0,0,0,1|3,0,0]=4 6312 B15R1.78 CCCOCC(=O)NCc1ccncc1 1626a_100000210450_100000745993 [0,0,0,0,0,1|3,0,0]=4 6313 B15R1.78 CCCOCC(=O)NCc1ccncc1 240690a_100000210450_100000745993 [0,0,0,0,0,1|3,0,0]=4 6314 B15R1.78 CCCOCC(=O)NCc1ccncc1 527a_100000210450_100000745993 [0,0,0,0,0,1|3,0,0]=4 6315 B15R1.78 CCCOCC(=O)NNc1ccccc1 22a_100015195140_100000745993 [0,0,0,0,0,1|3,0,0]=4 6316 B15R1.78 CCCOCC(=O)OCc1ccccc1 34a_100000210258_100000753625 [0,0,0,0,0,1|2,0,0]=3 6317 B15R1.78 CCCSCC(=O)CCc1ccccc1 1458a_100000217233_100000765856 [0,0,0,0,0,1|2,0,0]=3 6318 B15R1.78 CCCSCC(=O)CCc1ccccc1 62a_100000210303_100012361361 [0,0,0,0,0,1|2,0,0]=3 6319 B15R1.78 CCCSCC(=O)CCc1ccccc1 62a_100012361361_100000210303 [0,0,0,0,0,1|2,0,0]=3 6320 B15R1.78 CCCSCC(=O)CCc1ccccn1 1458a_100000217233_100015183660 [0,0,0,0,0,1|3,0,0]=4 6321 B15R1.78 CCCSCC(=O)CCc1cccnc1 1458a_100000217233_200011713674 [0,0,0,0,0,1|3,0,0]=4 6322 B15R1.78 CCCSCC(=O)CCc1ccncc1 1458a_100000217233_100000723409 [0,0,0,0,0,1|3,0,0]=4 6323 B15R1.78 CCCSCC(=O)NCc1ccccc1 11a_100015324214_100000217233 [0,0,0,0,0,1|2,0,0]=3 6324 B15R1.78 CCCSCC(=O)NCc1ccccc1 1626a_100015324214_100000217233 [0,0,0,0,0,1|2,0,0]=3 6325 B15R1.78 CCCSCC(=O)NCc1ccccc1 240690a_100015324214_100000217233 [0,0,0,0,0,1|2,0,0]=3 6326 B15R1.78 CCCSCC(=O)NCc1ccccc1 527a_100015324214_100000217233 [0,0,0,0,0,1|2,0,0]=3 6327 B15R1.78 CCCSCC(=O)NCc1ccccc1 62a_100000183539_100000210303 [0,0,0,0,0,1|2,0,0]=3 6328 B15R1.78 CCCSCC(=O)NCc1ccccc1 62a_100000210303_100000183539 [0,0,0,0,0,1|2,0,0]=3 6329 B15R1.78 CCCSCC(=O)NCc1ccccn1 11a_100000210449_100000217233 [0,0,0,0,0,1|3,0,0]=4 6330 B15R1.78 CCCSCC(=O)NCc1ccccn1 1626a_100000210449_100000217233 [0,0,0,0,0,1|3,0,0]=4 6331 B15R1.78 CCCSCC(=O)NCc1ccccn1 240690a_100000210449_100000217233 [0,0,0,0,0,1|3,0,0]=4 6332 B15R1.78 CCCSCC(=O)NCc1ccccn1 527a_100000210449_100000217233 [0,0,0,0,0,1|3,0,0]=4 6333 B15R1.78 CCCSCC(=O)NCc1ccccn1 62a_100000210303_100000684169 [0,0,0,0,0,1|3,0,0]=4 6334 B15R1.78 CCCSCC(=O)NCc1ccccn1 62a_100000684169_100000210303 [0,0,0,0,0,1|3,0,0]=4 6335 B15R1.78 CCCSCC(=O)NCc1cccnc1 11a_100000210453_100000217233 [0,0,0,0,0,1|3,0,0]=4 6336 B15R1.78 CCCSCC(=O)NCc1cccnc1 240690a_100000210453_100000217233 [0,0,0,0,0,1|3,0,0]=4 6337 B15R1.78 CCCSCC(=O)NCc1cccnc1 527a_100000210453_100000217233 [0,0,0,0,0,1|3,0,0]=4 6338 B15R1.78 CCCSCC(=O)NCc1cccnc1 62a_100000210303_100000752408 [0,0,0,0,0,1|3,0,0]=4 6339 B15R1.78 CCCSCC(=O)NCc1cccnc1 62a_100000752408_100000210303 [0,0,0,0,0,1|3,0,0]=4 6340 B15R1.78 CCCSCC(=O)NCc1ccncc1 11a_100000210450_100000217233 [0,0,0,0,0,1|3,0,0]=4 6341 B15R1.78 CCCSCC(=O)NCc1ccncc1 1626a_100000210450_100000217233 [0,0,0,0,0,1|3,0,0]=4 6342 B15R1.78 CCCSCC(=O)NCc1ccncc1 240690a_100000210450_100000217233 [0,0,0,0,0,1|3,0,0]=4 6343 B15R1.78 CCCSCC(=O)NCc1ccncc1 527a_100000210450_100000217233 [0,0,0,0,0,1|3,0,0]=4 6344 B15R1.78 CCCSCC(=O)NCc1ccncc1 62a_100000210303_100011243468 [0,0,0,0,0,1|3,0,0]=4 6345 B15R1.78 CCCSCC(=O)NCc1ccncc1 62a_100011243468_100000210303 [0,0,0,0,0,1|3,0,0]=4 6346 B15R1.78 CCCSCC(=O)NNc1ccccc1 22a_100015195140_100000217233 [0,0,0,0,0,1|3,0,0]=4 6347 B15R1.78 CCCSCC(=O)OCc1ccccc1 62a_100000210303_100000753625 [0,0,0,0,0,1|2,0,0]=3 6348 B15R1.78 CCCSCC(=O)OCc1ccccc1 62a_100000753625_100000210303 [0,0,0,0,0,1|2,0,0]=3 6349 B15R1.78 CCNCCC(=O)NCc1ccccc1 2230a_100025741942_100000210202 [0,0,0,0,0,1|2,0,0]=3 6350 B15R1.78 CCNCCC(=O)NCc1ccccc1 34a_100025741942_100000210202 [0,0,0,0,0,1|2,0,0]=3 6351 B15R1.78 CCNCCC(=O)OCc1ccccc1 2230a_100015525214_100009813219 [0,0,0,0,0,1|2,0,0]=3 6352 B15R1.78 CCOC=CC(=O)CCc1ccccc1 1458a_100016266692_100000765856 [0,0,0,0,0,1|2,0,1]=4 6353 B15R1.78 CCOC=CC(=O)NCc1ccccc1 11a_100015324214_100016266692 [0,0,0,0,0,1|2,0,1]=4 6354 B15R1.78 CCOC=CC(=O)NCc1ccccc1 1626a_100015324214_100016266692 [0,0,0,0,0,1|2,0,1]=4 6355 B15R1.78 CCOC=CC(=O)NCc1ccccc1 240690a_100015324214_100016266692 [0,0,0,0,0,1|2,0,1]=4 6356 B15R1.78 CCOCCC(=O)C#Cc1ccccc1 1458a_100000736102_100011215890 [0,0,0,0,0,1|2,0,1]=4 6357 B15R1.78 CCOCCC(=O)C=Cc1ccccc1 1458a_100000210462_100011215890 [0,0,0,0,0,1|2,0,1]=4 6358 B15R1.78 CCOCCC(=O)CCc1ccccc1 1458a_100000185753_100011215890 [0,0,0,0,0,1|2,0,0]=3 6359 B15R1.78 CCOCCC(=O)CCc1ccccc1 1458a_100000749530_100000765856 [0,0,0,0,0,1|2,0,0]=3 6360 B15R1.78 CCOCCC(=O)CCc1ccccn1 1458a_100000749530_100015183660 [0,0,0,0,0,1|3,0,0]=4 6361 B15R1.78 CCOCCC(=O)CCc1ccccn1 1458a_100015195070_100011215890 [0,0,0,0,0,1|3,0,0]=4 6362 B15R1.78 CCOCCC(=O)CCc1cccnc1 1458a_100000198484_100011215890 [0,0,0,0,0,1|3,0,0]=4 6363 B15R1.78 CCOCCC(=O)CCc1cccnc1 1458a_100000749530_200011713674 [0,0,0,0,0,1|3,0,0]=4 6364 B15R1.78 CCOCCC(=O)CCc1ccncc1 1458a_100000749530_100000723409 [0,0,0,0,0,1|3,0,0]=4 6365 B15R1.78 CCOCCC(=O)CCc1ccncc1 1458a_100011225043_100011215890 [0,0,0,0,0,1|3,0,0]=4 6366 B15R1.78 CCOCCC(=O)COc1ccccc1 1458a_100000186222_100011215890 [0,0,0,0,0,1|2,0,0]=3 6367 B15R1.78 CCOCCC(=O)COc1ccccn1 1458a_100102699861_100011215890 [0,0,0,0,0,1|3,0,0]=4 6368 B15R1.78 CCOCCC(=O)COc1cccnc1 1458a_100015207166_100011215890 [0,0,0,0,0,1|3,0,0]=4 6369 B15R1.78 CCOCCC(=O)CSc1ccccc1 1458a_100000211596_100011215890 [0,0,0,0,0,1|2,0,0]=3 6370 B15R1.78 CCOCCC(=O)CSc1ccccn1 1458a_100000156281_100011215890 [0,0,0,0,0,1|3,0,0]=4 6371 B15R1.78 CCOCCC(=O)CSc1ccncc1 1458a_100000211328_100011215890 [0,0,0,0,0,1|3,0,0]=4 6372 B15R1.78 CCOCCC(=O)NCc1ccccc1 11a_100015324214_100000749530 [0,0,0,0,0,1|2,0,0]=3 6373 B15R1.78 CCOCCC(=O)NCc1ccccc1 1626a_100015324214_100000749530 [0,0,0,0,0,1|2,0,0]=3 6374 B15R1.78 CCOCCC(=O)NCc1ccccc1 240690a_100015324214_100000749530 [0,0,0,0,0,1|2,0,0]=3 6375 B15R1.78 CCOCCC(=O)NCc1ccccc1 527a_100015324214_100000749530 [0,0,0,0,0,1|2,0,0]=3 6376 B15R1.78 CCOCCC(=O)NCc1ccccn1 11a_100000210449_100000749530 [0,0,0,0,0,1|3,0,0]=4 6377 B15R1.78 CCOCCC(=O)NCc1ccccn1 1626a_100000210449_100000749530 [0,0,0,0,0,1|3,0,0]=4 6378 B15R1.78 CCOCCC(=O)NCc1ccccn1 240690a_100000210449_100000749530 [0,0,0,0,0,1|3,0,0]=4 6379 B15R1.78 CCOCCC(=O)NCc1ccccn1 527a_100000210449_100000749530 [0,0,0,0,0,1|3,0,0]=4 6380 B15R1.78 CCOCCC(=O)NCc1cccnc1 11a_100000210453_100000749530 [0,0,0,0,0,1|3,0,0]=4 6381 B15R1.78 CCOCCC(=O)NCc1cccnc1 240690a_100000210453_100000749530 [0,0,0,0,0,1|3,0,0]=4 6382 B15R1.78 CCOCCC(=O)NCc1cccnc1 527a_100000210453_100000749530 [0,0,0,0,0,1|3,0,0]=4 6383 B15R1.78 CCOCCC(=O)NCc1ccncc1 11a_100000210450_100000749530 [0,0,0,0,0,1|3,0,0]=4 6384 B15R1.78 CCOCCC(=O)NCc1ccncc1 1626a_100000210450_100000749530 [0,0,0,0,0,1|3,0,0]=4 6385 B15R1.78 CCOCCC(=O)NCc1ccncc1 240690a_100000210450_100000749530 [0,0,0,0,0,1|3,0,0]=4 6386 B15R1.78 CCOCCC(=O)NCc1ccncc1 527a_100000210450_100000749530 [0,0,0,0,0,1|3,0,0]=4 6387 B15R1.78 CCOCCC(=O)NNc1ccccc1 22a_100015195140_100000749530 [0,0,0,0,0,1|3,0,0]=4 6388 B15R1.78 CCOCCC(=O)OCc1ccccc1 7a_100009831632_100000210202 [0,0,0,0,0,1|2,0,0]=3 6389 B15R1.78 CCSCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000757381 [0,0,0,0,0,1|2,0,1]=4 6390 B15R1.78 CCSCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000757381 [0,0,0,0,0,1|2,0,1]=4 6391 B15R1.78 CCSCCC(=O)CCc1ccccc1 1458a_100000185753_100000757381 [0,0,0,0,0,1|2,0,0]=3 6392 B15R1.78 CCSCCC(=O)CCc1ccccc1 1458a_100000230768_100000765856 [0,0,0,0,0,1|2,0,0]=3 6393 B15R1.78 CCSCCC(=O)CCc1ccccn1 1458a_100000230768_100015183660 [0,0,0,0,0,1|3,0,0]=4 6394 B15R1.78 CCSCCC(=O)CCc1ccccn1 1458a_100015195070_100000757381 [0,0,0,0,0,1|3,0,0]=4 6395 B15R1.78 CCSCCC(=O)CCc1cccnc1 1458a_100000198484_100000757381 [0,0,0,0,0,1|3,0,0]=4 6396 B15R1.78 CCSCCC(=O)CCc1cccnc1 1458a_100000230768_200011713674 [0,0,0,0,0,1|3,0,0]=4 6397 B15R1.78 CCSCCC(=O)CCc1ccncc1 1458a_100000230768_100000723409 [0,0,0,0,0,1|3,0,0]=4 6398 B15R1.78 CCSCCC(=O)CCc1ccncc1 1458a_100011225043_100000757381 [0,0,0,0,0,1|3,0,0]=4 6399 B15R1.78 CCSCCC(=O)COc1ccccc1 1458a_100000186222_100000757381 [0,0,0,0,0,1|2,0,0]=3 6400 B15R1.78 CCSCCC(=O)COc1ccccn1 1458a_100102699861_100000757381 [0,0,0,0,0,1|3,0,0]=4 6401 B15R1.78 CCSCCC(=O)COc1cccnc1 1458a_100015207166_100000757381 [0,0,0,0,0,1|3,0,0]=4 6402 B15R1.78 CCSCCC(=O)CSc1ccccc1 1458a_100000211596_100000757381 [0,0,0,0,0,1|2,0,0]=3 6403 B15R1.78 CCSCCC(=O)CSc1ccccn1 1458a_100000156281_100000757381 [0,0,0,0,0,1|3,0,0]=4 6404 B15R1.78 CCSCCC(=O)CSc1ccncc1 1458a_100000211328_100000757381 [0,0,0,0,0,1|3,0,0]=4 6405 B15R1.78 CCSCCC(=O)NCc1ccccc1 11a_100015324214_100000230768 [0,0,0,0,0,1|2,0,0]=3 6406 B15R1.78 CCSCCC(=O)NCc1ccccc1 1626a_100015324214_100000230768 [0,0,0,0,0,1|2,0,0]=3 6407 B15R1.78 CCSCCC(=O)NCc1ccccc1 240690a_100015324214_100000230768 [0,0,0,0,0,1|2,0,0]=3 6408 B15R1.78 CCSCCC(=O)NCc1ccccc1 527a_100015324214_100000230768 [0,0,0,0,0,1|2,0,0]=3 6409 B15R1.78 CCSCCC(=O)NCc1ccccn1 11a_100000210449_100000230768 [0,0,0,0,0,1|3,0,0]=4 6410 B15R1.78 CCSCCC(=O)NCc1ccccn1 1626a_100000210449_100000230768 [0,0,0,0,0,1|3,0,0]=4 6411 B15R1.78 CCSCCC(=O)NCc1ccccn1 240690a_100000210449_100000230768 [0,0,0,0,0,1|3,0,0]=4 6412 B15R1.78 CCSCCC(=O)NCc1ccccn1 527a_100000210449_100000230768 [0,0,0,0,0,1|3,0,0]=4 6413 B15R1.78 CCSCCC(=O)NCc1cccnc1 11a_100000210453_100000230768 [0,0,0,0,0,1|3,0,0]=4 6414 B15R1.78 CCSCCC(=O)NCc1cccnc1 240690a_100000210453_100000230768 [0,0,0,0,0,1|3,0,0]=4 6415 B15R1.78 CCSCCC(=O)NCc1cccnc1 527a_100000210453_100000230768 [0,0,0,0,0,1|3,0,0]=4 6416 B15R1.78 CCSCCC(=O)NCc1ccncc1 11a_100000210450_100000230768 [0,0,0,0,0,1|3,0,0]=4 6417 B15R1.78 CCSCCC(=O)NCc1ccncc1 1626a_100000210450_100000230768 [0,0,0,0,0,1|3,0,0]=4 6418 B15R1.78 CCSCCC(=O)NCc1ccncc1 240690a_100000210450_100000230768 [0,0,0,0,0,1|3,0,0]=4 6419 B15R1.78 CCSCCC(=O)NCc1ccncc1 527a_100000210450_100000230768 [0,0,0,0,0,1|3,0,0]=4 6420 B15R1.78 CCSCCC(=O)NNc1ccccc1 22a_100015195140_100000230768 [0,0,0,0,0,1|3,0,0]=4 6421 B15R1.78 CCSCCC(=O)OCc1ccccc1 62a_100000210202_100009813219 [0,0,0,0,0,1|2,0,0]=3 6422 B15R1.78 CCSCCC(=O)OCc1ccccc1 62a_100009813219_100000210202 [0,0,0,0,0,1|2,0,0]=3 6423 B15R1.78 CNCCCC(=O)OCc1ccccc1 2230a_106832991635_100009813218 [0,0,0,0,0,1|2,0,0]=3 6424 B15R1.78 CNCCCC(=O)OCc1ccccc1 34a_100102657272_100009813218 [0,0,0,0,0,1|2,0,0]=3 6425 B15R1.78 CNCCCC(=O)OCc1ccccc1 7a_106832991635_100009813218 [0,0,0,0,0,1|2,0,0]=3 6426 B15R1.78 CNCCNC(=O)OCc1ccccc1 2230a_106832991635_100012357035 [0,0,0,0,0,1|2,0,0]=3 6427 B15R1.78 CNCCNC(=O)OCc1ccccc1 7a_106832991635_100012357035 [0,0,0,0,0,1|2,0,0]=3 6428 B15R1.78 COCC=CC(=O)CCc1ccccc1 1458a_100016285016_100000765856 [0,0,0,0,0,1|2,0,1]=4 6429 B15R1.78 COCC=CC(=O)NCc1ccccc1 11a_100015324214_100016285016 [0,0,0,0,0,1|2,0,1]=4 6430 B15R1.78 COCC=CC(=O)NCc1ccccc1 1626a_100015324214_100016285016 [0,0,0,0,0,1|2,0,1]=4 6431 B15R1.78 COCC=CC(=O)NCc1ccccc1 240690a_100015324214_100016285016 [0,0,0,0,0,1|2,0,1]=4 6432 B15R1.78 COCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000740836 [0,0,0,0,0,1|2,0,1]=4 6433 B15R1.78 COCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000740836 [0,0,0,0,0,1|2,0,1]=4 6434 B15R1.78 COCCCC(=O)CCc1ccccc1 1458a_100000185753_100000740836 [0,0,0,0,0,1|2,0,0]=3 6435 B15R1.78 COCCCC(=O)CCc1ccccc1 1458a_100000741012_100000765856 [0,0,0,0,0,1|2,0,0]=3 6436 B15R1.78 COCCCC(=O)CCc1ccccn1 1458a_100000741012_100015183660 [0,0,0,0,0,1|3,0,0]=4 6437 B15R1.78 COCCCC(=O)CCc1ccccn1 1458a_100015195070_100000740836 [0,0,0,0,0,1|3,0,0]=4 6438 B15R1.78 COCCCC(=O)CCc1cccnc1 1458a_100000198484_100000740836 [0,0,0,0,0,1|3,0,0]=4 6439 B15R1.78 COCCCC(=O)CCc1cccnc1 1458a_100000741012_200011713674 [0,0,0,0,0,1|3,0,0]=4 6440 B15R1.78 COCCCC(=O)CCc1ccncc1 1458a_100000741012_100000723409 [0,0,0,0,0,1|3,0,0]=4 6441 B15R1.78 COCCCC(=O)CCc1ccncc1 1458a_100011225043_100000740836 [0,0,0,0,0,1|3,0,0]=4 6442 B15R1.78 COCCCC(=O)COc1ccccc1 1458a_100000186222_100000740836 [0,0,0,0,0,1|2,0,0]=3 6443 B15R1.78 COCCCC(=O)COc1ccccn1 1458a_100102699861_100000740836 [0,0,0,0,0,1|3,0,0]=4 6444 B15R1.78 COCCCC(=O)COc1cccnc1 1458a_100015207166_100000740836 [0,0,0,0,0,1|3,0,0]=4 6445 B15R1.78 COCCCC(=O)CSc1ccccc1 1458a_100000211596_100000740836 [0,0,0,0,0,1|2,0,0]=3 6446 B15R1.78 COCCCC(=O)CSc1ccccn1 1458a_100000156281_100000740836 [0,0,0,0,0,1|3,0,0]=4 6447 B15R1.78 COCCCC(=O)CSc1ccncc1 1458a_100000211328_100000740836 [0,0,0,0,0,1|3,0,0]=4 6448 B15R1.78 COCCCC(=O)NCc1ccccc1 11a_100015324214_100000741012 [0,0,0,0,0,1|2,0,0]=3 6449 B15R1.78 COCCCC(=O)NCc1ccccc1 1626a_100015324214_100000741012 [0,0,0,0,0,1|2,0,0]=3 6450 B15R1.78 COCCCC(=O)NCc1ccccc1 240690a_100015324214_100000741012 [0,0,0,0,0,1|2,0,0]=3 6451 B15R1.78 COCCCC(=O)NCc1ccccc1 527a_100015324214_100000741012 [0,0,0,0,0,1|2,0,0]=3 6452 B15R1.78 COCCCC(=O)NCc1ccccn1 11a_100000210449_100000741012 [0,0,0,0,0,1|3,0,0]=4 6453 B15R1.78 COCCCC(=O)NCc1ccccn1 1626a_100000210449_100000741012 [0,0,0,0,0,1|3,0,0]=4 6454 B15R1.78 COCCCC(=O)NCc1ccccn1 240690a_100000210449_100000741012 [0,0,0,0,0,1|3,0,0]=4 6455 B15R1.78 COCCCC(=O)NCc1ccccn1 527a_100000210449_100000741012 [0,0,0,0,0,1|3,0,0]=4 6456 B15R1.78 COCCCC(=O)NCc1cccnc1 11a_100000210453_100000741012 [0,0,0,0,0,1|3,0,0]=4 6457 B15R1.78 COCCCC(=O)NCc1cccnc1 240690a_100000210453_100000741012 [0,0,0,0,0,1|3,0,0]=4 6458 B15R1.78 COCCCC(=O)NCc1cccnc1 527a_100000210453_100000741012 [0,0,0,0,0,1|3,0,0]=4 6459 B15R1.78 COCCCC(=O)NCc1ccncc1 11a_100000210450_100000741012 [0,0,0,0,0,1|3,0,0]=4 6460 B15R1.78 COCCCC(=O)NCc1ccncc1 1626a_100000210450_100000741012 [0,0,0,0,0,1|3,0,0]=4 6461 B15R1.78 COCCCC(=O)NCc1ccncc1 240690a_100000210450_100000741012 [0,0,0,0,0,1|3,0,0]=4 6462 B15R1.78 COCCCC(=O)NCc1ccncc1 527a_100000210450_100000741012 [0,0,0,0,0,1|3,0,0]=4 6463 B15R1.78 COCCCC(=O)NNc1ccccc1 22a_100015195140_100000741012 [0,0,0,0,0,1|3,0,0]=4 6464 B15R1.78 COCCCC(=O)OCc1ccccc1 34a_100138415774_100009813218 [0,0,0,0,0,1|2,0,0]=3 6465 B15R1.78 COCCCC(=O)OCc1ccccc1 7a_100009831633_200000210301 [0,0,0,0,0,1|2,0,0]=3 6466 B15R1.78 COCCNC(=O)C#Cc1ccccc1 240690a_100000209980_100000736102 [0,0,0,0,0,1|2,0,1]=4 6467 B15R1.78 COCCNC(=O)C=Cc1ccccc1 1626a_100000209980_100000210462 [0,0,0,0,0,1|2,0,1]=4 6468 B15R1.78 COCCNC(=O)CCc1ccccc1 1626a_100000209980_100000185753 [0,0,0,0,0,1|2,0,0]=3 6469 B15R1.78 COCCNC(=O)CCc1ccccc1 240690a_100000209980_100000185753 [0,0,0,0,0,1|2,0,0]=3 6470 B15R1.78 COCCNC(=O)CCc1ccccc1 527a_100000209980_100000185753 [0,0,0,0,0,1|2,0,0]=3 6471 B15R1.78 COCCNC(=O)CCc1ccccn1 240690a_100000209980_100015195070 [0,0,0,0,0,1|3,0,0]=4 6472 B15R1.78 COCCNC(=O)CCc1ccccn1 527a_100000209980_100015195070 [0,0,0,0,0,1|3,0,0]=4 6473 B15R1.78 COCCNC(=O)CCc1cccnc1 1626a_100000209980_100000198484 [0,0,0,0,0,1|3,0,0]=4 6474 B15R1.78 COCCNC(=O)CCc1cccnc1 240690a_100000209980_100000198484 [0,0,0,0,0,1|3,0,0]=4 6475 B15R1.78 COCCNC(=O)CCc1cccnc1 527a_100000209980_100000198484 [0,0,0,0,0,1|3,0,0]=4 6476 B15R1.78 COCCNC(=O)CCc1ccncc1 240690a_100000209980_100011225043 [0,0,0,0,0,1|3,0,0]=4 6477 B15R1.78 COCCNC(=O)CCc1ccncc1 527a_100000209980_100011225043 [0,0,0,0,0,1|3,0,0]=4 6478 B15R1.78 COCCNC(=O)CNc1ccccc1 34a_100000106764_100000183275 [0,0,0,0,0,1|2,0,0]=3 6479 B15R1.78 COCCNC(=O)COc1ccccc1 1626a_100000209980_100000186222 [0,0,0,0,0,1|2,0,0]=3 6480 B15R1.78 COCCNC(=O)COc1ccccc1 240690a_100000209980_100000186222 [0,0,0,0,0,1|2,0,0]=3 6481 B15R1.78 COCCNC(=O)COc1ccccc1 34a_100000210340_100000183275 [0,0,0,0,0,1|2,0,0]=3 6482 B15R1.78 COCCNC(=O)COc1ccccc1 527a_100000209980_100000186222 [0,0,0,0,0,1|2,0,0]=3 6483 B15R1.78 COCCNC(=O)COc1ccccc1 7a_100000210340_100000183275 [0,0,0,0,0,1|2,0,0]=3 6484 B15R1.78 COCCNC(=O)COc1ccccn1 1626a_100000209980_100102699861 [0,0,0,0,0,1|3,0,0]=4 6485 B15R1.78 COCCNC(=O)COc1ccccn1 240690a_100000209980_100102699861 [0,0,0,0,0,1|3,0,0]=4 6486 B15R1.78 COCCNC(=O)COc1ccccn1 527a_100000209980_100102699861 [0,0,0,0,0,1|3,0,0]=4 6487 B15R1.78 COCCNC(=O)COc1cccnc1 1626a_100000209980_100015207166 [0,0,0,0,0,1|3,0,0]=4 6488 B15R1.78 COCCNC(=O)COc1cccnc1 240690a_100000209980_100015207166 [0,0,0,0,0,1|3,0,0]=4 6489 B15R1.78 COCCNC(=O)COc1cccnc1 34a_100000210849_100000183275 [0,0,0,0,0,1|3,0,0]=4 6490 B15R1.78 COCCNC(=O)COc1cccnc1 527a_100000209980_100015207166 [0,0,0,0,0,1|3,0,0]=4 6491 B15R1.78 COCCNC(=O)COc1cccnc1 7a_100000210849_100000183275 [0,0,0,0,0,1|3,0,0]=4 6492 B15R1.78 COCCNC(=O)COc1ccncc1 34a_100000212176_100000183275 [0,0,0,0,0,1|3,0,0]=4 6493 B15R1.78 COCCNC(=O)CSc1ccccc1 1626a_100000209980_100000211596 [0,0,0,0,0,1|2,0,0]=3 6494 B15R1.78 COCCNC(=O)CSc1ccccc1 240690a_100000209980_100000211596 [0,0,0,0,0,1|2,0,0]=3 6495 B15R1.78 COCCNC(=O)CSc1ccccc1 527a_100000209980_100000211596 [0,0,0,0,0,1|2,0,0]=3 6496 B15R1.78 COCCNC(=O)CSc1ccccc1 62a_100000183275_100000041952 [0,0,0,0,0,1|2,0,0]=3 6497 B15R1.78 COCCNC(=O)CSc1ccccc1 62a_100000719477_100000183275 [0,0,0,0,0,1|2,0,0]=3 6498 B15R1.78 COCCNC(=O)CSc1ccccn1 240690a_100000209980_100000156281 [0,0,0,0,0,1|3,0,0]=4 6499 B15R1.78 COCCNC(=O)CSc1ccccn1 527a_100000209980_100000156281 [0,0,0,0,0,1|3,0,0]=4 6500 B15R1.78 COCCNC(=O)CSc1ccccn1 62a_100000183275_100011216584 [0,0,0,0,0,1|3,0,0]=4 6501 B15R1.78 COCCNC(=O)CSc1ccccn1 62a_100011216584_100000183275 [0,0,0,0,0,1|3,0,0]=4 6502 B15R1.78 COCCNC(=O)CSc1cccnc1 62a_100000183275_100000210063 [0,0,0,0,0,1|3,0,0]=4 6503 B15R1.78 COCCNC(=O)CSc1cccnc1 62a_100000210063_100000183275 [0,0,0,0,0,1|3,0,0]=4 6504 B15R1.78 COCCNC(=O)CSc1ccncc1 1626a_100000209980_100000211328 [0,0,0,0,0,1|3,0,0]=4 6505 B15R1.78 COCCNC(=O)CSc1ccncc1 240690a_100000209980_100000211328 [0,0,0,0,0,1|3,0,0]=4 6506 B15R1.78 COCCNC(=O)CSc1ccncc1 527a_100000209980_100000211328 [0,0,0,0,0,1|3,0,0]=4 6507 B15R1.78 COCCNC(=O)CSc1ccncc1 62a_100000183275_100000728582 [0,0,0,0,0,1|3,0,0]=4 6508 B15R1.78 COCCNC(=O)CSc1ccncc1 62a_100000728582_100000183275 [0,0,0,0,0,1|3,0,0]=4 6509 B15R1.78 COCCNC(=O)NCc1ccccc1 2708a_100015324214_100000209980 [0,0,0,0,0,1|2,0,0]=3 6510 B15R1.78 COCCNC(=O)NCc1ccccc1 273464a_100000209980_100015324214 [0,0,0,0,0,1|2,0,0]=3 6511 B15R1.78 COCCNC(=O)NCc1ccccc1 273464a_100015324214_100000209980 [0,0,0,0,0,1|2,0,0]=3 6512 B15R1.78 COCCNC(=O)NCc1ccccn1 2708a_100000210449_100000209980 [0,0,0,0,0,1|3,0,0]=4 6513 B15R1.78 COCCNC(=O)NCc1ccccn1 273464a_100000209980_100000210449 [0,0,0,0,0,1|3,0,0]=4 6514 B15R1.78 COCCNC(=O)NCc1ccccn1 273464a_100000210449_100000209980 [0,0,0,0,0,1|3,0,0]=4 6515 B15R1.78 COCCNC(=O)NCc1cccnc1 2708a_100000210453_100000209980 [0,0,0,0,0,1|3,0,0]=4 6516 B15R1.78 COCCNC(=O)NCc1cccnc1 273464a_100000209980_100000210453 [0,0,0,0,0,1|3,0,0]=4 6517 B15R1.78 COCCNC(=O)NCc1cccnc1 273464a_100000210453_100000209980 [0,0,0,0,0,1|3,0,0]=4 6518 B15R1.78 COCCNC(=O)NCc1ccncc1 2708a_100000210450_100000209980 [0,0,0,0,0,1|3,0,0]=4 6519 B15R1.78 COCCNC(=O)NCc1ccncc1 273464a_100000209980_100000210450 [0,0,0,0,0,1|3,0,0]=4 6520 B15R1.78 COCCNC(=O)NCc1ccncc1 273464a_100000210450_100000209980 [0,0,0,0,0,1|3,0,0]=4 6521 B15R1.78 COCCNC(=O)NNc1ccccc1 273464a_100000209980_100015195140 [0,0,0,0,0,1|3,0,0]=4 6522 B15R1.78 COCCNC(=O)OCc1ccccc1 34a_100000159002_200000210301 [0,0,0,0,0,1|2,0,0]=3 6523 B15R1.78 COCCNC(=O)OCc1ccccc1 7a_100000159002_200000210301 [0,0,0,0,0,1|2,0,0]=3 6524 B15R1.78 COCCOC(=O)CNc1ccccc1 34a_100000106764_200000040189 [0,0,0,0,0,1|1,0,0]=2 6525 B15R1.78 COCCOC(=O)COc1ccccc1 34a_100000210340_200000040189 [0,0,0,0,0,1|1,0,0]=2 6526 B15R1.78 COCCOC(=O)COc1ccccc1 7a_100000210340_200000040189 [0,0,0,0,0,1|1,0,0]=2 6527 B15R1.78 COCCOC(=O)COc1cccnc1 34a_100000210849_200000040189 [0,0,0,0,0,1|2,0,0]=3 6528 B15R1.78 COCCOC(=O)COc1cccnc1 7a_100000210849_200000040189 [0,0,0,0,0,1|2,0,0]=3 6529 B15R1.78 COCCOC(=O)COc1ccncc1 34a_100000212176_200000040189 [0,0,0,0,0,1|2,0,0]=3 6530 B15R1.78 COCCOC(=O)COc1ccnnc1 34a_100015204005_200000040189 [0,0,0,0,0,1|3,0,0]=4 6531 B15R1.78 COCCOC(=O)COc1cncnc1 7a_100000754086_200000040189 [0,0,0,0,0,1|3,0,0]=4 6532 B15R1.78 COCCOC(=O)CSc1ccccc1 62a_100000719477_200000040189 [0,0,0,0,0,1|1,0,0]=2 6533 B15R1.78 COCCOC(=O)CSc1ccccc1 62a_200000040189_100000041952 [0,0,0,0,0,1|1,0,0]=2 6534 B15R1.78 COCCOC(=O)CSc1ccccn1 62a_100011216584_200000040189 [0,0,0,0,0,1|2,0,0]=3 6535 B15R1.78 COCCOC(=O)CSc1ccccn1 62a_200000040189_100011216584 [0,0,0,0,0,1|2,0,0]=3 6536 B15R1.78 COCCOC(=O)CSc1cccnc1 62a_100000210063_200000040189 [0,0,0,0,0,1|2,0,0]=3 6537 B15R1.78 COCCOC(=O)CSc1cccnc1 62a_200000040189_100000210063 [0,0,0,0,0,1|2,0,0]=3 6538 B15R1.78 COCCOC(=O)CSc1cccnn1 62a_100016991348_200000040189 [0,0,0,0,0,1|3,0,0]=4 6539 B15R1.78 COCCOC(=O)CSc1cccnn1 62a_200000040189_100016991348 [0,0,0,0,0,1|3,0,0]=4 6540 B15R1.78 COCCOC(=O)CSc1ccncc1 62a_100000728582_200000040189 [0,0,0,0,0,1|2,0,0]=3 6541 B15R1.78 COCCOC(=O)CSc1ccncc1 62a_200000040189_100000728582 [0,0,0,0,0,1|2,0,0]=3 6542 B15R1.78 COCCOC(=O)CSc1ccncn1 62a_100000703185_200000040189 [0,0,0,0,0,1|3,0,0]=4 6543 B15R1.78 COCCOC(=O)CSc1ccncn1 62a_200000040189_100000703185 [0,0,0,0,0,1|3,0,0]=4 6544 B15R1.78 COCCOC(=O)CSc1ccnnc1 62a_100000732662_200000040189 [0,0,0,0,0,1|3,0,0]=4 6545 B15R1.78 COCCOC(=O)CSc1ccnnc1 62a_200000040189_100000732662 [0,0,0,0,0,1|3,0,0]=4 6546 B15R1.78 COCCOC(=O)CSc1cnccn1 62a_100000211759_200000040189 [0,0,0,0,0,1|3,0,0]=4 6547 B15R1.78 COCCOC(=O)CSc1cnccn1 62a_200000040189_100000211759 [0,0,0,0,0,1|3,0,0]=4 6548 B15R1.78 COCCOC(=O)CSc1cncnc1 62a_100011206942_200000040189 [0,0,0,0,0,1|3,0,0]=4 6549 B15R1.78 COCCOC(=O)CSc1cncnc1 62a_200000040189_100011206942 [0,0,0,0,0,1|3,0,0]=4 6550 B15R1.78 COCCOC(=O)CSc1ncccn1 62a_100000211032_200000040189 [0,0,0,0,0,1|3,0,0]=4 6551 B15R1.78 COCCOC(=O)CSc1ncccn1 62a_200000040189_100000211032 [0,0,0,0,0,1|3,0,0]=4 6552 B15R1.78 COCCOC(C)COc1ccccc1 34a_100000210911_100011201679 [0,0,0,0,0,1|2,0,1]=4 6553 B15R1.78 COCCOC(C)COc1ccccc1 7a_100000210911_100000233755 [0,0,0,0,0,1|2,0,1]=4 6554 B15R1.78 COCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100011201679 [0,0,0,0,0,1|2,0,1]=4 6555 B15R1.78 COCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000233755 [0,0,0,0,0,1|2,0,1]=4 6556 B15R1.78 COCNCC(=O)NCc1ccccc1 2230a_100000739245_100000766300 [0,0,0,0,0,1|3,0,0]=4 6557 B15R1.78 COCSCC(=O)CCc1ccccc1 62a_100000766300_100012361361 [0,0,0,0,0,1|3,0,0]=4 6558 B15R1.78 COCSCC(=O)CCc1ccccc1 62a_100012361361_100000766300 [0,0,0,0,0,1|3,0,0]=4 6559 B15R1.78 COCSCC(=O)NCc1ccccc1 62a_100000183539_100000766300 [0,0,0,0,0,1|3,0,0]=4 6560 B15R1.78 COCSCC(=O)NCc1ccccc1 62a_100000766300_100000183539 [0,0,0,0,0,1|3,0,0]=4 6561 B15R1.78 COCSCC(=O)OCc1ccccc1 62a_100000753625_100000766300 [0,0,0,0,0,1|3,0,0]=4 6562 B15R1.78 COCSCC(=O)OCc1ccccc1 62a_100000766300_100000753625 [0,0,0,0,0,1|3,0,0]=4 6563 B15R1.78 CSCCCC(=O)CCc1ccccc1 1458a_100000173376_100000765856 [0,0,0,0,0,1|2,0,0]=3 6564 B15R1.78 CSCCCC(=O)CCc1ccccn1 1458a_100000173376_100015183660 [0,0,0,0,0,1|3,0,0]=4 6565 B15R1.78 CSCCCC(=O)CCc1cccnc1 1458a_100000173376_200011713674 [0,0,0,0,0,1|3,0,0]=4 6566 B15R1.78 CSCCCC(=O)CCc1ccncc1 1458a_100000173376_100000723409 [0,0,0,0,0,1|3,0,0]=4 6567 B15R1.78 CSCCCC(=O)NCc1ccccc1 11a_100015324214_100000173376 [0,0,0,0,0,1|2,0,0]=3 6568 B15R1.78 CSCCCC(=O)NCc1ccccc1 1626a_100015324214_100000173376 [0,0,0,0,0,1|2,0,0]=3 6569 B15R1.78 CSCCCC(=O)NCc1ccccc1 240690a_100015324214_100000173376 [0,0,0,0,0,1|2,0,0]=3 6570 B15R1.78 CSCCCC(=O)NCc1ccccc1 527a_100015324214_100000173376 [0,0,0,0,0,1|2,0,0]=3 6571 B15R1.78 CSCCCC(=O)NCc1ccccn1 11a_100000210449_100000173376 [0,0,0,0,0,1|3,0,0]=4 6572 B15R1.78 CSCCCC(=O)NCc1ccccn1 1626a_100000210449_100000173376 [0,0,0,0,0,1|3,0,0]=4 6573 B15R1.78 CSCCCC(=O)NCc1ccccn1 240690a_100000210449_100000173376 [0,0,0,0,0,1|3,0,0]=4 6574 B15R1.78 CSCCCC(=O)NCc1ccccn1 527a_100000210449_100000173376 [0,0,0,0,0,1|3,0,0]=4 6575 B15R1.78 CSCCCC(=O)NCc1cccnc1 11a_100000210453_100000173376 [0,0,0,0,0,1|3,0,0]=4 6576 B15R1.78 CSCCCC(=O)NCc1cccnc1 240690a_100000210453_100000173376 [0,0,0,0,0,1|3,0,0]=4 6577 B15R1.78 CSCCCC(=O)NCc1cccnc1 527a_100000210453_100000173376 [0,0,0,0,0,1|3,0,0]=4 6578 B15R1.78 CSCCCC(=O)NCc1ccncc1 11a_100000210450_100000173376 [0,0,0,0,0,1|3,0,0]=4 6579 B15R1.78 CSCCCC(=O)NCc1ccncc1 1626a_100000210450_100000173376 [0,0,0,0,0,1|3,0,0]=4 6580 B15R1.78 CSCCCC(=O)NCc1ccncc1 240690a_100000210450_100000173376 [0,0,0,0,0,1|3,0,0]=4 6581 B15R1.78 CSCCCC(=O)NCc1ccncc1 527a_100000210450_100000173376 [0,0,0,0,0,1|3,0,0]=4 6582 B15R1.78 CSCCCC(=O)NNc1ccccc1 22a_100015195140_100000173376 [0,0,0,0,0,1|3,0,0]=4 6583 B15R1.78 CSCCCC(=O)OCc1ccccc1 62a_100009813218_200000210301 [0,0,0,0,0,1|2,0,0]=3 6584 B15R1.78 CSCCCC(=O)OCc1ccccc1 62a_200000210301_100009813218 [0,0,0,0,0,1|2,0,0]=3 6585 B15R1.78 CSCCNC(=O)C#Cc1ccccc1 240690a_100020590264_100000736102 [0,0,0,0,0,1|2,0,1]=4 6586 B15R1.78 CSCCNC(=O)C=Cc1ccccc1 11a_100020590264_100000210462 [0,0,0,0,0,1|2,0,1]=4 6587 B15R1.78 CSCCNC(=O)C=Cc1ccccc1 1626a_100020590264_100000210462 [0,0,0,0,0,1|2,0,1]=4 6588 B15R1.78 CSCCNC(=O)CCc1ccccc1 11a_100020590264_100000185753 [0,0,0,0,0,1|2,0,0]=3 6589 B15R1.78 CSCCNC(=O)CCc1ccccc1 1626a_100020590264_100000185753 [0,0,0,0,0,1|2,0,0]=3 6590 B15R1.78 CSCCNC(=O)CCc1ccccc1 240690a_100020590264_100000185753 [0,0,0,0,0,1|2,0,0]=3 6591 B15R1.78 CSCCNC(=O)CCc1ccccc1 527a_100020590264_100000185753 [0,0,0,0,0,1|2,0,0]=3 6592 B15R1.78 CSCCNC(=O)CCc1ccccn1 11a_100020590264_100015195070 [0,0,0,0,0,1|3,0,0]=4 6593 B15R1.78 CSCCNC(=O)CCc1ccccn1 240690a_100020590264_100015195070 [0,0,0,0,0,1|3,0,0]=4 6594 B15R1.78 CSCCNC(=O)CCc1ccccn1 527a_100020590264_100015195070 [0,0,0,0,0,1|3,0,0]=4 6595 B15R1.78 CSCCNC(=O)CCc1cccnc1 11a_100020590264_100000198484 [0,0,0,0,0,1|3,0,0]=4 6596 B15R1.78 CSCCNC(=O)CCc1cccnc1 1626a_100020590264_100000198484 [0,0,0,0,0,1|3,0,0]=4 6597 B15R1.78 CSCCNC(=O)CCc1cccnc1 240690a_100020590264_100000198484 [0,0,0,0,0,1|3,0,0]=4 6598 B15R1.78 CSCCNC(=O)CCc1cccnc1 527a_100020590264_100000198484 [0,0,0,0,0,1|3,0,0]=4 6599 B15R1.78 CSCCNC(=O)CCc1ccncc1 11a_100020590264_100011225043 [0,0,0,0,0,1|3,0,0]=4 6600 B15R1.78 CSCCNC(=O)CCc1ccncc1 240690a_100020590264_100011225043 [0,0,0,0,0,1|3,0,0]=4 6601 B15R1.78 CSCCNC(=O)CCc1ccncc1 527a_100020590264_100011225043 [0,0,0,0,0,1|3,0,0]=4 6602 B15R1.78 CSCCNC(=O)COc1ccccc1 11a_100020590264_100000186222 [0,0,0,0,0,1|2,0,0]=3 6603 B15R1.78 CSCCNC(=O)COc1ccccc1 1626a_100020590264_100000186222 [0,0,0,0,0,1|2,0,0]=3 6604 B15R1.78 CSCCNC(=O)COc1ccccc1 240690a_100020590264_100000186222 [0,0,0,0,0,1|2,0,0]=3 6605 B15R1.78 CSCCNC(=O)COc1ccccc1 527a_100020590264_100000186222 [0,0,0,0,0,1|2,0,0]=3 6606 B15R1.78 CSCCNC(=O)COc1ccccn1 1626a_100020590264_100102699861 [0,0,0,0,0,1|3,0,0]=4 6607 B15R1.78 CSCCNC(=O)COc1ccccn1 240690a_100020590264_100102699861 [0,0,0,0,0,1|3,0,0]=4 6608 B15R1.78 CSCCNC(=O)COc1ccccn1 527a_100020590264_100102699861 [0,0,0,0,0,1|3,0,0]=4 6609 B15R1.78 CSCCNC(=O)COc1cccnc1 11a_100020590264_100015207166 [0,0,0,0,0,1|3,0,0]=4 6610 B15R1.78 CSCCNC(=O)COc1cccnc1 1626a_100020590264_100015207166 [0,0,0,0,0,1|3,0,0]=4 6611 B15R1.78 CSCCNC(=O)COc1cccnc1 240690a_100020590264_100015207166 [0,0,0,0,0,1|3,0,0]=4 6612 B15R1.78 CSCCNC(=O)COc1cccnc1 527a_100020590264_100015207166 [0,0,0,0,0,1|3,0,0]=4 6613 B15R1.78 CSCCNC(=O)CSc1ccccc1 11a_100020590264_100000211596 [0,0,0,0,0,1|2,0,0]=3 6614 B15R1.78 CSCCNC(=O)CSc1ccccc1 1626a_100020590264_100000211596 [0,0,0,0,0,1|2,0,0]=3 6615 B15R1.78 CSCCNC(=O)CSc1ccccc1 240690a_100020590264_100000211596 [0,0,0,0,0,1|2,0,0]=3 6616 B15R1.78 CSCCNC(=O)CSc1ccccc1 527a_100020590264_100000211596 [0,0,0,0,0,1|2,0,0]=3 6617 B15R1.78 CSCCNC(=O)CSc1ccccn1 11a_100020590264_100000156281 [0,0,0,0,0,1|3,0,0]=4 6618 B15R1.78 CSCCNC(=O)CSc1ccccn1 240690a_100020590264_100000156281 [0,0,0,0,0,1|3,0,0]=4 6619 B15R1.78 CSCCNC(=O)CSc1ccccn1 527a_100020590264_100000156281 [0,0,0,0,0,1|3,0,0]=4 6620 B15R1.78 CSCCNC(=O)CSc1ccncc1 11a_100020590264_100000211328 [0,0,0,0,0,1|3,0,0]=4 6621 B15R1.78 CSCCNC(=O)CSc1ccncc1 1626a_100020590264_100000211328 [0,0,0,0,0,1|3,0,0]=4 6622 B15R1.78 CSCCNC(=O)CSc1ccncc1 240690a_100020590264_100000211328 [0,0,0,0,0,1|3,0,0]=4 6623 B15R1.78 CSCCNC(=O)CSc1ccncc1 527a_100020590264_100000211328 [0,0,0,0,0,1|3,0,0]=4 6624 B15R1.78 CSCCNC(=O)NCc1ccccc1 2708a_100015324214_100020590264 [0,0,0,0,0,1|2,0,0]=3 6625 B15R1.78 CSCCNC(=O)NCc1ccccc1 2708a_100020590264_100015324214 [0,0,0,0,0,1|2,0,0]=3 6626 B15R1.78 CSCCNC(=O)NCc1ccccc1 273464a_100015324214_100020590264 [0,0,0,0,0,1|2,0,0]=3 6627 B15R1.78 CSCCNC(=O)NCc1ccccc1 273464a_100020590264_100015324214 [0,0,0,0,0,1|2,0,0]=3 6628 B15R1.78 CSCCNC(=O)NCc1ccccc1 512a_100015324214_100020590264 [0,0,0,0,0,1|2,0,0]=3 6629 B15R1.78 CSCCNC(=O)NCc1ccccc1 512a_100020590264_100015324214 [0,0,0,0,0,1|2,0,0]=3 6630 B15R1.78 CSCCNC(=O)NCc1ccccn1 2708a_100000210449_100020590264 [0,0,0,0,0,1|3,0,0]=4 6631 B15R1.78 CSCCNC(=O)NCc1ccccn1 2708a_100020590264_100000210449 [0,0,0,0,0,1|3,0,0]=4 6632 B15R1.78 CSCCNC(=O)NCc1ccccn1 273464a_100000210449_100020590264 [0,0,0,0,0,1|3,0,0]=4 6633 B15R1.78 CSCCNC(=O)NCc1ccccn1 273464a_100020590264_100000210449 [0,0,0,0,0,1|3,0,0]=4 6634 B15R1.78 CSCCNC(=O)NCc1ccccn1 512a_100020590264_100000210449 [0,0,0,0,0,1|3,0,0]=4 6635 B15R1.78 CSCCNC(=O)NCc1cccnc1 2708a_100000210453_100020590264 [0,0,0,0,0,1|3,0,0]=4 6636 B15R1.78 CSCCNC(=O)NCc1cccnc1 2708a_100020590264_100000210453 [0,0,0,0,0,1|3,0,0]=4 6637 B15R1.78 CSCCNC(=O)NCc1cccnc1 273464a_100000210453_100020590264 [0,0,0,0,0,1|3,0,0]=4 6638 B15R1.78 CSCCNC(=O)NCc1cccnc1 273464a_100020590264_100000210453 [0,0,0,0,0,1|3,0,0]=4 6639 B15R1.78 CSCCNC(=O)NCc1cccnc1 512a_100000210453_100020590264 [0,0,0,0,0,1|3,0,0]=4 6640 B15R1.78 CSCCNC(=O)NCc1cccnc1 512a_100020590264_100000210453 [0,0,0,0,0,1|3,0,0]=4 6641 B15R1.78 CSCCNC(=O)NCc1ccncc1 2708a_100000210450_100020590264 [0,0,0,0,0,1|3,0,0]=4 6642 B15R1.78 CSCCNC(=O)NCc1ccncc1 2708a_100020590264_100000210450 [0,0,0,0,0,1|3,0,0]=4 6643 B15R1.78 CSCCNC(=O)NCc1ccncc1 273464a_100000210450_100020590264 [0,0,0,0,0,1|3,0,0]=4 6644 B15R1.78 CSCCNC(=O)NCc1ccncc1 273464a_100020590264_100000210450 [0,0,0,0,0,1|3,0,0]=4 6645 B15R1.78 CSCCNC(=O)NCc1ccncc1 512a_100020590264_100000210450 [0,0,0,0,0,1|3,0,0]=4 6646 B15R1.78 CSCCNC(=O)NNc1ccccc1 273464a_100020590264_100015195140 [0,0,0,0,0,1|3,0,0]=4 6647 B15R1.78 CSCCNC(=O)NNc1ccccc1 512a_100020590264_100015195140 [0,0,0,0,0,1|3,0,0]=4 6648 B15R1.78 CSCCNC(=O)OCc1ccccc1 62a_100012357035_200000210301 [0,0,0,0,0,1|2,0,0]=3 6649 B15R1.78 CSCCNC(=O)OCc1ccccc1 62a_200000210301_100012357035 [0,0,0,0,0,1|2,0,0]=3 6650 B15R1.78 CSCCOC(C)COc1ccccc1 34a_100000210911_100000212216 [0,0,0,0,0,1|2,0,1]=4 6651 B15R1.78 CSCCOC(C)COc1ccccc1 7a_100000210911_100000212216 [0,0,0,0,0,1|2,0,1]=4 6652 B15R1.78 CSCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000212216 [0,0,0,0,0,1|2,0,1]=4 6653 B15R1.78 CSCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000212216 [0,0,0,0,0,1|2,0,1]=4 6654 B15R1.78 CSCNCC(=O)NCc1ccccc1 2230a_100000739245_100011218213 [0,0,0,0,0,1|3,0,0]=4 6655 B15R1.78 CSCSCC(=O)CCc1ccccc1 62a_100011218213_100012361361 [0,0,0,0,0,1|3,0,0]=4 6656 B15R1.78 CSCSCC(=O)CCc1ccccc1 62a_100012361361_100011218213 [0,0,0,0,0,1|3,0,0]=4 6657 B15R1.78 CSCSCC(=O)NCc1ccccc1 62a_100000183539_100011218213 [0,0,0,0,0,1|3,0,0]=4 6658 B15R1.78 CSCSCC(=O)NCc1ccccc1 62a_100011218213_100000183539 [0,0,0,0,0,1|3,0,0]=4 6659 B15R1.78 CSCSCC(=O)OCc1ccccc1 62a_100000753625_100011218213 [0,0,0,0,0,1|3,0,0]=4 6660 B15R1.78 CSCSCC(=O)OCc1ccccc1 62a_100011218213_100000753625 [0,0,0,0,0,1|3,0,0]=4 6661 B15R1.78 C[C@@H](CCc1ccccc1)OCCCF 34a_100009815974_100011934791 [0,0,0,0,0,1|2,0,1]=4 6662 B15R1.78 C[C@@H](CCc1ccccc1)OCCCF 7a_100009815974_100011934791 [0,0,0,0,0,1|2,0,1]=4 6663 B15R1.78 C[C@@H](CCc1ccccc1)OCCCO 34a_100009815974_100000230001 [0,0,0,0,0,1|2,0,1]=4 6664 B15R1.78 C[C@@H](CCc1ccccc1)OCCCO 7a_100009815974_100011215043 [0,0,0,0,0,1|2,0,1]=4 6665 B15R1.78 N#CCCCC(=O)CCc1ccccc1 1458a_100000075515_100000765856 [0,0,0,0,0,1|2,0,1]=4 6666 B15R1.78 N#CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000211468 [0,0,0,0,0,1|2,0,1]=4 6667 B15R1.78 N#CCCCC(=O)COc1ccccc1 1458a_100000186222_100000211468 [0,0,0,0,0,1|2,0,1]=4 6668 B15R1.78 N#CCCCC(=O)CSc1ccccc1 1458a_100000211596_100000211468 [0,0,0,0,0,1|2,0,1]=4 6669 B15R1.78 N#CCCCC(=O)NCc1ccccc1 11a_100015324214_100000075515 [0,0,0,0,0,1|2,0,1]=4 6670 B15R1.78 N#CCCCC(=O)NCc1ccccc1 1626a_100015324214_100000075515 [0,0,0,0,0,1|2,0,1]=4 6671 B15R1.78 N#CCCCC(=O)NCc1ccccc1 240690a_100015324214_100000075515 [0,0,0,0,0,1|2,0,1]=4 6672 B15R1.78 N#CCCCC(=O)NCc1ccccc1 527a_100015324214_100000075515 [0,0,0,0,0,1|2,0,1]=4 6673 B15R1.78 N#CCCNC(=O)CCc1ccccc1 11a_100000720768_100000185753 [0,0,0,0,0,1|2,0,1]=4 6674 B15R1.78 N#CCCNC(=O)CCc1ccccc1 1626a_100000720768_100000185753 [0,0,0,0,0,1|2,0,1]=4 6675 B15R1.78 N#CCCNC(=O)CCc1ccccc1 240690a_100000720768_100000185753 [0,0,0,0,0,1|2,0,1]=4 6676 B15R1.78 N#CCCNC(=O)CCc1ccccc1 527a_100000720768_100000185753 [0,0,0,0,0,1|2,0,1]=4 6677 B15R1.78 N#CCCNC(=O)COc1ccccc1 11a_100000720768_100000186222 [0,0,0,0,0,1|2,0,1]=4 6678 B15R1.78 N#CCCNC(=O)COc1ccccc1 1626a_100000720768_100000186222 [0,0,0,0,0,1|2,0,1]=4 6679 B15R1.78 N#CCCNC(=O)COc1ccccc1 240690a_100000720768_100000186222 [0,0,0,0,0,1|2,0,1]=4 6680 B15R1.78 N#CCCNC(=O)COc1ccccc1 527a_100000720768_100000186222 [0,0,0,0,0,1|2,0,1]=4 6681 B15R1.78 N#CCCNC(=O)CSc1ccccc1 11a_100000720768_100000211596 [0,0,0,0,0,1|2,0,1]=4 6682 B15R1.78 N#CCCNC(=O)CSc1ccccc1 1626a_100000720768_100000211596 [0,0,0,0,0,1|2,0,1]=4 6683 B15R1.78 N#CCCNC(=O)CSc1ccccc1 240690a_100000720768_100000211596 [0,0,0,0,0,1|2,0,1]=4 6684 B15R1.78 N#CCCNC(=O)CSc1ccccc1 527a_100000720768_100000211596 [0,0,0,0,0,1|2,0,1]=4 6685 B15R1.78 N#CCCNC(=O)NCc1ccccc1 2708a_100000720768_100015324214 [0,0,0,0,0,1|2,0,1]=4 6686 B15R1.78 N#CCCNC(=O)NCc1ccccc1 2708a_100015324214_100000720768 [0,0,0,0,0,1|2,0,1]=4 6687 B15R1.78 N#CCCNC(=O)NCc1ccccc1 273464a_100000720768_100015324214 [0,0,0,0,0,1|2,0,1]=4 6688 B15R1.78 N#CCCNC(=O)NCc1ccccc1 273464a_100015324214_100000720768 [0,0,0,0,0,1|2,0,1]=4 6689 B15R1.78 N#CCCNC(=O)NCc1ccccc1 512a_100000720768_100015324214 [0,0,0,0,0,1|2,0,1]=4 6690 B15R1.78 N#CCCNC(=O)NCc1ccccc1 512a_100015324214_100000720768 [0,0,0,0,0,1|2,0,1]=4 6691 B15R1.78 NCCOCC(=O)CCc1ccccc1 34a_100000210304_100012361361 [0,0,0,0,0,1|3,0,0]=4 6692 B15R1.78 NCCOCC(=O)NCc1ccccc1 34a_100000210304_100000183539 [0,0,0,0,0,1|3,0,0]=4 6693 B15R1.78 NCCOCC(=O)OCc1ccccc1 34a_100000210304_100000753625 [0,0,0,0,0,1|3,0,0]=4 6694 B15R1.78 O=C(C#Cc1ccccc1)CCCCF 1458a_100000736102_100000729493 [0,0,0,0,0,1|2,0,1]=4 6695 B15R1.78 O=C(C#Cc1ccccc1)CCCCO 1458a_100000736102_100000210776 [0,0,0,0,0,1|2,0,1]=4 6696 B15R1.78 O=C(C#Cc1ccccc1)NCCCF 240690a_100015189416_100000736102 [0,0,0,0,0,1|2,0,1]=4 6697 B15R1.78 O=C(C#Cc1ccccc1)NCCCO 240690a_100000182051_100000736102 [0,0,0,0,0,1|2,0,1]=4 6698 B15R1.78 O=C(C=Cc1ccccc1)CCCCF 1458a_100000210462_100000729493 [0,0,0,0,0,1|2,0,1]=4 6699 B15R1.78 O=C(C=Cc1ccccc1)CCCCO 1458a_100000210462_100000210776 [0,0,0,0,0,1|2,0,1]=4 6700 B15R1.78 O=C(C=Cc1ccccc1)NCCCF 11a_100015189416_100000210462 [0,0,0,0,0,1|2,0,1]=4 6701 B15R1.78 O=C(C=Cc1ccccc1)NCCCF 1626a_100015189416_100000210462 [0,0,0,0,0,1|2,0,1]=4 6702 B15R1.78 O=C(CCCCF)CCc1ccccc1 1458a_100000185753_100000729493 [0,0,0,0,0,1|2,0,0]=3 6703 B15R1.78 O=C(CCCCF)CCc1ccccn1 1458a_100015195070_100000729493 [0,0,0,0,0,1|3,0,0]=4 6704 B15R1.78 O=C(CCCCF)CCc1cccnc1 1458a_100000198484_100000729493 [0,0,0,0,0,1|3,0,0]=4 6705 B15R1.78 O=C(CCCCF)CCc1ccncc1 1458a_100011225043_100000729493 [0,0,0,0,0,1|3,0,0]=4 6706 B15R1.78 O=C(CCCCF)COc1ccccc1 1458a_100000186222_100000729493 [0,0,0,0,0,1|2,0,0]=3 6707 B15R1.78 O=C(CCCCF)COc1ccccn1 1458a_100102699861_100000729493 [0,0,0,0,0,1|3,0,0]=4 6708 B15R1.78 O=C(CCCCF)COc1cccnc1 1458a_100015207166_100000729493 [0,0,0,0,0,1|3,0,0]=4 6709 B15R1.78 O=C(CCCCF)CSc1ccccc1 1458a_100000211596_100000729493 [0,0,0,0,0,1|2,0,0]=3 6710 B15R1.78 O=C(CCCCF)CSc1ccccn1 1458a_100000156281_100000729493 [0,0,0,0,0,1|3,0,0]=4 6711 B15R1.78 O=C(CCCCF)CSc1ccncc1 1458a_100000211328_100000729493 [0,0,0,0,0,1|3,0,0]=4 6712 B15R1.78 O=C(CCCCO)CCc1ccccc1 1458a_100000185753_100000210776 [0,0,0,0,0,1|2,0,0]=3 6713 B15R1.78 O=C(CCCCO)CCc1ccccc1 1458a_100000695505_100000765856 [0,0,0,0,0,1|2,0,0]=3 6714 B15R1.78 O=C(CCCCO)CCc1ccccn1 1458a_100000695505_100015183660 [0,0,0,0,0,1|3,0,0]=4 6715 B15R1.78 O=C(CCCCO)CCc1ccccn1 1458a_100015195070_100000210776 [0,0,0,0,0,1|3,0,0]=4 6716 B15R1.78 O=C(CCCCO)CCc1cccnc1 1458a_100000198484_100000210776 [0,0,0,0,0,1|3,0,0]=4 6717 B15R1.78 O=C(CCCCO)CCc1cccnc1 1458a_100000695505_200011713674 [0,0,0,0,0,1|3,0,0]=4 6718 B15R1.78 O=C(CCCCO)CCc1ccncc1 1458a_100000695505_100000723409 [0,0,0,0,0,1|3,0,0]=4 6719 B15R1.78 O=C(CCCCO)CCc1ccncc1 1458a_100011225043_100000210776 [0,0,0,0,0,1|3,0,0]=4 6720 B15R1.78 O=C(CCCCO)COc1ccccc1 1458a_100000186222_100000210776 [0,0,0,0,0,1|2,0,0]=3 6721 B15R1.78 O=C(CCCCO)COc1ccccn1 1458a_100102699861_100000210776 [0,0,0,0,0,1|3,0,0]=4 6722 B15R1.78 O=C(CCCCO)COc1cccnc1 1458a_100015207166_100000210776 [0,0,0,0,0,1|3,0,0]=4 6723 B15R1.78 O=C(CCCCO)CSc1ccccc1 1458a_100000211596_100000210776 [0,0,0,0,0,1|2,0,0]=3 6724 B15R1.78 O=C(CCCCO)CSc1ccccn1 1458a_100000156281_100000210776 [0,0,0,0,0,1|3,0,0]=4 6725 B15R1.78 O=C(CCCCO)CSc1ccncc1 1458a_100000211328_100000210776 [0,0,0,0,0,1|3,0,0]=4 6726 B15R1.78 O=C(CCCCO)NCc1ccccc1 1626a_100015324214_100000695505 [0,0,0,0,0,1|2,0,0]=3 6727 B15R1.78 O=C(CCCCO)NCc1ccccn1 1626a_100000210449_100000695505 [0,0,0,0,0,1|3,0,0]=4 6728 B15R1.78 O=C(CCCCO)NCc1ccncc1 1626a_100000210450_100000695505 [0,0,0,0,0,1|3,0,0]=4 6729 B15R1.78 O=C(CCNCF)NCc1ccccc1 34a_100025741942_100015361967 [0,0,0,0,0,1|3,0,0]=4 6730 B15R1.78 O=C(CCOCF)OCc1ccccc1 7a_100009831632_100015361967 [0,0,0,0,0,1|3,0,0]=4 6731 B15R1.78 O=C(CCSCF)OCc1ccccc1 62a_100009813219_100015361967 [0,0,0,0,0,1|3,0,0]=4 6732 B15R1.78 O=C(CCSCF)OCc1ccccc1 62a_100015361967_100009813219 [0,0,0,0,0,1|3,0,0]=4 6733 B15R1.78 O=C(CCc1ccccc1)CNCCF 34a_100000724931_100012361361 [0,0,0,0,0,1|3,0,0]=4 6734 B15R1.78 O=C(CCc1ccccc1)CNCCO 2230a_100016997473_100012361361 [0,0,0,0,0,1|3,0,0]=4 6735 B15R1.78 O=C(CCc1ccccc1)CNCCO 34a_100016990907_100012361361 [0,0,0,0,0,1|3,0,0]=4 6736 B15R1.78 O=C(CCc1ccccc1)COCCBr 34a_100000211926_100012361361 [0,0,0,0,0,1|3,0,0]=4 6737 B15R1.78 O=C(CCc1ccccc1)COCCO 1458a_100000708028_100000765856 [0,0,0,0,0,1|3,0,0]=4 6738 B15R1.78 O=C(CCc1ccccc1)CSCCF 62a_100011217306_100012361361 [0,0,0,0,0,1|3,0,0]=4 6739 B15R1.78 O=C(CCc1ccccc1)CSCCF 62a_100012361361_100011217306 [0,0,0,0,0,1|3,0,0]=4 6740 B15R1.78 O=C(CCc1ccccc1)CSCCO 62a_100000211926_100012361361 [0,0,0,0,0,1|3,0,0]=4 6741 B15R1.78 O=C(CCc1ccccc1)CSCCO 62a_100012361361_100000211926 [0,0,0,0,0,1|3,0,0]=4 6742 B15R1.78 O=C(CCc1ccccc1)NCCCF 11a_100015189416_100000185753 [0,0,0,0,0,1|2,0,0]=3 6743 B15R1.78 O=C(CCc1ccccc1)NCCCF 1626a_100015189416_100000185753 [0,0,0,0,0,1|2,0,0]=3 6744 B15R1.78 O=C(CCc1ccccc1)NCCCF 240690a_100015189416_100000185753 [0,0,0,0,0,1|2,0,0]=3 6745 B15R1.78 O=C(CCc1ccccc1)NCCCF 527a_100015189416_100000185753 [0,0,0,0,0,1|2,0,0]=3 6746 B15R1.78 O=C(CCc1ccccc1)NCCCO 240690a_100000182051_100000185753 [0,0,0,0,0,1|2,0,0]=3 6747 B15R1.78 O=C(CCc1ccccc1)NCCCO 527a_100000182051_100000185753 [0,0,0,0,0,1|2,0,0]=3 6748 B15R1.78 O=C(CCc1ccccc1)NNCCO 22a_100000210001_100000185753 [0,0,0,0,0,1|3,0,0]=4 6749 B15R1.78 O=C(CCc1ccccn1)NCCCF 11a_100015189416_100015195070 [0,0,0,0,0,1|3,0,0]=4 6750 B15R1.78 O=C(CCc1ccccn1)NCCCF 240690a_100015189416_100015195070 [0,0,0,0,0,1|3,0,0]=4 6751 B15R1.78 O=C(CCc1ccccn1)NCCCF 527a_100015189416_100015195070 [0,0,0,0,0,1|3,0,0]=4 6752 B15R1.78 O=C(CCc1ccccn1)NCCCO 240690a_100000182051_100015195070 [0,0,0,0,0,1|3,0,0]=4 6753 B15R1.78 O=C(CCc1ccccn1)NCCCO 527a_100000182051_100015195070 [0,0,0,0,0,1|3,0,0]=4 6754 B15R1.78 O=C(CCc1cccnc1)NCCCF 11a_100015189416_100000198484 [0,0,0,0,0,1|3,0,0]=4 6755 B15R1.78 O=C(CCc1cccnc1)NCCCF 1626a_100015189416_100000198484 [0,0,0,0,0,1|3,0,0]=4 6756 B15R1.78 O=C(CCc1cccnc1)NCCCF 240690a_100015189416_100000198484 [0,0,0,0,0,1|3,0,0]=4 6757 B15R1.78 O=C(CCc1cccnc1)NCCCF 527a_100015189416_100000198484 [0,0,0,0,0,1|3,0,0]=4 6758 B15R1.78 O=C(CCc1cccnc1)NCCCO 240690a_100000182051_100000198484 [0,0,0,0,0,1|3,0,0]=4 6759 B15R1.78 O=C(CCc1cccnc1)NCCCO 527a_100000182051_100000198484 [0,0,0,0,0,1|3,0,0]=4 6760 B15R1.78 O=C(CCc1ccncc1)NCCCF 11a_100015189416_100011225043 [0,0,0,0,0,1|3,0,0]=4 6761 B15R1.78 O=C(CCc1ccncc1)NCCCF 240690a_100015189416_100011225043 [0,0,0,0,0,1|3,0,0]=4 6762 B15R1.78 O=C(CCc1ccncc1)NCCCF 527a_100015189416_100011225043 [0,0,0,0,0,1|3,0,0]=4 6763 B15R1.78 O=C(CCc1ccncc1)NCCCO 240690a_100000182051_100011225043 [0,0,0,0,0,1|3,0,0]=4 6764 B15R1.78 O=C(CCc1ccncc1)NCCCO 527a_100000182051_100011225043 [0,0,0,0,0,1|3,0,0]=4 6765 B15R1.78 O=C(CNCCF)NCc1ccccc1 2230a_100000739245_100011217306 [0,0,0,0,0,1|3,0,0]=4 6766 B15R1.78 O=C(CNCCF)NCc1ccccc1 34a_100000724931_100000183539 [0,0,0,0,0,1|3,0,0]=4 6767 B15R1.78 O=C(CNCCF)OCc1ccccc1 34a_100000724931_100000753625 [0,0,0,0,0,1|3,0,0]=4 6768 B15R1.78 O=C(CNCCO)NCc1ccccc1 2230a_100000739245_100000211926 [0,0,0,0,0,1|3,0,0]=4 6769 B15R1.78 O=C(CNCCO)NCc1ccccc1 2230a_100016997473_100000183539 [0,0,0,0,0,1|3,0,0]=4 6770 B15R1.78 O=C(CNCCO)NCc1ccccc1 34a_100016990907_100000183539 [0,0,0,0,0,1|3,0,0]=4 6771 B15R1.78 O=C(CNCCO)OCc1ccccc1 2230a_100016997473_100000753625 [0,0,0,0,0,1|3,0,0]=4 6772 B15R1.78 O=C(CNCCO)OCc1ccccc1 34a_100016990907_100000753625 [0,0,0,0,0,1|3,0,0]=4 6773 B15R1.78 O=C(COCCBr)NCc1ccccc1 34a_100000211926_100000183539 [0,0,0,0,0,1|3,0,0]=4 6774 B15R1.78 O=C(COCCBr)OCc1ccccc1 34a_100000211926_100000753625 [0,0,0,0,0,1|3,0,0]=4 6775 B15R1.78 O=C(COCCO)NCc1ccccc1 1626a_100015324214_100000708028 [0,0,0,0,0,1|3,0,0]=4 6776 B15R1.78 O=C(COCCO)NCc1ccccc1 240690a_100015324214_100000708028 [0,0,0,0,0,1|3,0,0]=4 6777 B15R1.78 O=C(COc1ccccc1)NCCCF 11a_100015189416_100000186222 [0,0,0,0,0,1|2,0,0]=3 6778 B15R1.78 O=C(COc1ccccc1)NCCCF 1626a_100015189416_100000186222 [0,0,0,0,0,1|2,0,0]=3 6779 B15R1.78 O=C(COc1ccccc1)NCCCF 240690a_100015189416_100000186222 [0,0,0,0,0,1|2,0,0]=3 6780 B15R1.78 O=C(COc1ccccc1)NCCCF 527a_100015189416_100000186222 [0,0,0,0,0,1|2,0,0]=3 6781 B15R1.78 O=C(COc1ccccc1)NCCCO 240690a_100000182051_100000186222 [0,0,0,0,0,1|2,0,0]=3 6782 B15R1.78 O=C(COc1ccccc1)NCCCO 527a_100000182051_100000186222 [0,0,0,0,0,1|2,0,0]=3 6783 B15R1.78 O=C(COc1ccccc1)NNCCO 22a_100000210001_100000186222 [0,0,0,0,0,1|3,0,0]=4 6784 B15R1.78 O=C(COc1ccccn1)NCCCF 1626a_100015189416_100102699861 [0,0,0,0,0,1|3,0,0]=4 6785 B15R1.78 O=C(COc1ccccn1)NCCCF 240690a_100015189416_100102699861 [0,0,0,0,0,1|3,0,0]=4 6786 B15R1.78 O=C(COc1ccccn1)NCCCF 527a_100015189416_100102699861 [0,0,0,0,0,1|3,0,0]=4 6787 B15R1.78 O=C(COc1ccccn1)NCCCO 240690a_100000182051_100102699861 [0,0,0,0,0,1|3,0,0]=4 6788 B15R1.78 O=C(COc1ccccn1)NCCCO 527a_100000182051_100102699861 [0,0,0,0,0,1|3,0,0]=4 6789 B15R1.78 O=C(COc1cccnc1)NCCCF 11a_100015189416_100015207166 [0,0,0,0,0,1|3,0,0]=4 6790 B15R1.78 O=C(COc1cccnc1)NCCCF 1626a_100015189416_100015207166 [0,0,0,0,0,1|3,0,0]=4 6791 B15R1.78 O=C(COc1cccnc1)NCCCF 240690a_100015189416_100015207166 [0,0,0,0,0,1|3,0,0]=4 6792 B15R1.78 O=C(COc1cccnc1)NCCCF 527a_100015189416_100015207166 [0,0,0,0,0,1|3,0,0]=4 6793 B15R1.78 O=C(COc1cccnc1)NCCCO 240690a_100000182051_100015207166 [0,0,0,0,0,1|3,0,0]=4 6794 B15R1.78 O=C(COc1cccnc1)NCCCO 527a_100000182051_100015207166 [0,0,0,0,0,1|3,0,0]=4 6795 B15R1.78 O=C(CSCCF)NCc1ccccc1 62a_100000183539_100011217306 [0,0,0,0,0,1|3,0,0]=4 6796 B15R1.78 O=C(CSCCF)NCc1ccccc1 62a_100011217306_100000183539 [0,0,0,0,0,1|3,0,0]=4 6797 B15R1.78 O=C(CSCCF)OCc1ccccc1 62a_100000753625_100011217306 [0,0,0,0,0,1|3,0,0]=4 6798 B15R1.78 O=C(CSCCF)OCc1ccccc1 62a_100011217306_100000753625 [0,0,0,0,0,1|3,0,0]=4 6799 B15R1.78 O=C(CSCCO)NCc1ccccc1 62a_100000183539_100000211926 [0,0,0,0,0,1|3,0,0]=4 6800 B15R1.78 O=C(CSCCO)NCc1ccccc1 62a_100000211926_100000183539 [0,0,0,0,0,1|3,0,0]=4 6801 B15R1.78 O=C(CSCCO)OCc1ccccc1 62a_100000211926_100000753625 [0,0,0,0,0,1|3,0,0]=4 6802 B15R1.78 O=C(CSCCO)OCc1ccccc1 62a_100000753625_100000211926 [0,0,0,0,0,1|3,0,0]=4 6803 B15R1.78 O=C(CSc1ccccc1)NCCCF 11a_100015189416_100000211596 [0,0,0,0,0,1|2,0,0]=3 6804 B15R1.78 O=C(CSc1ccccc1)NCCCF 1626a_100015189416_100000211596 [0,0,0,0,0,1|2,0,0]=3 6805 B15R1.78 O=C(CSc1ccccc1)NCCCF 240690a_100015189416_100000211596 [0,0,0,0,0,1|2,0,0]=3 6806 B15R1.78 O=C(CSc1ccccc1)NCCCF 527a_100015189416_100000211596 [0,0,0,0,0,1|2,0,0]=3 6807 B15R1.78 O=C(CSc1ccccc1)NCCCO 240690a_100000182051_100000211596 [0,0,0,0,0,1|2,0,0]=3 6808 B15R1.78 O=C(CSc1ccccc1)NCCCO 527a_100000182051_100000211596 [0,0,0,0,0,1|2,0,0]=3 6809 B15R1.78 O=C(CSc1ccccc1)NNCCO 22a_100000210001_100000211596 [0,0,0,0,0,1|3,0,0]=4 6810 B15R1.78 O=C(CSc1ccccn1)NCCCF 11a_100015189416_100000156281 [0,0,0,0,0,1|3,0,0]=4 6811 B15R1.78 O=C(CSc1ccccn1)NCCCF 240690a_100015189416_100000156281 [0,0,0,0,0,1|3,0,0]=4 6812 B15R1.78 O=C(CSc1ccccn1)NCCCF 527a_100015189416_100000156281 [0,0,0,0,0,1|3,0,0]=4 6813 B15R1.78 O=C(CSc1ccccn1)NCCCO 240690a_100000182051_100000156281 [0,0,0,0,0,1|3,0,0]=4 6814 B15R1.78 O=C(CSc1ccccn1)NCCCO 527a_100000182051_100000156281 [0,0,0,0,0,1|3,0,0]=4 6815 B15R1.78 O=C(CSc1ccncc1)NCCCF 11a_100015189416_100000211328 [0,0,0,0,0,1|3,0,0]=4 6816 B15R1.78 O=C(CSc1ccncc1)NCCCF 1626a_100015189416_100000211328 [0,0,0,0,0,1|3,0,0]=4 6817 B15R1.78 O=C(CSc1ccncc1)NCCCF 240690a_100015189416_100000211328 [0,0,0,0,0,1|3,0,0]=4 6818 B15R1.78 O=C(CSc1ccncc1)NCCCF 527a_100015189416_100000211328 [0,0,0,0,0,1|3,0,0]=4 6819 B15R1.78 O=C(CSc1ccncc1)NCCCO 240690a_100000182051_100000211328 [0,0,0,0,0,1|3,0,0]=4 6820 B15R1.78 O=C(CSc1ccncc1)NCCCO 527a_100000182051_100000211328 [0,0,0,0,0,1|3,0,0]=4 6821 B15R1.78 O=C(NCCCF)NCc1ccccc1 2708a_100015189416_100015324214 [0,0,0,0,0,1|2,0,0]=3 6822 B15R1.78 O=C(NCCCF)NCc1ccccc1 2708a_100015324214_100015189416 [0,0,0,0,0,1|2,0,0]=3 6823 B15R1.78 O=C(NCCCF)NCc1ccccc1 273464a_100015189416_100015324214 [0,0,0,0,0,1|2,0,0]=3 6824 B15R1.78 O=C(NCCCF)NCc1ccccc1 273464a_100015324214_100015189416 [0,0,0,0,0,1|2,0,0]=3 6825 B15R1.78 O=C(NCCCF)NCc1ccccc1 512a_100015189416_100015324214 [0,0,0,0,0,1|2,0,0]=3 6826 B15R1.78 O=C(NCCCF)NCc1ccccc1 512a_100015324214_100015189416 [0,0,0,0,0,1|2,0,0]=3 6827 B15R1.78 O=C(NCCCF)NCc1ccccn1 2708a_100000210449_100015189416 [0,0,0,0,0,1|3,0,0]=4 6828 B15R1.78 O=C(NCCCF)NCc1ccccn1 2708a_100015189416_100000210449 [0,0,0,0,0,1|3,0,0]=4 6829 B15R1.78 O=C(NCCCF)NCc1ccccn1 273464a_100000210449_100015189416 [0,0,0,0,0,1|3,0,0]=4 6830 B15R1.78 O=C(NCCCF)NCc1ccccn1 273464a_100015189416_100000210449 [0,0,0,0,0,1|3,0,0]=4 6831 B15R1.78 O=C(NCCCF)NCc1ccccn1 512a_100015189416_100000210449 [0,0,0,0,0,1|3,0,0]=4 6832 B15R1.78 O=C(NCCCF)NCc1cccnc1 2708a_100000210453_100015189416 [0,0,0,0,0,1|3,0,0]=4 6833 B15R1.78 O=C(NCCCF)NCc1cccnc1 2708a_100015189416_100000210453 [0,0,0,0,0,1|3,0,0]=4 6834 B15R1.78 O=C(NCCCF)NCc1cccnc1 273464a_100000210453_100015189416 [0,0,0,0,0,1|3,0,0]=4 6835 B15R1.78 O=C(NCCCF)NCc1cccnc1 273464a_100015189416_100000210453 [0,0,0,0,0,1|3,0,0]=4 6836 B15R1.78 O=C(NCCCF)NCc1cccnc1 512a_100000210453_100015189416 [0,0,0,0,0,1|3,0,0]=4 6837 B15R1.78 O=C(NCCCF)NCc1cccnc1 512a_100015189416_100000210453 [0,0,0,0,0,1|3,0,0]=4 6838 B15R1.78 O=C(NCCCF)NCc1ccncc1 2708a_100000210450_100015189416 [0,0,0,0,0,1|3,0,0]=4 6839 B15R1.78 O=C(NCCCF)NCc1ccncc1 2708a_100015189416_100000210450 [0,0,0,0,0,1|3,0,0]=4 6840 B15R1.78 O=C(NCCCF)NCc1ccncc1 273464a_100000210450_100015189416 [0,0,0,0,0,1|3,0,0]=4 6841 B15R1.78 O=C(NCCCF)NCc1ccncc1 273464a_100015189416_100000210450 [0,0,0,0,0,1|3,0,0]=4 6842 B15R1.78 O=C(NCCCF)NCc1ccncc1 512a_100015189416_100000210450 [0,0,0,0,0,1|3,0,0]=4 6843 B15R1.78 O=C(NCCCF)NNc1ccccc1 273464a_100015189416_100015195140 [0,0,0,0,0,1|3,0,0]=4 6844 B15R1.78 O=C(NCCCF)NNc1ccccc1 512a_100015189416_100015195140 [0,0,0,0,0,1|3,0,0]=4 6845 B15R1.78 O=C(NCCCO)NCc1ccccc1 2708a_100015324214_100000182051 [0,0,0,0,0,1|2,0,0]=3 6846 B15R1.78 O=C(NCCCO)NCc1ccccc1 273464a_100000182051_100015324214 [0,0,0,0,0,1|2,0,0]=3 6847 B15R1.78 O=C(NCCCO)NCc1ccccc1 273464a_100015324214_100000182051 [0,0,0,0,0,1|2,0,0]=3 6848 B15R1.78 O=C(NCCCO)NCc1ccccc1 512a_100015324214_100000182051 [0,0,0,0,0,1|2,0,0]=3 6849 B15R1.78 O=C(NCCCO)NCc1ccccn1 2708a_100000210449_100000182051 [0,0,0,0,0,1|3,0,0]=4 6850 B15R1.78 O=C(NCCCO)NCc1ccccn1 273464a_100000182051_100000210449 [0,0,0,0,0,1|3,0,0]=4 6851 B15R1.78 O=C(NCCCO)NCc1ccccn1 273464a_100000210449_100000182051 [0,0,0,0,0,1|3,0,0]=4 6852 B15R1.78 O=C(NCCCO)NCc1cccnc1 2708a_100000210453_100000182051 [0,0,0,0,0,1|3,0,0]=4 6853 B15R1.78 O=C(NCCCO)NCc1cccnc1 273464a_100000182051_100000210453 [0,0,0,0,0,1|3,0,0]=4 6854 B15R1.78 O=C(NCCCO)NCc1cccnc1 273464a_100000210453_100000182051 [0,0,0,0,0,1|3,0,0]=4 6855 B15R1.78 O=C(NCCCO)NCc1cccnc1 512a_100000210453_100000182051 [0,0,0,0,0,1|3,0,0]=4 6856 B15R1.78 O=C(NCCCO)NCc1ccncc1 2708a_100000210450_100000182051 [0,0,0,0,0,1|3,0,0]=4 6857 B15R1.78 O=C(NCCCO)NCc1ccncc1 273464a_100000182051_100000210450 [0,0,0,0,0,1|3,0,0]=4 6858 B15R1.78 O=C(NCCCO)NCc1ccncc1 273464a_100000210450_100000182051 [0,0,0,0,0,1|3,0,0]=4 6859 B15R1.78 O=C(NCCCO)NNc1ccccc1 273464a_100000182051_100015195140 [0,0,0,0,0,1|3,0,0]=4 6860 B15R1.78 O=C(NCc1ccccc1)NNCCO 273464a_100015324214_100000210001 [0,0,0,0,0,1|3,0,0]=4 6861 B15R1.78 O=C(NCc1ccccc1)NNCCO 512a_100015324214_100000210001 [0,0,0,0,0,1|3,0,0]=4 6862 B15R1.78 [13CH3]OCCCC(=O)OCc1ccccc1 7a_100009831633_200025704644 [0,0,0,0,0,1|2,0,0]=3 6863 B15R1.78 [13CH3]OCCNC(=O)OCc1ccccc1 34a_100000159002_200025704644 [0,0,0,0,0,1|2,0,0]=3 6864 B15R1.78 [13CH3]OCCNC(=O)OCc1ccccc1 7a_100000159002_200025704644 [0,0,0,0,0,1|2,0,0]=3 6865 B15R1.78 [13CH3]SCCCC(=O)OCc1ccccc1 62a_100009813218_200025704644 [0,0,0,0,0,1|2,0,0]=3 6866 B15R1.78 [13CH3]SCCCC(=O)OCc1ccccc1 62a_200025704644_100009813218 [0,0,0,0,0,1|2,0,0]=3 6867 B15R1.78 [13CH3]SCCNC(=O)OCc1ccccc1 62a_100012357035_200025704644 [0,0,0,0,0,1|2,0,0]=3 6868 B15R1.78 [13CH3]SCCNC(=O)OCc1ccccc1 62a_200025704644_100012357035 [0,0,0,0,0,1|2,0,0]=3 6869 B12R0.103 C=CC=CC(=O)CC(=O)NCCC 1458a_100016291481_100000183358 [1,0,1,0,0,0|2,0,0]=4 6870 B12R0.103 C=CC=CC(=O)CC(=O)OCCC 1458a_100016291481_200011215008 [1,0,1,0,0,0|1,0,0]=3 6871 B12R0.206 C=CC=CC(=O)CCOCCCC 1458a_100016291481_100000743108 [1,0,1,0,0,0|1,0,1]=4 6872 B12R0.239 C=CCC(=O)CC(=O)OCCCC 1458a_100000210193_100000211628 [1,0,1,0,0,0|1,0,1]=4 6873 B12R0.239 CC=CC(=O)CC(=O)OCCCC 1458a_100000210699_100000211628 [1,0,1,0,0,0|1,0,1]=4 6874 B12R0.239 CCCCOC(=O)CC(=O)C=CBr 1458a_100016273825_100000211628 [1,0,1,0,0,0|2,0,0]=4 6875 B12R0.239 CCCCOC(=O)CC(=O)C=CCl 1458a_200016279998_100000211628 [1,0,1,0,0,0|2,0,0]=4 6876 B12R0.239 CCCCOC(=O)CC(=O)C=CI 1458a_100016256311_100000211628 [1,0,1,0,0,0|2,0,0]=4 6877 B12R1.8 BrCCCOCc1ccccc1 34a_100011217188_100015291786 [2,0,0,0,0,0|1,0,0]=3 6878 B12R1.8 BrCCCOCc1ccccn1 34a_100011217188_100000721315 [2,0,0,0,0,0|2,0,0]=4 6879 B12R1.8 BrCCCOCc1cccnc1 34a_100011217188_100000733263 [2,0,0,0,0,0|2,0,0]=4 6880 B12R1.8 BrCCOCCc1ccccc1 34a_100000211926_100000765856 [2,0,0,0,0,0|1,0,1]=4 6881 B12R1.8 C#CCCOCc1ccccc1 34a_100000210790_100000688953 [2,0,0,0,0,0|0,0,2]=4 6882 B12R1.8 C#CCCOCc1ccccc1 34a_100011215631_100015291786 [2,0,0,0,0,0|0,0,2]=4 6883 B12R1.8 C#CCCOCc1ccccc1 7a_100000210790_100000688953 [2,0,0,0,0,0|0,0,2]=4 6884 B12R1.8 C/C=C/COCc1ccccc1 34a_100000210790_100102629194 [2,0,0,0,0,0|0,0,2]=4 6885 B12R1.8 C/C=C/COCc1ccccc1 34a_100016270725_100015291786 [2,0,0,0,0,0|0,0,2]=4 6886 B12R1.8 C/C=C/COCc1ccccc1 7a_100000210790_100102629194 [2,0,0,0,0,0|0,0,2]=4 6887 B12R1.8 C=CCCOCc1ccccc1 34a_100000210790_100000754431 [2,0,0,0,0,0|0,0,2]=4 6888 B12R1.8 C=CCCOCc1ccccc1 34a_100011205117_100015291786 [2,0,0,0,0,0|0,0,2]=4 6889 B12R1.8 C=CCCOCc1ccccc1 7a_100000210790_100000754431 [2,0,0,0,0,0|0,0,2]=4 6890 B12R1.8 CC#CCOCc1ccccc1 34a_100000210790_100000748600 [2,0,0,0,0,0|0,0,2]=4 6891 B12R1.8 CC#CCOCc1ccccc1 34a_100000761923_100015291786 [2,0,0,0,0,0|0,0,2]=4 6892 B12R1.8 CC#CCOCc1ccccc1 7a_100000210790_100000748600 [2,0,0,0,0,0|0,0,2]=4 6893 B12R1.8 CC=CCOCc1ccccc1 34a_100000210790_100000070051 [2,0,0,0,0,0|0,0,2]=4 6894 B12R1.8 CC=CCOCc1ccccc1 7a_100000210790_100000070051 [2,0,0,0,0,0|0,0,2]=4 6895 B12R1.8 CCCCC=Cc1ccccc1 271570a_100016275911_100000210277 [2,0,0,0,0,0|0,0,1]=3 6896 B12R1.8 CCCCC=Cc1ccccn1 271570a_100016275911_100011216584 [2,0,0,0,0,0|1,0,1]=4 6897 B12R1.8 CCCCC=Cc1cccnc1 271570a_100016275911_100000752921 [2,0,0,0,0,0|1,0,1]=4 6898 B12R1.8 CCCCC=Cc1ccncc1 271570a_100016275911_100000035832 [2,0,0,0,0,0|1,0,1]=4 6899 B12R1.8 CCCCCNc1ccccc1 34a_100000106764_100000718602 [2,0,0,0,0,0|1,0,1]=4 6900 B12R1.8 CCCCCOc1ccccc1 34a_100000210340_100000718602 [2,0,0,0,0,0|1,0,1]=4 6901 B12R1.8 CCCCCOc1ccccc1 7a_100000210340_100000210326 [2,0,0,0,0,0|1,0,1]=4 6902 B12R1.8 CCCCCSc1ccccc1 62a_100000210326_100000041952 [2,0,0,0,0,0|1,0,1]=4 6903 B12R1.8 CCCCCSc1ccccc1 62a_100000719477_100000210326 [2,0,0,0,0,0|1,0,1]=4 6904 B12R1.8 CCCCNCc1ccccc1 207a_100000102301_100015611070 [2,0,0,0,0,0|1,0,0]=3 6905 B12R1.8 CCCCNCc1ccccc1 2230a_100000102301_100015291786 [2,0,0,0,0,0|1,0,0]=3 6906 B12R1.8 CCCCNCc1ccccc1 2230a_100015324214_100000210211 [2,0,0,0,0,0|1,0,0]=3 6907 B12R1.8 CCCCNCc1ccccc1 270004a_100000102301_100015611070 [2,0,0,0,0,0|1,0,0]=3 6908 B12R1.8 CCCCNCc1ccccc1 34a_100015324214_100000210210 [2,0,0,0,0,0|1,0,0]=3 6909 B12R1.8 CCCCNCc1ccccc1 7a_106832991798_100000211182 [2,0,0,0,0,0|1,0,0]=3 6910 B12R1.8 CCCCNCc1ccccn1 207a_100000102301_100000209966 [2,0,0,0,0,0|2,0,0]=4 6911 B12R1.8 CCCCNCc1ccccn1 2230a_100000102301_100000721315 [2,0,0,0,0,0|2,0,0]=4 6912 B12R1.8 CCCCNCc1ccccn1 270004a_100000102301_100000209966 [2,0,0,0,0,0|2,0,0]=4 6913 B12R1.8 CCCCNCc1ccccn1 7a_106832991798_100000721315 [2,0,0,0,0,0|2,0,0]=4 6914 B12R1.8 CCCCNCc1cccnc1 207a_100000102301_100000209961 [2,0,0,0,0,0|2,0,0]=4 6915 B12R1.8 CCCCNCc1cccnc1 2230a_100000102301_100000741622 [2,0,0,0,0,0|2,0,0]=4 6916 B12R1.8 CCCCNCc1cccnc1 270004a_100000102301_100000209961 [2,0,0,0,0,0|2,0,0]=4 6917 B12R1.8 CCCCNCc1cccnc1 7a_106832991798_100000741622 [2,0,0,0,0,0|2,0,0]=4 6918 B12R1.8 CCCCNCc1ccncc1 207a_100000102301_100000186114 [2,0,0,0,0,0|2,0,0]=4 6919 B12R1.8 CCCCNCc1ccncc1 2230a_100000102301_100015193705 [2,0,0,0,0,0|2,0,0]=4 6920 B12R1.8 CCCCNCc1ccncc1 7a_106832991798_100015193705 [2,0,0,0,0,0|2,0,0]=4 6921 B12R1.8 CCCCOCc1ccccc1 34a_100000210227_100015291786 [2,0,0,0,0,0|0,0,0]=2 6922 B12R1.8 CCCCOCc1ccccc1 34a_100000210790_100000210210 [2,0,0,0,0,0|0,0,0]=2 6923 B12R1.8 CCCCOCc1ccccc1 7a_100000210227_100000211182 [2,0,0,0,0,0|0,0,0]=2 6924 B12R1.8 CCCCOCc1ccccc1 7a_100000210790_100000210211 [2,0,0,0,0,0|0,0,0]=2 6925 B12R1.8 CCCCOCc1ccccn1 34a_100000210227_100000721315 [2,0,0,0,0,0|1,0,0]=3 6926 B12R1.8 CCCCOCc1ccccn1 7a_100000210227_100000721315 [2,0,0,0,0,0|1,0,0]=3 6927 B12R1.8 CCCCOCc1cccnc1 34a_100000210227_100000733263 [2,0,0,0,0,0|1,0,0]=3 6928 B12R1.8 CCCCOCc1cccnc1 7a_100000210227_100000741622 [2,0,0,0,0,0|1,0,0]=3 6929 B12R1.8 CCCCOCc1cccnn1 34a_100000210227_100016990269 [2,0,0,0,0,0|2,0,0]=4 6930 B12R1.8 CCCCOCc1cccnn1 7a_100000210227_100016990269 [2,0,0,0,0,0|2,0,0]=4 6931 B12R1.8 CCCCOCc1ccncc1 7a_100000210227_100015193705 [2,0,0,0,0,0|1,0,0]=3 6932 B12R1.8 CCCCOCc1cnccn1 34a_100000210227_100016995436 [2,0,0,0,0,0|2,0,0]=4 6933 B12R1.8 CCCCOCc1cnccn1 7a_100000210227_100016995436 [2,0,0,0,0,0|2,0,0]=4 6934 B12R1.8 CCCCOCc1cncnc1 34a_100000210227_100015196519 [2,0,0,0,0,0|2,0,0]=4 6935 B12R1.8 CCCCOCc1cncnc1 7a_100000210227_100015196519 [2,0,0,0,0,0|2,0,0]=4 6936 B12R1.8 CCCCOCc1ncccn1 34a_100000210227_100000703007 [2,0,0,0,0,0|2,0,0]=4 6937 B12R1.8 CCCCOCc1ncccn1 7a_100000210227_100000703007 [2,0,0,0,0,0|2,0,0]=4 6938 B12R1.8 CCCCSCc1ccccc1 62a_100000210211_100015291786 [2,0,0,0,0,0|0,1,0]=3 6939 B12R1.8 CCCCSCc1ccccc1 62a_100000211182_100000210210 [2,0,0,0,0,0|0,1,0]=3 6940 B12R1.8 CCCCSCc1ccccn1 62a_100000210211_100000721315 [2,0,0,0,0,0|1,1,0]=4 6941 B12R1.8 CCCCSCc1ccccn1 62a_100000721315_100000210210 [2,0,0,0,0,0|1,1,0]=4 6942 B12R1.8 CCCCSCc1cccnc1 62a_100000210211_100000741622 [2,0,0,0,0,0|1,1,0]=4 6943 B12R1.8 CCCCSCc1cccnc1 62a_100000741622_100000210210 [2,0,0,0,0,0|1,1,0]=4 6944 B12R1.8 CCCCSCc1ccncc1 62a_100000210211_100015193705 [2,0,0,0,0,0|1,1,0]=4 6945 B12R1.8 CCCCSCc1ccncc1 62a_100015193705_100000210210 [2,0,0,0,0,0|1,1,0]=4 6946 B12R1.8 CCCNCCc1ccccc1 2230a_100000106460_100000210303 [2,0,0,0,0,0|1,0,1]=4 6947 B12R1.8 CCCNCCc1ccccc1 34a_100000106460_100000210303 [2,0,0,0,0,0|1,0,1]=4 6948 B12R1.8 CCCNN=Cc1ccccc1 4a_100000740057_100015611070 [2,0,0,0,0,0|2,0,0]=4 6949 B12R1.8 CCCOCCc1ccccc1 34a_100000210258_100000765856 [2,0,0,0,0,0|0,0,1]=3 6950 B12R1.8 CCCOCCc1ccccc1 34a_100000210268_100000210303 [2,0,0,0,0,0|0,0,1]=3 6951 B12R1.8 CCCOCCc1ccccc1 7a_100000210268_100000210303 [2,0,0,0,0,0|0,0,1]=3 6952 B12R1.8 CCCOCCc1ccccn1 34a_100000210271_100000210303 [2,0,0,0,0,0|1,0,1]=4 6953 B12R1.8 CCCOCCc1cccnc1 34a_100011217484_100000210303 [2,0,0,0,0,0|1,0,1]=4 6954 B12R1.8 CCCOCCc1ccncc1 34a_100011216225_100000210303 [2,0,0,0,0,0|1,0,1]=4 6955 B12R1.8 CCCSCCc1ccccc1 62a_100000210303_100011218657 [2,0,0,0,0,0|0,1,1]=4 6956 B12R1.8 CCCSCCc1ccccc1 62a_100000765856_100000210303 [2,0,0,0,0,0|0,1,1]=4 6957 B12R1.8 CCNC/C=C/c1ccccc1 2230a_100015525214_100016265936 [2,0,0,0,0,0|1,0,1]=4 6958 B12R1.8 CCNC/C=C/c1ccccc1 2230a_100020603302_100000210202 [2,0,0,0,0,0|1,0,1]=4 6959 B12R1.8 CCNC/C=C/c1ccccc1 34a_100020603302_100000210202 [2,0,0,0,0,0|1,0,1]=4 6960 B12R1.8 CCNCC=Cc1ccccc1 270004a_100015525214_100000210105 [2,0,0,0,0,0|1,0,1]=4 6961 B12R1.8 CCNCCCc1ccccc1 2230a_100000211184_100000210202 [2,0,0,0,0,0|1,0,1]=4 6962 B12R1.8 CCNCCCc1ccccc1 2230a_100015525214_100000211621 [2,0,0,0,0,0|1,0,1]=4 6963 B12R1.8 CCNCCCc1ccccc1 34a_100000211184_100000210202 [2,0,0,0,0,0|1,0,1]=4 6964 B12R1.8 CCNCOCc1ccccc1 2230a_100015525214_100000763385 [2,0,0,0,0,0|1,0,0]=3 6965 B12R1.8 CCNCSCc1ccccc1 2230a_100015525214_200011217039 [2,0,0,0,0,0|1,1,0]=4 6966 B12R1.8 CCNN=CCc1ccccc1 4a_100000756455_100000209964 [2,0,0,0,0,0|2,0,0]=4 6967 B12R1.8 CCOC/C=C/c1ccccc1 34a_100000210256_100000210202 [2,0,0,0,0,0|1,0,1]=4 6968 B12R1.8 CCOC/C=C/c1ccccc1 34a_100121572206_100016265936 [2,0,0,0,0,0|1,0,1]=4 6969 B12R1.8 CCOCCCc1ccccc1 34a_100000210828_100000210202 [2,0,0,0,0,0|1,0,1]=4 6970 B12R1.8 CCOCCCc1ccccc1 34a_100121572206_100000211621 [2,0,0,0,0,0|1,0,1]=4 6971 B12R1.8 CCOCCCc1ccccc1 7a_100000210828_100000210202 [2,0,0,0,0,0|1,0,1]=4 6972 B12R1.8 CCOCOCc1ccccc1 34a_100121572206_100000763385 [2,0,0,0,0,0|1,0,0]=3 6973 B12R1.8 CCOCSCc1ccccc1 34a_100121572206_200011217039 [2,0,0,0,0,0|1,1,0]=4 6974 B12R1.8 CCOCSCc1ccccc1 62a_100000211182_100000739092 [2,0,0,0,0,0|1,1,0]=4 6975 B12R1.8 CCOCSCc1ccccc1 62a_100000739092_100015291786 [2,0,0,0,0,0|1,1,0]=4 6976 B12R1.8 CCSC/C=C/c1ccccc1 62a_100000210202_100016265936 [2,0,0,0,0,0|1,0,1]=4 6977 B12R1.8 CCSC/C=C/c1ccccc1 62a_100016265936_100000210202 [2,0,0,0,0,0|1,0,1]=4 6978 B12R1.8 CCSCCCc1ccccc1 62a_100000210202_100000211621 [2,0,0,0,0,0|1,0,1]=4 6979 B12R1.8 CCSCCCc1ccccc1 62a_100000211621_100000210202 [2,0,0,0,0,0|1,0,1]=4 6980 B12R1.8 CCSCOCc1ccccc1 62a_100000210202_100000763385 [2,0,0,0,0,0|1,0,0]=3 6981 B12R1.8 CCSCOCc1ccccc1 62a_100000763385_100000210202 [2,0,0,0,0,0|1,0,0]=3 6982 B12R1.8 CCSCSCc1ccccc1 62a_100000210202_200011217039 [2,0,0,0,0,0|1,1,0]=4 6983 B12R1.8 CCSCSCc1ccccc1 62a_200011217039_100000210202 [2,0,0,0,0,0|1,1,0]=4 6984 B12R1.8 CNCCCCc1ccccc1 2230a_100015280158_200000210301 [2,0,0,0,0,0|1,0,1]=4 6985 B12R1.8 CNCCCCc1ccccc1 2230a_106832991635_100000701786 [2,0,0,0,0,0|1,0,1]=4 6986 B12R1.8 CNCCCCc1ccccc1 34a_100015280158_200000210301 [2,0,0,0,0,0|1,0,1]=4 6987 B12R1.8 CNCCCCc1ccccc1 34a_100102657272_100000701786 [2,0,0,0,0,0|1,0,1]=4 6988 B12R1.8 CNCCCCc1ccccc1 7a_106832991635_100000701786 [2,0,0,0,0,0|1,0,1]=4 6989 B12R1.8 CNCCOCc1ccccc1 2230a_100000753106_200000210301 [2,0,0,0,0,0|1,0,0]=3 6990 B12R1.8 CNCCOCc1ccccc1 2230a_106832991635_100000234347 [2,0,0,0,0,0|1,0,0]=3 6991 B12R1.8 CNCCOCc1ccccc1 34a_100000753106_200000210301 [2,0,0,0,0,0|1,0,0]=3 6992 B12R1.8 CNCCOCc1ccccc1 34a_100102657272_100000234347 [2,0,0,0,0,0|1,0,0]=3 6993 B12R1.8 CNCCOCc1ccccc1 7a_106832991635_100000234347 [2,0,0,0,0,0|1,0,0]=3 6994 B12R1.8 CNCCSCc1ccccc1 2230a_100000189534_200000210301 [2,0,0,0,0,0|1,1,0]=4 6995 B12R1.8 CNCCSCc1ccccc1 2230a_106832991635_200011297719 [2,0,0,0,0,0|1,1,0]=4 6996 B12R1.8 CNCCSCc1ccccc1 34a_100000189534_200000210301 [2,0,0,0,0,0|1,1,0]=4 6997 B12R1.8 CNCCSCc1ccccc1 34a_100102657272_200011297719 [2,0,0,0,0,0|1,1,0]=4 6998 B12R1.8 CNCCSCc1ccccc1 7a_100000189534_200000210301 [2,0,0,0,0,0|1,1,0]=4 6999 B12R1.8 COCCCCc1ccccc1 34a_100000703073_200000210301 [2,0,0,0,0,0|1,0,1]=4 7000 B12R1.8 COCCCCc1ccccc1 34a_100138415774_100000701786 [2,0,0,0,0,0|1,0,1]=4 7001 B12R1.8 COCCCCc1ccccc1 7a_100000703073_200000210301 [2,0,0,0,0,0|1,0,1]=4 7002 B12R1.8 COCCNCc1ccccc1 207a_100000209980_100015611070 [2,0,0,0,0,0|2,0,0]=4 7003 B12R1.8 COCCNCc1ccccc1 2230a_100000209980_100015291786 [2,0,0,0,0,0|2,0,0]=4 7004 B12R1.8 COCCNCc1ccccc1 2230a_100015324214_100011201679 [2,0,0,0,0,0|2,0,0]=4 7005 B12R1.8 COCCNCc1ccccc1 270004a_100000209980_100015611070 [2,0,0,0,0,0|2,0,0]=4 7006 B12R1.8 COCCNCc1ccccc1 34a_100000180844_200000210301 [2,0,0,0,0,0|2,0,0]=4 7007 B12R1.8 COCCNCc1ccccc1 34a_100015324214_100011201679 [2,0,0,0,0,0|2,0,0]=4 7008 B12R1.8 COCCOCc1ccccc1 34a_100000210237_100015291786 [2,0,0,0,0,0|1,0,0]=3 7009 B12R1.8 COCCOCc1ccccc1 34a_100000210790_100011201679 [2,0,0,0,0,0|1,0,0]=3 7010 B12R1.8 COCCOCc1ccccc1 34a_100000759325_200000210301 [2,0,0,0,0,0|1,0,0]=3 7011 B12R1.8 COCCOCc1ccccc1 34a_100138415774_100000234347 [2,0,0,0,0,0|1,0,0]=3 7012 B12R1.8 COCCOCc1ccccc1 7a_100000210790_100000233755 [2,0,0,0,0,0|1,0,0]=3 7013 B12R1.8 COCCOCc1ccccc1 7a_100000759325_200000210301 [2,0,0,0,0,0|1,0,0]=3 7014 B12R1.8 COCCOCc1ccccn1 34a_100000210237_100000721315 [2,0,0,0,0,0|2,0,0]=4 7015 B12R1.8 COCCOCc1cccnc1 34a_100000210237_100000733263 [2,0,0,0,0,0|2,0,0]=4 7016 B12R1.8 COCCSCc1ccccc1 34a_100011205989_200000210301 [2,0,0,0,0,0|1,1,0]=4 7017 B12R1.8 COCCSCc1ccccc1 34a_100138415774_200011297719 [2,0,0,0,0,0|1,1,0]=4 7018 B12R1.8 COCCSCc1ccccc1 62a_100000211182_100000233755 [2,0,0,0,0,0|1,1,0]=4 7019 B12R1.8 COCCSCc1ccccc1 62a_100000233755_100015291786 [2,0,0,0,0,0|1,1,0]=4 7020 B12R1.8 COCCSCc1ccccc1 7a_100011205989_200000210301 [2,0,0,0,0,0|1,1,0]=4 7021 B12R1.8 CSCCCCc1ccccc1 62a_100000701786_200000210301 [2,0,0,0,0,0|1,0,1]=4 7022 B12R1.8 CSCCCCc1ccccc1 62a_200000210301_100000701786 [2,0,0,0,0,0|1,0,1]=4 7023 B12R1.8 CSCCNCc1ccccc1 207a_100020590264_100015611070 [2,0,0,0,0,0|2,0,0]=4 7024 B12R1.8 CSCCNCc1ccccc1 2230a_100015324214_100000751147 [2,0,0,0,0,0|2,0,0]=4 7025 B12R1.8 CSCCNCc1ccccc1 2230a_100020590264_100015291786 [2,0,0,0,0,0|2,0,0]=4 7026 B12R1.8 CSCCNCc1ccccc1 270004a_100020590264_100015611070 [2,0,0,0,0,0|2,0,0]=4 7027 B12R1.8 CSCCNCc1ccccc1 34a_100015324214_100000212216 [2,0,0,0,0,0|2,0,0]=4 7028 B12R1.8 CSCCOCc1ccccc1 34a_100000210790_100000212216 [2,0,0,0,0,0|1,0,0]=3 7029 B12R1.8 CSCCOCc1ccccc1 34a_100000230434_100015291786 [2,0,0,0,0,0|1,0,0]=3 7030 B12R1.8 CSCCOCc1ccccc1 62a_100000234347_200000210301 [2,0,0,0,0,0|1,0,0]=3 7031 B12R1.8 CSCCOCc1ccccc1 62a_200000210301_100000234347 [2,0,0,0,0,0|1,0,0]=3 7032 B12R1.8 CSCCOCc1ccccc1 7a_100000210790_100000212216 [2,0,0,0,0,0|1,0,0]=3 7033 B12R1.8 CSCCOCc1ccccc1 7a_100000230434_100000211182 [2,0,0,0,0,0|1,0,0]=3 7034 B12R1.8 CSCCOCc1ccccn1 34a_100000230434_100000721315 [2,0,0,0,0,0|2,0,0]=4 7035 B12R1.8 CSCCOCc1ccccn1 7a_100000230434_100000721315 [2,0,0,0,0,0|2,0,0]=4 7036 B12R1.8 CSCCOCc1cccnc1 34a_100000230434_100000733263 [2,0,0,0,0,0|2,0,0]=4 7037 B12R1.8 CSCCOCc1cccnc1 7a_100000230434_100000741622 [2,0,0,0,0,0|2,0,0]=4 7038 B12R1.8 CSCCOCc1ccncc1 7a_100000230434_100015193705 [2,0,0,0,0,0|2,0,0]=4 7039 B12R1.8 CSCCSCc1ccccc1 62a_100000211182_100000751147 [2,0,0,0,0,0|1,1,0]=4 7040 B12R1.8 CSCCSCc1ccccc1 62a_100000212216_100015291786 [2,0,0,0,0,0|1,1,0]=4 7041 B12R1.8 CSCCSCc1ccccc1 62a_200000210301_200011297719 [2,0,0,0,0,0|1,1,0]=4 7042 B12R1.8 CSCCSCc1ccccc1 62a_200011297719_200000210301 [2,0,0,0,0,0|1,1,0]=4 7043 B12R1.8 CSCOCCc1ccccc1 34a_100000210268_100011218213 [2,0,0,0,0,0|1,0,1]=4 7044 B12R1.8 ClCCCOCc1ccccc1 34a_100000230001_100015291786 [2,0,0,0,0,0|1,0,0]=3 7045 B12R1.8 ClCCCOCc1ccccn1 34a_100000230001_100000721315 [2,0,0,0,0,0|2,0,0]=4 7046 B12R1.8 ClCCCOCc1cccnc1 34a_100000230001_100000733263 [2,0,0,0,0,0|2,0,0]=4 7047 B12R1.8 FCCCNCc1ccccc1 207a_100015189416_100015611070 [2,0,0,0,0,0|2,0,0]=4 7048 B12R1.8 FCCCNCc1ccccc1 2230a_100015189416_100015291786 [2,0,0,0,0,0|2,0,0]=4 7049 B12R1.8 FCCCNCc1ccccc1 2230a_100015324214_100011934791 [2,0,0,0,0,0|2,0,0]=4 7050 B12R1.8 FCCCNCc1ccccc1 270004a_100015189416_100015611070 [2,0,0,0,0,0|2,0,0]=4 7051 B12R1.8 FCCCNCc1ccccc1 34a_100015189416_100015291786 [2,0,0,0,0,0|2,0,0]=4 7052 B12R1.8 FCCCNCc1ccccc1 34a_100015324214_100011934791 [2,0,0,0,0,0|2,0,0]=4 7053 B12R1.8 FCCCOCc1ccccc1 34a_100000210790_100011934791 [2,0,0,0,0,0|1,0,0]=3 7054 B12R1.8 FCCCOCc1ccccc1 34a_100000759539_100015291786 [2,0,0,0,0,0|1,0,0]=3 7055 B12R1.8 FCCCOCc1ccccc1 7a_100000210790_100011934791 [2,0,0,0,0,0|1,0,0]=3 7056 B12R1.8 FCCCOCc1ccccn1 34a_100000759539_100000721315 [2,0,0,0,0,0|2,0,0]=4 7057 B12R1.8 FCCCOCc1cccnc1 34a_100000759539_100000733263 [2,0,0,0,0,0|2,0,0]=4 7058 B12R1.8 FCCCSCc1ccccc1 62a_100000211182_100011934791 [2,0,0,0,0,0|1,1,0]=4 7059 B12R1.8 FCCCSCc1ccccc1 62a_100011934791_100015291786 [2,0,0,0,0,0|1,1,0]=4 7060 B12R1.8 FCCOCCc1ccccc1 34a_100000210268_100011217306 [2,0,0,0,0,0|1,0,1]=4 7061 B12R1.8 FCCOCCc1ccccc1 7a_100000210268_100011217306 [2,0,0,0,0,0|1,0,1]=4 7062 B12R1.8 FCSCOCc1ccccc1 62a_100000763385_100015361967 [2,0,0,0,0,0|2,0,0]=4 7063 B12R1.8 FCSCOCc1ccccc1 62a_100015361967_100000763385 [2,0,0,0,0,0|2,0,0]=4 7064 B12R1.8 N#CCCOCc1ccccc1 7a_100000210790_100000184422 [2,0,0,0,0,0|1,0,1]=4 7065 B12R1.8 NCCCOCc1ccccc1 34a_100000182051_100015291786 [2,0,0,0,0,0|1,0,0]=3 7066 B12R1.8 NCCCOCc1ccccn1 34a_100000182051_100000721315 [2,0,0,0,0,0|2,0,0]=4 7067 B12R1.8 NCCCOCc1cccnc1 34a_100000182051_100000733263 [2,0,0,0,0,0|2,0,0]=4 7068 B12R1.8 NCCOCCc1ccccc1 34a_100000210304_100000765856 [2,0,0,0,0,0|1,0,1]=4 7069 B12R1.8 NOCCOCc1ccccc1 34a_100000700252_100015291786 [2,0,0,0,0,0|2,0,0]=4 7070 B12R1.8 OCCCNCc1ccccc1 207a_100000182051_100015611070 [2,0,0,0,0,0|2,0,0]=4 7071 B12R1.8 OCCCNCc1ccccc1 2230a_100015324214_100000230001 [2,0,0,0,0,0|2,0,0]=4 7072 B12R1.8 OCCCNCc1ccccc1 270004a_100000182051_100015611070 [2,0,0,0,0,0|2,0,0]=4 7073 B12R1.8 OCCCNCc1ccccc1 34a_100015324214_100000230001 [2,0,0,0,0,0|2,0,0]=4 7074 B12R1.8 OCCCOCc1ccccc1 34a_100000210790_100000230001 [2,0,0,0,0,0|1,0,0]=3 7075 B12R1.8 OCCCOCc1ccccc1 7a_100000210790_100011215043 [2,0,0,0,0,0|1,0,0]=3 7076 B12R1.8 OCCCSCc1ccccc1 62a_100000211182_100011215043 [2,0,0,0,0,0|1,1,0]=4 7077 B12R1.8 OCCCSCc1ccccc1 62a_100011215043_100015291786 [2,0,0,0,0,0|1,1,0]=4 7078 B12R1.8 OCCOCCc1ccccc1 34a_100000210268_100000211926 [2,0,0,0,0,0|1,0,1]=4 7079 B12R1.8 OCCOCCc1ccccc1 7a_100000210268_100000211926 [2,0,0,0,0,0|1,0,1]=4 7080 B12R1.8 [13CH3]NCCCCc1ccccc1 2230a_100015280158_200025704644 [2,0,0,0,0,0|1,0,1]=4 7081 B12R1.8 [13CH3]NCCCCc1ccccc1 34a_100015280158_200025704644 [2,0,0,0,0,0|1,0,1]=4 7082 B12R1.8 [13CH3]NCCOCc1ccccc1 2230a_100000753106_200025704644 [2,0,0,0,0,0|1,0,0]=3 7083 B12R1.8 [13CH3]NCCOCc1ccccc1 34a_100000753106_200025704644 [2,0,0,0,0,0|1,0,0]=3 7084 B12R1.8 [13CH3]NCCSCc1ccccc1 2230a_100000189534_200025704644 [2,0,0,0,0,0|1,1,0]=4 7085 B12R1.8 [13CH3]NCCSCc1ccccc1 34a_100000189534_200025704644 [2,0,0,0,0,0|1,1,0]=4 7086 B12R1.8 [13CH3]NCCSCc1ccccc1 7a_100000189534_200025704644 [2,0,0,0,0,0|1,1,0]=4 7087 B12R1.8 [13CH3]OCCCCc1ccccc1 34a_100000703073_200025704644 [2,0,0,0,0,0|1,0,1]=4 7088 B12R1.8 [13CH3]OCCCCc1ccccc1 7a_100000703073_200025704644 [2,0,0,0,0,0|1,0,1]=4 7089 B12R1.8 [13CH3]OCCNCc1ccccc1 34a_100000180844_200025704644 [2,0,0,0,0,0|2,0,0]=4 7090 B12R1.8 [13CH3]OCCOCc1ccccc1 34a_100000759325_200025704644 [2,0,0,0,0,0|1,0,0]=3 7091 B12R1.8 [13CH3]OCCOCc1ccccc1 7a_100000759325_200025704644 [2,0,0,0,0,0|1,0,0]=3 7092 B12R1.8 [13CH3]OCCSCc1ccccc1 34a_100011205989_200025704644 [2,0,0,0,0,0|1,1,0]=4 7093 B12R1.8 [13CH3]OCCSCc1ccccc1 7a_100011205989_200025704644 [2,0,0,0,0,0|1,1,0]=4 7094 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_100000701786_200025704644 [2,0,0,0,0,0|1,0,1]=4 7095 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_200025704644_100000701786 [2,0,0,0,0,0|1,0,1]=4 7096 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_100000234347_200025704644 [2,0,0,0,0,0|1,0,0]=3 7097 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_200025704644_100000234347 [2,0,0,0,0,0|1,0,0]=3 7098 B12R1.8 [13CH3]SCCSCc1ccccc1 62a_200011297719_200025704644 [2,0,0,0,0,0|1,1,0]=4 7099 B12R1.8 [13CH3]SCCSCc1ccccc1 62a_200025704644_200011297719 [2,0,0,0,0,0|1,1,0]=4 7100 B12R1.32 C#CCC(=O)Cc1ccccc1 1458a_100011220946_100015291786 [2,0,0,0,0,0|0,0,2]=4 7101 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [2,0,0,0,0,0|0,0,2]=4 7102 B12R1.32 CC#CC(=O)Cc1ccccc1 1458a_100000763181_100015291786 [2,0,0,0,0,0|0,0,2]=4 7103 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [2,0,0,0,0,0|0,0,2]=4 7104 B12R1.32 CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210303 [2,0,0,0,0,0|1,0,0]=3 7105 B12R1.32 CCCC(=O)Cc1ccccc1 1458a_100000211992_100015291786 [2,0,0,0,0,0|0,0,0]=2 7106 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000211992_100000721315 [2,0,0,0,0,0|1,0,0]=3 7107 B12R1.32 CCCC(=O)Cc1ccccn1 1458a_100000233486_100000210303 [2,0,0,0,0,0|1,0,0]=3 7108 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000211992_100000733263 [2,0,0,0,0,0|1,0,0]=3 7109 B12R1.32 CCCC(=O)Cc1cccnc1 1458a_100000737805_100000210303 [2,0,0,0,0,0|1,0,0]=3 7110 B12R1.32 CCCC(=O)Cc1cccnn1 1458a_100000211992_100016990269 [2,0,0,0,0,0|2,0,0]=4 7111 B12R1.32 CCCC(=O)Cc1ccncc1 1458a_100000211992_100000705612 [2,0,0,0,0,0|1,0,0]=3 7112 B12R1.32 CCCC(=O)Cc1cnccn1 1458a_100000211992_100016995436 [2,0,0,0,0,0|2,0,0]=4 7113 B12R1.32 CCCC(=O)Cc1cncnc1 1458a_100000211992_100015196519 [2,0,0,0,0,0|2,0,0]=4 7114 B12R1.32 CCCC(=O)Cc1cncnc1 1458a_100000721575_100000210303 [2,0,0,0,0,0|2,0,0]=4 7115 B12R1.32 CCCC(=O)Cc1ncccn1 1458a_100000211992_100000703007 [2,0,0,0,0,0|2,0,0]=4 7116 B12R1.32 CCCC(=O)Nc1ccccc1 11a_100000106764_100000211992 [2,0,0,0,0,0|1,0,0]=3 7117 B12R1.32 CCCC(=O)Nc1ccccc1 1626a_100000106764_100000211992 [2,0,0,0,0,0|1,0,0]=3 7118 B12R1.32 CCCC(=O)Nc1ccccc1 22a_100000106764_100000211992 [2,0,0,0,0,0|1,0,0]=3 7119 B12R1.32 CCCC(=O)Nc1ccccc1 527a_100000106764_100000211992 [2,0,0,0,0,0|1,0,0]=3 7120 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000184400_200000210301 [2,0,0,0,0,0|2,0,0]=4 7121 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000186898_100000210303 [2,0,0,0,0,0|2,0,0]=4 7122 B12R1.32 CCCN(C)Cc1ccccc1 2230a_100000747261_100015291786 [2,0,0,0,0,0|2,0,0]=4 7123 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000184400_200000210301 [2,0,0,0,0,0|2,0,0]=4 7124 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000186898_100000210303 [2,0,0,0,0,0|2,0,0]=4 7125 B12R1.32 CCCN(C)Cc1ccccc1 269982a_100000747261_100000211182 [2,0,0,0,0,0|2,0,0]=4 7126 B12R1.32 CCCN(C)Cc1ccccc1 270004a_100000747261_100015611070 [2,0,0,0,0,0|2,0,0]=4 7127 B12R1.32 CCCN([13CH3])Cc1ccccc1 2230a_100000184400_200025704644 [2,0,0,0,0,0|2,0,0]=4 7128 B12R1.32 CCCN([13CH3])Cc1ccccc1 269982a_100000184400_200025704644 [2,0,0,0,0,0|2,0,0]=4 7129 B12R1.32 CCNC(=O)C[n+]1ccccc1 11a_100015525214_200000086051 [2,0,0,0,0,0|2,0,0]=4 7130 B12R1.32 CCNC(=O)C[n+]1ccccc1 240690a_100015525214_200000086051 [2,0,0,0,0,0|2,0,0]=4 7131 B12R1.32 CCNC(=O)C[n+]1ccccc1 527a_100015525214_200000086051 [2,0,0,0,0,0|2,0,0]=4 7132 B12R1.32 CCNC(=O)Cc1ccccn1 11a_100015525214_100000233486 [2,0,0,0,0,0|2,0,0]=4 7133 B12R1.32 CCNC(=O)Cc1cccnc1 11a_100015525214_100000737805 [2,0,0,0,0,0|2,0,0]=4 7134 B12R1.32 CCNC(=O)Cc1cccnc1 240690a_100015525214_100000737805 [2,0,0,0,0,0|2,0,0]=4 7135 B12R1.32 CCNC(=O)Cc1cccnc1 527a_100015525214_100000737805 [2,0,0,0,0,0|2,0,0]=4 7136 B12R1.32 CCNC(=O)Cc1ccncc1 11a_100015525214_100011201483 [2,0,0,0,0,0|2,0,0]=4 7137 B12R1.32 CCNC(=O)Cc1ccncc1 240690a_100015525214_100011201483 [2,0,0,0,0,0|2,0,0]=4 7138 B12R1.32 CCNC(=O)Nc1ccccc1 2430a_100000106764_100015525214 [2,0,0,0,0,0|2,0,0]=4 7139 B12R1.32 CCOC(C)Cc1ccccc1 34a_100000748627_100000210202 [2,0,0,0,0,0|1,0,1]=4 7140 B12R1.32 CCOC(C)Cc1ccccc1 34a_100121572206_200011218536 [2,0,0,0,0,0|1,0,1]=4 7141 B12R1.32 CCOC(C)Cc1ccccc1 7a_100000748627_100000210202 [2,0,0,0,0,0|1,0,1]=4 7142 B12R1.32 CNCC(=O)Cc1ccccc1 2230a_106832991635_100000233483 [2,0,0,0,0,0|1,0,0]=3 7143 B12R1.32 CNCC(=O)Cc1ccccc1 7a_106832991635_100000233483 [2,0,0,0,0,0|1,0,0]=3 7144 B12R1.32 CNCC(=O)Nc1ccccc1 2230a_106832991635_100000182850 [2,0,0,0,0,0|2,0,0]=4 7145 B12R1.32 CNCC(=O)Nc1ccccc1 34a_100102657272_100000182850 [2,0,0,0,0,0|2,0,0]=4 7146 B12R1.32 CNCC(=O)Nc1ccccc1 7a_106832991635_100000182850 [2,0,0,0,0,0|2,0,0]=4 7147 B12R1.32 CNCC(=O)Oc1ccccc1 2230a_106832991635_100009813826 [2,0,0,0,0,0|2,0,0]=4 7148 B12R1.32 CNCC(=O)Oc1ccccc1 34a_100102657272_100009813826 [2,0,0,0,0,0|2,0,0]=4 7149 B12R1.32 CNCC(=O)Oc1ccccc1 7a_106832991635_100009813826 [2,0,0,0,0,0|2,0,0]=4 7150 B12R1.32 COCC(=O)Cc1ccccc1 1458a_100000210968_100015291786 [2,0,0,0,0,0|1,0,0]=3 7151 B12R1.32 COCC(=O)Cc1ccccn1 1458a_100000210968_100000721315 [2,0,0,0,0,0|2,0,0]=4 7152 B12R1.32 COCC(=O)Cc1cccnc1 1458a_100000210968_100000733263 [2,0,0,0,0,0|2,0,0]=4 7153 B12R1.32 COCC(=O)Cc1ccncc1 1458a_100000210968_100000705612 [2,0,0,0,0,0|2,0,0]=4 7154 B12R1.32 COCC(=O)Nc1ccccc1 11a_100000106764_100000210968 [2,0,0,0,0,0|2,0,0]=4 7155 B12R1.32 COCC(=O)Nc1ccccc1 1626a_100000106764_100000210968 [2,0,0,0,0,0|2,0,0]=4 7156 B12R1.32 COCC(=O)Nc1ccccc1 22a_100000106764_100000210968 [2,0,0,0,0,0|2,0,0]=4 7157 B12R1.32 COCC(=O)Nc1ccccc1 34a_100000246334_200000210301 [2,0,0,0,0,0|2,0,0]=4 7158 B12R1.32 COCC(=O)Nc1ccccc1 34a_100138415774_100000182850 [2,0,0,0,0,0|2,0,0]=4 7159 B12R1.32 COCC(=O)Nc1ccccc1 527a_100000106764_100000210968 [2,0,0,0,0,0|2,0,0]=4 7160 B12R1.32 COCC(=O)Oc1ccccc1 34a_100138415774_100009813826 [2,0,0,0,0,0|2,0,0]=4 7161 B12R1.32 CSCC(=O)Cc1ccccc1 1458a_100000184570_100015291786 [2,0,0,0,0,0|1,0,0]=3 7162 B12R1.32 CSCC(=O)Cc1ccccc1 62a_100000233483_200000210301 [2,0,0,0,0,0|1,0,0]=3 7163 B12R1.32 CSCC(=O)Cc1ccccc1 62a_200000210301_100000233483 [2,0,0,0,0,0|1,0,0]=3 7164 B12R1.32 CSCC(=O)Cc1ccccn1 1458a_100000184570_100000721315 [2,0,0,0,0,0|2,0,0]=4 7165 B12R1.32 CSCC(=O)Cc1cccnc1 1458a_100000184570_100000733263 [2,0,0,0,0,0|2,0,0]=4 7166 B12R1.32 CSCC(=O)Cc1ccncc1 1458a_100000184570_100000705612 [2,0,0,0,0,0|2,0,0]=4 7167 B12R1.32 CSCC(=O)Nc1ccccc1 11a_100000106764_100000184570 [2,0,0,0,0,0|2,0,0]=4 7168 B12R1.32 CSCC(=O)Nc1ccccc1 1626a_100000106764_100000184570 [2,0,0,0,0,0|2,0,0]=4 7169 B12R1.32 CSCC(=O)Nc1ccccc1 22a_100000106764_100000184570 [2,0,0,0,0,0|2,0,0]=4 7170 B12R1.32 CSCC(=O)Nc1ccccc1 527a_100000106764_100000184570 [2,0,0,0,0,0|2,0,0]=4 7171 B12R1.32 CSCC(=O)Nc1ccccc1 62a_100012148978_200000210301 [2,0,0,0,0,0|2,0,0]=4 7172 B12R1.32 CSCC(=O)Nc1ccccc1 62a_200000210301_100000182850 [2,0,0,0,0,0|2,0,0]=4 7173 B12R1.32 CSCC(=O)Oc1ccccc1 62a_100009813826_200000210301 [2,0,0,0,0,0|2,0,0]=4 7174 B12R1.32 CSCC(=O)Oc1ccccc1 62a_200000210301_100009813826 [2,0,0,0,0,0|2,0,0]=4 7175 B12R1.32 N#CCC(=O)Cc1ccccc1 1458a_100051588842_100015291786 [2,0,0,0,0,0|1,0,1]=4 7176 B12R1.32 O=C(CCF)C[n+]1ccccc1 1458a_200000086051_100011217306 [2,0,0,0,0,0|2,0,0]=4 7177 B12R1.32 O=C(CCF)Cc1ccccn1 1458a_100000233486_100011217306 [2,0,0,0,0,0|2,0,0]=4 7178 B12R1.32 O=C(CCF)Cc1cccnc1 1458a_100000737805_100011217306 [2,0,0,0,0,0|2,0,0]=4 7179 B12R1.32 O=C(CCO)C[n+]1ccccc1 1458a_200000086051_100000211926 [2,0,0,0,0,0|2,0,0]=4 7180 B12R1.32 O=C(CCO)Cc1ccccc1 1458a_100011216618_100015291786 [2,0,0,0,0,0|1,0,0]=3 7181 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100000233486_100000211926 [2,0,0,0,0,0|2,0,0]=4 7182 B12R1.32 O=C(CCO)Cc1ccccn1 1458a_100011216618_100000721315 [2,0,0,0,0,0|2,0,0]=4 7183 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100000737805_100000211926 [2,0,0,0,0,0|2,0,0]=4 7184 B12R1.32 O=C(CCO)Cc1cccnc1 1458a_100011216618_100000733263 [2,0,0,0,0,0|2,0,0]=4 7185 B12R1.32 O=C(CCO)Cc1ccncc1 1458a_100011216618_100000705612 [2,0,0,0,0,0|2,0,0]=4 7186 B12R1.32 O=C(CCO)Nc1ccccc1 22a_100000106764_100011216618 [2,0,0,0,0,0|2,0,0]=4 7187 B12R1.32 [13CH3]OCC(=O)Nc1ccccc1 34a_100000246334_200025704644 [2,0,0,0,0,0|2,0,0]=4 7188 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_100000233483_200025704644 [2,0,0,0,0,0|1,0,0]=3 7189 B12R1.32 [13CH3]SCC(=O)Cc1ccccc1 62a_200025704644_100000233483 [2,0,0,0,0,0|1,0,0]=3 7190 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_100012148978_200025704644 [2,0,0,0,0,0|2,0,0]=4 7191 B12R1.32 [13CH3]SCC(=O)Nc1ccccc1 62a_200025704644_100000182850 [2,0,0,0,0,0|2,0,0]=4 7192 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_100009813826_200025704644 [2,0,0,0,0,0|2,0,0]=4 7193 B12R1.32 [13CH3]SCC(=O)Oc1ccccc1 62a_200025704644_100009813826 [2,0,0,0,0,0|2,0,0]=4 7194 B14R0.203 C=CC=CC(=O)CC(=O)NCCCCC 1458a_100016291481_100000230301 [0,1,1,0,0,0|2,0,0]=4 7195 B14R0.203 C=CC=CC(=O)CC(=O)NCCCOC 1458a_100016291481_100000183178 [0,1,1,0,0,0|2,0,0]=4 7196 B14R0.203 C=CC=CC(=O)CC(=O)OCCOCC 1458a_100016291481_200000101388 [0,1,1,0,0,0|1,0,0]=3 7197 B14R0.474 C=CC=CC(=O)C(C)C(=O)NCCCC 1458a_100016291481_100000735917 [0,1,1,0,0,0|2,0,0]=4 7198 B14R0.474 C=CC=CC(=O)C(C)C(=O)OCCCC 1458a_100016291481_100000759602 [0,1,1,0,0,0|1,0,0]=3 7199 B14R0.1299 C=CC=CC(=O)CC(=O)N(C)CCCC 1458a_100016291481_100000230175 [0,1,1,0,0,0|2,0,0]=4 7200 B14R0.1444 C/C=C/C=CC(=O)CC(=O)CCCCC 1458a_100000185730_200012276598 [0,1,1,0,0,0|2,0,0]=4 7201 B14R0.1444 C/C=C/C=CC(=O)CC(=O)NCCCC 1458a_100000185730_100000182744 [0,1,1,0,0,0|2,0,0]=4 7202 B14R0.1444 C/C=C/C=CC(=O)CC(=O)OCCCC 1458a_100000185730_100000211628 [0,1,1,0,0,0|1,0,0]=3 7203 B14R0.1444 C/C=C/C=CC(=O)CC(=O)OCCOC 1458a_100000185730_200000040189 [0,1,1,0,0,0|2,0,0]=4 7204 B14R0.179 C/C=C/C=C/COCC(=O)OCCCC 34a_100016283227_100000211628 [0,1,1,0,0,0|0,0,2]=4 7205 B14R0.528 C=CCN(CC=C)CC(=O)OCCCC 2230a_100000210471_100000211628 [0,1,1,0,0,0|1,0,1]=4 7206 B14R0.528 C=CCN(CC=C)CC(=O)OCCCC 269982a_100000210471_100000211628 [0,1,1,0,0,0|1,0,1]=4 7207 B14R1.14 BrCCCOCCc1ccc(cc1)Br 34a_100011217188_100011740612 [1,1,0,0,0,0|1,0,1]=4 7208 B14R1.14 CCCCCC=Cc1ccc(cc1)Br 271570a_100000062253_100000752885 [1,1,0,0,0,0|1,0,1]=4 7209 B14R1.14 CCCCCC=Cc1ccc(cc1)C 271570a_100000062253_100000186775 [1,1,0,0,0,0|1,0,1]=4 7210 B14R1.14 CCCCCC=Cc1ccc(cc1)Cl 271570a_100000062253_100000755918 [1,1,0,0,0,0|1,0,1]=4 7211 B14R1.14 CCCCCC=Cc1ccc(cc1)F 271570a_100000062253_100000211213 [1,1,0,0,0,0|1,0,1]=4 7212 B14R1.14 CCCCCC=Cc1ccc(cc1)N 271570a_100000062253_100000185761 [1,1,0,0,0,0|1,0,1]=4 7213 B14R1.14 CCCCCC=Cc1ccc(cc1)O 271570a_100000062253_100000185759 [1,1,0,0,0,0|1,0,1]=4 7214 B14R1.14 CCCCCCCc1ccc(cc1)O 271570a_203496583355_100009813667 [1,1,0,0,0,0|1,0,1]=4 7215 B14R1.14 CCCCCNCc1ccc(cc1)Br 207a_100000209983_100000186029 [1,1,0,0,0,0|2,0,0]=4 7216 B14R1.14 CCCCCNCc1ccc(cc1)Br 2230a_100000174875_100000210326 [1,1,0,0,0,0|2,0,0]=4 7217 B14R1.14 CCCCCNCc1ccc(cc1)Br 2230a_100000209983_100011217064 [1,1,0,0,0,0|2,0,0]=4 7218 B14R1.14 CCCCCNCc1ccc(cc1)Br 270004a_100000209983_100000186029 [1,1,0,0,0,0|2,0,0]=4 7219 B14R1.14 CCCCCNCc1ccc(cc1)Br 34a_100000174875_100000718602 [1,1,0,0,0,0|2,0,0]=4 7220 B14R1.14 CCCCCNCc1ccc(cc1)C 207a_100000209983_100000211033 [1,1,0,0,0,0|2,0,0]=4 7221 B14R1.14 CCCCCNCc1ccc(cc1)C 2230a_100000174908_100000210326 [1,1,0,0,0,0|2,0,0]=4 7222 B14R1.14 CCCCCNCc1ccc(cc1)C 2230a_100000209983_100000210814 [1,1,0,0,0,0|2,0,0]=4 7223 B14R1.14 CCCCCNCc1ccc(cc1)C 270004a_100000209983_100000211033 [1,1,0,0,0,0|2,0,0]=4 7224 B14R1.14 CCCCCNCc1ccc(cc1)C 34a_100000174908_100000718602 [1,1,0,0,0,0|2,0,0]=4 7225 B14R1.14 CCCCCNCc1ccc(cc1)Cl 207a_100000209983_100000189385 [1,1,0,0,0,0|2,0,0]=4 7226 B14R1.14 CCCCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210326 [1,1,0,0,0,0|2,0,0]=4 7227 B14R1.14 CCCCCNCc1ccc(cc1)Cl 2230a_100000209983_100000694040 [1,1,0,0,0,0|2,0,0]=4 7228 B14R1.14 CCCCCNCc1ccc(cc1)Cl 270004a_100000209983_100000189385 [1,1,0,0,0,0|2,0,0]=4 7229 B14R1.14 CCCCCNCc1ccc(cc1)Cl 34a_100000174871_100000718602 [1,1,0,0,0,0|2,0,0]=4 7230 B14R1.14 CCCCCNCc1ccc(cc1)F 207a_100000209983_100000210084 [1,1,0,0,0,0|2,0,0]=4 7231 B14R1.14 CCCCCNCc1ccc(cc1)F 2230a_100000174882_100000210326 [1,1,0,0,0,0|2,0,0]=4 7232 B14R1.14 CCCCCNCc1ccc(cc1)F 2230a_100000209983_100000198546 [1,1,0,0,0,0|2,0,0]=4 7233 B14R1.14 CCCCCNCc1ccc(cc1)F 270004a_100000209983_100000210084 [1,1,0,0,0,0|2,0,0]=4 7234 B14R1.14 CCCCCNCc1ccc(cc1)F 34a_100000174882_100000718602 [1,1,0,0,0,0|2,0,0]=4 7235 B14R1.14 CCCCCNCc1ccc(cc1)I 207a_100000209983_100000188517 [1,1,0,0,0,0|2,0,0]=4 7236 B14R1.14 CCCCCNCc1ccc(cc1)I 2230a_100000209983_100000189116 [1,1,0,0,0,0|2,0,0]=4 7237 B14R1.14 CCCCCNCc1ccc(cc1)I 2230a_100016989417_100000210326 [1,1,0,0,0,0|2,0,0]=4 7238 B14R1.14 CCCCCNCc1ccc(cc1)I 34a_100016989417_100000718602 [1,1,0,0,0,0|2,0,0]=4 7239 B14R1.14 CCCCCNCc1ccc(cc1)O 34a_100000185549_100000718602 [1,1,0,0,0,0|2,0,0]=4 7240 B14R1.14 CCCCCOCc1ccc(cc1)Br 34a_100000210253_100000189115 [1,1,0,0,0,0|2,0,0]=4 7241 B14R1.14 CCCCCOCc1ccc(cc1)Br 34a_100000695286_100000718602 [1,1,0,0,0,0|2,0,0]=4 7242 B14R1.14 CCCCCOCc1ccc(cc1)Br 7a_100000210253_100011217064 [1,1,0,0,0,0|2,0,0]=4 7243 B14R1.14 CCCCCOCc1ccc(cc1)C 34a_100000210253_100000210814 [1,1,0,0,0,0|2,0,0]=4 7244 B14R1.14 CCCCCOCc1ccc(cc1)C 34a_100011215236_100000718602 [1,1,0,0,0,0|2,0,0]=4 7245 B14R1.14 CCCCCOCc1ccc(cc1)C 7a_100000210253_100000210814 [1,1,0,0,0,0|2,0,0]=4 7246 B14R1.14 CCCCCOCc1ccc(cc1)C 7a_100011215236_100000210326 [1,1,0,0,0,0|2,0,0]=4 7247 B14R1.14 CCCCCOCc1ccc(cc1)Cl 34a_100000210253_100000694040 [1,1,0,0,0,0|2,0,0]=4 7248 B14R1.14 CCCCCOCc1ccc(cc1)Cl 34a_100000211118_100000718602 [1,1,0,0,0,0|2,0,0]=4 7249 B14R1.14 CCCCCOCc1ccc(cc1)Cl 7a_100000210253_100000187161 [1,1,0,0,0,0|2,0,0]=4 7250 B14R1.14 CCCCCOCc1ccc(cc1)Cl 7a_100000211118_100000210326 [1,1,0,0,0,0|2,0,0]=4 7251 B14R1.14 CCCCCOCc1ccc(cc1)F 34a_100000210253_100000198546 [1,1,0,0,0,0|2,0,0]=4 7252 B14R1.14 CCCCCOCc1ccc(cc1)F 34a_100000210977_100000718602 [1,1,0,0,0,0|2,0,0]=4 7253 B14R1.14 CCCCCOCc1ccc(cc1)F 7a_100000210253_100000198546 [1,1,0,0,0,0|2,0,0]=4 7254 B14R1.14 CCCCCOCc1ccc(cc1)F 7a_100000210977_100000210326 [1,1,0,0,0,0|2,0,0]=4 7255 B14R1.14 CCCCCOCc1ccc(cc1)I 34a_100000210253_100000189116 [1,1,0,0,0,0|2,0,0]=4 7256 B14R1.14 CCCCCOCc1ccc(cc1)I 34a_100000690907_100000718602 [1,1,0,0,0,0|2,0,0]=4 7257 B14R1.14 CCCCCOCc1ccc(cc1)I 7a_100000210253_100000189116 [1,1,0,0,0,0|2,0,0]=4 7258 B14R1.14 CCCCCOCc1ccc(cc1)I 7a_100000690907_100000210326 [1,1,0,0,0,0|2,0,0]=4 7259 B14R1.14 CCCCCOCc1ccc(cc1)N 34a_100011215238_100000718602 [1,1,0,0,0,0|2,0,0]=4 7260 B14R1.14 CCCCCSCc1ccc(cc1)Br 62a_100000189115_100000210326 [1,1,0,0,0,0|2,0,0]=4 7261 B14R1.14 CCCCCSCc1ccc(cc1)Br 62a_100000210326_100000189115 [1,1,0,0,0,0|2,0,0]=4 7262 B14R1.14 CCCCCSCc1ccc(cc1)C 62a_100000210326_100000210814 [1,1,0,0,0,0|2,0,0]=4 7263 B14R1.14 CCCCCSCc1ccc(cc1)C 62a_100000210814_100000210326 [1,1,0,0,0,0|2,0,0]=4 7264 B14R1.14 CCCCCSCc1ccc(cc1)Cl 62a_100000187161_100000210326 [1,1,0,0,0,0|2,0,0]=4 7265 B14R1.14 CCCCCSCc1ccc(cc1)Cl 62a_100000210326_100000187161 [1,1,0,0,0,0|2,0,0]=4 7266 B14R1.14 CCCCCSCc1ccc(cc1)F 62a_100000198546_100000210326 [1,1,0,0,0,0|2,0,0]=4 7267 B14R1.14 CCCCCSCc1ccc(cc1)F 62a_100000210326_100000187164 [1,1,0,0,0,0|2,0,0]=4 7268 B14R1.14 CCCCCSCc1ccc(cc1)I 62a_100000189116_100000210326 [1,1,0,0,0,0|2,0,0]=4 7269 B14R1.14 CCCCCSCc1ccc(cc1)I 62a_100000210326_100000189116 [1,1,0,0,0,0|2,0,0]=4 7270 B14R1.14 CCCCNCCc1ccc(cc1)Br 2230a_100000102301_100011740612 [1,1,0,0,0,0|1,0,1]=4 7271 B14R1.14 CCCCNCCc1ccc(cc1)Br 2230a_100000755846_100000210211 [1,1,0,0,0,0|1,0,1]=4 7272 B14R1.14 CCCCNCCc1ccc(cc1)Br 34a_100000755846_100000210210 [1,1,0,0,0,0|1,0,1]=4 7273 B14R1.14 CCCCNCCc1ccc(cc1)Br 7a_106832991798_100011740612 [1,1,0,0,0,0|1,0,1]=4 7274 B14R1.14 CCCCNCCc1ccc(cc1)C 2230a_100000102301_100011713686 [1,1,0,0,0,0|1,0,1]=4 7275 B14R1.14 CCCCNCCc1ccc(cc1)C 2230a_100000705350_100000210211 [1,1,0,0,0,0|1,0,1]=4 7276 B14R1.14 CCCCNCCc1ccc(cc1)C 34a_100000705350_100000210210 [1,1,0,0,0,0|1,0,1]=4 7277 B14R1.14 CCCCNCCc1ccc(cc1)C 7a_106832991798_100011713686 [1,1,0,0,0,0|1,0,1]=4 7278 B14R1.14 CCCCNCCc1ccc(cc1)Cl 2230a_100000102301_100011713675 [1,1,0,0,0,0|1,0,1]=4 7279 B14R1.14 CCCCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210211 [1,1,0,0,0,0|1,0,1]=4 7280 B14R1.14 CCCCNCCc1ccc(cc1)Cl 34a_100000185265_100000210210 [1,1,0,0,0,0|1,0,1]=4 7281 B14R1.14 CCCCNCCc1ccc(cc1)Cl 7a_106832991798_100011713675 [1,1,0,0,0,0|1,0,1]=4 7282 B14R1.14 CCCCNCCc1ccc(cc1)F 2230a_100000102301_100011217392 [1,1,0,0,0,0|1,0,1]=4 7283 B14R1.14 CCCCNCCc1ccc(cc1)F 2230a_100000199005_100000210211 [1,1,0,0,0,0|1,0,1]=4 7284 B14R1.14 CCCCNCCc1ccc(cc1)F 34a_100000199005_100000210210 [1,1,0,0,0,0|1,0,1]=4 7285 B14R1.14 CCCCNCCc1ccc(cc1)F 7a_106832991798_100011217392 [1,1,0,0,0,0|1,0,1]=4 7286 B14R1.14 CCCCNCCc1ccc(cc1)O 2230a_100000102301_100009816426 [1,1,0,0,0,0|1,0,1]=4 7287 B14R1.14 CCCCNCCc1ccc(cc1)O 34a_100000743037_100000210210 [1,1,0,0,0,0|1,0,1]=4 7288 B14R1.14 CCCCNCCc1ccc(cc1)O 7a_106832991798_100009816426 [1,1,0,0,0,0|1,0,1]=4 7289 B14R1.14 CCCCOCCc1ccc(cc1)Br 34a_100000210227_100011740612 [1,1,0,0,0,0|0,0,1]=3 7290 B14R1.14 CCCCOCCc1ccc(cc1)Br 34a_100000766406_100000210210 [1,1,0,0,0,0|0,0,1]=3 7291 B14R1.14 CCCCOCCc1ccc(cc1)Br 7a_100000210227_100011740612 [1,1,0,0,0,0|0,0,1]=3 7292 B14R1.14 CCCCOCCc1ccc(cc1)Br 7a_100000766406_100000210211 [1,1,0,0,0,0|0,0,1]=3 7293 B14R1.14 CCCCOCCc1ccc(cc1)C 34a_100000210227_100011713686 [1,1,0,0,0,0|0,0,1]=3 7294 B14R1.14 CCCCOCCc1ccc(cc1)C 34a_100000756670_100000210210 [1,1,0,0,0,0|0,0,1]=3 7295 B14R1.14 CCCCOCCc1ccc(cc1)C 7a_100000210227_100011713686 [1,1,0,0,0,0|0,0,1]=3 7296 B14R1.14 CCCCOCCc1ccc(cc1)C 7a_100000756670_100000210211 [1,1,0,0,0,0|0,0,1]=3 7297 B14R1.14 CCCCOCCc1ccc(cc1)Cl 34a_100000210227_100011713675 [1,1,0,0,0,0|0,0,1]=3 7298 B14R1.14 CCCCOCCc1ccc(cc1)Cl 34a_100011219627_100000210210 [1,1,0,0,0,0|0,0,1]=3 7299 B14R1.14 CCCCOCCc1ccc(cc1)Cl 7a_100000210227_100011713675 [1,1,0,0,0,0|0,0,1]=3 7300 B14R1.14 CCCCOCCc1ccc(cc1)Cl 7a_100011219627_100000210211 [1,1,0,0,0,0|0,0,1]=3 7301 B14R1.14 CCCCOCCc1ccc(cc1)F 34a_100000210227_100011217392 [1,1,0,0,0,0|0,0,1]=3 7302 B14R1.14 CCCCOCCc1ccc(cc1)F 34a_100000754732_100000210210 [1,1,0,0,0,0|0,0,1]=3 7303 B14R1.14 CCCCOCCc1ccc(cc1)F 7a_100000210227_100011217392 [1,1,0,0,0,0|0,0,1]=3 7304 B14R1.14 CCCCOCCc1ccc(cc1)F 7a_100000754732_100000210211 [1,1,0,0,0,0|0,0,1]=3 7305 B14R1.14 CCCCOCCc1ccc(cc1)I 34a_100012291149_100000210210 [1,1,0,0,0,0|0,0,1]=3 7306 B14R1.14 CCCCOCCc1ccc(cc1)I 7a_100012291149_100000210211 [1,1,0,0,0,0|0,0,1]=3 7307 B14R1.14 CCCCOCCc1ccc(cc1)N 34a_100011204434_100000210210 [1,1,0,0,0,0|0,0,1]=3 7308 B14R1.14 CCCCOCCc1ccc(cc1)O 7a_100000210227_100009816426 [1,1,0,0,0,0|0,0,1]=3 7309 B14R1.14 CCCCOCCc1ccc(cn1)Br 34a_100012357577_100000210210 [1,1,0,0,0,0|1,0,1]=4 7310 B14R1.14 CCCCOCCc1ccc(nc1)C 34a_100011815783_100000210210 [1,1,0,0,0,0|1,0,1]=4 7311 B14R1.14 CCCCOCCc1ccc(nc1)Cl 34a_100009880866_100000210210 [1,1,0,0,0,0|1,0,1]=4 7312 B14R1.14 CCCCOCCc1ccc(nc1)Cl 7a_100009880866_100000210211 [1,1,0,0,0,0|1,0,1]=4 7313 B14R1.14 CCCCOCNc1ccc(cc1)Br 2230a_100000210018_100011995733 [1,1,0,0,0,0|1,0,1]=4 7314 B14R1.14 CCCCOCNc1ccc(cc1)Br 34a_100000210018_100011995733 [1,1,0,0,0,0|1,0,1]=4 7315 B14R1.14 CCCCOCNc1ccc(cc1)C 34a_100000124888_100011995733 [1,1,0,0,0,0|1,0,1]=4 7316 B14R1.14 CCCCOCNc1ccc(cc1)Cl 2230a_100000210052_100011995733 [1,1,0,0,0,0|1,0,1]=4 7317 B14R1.14 CCCCOCNc1ccc(cc1)Cl 34a_100000210052_100011995733 [1,1,0,0,0,0|1,0,1]=4 7318 B14R1.14 CCCCOCNc1ccc(cc1)F 34a_100000185862_100011995733 [1,1,0,0,0,0|1,0,1]=4 7319 B14R1.14 CCCCOCNc1ccc(cc1)I 34a_100000185761_100011995733 [1,1,0,0,0,0|1,0,1]=4 7320 B14R1.14 CCCCOCNc1ccc(cc1)O 34a_100000185829_100011995733 [1,1,0,0,0,0|1,0,1]=4 7321 B14R1.14 CCCCOCOc1ccc(cc1)Br 34a_100000185759_100011995733 [1,1,0,0,0,0|1,0,1]=4 7322 B14R1.14 CCCCOCOc1ccc(cc1)C 34a_100000210336_100011995733 [1,1,0,0,0,0|1,0,1]=4 7323 B14R1.14 CCCCOCOc1ccc(cc1)Cl 34a_100000210216_100011995733 [1,1,0,0,0,0|1,0,1]=4 7324 B14R1.14 CCCCOCOc1ccc(cc1)F 34a_100000210339_100011995733 [1,1,0,0,0,0|1,0,1]=4 7325 B14R1.14 CCCCOCOc1ccc(cc1)I 34a_100000212066_100011995733 [1,1,0,0,0,0|1,0,1]=4 7326 B14R1.14 CCCCOCOc1ccc(cc1)N 34a_100000185829_100011995733 [1,1,0,0,0,0|1,0,1]=4 7327 B14R1.14 CCCCOCSc1ccc(cc1)Br 62a_100000752885_100011995733 [1,1,0,0,0,0|1,0,1]=4 7328 B14R1.14 CCCCOCSc1ccc(cc1)Br 62a_100011995733_100000752885 [1,1,0,0,0,0|1,0,1]=4 7329 B14R1.14 CCCCOCSc1ccc(cc1)C 62a_100000186775_100011995733 [1,1,0,0,0,0|1,0,1]=4 7330 B14R1.14 CCCCOCSc1ccc(cc1)C 62a_100011995733_100000186775 [1,1,0,0,0,0|1,0,1]=4 7331 B14R1.14 CCCCOCSc1ccc(cc1)Cl 62a_100000755918_100011995733 [1,1,0,0,0,0|1,0,1]=4 7332 B14R1.14 CCCCOCSc1ccc(cc1)Cl 62a_100011995733_100000755918 [1,1,0,0,0,0|1,0,1]=4 7333 B14R1.14 CCCCOCSc1ccc(cc1)F 62a_100000211213_100011995733 [1,1,0,0,0,0|1,0,1]=4 7334 B14R1.14 CCCCOCSc1ccc(cc1)F 62a_100011995733_100000211213 [1,1,0,0,0,0|1,0,1]=4 7335 B14R1.14 CCCCOCSc1ccc(cc1)N 62a_100000185761_100011995733 [1,1,0,0,0,0|1,0,1]=4 7336 B14R1.14 CCCCOCSc1ccc(cc1)N 62a_100011995733_100000185761 [1,1,0,0,0,0|1,0,1]=4 7337 B14R1.14 CCCCOCSc1ccc(cc1)O 62a_100011995733_100000185759 [1,1,0,0,0,0|1,0,1]=4 7338 B14R1.14 CCCCSCCc1ccc(cc1)Br 62a_100000210211_100011740612 [1,1,0,0,0,0|0,1,1]=4 7339 B14R1.14 CCCCSCCc1ccc(cc1)Br 62a_100011740612_100000210210 [1,1,0,0,0,0|0,1,1]=4 7340 B14R1.14 CCCCSCCc1ccc(cc1)C 62a_100000210211_100011713686 [1,1,0,0,0,0|0,1,1]=4 7341 B14R1.14 CCCCSCCc1ccc(cc1)C 62a_100011713686_100000210210 [1,1,0,0,0,0|0,1,1]=4 7342 B14R1.14 CCCCSCCc1ccc(cc1)Cl 62a_100000210211_100011713675 [1,1,0,0,0,0|0,1,1]=4 7343 B14R1.14 CCCCSCCc1ccc(cc1)Cl 62a_100011713675_100000210210 [1,1,0,0,0,0|0,1,1]=4 7344 B14R1.14 CCCCSCCc1ccc(cc1)F 62a_100000210211_100011217392 [1,1,0,0,0,0|0,1,1]=4 7345 B14R1.14 CCCCSCCc1ccc(cc1)F 62a_100011217392_100000210210 [1,1,0,0,0,0|0,1,1]=4 7346 B14R1.14 CCCCSCCc1ccc(cc1)O 62a_100000210211_100009816426 [1,1,0,0,0,0|0,1,1]=4 7347 B14R1.14 CCCCSCCc1ccc(cc1)O 62a_100009816426_100000210210 [1,1,0,0,0,0|0,1,1]=4 7348 B14R1.14 CCCNN=CCc1ccc(cc1)Br 4a_100000740057_100011361690 [1,1,0,0,0,0|2,0,0]=4 7349 B14R1.14 CCCNN=CCc1ccc(cc1)C 4a_100000740057_100011361684 [1,1,0,0,0,0|2,0,0]=4 7350 B14R1.14 CCCNN=CCc1ccc(cc1)Cl 4a_100000740057_100000730895 [1,1,0,0,0,0|2,0,0]=4 7351 B14R1.14 CCCNN=CCc1ccc(cc1)F 4a_100000740057_100000684651 [1,1,0,0,0,0|2,0,0]=4 7352 B14R1.14 COCCOCCc1ccc(cc1)Br 34a_100000210237_100011740612 [1,1,0,0,0,0|1,0,1]=4 7353 B14R1.14 COCCOCCc1ccc(cc1)Br 34a_100000766406_100011201679 [1,1,0,0,0,0|1,0,1]=4 7354 B14R1.14 COCCOCCc1ccc(cc1)Br 7a_100000766406_100000233755 [1,1,0,0,0,0|1,0,1]=4 7355 B14R1.14 COCCOCCc1ccc(cc1)C 34a_100000210237_100011713686 [1,1,0,0,0,0|1,0,1]=4 7356 B14R1.14 COCCOCCc1ccc(cc1)C 34a_100000756670_100011201679 [1,1,0,0,0,0|1,0,1]=4 7357 B14R1.14 COCCOCCc1ccc(cc1)C 7a_100000756670_100000233755 [1,1,0,0,0,0|1,0,1]=4 7358 B14R1.14 COCCOCCc1ccc(cc1)Cl 34a_100000210237_100011713675 [1,1,0,0,0,0|1,0,1]=4 7359 B14R1.14 COCCOCCc1ccc(cc1)Cl 34a_100011219627_100011201679 [1,1,0,0,0,0|1,0,1]=4 7360 B14R1.14 COCCOCCc1ccc(cc1)Cl 7a_100011219627_100000233755 [1,1,0,0,0,0|1,0,1]=4 7361 B14R1.14 COCCOCCc1ccc(cc1)F 34a_100000210237_100011217392 [1,1,0,0,0,0|1,0,1]=4 7362 B14R1.14 COCCOCCc1ccc(cc1)F 34a_100000754732_100011201679 [1,1,0,0,0,0|1,0,1]=4 7363 B14R1.14 COCCOCCc1ccc(cc1)F 7a_100000754732_100000233755 [1,1,0,0,0,0|1,0,1]=4 7364 B14R1.14 COCCOCCc1ccc(cc1)I 34a_100012291149_100011201679 [1,1,0,0,0,0|1,0,1]=4 7365 B14R1.14 COCCOCCc1ccc(cc1)I 7a_100012291149_100000233755 [1,1,0,0,0,0|1,0,1]=4 7366 B14R1.14 COCCOCCc1ccc(cc1)N 34a_100011204434_100011201679 [1,1,0,0,0,0|1,0,1]=4 7367 B14R1.14 CSCCOCCc1ccc(cc1)Br 34a_100000230434_100011740612 [1,1,0,0,0,0|1,0,1]=4 7368 B14R1.14 CSCCOCCc1ccc(cc1)Br 34a_100000766406_100000212216 [1,1,0,0,0,0|1,0,1]=4 7369 B14R1.14 CSCCOCCc1ccc(cc1)Br 7a_100000230434_100011740612 [1,1,0,0,0,0|1,0,1]=4 7370 B14R1.14 CSCCOCCc1ccc(cc1)Br 7a_100000766406_100000212216 [1,1,0,0,0,0|1,0,1]=4 7371 B14R1.14 CSCCOCCc1ccc(cc1)C 34a_100000230434_100011713686 [1,1,0,0,0,0|1,0,1]=4 7372 B14R1.14 CSCCOCCc1ccc(cc1)C 34a_100000756670_100000212216 [1,1,0,0,0,0|1,0,1]=4 7373 B14R1.14 CSCCOCCc1ccc(cc1)C 7a_100000230434_100011713686 [1,1,0,0,0,0|1,0,1]=4 7374 B14R1.14 CSCCOCCc1ccc(cc1)C 7a_100000756670_100000212216 [1,1,0,0,0,0|1,0,1]=4 7375 B14R1.14 CSCCOCCc1ccc(cc1)Cl 34a_100000230434_100011713675 [1,1,0,0,0,0|1,0,1]=4 7376 B14R1.14 CSCCOCCc1ccc(cc1)Cl 34a_100011219627_100000212216 [1,1,0,0,0,0|1,0,1]=4 7377 B14R1.14 CSCCOCCc1ccc(cc1)Cl 7a_100000230434_100011713675 [1,1,0,0,0,0|1,0,1]=4 7378 B14R1.14 CSCCOCCc1ccc(cc1)Cl 7a_100011219627_100000212216 [1,1,0,0,0,0|1,0,1]=4 7379 B14R1.14 CSCCOCCc1ccc(cc1)F 34a_100000230434_100011217392 [1,1,0,0,0,0|1,0,1]=4 7380 B14R1.14 CSCCOCCc1ccc(cc1)F 34a_100000754732_100000212216 [1,1,0,0,0,0|1,0,1]=4 7381 B14R1.14 CSCCOCCc1ccc(cc1)F 7a_100000230434_100011217392 [1,1,0,0,0,0|1,0,1]=4 7382 B14R1.14 CSCCOCCc1ccc(cc1)F 7a_100000754732_100000212216 [1,1,0,0,0,0|1,0,1]=4 7383 B14R1.14 CSCCOCCc1ccc(cc1)I 34a_100012291149_100000212216 [1,1,0,0,0,0|1,0,1]=4 7384 B14R1.14 CSCCOCCc1ccc(cc1)I 7a_100012291149_100000212216 [1,1,0,0,0,0|1,0,1]=4 7385 B14R1.14 CSCCOCCc1ccc(cc1)N 34a_100011204434_100000212216 [1,1,0,0,0,0|1,0,1]=4 7386 B14R1.14 CSCCOCCc1ccc(cc1)O 7a_100000230434_100009816426 [1,1,0,0,0,0|1,0,1]=4 7387 B14R1.14 Cc1ccc(cc1)CCOCCCBr 34a_100011217188_100011713686 [1,1,0,0,0,0|1,0,1]=4 7388 B14R1.14 Cc1ccc(cc1)CCOCCCCl 34a_100000230001_100011713686 [1,1,0,0,0,0|1,0,1]=4 7389 B14R1.14 Cc1ccc(cc1)CCOCCCF 34a_100000756670_100011934791 [1,1,0,0,0,0|1,0,1]=4 7390 B14R1.14 Cc1ccc(cc1)CCOCCCF 34a_100000759539_100011713686 [1,1,0,0,0,0|1,0,1]=4 7391 B14R1.14 Cc1ccc(cc1)CCOCCCF 7a_100000756670_100011934791 [1,1,0,0,0,0|1,0,1]=4 7392 B14R1.14 Cc1ccc(cc1)CCOCCCN 34a_100000182051_100011713686 [1,1,0,0,0,0|1,0,1]=4 7393 B14R1.14 Cc1ccc(cc1)CCOCCCO 34a_100000756670_100000230001 [1,1,0,0,0,0|1,0,1]=4 7394 B14R1.14 Cc1ccc(cc1)CCOCCCO 7a_100000756670_100011215043 [1,1,0,0,0,0|1,0,1]=4 7395 B14R1.14 ClCCCOCCc1ccc(cc1)Br 34a_100000230001_100011740612 [1,1,0,0,0,0|1,0,1]=4 7396 B14R1.14 ClCCCOCCc1ccc(cc1)Cl 34a_100000230001_100011713675 [1,1,0,0,0,0|1,0,1]=4 7397 B14R1.14 Clc1ccc(cc1)CCOCCCBr 34a_100011217188_100011713675 [1,1,0,0,0,0|1,0,1]=4 7398 B14R1.14 FCCCOCCc1ccc(cc1)Br 34a_100000759539_100011740612 [1,1,0,0,0,0|1,0,1]=4 7399 B14R1.14 FCCCOCCc1ccc(cc1)Br 34a_100000766406_100011934791 [1,1,0,0,0,0|1,0,1]=4 7400 B14R1.14 FCCCOCCc1ccc(cc1)Br 7a_100000766406_100011934791 [1,1,0,0,0,0|1,0,1]=4 7401 B14R1.14 FCCCOCCc1ccc(cc1)Cl 34a_100000759539_100011713675 [1,1,0,0,0,0|1,0,1]=4 7402 B14R1.14 FCCCOCCc1ccc(cc1)Cl 34a_100011219627_100011934791 [1,1,0,0,0,0|1,0,1]=4 7403 B14R1.14 FCCCOCCc1ccc(cc1)Cl 7a_100011219627_100011934791 [1,1,0,0,0,0|1,0,1]=4 7404 B14R1.14 FCCCOCCc1ccc(cc1)F 34a_100000754732_100011934791 [1,1,0,0,0,0|1,0,1]=4 7405 B14R1.14 FCCCOCCc1ccc(cc1)F 34a_100000759539_100011217392 [1,1,0,0,0,0|1,0,1]=4 7406 B14R1.14 FCCCOCCc1ccc(cc1)F 7a_100000754732_100011934791 [1,1,0,0,0,0|1,0,1]=4 7407 B14R1.14 FCCCOCCc1ccc(cc1)I 34a_100012291149_100011934791 [1,1,0,0,0,0|1,0,1]=4 7408 B14R1.14 FCCCOCCc1ccc(cc1)I 7a_100012291149_100011934791 [1,1,0,0,0,0|1,0,1]=4 7409 B14R1.14 Fc1ccc(cc1)CCOCCCBr 34a_100011217188_100011217392 [1,1,0,0,0,0|1,0,1]=4 7410 B14R1.14 Fc1ccc(cc1)CCOCCCCl 34a_100000230001_100011217392 [1,1,0,0,0,0|1,0,1]=4 7411 B14R1.14 NCCCOCCc1ccc(cc1)Br 34a_100000182051_100011740612 [1,1,0,0,0,0|1,0,1]=4 7412 B14R1.14 NCCCOCCc1ccc(cc1)Cl 34a_100000182051_100011713675 [1,1,0,0,0,0|1,0,1]=4 7413 B14R1.14 NCCCOCCc1ccc(cc1)F 34a_100000182051_100011217392 [1,1,0,0,0,0|1,0,1]=4 7414 B14R1.14 Nc1ccc(cc1)CCOCCCF 34a_100011204434_100011934791 [1,1,0,0,0,0|1,0,1]=4 7415 B14R1.14 Nc1ccc(cc1)CCOCCCO 34a_100011204434_100000230001 [1,1,0,0,0,0|1,0,1]=4 7416 B14R1.14 OCCCOCCc1ccc(cc1)Br 34a_100000766406_100000230001 [1,1,0,0,0,0|1,0,1]=4 7417 B14R1.14 OCCCOCCc1ccc(cc1)Br 7a_100000766406_100011215043 [1,1,0,0,0,0|1,0,1]=4 7418 B14R1.14 OCCCOCCc1ccc(cc1)Cl 34a_100011219627_100000230001 [1,1,0,0,0,0|1,0,1]=4 7419 B14R1.14 OCCCOCCc1ccc(cc1)Cl 7a_100011219627_100011215043 [1,1,0,0,0,0|1,0,1]=4 7420 B14R1.14 OCCCOCCc1ccc(cc1)F 34a_100000754732_100000230001 [1,1,0,0,0,0|1,0,1]=4 7421 B14R1.14 OCCCOCCc1ccc(cc1)F 7a_100000754732_100011215043 [1,1,0,0,0,0|1,0,1]=4 7422 B14R1.14 OCCCOCCc1ccc(cc1)I 34a_100012291149_100000230001 [1,1,0,0,0,0|1,0,1]=4 7423 B14R1.14 OCCCOCCc1ccc(cc1)I 7a_100012291149_100011215043 [1,1,0,0,0,0|1,0,1]=4 7424 B14R1.26 BrCCCOCCc1cccc(c1)Br 34a_100011217188_100011740638 [1,1,0,0,0,0|1,0,1]=4 7425 B14R1.26 CCCCCC=Cc1cccc(c1)Br 271570a_100000062253_100000691529 [1,1,0,0,0,0|1,0,1]=4 7426 B14R1.26 CCCCCC=Cc1cccc(c1)C 271570a_100000062253_100011215228 [1,1,0,0,0,0|1,0,1]=4 7427 B14R1.26 CCCCCC=Cc1cccc(c1)Cl 271570a_100000062253_100000699651 [1,1,0,0,0,0|1,0,1]=4 7428 B14R1.26 CCCCCC=Cc1cccc(c1)F 271570a_100000062253_100000685547 [1,1,0,0,0,0|1,0,1]=4 7429 B14R1.26 CCCCCC=Cc1cccc(c1)N 271570a_100000062253_100000210019 [1,1,0,0,0,0|1,0,1]=4 7430 B14R1.26 CCCCCC=Cc1cccc(c1)O 271570a_100000062253_100000211634 [1,1,0,0,0,0|1,0,1]=4 7431 B14R1.26 CCCCCC=Cc1cccc(c1)[S] 271570a_100000062253_114929384022 [1,1,0,0,0,0|1,0,1]=4 7432 B14R1.26 CCCCCNCc1cccc(c1)Br 207a_100000209983_100000210085 [1,1,0,0,0,0|2,0,0]=4 7433 B14R1.26 CCCCCNCc1cccc(c1)Br 2230a_100000174977_100000210326 [1,1,0,0,0,0|2,0,0]=4 7434 B14R1.26 CCCCCNCc1cccc(c1)Br 2230a_100000209983_100000698116 [1,1,0,0,0,0|2,0,0]=4 7435 B14R1.26 CCCCCNCc1cccc(c1)Br 270004a_100000209983_100000210085 [1,1,0,0,0,0|2,0,0]=4 7436 B14R1.26 CCCCCNCc1cccc(c1)Br 34a_100000174977_100000718602 [1,1,0,0,0,0|2,0,0]=4 7437 B14R1.26 CCCCCNCc1cccc(c1)C 207a_100000209983_100000211157 [1,1,0,0,0,0|2,0,0]=4 7438 B14R1.26 CCCCCNCc1cccc(c1)C 2230a_100000185548_100000210326 [1,1,0,0,0,0|2,0,0]=4 7439 B14R1.26 CCCCCNCc1cccc(c1)C 2230a_100000209983_100000211840 [1,1,0,0,0,0|2,0,0]=4 7440 B14R1.26 CCCCCNCc1cccc(c1)C 270004a_100000209983_100000211157 [1,1,0,0,0,0|2,0,0]=4 7441 B14R1.26 CCCCCNCc1cccc(c1)C 34a_100000185548_100000718602 [1,1,0,0,0,0|2,0,0]=4 7442 B14R1.26 CCCCCNCc1cccc(c1)Cl 207a_100000209983_100000210801 [1,1,0,0,0,0|2,0,0]=4 7443 B14R1.26 CCCCCNCc1cccc(c1)Cl 2230a_100000174878_100000210326 [1,1,0,0,0,0|2,0,0]=4 7444 B14R1.26 CCCCCNCc1cccc(c1)Cl 2230a_100000209983_100000181238 [1,1,0,0,0,0|2,0,0]=4 7445 B14R1.26 CCCCCNCc1cccc(c1)Cl 270004a_100000209983_100000210801 [1,1,0,0,0,0|2,0,0]=4 7446 B14R1.26 CCCCCNCc1cccc(c1)Cl 34a_100000174878_100000718602 [1,1,0,0,0,0|2,0,0]=4 7447 B14R1.26 CCCCCNCc1cccc(c1)F 207a_100000209983_100000210812 [1,1,0,0,0,0|2,0,0]=4 7448 B14R1.26 CCCCCNCc1cccc(c1)F 2230a_100000174948_100000210326 [1,1,0,0,0,0|2,0,0]=4 7449 B14R1.26 CCCCCNCc1cccc(c1)F 2230a_100000209983_100000230114 [1,1,0,0,0,0|2,0,0]=4 7450 B14R1.26 CCCCCNCc1cccc(c1)F 270004a_100000209983_100000210812 [1,1,0,0,0,0|2,0,0]=4 7451 B14R1.26 CCCCCNCc1cccc(c1)F 34a_100000174948_100000718602 [1,1,0,0,0,0|2,0,0]=4 7452 B14R1.26 CCCCCNCc1cccc(c1)I 207a_100000209983_100000014684 [1,1,0,0,0,0|2,0,0]=4 7453 B14R1.26 CCCCCNCc1cccc(c1)I 2230a_100000106179_100000210326 [1,1,0,0,0,0|2,0,0]=4 7454 B14R1.26 CCCCCNCc1cccc(c1)I 2230a_100000209983_100011218688 [1,1,0,0,0,0|2,0,0]=4 7455 B14R1.26 CCCCCNCc1cccc(c1)I 270004a_100000209983_100000014684 [1,1,0,0,0,0|2,0,0]=4 7456 B14R1.26 CCCCCNCc1cccc(c1)I 34a_100000106179_100000718602 [1,1,0,0,0,0|2,0,0]=4 7457 B14R1.26 CCCCCNCc1cccc(c1)O 207a_100000209983_100000188321 [1,1,0,0,0,0|2,0,0]=4 7458 B14R1.26 CCCCCNCc1cccc(c1)O 2230a_100000209983_100011660834 [1,1,0,0,0,0|2,0,0]=4 7459 B14R1.26 CCCCCNCc1cccc(c1)O 2230a_100000743036_100000210326 [1,1,0,0,0,0|2,0,0]=4 7460 B14R1.26 CCCCCNCc1cccc(c1)O 270004a_100000209983_100000188321 [1,1,0,0,0,0|2,0,0]=4 7461 B14R1.26 CCCCCNCc1cccc(c1)O 34a_100000743036_100000718602 [1,1,0,0,0,0|2,0,0]=4 7462 B14R1.26 CCCCCOCc1cccc(c1)Br 34a_100000210253_100000698116 [1,1,0,0,0,0|2,0,0]=4 7463 B14R1.26 CCCCCOCc1cccc(c1)Br 34a_100000687537_100000718602 [1,1,0,0,0,0|2,0,0]=4 7464 B14R1.26 CCCCCOCc1cccc(c1)Br 7a_100000210253_100000211773 [1,1,0,0,0,0|2,0,0]=4 7465 B14R1.26 CCCCCOCc1cccc(c1)Br 7a_100000687537_100000210326 [1,1,0,0,0,0|2,0,0]=4 7466 B14R1.26 CCCCCOCc1cccc(c1)C 34a_100000210253_100000211840 [1,1,0,0,0,0|2,0,0]=4 7467 B14R1.26 CCCCCOCc1cccc(c1)C 34a_100011217746_100000718602 [1,1,0,0,0,0|2,0,0]=4 7468 B14R1.26 CCCCCOCc1cccc(c1)C 7a_100000210253_100000211840 [1,1,0,0,0,0|2,0,0]=4 7469 B14R1.26 CCCCCOCc1cccc(c1)C 7a_100011217746_100000210326 [1,1,0,0,0,0|2,0,0]=4 7470 B14R1.26 CCCCCOCc1cccc(c1)Cl 34a_100000210253_100000187163 [1,1,0,0,0,0|2,0,0]=4 7471 B14R1.26 CCCCCOCc1cccc(c1)Cl 34a_100000241301_100000718602 [1,1,0,0,0,0|2,0,0]=4 7472 B14R1.26 CCCCCOCc1cccc(c1)Cl 7a_100000210253_100000187163 [1,1,0,0,0,0|2,0,0]=4 7473 B14R1.26 CCCCCOCc1cccc(c1)Cl 7a_100000241301_100000210326 [1,1,0,0,0,0|2,0,0]=4 7474 B14R1.26 CCCCCOCc1cccc(c1)F 34a_100000210253_100000187166 [1,1,0,0,0,0|2,0,0]=4 7475 B14R1.26 CCCCCOCc1cccc(c1)F 34a_100000210976_100000718602 [1,1,0,0,0,0|2,0,0]=4 7476 B14R1.26 CCCCCOCc1cccc(c1)F 7a_100000210253_100000230114 [1,1,0,0,0,0|2,0,0]=4 7477 B14R1.26 CCCCCOCc1cccc(c1)F 7a_100000210976_100000210326 [1,1,0,0,0,0|2,0,0]=4 7478 B14R1.26 CCCCCOCc1cccc(c1)I 34a_100000210253_100011218688 [1,1,0,0,0,0|2,0,0]=4 7479 B14R1.26 CCCCCOCc1cccc(c1)I 34a_100011215336_100000718602 [1,1,0,0,0,0|2,0,0]=4 7480 B14R1.26 CCCCCOCc1cccc(c1)I 7a_100000210253_100011218688 [1,1,0,0,0,0|2,0,0]=4 7481 B14R1.26 CCCCCOCc1cccc(c1)I 7a_100011215336_100000210326 [1,1,0,0,0,0|2,0,0]=4 7482 B14R1.26 CCCCCOCc1cccc(c1)N 34a_100000211919_100000718602 [1,1,0,0,0,0|2,0,0]=4 7483 B14R1.26 CCCCCOCc1cccc(c1)O 34a_100000210253_100011660834 [1,1,0,0,0,0|2,0,0]=4 7484 B14R1.26 CCCCCOCc1cccc(c1)O 7a_100000210253_100000084143 [1,1,0,0,0,0|2,0,0]=4 7485 B14R1.26 CCCCCSCc1cccc(c1)Br 62a_100000210326_100000211773 [1,1,0,0,0,0|2,0,0]=4 7486 B14R1.26 CCCCCSCc1cccc(c1)Br 62a_100000211773_100000210326 [1,1,0,0,0,0|2,0,0]=4 7487 B14R1.26 CCCCCSCc1cccc(c1)C 62a_100000210326_100000211840 [1,1,0,0,0,0|2,0,0]=4 7488 B14R1.26 CCCCCSCc1cccc(c1)C 62a_100000211840_100000210326 [1,1,0,0,0,0|2,0,0]=4 7489 B14R1.26 CCCCCSCc1cccc(c1)Cl 62a_100000187163_100000210326 [1,1,0,0,0,0|2,0,0]=4 7490 B14R1.26 CCCCCSCc1cccc(c1)Cl 62a_100000210326_100000187163 [1,1,0,0,0,0|2,0,0]=4 7491 B14R1.26 CCCCCSCc1cccc(c1)F 62a_100000210326_100000230114 [1,1,0,0,0,0|2,0,0]=4 7492 B14R1.26 CCCCCSCc1cccc(c1)F 62a_100000230114_100000210326 [1,1,0,0,0,0|2,0,0]=4 7493 B14R1.26 CCCCCSCc1cccc(c1)I 62a_100000210326_100011218688 [1,1,0,0,0,0|2,0,0]=4 7494 B14R1.26 CCCCCSCc1cccc(c1)I 62a_100011218688_100000210326 [1,1,0,0,0,0|2,0,0]=4 7495 B14R1.26 CCCCCSCc1cccc(c1)O 62a_100000210326_100011660834 [1,1,0,0,0,0|2,0,0]=4 7496 B14R1.26 CCCCCSCc1cccc(c1)O 62a_100011660834_100000210326 [1,1,0,0,0,0|2,0,0]=4 7497 B14R1.26 CCCCNCCc1cccc(c1)Br 2230a_100000102301_100011740638 [1,1,0,0,0,0|1,0,1]=4 7498 B14R1.26 CCCCNCCc1cccc(c1)Br 2230a_100011207229_100000210211 [1,1,0,0,0,0|1,0,1]=4 7499 B14R1.26 CCCCNCCc1cccc(c1)Br 34a_100011207229_100000210210 [1,1,0,0,0,0|1,0,1]=4 7500 B14R1.26 CCCCNCCc1cccc(c1)Br 7a_106832991798_100011740638 [1,1,0,0,0,0|1,0,1]=4 7501 B14R1.26 CCCCNCCc1cccc(c1)C 2230a_100000102301_100011713685 [1,1,0,0,0,0|1,0,1]=4 7502 B14R1.26 CCCCNCCc1cccc(c1)C 2230a_100000749837_100000210211 [1,1,0,0,0,0|1,0,1]=4 7503 B14R1.26 CCCCNCCc1cccc(c1)C 34a_100000749837_100000210210 [1,1,0,0,0,0|1,0,1]=4 7504 B14R1.26 CCCCNCCc1cccc(c1)C 7a_106832991798_100011713685 [1,1,0,0,0,0|1,0,1]=4 7505 B14R1.26 CCCCNCCc1cccc(c1)Cl 2230a_100000102301_100011713710 [1,1,0,0,0,0|1,0,1]=4 7506 B14R1.26 CCCCNCCc1cccc(c1)Cl 2230a_100000185263_100000210211 [1,1,0,0,0,0|1,0,1]=4 7507 B14R1.26 CCCCNCCc1cccc(c1)Cl 34a_100000185263_100000210210 [1,1,0,0,0,0|1,0,1]=4 7508 B14R1.26 CCCCNCCc1cccc(c1)Cl 7a_106832991798_100011713710 [1,1,0,0,0,0|1,0,1]=4 7509 B14R1.26 CCCCNCCc1cccc(c1)F 2230a_100000102301_100011217235 [1,1,0,0,0,0|1,0,1]=4 7510 B14R1.26 CCCCNCCc1cccc(c1)F 2230a_100000205154_100000210211 [1,1,0,0,0,0|1,0,1]=4 7511 B14R1.26 CCCCNCCc1cccc(c1)F 34a_100000205154_100000210210 [1,1,0,0,0,0|1,0,1]=4 7512 B14R1.26 CCCCNCCc1cccc(c1)F 7a_106832991798_100011217235 [1,1,0,0,0,0|1,0,1]=4 7513 B14R1.26 CCCCNCCc1cccc(c1)O 2230a_100000747277_100000210211 [1,1,0,0,0,0|1,0,1]=4 7514 B14R1.26 CCCCNCCc1cccc(c1)O 34a_100000747277_100000210210 [1,1,0,0,0,0|1,0,1]=4 7515 B14R1.26 CCCCOCCc1cccc(c1)Br 34a_100000210227_100011740638 [1,1,0,0,0,0|0,0,1]=3 7516 B14R1.26 CCCCOCCc1cccc(c1)Br 34a_100011217444_100000210210 [1,1,0,0,0,0|0,0,1]=3 7517 B14R1.26 CCCCOCCc1cccc(c1)Br 7a_100000210227_100011740638 [1,1,0,0,0,0|0,0,1]=3 7518 B14R1.26 CCCCOCCc1cccc(c1)Br 7a_100011217444_100000210211 [1,1,0,0,0,0|0,0,1]=3 7519 B14R1.26 CCCCOCCc1cccc(c1)C 34a_100000210227_100011713685 [1,1,0,0,0,0|0,0,1]=3 7520 B14R1.26 CCCCOCCc1cccc(c1)C 34a_100011217157_100000210210 [1,1,0,0,0,0|0,0,1]=3 7521 B14R1.26 CCCCOCCc1cccc(c1)C 7a_100000210227_100011713685 [1,1,0,0,0,0|0,0,1]=3 7522 B14R1.26 CCCCOCCc1cccc(c1)C 7a_100011217157_100000210211 [1,1,0,0,0,0|0,0,1]=3 7523 B14R1.26 CCCCOCCc1cccc(c1)Cl 34a_100000210227_100011713710 [1,1,0,0,0,0|0,0,1]=3 7524 B14R1.26 CCCCOCCc1cccc(c1)Cl 34a_100000754733_100000210210 [1,1,0,0,0,0|0,0,1]=3 7525 B14R1.26 CCCCOCCc1cccc(c1)Cl 7a_100000210227_100011713710 [1,1,0,0,0,0|0,0,1]=3 7526 B14R1.26 CCCCOCCc1cccc(c1)Cl 7a_100000754733_100000210211 [1,1,0,0,0,0|0,0,1]=3 7527 B14R1.26 CCCCOCCc1cccc(c1)F 34a_100000210227_100011217235 [1,1,0,0,0,0|0,0,1]=3 7528 B14R1.26 CCCCOCCc1cccc(c1)F 34a_100000763591_100000210210 [1,1,0,0,0,0|0,0,1]=3 7529 B14R1.26 CCCCOCCc1cccc(c1)F 7a_100000210227_100011217235 [1,1,0,0,0,0|0,0,1]=3 7530 B14R1.26 CCCCOCCc1cccc(c1)F 7a_100000763591_100000210211 [1,1,0,0,0,0|0,0,1]=3 7531 B14R1.26 CCCCOCCc1cccc(c1)N 34a_100011996697_100000210210 [1,1,0,0,0,0|0,0,1]=3 7532 B14R1.26 CCCCOCCc1cccc(n1)Br 34a_100010221043_100000210210 [1,1,0,0,0,0|1,0,1]=4 7533 B14R1.26 CCCCOCCc1cccc(n1)Br 7a_100010221043_100000210211 [1,1,0,0,0,0|1,0,1]=4 7534 B14R1.26 CCCCOCNc1cccc(c1)Br 34a_100000210019_100011995733 [1,1,0,0,0,0|1,0,1]=4 7535 B14R1.26 CCCCOCNc1cccc(c1)C 2230a_100000188690_100011995733 [1,1,0,0,0,0|1,0,1]=4 7536 B14R1.26 CCCCOCNc1cccc(c1)C 34a_100000188690_100011995733 [1,1,0,0,0,0|1,0,1]=4 7537 B14R1.26 CCCCOCNc1cccc(c1)Cl 34a_100000185859_100011995733 [1,1,0,0,0,0|1,0,1]=4 7538 B14R1.26 CCCCOCNc1cccc(c1)F 34a_100000210047_100011995733 [1,1,0,0,0,0|1,0,1]=4 7539 B14R1.26 CCCCOCNc1cccc(c1)I 34a_100000211102_100011995733 [1,1,0,0,0,0|1,0,1]=4 7540 B14R1.26 CCCCOCNc1cccc(c1)O 34a_100000210217_100011995733 [1,1,0,0,0,0|1,0,1]=4 7541 B14R1.26 CCCCOCOc1cccc(c1)Br 34a_100000210342_100011995733 [1,1,0,0,0,0|1,0,1]=4 7542 B14R1.26 CCCCOCOc1cccc(c1)C 34a_100000210337_100011995733 [1,1,0,0,0,0|1,0,1]=4 7543 B14R1.26 CCCCOCOc1cccc(c1)Cl 34a_100000210295_100011995733 [1,1,0,0,0,0|1,0,1]=4 7544 B14R1.26 CCCCOCOc1cccc(c1)F 34a_100000210426_100011995733 [1,1,0,0,0,0|1,0,1]=4 7545 B14R1.26 CCCCOCOc1cccc(c1)I 34a_100000211634_100011995733 [1,1,0,0,0,0|1,0,1]=4 7546 B14R1.26 CCCCOCOc1cccc(c1)N 34a_100000210217_100011995733 [1,1,0,0,0,0|1,0,1]=4 7547 B14R1.26 CCCCOCSc1cccc(c1)Br 62a_100000691529_100011995733 [1,1,0,0,0,0|1,0,1]=4 7548 B14R1.26 CCCCOCSc1cccc(c1)Br 62a_100011995733_100000691529 [1,1,0,0,0,0|1,0,1]=4 7549 B14R1.26 CCCCOCSc1cccc(c1)C 62a_100011215228_100011995733 [1,1,0,0,0,0|1,0,1]=4 7550 B14R1.26 CCCCOCSc1cccc(c1)C 62a_100011995733_100011215228 [1,1,0,0,0,0|1,0,1]=4 7551 B14R1.26 CCCCOCSc1cccc(c1)Cl 62a_100000699651_100011995733 [1,1,0,0,0,0|1,0,1]=4 7552 B14R1.26 CCCCOCSc1cccc(c1)Cl 62a_100011995733_100000699651 [1,1,0,0,0,0|1,0,1]=4 7553 B14R1.26 CCCCOCSc1cccc(c1)F 62a_100000685547_100011995733 [1,1,0,0,0,0|1,0,1]=4 7554 B14R1.26 CCCCOCSc1cccc(c1)F 62a_100011995733_100000685547 [1,1,0,0,0,0|1,0,1]=4 7555 B14R1.26 CCCCOCSc1cccc(c1)N 62a_100000210019_100011995733 [1,1,0,0,0,0|1,0,1]=4 7556 B14R1.26 CCCCOCSc1cccc(c1)N 62a_100011995733_100000210019 [1,1,0,0,0,0|1,0,1]=4 7557 B14R1.26 CCCCOCSc1cccc(c1)O 62a_100011995733_100000211634 [1,1,0,0,0,0|1,0,1]=4 7558 B14R1.26 CCCCOCSc1cccc(c1)[S] 62a_100011995733_114929384022 [1,1,0,0,0,0|1,0,1]=4 7559 B14R1.26 CCCCOCSc1cccc(c1)[S] 62a_114929384022_100011995733 [1,1,0,0,0,0|1,0,1]=4 7560 B14R1.26 CCCCSCCc1cccc(c1)Br 62a_100000210211_100011740638 [1,1,0,0,0,0|0,1,1]=4 7561 B14R1.26 CCCCSCCc1cccc(c1)Br 62a_100011740638_100000210210 [1,1,0,0,0,0|0,1,1]=4 7562 B14R1.26 CCCCSCCc1cccc(c1)C 62a_100000210211_100011713685 [1,1,0,0,0,0|0,1,1]=4 7563 B14R1.26 CCCCSCCc1cccc(c1)C 62a_100011713685_100000210210 [1,1,0,0,0,0|0,1,1]=4 7564 B14R1.26 CCCCSCCc1cccc(c1)Cl 62a_100000210211_100011713710 [1,1,0,0,0,0|0,1,1]=4 7565 B14R1.26 CCCCSCCc1cccc(c1)Cl 62a_100011713710_100000210210 [1,1,0,0,0,0|0,1,1]=4 7566 B14R1.26 CCCCSCCc1cccc(c1)F 62a_100000210211_100011217235 [1,1,0,0,0,0|0,1,1]=4 7567 B14R1.26 CCCCSCCc1cccc(c1)F 62a_100011217235_100000210210 [1,1,0,0,0,0|0,1,1]=4 7568 B14R1.26 CCCNN=CCc1cccc(c1)Br 4a_100000740057_200000698211 [1,1,0,0,0,0|2,0,0]=4 7569 B14R1.26 CCCNN=CCc1cccc(c1)Cl 4a_100000740057_100000765889 [1,1,0,0,0,0|2,0,0]=4 7570 B14R1.26 CCCNN=CCc1cccc(c1)F 4a_100000740057_100011713417 [1,1,0,0,0,0|2,0,0]=4 7571 B14R1.26 COCCOCCc1cccc(c1)Br 34a_100000210237_100011740638 [1,1,0,0,0,0|1,0,1]=4 7572 B14R1.26 COCCOCCc1cccc(c1)Br 34a_100011217444_100011201679 [1,1,0,0,0,0|1,0,1]=4 7573 B14R1.26 COCCOCCc1cccc(c1)Br 7a_100011217444_100000233755 [1,1,0,0,0,0|1,0,1]=4 7574 B14R1.26 COCCOCCc1cccc(c1)C 34a_100000210237_100011713685 [1,1,0,0,0,0|1,0,1]=4 7575 B14R1.26 COCCOCCc1cccc(c1)C 34a_100011217157_100011201679 [1,1,0,0,0,0|1,0,1]=4 7576 B14R1.26 COCCOCCc1cccc(c1)C 7a_100011217157_100000233755 [1,1,0,0,0,0|1,0,1]=4 7577 B14R1.26 COCCOCCc1cccc(c1)Cl 34a_100000210237_100011713710 [1,1,0,0,0,0|1,0,1]=4 7578 B14R1.26 COCCOCCc1cccc(c1)Cl 34a_100000754733_100011201679 [1,1,0,0,0,0|1,0,1]=4 7579 B14R1.26 COCCOCCc1cccc(c1)Cl 7a_100000754733_100000233755 [1,1,0,0,0,0|1,0,1]=4 7580 B14R1.26 COCCOCCc1cccc(c1)F 34a_100000210237_100011217235 [1,1,0,0,0,0|1,0,1]=4 7581 B14R1.26 COCCOCCc1cccc(c1)F 34a_100000763591_100011201679 [1,1,0,0,0,0|1,0,1]=4 7582 B14R1.26 COCCOCCc1cccc(c1)F 7a_100000763591_100000233755 [1,1,0,0,0,0|1,0,1]=4 7583 B14R1.26 COCCOCCc1cccc(c1)N 34a_100011996697_100011201679 [1,1,0,0,0,0|1,0,1]=4 7584 B14R1.26 CSCCOCCc1cccc(c1)Br 34a_100000230434_100011740638 [1,1,0,0,0,0|1,0,1]=4 7585 B14R1.26 CSCCOCCc1cccc(c1)Br 34a_100011217444_100000212216 [1,1,0,0,0,0|1,0,1]=4 7586 B14R1.26 CSCCOCCc1cccc(c1)Br 7a_100000230434_100011740638 [1,1,0,0,0,0|1,0,1]=4 7587 B14R1.26 CSCCOCCc1cccc(c1)Br 7a_100011217444_100000212216 [1,1,0,0,0,0|1,0,1]=4 7588 B14R1.26 CSCCOCCc1cccc(c1)C 34a_100000230434_100011713685 [1,1,0,0,0,0|1,0,1]=4 7589 B14R1.26 CSCCOCCc1cccc(c1)C 34a_100011217157_100000212216 [1,1,0,0,0,0|1,0,1]=4 7590 B14R1.26 CSCCOCCc1cccc(c1)C 7a_100000230434_100011713685 [1,1,0,0,0,0|1,0,1]=4 7591 B14R1.26 CSCCOCCc1cccc(c1)C 7a_100011217157_100000212216 [1,1,0,0,0,0|1,0,1]=4 7592 B14R1.26 CSCCOCCc1cccc(c1)Cl 34a_100000230434_100011713710 [1,1,0,0,0,0|1,0,1]=4 7593 B14R1.26 CSCCOCCc1cccc(c1)Cl 34a_100000754733_100000212216 [1,1,0,0,0,0|1,0,1]=4 7594 B14R1.26 CSCCOCCc1cccc(c1)Cl 7a_100000230434_100011713710 [1,1,0,0,0,0|1,0,1]=4 7595 B14R1.26 CSCCOCCc1cccc(c1)Cl 7a_100000754733_100000212216 [1,1,0,0,0,0|1,0,1]=4 7596 B14R1.26 CSCCOCCc1cccc(c1)F 34a_100000230434_100011217235 [1,1,0,0,0,0|1,0,1]=4 7597 B14R1.26 CSCCOCCc1cccc(c1)F 34a_100000763591_100000212216 [1,1,0,0,0,0|1,0,1]=4 7598 B14R1.26 CSCCOCCc1cccc(c1)F 7a_100000230434_100011217235 [1,1,0,0,0,0|1,0,1]=4 7599 B14R1.26 CSCCOCCc1cccc(c1)F 7a_100000763591_100000212216 [1,1,0,0,0,0|1,0,1]=4 7600 B14R1.26 CSCCOCCc1cccc(c1)N 34a_100011996697_100000212216 [1,1,0,0,0,0|1,0,1]=4 7601 B14R1.26 Cc1cccc(c1)CCOCCCBr 34a_100011217188_100011713685 [1,1,0,0,0,0|1,0,1]=4 7602 B14R1.26 Cc1cccc(c1)CCOCCCCl 34a_100000230001_100011713685 [1,1,0,0,0,0|1,0,1]=4 7603 B14R1.26 Cc1cccc(c1)CCOCCCF 34a_100000759539_100011713685 [1,1,0,0,0,0|1,0,1]=4 7604 B14R1.26 Cc1cccc(c1)CCOCCCF 34a_100011217157_100011934791 [1,1,0,0,0,0|1,0,1]=4 7605 B14R1.26 Cc1cccc(c1)CCOCCCF 7a_100011217157_100011934791 [1,1,0,0,0,0|1,0,1]=4 7606 B14R1.26 Cc1cccc(c1)CCOCCCN 34a_100000182051_100011713685 [1,1,0,0,0,0|1,0,1]=4 7607 B14R1.26 Cc1cccc(c1)CCOCCCO 34a_100011217157_100000230001 [1,1,0,0,0,0|1,0,1]=4 7608 B14R1.26 Cc1cccc(c1)CCOCCCO 7a_100011217157_100011215043 [1,1,0,0,0,0|1,0,1]=4 7609 B14R1.26 ClCCCOCCc1cccc(c1)Br 34a_100000230001_100011740638 [1,1,0,0,0,0|1,0,1]=4 7610 B14R1.26 ClCCCOCCc1cccc(c1)Cl 34a_100000230001_100011713710 [1,1,0,0,0,0|1,0,1]=4 7611 B14R1.26 Clc1cccc(c1)CCOCCCBr 34a_100011217188_100011713710 [1,1,0,0,0,0|1,0,1]=4 7612 B14R1.26 FCCCOCCc1cccc(c1)Br 34a_100000759539_100011740638 [1,1,0,0,0,0|1,0,1]=4 7613 B14R1.26 FCCCOCCc1cccc(c1)Br 34a_100011217444_100011934791 [1,1,0,0,0,0|1,0,1]=4 7614 B14R1.26 FCCCOCCc1cccc(c1)Br 7a_100011217444_100011934791 [1,1,0,0,0,0|1,0,1]=4 7615 B14R1.26 FCCCOCCc1cccc(c1)Cl 34a_100000754733_100011934791 [1,1,0,0,0,0|1,0,1]=4 7616 B14R1.26 FCCCOCCc1cccc(c1)Cl 34a_100000759539_100011713710 [1,1,0,0,0,0|1,0,1]=4 7617 B14R1.26 FCCCOCCc1cccc(c1)Cl 7a_100000754733_100011934791 [1,1,0,0,0,0|1,0,1]=4 7618 B14R1.26 FCCCOCCc1cccc(c1)F 34a_100000759539_100011217235 [1,1,0,0,0,0|1,0,1]=4 7619 B14R1.26 FCCCOCCc1cccc(c1)F 34a_100000763591_100011934791 [1,1,0,0,0,0|1,0,1]=4 7620 B14R1.26 FCCCOCCc1cccc(c1)F 7a_100000763591_100011934791 [1,1,0,0,0,0|1,0,1]=4 7621 B14R1.26 Fc1cccc(c1)CCOCCCBr 34a_100011217188_100011217235 [1,1,0,0,0,0|1,0,1]=4 7622 B14R1.26 Fc1cccc(c1)CCOCCCCl 34a_100000230001_100011217235 [1,1,0,0,0,0|1,0,1]=4 7623 B14R1.26 NCCCOCCc1cccc(c1)Br 34a_100000182051_100011740638 [1,1,0,0,0,0|1,0,1]=4 7624 B14R1.26 NCCCOCCc1cccc(c1)Cl 34a_100000182051_100011713710 [1,1,0,0,0,0|1,0,1]=4 7625 B14R1.26 NCCCOCCc1cccc(c1)F 34a_100000182051_100011217235 [1,1,0,0,0,0|1,0,1]=4 7626 B14R1.26 Nc1cccc(c1)CCOCCCF 34a_100011996697_100011934791 [1,1,0,0,0,0|1,0,1]=4 7627 B14R1.26 Nc1cccc(c1)CCOCCCO 34a_100011996697_100000230001 [1,1,0,0,0,0|1,0,1]=4 7628 B14R1.26 OCCCOCCc1cccc(c1)Br 34a_100011217444_100000230001 [1,1,0,0,0,0|1,0,1]=4 7629 B14R1.26 OCCCOCCc1cccc(c1)Br 7a_100011217444_100011215043 [1,1,0,0,0,0|1,0,1]=4 7630 B14R1.26 OCCCOCCc1cccc(c1)Cl 34a_100000754733_100000230001 [1,1,0,0,0,0|1,0,1]=4 7631 B14R1.26 OCCCOCCc1cccc(c1)Cl 7a_100000754733_100011215043 [1,1,0,0,0,0|1,0,1]=4 7632 B14R1.26 OCCCOCCc1cccc(c1)F 34a_100000763591_100000230001 [1,1,0,0,0,0|1,0,1]=4 7633 B14R1.26 OCCCOCCc1cccc(c1)F 7a_100000763591_100011215043 [1,1,0,0,0,0|1,0,1]=4 7634 B14R1.38 CC(COCCCBr)c1ccccc1 34a_100011217188_100000756946 [1,1,0,0,0,0|1,0,1]=4 7635 B14R1.38 CC(COCCCCl)c1ccccc1 34a_100000230001_100000756946 [1,1,0,0,0,0|1,0,1]=4 7636 B14R1.38 CC(COCCCF)c1ccccc1 34a_100000759539_100000756946 [1,1,0,0,0,0|1,0,1]=4 7637 B14R1.38 CC(COCCCF)c1ccccc1 34a_100011215166_100011934791 [1,1,0,0,0,0|1,0,1]=4 7638 B14R1.38 CC(COCCCF)c1ccccc1 7a_100011215166_100011934791 [1,1,0,0,0,0|1,0,1]=4 7639 B14R1.38 CC(COCCCN)c1ccccc1 34a_100000182051_100000756946 [1,1,0,0,0,0|1,0,1]=4 7640 B14R1.38 CC(COCCCO)c1ccccc1 34a_100011215166_100000230001 [1,1,0,0,0,0|1,0,1]=4 7641 B14R1.38 CC(COCCCO)c1ccccc1 7a_100011215166_100011215043 [1,1,0,0,0,0|1,0,1]=4 7642 B14R1.38 CCCCCNC(C)c1ccccc1 2230a_100000209983_100000230085 [1,1,0,0,0,0|2,0,0]=4 7643 B14R1.38 CCCCCNC(C)c1ccccc1 269862a_100000209983_100000185851 [1,1,0,0,0,0|2,0,0]=4 7644 B14R1.38 CCCCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210326 [1,1,0,0,0,0|2,0,0]=4 7645 B14R1.38 CCCCCOC(C)c1ccccc1 34a_100000210253_100000211855 [1,1,0,0,0,0|2,0,0]=4 7646 B14R1.38 CCCCCOC(C)c1ccccc1 7a_100000210253_100000230085 [1,1,0,0,0,0|2,0,0]=4 7647 B14R1.38 CCCCCO[C@H](C)c1ccccc1 34a_100000761318_100000718602 [1,1,0,0,0,0|2,0,0]=4 7648 B14R1.38 CCCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210326 [1,1,0,0,0,0|2,0,0]=4 7649 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000210326_100000230085 [1,1,0,0,0,0|2,0,0]=4 7650 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000230085_100000210326 [1,1,0,0,0,0|2,0,0]=4 7651 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000102301_100000756946 [1,1,0,0,0,0|1,0,1]=4 7652 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000701038_100000210211 [1,1,0,0,0,0|1,0,1]=4 7653 B14R1.38 CCCCNCC(C)c1ccccc1 270004a_100000102301_100000212034 [1,1,0,0,0,0|1,0,1]=4 7654 B14R1.38 CCCCNCC(C)c1ccccc1 34a_100000701038_100000210210 [1,1,0,0,0,0|1,0,1]=4 7655 B14R1.38 CCCCNCC(C)c1ccccc1 7a_106832991798_100000756946 [1,1,0,0,0,0|1,0,1]=4 7656 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000102301_100000185958 [1,1,0,0,0,0|1,0,1]=4 7657 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000210709_100000210211 [1,1,0,0,0,0|1,0,1]=4 7658 B14R1.38 CCCCNCC(O)c1ccccc1 7a_106832991798_100000185958 [1,1,0,0,0,0|1,0,1]=4 7659 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 2230a_100000102301_100011933945 [1,1,0,0,0,0|1,0,1]=4 7660 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 7a_106832991798_100011933945 [1,1,0,0,0,0|1,0,1]=4 7661 B14R1.38 CCCCOCC(=O)c1ccccc1 1458a_100000185807_100011995733 [1,1,0,0,0,0|0,0,2]=4 7662 B14R1.38 CCCCOCC(=O)c1ccccc1 7a_100000210227_100000211460 [1,1,0,0,0,0|0,0,2]=4 7663 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100000210227_100000756946 [1,1,0,0,0,0|0,0,1]=3 7664 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100011215166_100000210210 [1,1,0,0,0,0|0,0,1]=3 7665 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100000210227_100000756946 [1,1,0,0,0,0|0,0,1]=3 7666 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100011215166_100000210211 [1,1,0,0,0,0|0,0,1]=3 7667 B14R1.38 CCCCOCC(O)c1ccccc1 34a_100000210227_100000185958 [1,1,0,0,0,0|0,0,1]=3 7668 B14R1.38 CCCCOCC(O)c1ccccc1 7a_100000210227_100000185958 [1,1,0,0,0,0|0,0,1]=3 7669 B14R1.38 CCCCOCN(C)c1ccccc1 2230a_100000210012_100011995733 [1,1,0,0,0,0|1,0,1]=4 7670 B14R1.38 CCCCOCN(C)c1ccccc1 269982a_100000210012_100011995733 [1,1,0,0,0,0|1,0,1]=4 7671 B14R1.38 CCCCOCN(C)c1ccccc1 34a_100000210012_100011995733 [1,1,0,0,0,0|1,0,1]=4 7672 B14R1.38 CCCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210210 [1,1,0,0,0,0|0,0,1]=3 7673 B14R1.38 CCCCOC[C@@H](N)c1ccncc1 34a_100138412524_100000210210 [1,1,0,0,0,0|1,0,1]=4 7674 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 34a_100000210227_100011933945 [1,1,0,0,0,0|0,0,1]=3 7675 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 7a_100000210227_100011933945 [1,1,0,0,0,0|0,0,1]=3 7676 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000210211_100000756946 [1,1,0,0,0,0|0,1,1]=4 7677 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000756946_100000210210 [1,1,0,0,0,0|0,1,1]=4 7678 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000185958_100000210210 [1,1,0,0,0,0|0,1,1]=4 7679 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000210211_100000185958 [1,1,0,0,0,0|0,1,1]=4 7680 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100000210211_100011933945 [1,1,0,0,0,0|0,1,1]=4 7681 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100011933945_100000210210 [1,1,0,0,0,0|0,1,1]=4 7682 B14R1.38 CCCNN=CC(C)c1ccccc1 4a_100000740057_100000212034 [1,1,0,0,0,0|2,0,0]=4 7683 B14R1.38 COCCOCC(C)c1ccccc1 34a_100000210237_100000756946 [1,1,0,0,0,0|1,0,1]=4 7684 B14R1.38 COCCOCC(C)c1ccccc1 34a_100011215166_100011201679 [1,1,0,0,0,0|1,0,1]=4 7685 B14R1.38 COCCOCC(C)c1ccccc1 7a_100011215166_100000233755 [1,1,0,0,0,0|1,0,1]=4 7686 B14R1.38 COCCOCC(O)c1ccccc1 34a_100000210237_100000185958 [1,1,0,0,0,0|1,0,1]=4 7687 B14R1.38 COCCOC[C@@H](N)c1ccccc1 34a_100000751927_100011201679 [1,1,0,0,0,0|1,0,1]=4 7688 B14R1.38 COCCOC[C@@H](O)c1ccccc1 34a_100000210237_100011933945 [1,1,0,0,0,0|1,0,1]=4 7689 B14R1.38 CSCCOCC(C)c1ccccc1 34a_100000230434_100000756946 [1,1,0,0,0,0|1,0,1]=4 7690 B14R1.38 CSCCOCC(C)c1ccccc1 34a_100011215166_100000212216 [1,1,0,0,0,0|1,0,1]=4 7691 B14R1.38 CSCCOCC(C)c1ccccc1 7a_100000230434_100000756946 [1,1,0,0,0,0|1,0,1]=4 7692 B14R1.38 CSCCOCC(C)c1ccccc1 7a_100011215166_100000212216 [1,1,0,0,0,0|1,0,1]=4 7693 B14R1.38 CSCCOCC(O)c1ccccc1 34a_100000230434_100000185958 [1,1,0,0,0,0|1,0,1]=4 7694 B14R1.38 CSCCOCC(O)c1ccccc1 7a_100000230434_100000185958 [1,1,0,0,0,0|1,0,1]=4 7695 B14R1.38 CSCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000212216 [1,1,0,0,0,0|1,0,1]=4 7696 B14R1.38 CSCCOC[C@@H](O)c1ccccc1 34a_100000230434_100011933945 [1,1,0,0,0,0|1,0,1]=4 7697 B14R1.38 CSCCOC[C@@H](O)c1ccccc1 7a_100000230434_100011933945 [1,1,0,0,0,0|1,0,1]=4 7698 B14R1.38 NCCCOCC(O)c1ccccc1 34a_100000182051_100000185958 [1,1,0,0,0,0|1,0,1]=4 7699 B14R1.38 NCCCOC[C@@H](O)c1ccccc1 34a_100000182051_100011933945 [1,1,0,0,0,0|1,0,1]=4 7700 B14R1.38 N[C@H](COCCCF)c1ccccc1 34a_100000751927_100011934791 [1,1,0,0,0,0|1,0,1]=4 7701 B14R1.38 N[C@H](COCCCO)c1ccccc1 34a_100000751927_100000230001 [1,1,0,0,0,0|1,0,1]=4 7702 B14R1.38 OC(COCCCBr)c1ccccc1 34a_100011217188_100000185958 [1,1,0,0,0,0|1,0,1]=4 7703 B14R1.38 OC(COCCCCl)c1ccccc1 34a_100000230001_100000185958 [1,1,0,0,0,0|1,0,1]=4 7704 B14R1.38 OC(COCCCF)c1ccccc1 34a_100000759539_100000185958 [1,1,0,0,0,0|1,0,1]=4 7705 B14R1.38 O[C@H](COCCCBr)c1ccccc1 34a_100011217188_100011933945 [1,1,0,0,0,0|1,0,1]=4 7706 B14R1.38 O[C@H](COCCCCl)c1ccccc1 34a_100000230001_100011933945 [1,1,0,0,0,0|1,0,1]=4 7707 B14R1.38 O[C@H](COCCCF)c1ccccc1 34a_100000759539_100011933945 [1,1,0,0,0,0|1,0,1]=4 7708 B14R1.123 BrCCCCCOCc1ccccc1 34a_100000746331_100015291786 [1,1,0,0,0,0|2,0,0]=4 7709 B14R1.123 BrCCCCCOCc1ccccc1 7a_100000746331_100000211182 [1,1,0,0,0,0|2,0,0]=4 7710 B14R1.123 BrCCCCOCCc1ccccc1 34a_100011216708_100000765856 [1,1,0,0,0,0|0,0,1]=3 7711 B14R1.123 BrCCCOC/C=C/c1ccccc1 34a_100011217188_100016265936 [1,1,0,0,0,0|1,0,1]=4 7712 B14R1.123 BrCCCOCCCc1ccccc1 34a_100011217188_100000211621 [1,1,0,0,0,0|1,0,1]=4 7713 B14R1.123 BrCCCOCCOc1ccccc1 34a_100011217188_100000184471 [1,1,0,0,0,0|1,0,1]=4 7714 B14R1.123 BrCCCOCCSc1ccccc1 34a_100011217188_100000246102 [1,1,0,0,0,0|1,0,1]=4 7715 B14R1.123 BrCCCOCOCc1ccccc1 34a_100011217188_100000763385 [1,1,0,0,0,0|1,0,1]=4 7716 B14R1.123 BrCCCOCSCc1ccccc1 34a_100011217188_200011217039 [1,1,0,0,0,0|1,0,1]=4 7717 B14R1.123 C#CCCCOCCc1ccccc1 34a_100000210268_100000695029 [1,1,0,0,0,0|0,0,2]=4 7718 B14R1.123 C#CCCCOCCc1ccccc1 34a_100000215630_100000765856 [1,1,0,0,0,0|0,0,2]=4 7719 B14R1.123 C#CCCCOCCc1ccccc1 7a_100000210268_100011215417 [1,1,0,0,0,0|0,0,2]=4 7720 B14R1.123 C#CCCCOCCc1ccccc1 7a_100000215630_100000765856 [1,1,0,0,0,0|0,0,2]=4 7721 B14R1.123 C/C=C/CCOCCc1ccccc1 34a_100016278192_100000765856 [1,1,0,0,0,0|0,0,2]=4 7722 B14R1.123 C=CCCCOCCc1ccccc1 34a_100000210268_100000757094 [1,1,0,0,0,0|0,0,2]=4 7723 B14R1.123 C=CCCCOCCc1ccccc1 34a_100000758997_100000765856 [1,1,0,0,0,0|0,0,2]=4 7724 B14R1.123 C=CCCCOCCc1ccccc1 7a_100000210268_100000757094 [1,1,0,0,0,0|0,0,2]=4 7725 B14R1.123 C=CCCCOCCc1ccccc1 7a_100000758997_100000765856 [1,1,0,0,0,0|0,0,2]=4 7726 B14R1.123 CC#CCCOCCc1ccccc1 34a_100000750427_100000765856 [1,1,0,0,0,0|0,0,2]=4 7727 B14R1.123 CC/C=C\COCCc1ccccc1 34a_100000210268_100103147603 [1,1,0,0,0,0|0,0,2]=4 7728 B14R1.123 CC/C=C\COCCc1ccccc1 34a_100016268518_100000765856 [1,1,0,0,0,0|0,0,2]=4 7729 B14R1.123 CC/C=C\COCCc1ccccc1 7a_100000210268_100103147603 [1,1,0,0,0,0|0,0,2]=4 7730 B14R1.123 CCC#CCOCCc1ccccc1 34a_100000032950_100000765856 [1,1,0,0,0,0|0,0,2]=4 7731 B14R1.123 CCC#CCOCCc1ccccc1 34a_100000210268_100009813939 [1,1,0,0,0,0|0,0,2]=4 7732 B14R1.123 CCC#CCOCCc1ccccc1 7a_100000210268_100009813939 [1,1,0,0,0,0|0,0,2]=4 7733 B14R1.123 CCCCC=NNCc1ccccc1 4a_100000007032_100000210104 [1,1,0,0,0,0|2,0,0]=4 7734 B14R1.123 CCCCCC=NNc1ccccc1 4a_100015195140_100000737632 [1,1,0,0,0,0|2,0,0]=4 7735 B14R1.123 CCCCCCC=Cc1ccccc1 271570a_200015348155_100000210277 [1,1,0,0,0,0|1,0,1]=4 7736 B14R1.123 CCCCCCCNc1ccccc1 34a_100000106764_100000210614 [1,1,0,0,0,0|1,0,1]=4 7737 B14R1.123 CCCCCCCOc1ccccc1 34a_100000210340_100000210614 [1,1,0,0,0,0|1,0,1]=4 7738 B14R1.123 CCCCCCCOc1ccccc1 7a_100000210340_100000210614 [1,1,0,0,0,0|1,0,1]=4 7739 B14R1.123 CCCCCCCSc1ccccc1 62a_100000210614_100000041952 [1,1,0,0,0,0|1,0,1]=4 7740 B14R1.123 CCCCCCCSc1ccccc1 62a_100000719477_100000210316 [1,1,0,0,0,0|1,0,1]=4 7741 B14R1.123 CCCCCCNCc1ccccc1 207a_100000210581_100015611070 [1,1,0,0,0,0|1,0,1]=4 7742 B14R1.123 CCCCCCNCc1ccccc1 2230a_100000210581_100015291786 [1,1,0,0,0,0|1,0,1]=4 7743 B14R1.123 CCCCCCNCc1ccccc1 2230a_100015324214_100000210314 [1,1,0,0,0,0|1,0,1]=4 7744 B14R1.123 CCCCCCNCc1ccccc1 270004a_100000210581_100015611070 [1,1,0,0,0,0|1,0,1]=4 7745 B14R1.123 CCCCCCNCc1ccccc1 34a_100015324214_100000210314 [1,1,0,0,0,0|1,0,1]=4 7746 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210259_100015291786 [1,1,0,0,0,0|1,0,1]=4 7747 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210790_100000210314 [1,1,0,0,0,0|1,0,1]=4 7748 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210259_100000211182 [1,1,0,0,0,0|1,0,1]=4 7749 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210790_100000210314 [1,1,0,0,0,0|1,0,1]=4 7750 B14R1.123 CCCCCCSCc1ccccc1 62a_100000210314_100015291786 [1,1,0,0,0,0|1,0,1]=4 7751 B14R1.123 CCCCCCSCc1ccccc1 62a_100000211182_100000210757 [1,1,0,0,0,0|1,0,1]=4 7752 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000106460_100000210326 [1,1,0,0,0,0|1,0,1]=4 7753 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000209983_100000765856 [1,1,0,0,0,0|1,0,1]=4 7754 B14R1.123 CCCCCNCCc1ccccc1 34a_100000106460_100000718602 [1,1,0,0,0,0|1,0,1]=4 7755 B14R1.123 CCCCCNCSc1ccccc1 2230a_100000209983_100011218342 [1,1,0,0,0,0|2,0,0]=4 7756 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210253_100000765856 [1,1,0,0,0,0|0,0,1]=3 7757 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210268_100000718602 [1,1,0,0,0,0|0,0,1]=3 7758 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210253_100000765856 [1,1,0,0,0,0|0,0,1]=3 7759 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210268_100000210326 [1,1,0,0,0,0|0,0,1]=3 7760 B14R1.123 CCCCCOCCc1ccccn1 34a_100000210271_100000718602 [1,1,0,0,0,0|1,0,1]=4 7761 B14R1.123 CCCCCOCCc1ccccn1 7a_100000210253_100015183660 [1,1,0,0,0,0|1,0,1]=4 7762 B14R1.123 CCCCCOCCc1cccnc1 34a_100011217484_100000718602 [1,1,0,0,0,0|1,0,1]=4 7763 B14R1.123 CCCCCOCCc1cccnc1 7a_100000210253_200011713674 [1,1,0,0,0,0|1,0,1]=4 7764 B14R1.123 CCCCCOCCc1ccncc1 34a_100011216225_100000718602 [1,1,0,0,0,0|1,0,1]=4 7765 B14R1.123 CCCCCOCCc1ccncc1 7a_100000210253_100000723409 [1,1,0,0,0,0|1,0,1]=4 7766 B14R1.123 CCCCCSCCc1ccccc1 62a_100000210326_100011218657 [1,1,0,0,0,0|0,1,1]=4 7767 B14R1.123 CCCCCSCCc1ccccc1 62a_100000765856_100000210326 [1,1,0,0,0,0|0,1,1]=4 7768 B14R1.123 CCCCCSCSc1ccccc1 62a_100000210326_100011218342 [1,1,0,0,0,0|2,0,0]=4 7769 B14R1.123 CCCCCSCSc1ccccc1 62a_100011218342_100000210326 [1,1,0,0,0,0|2,0,0]=4 7770 B14R1.123 CCCCNC/C=C/c1ccccc1 2230a_100000102301_100016265936 [1,1,0,0,0,0|1,0,1]=4 7771 B14R1.123 CCCCNC/C=C/c1ccccc1 2230a_100020603302_100000210211 [1,1,0,0,0,0|1,0,1]=4 7772 B14R1.123 CCCCNC/C=C/c1ccccc1 34a_100020603302_100000210210 [1,1,0,0,0,0|1,0,1]=4 7773 B14R1.123 CCCCNC/C=C/c1ccccc1 7a_106832991798_100016265936 [1,1,0,0,0,0|1,0,1]=4 7774 B14R1.123 CCCCNCC=Cc1ccccc1 270004a_100000102301_100000210105 [1,1,0,0,0,0|1,0,1]=4 7775 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000102301_100000211621 [1,1,0,0,0,0|1,0,1]=4 7776 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000211184_100000210211 [1,1,0,0,0,0|1,0,1]=4 7777 B14R1.123 CCCCNCCCc1ccccc1 34a_100000211184_100000210210 [1,1,0,0,0,0|1,0,1]=4 7778 B14R1.123 CCCCNCCCc1ccccc1 7a_106832991798_100000211621 [1,1,0,0,0,0|1,0,1]=4 7779 B14R1.123 CCCCNCCOc1ccccc1 2230a_100000102301_100000184471 [1,1,0,0,0,0|1,0,1]=4 7780 B14R1.123 CCCCNCCOc1ccccc1 2230a_100000174943_100000210211 [1,1,0,0,0,0|1,0,1]=4 7781 B14R1.123 CCCCNCCOc1ccccc1 270004a_100000102301_100000758736 [1,1,0,0,0,0|1,0,1]=4 7782 B14R1.123 CCCCNCCOc1ccccc1 34a_100000174943_100000210210 [1,1,0,0,0,0|1,0,1]=4 7783 B14R1.123 CCCCNCCOc1ccccc1 7a_106832991798_100000184471 [1,1,0,0,0,0|1,0,1]=4 7784 B14R1.123 CCCCNCCSc1ccccc1 2230a_100000102301_100000246102 [1,1,0,0,0,0|1,0,1]=4 7785 B14R1.123 CCCCNCCSc1ccccc1 2230a_100000189519_100000210211 [1,1,0,0,0,0|1,0,1]=4 7786 B14R1.123 CCCCNCCSc1ccccc1 7a_106832991798_100000246102 [1,1,0,0,0,0|1,0,1]=4 7787 B14R1.123 CCCCNCOCc1ccccc1 2230a_100000102301_100000763385 [1,1,0,0,0,0|1,0,1]=4 7788 B14R1.123 CCCCNCSCc1ccccc1 2230a_100000102301_200011217039 [1,1,0,0,0,0|1,0,1]=4 7789 B14R1.123 CCCCNN=CCc1ccccc1 4a_100025702795_100000209964 [1,1,0,0,0,0|1,0,0]=3 7790 B14R1.123 CCCCOC/C=C/c1ccccc1 34a_100000210227_100016265936 [1,1,0,0,0,0|0,0,1]=3 7791 B14R1.123 CCCCOC/C=C/c1ccccc1 34a_100000210256_100000210210 [1,1,0,0,0,0|0,0,1]=3 7792 B14R1.123 CCCCOC/C=C/c1ccccc1 7a_100000210227_100016265936 [1,1,0,0,0,0|0,0,1]=3 7793 B14R1.123 CCCCOC/C=C/c1cccnc1 34a_200102594124_100000210210 [1,1,0,0,0,0|1,0,1]=4 7794 B14R1.123 CCCCOCC#Cc1ccccc1 34a_100000210227_100011352542 [1,1,0,0,0,0|0,0,2]=4 7795 B14R1.123 CCCCOCC#Cc1ccccc1 34a_100011217464_100000210210 [1,1,0,0,0,0|0,0,2]=4 7796 B14R1.123 CCCCOCC#Cc1ccccc1 7a_100000210227_100011352542 [1,1,0,0,0,0|0,0,2]=4 7797 B14R1.123 CCCCOCC#Cc1ccccc1 7a_100011217464_100000210211 [1,1,0,0,0,0|0,0,2]=4 7798 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210227_100000211621 [1,1,0,0,0,0|0,0,1]=3 7799 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210828_100000210210 [1,1,0,0,0,0|0,0,1]=3 7800 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210227_100000211621 [1,1,0,0,0,0|0,0,1]=3 7801 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210828_100000210211 [1,1,0,0,0,0|0,0,1]=3 7802 B14R1.123 CCCCOCCCc1ccccn1 34a_100011215068_100000210210 [1,1,0,0,0,0|1,0,1]=4 7803 B14R1.123 CCCCOCCCc1cccnc1 34a_100000211284_100000210210 [1,1,0,0,0,0|1,0,1]=4 7804 B14R1.123 CCCCOCCCc1ccncc1 34a_100000210659_100000210210 [1,1,0,0,0,0|1,0,1]=4 7805 B14R1.123 CCCCOCCNc1ccccc1 34a_100000106764_100000743108 [1,1,0,0,0,0|0,0,1]=3 7806 B14R1.123 CCCCOCCNc1ccccc1 34a_100000211345_100000210210 [1,1,0,0,0,0|0,0,1]=3 7807 B14R1.123 CCCCOCCNc1ccncc1 34a_200011243140_100000210210 [1,1,0,0,0,0|1,0,1]=4 7808 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210227_100000184471 [1,1,0,0,0,0|0,0,1]=3 7809 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210260_100000210210 [1,1,0,0,0,0|0,0,1]=3 7810 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210340_100000743108 [1,1,0,0,0,0|0,0,1]=3 7811 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210227_100000184471 [1,1,0,0,0,0|0,0,1]=3 7812 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210260_100000210211 [1,1,0,0,0,0|0,0,1]=3 7813 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210340_100000743108 [1,1,0,0,0,0|0,0,1]=3 7814 B14R1.123 CCCCOCCOc1cccnc1 34a_100000210849_100000743108 [1,1,0,0,0,0|1,0,1]=4 7815 B14R1.123 CCCCOCCOc1cccnc1 7a_100000210849_100000743108 [1,1,0,0,0,0|1,0,1]=4 7816 B14R1.123 CCCCOCCOc1ccncc1 34a_100000212176_100000743108 [1,1,0,0,0,0|1,0,1]=4 7817 B14R1.123 CCCCOCCSc1ccccc1 34a_100000210227_100000246102 [1,1,0,0,0,0|0,0,1]=3 7818 B14R1.123 CCCCOCCSc1ccccc1 62a_100000719477_100000743108 [1,1,0,0,0,0|0,0,1]=3 7819 B14R1.123 CCCCOCCSc1ccccc1 62a_100000743108_100000041952 [1,1,0,0,0,0|0,0,1]=3 7820 B14R1.123 CCCCOCCSc1ccccc1 7a_100000210227_100000246102 [1,1,0,0,0,0|0,0,1]=3 7821 B14R1.123 CCCCOCCSc1ccccc1 7a_100000230494_100000210211 [1,1,0,0,0,0|0,0,1]=3 7822 B14R1.123 CCCCOCCSc1ccccn1 62a_100000743108_100011216584 [1,1,0,0,0,0|1,0,1]=4 7823 B14R1.123 CCCCOCCSc1ccccn1 62a_100011216584_100000743108 [1,1,0,0,0,0|1,0,1]=4 7824 B14R1.123 CCCCOCCSc1ccccn1 7a_100000156319_100000210211 [1,1,0,0,0,0|1,0,1]=4 7825 B14R1.123 CCCCOCCSc1cccnc1 62a_100000210063_100000743108 [1,1,0,0,0,0|1,0,1]=4 7826 B14R1.123 CCCCOCCSc1cccnc1 62a_100000743108_100000210063 [1,1,0,0,0,0|1,0,1]=4 7827 B14R1.123 CCCCOCCSc1ccncc1 62a_100000728582_100000743108 [1,1,0,0,0,0|1,0,1]=4 7828 B14R1.123 CCCCOCCSc1ccncc1 62a_100000743108_100000728582 [1,1,0,0,0,0|1,0,1]=4 7829 B14R1.123 CCCCOCNCc1ccccc1 2230a_100015324214_100011995733 [1,1,0,0,0,0|0,0,1]=3 7830 B14R1.123 CCCCOCNCc1ccccc1 34a_100015324214_100011995733 [1,1,0,0,0,0|0,0,1]=3 7831 B14R1.123 CCCCOCOCc1ccccc1 34a_100000210227_100000763385 [1,1,0,0,0,0|0,0,1]=3 7832 B14R1.123 CCCCOCOCc1ccccc1 34a_100000210790_100011995733 [1,1,0,0,0,0|0,0,1]=3 7833 B14R1.123 CCCCOCSCc1ccccc1 34a_100000210227_200011217039 [1,1,0,0,0,0|0,0,1]=3 7834 B14R1.123 CCCCOCSCc1ccccc1 62a_100000211182_100011995733 [1,1,0,0,0,0|0,0,1]=3 7835 B14R1.123 CCCCOCSCc1ccccc1 62a_100011995733_100015291786 [1,1,0,0,0,0|0,0,1]=3 7836 B14R1.123 CCCCOCSCc1ccccn1 62a_100000721315_100011995733 [1,1,0,0,0,0|1,0,1]=4 7837 B14R1.123 CCCCOCSCc1ccccn1 62a_100011995733_100000721315 [1,1,0,0,0,0|1,0,1]=4 7838 B14R1.123 CCCCOCSCc1cccnc1 62a_100000741622_100011995733 [1,1,0,0,0,0|1,0,1]=4 7839 B14R1.123 CCCCOCSCc1cccnc1 62a_100011995733_100000741622 [1,1,0,0,0,0|1,0,1]=4 7840 B14R1.123 CCCCOCSCc1ccncc1 62a_100011995733_100015193705 [1,1,0,0,0,0|1,0,1]=4 7841 B14R1.123 CCCCOCSCc1ccncc1 62a_100015193705_100011995733 [1,1,0,0,0,0|1,0,1]=4 7842 B14R1.123 CCCCSC/C=C/c1ccccc1 62a_100000210211_100016265936 [1,1,0,0,0,0|0,1,1]=4 7843 B14R1.123 CCCCSC/C=C/c1ccccc1 62a_100016265936_100000210210 [1,1,0,0,0,0|0,1,1]=4 7844 B14R1.123 CCCCSCCCc1ccccc1 62a_100000210211_100000211621 [1,1,0,0,0,0|0,1,1]=4 7845 B14R1.123 CCCCSCCCc1ccccc1 62a_100000211621_100000210210 [1,1,0,0,0,0|0,1,1]=4 7846 B14R1.123 CCCCSCCOc1ccccc1 62a_100000184471_100000210210 [1,1,0,0,0,0|0,1,1]=4 7847 B14R1.123 CCCCSCCOc1ccccc1 62a_100000210211_100000184471 [1,1,0,0,0,0|0,1,1]=4 7848 B14R1.123 CCCCSCCSc1ccccc1 62a_100000210211_100000246102 [1,1,0,0,0,0|0,1,1]=4 7849 B14R1.123 CCCCSCCSc1ccccc1 62a_100000246102_100000210210 [1,1,0,0,0,0|0,1,1]=4 7850 B14R1.123 CCCCSCOCc1ccccc1 62a_100000210211_100000763385 [1,1,0,0,0,0|0,1,1]=4 7851 B14R1.123 CCCCSCOCc1ccccc1 62a_100000763385_100000210210 [1,1,0,0,0,0|0,1,1]=4 7852 B14R1.123 CCCCSCSCc1ccccc1 62a_100000210211_200011217039 [1,1,0,0,0,0|0,1,1]=4 7853 B14R1.123 CCCCSCSCc1ccccc1 62a_200011217039_100000210210 [1,1,0,0,0,0|0,1,1]=4 7854 B14R1.123 CCCNCCCCc1ccccc1 2230a_100015280158_100000210303 [1,1,0,0,0,0|1,0,1]=4 7855 B14R1.123 CCCNCCCCc1ccccc1 34a_100015280158_100000210303 [1,1,0,0,0,0|1,0,1]=4 7856 B14R1.123 CCCNCCOCc1ccccc1 2230a_100000753106_100000210303 [1,1,0,0,0,0|2,0,0]=4 7857 B14R1.123 CCCNCCOCc1ccccc1 34a_100000753106_100000210303 [1,1,0,0,0,0|2,0,0]=4 7858 B14R1.123 CCCNCCSCc1ccccc1 2230a_100000189534_100000210303 [1,1,0,0,0,0|2,0,0]=4 7859 B14R1.123 CCCNCCSCc1ccccc1 34a_100000189534_100000210303 [1,1,0,0,0,0|2,0,0]=4 7860 B14R1.123 CCCNCCSCc1ccccc1 7a_100000189534_100000210303 [1,1,0,0,0,0|2,0,0]=4 7861 B14R1.123 CCCNN=CCCc1ccccc1 4a_100000740057_100000198083 [1,1,0,0,0,0|2,0,0]=4 7862 B14R1.123 CCCNN=CCOc1ccccc1 4a_100000740057_100000758736 [1,1,0,0,0,0|2,0,0]=4 7863 B14R1.123 CCCOCCCCc1ccccc1 34a_100000210258_100000701786 [1,1,0,0,0,0|1,0,1]=4 7864 B14R1.123 CCCOCCCCc1ccccc1 34a_100000703073_100000210303 [1,1,0,0,0,0|1,0,1]=4 7865 B14R1.123 CCCOCCCCc1ccccc1 7a_100000703073_100000210303 [1,1,0,0,0,0|1,0,1]=4 7866 B14R1.123 CCCOCCNCc1ccccc1 207a_100161115042_100015611070 [1,1,0,0,0,0|2,0,0]=4 7867 B14R1.123 CCCOCCNCc1ccccc1 2230a_100015324214_100011215938 [1,1,0,0,0,0|2,0,0]=4 7868 B14R1.123 CCCOCCNCc1ccccc1 2230a_100161115042_100015291786 [1,1,0,0,0,0|2,0,0]=4 7869 B14R1.123 CCCOCCNCc1ccccc1 270004a_100161115042_100015611070 [1,1,0,0,0,0|2,0,0]=4 7870 B14R1.123 CCCOCCNCc1ccccc1 34a_100000180844_100000210303 [1,1,0,0,0,0|2,0,0]=4 7871 B14R1.123 CCCOCCNCc1ccccc1 34a_100015324214_100011215938 [1,1,0,0,0,0|2,0,0]=4 7872 B14R1.123 CCCOCCNCc1ccccc1 34a_100161115042_100015291786 [1,1,0,0,0,0|2,0,0]=4 7873 B14R1.123 CCCOCCOCc1ccccc1 34a_100000210258_100000234347 [1,1,0,0,0,0|2,0,0]=4 7874 B14R1.123 CCCOCCOCc1ccccc1 34a_100000210790_100011215938 [1,1,0,0,0,0|2,0,0]=4 7875 B14R1.123 CCCOCCOCc1ccccc1 34a_100000752267_100015291786 [1,1,0,0,0,0|2,0,0]=4 7876 B14R1.123 CCCOCCOCc1ccccc1 34a_100000759325_100000210303 [1,1,0,0,0,0|2,0,0]=4 7877 B14R1.123 CCCOCCOCc1ccccc1 7a_100000210790_100011215938 [1,1,0,0,0,0|2,0,0]=4 7878 B14R1.123 CCCOCCOCc1ccccc1 7a_100000752267_100000211182 [1,1,0,0,0,0|2,0,0]=4 7879 B14R1.123 CCCOCCOCc1ccccc1 7a_100000759325_100000210303 [1,1,0,0,0,0|2,0,0]=4 7880 B14R1.123 CCCOCCSCc1ccccc1 34a_100000210258_200011297719 [1,1,0,0,0,0|2,0,0]=4 7881 B14R1.123 CCCOCCSCc1ccccc1 34a_100011205989_100000210303 [1,1,0,0,0,0|2,0,0]=4 7882 B14R1.123 CCCOCCSCc1ccccc1 62a_100000211182_100011215938 [1,1,0,0,0,0|2,0,0]=4 7883 B14R1.123 CCCOCCSCc1ccccc1 62a_100011215938_100015291786 [1,1,0,0,0,0|2,0,0]=4 7884 B14R1.123 CCCOCCSCc1ccccc1 7a_100011205989_100000210303 [1,1,0,0,0,0|2,0,0]=4 7885 B14R1.123 CCCSCCCCc1ccccc1 62a_100000210303_100000701786 [1,1,0,0,0,0|1,0,1]=4 7886 B14R1.123 CCCSCCCCc1ccccc1 62a_100000701786_100000210303 [1,1,0,0,0,0|1,0,1]=4 7887 B14R1.123 CCCSCCNCc1ccccc1 207a_100020603323_100015611070 [1,1,0,0,0,0|2,0,0]=4 7888 B14R1.123 CCCSCCNCc1ccccc1 2230a_100020603323_100015291786 [1,1,0,0,0,0|2,0,0]=4 7889 B14R1.123 CCCSCCNCc1ccccc1 270004a_100020603323_100015611070 [1,1,0,0,0,0|2,0,0]=4 7890 B14R1.123 CCCSCCOCc1ccccc1 34a_200000230433_100015291786 [1,1,0,0,0,0|2,0,0]=4 7891 B14R1.123 CCCSCCOCc1ccccc1 62a_100000210303_100000234347 [1,1,0,0,0,0|2,0,0]=4 7892 B14R1.123 CCCSCCOCc1ccccc1 62a_100000234347_100000210303 [1,1,0,0,0,0|2,0,0]=4 7893 B14R1.123 CCCSCCOCc1ccccc1 7a_200000230433_100000211182 [1,1,0,0,0,0|2,0,0]=4 7894 B14R1.123 CCCSCCSCc1ccccc1 62a_100000210303_200011297719 [1,1,0,0,0,0|2,0,0]=4 7895 B14R1.123 CCCSCCSCc1ccccc1 62a_200011297719_100000210303 [1,1,0,0,0,0|2,0,0]=4 7896 B14R1.123 CCNCCCCCc1ccccc1 2230a_100000750932_100000210202 [1,1,0,0,0,0|1,0,1]=4 7897 B14R1.123 CCNCCCCCc1ccccc1 2230a_100015525214_200011217138 [1,1,0,0,0,0|1,0,1]=4 7898 B14R1.123 CCNCCCCCc1ccccc1 34a_100000750932_100000210202 [1,1,0,0,0,0|1,0,1]=4 7899 B14R1.123 CCNCCCOCc1ccccc1 2230a_100015525214_100011215529 [1,1,0,0,0,0|2,0,0]=4 7900 B14R1.123 CCNCCCOCc1ccccc1 2230a_200000206031_100000210202 [1,1,0,0,0,0|2,0,0]=4 7901 B14R1.123 CCNCCCOCc1ccccc1 34a_200000206031_100000210202 [1,1,0,0,0,0|2,0,0]=4 7902 B14R1.123 CCOCCCCCc1ccccc1 34a_100121572206_200011217138 [1,1,0,0,0,0|1,0,1]=4 7903 B14R1.123 CCOCCCCCc1ccccc1 34a_200011219639_100000210202 [1,1,0,0,0,0|1,0,1]=4 7904 B14R1.123 CCOCCCCCc1ccccc1 7a_200011219639_100000210202 [1,1,0,0,0,0|1,0,1]=4 7905 B14R1.123 CCOCCCNCc1ccccc1 207a_100000210961_100015611070 [1,1,0,0,0,0|2,0,0]=4 7906 B14R1.123 CCOCCCNCc1ccccc1 2230a_100000210961_100015291786 [1,1,0,0,0,0|2,0,0]=4 7907 B14R1.123 CCOCCCNCc1ccccc1 2230a_100015324214_100012232248 [1,1,0,0,0,0|2,0,0]=4 7908 B14R1.123 CCOCCCNCc1ccccc1 270004a_100000210961_100015611070 [1,1,0,0,0,0|2,0,0]=4 7909 B14R1.123 CCOCCCNCc1ccccc1 34a_100000185501_100000210202 [1,1,0,0,0,0|2,0,0]=4 7910 B14R1.123 CCOCCCNCc1ccccc1 34a_100000210961_100015291786 [1,1,0,0,0,0|2,0,0]=4 7911 B14R1.123 CCOCCCNCc1ccccc1 34a_100015324214_100012232248 [1,1,0,0,0,0|2,0,0]=4 7912 B14R1.123 CCOCCCOCc1ccccc1 34a_100000210790_100012232248 [1,1,0,0,0,0|2,0,0]=4 7913 B14R1.123 CCOCCCOCc1ccccc1 34a_100000691849_100000210202 [1,1,0,0,0,0|2,0,0]=4 7914 B14R1.123 CCOCCCOCc1ccccc1 34a_100000757476_100015291786 [1,1,0,0,0,0|2,0,0]=4 7915 B14R1.123 CCOCCCOCc1ccccc1 34a_100121572206_100011215529 [1,1,0,0,0,0|2,0,0]=4 7916 B14R1.123 CCOCCCOCc1ccccc1 7a_100000210790_100012232248 [1,1,0,0,0,0|2,0,0]=4 7917 B14R1.123 CCOCCCOCc1ccccc1 7a_100000691849_100000210202 [1,1,0,0,0,0|2,0,0]=4 7918 B14R1.123 CCOCCCOCc1ccccc1 7a_100000757476_100000211182 [1,1,0,0,0,0|2,0,0]=4 7919 B14R1.123 CCOCCCSCc1ccccc1 62a_100000211182_100012232248 [1,1,0,0,0,0|2,0,0]=4 7920 B14R1.123 CCOCCCSCc1ccccc1 62a_100012232248_100015291786 [1,1,0,0,0,0|2,0,0]=4 7921 B14R1.123 CCOCCNCCc1ccccc1 2230a_100000106460_100011215890 [1,1,0,0,0,0|1,0,1]=4 7922 B14R1.123 CCOCCNCCc1ccccc1 2230a_102516460346_100000765856 [1,1,0,0,0,0|1,0,1]=4 7923 B14R1.123 CCOCCNCCc1ccccc1 34a_100000106460_100000210147 [1,1,0,0,0,0|1,0,1]=4 7924 B14R1.123 CCOCCNCCc1ccccc1 34a_102516460346_100000765856 [1,1,0,0,0,0|1,0,1]=4 7925 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210136_100000765856 [1,1,0,0,0,0|0,0,1]=3 7926 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210268_100000210147 [1,1,0,0,0,0|0,0,1]=3 7927 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210136_100000765856 [1,1,0,0,0,0|0,0,1]=3 7928 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210268_100011215890 [1,1,0,0,0,0|0,0,1]=3 7929 B14R1.123 CCOCCOCCc1ccccn1 34a_100000210271_100000210147 [1,1,0,0,0,0|1,0,1]=4 7930 B14R1.123 CCOCCOCCc1ccccn1 7a_100000210136_100015183660 [1,1,0,0,0,0|1,0,1]=4 7931 B14R1.123 CCOCCOCCc1cccnc1 34a_100011217484_100000210147 [1,1,0,0,0,0|1,0,1]=4 7932 B14R1.123 CCOCCOCCc1cccnc1 7a_100000210136_200011713674 [1,1,0,0,0,0|1,0,1]=4 7933 B14R1.123 CCOCCOCCc1ccncc1 34a_100011216225_100000210147 [1,1,0,0,0,0|1,0,1]=4 7934 B14R1.123 CCOCCOCCc1ccncc1 7a_100000210136_100000723409 [1,1,0,0,0,0|1,0,1]=4 7935 B14R1.123 CCOCCSCCc1ccccc1 62a_100000210147_100011218657 [1,1,0,0,0,0|0,1,1]=4 7936 B14R1.123 CCOCCSCCc1ccccc1 62a_100000765856_100011215890 [1,1,0,0,0,0|0,1,1]=4 7937 B14R1.123 CCSCCCCCc1ccccc1 62a_100000210202_200011217138 [1,1,0,0,0,0|1,0,1]=4 7938 B14R1.123 CCSCCCCCc1ccccc1 62a_200011217138_100000210202 [1,1,0,0,0,0|1,0,1]=4 7939 B14R1.123 CCSCCCOCc1ccccc1 34a_100011216438_100015291786 [1,1,0,0,0,0|2,0,0]=4 7940 B14R1.123 CCSCCCOCc1ccccc1 62a_100000210202_100011215529 [1,1,0,0,0,0|2,0,0]=4 7941 B14R1.123 CCSCCCOCc1ccccc1 62a_100011215529_100000210202 [1,1,0,0,0,0|2,0,0]=4 7942 B14R1.123 CCSCCCOCc1ccccc1 7a_100011216438_100000211182 [1,1,0,0,0,0|2,0,0]=4 7943 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106460_100000757381 [1,1,0,0,0,0|1,0,1]=4 7944 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106463_100000765856 [1,1,0,0,0,0|1,0,1]=4 7945 B14R1.123 CCSCCNCCc1ccccc1 34a_100000106460_100000757381 [1,1,0,0,0,0|1,0,1]=4 7946 B14R1.123 CCSCCOCCc1ccccc1 34a_100000210268_100000757381 [1,1,0,0,0,0|0,0,1]=3 7947 B14R1.123 CCSCCOCCc1ccccc1 34a_100000212035_100000765856 [1,1,0,0,0,0|0,0,1]=3 7948 B14R1.123 CCSCCOCCc1ccccc1 7a_100000210268_100000757381 [1,1,0,0,0,0|0,0,1]=3 7949 B14R1.123 CCSCCOCCc1ccccc1 7a_100000212035_100000765856 [1,1,0,0,0,0|0,0,1]=3 7950 B14R1.123 CCSCCOCCc1ccccn1 34a_100000210271_100000757381 [1,1,0,0,0,0|1,0,1]=4 7951 B14R1.123 CCSCCOCCc1ccccn1 7a_100000212035_100015183660 [1,1,0,0,0,0|1,0,1]=4 7952 B14R1.123 CCSCCOCCc1cccnc1 34a_100011217484_100000757381 [1,1,0,0,0,0|1,0,1]=4 7953 B14R1.123 CCSCCOCCc1cccnc1 7a_100000212035_200011713674 [1,1,0,0,0,0|1,0,1]=4 7954 B14R1.123 CCSCCOCCc1ccncc1 34a_100011216225_100000757381 [1,1,0,0,0,0|1,0,1]=4 7955 B14R1.123 CCSCCOCCc1ccncc1 7a_100000212035_100000723409 [1,1,0,0,0,0|1,0,1]=4 7956 B14R1.123 CCSCCSCCc1ccccc1 62a_100000757381_100011218657 [1,1,0,0,0,0|0,1,1]=4 7957 B14R1.123 CCSCCSCCc1ccccc1 62a_100000765856_100000757381 [1,1,0,0,0,0|0,1,1]=4 7958 B14R1.123 CNCCCCCCc1ccccc1 2230a_106832991635_100011218729 [1,1,0,0,0,0|1,0,1]=4 7959 B14R1.123 CNCCCCCCc1ccccc1 34a_100102657272_100011218729 [1,1,0,0,0,0|1,0,1]=4 7960 B14R1.123 CNCCCCCCc1ccccc1 7a_106832991635_100011218729 [1,1,0,0,0,0|1,0,1]=4 7961 B14R1.123 CNCCCCOCc1ccccc1 2230a_100000748060_200000210301 [1,1,0,0,0,0|2,0,0]=4 7962 B14R1.123 CNCCCCOCc1ccccc1 2230a_106832991635_100011219843 [1,1,0,0,0,0|2,0,0]=4 7963 B14R1.123 CNCCCCOCc1ccccc1 34a_100000748060_200000210301 [1,1,0,0,0,0|2,0,0]=4 7964 B14R1.123 CNCCCCOCc1ccccc1 34a_100102657272_100011219843 [1,1,0,0,0,0|2,0,0]=4 7965 B14R1.123 CNCCCCOCc1ccccc1 7a_106832991635_100011219843 [1,1,0,0,0,0|2,0,0]=4 7966 B14R1.123 CNCCCOCCc1ccccc1 34a_100000213112_100000765856 [1,1,0,0,0,0|0,0,1]=3 7967 B14R1.123 COCCCCCCc1ccccc1 34a_100011215581_200000210301 [1,1,0,0,0,0|1,0,1]=4 7968 B14R1.123 COCCCCCCc1ccccc1 34a_100138415774_100011218729 [1,1,0,0,0,0|1,0,1]=4 7969 B14R1.123 COCCCCCCc1ccccc1 7a_100011215581_200000210301 [1,1,0,0,0,0|1,0,1]=4 7970 B14R1.123 COCCCCNCc1ccccc1 2230a_100015324214_100000730899 [1,1,0,0,0,0|2,0,0]=4 7971 B14R1.123 COCCCCNCc1ccccc1 34a_100000186360_200000210301 [1,1,0,0,0,0|2,0,0]=4 7972 B14R1.123 COCCCCNCc1ccccc1 34a_100015324214_100000755781 [1,1,0,0,0,0|2,0,0]=4 7973 B14R1.123 COCCCCOCc1ccccc1 34a_100000210790_100000755781 [1,1,0,0,0,0|2,0,0]=4 7974 B14R1.123 COCCCCOCc1ccccc1 34a_100000740925_100015291786 [1,1,0,0,0,0|2,0,0]=4 7975 B14R1.123 COCCCCOCc1ccccc1 34a_100011215074_200000210301 [1,1,0,0,0,0|2,0,0]=4 7976 B14R1.123 COCCCCOCc1ccccc1 34a_100138415774_100011219843 [1,1,0,0,0,0|2,0,0]=4 7977 B14R1.123 COCCCCOCc1ccccc1 7a_100000210790_100000730899 [1,1,0,0,0,0|2,0,0]=4 7978 B14R1.123 COCCCCOCc1ccccc1 7a_100011215074_200000210301 [1,1,0,0,0,0|2,0,0]=4 7979 B14R1.123 COCCCCSCc1ccccc1 62a_100000211182_100000730899 [1,1,0,0,0,0|2,0,0]=4 7980 B14R1.123 COCCCCSCc1ccccc1 62a_100000730899_100015291786 [1,1,0,0,0,0|2,0,0]=4 7981 B14R1.123 COCCCNCCc1ccccc1 2230a_100000106460_100000740836 [1,1,0,0,0,0|1,0,1]=4 7982 B14R1.123 COCCCNCCc1ccccc1 34a_100000106460_100000740836 [1,1,0,0,0,0|1,0,1]=4 7983 B14R1.123 COCCCNCCc1ccccc1 34a_100150723488_100000765856 [1,1,0,0,0,0|1,0,1]=4 7984 B14R1.123 COCCCOCCc1ccccc1 34a_100000210268_100000740836 [1,1,0,0,0,0|0,0,1]=3 7985 B14R1.123 COCCCOCCc1ccccc1 34a_100000740835_100000765856 [1,1,0,0,0,0|0,0,1]=3 7986 B14R1.123 COCCCOCCc1ccccc1 7a_100000210268_100000740836 [1,1,0,0,0,0|0,0,1]=3 7987 B14R1.123 COCCCOCCc1ccccn1 34a_100000210271_100000740836 [1,1,0,0,0,0|1,0,1]=4 7988 B14R1.123 COCCCOCCc1cccnc1 34a_100011217484_100000740836 [1,1,0,0,0,0|1,0,1]=4 7989 B14R1.123 COCCCOCCc1ccncc1 34a_100011216225_100000740836 [1,1,0,0,0,0|1,0,1]=4 7990 B14R1.123 COCCCSCCc1ccccc1 62a_100000709357_100011218657 [1,1,0,0,0,0|0,1,1]=4 7991 B14R1.123 COCCCSCCc1ccccc1 62a_100000765856_100000709357 [1,1,0,0,0,0|0,1,1]=4 7992 B14R1.123 COCCOC/C=C/c1ccccc1 34a_100000210237_100016265936 [1,1,0,0,0,0|1,0,1]=4 7993 B14R1.123 COCCOC/C=C/c1ccccc1 34a_100000210256_100011201679 [1,1,0,0,0,0|1,0,1]=4 7994 B14R1.123 COCCOCCCc1ccccc1 34a_100000210237_100000211621 [1,1,0,0,0,0|1,0,1]=4 7995 B14R1.123 COCCOCCCc1ccccc1 34a_100000210828_100011201679 [1,1,0,0,0,0|1,0,1]=4 7996 B14R1.123 COCCOCCCc1ccccc1 7a_100000210828_100000233755 [1,1,0,0,0,0|1,0,1]=4 7997 B14R1.123 COCCOCCNc1ccccc1 34a_100000106764_100000695917 [1,1,0,0,0,0|1,0,1]=4 7998 B14R1.123 COCCOCCNc1ccccc1 34a_100000211345_100011201679 [1,1,0,0,0,0|1,0,1]=4 7999 B14R1.123 COCCOCCOc1ccccc1 34a_100000210237_100000184471 [1,1,0,0,0,0|1,0,1]=4 8000 B14R1.123 COCCOCCOc1ccccc1 34a_100000210260_100011201679 [1,1,0,0,0,0|1,0,1]=4 8001 B14R1.123 COCCOCCOc1ccccc1 34a_100000210340_100000695917 [1,1,0,0,0,0|1,0,1]=4 8002 B14R1.123 COCCOCCOc1ccccc1 34a_100000756377_200000210301 [1,1,0,0,0,0|1,0,1]=4 8003 B14R1.123 COCCOCCOc1ccccc1 7a_100000210260_100000233755 [1,1,0,0,0,0|1,0,1]=4 8004 B14R1.123 COCCOCCOc1ccccc1 7a_100000210340_100000695917 [1,1,0,0,0,0|1,0,1]=4 8005 B14R1.123 COCCOCCOc1ccccc1 7a_100000756377_200000210301 [1,1,0,0,0,0|1,0,1]=4 8006 B14R1.123 COCCOCCSc1ccccc1 34a_100000210237_100000246102 [1,1,0,0,0,0|1,0,1]=4 8007 B14R1.123 COCCOCCSc1ccccc1 62a_100000695917_100000041952 [1,1,0,0,0,0|1,0,1]=4 8008 B14R1.123 COCCOCCSc1ccccc1 62a_100000719477_100000695917 [1,1,0,0,0,0|1,0,1]=4 8009 B14R1.123 COCCOCCSc1ccccc1 7a_100000230494_100000233755 [1,1,0,0,0,0|1,0,1]=4 8010 B14R1.123 COCCOCNCc1ccccc1 2230a_100015324214_100000231047 [1,1,0,0,0,0|1,0,1]=4 8011 B14R1.123 COCCOCOCc1ccccc1 34a_100000210237_100000763385 [1,1,0,0,0,0|1,0,1]=4 8012 B14R1.123 COCCOCSCc1ccccc1 34a_100000210237_200011217039 [1,1,0,0,0,0|1,0,1]=4 8013 B14R1.123 COCCOCSCc1ccccc1 62a_100000211182_100000231047 [1,1,0,0,0,0|1,0,1]=4 8014 B14R1.123 COCCOCSCc1ccccc1 62a_100000231047_100015291786 [1,1,0,0,0,0|1,0,1]=4 8015 B14R1.123 CSCCCCCCc1ccccc1 62a_100011218729_200000210301 [1,1,0,0,0,0|1,0,1]=4 8016 B14R1.123 CSCCCCCCc1ccccc1 62a_200000210301_100011218729 [1,1,0,0,0,0|1,0,1]=4 8017 B14R1.123 CSCCCCOCc1ccccc1 34a_100011217163_100015291786 [1,1,0,0,0,0|2,0,0]=4 8018 B14R1.123 CSCCCCOCc1ccccc1 62a_100011219843_200000210301 [1,1,0,0,0,0|2,0,0]=4 8019 B14R1.123 CSCCCCOCc1ccccc1 62a_200000210301_100011219843 [1,1,0,0,0,0|2,0,0]=4 8020 B14R1.123 CSCCCCOCc1ccccc1 7a_100011217163_100000211182 [1,1,0,0,0,0|2,0,0]=4 8021 B14R1.123 CSCCCNCCc1ccccc1 2230a_100000749238_100000765856 [1,1,0,0,0,0|1,0,1]=4 8022 B14R1.123 CSCCCOCCc1ccccc1 34a_100000690336_100000765856 [1,1,0,0,0,0|0,0,1]=3 8023 B14R1.123 CSCCCOCCc1ccccc1 7a_100000690336_100000765856 [1,1,0,0,0,0|0,0,1]=3 8024 B14R1.123 CSCCCOCCc1ccccn1 7a_100000690336_100015183660 [1,1,0,0,0,0|1,0,1]=4 8025 B14R1.123 CSCCCOCCc1cccnc1 7a_100000690336_200011713674 [1,1,0,0,0,0|1,0,1]=4 8026 B14R1.123 CSCCCOCCc1ccncc1 7a_100000690336_100000723409 [1,1,0,0,0,0|1,0,1]=4 8027 B14R1.123 CSCCOC/C=C/c1ccccc1 34a_100000210256_100000212216 [1,1,0,0,0,0|1,0,1]=4 8028 B14R1.123 CSCCOC/C=C/c1ccccc1 34a_100000230434_100016265936 [1,1,0,0,0,0|1,0,1]=4 8029 B14R1.123 CSCCOC/C=C/c1ccccc1 7a_100000230434_100016265936 [1,1,0,0,0,0|1,0,1]=4 8030 B14R1.123 CSCCOCCCc1ccccc1 34a_100000210828_100000212216 [1,1,0,0,0,0|1,0,1]=4 8031 B14R1.123 CSCCOCCCc1ccccc1 34a_100000230434_100000211621 [1,1,0,0,0,0|1,0,1]=4 8032 B14R1.123 CSCCOCCCc1ccccc1 7a_100000210828_100000212216 [1,1,0,0,0,0|1,0,1]=4 8033 B14R1.123 CSCCOCCCc1ccccc1 7a_100000230434_100000211621 [1,1,0,0,0,0|1,0,1]=4 8034 B14R1.123 CSCCOCCNc1ccccc1 34a_100000211345_100000212216 [1,1,0,0,0,0|1,0,1]=4 8035 B14R1.123 CSCCOCCOc1ccccc1 34a_100000210260_100000212216 [1,1,0,0,0,0|1,0,1]=4 8036 B14R1.123 CSCCOCCOc1ccccc1 34a_100000230434_100000184471 [1,1,0,0,0,0|1,0,1]=4 8037 B14R1.123 CSCCOCCOc1ccccc1 7a_100000210260_100000212216 [1,1,0,0,0,0|1,0,1]=4 8038 B14R1.123 CSCCOCCOc1ccccc1 7a_100000230434_100000184471 [1,1,0,0,0,0|1,0,1]=4 8039 B14R1.123 CSCCOCCSc1ccccc1 34a_100000230434_100000246102 [1,1,0,0,0,0|1,0,1]=4 8040 B14R1.123 CSCCOCCSc1ccccc1 7a_100000230434_100000246102 [1,1,0,0,0,0|1,0,1]=4 8041 B14R1.123 CSCCOCCSc1ccccc1 7a_100000230494_100000212216 [1,1,0,0,0,0|1,0,1]=4 8042 B14R1.123 CSCCOCOCc1ccccc1 34a_100000230434_100000763385 [1,1,0,0,0,0|1,0,1]=4 8043 B14R1.123 CSCCOCSCc1ccccc1 34a_100000230434_200011217039 [1,1,0,0,0,0|1,0,1]=4 8044 B14R1.123 ClCCCCCOCc1ccccc1 34a_100000746330_100015291786 [1,1,0,0,0,0|2,0,0]=4 8045 B14R1.123 ClCCCCCOCc1ccccc1 7a_100000746330_100000211182 [1,1,0,0,0,0|2,0,0]=4 8046 B14R1.123 ClCCCCOCCc1ccccc1 34a_100000210776_100000765856 [1,1,0,0,0,0|0,0,1]=3 8047 B14R1.123 ClCCCCOCCc1ccccc1 7a_100000210776_100000765856 [1,1,0,0,0,0|0,0,1]=3 8048 B14R1.123 ClCCCCOCCc1ccccn1 7a_100000210776_100015183660 [1,1,0,0,0,0|1,0,1]=4 8049 B14R1.123 ClCCCCOCCc1cccnc1 7a_100000210776_200011713674 [1,1,0,0,0,0|1,0,1]=4 8050 B14R1.123 ClCCCCOCCc1ccncc1 7a_100000210776_100000723409 [1,1,0,0,0,0|1,0,1]=4 8051 B14R1.123 ClCCCOC/C=C/c1ccccc1 34a_100000230001_100016265936 [1,1,0,0,0,0|1,0,1]=4 8052 B14R1.123 ClCCCOCCCc1ccccc1 34a_100000230001_100000211621 [1,1,0,0,0,0|1,0,1]=4 8053 B14R1.123 ClCCCOCCOc1ccccc1 34a_100000230001_100000184471 [1,1,0,0,0,0|1,0,1]=4 8054 B14R1.123 ClCCCOCCSc1ccccc1 34a_100000230001_100000246102 [1,1,0,0,0,0|1,0,1]=4 8055 B14R1.123 ClCCCOCOCc1ccccc1 34a_100000230001_100000763385 [1,1,0,0,0,0|1,0,1]=4 8056 B14R1.123 ClCCCOCSCc1ccccc1 34a_100000230001_200011217039 [1,1,0,0,0,0|1,0,1]=4 8057 B14R1.123 FCCCCCNCc1ccccc1 2230a_100015324214_100000729378 [1,1,0,0,0,0|2,0,0]=4 8058 B14R1.123 FCCCCCNCc1ccccc1 34a_100015324214_100000729378 [1,1,0,0,0,0|2,0,0]=4 8059 B14R1.123 FCCCCCOCc1ccccc1 34a_100000210790_100000729378 [1,1,0,0,0,0|2,0,0]=4 8060 B14R1.123 FCCCCCOCc1ccccc1 7a_100000210790_100000729378 [1,1,0,0,0,0|2,0,0]=4 8061 B14R1.123 FCCCCCSCc1ccccc1 62a_100000211182_100000729378 [1,1,0,0,0,0|2,0,0]=4 8062 B14R1.123 FCCCCCSCc1ccccc1 62a_100000729378_100015291786 [1,1,0,0,0,0|2,0,0]=4 8063 B14R1.123 FCCCCNCCc1ccccc1 2230a_100000106460_100000729493 [1,1,0,0,0,0|1,0,1]=4 8064 B14R1.123 FCCCCNCCc1ccccc1 34a_100000106460_100000729493 [1,1,0,0,0,0|1,0,1]=4 8065 B14R1.123 FCCCCOCCc1ccccc1 34a_100000210268_100000729493 [1,1,0,0,0,0|0,0,1]=3 8066 B14R1.123 FCCCCOCCc1ccccc1 34a_100011995726_100000765856 [1,1,0,0,0,0|0,0,1]=3 8067 B14R1.123 FCCCCOCCc1ccccc1 7a_100000210268_100000729493 [1,1,0,0,0,0|0,0,1]=3 8068 B14R1.123 FCCCCOCCc1ccccc1 7a_100011995726_100000765856 [1,1,0,0,0,0|0,0,1]=3 8069 B14R1.123 FCCCCOCCc1ccccn1 34a_100000210271_100000729493 [1,1,0,0,0,0|1,0,1]=4 8070 B14R1.123 FCCCCOCCc1ccccn1 7a_100011995726_100015183660 [1,1,0,0,0,0|1,0,1]=4 8071 B14R1.123 FCCCCOCCc1cccnc1 34a_100011217484_100000729493 [1,1,0,0,0,0|1,0,1]=4 8072 B14R1.123 FCCCCOCCc1cccnc1 7a_100011995726_200011713674 [1,1,0,0,0,0|1,0,1]=4 8073 B14R1.123 FCCCCOCCc1ccncc1 34a_100011216225_100000729493 [1,1,0,0,0,0|1,0,1]=4 8074 B14R1.123 FCCCCOCCc1ccncc1 7a_100011995726_100000723409 [1,1,0,0,0,0|1,0,1]=4 8075 B14R1.123 FCCCCSCCc1ccccc1 62a_100000729493_100011218657 [1,1,0,0,0,0|0,1,1]=4 8076 B14R1.123 FCCCCSCCc1ccccc1 62a_100000765856_100000729493 [1,1,0,0,0,0|0,1,1]=4 8077 B14R1.123 FCCCOC/C=C/c1ccccc1 34a_100000210256_100011934791 [1,1,0,0,0,0|1,0,1]=4 8078 B14R1.123 FCCCOC/C=C/c1ccccc1 34a_100000759539_100016265936 [1,1,0,0,0,0|1,0,1]=4 8079 B14R1.123 FCCCOCCCc1ccccc1 34a_100000210828_100011934791 [1,1,0,0,0,0|1,0,1]=4 8080 B14R1.123 FCCCOCCCc1ccccc1 34a_100000759539_100000211621 [1,1,0,0,0,0|1,0,1]=4 8081 B14R1.123 FCCCOCCCc1ccccc1 7a_100000210828_100011934791 [1,1,0,0,0,0|1,0,1]=4 8082 B14R1.123 FCCCOCCNc1ccccc1 34a_100000211345_100011934791 [1,1,0,0,0,0|1,0,1]=4 8083 B14R1.123 FCCCOCCOc1ccccc1 34a_100000210260_100011934791 [1,1,0,0,0,0|1,0,1]=4 8084 B14R1.123 FCCCOCCOc1ccccc1 34a_100000759539_100000184471 [1,1,0,0,0,0|1,0,1]=4 8085 B14R1.123 FCCCOCCOc1ccccc1 7a_100000210260_100011934791 [1,1,0,0,0,0|1,0,1]=4 8086 B14R1.123 FCCCOCCSc1ccccc1 34a_100000759539_100000246102 [1,1,0,0,0,0|1,0,1]=4 8087 B14R1.123 FCCCOCCSc1ccccc1 7a_100000230494_100011934791 [1,1,0,0,0,0|1,0,1]=4 8088 B14R1.123 FCCCOCOCc1ccccc1 34a_100000759539_100000763385 [1,1,0,0,0,0|1,0,1]=4 8089 B14R1.123 FCCCOCSCc1ccccc1 34a_100000759539_200011217039 [1,1,0,0,0,0|1,0,1]=4 8090 B14R1.123 ICCCCCOCc1ccccc1 34a_200012148887_100015291786 [1,1,0,0,0,0|2,0,0]=4 8091 B14R1.123 ICCCCCOCc1ccccc1 7a_200012148887_100000211182 [1,1,0,0,0,0|2,0,0]=4 8092 B14R1.123 ICCCCOCCc1ccccc1 34a_200012148704_100000765856 [1,1,0,0,0,0|0,0,1]=3 8093 B14R1.123 N#CCCCOCCc1ccccc1 7a_100000210268_100000687738 [1,1,0,0,0,0|0,0,2]=4 8094 B14R1.123 NCCCCCOCc1ccccc1 34a_100000762737_100015291786 [1,1,0,0,0,0|2,0,0]=4 8095 B14R1.123 NCCCCOCCc1ccccc1 34a_100000750430_100000765856 [1,1,0,0,0,0|0,0,1]=3 8096 B14R1.123 NCCCOC/C=C/c1ccccc1 34a_100000182051_100016265936 [1,1,0,0,0,0|1,0,1]=4 8097 B14R1.123 NCCCOCCCc1ccccc1 34a_100000182051_100000211621 [1,1,0,0,0,0|1,0,1]=4 8098 B14R1.123 NCCCOCCOc1ccccc1 34a_100000182051_100000184471 [1,1,0,0,0,0|1,0,1]=4 8099 B14R1.123 NCCCOCCSc1ccccc1 34a_100000182051_100000246102 [1,1,0,0,0,0|1,0,1]=4 8100 B14R1.123 NCCCOCOCc1ccccc1 34a_100000182051_100000763385 [1,1,0,0,0,0|1,0,1]=4 8101 B14R1.123 NCCCOCSCc1ccccc1 34a_100000182051_200011217039 [1,1,0,0,0,0|1,0,1]=4 8102 B14R1.123 O=CCCCOCCc1ccccc1 7a_100000210268_200011292268 [1,1,0,0,0,0|0,0,2]=4 8103 B14R1.123 OCCCCCNCc1ccccc1 207a_100000762737_100015611070 [1,1,0,0,0,0|2,0,0]=4 8104 B14R1.123 OCCCCCNCc1ccccc1 2230a_100000762737_100015291786 [1,1,0,0,0,0|2,0,0]=4 8105 B14R1.123 OCCCCCNCc1ccccc1 2230a_100015324214_100000746330 [1,1,0,0,0,0|2,0,0]=4 8106 B14R1.123 OCCCCCNCc1ccccc1 270004a_100000762737_100015611070 [1,1,0,0,0,0|2,0,0]=4 8107 B14R1.123 OCCCCCNCc1ccccc1 34a_100000762737_100015291786 [1,1,0,0,0,0|2,0,0]=4 8108 B14R1.123 OCCCCCNCc1ccccc1 34a_100015324214_100000746330 [1,1,0,0,0,0|2,0,0]=4 8109 B14R1.123 OCCCCCOCc1ccccc1 34a_100000210790_100000746330 [1,1,0,0,0,0|2,0,0]=4 8110 B14R1.123 OCCCCCOCc1ccccc1 7a_100000210790_100000746330 [1,1,0,0,0,0|2,0,0]=4 8111 B14R1.123 OCCCCCSCc1ccccc1 62a_100000211182_100000746330 [1,1,0,0,0,0|2,0,0]=4 8112 B14R1.123 OCCCCCSCc1ccccc1 62a_100000746330_100015291786 [1,1,0,0,0,0|2,0,0]=4 8113 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000106460_100000210776 [1,1,0,0,0,0|1,0,1]=4 8114 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000750430_100000765856 [1,1,0,0,0,0|1,0,1]=4 8115 B14R1.123 OCCCCNCCc1ccccc1 34a_100000106460_100011216708 [1,1,0,0,0,0|1,0,1]=4 8116 B14R1.123 OCCCCNCCc1ccccc1 34a_100000750430_100000765856 [1,1,0,0,0,0|1,0,1]=4 8117 B14R1.123 OCCCCOCCc1ccccc1 34a_100000210268_100011216708 [1,1,0,0,0,0|0,0,1]=3 8118 B14R1.123 OCCCCOCCc1ccccc1 7a_100000210268_100000210776 [1,1,0,0,0,0|0,0,1]=3 8119 B14R1.123 OCCCCOCCc1ccccn1 34a_100000210271_100011216708 [1,1,0,0,0,0|1,0,1]=4 8120 B14R1.123 OCCCCOCCc1cccnc1 34a_100011217484_100011216708 [1,1,0,0,0,0|1,0,1]=4 8121 B14R1.123 OCCCCOCCc1ccncc1 34a_100011216225_100011216708 [1,1,0,0,0,0|1,0,1]=4 8122 B14R1.123 OCCCCSCCc1ccccc1 62a_100000210776_100011218657 [1,1,0,0,0,0|0,1,1]=4 8123 B14R1.123 OCCCCSCCc1ccccc1 62a_100000765856_100000210776 [1,1,0,0,0,0|0,1,1]=4 8124 B14R1.123 OCCCOC/C=C/c1ccccc1 34a_100000210256_100000230001 [1,1,0,0,0,0|1,0,1]=4 8125 B14R1.123 OCCCOCCCc1ccccc1 34a_100000210828_100000230001 [1,1,0,0,0,0|1,0,1]=4 8126 B14R1.123 OCCCOCCCc1ccccc1 7a_100000210828_100011215043 [1,1,0,0,0,0|1,0,1]=4 8127 B14R1.123 OCCCOCCNc1ccccc1 34a_100000211345_100000230001 [1,1,0,0,0,0|1,0,1]=4 8128 B14R1.123 OCCCOCCOc1ccccc1 34a_100000210260_100000230001 [1,1,0,0,0,0|1,0,1]=4 8129 B14R1.123 OCCCOCCOc1ccccc1 7a_100000210260_100011215043 [1,1,0,0,0,0|1,0,1]=4 8130 B14R1.123 OCCCOCCSc1ccccc1 7a_100000230494_100011215043 [1,1,0,0,0,0|1,0,1]=4 8131 B14R1.123 [13CH3]NCCCCOCc1ccccc1 2230a_100000748060_200025704644 [1,1,0,0,0,0|2,0,0]=4 8132 B14R1.123 [13CH3]NCCCCOCc1ccccc1 34a_100000748060_200025704644 [1,1,0,0,0,0|2,0,0]=4 8133 B14R1.123 [13CH3]OCCCCCCc1ccccc1 34a_100011215581_200025704644 [1,1,0,0,0,0|1,0,1]=4 8134 B14R1.123 [13CH3]OCCCCCCc1ccccc1 7a_100011215581_200025704644 [1,1,0,0,0,0|1,0,1]=4 8135 B14R1.123 [13CH3]OCCCCNCc1ccccc1 34a_100000186360_200025704644 [1,1,0,0,0,0|2,0,0]=4 8136 B14R1.123 [13CH3]OCCCCOCc1ccccc1 34a_100011215074_200025704644 [1,1,0,0,0,0|2,0,0]=4 8137 B14R1.123 [13CH3]OCCCCOCc1ccccc1 7a_100011215074_200025704644 [1,1,0,0,0,0|2,0,0]=4 8138 B14R1.123 [13CH3]OCCOCCOc1ccccc1 34a_100000756377_200025704644 [1,1,0,0,0,0|1,0,1]=4 8139 B14R1.123 [13CH3]OCCOCCOc1ccccc1 7a_100000756377_200025704644 [1,1,0,0,0,0|1,0,1]=4 8140 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_100011218729_200025704644 [1,1,0,0,0,0|1,0,1]=4 8141 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_200025704644_100011218729 [1,1,0,0,0,0|1,0,1]=4 8142 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_100011219843_200025704644 [1,1,0,0,0,0|2,0,0]=4 8143 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_200025704644_100011219843 [1,1,0,0,0,0|2,0,0]=4 8144 B14R1.156 CCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210211 [1,1,0,0,0,0|1,0,1]=4 8145 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210211 [1,1,0,0,0,0|1,0,1]=4 8146 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000210183_100000765856 [1,1,0,0,0,0|1,0,1]=4 8147 B14R1.156 CCCCC(=O)NCc1ccccc1 11a_100015324214_100000210183 [1,1,0,0,0,0|2,0,0]=4 8148 B14R1.156 CCCCC(=O)NCc1ccccc1 1626a_100015324214_100000210183 [1,1,0,0,0,0|2,0,0]=4 8149 B14R1.156 CCCCC(=O)NCc1ccccc1 240690a_100015324214_100000210183 [1,1,0,0,0,0|2,0,0]=4 8150 B14R1.156 CCCCC(=O)NCc1ccccc1 527a_100015324214_100000210183 [1,1,0,0,0,0|2,0,0]=4 8151 B14R1.156 CCCCC(C)NCc1ccccc1 207a_100000126638_100015611070 [1,1,0,0,0,0|2,0,0]=4 8152 B14R1.156 CCCCC(C)NCc1ccccc1 2230a_100000126638_100015291786 [1,1,0,0,0,0|2,0,0]=4 8153 B14R1.156 CCCCC(C)NCc1ccccc1 2230a_100015324214_200011215066 [1,1,0,0,0,0|2,0,0]=4 8154 B14R1.156 CCCCC(C)NCc1ccccc1 270004a_100000126638_100015611070 [1,1,0,0,0,0|2,0,0]=4 8155 B14R1.156 CCCCC(C)NCc1ccccc1 270004a_100015324214_100000210087 [1,1,0,0,0,0|2,0,0]=4 8156 B14R1.156 CCCCC(C)NCc1ccccc1 34a_100015324214_200011215066 [1,1,0,0,0,0|2,0,0]=4 8157 B14R1.156 CCCCC(C)OCc1ccccc1 34a_100000210790_200011215066 [1,1,0,0,0,0|2,0,0]=4 8158 B14R1.156 CCCCC(C)OCc1ccccc1 34a_100000687866_100015291786 [1,1,0,0,0,0|2,0,0]=4 8159 B14R1.156 CCCCC(C)OCc1ccccc1 7a_100000210790_200011215066 [1,1,0,0,0,0|2,0,0]=4 8160 B14R1.156 CCCCC(C)OCc1ccccc1 7a_100000687866_100000211182 [1,1,0,0,0,0|2,0,0]=4 8161 B14R1.156 CCCCC(C)SCc1ccccc1 62a_100000211182_200011215066 [1,1,0,0,0,0|2,0,0]=4 8162 B14R1.156 CCCCC(C)SCc1ccccc1 62a_200011215066_100015291786 [1,1,0,0,0,0|2,0,0]=4 8163 B14R1.156 CCCCN(C)CCc1ccccc1 2230a_100000207497_100000210211 [1,1,0,0,0,0|1,0,1]=4 8164 B14R1.156 CCCCN(C)CCc1ccccc1 2230a_100000207549_100000765856 [1,1,0,0,0,0|1,0,1]=4 8165 B14R1.156 CCCCN(C)CCc1ccccc1 269982a_100000207497_100000210211 [1,1,0,0,0,0|1,0,1]=4 8166 B14R1.156 CCCCN(C)CCc1ccccc1 269982a_100000207549_100000765856 [1,1,0,0,0,0|1,0,1]=4 8167 B14R1.422 C=C(C)CCOCCc1ccccc1 34a_100000210268_100000730704 [1,1,0,0,0,0|0,0,2]=4 8168 B14R1.422 C=C(C)CCOCCc1ccccc1 34a_100000764851_100000765856 [1,1,0,0,0,0|0,0,2]=4 8169 B14R1.422 C=C(C)CCOCCc1ccccc1 7a_100000210268_100000730704 [1,1,0,0,0,0|0,0,2]=4 8170 B14R1.422 CC(=O)CCOCCc1ccccc1 34a_100000759926_100000765856 [1,1,0,0,0,0|0,0,2]=4 8171 B14R1.422 CC(=O)CCOCCc1ccccc1 7a_100000210268_100000053229 [1,1,0,0,0,0|0,0,2]=4 8172 B14R1.422 CC(=O)CCOCCc1ccccc1 7a_100000759926_100000765856 [1,1,0,0,0,0|0,0,2]=4 8173 B14R1.422 CC(Br)CCOCCc1ccccc1 34a_100009893172_100000765856 [1,1,0,0,0,0|0,0,1]=3 8174 B14R1.422 CC(C)CCCNCc1ccccc1 207a_200000737386_100015611070 [1,1,0,0,0,0|2,0,0]=4 8175 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_100015324214_100011214892 [1,1,0,0,0,0|2,0,0]=4 8176 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_200000737386_100015291786 [1,1,0,0,0,0|2,0,0]=4 8177 B14R1.422 CC(C)CCCNCc1ccccc1 270004a_200000737386_100015611070 [1,1,0,0,0,0|2,0,0]=4 8178 B14R1.422 CC(C)CCCNCc1ccccc1 34a_100015324214_100011214892 [1,1,0,0,0,0|2,0,0]=4 8179 B14R1.422 CC(C)CCCNCc1ccccc1 34a_200000737386_100015291786 [1,1,0,0,0,0|2,0,0]=4 8180 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210774_100015291786 [1,1,0,0,0,0|2,0,0]=4 8181 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210790_100011214892 [1,1,0,0,0,0|2,0,0]=4 8182 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210774_100000211182 [1,1,0,0,0,0|2,0,0]=4 8183 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210790_100011214892 [1,1,0,0,0,0|2,0,0]=4 8184 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100000211182_100011214892 [1,1,0,0,0,0|2,0,0]=4 8185 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100011214892_100015291786 [1,1,0,0,0,0|2,0,0]=4 8186 B14R1.422 CC(C)CCNCCc1ccccc1 2230a_100000106460_100000210312 [1,1,0,0,0,0|1,0,1]=4 8187 B14R1.422 CC(C)CCNCCc1ccccc1 269862a_100000106460_100000185833 [1,1,0,0,0,0|1,0,1]=4 8188 B14R1.422 CC(C)CCNCCc1ccccc1 34a_100000106460_100000210312 [1,1,0,0,0,0|1,0,1]=4 8189 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210254_100000765856 [1,1,0,0,0,0|0,0,1]=3 8190 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210268_100000210312 [1,1,0,0,0,0|0,0,1]=3 8191 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210254_100000765856 [1,1,0,0,0,0|0,0,1]=3 8192 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210268_100000210626 [1,1,0,0,0,0|0,0,1]=3 8193 B14R1.422 CC(C)CCOCCc1ccccn1 34a_100000210271_100000210312 [1,1,0,0,0,0|1,0,1]=4 8194 B14R1.422 CC(C)CCOCCc1ccccn1 7a_100000210254_100015183660 [1,1,0,0,0,0|1,0,1]=4 8195 B14R1.422 CC(C)CCOCCc1cccnc1 34a_100011217484_100000210312 [1,1,0,0,0,0|1,0,1]=4 8196 B14R1.422 CC(C)CCOCCc1cccnc1 7a_100000210254_200011713674 [1,1,0,0,0,0|1,0,1]=4 8197 B14R1.422 CC(C)CCOCCc1ccncc1 34a_100011216225_100000210312 [1,1,0,0,0,0|1,0,1]=4 8198 B14R1.422 CC(C)CCOCCc1ccncc1 7a_100000210254_100000723409 [1,1,0,0,0,0|1,0,1]=4 8199 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000210312_100011218657 [1,1,0,0,0,0|0,1,1]=4 8200 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000765856_100000210312 [1,1,0,0,0,0|0,1,1]=4 8201 B14R1.422 CC(C)OCOCCc1ccccc1 34a_100000210268_100000709892 [1,1,0,0,0,0|1,0,1]=4 8202 B14R1.422 CC(O)CCCNCc1ccccc1 2230a_100015324214_200000718107 [1,1,0,0,0,0|2,0,0]=4 8203 B14R1.422 CC(O)CCCNCc1ccccc1 34a_100015324214_200000718107 [1,1,0,0,0,0|2,0,0]=4 8204 B14R1.422 CC(O)CCCOCc1ccccc1 34a_100000210790_200000718107 [1,1,0,0,0,0|2,0,0]=4 8205 B14R1.422 CC(O)CCCOCc1ccccc1 7a_100000210790_200000718107 [1,1,0,0,0,0|2,0,0]=4 8206 B14R1.422 CC(O)CCCSCc1ccccc1 62a_100000211182_200000718107 [1,1,0,0,0,0|2,0,0]=4 8207 B14R1.422 CC(O)CCCSCc1ccccc1 62a_200000718107_100015291786 [1,1,0,0,0,0|2,0,0]=4 8208 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_100000106460_100012276601 [1,1,0,0,0,0|1,0,1]=4 8209 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_200000755665_100000765856 [1,1,0,0,0,0|1,0,1]=4 8210 B14R1.422 CC(O)CCNCCc1ccccc1 34a_100000106460_100012276601 [1,1,0,0,0,0|1,0,1]=4 8211 B14R1.422 CC(O)CCOCCc1ccccc1 34a_100000210268_100012276601 [1,1,0,0,0,0|0,0,1]=3 8212 B14R1.422 CC(O)CCOCCc1ccccc1 7a_100000210268_100012276601 [1,1,0,0,0,0|0,0,1]=3 8213 B14R1.422 CC(O)CCOCCc1ccccn1 34a_100000210271_100012276601 [1,1,0,0,0,0|1,0,1]=4 8214 B14R1.422 CC(O)CCOCCc1cccnc1 34a_100011217484_100012276601 [1,1,0,0,0,0|1,0,1]=4 8215 B14R1.422 CC(O)CCOCCc1ccncc1 34a_100011216225_100012276601 [1,1,0,0,0,0|1,0,1]=4 8216 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100000765856_100012276601 [1,1,0,0,0,0|0,1,1]=4 8217 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100012276601_100011218657 [1,1,0,0,0,0|0,1,1]=4 8218 B14R1.422 CC(O)CNN=CCc1ccccc1 4a_200000730056_100000209964 [1,1,0,0,0,0|2,0,0]=4 8219 B14R1.422 CN(C)CCOCCc1ccccc1 7a_100000210268_100000755713 [1,1,0,0,0,0|1,0,1]=4 8220 B14R1.422 C[C@@H](N)CCOCCc1ccccc1 34a_100000706166_100000765856 [1,1,0,0,0,0|0,0,1]=3 8221 B14R1.422 FC(F)CCOCCc1ccccc1 34a_100103093639_100000765856 [1,1,0,0,0,0|1,0,1]=4 8222 B14R1.520 CC(CCBr)OCCc1ccccc1 34a_100012276601_100000765856 [1,1,0,0,0,0|1,0,1]=4 8223 B14R1.520 CC(CCO)OCCc1ccccc1 34a_100000210268_100009893172 [1,1,0,0,0,0|1,0,1]=4 8224 B14R1.520 CC(CCO)OCCc1ccccc1 7a_100000210268_100009893172 [1,1,0,0,0,0|1,0,1]=4 8225 B14R1.520 CCCC(C)CNCc1ccccc1 2230a_100015324214_100011216630 [1,1,0,0,0,0|2,0,0]=4 8226 B14R1.520 CCCC(C)CNCc1ccccc1 270004a_100015324214_100000243154 [1,1,0,0,0,0|2,0,0]=4 8227 B14R1.520 CCCC(C)CNCc1ccccc1 34a_100015324214_100011216630 [1,1,0,0,0,0|2,0,0]=4 8228 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000210790_100011216630 [1,1,0,0,0,0|2,0,0]=4 8229 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000688023_100015291786 [1,1,0,0,0,0|2,0,0]=4 8230 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000210790_100011216630 [1,1,0,0,0,0|2,0,0]=4 8231 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000688023_100000211182 [1,1,0,0,0,0|2,0,0]=4 8232 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100000211182_100011216630 [1,1,0,0,0,0|2,0,0]=4 8233 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100011216630_100015291786 [1,1,0,0,0,0|2,0,0]=4 8234 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000106460_100000766640 [1,1,0,0,0,0|1,0,1]=4 8235 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000741246_100000765856 [1,1,0,0,0,0|1,0,1]=4 8236 B14R1.520 CCCC(C)NCCc1ccccc1 270004a_100000106460_100000211909 [1,1,0,0,0,0|1,0,1]=4 8237 B14R1.520 CCCC(C)NCCc1ccccc1 34a_100000106460_100000766640 [1,1,0,0,0,0|1,0,1]=4 8238 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000210268_100000766640 [1,1,0,0,0,0|0,0,1]=3 8239 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000764384_100000765856 [1,1,0,0,0,0|0,0,1]=3 8240 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000210268_100000766640 [1,1,0,0,0,0|0,0,1]=3 8241 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000764384_100000765856 [1,1,0,0,0,0|0,0,1]=3 8242 B14R1.520 CCCC(C)OCCc1ccccn1 34a_100000210271_100000766640 [1,1,0,0,0,0|1,0,1]=4 8243 B14R1.520 CCCC(C)OCCc1ccccn1 7a_100000764384_100015183660 [1,1,0,0,0,0|1,0,1]=4 8244 B14R1.520 CCCC(C)OCCc1cccnc1 34a_100011217484_100000766640 [1,1,0,0,0,0|1,0,1]=4 8245 B14R1.520 CCCC(C)OCCc1cccnc1 7a_100000764384_200011713674 [1,1,0,0,0,0|1,0,1]=4 8246 B14R1.520 CCCC(C)OCCc1ccncc1 34a_100011216225_100000766640 [1,1,0,0,0,0|1,0,1]=4 8247 B14R1.520 CCCC(C)OCCc1ccncc1 7a_100000764384_100000723409 [1,1,0,0,0,0|1,0,1]=4 8248 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000765856_100000766640 [1,1,0,0,0,0|0,1,1]=4 8249 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000766640_100011218657 [1,1,0,0,0,0|0,1,1]=4 8250 B14R1.520 CCC[C@H](N)COCc1ccccc1 34a_100000732646_100015291786 [1,1,0,0,0,0|2,0,0]=4 8251 B14R1.520 COCC(C)OCCc1ccccc1 34a_100000210268_100000765312 [1,1,0,0,0,0|1,0,1]=4 8252 B14R1.520 COCC(C)OCCc1ccccc1 7a_100000210268_100000765312 [1,1,0,0,0,0|1,0,1]=4 8253 B14R1.520 COC[C@@H](C)OCCc1ccccc1 34a_100011934205_100000765856 [1,1,0,0,0,0|1,0,1]=4 8254 B14R1.716 CC(CN)COCCc1ccccc1 34a_100000744482_100000765856 [1,1,0,0,0,0|1,0,1]=4 8255 B14R1.716 CCC(=O)COCCc1ccccc1 34a_100000725409_100000765856 [1,1,0,0,0,0|0,0,2]=4 8256 B14R1.716 CCC(=O)COCCc1ccccc1 7a_100000210268_100000747405 [1,1,0,0,0,0|0,0,2]=4 8257 B14R1.716 CCC(C)CCNCc1ccccc1 207a_100020591266_100015611070 [1,1,0,0,0,0|2,0,0]=4 8258 B14R1.716 CCC(C)CCNCc1ccccc1 2230a_100020591266_100015291786 [1,1,0,0,0,0|2,0,0]=4 8259 B14R1.716 CCC(C)CCNCc1ccccc1 270004a_100020591266_100015611070 [1,1,0,0,0,0|2,0,0]=4 8260 B14R1.716 CCC(C)CCOCc1ccccc1 7a_100011215188_100000211182 [1,1,0,0,0,0|2,0,0]=4 8261 B14R1.716 CCC(C)CNCCc1ccccc1 2230a_100000106460_100000748023 [1,1,0,0,0,0|1,0,1]=4 8262 B14R1.716 CCC(C)CNCCc1ccccc1 2230a_100020588543_100000765856 [1,1,0,0,0,0|1,0,1]=4 8263 B14R1.716 CCC(C)CNCCc1ccccc1 270004a_100000106460_100000243153 [1,1,0,0,0,0|1,0,1]=4 8264 B14R1.716 CCC(C)CNCCc1ccccc1 34a_100000106460_100000748023 [1,1,0,0,0,0|1,0,1]=4 8265 B14R1.716 CCC(C)COCCc1ccccc1 34a_100000210268_100000748023 [1,1,0,0,0,0|0,0,1]=3 8266 B14R1.716 CCC(C)COCCc1ccccc1 7a_100000210268_100000748023 [1,1,0,0,0,0|0,0,1]=3 8267 B14R1.716 CCC(C)COCCc1ccccn1 34a_100000210271_100000748023 [1,1,0,0,0,0|1,0,1]=4 8268 B14R1.716 CCC(C)COCCc1cccnc1 34a_100011217484_100000748023 [1,1,0,0,0,0|1,0,1]=4 8269 B14R1.716 CCC(C)COCCc1ccncc1 34a_100011216225_100000748023 [1,1,0,0,0,0|1,0,1]=4 8270 B14R1.716 CCC(C)CSCCc1ccccc1 62a_100000748023_100011218657 [1,1,0,0,0,0|0,1,1]=4 8271 B14R1.716 CCC(C)CSCCc1ccccc1 62a_100000765856_100000748023 [1,1,0,0,0,0|0,1,1]=4 8272 B14R1.716 CCC(C)NN=CCc1ccccc1 4a_100000718999_100000209964 [1,1,0,0,0,0|2,0,0]=4 8273 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100000106460_100011218378 [1,1,0,0,0,0|1,0,1]=4 8274 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100011218483_100000765856 [1,1,0,0,0,0|1,0,1]=4 8275 B14R1.716 CCC(O)CNCCc1ccccc1 34a_100000106460_100011218378 [1,1,0,0,0,0|1,0,1]=4 8276 B14R1.716 CCC(O)COCCc1ccccc1 34a_100000210268_100011218378 [1,1,0,0,0,0|0,0,1]=3 8277 B14R1.716 CCC(O)COCCc1ccccc1 7a_100000210268_100011218378 [1,1,0,0,0,0|0,0,1]=3 8278 B14R1.716 CCC(O)COCCc1ccccn1 34a_100000210271_100011218378 [1,1,0,0,0,0|1,0,1]=4 8279 B14R1.716 CCC(O)COCCc1cccnc1 34a_100011217484_100011218378 [1,1,0,0,0,0|1,0,1]=4 8280 B14R1.716 CCC(O)COCCc1ccncc1 34a_100011216225_100011218378 [1,1,0,0,0,0|1,0,1]=4 8281 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100000765856_100011218378 [1,1,0,0,0,0|0,1,1]=4 8282 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100011218378_100011218657 [1,1,0,0,0,0|0,1,1]=4 8283 B14R1.716 CC[C@H](C)CNCCc1ccccc1 2230a_100000106460_100009816398 [1,1,0,0,0,0|1,0,1]=4 8284 B14R1.716 CC[C@H](C)CNCCc1ccccc1 34a_100000106460_100009816398 [1,1,0,0,0,0|1,0,1]=4 8285 B14R1.716 CC[C@H](C)COCCc1ccccc1 34a_100000210268_100009816398 [1,1,0,0,0,0|0,0,1]=3 8286 B14R1.716 CC[C@H](C)COCCc1ccccc1 7a_100000210268_100009816398 [1,1,0,0,0,0|0,0,1]=3 8287 B14R1.716 CC[C@H](C)COCCc1ccccc1 7a_100009816381_100000765856 [1,1,0,0,0,0|0,0,1]=3 8288 B14R1.716 CC[C@H](C)COCCc1ccccn1 34a_100000210271_100009816398 [1,1,0,0,0,0|1,0,1]=4 8289 B14R1.716 CC[C@H](C)COCCc1ccccn1 7a_100009816381_100015183660 [1,1,0,0,0,0|1,0,1]=4 8290 B14R1.716 CC[C@H](C)COCCc1cccnc1 34a_100011217484_100009816398 [1,1,0,0,0,0|1,0,1]=4 8291 B14R1.716 CC[C@H](C)COCCc1cccnc1 7a_100009816381_200011713674 [1,1,0,0,0,0|1,0,1]=4 8292 B14R1.716 CC[C@H](C)COCCc1ccncc1 34a_100011216225_100009816398 [1,1,0,0,0,0|1,0,1]=4 8293 B14R1.716 CC[C@H](C)COCCc1ccncc1 7a_100009816381_100000723409 [1,1,0,0,0,0|1,0,1]=4 8294 B14R1.716 CC[C@H](C)CSCCc1ccccc1 62a_100000765856_100009816398 [1,1,0,0,0,0|0,1,1]=4 8295 B14R1.716 CC[C@H](C)CSCCc1ccccc1 62a_100009816398_100011218657 [1,1,0,0,0,0|0,1,1]=4 8296 B14R1.716 COC(C)COCCc1ccccc1 34a_100000690652_100000765856 [1,1,0,0,0,0|1,0,1]=4 8297 B14R1.716 C[C@@H](CO)COCCc1ccccc1 34a_100000210268_100000059175 [1,1,0,0,0,0|1,0,1]=4 8298 B14R1.716 C[C@@H](CO)COCCc1ccccc1 7a_100000210268_100000059175 [1,1,0,0,0,0|1,0,1]=4 8299 B14R1.716 ClCC(Cl)COCCc1ccccc1 34a_100000033668_100000765856 [1,1,0,0,0,0|1,0,1]=4 8300 B14R1.716 NC[C@@H](F)COCCc1ccccc1 34a_100015665980_100000765856 [1,1,0,0,0,0|1,0,1]=4 8301 B14R1.716 OCC(O)COCCc1ccccc1 34a_100000210268_100011219619 [1,1,0,0,0,0|1,0,1]=4 8302 B14R1.716 OCC(O)COCCc1ccccc1 7a_100000210268_100011219619 [1,1,0,0,0,0|1,0,1]=4 8303 B14R1.716 OC[C@H](O)COCCc1ccccc1 34a_100000210268_100009815848 [1,1,0,0,0,0|1,0,1]=4 8304 B14R1.716 OC[C@H](O)COCCc1ccccc1 7a_100000210268_100009815848 [1,1,0,0,0,0|1,0,1]=4 8305 B14R1.716 O[C@@H](CF)COCCc1ccccc1 34a_100000210268_100015614560 [1,1,0,0,0,0|1,0,1]=4 8306 B14R1.716 O[C@@H](CF)COCCc1ccccc1 7a_100000210268_100015614560 [1,1,0,0,0,0|1,0,1]=4 8307 B14R1.882 BrCCCOCCc1ccccc1Br 34a_100011217188_100012161201 [1,1,0,0,0,0|1,0,1]=4 8308 B14R1.882 CCCCCC=Cc1ccccc1Br 271570a_100000062253_100000695589 [1,1,0,0,0,0|1,0,1]=4 8309 B14R1.882 CCCCCC=Cc1ccccc1C 271570a_100000062253_100000210755 [1,1,0,0,0,0|1,0,1]=4 8310 B14R1.882 CCCCCC=Cc1ccccc1Cl 271570a_100000062253_100000764095 [1,1,0,0,0,0|1,0,1]=4 8311 B14R1.882 CCCCCC=Cc1ccccc1F 271570a_100000062253_100011215700 [1,1,0,0,0,0|1,0,1]=4 8312 B14R1.882 CCCCCC=Cc1ccccc1N 271570a_100000062253_100000210017 [1,1,0,0,0,0|1,0,1]=4 8313 B14R1.882 CCCCCC=Cc1ccccc1O 271570a_100000062253_100000739446 [1,1,0,0,0,0|1,0,1]=4 8314 B14R1.882 CCCCCNCc1ccccc1Br 207a_100000209983_100000211189 [1,1,0,0,0,0|2,0,0]=4 8315 B14R1.882 CCCCCNCc1ccccc1Br 2230a_100000209983_100000184730 [1,1,0,0,0,0|2,0,0]=4 8316 B14R1.882 CCCCCNCc1ccccc1Br 2230a_100000689332_100000210326 [1,1,0,0,0,0|2,0,0]=4 8317 B14R1.882 CCCCCNCc1ccccc1Br 270004a_100000209983_100000211189 [1,1,0,0,0,0|2,0,0]=4 8318 B14R1.882 CCCCCNCc1ccccc1Br 34a_100000689332_100000718602 [1,1,0,0,0,0|2,0,0]=4 8319 B14R1.882 CCCCCNCc1ccccc1C 207a_100000209983_100000211143 [1,1,0,0,0,0|2,0,0]=4 8320 B14R1.882 CCCCCNCc1ccccc1C 2230a_100000209983_100000211839 [1,1,0,0,0,0|2,0,0]=4 8321 B14R1.882 CCCCCNCc1ccccc1C 270004a_100000209983_100000211143 [1,1,0,0,0,0|2,0,0]=4 8322 B14R1.882 CCCCCNCc1ccccc1C 34a_100000174972_100000718602 [1,1,0,0,0,0|2,0,0]=4 8323 B14R1.882 CCCCCNCc1ccccc1Cl 207a_100000209983_100000210073 [1,1,0,0,0,0|2,0,0]=4 8324 B14R1.882 CCCCCNCc1ccccc1Cl 2230a_100000174879_100000210326 [1,1,0,0,0,0|2,0,0]=4 8325 B14R1.882 CCCCCNCc1ccccc1Cl 2230a_100000209983_100000187162 [1,1,0,0,0,0|2,0,0]=4 8326 B14R1.882 CCCCCNCc1ccccc1Cl 270004a_100000209983_100000210073 [1,1,0,0,0,0|2,0,0]=4 8327 B14R1.882 CCCCCNCc1ccccc1Cl 34a_100000174879_100000718602 [1,1,0,0,0,0|2,0,0]=4 8328 B14R1.882 CCCCCNCc1ccccc1F 207a_100000209983_100000210811 [1,1,0,0,0,0|2,0,0]=4 8329 B14R1.882 CCCCCNCc1ccccc1F 2230a_100000209983_100000211605 [1,1,0,0,0,0|2,0,0]=4 8330 B14R1.882 CCCCCNCc1ccccc1F 270004a_100000209983_100000210811 [1,1,0,0,0,0|2,0,0]=4 8331 B14R1.882 CCCCCNCc1ccccc1F 34a_100000174869_100000718602 [1,1,0,0,0,0|2,0,0]=4 8332 B14R1.882 CCCCCNCc1ccccc1I 207a_100000209983_100000010305 [1,1,0,0,0,0|2,0,0]=4 8333 B14R1.882 CCCCCNCc1ccccc1I 2230a_100000209983_100011215278 [1,1,0,0,0,0|2,0,0]=4 8334 B14R1.882 CCCCCNCc1ccccc1I 270004a_100000209983_100000010305 [1,1,0,0,0,0|2,0,0]=4 8335 B14R1.882 CCCCCNCc1ccccc1O 34a_100000185550_100000718602 [1,1,0,0,0,0|2,0,0]=4 8336 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000210253_100000184730 [1,1,0,0,0,0|2,0,0]=4 8337 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000756307_100000718602 [1,1,0,0,0,0|2,0,0]=4 8338 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000210253_100000184730 [1,1,0,0,0,0|2,0,0]=4 8339 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000756307_100000210326 [1,1,0,0,0,0|2,0,0]=4 8340 B14R1.882 CCCCCOCc1ccccc1C 34a_100000210253_100000211839 [1,1,0,0,0,0|2,0,0]=4 8341 B14R1.882 CCCCCOCc1ccccc1C 34a_100000698903_100000718602 [1,1,0,0,0,0|2,0,0]=4 8342 B14R1.882 CCCCCOCc1ccccc1C 7a_100000210253_100000211839 [1,1,0,0,0,0|2,0,0]=4 8343 B14R1.882 CCCCCOCc1ccccc1C 7a_100000698903_100000210326 [1,1,0,0,0,0|2,0,0]=4 8344 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210253_100000187162 [1,1,0,0,0,0|2,0,0]=4 8345 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210847_100000718602 [1,1,0,0,0,0|2,0,0]=4 8346 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210253_100000187162 [1,1,0,0,0,0|2,0,0]=4 8347 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210847_100000210326 [1,1,0,0,0,0|2,0,0]=4 8348 B14R1.882 CCCCCOCc1ccccc1F 34a_100000210253_100000211605 [1,1,0,0,0,0|2,0,0]=4 8349 B14R1.882 CCCCCOCc1ccccc1F 34a_100000211962_100000718602 [1,1,0,0,0,0|2,0,0]=4 8350 B14R1.882 CCCCCOCc1ccccc1F 7a_100000210253_100000211605 [1,1,0,0,0,0|2,0,0]=4 8351 B14R1.882 CCCCCOCc1ccccc1F 7a_100000211962_100000210326 [1,1,0,0,0,0|2,0,0]=4 8352 B14R1.882 CCCCCOCc1ccccc1I 34a_100000187465_100000718602 [1,1,0,0,0,0|2,0,0]=4 8353 B14R1.882 CCCCCOCc1ccccc1I 34a_100000210253_100011215278 [1,1,0,0,0,0|2,0,0]=4 8354 B14R1.882 CCCCCOCc1ccccc1I 7a_100000187465_100000210326 [1,1,0,0,0,0|2,0,0]=4 8355 B14R1.882 CCCCCOCc1ccccc1I 7a_100000210253_100011215278 [1,1,0,0,0,0|2,0,0]=4 8356 B14R1.882 CCCCCOCc1ccccc1N 34a_100000212039_100000718602 [1,1,0,0,0,0|2,0,0]=4 8357 B14R1.882 CCCCCSCc1ccccc1Br 62a_100000184730_100000210326 [1,1,0,0,0,0|2,0,0]=4 8358 B14R1.882 CCCCCSCc1ccccc1Br 62a_100000210326_100000184730 [1,1,0,0,0,0|2,0,0]=4 8359 B14R1.882 CCCCCSCc1ccccc1C 62a_100000210326_100000211839 [1,1,0,0,0,0|2,0,0]=4 8360 B14R1.882 CCCCCSCc1ccccc1C 62a_100000211839_100000210326 [1,1,0,0,0,0|2,0,0]=4 8361 B14R1.882 CCCCCSCc1ccccc1Cl 62a_100000187162_100000210326 [1,1,0,0,0,0|2,0,0]=4 8362 B14R1.882 CCCCCSCc1ccccc1Cl 62a_100000210326_100000187162 [1,1,0,0,0,0|2,0,0]=4 8363 B14R1.882 CCCCCSCc1ccccc1F 62a_100000210326_100000211605 [1,1,0,0,0,0|2,0,0]=4 8364 B14R1.882 CCCCCSCc1ccccc1F 62a_100000211605_100000210326 [1,1,0,0,0,0|2,0,0]=4 8365 B14R1.882 CCCCCSCc1ccccc1I 62a_100000210326_100011216222 [1,1,0,0,0,0|2,0,0]=4 8366 B14R1.882 CCCCCSCc1ccccc1I 62a_100011216222_100000210326 [1,1,0,0,0,0|2,0,0]=4 8367 B14R1.882 CCCCNCCc1ccccc1Br 2230a_100000102301_100012161201 [1,1,0,0,0,0|1,0,1]=4 8368 B14R1.882 CCCCNCCc1ccccc1Br 2230a_100000747383_100000210211 [1,1,0,0,0,0|1,0,1]=4 8369 B14R1.882 CCCCNCCc1ccccc1Br 34a_100000747383_100000210210 [1,1,0,0,0,0|1,0,1]=4 8370 B14R1.882 CCCCNCCc1ccccc1Br 7a_106832991798_100012161201 [1,1,0,0,0,0|1,0,1]=4 8371 B14R1.882 CCCCNCCc1ccccc1C 2230a_100000102301_100011713688 [1,1,0,0,0,0|1,0,1]=4 8372 B14R1.882 CCCCNCCc1ccccc1C 2230a_100000685071_100000210211 [1,1,0,0,0,0|1,0,1]=4 8373 B14R1.882 CCCCNCCc1ccccc1C 34a_100000685071_100000210210 [1,1,0,0,0,0|1,0,1]=4 8374 B14R1.882 CCCCNCCc1ccccc1C 7a_106832991798_100011713688 [1,1,0,0,0,0|1,0,1]=4 8375 B14R1.882 CCCCNCCc1ccccc1Cl 2230a_100000102301_100011713703 [1,1,0,0,0,0|1,0,1]=4 8376 B14R1.882 CCCCNCCc1ccccc1Cl 2230a_100011207228_100000210211 [1,1,0,0,0,0|1,0,1]=4 8377 B14R1.882 CCCCNCCc1ccccc1Cl 270004a_100000102301_200011713468 [1,1,0,0,0,0|1,0,1]=4 8378 B14R1.882 CCCCNCCc1ccccc1Cl 34a_100011207228_100000210210 [1,1,0,0,0,0|1,0,1]=4 8379 B14R1.882 CCCCNCCc1ccccc1Cl 7a_106832991798_100011713703 [1,1,0,0,0,0|1,0,1]=4 8380 B14R1.882 CCCCNCCc1ccccc1F 2230a_100000102301_100011713696 [1,1,0,0,0,0|1,0,1]=4 8381 B14R1.882 CCCCNCCc1ccccc1F 2230a_100000185272_100000210211 [1,1,0,0,0,0|1,0,1]=4 8382 B14R1.882 CCCCNCCc1ccccc1F 34a_100000185272_100000210210 [1,1,0,0,0,0|1,0,1]=4 8383 B14R1.882 CCCCNCCc1ccccc1F 7a_106832991798_100000720011 [1,1,0,0,0,0|1,0,1]=4 8384 B14R1.882 CCCCNCCc1ccccc1O 34a_100011207237_100000210210 [1,1,0,0,0,0|1,0,1]=4 8385 B14R1.882 CCCCNCCc1ccccc1O 7a_106832991798_100000722297 [1,1,0,0,0,0|1,0,1]=4 8386 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000210227_100012161201 [1,1,0,0,0,0|0,0,1]=3 8387 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000731337_100000210210 [1,1,0,0,0,0|0,0,1]=3 8388 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000210227_100012161201 [1,1,0,0,0,0|0,0,1]=3 8389 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000731337_100000210211 [1,1,0,0,0,0|0,0,1]=3 8390 B14R1.882 CCCCOCCc1ccccc1C 34a_100000210227_100011713688 [1,1,0,0,0,0|0,0,1]=3 8391 B14R1.882 CCCCOCCc1ccccc1C 34a_100011220023_100000210210 [1,1,0,0,0,0|0,0,1]=3 8392 B14R1.882 CCCCOCCc1ccccc1C 7a_100000210227_100011713688 [1,1,0,0,0,0|0,0,1]=3 8393 B14R1.882 CCCCOCCc1ccccc1C 7a_100011220023_100000210211 [1,1,0,0,0,0|0,0,1]=3 8394 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100000210227_100011713703 [1,1,0,0,0,0|0,0,1]=3 8395 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100011215284_100000210210 [1,1,0,0,0,0|0,0,1]=3 8396 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100000210227_100011713703 [1,1,0,0,0,0|0,0,1]=3 8397 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100011215284_100000210211 [1,1,0,0,0,0|0,0,1]=3 8398 B14R1.882 CCCCOCCc1ccccc1F 34a_100000210227_100000720011 [1,1,0,0,0,0|0,0,1]=3 8399 B14R1.882 CCCCOCCc1ccccc1F 34a_100000753711_100000210210 [1,1,0,0,0,0|0,0,1]=3 8400 B14R1.882 CCCCOCCc1ccccc1F 7a_100000210227_100000720011 [1,1,0,0,0,0|0,0,1]=3 8401 B14R1.882 CCCCOCCc1ccccc1F 7a_100000753711_100000210211 [1,1,0,0,0,0|0,0,1]=3 8402 B14R1.882 CCCCOCCc1ccccc1I 34a_100010255290_100000210210 [1,1,0,0,0,0|0,0,1]=3 8403 B14R1.882 CCCCOCCc1ccccc1I 7a_100010255290_100000210211 [1,1,0,0,0,0|0,0,1]=3 8404 B14R1.882 CCCCOCCc1ccccc1N 34a_100011215289_100000210210 [1,1,0,0,0,0|0,0,1]=3 8405 B14R1.882 CCCCOCCc1ccccc1O 34a_100000210227_100000722297 [1,1,0,0,0,0|0,0,1]=3 8406 B14R1.882 CCCCOCCc1ccccc1O 7a_100000210227_100000722297 [1,1,0,0,0,0|0,0,1]=3 8407 B14R1.882 CCCCOCCc1ncccc1C 34a_100011997706_100000210210 [1,1,0,0,0,0|1,0,1]=4 8408 B14R1.882 CCCCOCCc1ncccc1C 7a_100011997706_100000210211 [1,1,0,0,0,0|1,0,1]=4 8409 B14R1.882 CCCCOCNc1ccccc1Br 34a_100000210017_100011995733 [1,1,0,0,0,0|1,0,1]=4 8410 B14R1.882 CCCCOCNc1ccccc1C 34a_100015192222_100011995733 [1,1,0,0,0,0|1,0,1]=4 8411 B14R1.882 CCCCOCNc1ccccc1Cl 34a_100000185783_100011995733 [1,1,0,0,0,0|1,0,1]=4 8412 B14R1.882 CCCCOCNc1ccccc1F 34a_100000210422_100011995733 [1,1,0,0,0,0|1,0,1]=4 8413 B14R1.882 CCCCOCNc1ccccc1I 34a_100000210053_100011995733 [1,1,0,0,0,0|1,0,1]=4 8414 B14R1.882 CCCCOCNc1ccccc1O 34a_100000185747_100011995733 [1,1,0,0,0,0|1,0,1]=4 8415 B14R1.882 CCCCOCOc1ccccc1Br 34a_100000181306_100011995733 [1,1,0,0,0,0|1,0,1]=4 8416 B14R1.882 CCCCOCOc1ccccc1C 34a_100000210338_100011995733 [1,1,0,0,0,0|1,0,1]=4 8417 B14R1.882 CCCCOCOc1ccccc1Cl 34a_100000210172_100011995733 [1,1,0,0,0,0|1,0,1]=4 8418 B14R1.882 CCCCOCOc1ccccc1F 34a_100000210171_100011995733 [1,1,0,0,0,0|1,0,1]=4 8419 B14R1.882 CCCCOCOc1ccccc1I 34a_100000739446_100011995733 [1,1,0,0,0,0|1,0,1]=4 8420 B14R1.882 CCCCOCOc1ccccc1N 34a_100000185747_100011995733 [1,1,0,0,0,0|1,0,1]=4 8421 B14R1.882 CCCCOCSc1ccccc1Br 62a_100000695589_100011995733 [1,1,0,0,0,0|1,0,1]=4 8422 B14R1.882 CCCCOCSc1ccccc1Br 62a_100011995733_100000695589 [1,1,0,0,0,0|1,0,1]=4 8423 B14R1.882 CCCCOCSc1ccccc1C 62a_100000210755_100011995733 [1,1,0,0,0,0|1,0,1]=4 8424 B14R1.882 CCCCOCSc1ccccc1C 62a_100011995733_100000210755 [1,1,0,0,0,0|1,0,1]=4 8425 B14R1.882 CCCCOCSc1ccccc1Cl 62a_100000764095_100011995733 [1,1,0,0,0,0|1,0,1]=4 8426 B14R1.882 CCCCOCSc1ccccc1Cl 62a_100011995733_100000764095 [1,1,0,0,0,0|1,0,1]=4 8427 B14R1.882 CCCCOCSc1ccccc1F 62a_100011215700_100011995733 [1,1,0,0,0,0|1,0,1]=4 8428 B14R1.882 CCCCOCSc1ccccc1F 62a_100011995733_100011215700 [1,1,0,0,0,0|1,0,1]=4 8429 B14R1.882 CCCCOCSc1ccccc1N 62a_100000210017_100011995733 [1,1,0,0,0,0|1,0,1]=4 8430 B14R1.882 CCCCOCSc1ccccc1N 62a_100011995733_100000210017 [1,1,0,0,0,0|1,0,1]=4 8431 B14R1.882 CCCCOCSc1ccccc1O 62a_100000739446_100011995733 [1,1,0,0,0,0|1,0,1]=4 8432 B14R1.882 CCCCOCSc1ccccc1O 62a_100011995733_100000739446 [1,1,0,0,0,0|1,0,1]=4 8433 B14R1.882 CCCCSCCc1ccccc1Br 62a_100000210211_100012161201 [1,1,0,0,0,0|0,1,1]=4 8434 B14R1.882 CCCCSCCc1ccccc1Br 62a_100012161201_100000210210 [1,1,0,0,0,0|0,1,1]=4 8435 B14R1.882 CCCCSCCc1ccccc1C 62a_100000210211_100011713688 [1,1,0,0,0,0|0,1,1]=4 8436 B14R1.882 CCCCSCCc1ccccc1C 62a_100011713688_100000210210 [1,1,0,0,0,0|0,1,1]=4 8437 B14R1.882 CCCCSCCc1ccccc1Cl 62a_100000210211_100011713703 [1,1,0,0,0,0|0,1,1]=4 8438 B14R1.882 CCCCSCCc1ccccc1Cl 62a_100011713703_100000210210 [1,1,0,0,0,0|0,1,1]=4 8439 B14R1.882 CCCCSCCc1ccccc1F 62a_100000210211_100011713696 [1,1,0,0,0,0|0,1,1]=4 8440 B14R1.882 CCCCSCCc1ccccc1F 62a_100011713696_100000210210 [1,1,0,0,0,0|0,1,1]=4 8441 B14R1.882 CCCCSCCc1ccccc1O 62a_100000210211_100000722297 [1,1,0,0,0,0|0,1,1]=4 8442 B14R1.882 CCCCSCCc1ccccc1O 62a_100000722297_100000210210 [1,1,0,0,0,0|0,1,1]=4 8443 B14R1.882 CCCNN=CCc1ccccc1Cl 4a_100000740057_200011713468 [1,1,0,0,0,0|2,0,0]=4 8444 B14R1.882 CCCNN=CCc1ccccc1F 4a_100000740057_200000687578 [1,1,0,0,0,0|2,0,0]=4 8445 B14R1.882 COCCOCCc1ccccc1Br 34a_100000210237_100012161201 [1,1,0,0,0,0|1,0,1]=4 8446 B14R1.882 COCCOCCc1ccccc1Br 34a_100000731337_100011201679 [1,1,0,0,0,0|1,0,1]=4 8447 B14R1.882 COCCOCCc1ccccc1Br 7a_100000731337_100000233755 [1,1,0,0,0,0|1,0,1]=4 8448 B14R1.882 COCCOCCc1ccccc1C 34a_100000210237_100011713688 [1,1,0,0,0,0|1,0,1]=4 8449 B14R1.882 COCCOCCc1ccccc1C 34a_100011220023_100011201679 [1,1,0,0,0,0|1,0,1]=4 8450 B14R1.882 COCCOCCc1ccccc1C 7a_100011220023_100000233755 [1,1,0,0,0,0|1,0,1]=4 8451 B14R1.882 COCCOCCc1ccccc1Cl 34a_100000210237_100011713703 [1,1,0,0,0,0|1,0,1]=4 8452 B14R1.882 COCCOCCc1ccccc1Cl 34a_100011215284_100011201679 [1,1,0,0,0,0|1,0,1]=4 8453 B14R1.882 COCCOCCc1ccccc1Cl 7a_100011215284_100000233755 [1,1,0,0,0,0|1,0,1]=4 8454 B14R1.882 COCCOCCc1ccccc1F 34a_100000210237_100000720011 [1,1,0,0,0,0|1,0,1]=4 8455 B14R1.882 COCCOCCc1ccccc1F 34a_100000753711_100011201679 [1,1,0,0,0,0|1,0,1]=4 8456 B14R1.882 COCCOCCc1ccccc1F 7a_100000753711_100000233755 [1,1,0,0,0,0|1,0,1]=4 8457 B14R1.882 COCCOCCc1ccccc1I 34a_100010255290_100011201679 [1,1,0,0,0,0|1,0,1]=4 8458 B14R1.882 COCCOCCc1ccccc1I 7a_100010255290_100000233755 [1,1,0,0,0,0|1,0,1]=4 8459 B14R1.882 COCCOCCc1ccccc1N 34a_100011215289_100011201679 [1,1,0,0,0,0|1,0,1]=4 8460 B14R1.882 COCCOCCc1ccccc1O 34a_100000210237_100000722297 [1,1,0,0,0,0|1,0,1]=4 8461 B14R1.882 CSCCOCCc1ccccc1Br 34a_100000230434_100012161201 [1,1,0,0,0,0|1,0,1]=4 8462 B14R1.882 CSCCOCCc1ccccc1Br 34a_100000731337_100000212216 [1,1,0,0,0,0|1,0,1]=4 8463 B14R1.882 CSCCOCCc1ccccc1Br 7a_100000230434_100012161201 [1,1,0,0,0,0|1,0,1]=4 8464 B14R1.882 CSCCOCCc1ccccc1Br 7a_100000731337_100000212216 [1,1,0,0,0,0|1,0,1]=4 8465 B14R1.882 CSCCOCCc1ccccc1C 34a_100000230434_100011713688 [1,1,0,0,0,0|1,0,1]=4 8466 B14R1.882 CSCCOCCc1ccccc1C 34a_100011220023_100000212216 [1,1,0,0,0,0|1,0,1]=4 8467 B14R1.882 CSCCOCCc1ccccc1C 7a_100000230434_100011713688 [1,1,0,0,0,0|1,0,1]=4 8468 B14R1.882 CSCCOCCc1ccccc1C 7a_100011220023_100000212216 [1,1,0,0,0,0|1,0,1]=4 8469 B14R1.882 CSCCOCCc1ccccc1Cl 34a_100000230434_100011713703 [1,1,0,0,0,0|1,0,1]=4 8470 B14R1.882 CSCCOCCc1ccccc1Cl 34a_100011215284_100000212216 [1,1,0,0,0,0|1,0,1]=4 8471 B14R1.882 CSCCOCCc1ccccc1Cl 7a_100000230434_100011713703 [1,1,0,0,0,0|1,0,1]=4 8472 B14R1.882 CSCCOCCc1ccccc1Cl 7a_100011215284_100000212216 [1,1,0,0,0,0|1,0,1]=4 8473 B14R1.882 CSCCOCCc1ccccc1F 34a_100000230434_100000720011 [1,1,0,0,0,0|1,0,1]=4 8474 B14R1.882 CSCCOCCc1ccccc1F 34a_100000753711_100000212216 [1,1,0,0,0,0|1,0,1]=4 8475 B14R1.882 CSCCOCCc1ccccc1F 7a_100000230434_100000720011 [1,1,0,0,0,0|1,0,1]=4 8476 B14R1.882 CSCCOCCc1ccccc1F 7a_100000753711_100000212216 [1,1,0,0,0,0|1,0,1]=4 8477 B14R1.882 CSCCOCCc1ccccc1I 34a_100010255290_100000212216 [1,1,0,0,0,0|1,0,1]=4 8478 B14R1.882 CSCCOCCc1ccccc1I 7a_100010255290_100000212216 [1,1,0,0,0,0|1,0,1]=4 8479 B14R1.882 CSCCOCCc1ccccc1N 34a_100011215289_100000212216 [1,1,0,0,0,0|1,0,1]=4 8480 B14R1.882 CSCCOCCc1ccccc1O 34a_100000230434_100000722297 [1,1,0,0,0,0|1,0,1]=4 8481 B14R1.882 CSCCOCCc1ccccc1O 7a_100000230434_100000722297 [1,1,0,0,0,0|1,0,1]=4 8482 B14R1.882 Cc1ccccc1CCOCCCBr 34a_100011217188_100011713688 [1,1,0,0,0,0|1,0,1]=4 8483 B14R1.882 Cc1ccccc1CCOCCCCl 34a_100000230001_100011713688 [1,1,0,0,0,0|1,0,1]=4 8484 B14R1.882 Cc1ccccc1CCOCCCF 34a_100000759539_100011713688 [1,1,0,0,0,0|1,0,1]=4 8485 B14R1.882 Cc1ccccc1CCOCCCF 34a_100011220023_100011934791 [1,1,0,0,0,0|1,0,1]=4 8486 B14R1.882 Cc1ccccc1CCOCCCF 7a_100011220023_100011934791 [1,1,0,0,0,0|1,0,1]=4 8487 B14R1.882 Cc1ccccc1CCOCCCN 34a_100000182051_100011713688 [1,1,0,0,0,0|1,0,1]=4 8488 B14R1.882 Cc1ccccc1CCOCCCO 34a_100011220023_100000230001 [1,1,0,0,0,0|1,0,1]=4 8489 B14R1.882 Cc1ccccc1CCOCCCO 7a_100011220023_100011215043 [1,1,0,0,0,0|1,0,1]=4 8490 B14R1.882 ClCCCOCCc1ccccc1Br 34a_100000230001_100012161201 [1,1,0,0,0,0|1,0,1]=4 8491 B14R1.882 ClCCCOCCc1ccccc1Cl 34a_100000230001_100011713703 [1,1,0,0,0,0|1,0,1]=4 8492 B14R1.882 Clc1ccccc1CCOCCCBr 34a_100011217188_100011713703 [1,1,0,0,0,0|1,0,1]=4 8493 B14R1.882 FCCCOCCc1ccccc1Br 34a_100000731337_100011934791 [1,1,0,0,0,0|1,0,1]=4 8494 B14R1.882 FCCCOCCc1ccccc1Br 34a_100000759539_100012161201 [1,1,0,0,0,0|1,0,1]=4 8495 B14R1.882 FCCCOCCc1ccccc1Br 7a_100000731337_100011934791 [1,1,0,0,0,0|1,0,1]=4 8496 B14R1.882 FCCCOCCc1ccccc1Cl 34a_100000759539_100011713703 [1,1,0,0,0,0|1,0,1]=4 8497 B14R1.882 FCCCOCCc1ccccc1Cl 34a_100011215284_100011934791 [1,1,0,0,0,0|1,0,1]=4 8498 B14R1.882 FCCCOCCc1ccccc1Cl 7a_100011215284_100011934791 [1,1,0,0,0,0|1,0,1]=4 8499 B14R1.882 FCCCOCCc1ccccc1F 34a_100000753711_100011934791 [1,1,0,0,0,0|1,0,1]=4 8500 B14R1.882 FCCCOCCc1ccccc1F 34a_100000759539_100000720011 [1,1,0,0,0,0|1,0,1]=4 8501 B14R1.882 FCCCOCCc1ccccc1F 7a_100000753711_100011934791 [1,1,0,0,0,0|1,0,1]=4 8502 B14R1.882 FCCCOCCc1ccccc1I 34a_100010255290_100011934791 [1,1,0,0,0,0|1,0,1]=4 8503 B14R1.882 FCCCOCCc1ccccc1I 7a_100010255290_100011934791 [1,1,0,0,0,0|1,0,1]=4 8504 B14R1.882 Fc1ccccc1CCOCCCBr 34a_100011217188_100000720011 [1,1,0,0,0,0|1,0,1]=4 8505 B14R1.882 Fc1ccccc1CCOCCCCl 34a_100000230001_100000720011 [1,1,0,0,0,0|1,0,1]=4 8506 B14R1.882 NCCCOCCc1ccccc1Br 34a_100000182051_100012161201 [1,1,0,0,0,0|1,0,1]=4 8507 B14R1.882 NCCCOCCc1ccccc1Cl 34a_100000182051_100011713703 [1,1,0,0,0,0|1,0,1]=4 8508 B14R1.882 NCCCOCCc1ccccc1F 34a_100000182051_100000720011 [1,1,0,0,0,0|1,0,1]=4 8509 B14R1.882 NCCCOCCc1ccccc1O 34a_100000182051_100000722297 [1,1,0,0,0,0|1,0,1]=4 8510 B14R1.882 Nc1ccccc1CCOCCCF 34a_100011215289_100011934791 [1,1,0,0,0,0|1,0,1]=4 8511 B14R1.882 Nc1ccccc1CCOCCCO 34a_100011215289_100000230001 [1,1,0,0,0,0|1,0,1]=4 8512 B14R1.882 OCCCOCCc1ccccc1Br 34a_100000731337_100000230001 [1,1,0,0,0,0|1,0,1]=4 8513 B14R1.882 OCCCOCCc1ccccc1Br 7a_100000731337_100011215043 [1,1,0,0,0,0|1,0,1]=4 8514 B14R1.882 OCCCOCCc1ccccc1Cl 34a_100011215284_100000230001 [1,1,0,0,0,0|1,0,1]=4 8515 B14R1.882 OCCCOCCc1ccccc1Cl 7a_100011215284_100011215043 [1,1,0,0,0,0|1,0,1]=4 8516 B14R1.882 OCCCOCCc1ccccc1F 34a_100000753711_100000230001 [1,1,0,0,0,0|1,0,1]=4 8517 B14R1.882 OCCCOCCc1ccccc1F 7a_100000753711_100011215043 [1,1,0,0,0,0|1,0,1]=4 8518 B14R1.882 OCCCOCCc1ccccc1I 34a_100010255290_100000230001 [1,1,0,0,0,0|1,0,1]=4 8519 B14R1.882 OCCCOCCc1ccccc1I 7a_100010255290_100011215043 [1,1,0,0,0,0|1,0,1]=4 8520 B14R1.882 Oc1ccccc1CCOCCCBr 34a_100011217188_100000722297 [1,1,0,0,0,0|1,0,1]=4 8521 B14R1.882 Oc1ccccc1CCOCCCCl 34a_100000230001_100000722297 [1,1,0,0,0,0|1,0,1]=4 8522 B14R1.882 Oc1ccccc1CCOCCCF 34a_100000759539_100000722297 [1,1,0,0,0,0|1,0,1]=4 8523 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000753159 [1,1,0,0,0,0|0,0,2]=4 8524 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Br 1458a_100000692101_100000189115 [1,1,0,0,0,0|0,0,2]=4 8525 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000753159 [1,1,0,0,0,0|0,0,2]=4 8526 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)C 1458a_100000692101_100000210814 [1,1,0,0,0,0|0,0,2]=4 8527 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000753159 [1,1,0,0,0,0|0,0,2]=4 8528 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000692101_100000694040 [1,1,0,0,0,0|0,0,2]=4 8529 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000753159 [1,1,0,0,0,0|0,0,2]=4 8530 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)F 1458a_100000692101_100000198546 [1,1,0,0,0,0|0,0,2]=4 8531 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000753159 [1,1,0,0,0,0|0,0,2]=4 8532 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)I 1458a_100000692101_100000189116 [1,1,0,0,0,0|0,0,2]=4 8533 B14R1.33 C#CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000753159 [1,1,0,0,0,0|0,0,2]=4 8534 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100102629194 [1,1,0,0,0,0|0,0,2]=4 8535 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100102629194 [1,1,0,0,0,0|0,0,2]=4 8536 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100102629194 [1,1,0,0,0,0|0,0,2]=4 8537 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100102629194 [1,1,0,0,0,0|0,0,2]=4 8538 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100102629194 [1,1,0,0,0,0|0,0,2]=4 8539 B14R1.33 C/C=C/CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100102629194 [1,1,0,0,0,0|0,0,2]=4 8540 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000754431 [1,1,0,0,0,0|0,0,2]=4 8541 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Br 1458a_100000749702_100000189115 [1,1,0,0,0,0|0,0,2]=4 8542 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000754431 [1,1,0,0,0,0|0,0,2]=4 8543 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)C 1458a_100000749702_100000210814 [1,1,0,0,0,0|0,0,2]=4 8544 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000754431 [1,1,0,0,0,0|0,0,2]=4 8545 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749702_100000694040 [1,1,0,0,0,0|0,0,2]=4 8546 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000754431 [1,1,0,0,0,0|0,0,2]=4 8547 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)F 1458a_100000749702_100000198546 [1,1,0,0,0,0|0,0,2]=4 8548 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000754431 [1,1,0,0,0,0|0,0,2]=4 8549 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)I 1458a_100000749702_100000189116 [1,1,0,0,0,0|0,0,2]=4 8550 B14R1.33 C=CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000754431 [1,1,0,0,0,0|0,0,2]=4 8551 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000748600 [1,1,0,0,0,0|0,0,2]=4 8552 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000748600 [1,1,0,0,0,0|0,0,2]=4 8553 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000748600 [1,1,0,0,0,0|0,0,2]=4 8554 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000748600 [1,1,0,0,0,0|0,0,2]=4 8555 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000748600 [1,1,0,0,0,0|0,0,2]=4 8556 B14R1.33 CC#CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000748600 [1,1,0,0,0,0|0,0,2]=4 8557 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000070051 [1,1,0,0,0,0|0,0,2]=4 8558 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)Br 1458a_100121576822_100000189115 [1,1,0,0,0,0|0,0,2]=4 8559 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000070051 [1,1,0,0,0,0|0,0,2]=4 8560 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)C 1458a_100121576822_100000210814 [1,1,0,0,0,0|0,0,2]=4 8561 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000070051 [1,1,0,0,0,0|0,0,2]=4 8562 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)Cl 1458a_100121576822_100000694040 [1,1,0,0,0,0|0,0,2]=4 8563 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000070051 [1,1,0,0,0,0|0,0,2]=4 8564 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)F 1458a_100121576822_100000198546 [1,1,0,0,0,0|0,0,2]=4 8565 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000070051 [1,1,0,0,0,0|0,0,2]=4 8566 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)I 1458a_100121576822_100000189116 [1,1,0,0,0,0|0,0,2]=4 8567 B14R1.33 CC=CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000070051 [1,1,0,0,0,0|0,0,2]=4 8568 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)Br 1458a_100011827653_100000189115 [1,1,0,0,0,0|0,0,2]=4 8569 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)C 1458a_100011827653_100000210814 [1,1,0,0,0,0|0,0,2]=4 8570 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)Cl 1458a_100011827653_100000694040 [1,1,0,0,0,0|0,0,2]=4 8571 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)F 1458a_100011827653_100000198546 [1,1,0,0,0,0|0,0,2]=4 8572 B14R1.33 CCC#CC(=O)Cc1ccc(cc1)I 1458a_100011827653_100000189116 [1,1,0,0,0,0|0,0,2]=4 8573 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)Br 1458a_100000212282_100000189115 [1,1,0,0,0,0|0,0,2]=4 8574 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)C 1458a_100000212282_100000210814 [1,1,0,0,0,0|0,0,2]=4 8575 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100000212282_100000694040 [1,1,0,0,0,0|0,0,2]=4 8576 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)F 1458a_100000212282_100000198546 [1,1,0,0,0,0|0,0,2]=4 8577 B14R1.33 CCC=CC(=O)Cc1ccc(cc1)I 1458a_100000212282_100000189116 [1,1,0,0,0,0|0,0,2]=4 8578 B14R1.33 CCCCC(=Cc1ccc(cc1)Br)Br 271570a_206741709834_100000752885 [1,1,0,0,0,0|1,0,1]=4 8579 B14R1.33 CCCCC(=Cc1ccc(cc1)C)Br 271570a_206741709834_100000186775 [1,1,0,0,0,0|1,0,1]=4 8580 B14R1.33 CCCCC(=Cc1ccc(cc1)Cl)Br 271570a_206741709834_100000755918 [1,1,0,0,0,0|1,0,1]=4 8581 B14R1.33 CCCCC(=Cc1ccc(cc1)F)Br 271570a_206741709834_100000211213 [1,1,0,0,0,0|1,0,1]=4 8582 B14R1.33 CCCCC(=Cc1ccc(cc1)N)Br 271570a_206741709834_100000185761 [1,1,0,0,0,0|1,0,1]=4 8583 B14R1.33 CCCCC(=Cc1ccc(cc1)O)Br 271570a_206741709834_100000185759 [1,1,0,0,0,0|1,0,1]=4 8584 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210211 [1,1,0,0,0,0|0,0,0]=2 8585 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Br 1458a_100000210183_100000189115 [1,1,0,0,0,0|0,0,0]=2 8586 B14R1.33 CCCCC(=O)Cc1ccc(cc1)C 1458a_100000210183_100000210814 [1,1,0,0,0,0|0,0,0]=2 8587 B14R1.33 CCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210211 [1,1,0,0,0,0|0,0,0]=2 8588 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000210183_100000694040 [1,1,0,0,0,0|0,0,0]=2 8589 B14R1.33 CCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210211 [1,1,0,0,0,0|0,0,0]=2 8590 B14R1.33 CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210183_100000198546 [1,1,0,0,0,0|0,0,0]=2 8591 B14R1.33 CCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210211 [1,1,0,0,0,0|0,0,0]=2 8592 B14R1.33 CCCCC(=O)Cc1ccc(cc1)I 1458a_100000210183_100000189116 [1,1,0,0,0,0|0,0,0]=2 8593 B14R1.33 CCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210211 [1,1,0,0,0,0|0,0,0]=2 8594 B14R1.33 CCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210211 [1,1,0,0,0,0|0,0,0]=2 8595 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Br 1458a_100000210183_100000702658 [1,1,0,0,0,0|1,0,0]=3 8596 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210211 [1,1,0,0,0,0|1,0,0]=3 8597 B14R1.33 CCCCC(=O)Cc1ccc(cn1)C 1458a_100000210183_100000691093 [1,1,0,0,0,0|1,0,0]=3 8598 B14R1.33 CCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210211 [1,1,0,0,0,0|1,0,0]=3 8599 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000210183_100012066911 [1,1,0,0,0,0|1,0,0]=3 8600 B14R1.33 CCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210211 [1,1,0,0,0,0|1,0,0]=3 8601 B14R1.33 CCCCC(=O)Cc1ccc(cn1)F 1458a_100000210183_100000703193 [1,1,0,0,0,0|1,0,0]=3 8602 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Br 1458a_100000210183_100009831999 [1,1,0,0,0,0|1,0,0]=3 8603 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210211 [1,1,0,0,0,0|1,0,0]=3 8604 B14R1.33 CCCCC(=O)Cc1ccc(nc1)C 1458a_100000210183_100016987292 [1,1,0,0,0,0|1,0,0]=3 8605 B14R1.33 CCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210211 [1,1,0,0,0,0|1,0,0]=3 8606 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210211 [1,1,0,0,0,0|1,0,0]=3 8607 B14R1.33 CCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000210183_100000735431 [1,1,0,0,0,0|1,0,0]=3 8608 B14R1.33 CCCCC(=O)Cc1ccc(nc1)F 1458a_100000210183_100009820150 [1,1,0,0,0,0|1,0,0]=3 8609 B14R1.33 CCCCC(=O)Cc1ccc(nn1)Cl 1458a_100000210183_100016992710 [1,1,0,0,0,0|2,0,0]=4 8610 B14R1.33 CCCCC(=O)Cc1cnc(cn1)C 1458a_100000210183_100000752025 [1,1,0,0,0,0|2,0,0]=4 8611 B14R1.33 CCCCC(=O)Cc1ncc(cn1)Br 1458a_100000210183_100010064664 [1,1,0,0,0,0|2,0,0]=4 8612 B14R1.33 CCCCC(=O)Cc1ncc(cn1)C 1458a_100000210183_100000685645 [1,1,0,0,0,0|2,0,0]=4 8613 B14R1.33 CCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210211 [1,1,0,0,0,0|1,0,0]=3 8614 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210183 [1,1,0,0,0,0|1,0,0]=3 8615 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210183 [1,1,0,0,0,0|1,0,0]=3 8616 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210183 [1,1,0,0,0,0|1,0,0]=3 8617 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210183 [1,1,0,0,0,0|1,0,0]=3 8618 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210183 [1,1,0,0,0,0|1,0,0]=3 8619 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210183 [1,1,0,0,0,0|1,0,0]=3 8620 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210183 [1,1,0,0,0,0|1,0,0]=3 8621 B14R1.33 CCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210183 [1,1,0,0,0,0|1,0,0]=3 8622 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210183 [1,1,0,0,0,0|1,0,0]=3 8623 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210183 [1,1,0,0,0,0|1,0,0]=3 8624 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210183 [1,1,0,0,0,0|1,0,0]=3 8625 B14R1.33 CCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210183 [1,1,0,0,0,0|1,0,0]=3 8626 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210183 [1,1,0,0,0,0|1,0,0]=3 8627 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210183 [1,1,0,0,0,0|1,0,0]=3 8628 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210183 [1,1,0,0,0,0|1,0,0]=3 8629 B14R1.33 CCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210183 [1,1,0,0,0,0|1,0,0]=3 8630 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210183 [1,1,0,0,0,0|1,0,0]=3 8631 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210183 [1,1,0,0,0,0|1,0,0]=3 8632 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210183 [1,1,0,0,0,0|1,0,0]=3 8633 B14R1.33 CCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210183 [1,1,0,0,0,0|1,0,0]=3 8634 B14R1.33 CCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210183 [1,1,0,0,0,0|1,0,0]=3 8635 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100000210211 [1,1,0,0,0,0|2,0,0]=4 8636 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 2230a_100000207549_100011217064 [1,1,0,0,0,0|2,0,0]=4 8637 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 2230a_100015187156_200000210301 [1,1,0,0,0,0|2,0,0]=4 8638 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000210211 [1,1,0,0,0,0|2,0,0]=4 8639 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 269982a_100000207549_100011217064 [1,1,0,0,0,0|2,0,0]=4 8640 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 269982a_100015187156_200000210301 [1,1,0,0,0,0|2,0,0]=4 8641 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 26a_100000207549_100000185759 [1,1,0,0,0,0|2,0,0]=4 8642 B14R1.33 CCCCN(C)Cc1ccc(cc1)Br 270004a_100000207549_100000186029 [1,1,0,0,0,0|2,0,0]=4 8643 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 2230a_100000196039_200000210301 [1,1,0,0,0,0|2,0,0]=4 8644 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 2230a_100000207549_100000210814 [1,1,0,0,0,0|2,0,0]=4 8645 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210211 [1,1,0,0,0,0|2,0,0]=4 8646 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 269982a_100000196039_200000210301 [1,1,0,0,0,0|2,0,0]=4 8647 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 269982a_100000207549_100000210814 [1,1,0,0,0,0|2,0,0]=4 8648 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000210211 [1,1,0,0,0,0|2,0,0]=4 8649 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 26a_100000207549_200020625495 [1,1,0,0,0,0|2,0,0]=4 8650 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 270004a_100000207549_100000211033 [1,1,0,0,0,0|2,0,0]=4 8651 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 34a_100000196039_200000210301 [1,1,0,0,0,0|2,0,0]=4 8652 B14R1.33 CCCCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210210 [1,1,0,0,0,0|2,0,0]=4 8653 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100000210211 [1,1,0,0,0,0|2,0,0]=4 8654 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 2230a_100000207549_100000694040 [1,1,0,0,0,0|2,0,0]=4 8655 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 2230a_100015186511_200000210301 [1,1,0,0,0,0|2,0,0]=4 8656 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000210211 [1,1,0,0,0,0|2,0,0]=4 8657 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 269982a_100000207549_100000187161 [1,1,0,0,0,0|2,0,0]=4 8658 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 269982a_100015186511_200000210301 [1,1,0,0,0,0|2,0,0]=4 8659 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 270004a_100000207549_100000189385 [1,1,0,0,0,0|2,0,0]=4 8660 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100000210210 [1,1,0,0,0,0|2,0,0]=4 8661 B14R1.33 CCCCN(C)Cc1ccc(cc1)Cl 34a_100015186511_200000210301 [1,1,0,0,0,0|2,0,0]=4 8662 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 2230a_100000184576_100000210211 [1,1,0,0,0,0|2,0,0]=4 8663 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 2230a_100000196033_200000210301 [1,1,0,0,0,0|2,0,0]=4 8664 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 2230a_100000207549_100000198546 [1,1,0,0,0,0|2,0,0]=4 8665 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000210211 [1,1,0,0,0,0|2,0,0]=4 8666 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 269982a_100000196033_200000210301 [1,1,0,0,0,0|2,0,0]=4 8667 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 269982a_100000207549_100000198546 [1,1,0,0,0,0|2,0,0]=4 8668 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 270004a_100000207549_100000210084 [1,1,0,0,0,0|2,0,0]=4 8669 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 34a_100000184576_100000210210 [1,1,0,0,0,0|2,0,0]=4 8670 B14R1.33 CCCCN(C)Cc1ccc(cc1)F 34a_100000196033_200000210301 [1,1,0,0,0,0|2,0,0]=4 8671 B14R1.33 CCCCN(C)Cc1ccc(cc1)I 2230a_100000207549_100000189116 [1,1,0,0,0,0|2,0,0]=4 8672 B14R1.33 CCCCN(C)Cc1ccc(cc1)I 269982a_100000207549_100000189116 [1,1,0,0,0,0|2,0,0]=4 8673 B14R1.33 CCCCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210211 [1,1,0,0,0,0|2,0,0]=4 8674 B14R1.33 CCCCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000210211 [1,1,0,0,0,0|2,0,0]=4 8675 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)Br 2230a_100015187156_200025704644 [1,1,0,0,0,0|2,0,0]=4 8676 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)Br 269982a_100015187156_200025704644 [1,1,0,0,0,0|2,0,0]=4 8677 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)C 2230a_100000196039_200025704644 [1,1,0,0,0,0|2,0,0]=4 8678 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)C 269982a_100000196039_200025704644 [1,1,0,0,0,0|2,0,0]=4 8679 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)C 34a_100000196039_200025704644 [1,1,0,0,0,0|2,0,0]=4 8680 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)Cl 2230a_100015186511_200025704644 [1,1,0,0,0,0|2,0,0]=4 8681 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)Cl 269982a_100015186511_200025704644 [1,1,0,0,0,0|2,0,0]=4 8682 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)Cl 34a_100015186511_200025704644 [1,1,0,0,0,0|2,0,0]=4 8683 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)F 2230a_100000196033_200025704644 [1,1,0,0,0,0|2,0,0]=4 8684 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)F 269982a_100000196033_200025704644 [1,1,0,0,0,0|2,0,0]=4 8685 B14R1.33 CCCCN([13CH3])Cc1ccc(cc1)F 34a_100000196033_200025704644 [1,1,0,0,0,0|2,0,0]=4 8686 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 11a_100020643023_100000198978 [1,1,0,0,0,0|1,0,0]=3 8687 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 240690a_100020643023_100000198978 [1,1,0,0,0,0|1,0,0]=3 8688 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Br 527a_100020643023_100000198978 [1,1,0,0,0,0|1,0,0]=3 8689 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 11a_100020643023_100000212244 [1,1,0,0,0,0|1,0,0]=3 8690 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 240690a_100020643023_100000212244 [1,1,0,0,0,0|1,0,0]=3 8691 B14R1.33 CCCNC(=O)Cc1ccc(cc1)C 527a_100020643023_100000212244 [1,1,0,0,0,0|1,0,0]=3 8692 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 11a_100020643023_100000211027 [1,1,0,0,0,0|1,0,0]=3 8693 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 240690a_100020643023_100000211027 [1,1,0,0,0,0|1,0,0]=3 8694 B14R1.33 CCCNC(=O)Cc1ccc(cc1)Cl 527a_100020643023_100000211027 [1,1,0,0,0,0|1,0,0]=3 8695 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 11a_100020643023_100000210951 [1,1,0,0,0,0|1,0,0]=3 8696 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 1626a_100020643023_100000210951 [1,1,0,0,0,0|1,0,0]=3 8697 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 240690a_100020643023_100000210951 [1,1,0,0,0,0|1,0,0]=3 8698 B14R1.33 CCCNC(=O)Cc1ccc(cc1)F 527a_100020643023_100000210951 [1,1,0,0,0,0|1,0,0]=3 8699 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 11a_100020643023_100000688869 [1,1,0,0,0,0|1,0,0]=3 8700 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 1626a_100020643023_100000688869 [1,1,0,0,0,0|1,0,0]=3 8701 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 240690a_100020643023_100000688869 [1,1,0,0,0,0|1,0,0]=3 8702 B14R1.33 CCCNC(=O)Cc1ccc(cc1)I 527a_100020643023_100000688869 [1,1,0,0,0,0|1,0,0]=3 8703 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 1626a_100020643023_100000198540 [1,1,0,0,0,0|1,0,0]=3 8704 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 240690a_100020643023_100000198540 [1,1,0,0,0,0|1,0,0]=3 8705 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 271570a_203496583355_200000152284 [1,1,0,0,0,0|1,0,0]=3 8706 B14R1.33 CCCNC(=O)Cc1ccc(cc1)O 527a_100020643023_100000198540 [1,1,0,0,0,0|1,0,0]=3 8707 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br 11a_100020643023_100020629044 [1,1,0,0,0,0|2,0,0]=4 8708 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Br 240690a_100020643023_100020629044 [1,1,0,0,0,0|2,0,0]=4 8709 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 11a_100020643023_100025705728 [1,1,0,0,0,0|2,0,0]=4 8710 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 1626a_100020643023_100025705728 [1,1,0,0,0,0|2,0,0]=4 8711 B14R1.33 CCCNC(=O)Cc1ccc(cn1)C 240690a_100020643023_100025705728 [1,1,0,0,0,0|2,0,0]=4 8712 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 11a_100020643023_100000728320 [1,1,0,0,0,0|2,0,0]=4 8713 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 1626a_100020643023_100000728320 [1,1,0,0,0,0|2,0,0]=4 8714 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 240690a_100020643023_100000728320 [1,1,0,0,0,0|2,0,0]=4 8715 B14R1.33 CCCNC(=O)Cc1ccc(cn1)Cl 527a_100020643023_100000728320 [1,1,0,0,0,0|2,0,0]=4 8716 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 11a_100020643023_100010067268 [1,1,0,0,0,0|2,0,0]=4 8717 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 240690a_100020643023_100010067268 [1,1,0,0,0,0|2,0,0]=4 8718 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Br 527a_100020643023_100010067268 [1,1,0,0,0,0|2,0,0]=4 8719 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 11a_100020643023_100000740413 [1,1,0,0,0,0|2,0,0]=4 8720 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 1626a_100020643023_100000740413 [1,1,0,0,0,0|2,0,0]=4 8721 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 240690a_100020643023_100000740413 [1,1,0,0,0,0|2,0,0]=4 8722 B14R1.33 CCCNC(=O)Cc1ccc(nc1)C 527a_100020643023_100000740413 [1,1,0,0,0,0|2,0,0]=4 8723 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 11a_100020643023_100000061944 [1,1,0,0,0,0|2,0,0]=4 8724 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 1626a_100020643023_100000061944 [1,1,0,0,0,0|2,0,0]=4 8725 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 240690a_100020643023_100000061944 [1,1,0,0,0,0|2,0,0]=4 8726 B14R1.33 CCCNC(=O)Cc1ccc(nc1)Cl 527a_100020643023_100000061944 [1,1,0,0,0,0|2,0,0]=4 8727 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 11a_100020643023_200000238563 [1,1,0,0,0,0|2,0,0]=4 8728 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 1626a_100020643023_200000238563 [1,1,0,0,0,0|2,0,0]=4 8729 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 240690a_100020643023_200000238563 [1,1,0,0,0,0|2,0,0]=4 8730 B14R1.33 CCCNC(=O)Cn1ccc(=O)cc1 527a_100020643023_200000238563 [1,1,0,0,0,0|2,0,0]=4 8731 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020643023 [1,1,0,0,0,0|2,0,0]=4 8732 B14R1.33 CCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020643023 [1,1,0,0,0,0|2,0,0]=4 8733 B14R1.33 CCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020643023 [1,1,0,0,0,0|2,0,0]=4 8734 B14R1.33 CCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020643023 [1,1,0,0,0,0|2,0,0]=4 8735 B14R1.33 CCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020643023 [1,1,0,0,0,0|2,0,0]=4 8736 B14R1.33 CCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020643023 [1,1,0,0,0,0|2,0,0]=4 8737 B14R1.33 CCCNC(=O)Nc1ccc(cc1)O 271570a_203496583355_200000163292 [1,1,0,0,0,0|2,0,0]=4 8738 B14R1.33 CCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000210303 [1,1,0,0,0,0|1,0,1]=4 8739 B14R1.33 CCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000210303 [1,1,0,0,0,0|1,0,1]=4 8740 B14R1.33 CCNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210202 [1,1,0,0,0,0|2,0,0]=4 8741 B14R1.33 CCNCC(=O)Nc1ccc(cc1)Br 2230a_100015525214_100000183692 [1,1,0,0,0,0|2,0,0]=4 8742 B14R1.33 CCNCC(=O)Nc1ccc(cc1)C 2230a_100015525214_100000182914 [1,1,0,0,0,0|2,0,0]=4 8743 B14R1.33 CCNCC(=O)Nc1ccc(cc1)Cl 2230a_100015525214_100000182960 [1,1,0,0,0,0|2,0,0]=4 8744 B14R1.33 CCNCC(=O)Nc1ccc(cc1)F 2230a_100015525214_100000181725 [1,1,0,0,0,0|2,0,0]=4 8745 B14R1.33 CCNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210202 [1,1,0,0,0,0|2,0,0]=4 8746 B14R1.33 CCNCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210202 [1,1,0,0,0,0|2,0,0]=4 8747 B14R1.33 CCNCC(=O)Nc1ccc(cc1)I 2230a_100015525214_100000183000 [1,1,0,0,0,0|2,0,0]=4 8748 B14R1.33 CCNCC(=O)Nc1ccc(cc1)O 2230a_100015525214_100000233757 [1,1,0,0,0,0|2,0,0]=4 8749 B14R1.33 CCNCC(=O)Oc1ccc(cc1)Br 2230a_100015525214_200010760497 [1,1,0,0,0,0|2,0,0]=4 8750 B14R1.33 CCNNC(=O)Cc1ccc(cc1)Br 22a_100000756455_100000198978 [1,1,0,0,0,0|2,0,0]=4 8751 B14R1.33 CCNNC(=O)Cc1ccc(cc1)C 22a_100000756455_100000212244 [1,1,0,0,0,0|2,0,0]=4 8752 B14R1.33 CCNNC(=O)Cc1ccc(cc1)Cl 22a_100000756455_100000211027 [1,1,0,0,0,0|2,0,0]=4 8753 B14R1.33 CCNNC(=O)Cc1ccc(cc1)F 22a_100000756455_100000210951 [1,1,0,0,0,0|2,0,0]=4 8754 B14R1.33 CCNNC(=O)Cc1ccc(cc1)I 22a_100000756455_100000688869 [1,1,0,0,0,0|2,0,0]=4 8755 B14R1.33 CCNNC(=O)Cc1ccc(cc1)O 22a_100000756455_100000198540 [1,1,0,0,0,0|2,0,0]=4 8756 B14R1.33 CCOCC(=O)Cc1ccc(cc1)Br 1458a_100000211967_100000189115 [1,1,0,0,0,0|1,0,0]=3 8757 B14R1.33 CCOCC(=O)Cc1ccc(cc1)C 1458a_100000211967_100000210814 [1,1,0,0,0,0|1,0,0]=3 8758 B14R1.33 CCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000211967_100000694040 [1,1,0,0,0,0|1,0,0]=3 8759 B14R1.33 CCOCC(=O)Cc1ccc(cc1)F 1458a_100000211967_100000198546 [1,1,0,0,0,0|1,0,0]=3 8760 B14R1.33 CCOCC(=O)Cc1ccc(cc1)I 1458a_100000211967_100000189116 [1,1,0,0,0,0|1,0,0]=3 8761 B14R1.33 CCOCC(=O)Cc1ccc(cn1)Br 1458a_100000211967_100000702658 [1,1,0,0,0,0|2,0,0]=4 8762 B14R1.33 CCOCC(=O)Cc1ccc(cn1)C 1458a_100000211967_100000691093 [1,1,0,0,0,0|2,0,0]=4 8763 B14R1.33 CCOCC(=O)Cc1ccc(cn1)Cl 1458a_100000211967_100012066911 [1,1,0,0,0,0|2,0,0]=4 8764 B14R1.33 CCOCC(=O)Cc1ccc(cn1)F 1458a_100000211967_100000703193 [1,1,0,0,0,0|2,0,0]=4 8765 B14R1.33 CCOCC(=O)Cc1ccc(nc1)Br 1458a_100000211967_100009831999 [1,1,0,0,0,0|2,0,0]=4 8766 B14R1.33 CCOCC(=O)Cc1ccc(nc1)C 1458a_100000211967_100016987292 [1,1,0,0,0,0|2,0,0]=4 8767 B14R1.33 CCOCC(=O)Cc1ccc(nc1)Cl 1458a_100000211967_100000735431 [1,1,0,0,0,0|2,0,0]=4 8768 B14R1.33 CCOCC(=O)Cc1ccc(nc1)F 1458a_100000211967_100009820150 [1,1,0,0,0,0|2,0,0]=4 8769 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000211967 [1,1,0,0,0,0|2,0,0]=4 8770 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000211967 [1,1,0,0,0,0|2,0,0]=4 8771 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000211967 [1,1,0,0,0,0|2,0,0]=4 8772 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Br 34a_100121572206_100000183692 [1,1,0,0,0,0|2,0,0]=4 8773 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000211967 [1,1,0,0,0,0|2,0,0]=4 8774 B14R1.33 CCOCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211967 [1,1,0,0,0,0|2,0,0]=4 8775 B14R1.33 CCOCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211967 [1,1,0,0,0,0|2,0,0]=4 8776 B14R1.33 CCOCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211967 [1,1,0,0,0,0|2,0,0]=4 8777 B14R1.33 CCOCC(=O)Nc1ccc(cc1)C 34a_100121572206_100000182914 [1,1,0,0,0,0|2,0,0]=4 8778 B14R1.33 CCOCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211967 [1,1,0,0,0,0|2,0,0]=4 8779 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000211967 [1,1,0,0,0,0|2,0,0]=4 8780 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000211967 [1,1,0,0,0,0|2,0,0]=4 8781 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211967 [1,1,0,0,0,0|2,0,0]=4 8782 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 34a_100121572206_100000182960 [1,1,0,0,0,0|2,0,0]=4 8783 B14R1.33 CCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000211967 [1,1,0,0,0,0|2,0,0]=4 8784 B14R1.33 CCOCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000211967 [1,1,0,0,0,0|2,0,0]=4 8785 B14R1.33 CCOCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000211967 [1,1,0,0,0,0|2,0,0]=4 8786 B14R1.33 CCOCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000211967 [1,1,0,0,0,0|2,0,0]=4 8787 B14R1.33 CCOCC(=O)Nc1ccc(cc1)F 34a_100121572206_100000181725 [1,1,0,0,0,0|2,0,0]=4 8788 B14R1.33 CCOCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000211967 [1,1,0,0,0,0|2,0,0]=4 8789 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000211967 [1,1,0,0,0,0|2,0,0]=4 8790 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000211967 [1,1,0,0,0,0|2,0,0]=4 8791 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000211967 [1,1,0,0,0,0|2,0,0]=4 8792 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I 34a_100121572206_100000183000 [1,1,0,0,0,0|2,0,0]=4 8793 B14R1.33 CCOCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000211967 [1,1,0,0,0,0|2,0,0]=4 8794 B14R1.33 CCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000210202 [1,1,0,0,0,0|2,0,0]=4 8795 B14R1.33 CCOCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000211967 [1,1,0,0,0,0|2,0,0]=4 8796 B14R1.33 CCOCC(=O)Nc1ccc(cc1)O 34a_100121572206_100000233757 [1,1,0,0,0,0|2,0,0]=4 8797 B14R1.33 CCOCC(=O)Oc1ccc(cc1)Br 34a_100121572206_200010760497 [1,1,0,0,0,0|2,0,0]=4 8798 B14R1.33 CCSCC(=O)Cc1ccc(cc1)Br 1458a_100000230394_100000189115 [1,1,0,0,0,0|1,0,0]=3 8799 B14R1.33 CCSCC(=O)Cc1ccc(cc1)C 1458a_100000230394_100000210814 [1,1,0,0,0,0|1,0,0]=3 8800 B14R1.33 CCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000230394_100000694040 [1,1,0,0,0,0|1,0,0]=3 8801 B14R1.33 CCSCC(=O)Cc1ccc(cc1)F 1458a_100000230394_100000198546 [1,1,0,0,0,0|1,0,0]=3 8802 B14R1.33 CCSCC(=O)Cc1ccc(cc1)I 1458a_100000230394_100000189116 [1,1,0,0,0,0|1,0,0]=3 8803 B14R1.33 CCSCC(=O)Cc1ccc(cn1)Br 1458a_100000230394_100000702658 [1,1,0,0,0,0|2,0,0]=4 8804 B14R1.33 CCSCC(=O)Cc1ccc(cn1)C 1458a_100000230394_100000691093 [1,1,0,0,0,0|2,0,0]=4 8805 B14R1.33 CCSCC(=O)Cc1ccc(cn1)Cl 1458a_100000230394_100012066911 [1,1,0,0,0,0|2,0,0]=4 8806 B14R1.33 CCSCC(=O)Cc1ccc(cn1)F 1458a_100000230394_100000703193 [1,1,0,0,0,0|2,0,0]=4 8807 B14R1.33 CCSCC(=O)Cc1ccc(nc1)Br 1458a_100000230394_100009831999 [1,1,0,0,0,0|2,0,0]=4 8808 B14R1.33 CCSCC(=O)Cc1ccc(nc1)C 1458a_100000230394_100016987292 [1,1,0,0,0,0|2,0,0]=4 8809 B14R1.33 CCSCC(=O)Cc1ccc(nc1)Cl 1458a_100000230394_100000735431 [1,1,0,0,0,0|2,0,0]=4 8810 B14R1.33 CCSCC(=O)Cc1ccc(nc1)F 1458a_100000230394_100009820150 [1,1,0,0,0,0|2,0,0]=4 8811 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000230394 [1,1,0,0,0,0|2,0,0]=4 8812 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000230394 [1,1,0,0,0,0|2,0,0]=4 8813 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000230394 [1,1,0,0,0,0|2,0,0]=4 8814 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000230394 [1,1,0,0,0,0|2,0,0]=4 8815 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_100000210202 [1,1,0,0,0,0|2,0,0]=4 8816 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Br 62a_100000210202_100000183692 [1,1,0,0,0,0|2,0,0]=4 8817 B14R1.33 CCSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000230394 [1,1,0,0,0,0|2,0,0]=4 8818 B14R1.33 CCSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000230394 [1,1,0,0,0,0|2,0,0]=4 8819 B14R1.33 CCSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000230394 [1,1,0,0,0,0|2,0,0]=4 8820 B14R1.33 CCSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000230394 [1,1,0,0,0,0|2,0,0]=4 8821 B14R1.33 CCSCC(=O)Nc1ccc(cc1)C 62a_100000210202_100000182914 [1,1,0,0,0,0|2,0,0]=4 8822 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000230394 [1,1,0,0,0,0|2,0,0]=4 8823 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000230394 [1,1,0,0,0,0|2,0,0]=4 8824 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000230394 [1,1,0,0,0,0|2,0,0]=4 8825 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000230394 [1,1,0,0,0,0|2,0,0]=4 8826 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210202_100000182960 [1,1,0,0,0,0|2,0,0]=4 8827 B14R1.33 CCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210202 [1,1,0,0,0,0|2,0,0]=4 8828 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000230394 [1,1,0,0,0,0|2,0,0]=4 8829 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000230394 [1,1,0,0,0,0|2,0,0]=4 8830 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000230394 [1,1,0,0,0,0|2,0,0]=4 8831 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000230394 [1,1,0,0,0,0|2,0,0]=4 8832 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 62a_100000210202_100000181725 [1,1,0,0,0,0|2,0,0]=4 8833 B14R1.33 CCSCC(=O)Nc1ccc(cc1)F 62a_200000243717_100000210202 [1,1,0,0,0,0|2,0,0]=4 8834 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000230394 [1,1,0,0,0,0|2,0,0]=4 8835 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000230394 [1,1,0,0,0,0|2,0,0]=4 8836 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000230394 [1,1,0,0,0,0|2,0,0]=4 8837 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000230394 [1,1,0,0,0,0|2,0,0]=4 8838 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 62a_100000183000_100000210202 [1,1,0,0,0,0|2,0,0]=4 8839 B14R1.33 CCSCC(=O)Nc1ccc(cc1)I 62a_100000210202_100000183000 [1,1,0,0,0,0|2,0,0]=4 8840 B14R1.33 CCSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000230394 [1,1,0,0,0,0|2,0,0]=4 8841 B14R1.33 CCSCC(=O)Nc1ccc(cc1)O 62a_100000210202_100000233757 [1,1,0,0,0,0|2,0,0]=4 8842 B14R1.33 CCSCC(=O)Oc1ccc(cc1)Br 62a_100000210202_200010760497 [1,1,0,0,0,0|2,0,0]=4 8843 B14R1.33 CCSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_100000210202 [1,1,0,0,0,0|2,0,0]=4 8844 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Br 2230a_100000743120_200000210301 [1,1,0,0,0,0|2,0,0]=4 8845 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Br 2230a_106832991635_100000740023 [1,1,0,0,0,0|2,0,0]=4 8846 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Br 34a_100000743120_200000210301 [1,1,0,0,0,0|2,0,0]=4 8847 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Br 34a_100102657272_100000740023 [1,1,0,0,0,0|2,0,0]=4 8848 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Br 7a_106832991635_100000740023 [1,1,0,0,0,0|2,0,0]=4 8849 B14R1.33 CNCCC(=O)Nc1ccc(cc1)C 2230a_106832991635_200000187088 [1,1,0,0,0,0|2,0,0]=4 8850 B14R1.33 CNCCC(=O)Nc1ccc(cc1)C 34a_100015187665_200000210301 [1,1,0,0,0,0|2,0,0]=4 8851 B14R1.33 CNCCC(=O)Nc1ccc(cc1)C 34a_100102657272_200000187088 [1,1,0,0,0,0|2,0,0]=4 8852 B14R1.33 CNCCC(=O)Nc1ccc(cc1)C 7a_106832991635_200000187088 [1,1,0,0,0,0|2,0,0]=4 8853 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Cl 2230a_106832991635_100000188356 [1,1,0,0,0,0|2,0,0]=4 8854 B14R1.33 CNCCC(=O)Nc1ccc(cc1)Cl 7a_106832991635_100000188356 [1,1,0,0,0,0|2,0,0]=4 8855 B14R1.33 CNCCC(=O)Nc1ccc(cc1)F 2230a_100015184513_200000210301 [1,1,0,0,0,0|2,0,0]=4 8856 B14R1.33 CNCCC(=O)Nc1ccc(cc1)F 2230a_106832991635_100000736363 [1,1,0,0,0,0|2,0,0]=4 8857 B14R1.33 CNCCC(=O)Nc1ccc(cc1)F 34a_100015184513_200000210301 [1,1,0,0,0,0|2,0,0]=4 8858 B14R1.33 CNCCC(=O)Nc1ccc(cc1)F 7a_106832991635_100000736363 [1,1,0,0,0,0|2,0,0]=4 8859 B14R1.33 CNCCC(=O)Nc1ccc(cc1)O 2230a_106832991635_100011302330 [1,1,0,0,0,0|2,0,0]=4 8860 B14R1.33 CNCCC(=O)Nc1ccc(cc1)O 7a_106832991635_100011302330 [1,1,0,0,0,0|2,0,0]=4 8861 B14R1.33 COCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000233755 [1,1,0,0,0,0|1,0,0]=3 8862 B14R1.33 COCCC(=O)Cc1ccc(cc1)Br 1458a_100000749529_100000189115 [1,1,0,0,0,0|1,0,0]=3 8863 B14R1.33 COCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000233755 [1,1,0,0,0,0|1,0,0]=3 8864 B14R1.33 COCCC(=O)Cc1ccc(cc1)C 1458a_100000749529_100000210814 [1,1,0,0,0,0|1,0,0]=3 8865 B14R1.33 COCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000233755 [1,1,0,0,0,0|1,0,0]=3 8866 B14R1.33 COCCC(=O)Cc1ccc(cc1)Cl 1458a_100000749529_100000694040 [1,1,0,0,0,0|1,0,0]=3 8867 B14R1.33 COCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000233755 [1,1,0,0,0,0|1,0,0]=3 8868 B14R1.33 COCCC(=O)Cc1ccc(cc1)F 1458a_100000749529_100000198546 [1,1,0,0,0,0|1,0,0]=3 8869 B14R1.33 COCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000233755 [1,1,0,0,0,0|1,0,0]=3 8870 B14R1.33 COCCC(=O)Cc1ccc(cc1)I 1458a_100000749529_100000189116 [1,1,0,0,0,0|1,0,0]=3 8871 B14R1.33 COCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000233755 [1,1,0,0,0,0|1,0,0]=3 8872 B14R1.33 COCCC(=O)Cc1ccc(cn1)Br 1458a_100000749529_100000702658 [1,1,0,0,0,0|2,0,0]=4 8873 B14R1.33 COCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000233755 [1,1,0,0,0,0|2,0,0]=4 8874 B14R1.33 COCCC(=O)Cc1ccc(cn1)C 1458a_100000749529_100000691093 [1,1,0,0,0,0|2,0,0]=4 8875 B14R1.33 COCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000233755 [1,1,0,0,0,0|2,0,0]=4 8876 B14R1.33 COCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000233755 [1,1,0,0,0,0|2,0,0]=4 8877 B14R1.33 COCCC(=O)Cc1ccc(cn1)Cl 1458a_100000749529_100012066911 [1,1,0,0,0,0|2,0,0]=4 8878 B14R1.33 COCCC(=O)Cc1ccc(cn1)F 1458a_100000749529_100000703193 [1,1,0,0,0,0|2,0,0]=4 8879 B14R1.33 COCCC(=O)Cc1ccc(nc1)Br 1458a_100000749529_100009831999 [1,1,0,0,0,0|2,0,0]=4 8880 B14R1.33 COCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000233755 [1,1,0,0,0,0|2,0,0]=4 8881 B14R1.33 COCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000233755 [1,1,0,0,0,0|2,0,0]=4 8882 B14R1.33 COCCC(=O)Cc1ccc(nc1)C 1458a_100000749529_100016987292 [1,1,0,0,0,0|2,0,0]=4 8883 B14R1.33 COCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000233755 [1,1,0,0,0,0|2,0,0]=4 8884 B14R1.33 COCCC(=O)Cc1ccc(nc1)Cl 1458a_100000749529_100000735431 [1,1,0,0,0,0|2,0,0]=4 8885 B14R1.33 COCCC(=O)Cc1ccc(nc1)F 1458a_100000749529_100009820150 [1,1,0,0,0,0|2,0,0]=4 8886 B14R1.33 COCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000233755 [1,1,0,0,0,0|2,0,0]=4 8887 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000749529 [1,1,0,0,0,0|2,0,0]=4 8888 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000749529 [1,1,0,0,0,0|2,0,0]=4 8889 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000749529 [1,1,0,0,0,0|2,0,0]=4 8890 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br 34a_100138415774_100000740023 [1,1,0,0,0,0|2,0,0]=4 8891 B14R1.33 COCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000749529 [1,1,0,0,0,0|2,0,0]=4 8892 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000749529 [1,1,0,0,0,0|2,0,0]=4 8893 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000749529 [1,1,0,0,0,0|2,0,0]=4 8894 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000749529 [1,1,0,0,0,0|2,0,0]=4 8895 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 34a_100138415774_200000187088 [1,1,0,0,0,0|2,0,0]=4 8896 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 34a_200009859269_200000210301 [1,1,0,0,0,0|2,0,0]=4 8897 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000749529 [1,1,0,0,0,0|2,0,0]=4 8898 B14R1.33 COCCC(=O)Nc1ccc(cc1)C 7a_200009859269_200000210301 [1,1,0,0,0,0|2,0,0]=4 8899 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000749529 [1,1,0,0,0,0|2,0,0]=4 8900 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000749529 [1,1,0,0,0,0|2,0,0]=4 8901 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000749529 [1,1,0,0,0,0|2,0,0]=4 8902 B14R1.33 COCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000749529 [1,1,0,0,0,0|2,0,0]=4 8903 B14R1.33 COCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000749529 [1,1,0,0,0,0|2,0,0]=4 8904 B14R1.33 COCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000749529 [1,1,0,0,0,0|2,0,0]=4 8905 B14R1.33 COCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000749529 [1,1,0,0,0,0|2,0,0]=4 8906 B14R1.33 COCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000749529 [1,1,0,0,0,0|2,0,0]=4 8907 B14R1.33 COCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000749529 [1,1,0,0,0,0|2,0,0]=4 8908 B14R1.33 COCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000749529 [1,1,0,0,0,0|2,0,0]=4 8909 B14R1.33 COCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000749529 [1,1,0,0,0,0|2,0,0]=4 8910 B14R1.33 COCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000749529 [1,1,0,0,0,0|2,0,0]=4 8911 B14R1.33 COCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000749529 [1,1,0,0,0,0|2,0,0]=4 8912 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Br 1458a_100000174002_100000189115 [1,1,0,0,0,0|1,0,0]=3 8913 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000751147 [1,1,0,0,0,0|1,0,0]=3 8914 B14R1.33 CSCCC(=O)Cc1ccc(cc1)C 1458a_100000174002_100000210814 [1,1,0,0,0,0|1,0,0]=3 8915 B14R1.33 CSCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000751147 [1,1,0,0,0,0|1,0,0]=3 8916 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000174002_100000694040 [1,1,0,0,0,0|1,0,0]=3 8917 B14R1.33 CSCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000751147 [1,1,0,0,0,0|1,0,0]=3 8918 B14R1.33 CSCCC(=O)Cc1ccc(cc1)F 1458a_100000174002_100000198546 [1,1,0,0,0,0|1,0,0]=3 8919 B14R1.33 CSCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000751147 [1,1,0,0,0,0|1,0,0]=3 8920 B14R1.33 CSCCC(=O)Cc1ccc(cc1)I 1458a_100000174002_100000189116 [1,1,0,0,0,0|1,0,0]=3 8921 B14R1.33 CSCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000751147 [1,1,0,0,0,0|1,0,0]=3 8922 B14R1.33 CSCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000751147 [1,1,0,0,0,0|1,0,0]=3 8923 B14R1.33 CSCCC(=O)Cc1ccc(cn1)Br 1458a_100000174002_100000702658 [1,1,0,0,0,0|2,0,0]=4 8924 B14R1.33 CSCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000751147 [1,1,0,0,0,0|2,0,0]=4 8925 B14R1.33 CSCCC(=O)Cc1ccc(cn1)C 1458a_100000174002_100000691093 [1,1,0,0,0,0|2,0,0]=4 8926 B14R1.33 CSCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000751147 [1,1,0,0,0,0|2,0,0]=4 8927 B14R1.33 CSCCC(=O)Cc1ccc(cn1)Cl 1458a_100000174002_100012066911 [1,1,0,0,0,0|2,0,0]=4 8928 B14R1.33 CSCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000751147 [1,1,0,0,0,0|2,0,0]=4 8929 B14R1.33 CSCCC(=O)Cc1ccc(cn1)F 1458a_100000174002_100000703193 [1,1,0,0,0,0|2,0,0]=4 8930 B14R1.33 CSCCC(=O)Cc1ccc(nc1)Br 1458a_100000174002_100009831999 [1,1,0,0,0,0|2,0,0]=4 8931 B14R1.33 CSCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000751147 [1,1,0,0,0,0|2,0,0]=4 8932 B14R1.33 CSCCC(=O)Cc1ccc(nc1)C 1458a_100000174002_100016987292 [1,1,0,0,0,0|2,0,0]=4 8933 B14R1.33 CSCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000751147 [1,1,0,0,0,0|2,0,0]=4 8934 B14R1.33 CSCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000751147 [1,1,0,0,0,0|2,0,0]=4 8935 B14R1.33 CSCCC(=O)Cc1ccc(nc1)Cl 1458a_100000174002_100000735431 [1,1,0,0,0,0|2,0,0]=4 8936 B14R1.33 CSCCC(=O)Cc1ccc(nc1)F 1458a_100000174002_100009820150 [1,1,0,0,0,0|2,0,0]=4 8937 B14R1.33 CSCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000751147 [1,1,0,0,0,0|2,0,0]=4 8938 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000174002 [1,1,0,0,0,0|2,0,0]=4 8939 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000174002 [1,1,0,0,0,0|2,0,0]=4 8940 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000174002 [1,1,0,0,0,0|2,0,0]=4 8941 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000174002 [1,1,0,0,0,0|2,0,0]=4 8942 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 62a_100011219129_200000210301 [1,1,0,0,0,0|2,0,0]=4 8943 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Br 62a_200000210301_100000740023 [1,1,0,0,0,0|2,0,0]=4 8944 B14R1.33 CSCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000174002 [1,1,0,0,0,0|2,0,0]=4 8945 B14R1.33 CSCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000174002 [1,1,0,0,0,0|2,0,0]=4 8946 B14R1.33 CSCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000174002 [1,1,0,0,0,0|2,0,0]=4 8947 B14R1.33 CSCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000174002 [1,1,0,0,0,0|2,0,0]=4 8948 B14R1.33 CSCCC(=O)Nc1ccc(cc1)C 62a_200000210301_200000187088 [1,1,0,0,0,0|2,0,0]=4 8949 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000174002 [1,1,0,0,0,0|2,0,0]=4 8950 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000174002 [1,1,0,0,0,0|2,0,0]=4 8951 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000174002 [1,1,0,0,0,0|2,0,0]=4 8952 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000174002 [1,1,0,0,0,0|2,0,0]=4 8953 B14R1.33 CSCCC(=O)Nc1ccc(cc1)Cl 62a_200000210301_100000188356 [1,1,0,0,0,0|2,0,0]=4 8954 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000174002 [1,1,0,0,0,0|2,0,0]=4 8955 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000174002 [1,1,0,0,0,0|2,0,0]=4 8956 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000174002 [1,1,0,0,0,0|2,0,0]=4 8957 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000174002 [1,1,0,0,0,0|2,0,0]=4 8958 B14R1.33 CSCCC(=O)Nc1ccc(cc1)F 62a_200000210301_100000736363 [1,1,0,0,0,0|2,0,0]=4 8959 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000174002 [1,1,0,0,0,0|2,0,0]=4 8960 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000174002 [1,1,0,0,0,0|2,0,0]=4 8961 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000174002 [1,1,0,0,0,0|2,0,0]=4 8962 B14R1.33 CSCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000174002 [1,1,0,0,0,0|2,0,0]=4 8963 B14R1.33 CSCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000174002 [1,1,0,0,0,0|2,0,0]=4 8964 B14R1.33 CSCCC(=O)Nc1ccc(cc1)O 62a_200000210301_100011302330 [1,1,0,0,0,0|2,0,0]=4 8965 B14R1.33 Cc1ccc(cc1)CC(=O)CCC#N 1458a_100000212244_100011215226 [1,1,0,0,0,0|1,0,1]=4 8966 B14R1.33 Cc1ccc(cc1)CC(=O)CCC#N 1458a_100011934036_100000210814 [1,1,0,0,0,0|1,0,1]=4 8967 B14R1.33 Cc1ccc(cc1)CC(=O)CCCF 1458a_100000212244_100011934791 [1,1,0,0,0,0|1,0,0]=3 8968 B14R1.33 Cc1ccc(cc1)CC(=O)CCCO 1458a_100000212244_100011215043 [1,1,0,0,0,0|1,0,0]=3 8969 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 11a_100000724931_100000212244 [1,1,0,0,0,0|2,0,0]=4 8970 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 240690a_100000724931_100000212244 [1,1,0,0,0,0|2,0,0]=4 8971 B14R1.33 Cc1ccc(cc1)CC(=O)NCCF 527a_100000724931_100000212244 [1,1,0,0,0,0|2,0,0]=4 8972 B14R1.33 Cc1ccc(cc1)CC(=O)NCCO 240690a_100000210304_100000212244 [1,1,0,0,0,0|2,0,0]=4 8973 B14R1.33 Cc1ccc(cc1)CC(=O)NCCO 527a_100000210304_100000212244 [1,1,0,0,0,0|2,0,0]=4 8974 B14R1.33 Cc1ccc(cc1)NC(=O)CCN[13CH3] 34a_100015187665_200025704644 [1,1,0,0,0,0|2,0,0]=4 8975 B14R1.33 Cc1ccc(cc1)NC(=O)CCO[13CH3] 34a_200009859269_200025704644 [1,1,0,0,0,0|2,0,0]=4 8976 B14R1.33 Cc1ccc(cc1)NC(=O)CCO[13CH3] 7a_200009859269_200025704644 [1,1,0,0,0,0|2,0,0]=4 8977 B14R1.33 Cc1ccc(cc1)NC(=O)CCS[13CH3] 62a_200025704644_200000187088 [1,1,0,0,0,0|2,0,0]=4 8978 B14R1.33 Cc1ccc(cn1)CC(=O)CCCF 1458a_100000740413_100011934791 [1,1,0,0,0,0|2,0,0]=4 8979 B14R1.33 Cc1ccc(cn1)CC(=O)CCCO 1458a_100000740413_100011215043 [1,1,0,0,0,0|2,0,0]=4 8980 B14R1.33 Cc1ccc(nc1)CC(=O)CCCF 1458a_100025705728_100011934791 [1,1,0,0,0,0|2,0,0]=4 8981 B14R1.33 Cc1ccc(nc1)CC(=O)CCCO 1458a_100025705728_100011215043 [1,1,0,0,0,0|2,0,0]=4 8982 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215226 [1,1,0,0,0,0|1,0,1]=4 8983 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Br 1458a_100011934036_100000189115 [1,1,0,0,0,0|1,0,1]=4 8984 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215226 [1,1,0,0,0,0|1,0,1]=4 8985 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)Cl 1458a_100011934036_100000694040 [1,1,0,0,0,0|1,0,1]=4 8986 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215226 [1,1,0,0,0,0|1,0,1]=4 8987 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)F 1458a_100011934036_100000198546 [1,1,0,0,0,0|1,0,1]=4 8988 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215226 [1,1,0,0,0,0|1,0,1]=4 8989 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)I 1458a_100011934036_100000189116 [1,1,0,0,0,0|1,0,1]=4 8990 B14R1.33 N#CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215226 [1,1,0,0,0,0|1,0,1]=4 8991 B14R1.33 O=C(CCCF)Cc1ccc(cc1)Br 1458a_100000198978_100011934791 [1,1,0,0,0,0|1,0,0]=3 8992 B14R1.33 O=C(CCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100011934791 [1,1,0,0,0,0|1,0,0]=3 8993 B14R1.33 O=C(CCCF)Cc1ccc(cc1)F 1458a_100000210951_100011934791 [1,1,0,0,0,0|1,0,0]=3 8994 B14R1.33 O=C(CCCF)Cc1ccc(cc1)I 1458a_100000688869_100011934791 [1,1,0,0,0,0|1,0,0]=3 8995 B14R1.33 O=C(CCCF)Cc1ccc(cc1)O 1458a_100000198540_100011934791 [1,1,0,0,0,0|1,0,0]=3 8996 B14R1.33 O=C(CCCF)Cc1ccc(cn1)Br 1458a_100020629044_100011934791 [1,1,0,0,0,0|2,0,0]=4 8997 B14R1.33 O=C(CCCF)Cc1ccc(cn1)Cl 1458a_100000728320_100011934791 [1,1,0,0,0,0|2,0,0]=4 8998 B14R1.33 O=C(CCCF)Cc1ccc(nc1)Br 1458a_100010067268_100011934791 [1,1,0,0,0,0|2,0,0]=4 8999 B14R1.33 O=C(CCCF)Cc1ccc(nc1)Cl 1458a_100000061944_100011934791 [1,1,0,0,0,0|2,0,0]=4 9000 B14R1.33 O=C(CCCF)Cn1ccc(=O)cc1 1458a_200000238563_100011934791 [1,1,0,0,0,0|2,0,0]=4 9001 B14R1.33 O=C(CCCO)Cc1ccc(cc1)Br 1458a_100000198978_100011215043 [1,1,0,0,0,0|1,0,0]=3 9002 B14R1.33 O=C(CCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100011215043 [1,1,0,0,0,0|1,0,0]=3 9003 B14R1.33 O=C(CCCO)Cc1ccc(cc1)F 1458a_100000210951_100011215043 [1,1,0,0,0,0|1,0,0]=3 9004 B14R1.33 O=C(CCCO)Cc1ccc(cc1)I 1458a_100000688869_100011215043 [1,1,0,0,0,0|1,0,0]=3 9005 B14R1.33 O=C(CCCO)Cc1ccc(cc1)O 1458a_100000198540_100011215043 [1,1,0,0,0,0|1,0,0]=3 9006 B14R1.33 O=C(CCCO)Cc1ccc(cn1)Br 1458a_100020629044_100011215043 [1,1,0,0,0,0|2,0,0]=4 9007 B14R1.33 O=C(CCCO)Cc1ccc(cn1)Cl 1458a_100000728320_100011215043 [1,1,0,0,0,0|2,0,0]=4 9008 B14R1.33 O=C(CCCO)Cc1ccc(nc1)Br 1458a_100010067268_100011215043 [1,1,0,0,0,0|2,0,0]=4 9009 B14R1.33 O=C(CCCO)Cc1ccc(nc1)Cl 1458a_100000061944_100011215043 [1,1,0,0,0,0|2,0,0]=4 9010 B14R1.33 O=C(CCCO)Cn1ccc(=O)cc1 1458a_200000238563_100011215043 [1,1,0,0,0,0|2,0,0]=4 9011 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 11a_100000724931_100000198978 [1,1,0,0,0,0|2,0,0]=4 9012 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 240690a_100000724931_100000198978 [1,1,0,0,0,0|2,0,0]=4 9013 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCF 527a_100000724931_100000198978 [1,1,0,0,0,0|2,0,0]=4 9014 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCO 240690a_100000210304_100000198978 [1,1,0,0,0,0|2,0,0]=4 9015 B14R1.33 O=C(Cc1ccc(cc1)Br)NCCO 527a_100000210304_100000198978 [1,1,0,0,0,0|2,0,0]=4 9016 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 11a_100000724931_100000211027 [1,1,0,0,0,0|2,0,0]=4 9017 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 240690a_100000724931_100000211027 [1,1,0,0,0,0|2,0,0]=4 9018 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCF 527a_100000724931_100000211027 [1,1,0,0,0,0|2,0,0]=4 9019 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCO 240690a_100000210304_100000211027 [1,1,0,0,0,0|2,0,0]=4 9020 B14R1.33 O=C(Cc1ccc(cc1)Cl)NCCO 527a_100000210304_100000211027 [1,1,0,0,0,0|2,0,0]=4 9021 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 11a_100000724931_100000210951 [1,1,0,0,0,0|2,0,0]=4 9022 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 1626a_100000724931_100000210951 [1,1,0,0,0,0|2,0,0]=4 9023 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 240690a_100000724931_100000210951 [1,1,0,0,0,0|2,0,0]=4 9024 B14R1.33 O=C(Cc1ccc(cc1)F)NCCF 527a_100000724931_100000210951 [1,1,0,0,0,0|2,0,0]=4 9025 B14R1.33 O=C(Cc1ccc(cc1)F)NCCO 240690a_100000210304_100000210951 [1,1,0,0,0,0|2,0,0]=4 9026 B14R1.33 O=C(Cc1ccc(cc1)F)NCCO 527a_100000210304_100000210951 [1,1,0,0,0,0|2,0,0]=4 9027 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 11a_100000724931_100000688869 [1,1,0,0,0,0|2,0,0]=4 9028 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 1626a_100000724931_100000688869 [1,1,0,0,0,0|2,0,0]=4 9029 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 240690a_100000724931_100000688869 [1,1,0,0,0,0|2,0,0]=4 9030 B14R1.33 O=C(Cc1ccc(cc1)I)NCCF 527a_100000724931_100000688869 [1,1,0,0,0,0|2,0,0]=4 9031 B14R1.33 O=C(Cc1ccc(cc1)I)NCCO 240690a_100000210304_100000688869 [1,1,0,0,0,0|2,0,0]=4 9032 B14R1.33 O=C(Cc1ccc(cc1)I)NCCO 527a_100000210304_100000688869 [1,1,0,0,0,0|2,0,0]=4 9033 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 1626a_100000724931_100000198540 [1,1,0,0,0,0|2,0,0]=4 9034 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 240690a_100000724931_100000198540 [1,1,0,0,0,0|2,0,0]=4 9035 B14R1.33 O=C(Cc1ccc(cc1)O)NCCF 527a_100000724931_100000198540 [1,1,0,0,0,0|2,0,0]=4 9036 B14R1.33 O=C(Cc1ccc(cc1)O)NCCO 240690a_100000210304_100000198540 [1,1,0,0,0,0|2,0,0]=4 9037 B14R1.33 O=C(Cc1ccc(cc1)O)NCCO 527a_100000210304_100000198540 [1,1,0,0,0,0|2,0,0]=4 9038 B14R1.33 [13CH3]NCCC(=O)Nc1ccc(cc1)Br 2230a_100000743120_200025704644 [1,1,0,0,0,0|2,0,0]=4 9039 B14R1.33 [13CH3]NCCC(=O)Nc1ccc(cc1)Br 34a_100000743120_200025704644 [1,1,0,0,0,0|2,0,0]=4 9040 B14R1.33 [13CH3]NCCC(=O)Nc1ccc(cc1)F 2230a_100015184513_200025704644 [1,1,0,0,0,0|2,0,0]=4 9041 B14R1.33 [13CH3]NCCC(=O)Nc1ccc(cc1)F 34a_100015184513_200025704644 [1,1,0,0,0,0|2,0,0]=4 9042 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)Br 62a_100011219129_200025704644 [1,1,0,0,0,0|2,0,0]=4 9043 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)Br 62a_200025704644_100000740023 [1,1,0,0,0,0|2,0,0]=4 9044 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)Cl 62a_200025704644_100000188356 [1,1,0,0,0,0|2,0,0]=4 9045 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)F 62a_200025704644_100000736363 [1,1,0,0,0,0|2,0,0]=4 9046 B14R1.33 [13CH3]SCCC(=O)Nc1ccc(cc1)O 62a_200025704644_100011302330 [1,1,0,0,0,0|2,0,0]=4 9047 B14R1.34 C#CCCC(=O)Cc1cccc(c1)Br 1458a_100000692101_100000211773 [1,1,0,0,0,0|0,0,2]=4 9048 B14R1.34 C#CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000753159 [1,1,0,0,0,0|0,0,2]=4 9049 B14R1.34 C#CCCC(=O)Cc1cccc(c1)C 1458a_100000692101_100000211840 [1,1,0,0,0,0|0,0,2]=4 9050 B14R1.34 C#CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000753159 [1,1,0,0,0,0|0,0,2]=4 9051 B14R1.34 C#CCCC(=O)Cc1cccc(c1)Cl 1458a_100000692101_100000181238 [1,1,0,0,0,0|0,0,2]=4 9052 B14R1.34 C#CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000753159 [1,1,0,0,0,0|0,0,2]=4 9053 B14R1.34 C#CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000753159 [1,1,0,0,0,0|0,0,2]=4 9054 B14R1.34 C#CCCC(=O)Cc1cccc(c1)F 1458a_100000692101_100000230114 [1,1,0,0,0,0|0,0,2]=4 9055 B14R1.34 C#CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000753159 [1,1,0,0,0,0|0,0,2]=4 9056 B14R1.34 C#CCCC(=O)Cc1cccc(c1)I 1458a_100000692101_100011218688 [1,1,0,0,0,0|0,0,2]=4 9057 B14R1.34 C#CCCC(=O)Cc1cccc(c1)O 1458a_100000692101_100011660834 [1,1,0,0,0,0|0,0,2]=4 9058 B14R1.34 C#CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000753159 [1,1,0,0,0,0|0,0,2]=4 9059 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)Br 1458a_100000747190_100102629194 [1,1,0,0,0,0|0,0,2]=4 9060 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)C 1458a_100011206899_100102629194 [1,1,0,0,0,0|0,0,2]=4 9061 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100102629194 [1,1,0,0,0,0|0,0,2]=4 9062 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)F 1458a_100000211661_100102629194 [1,1,0,0,0,0|0,0,2]=4 9063 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)I 1458a_100000238430_100102629194 [1,1,0,0,0,0|0,0,2]=4 9064 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)O 1458a_100000745134_100102629194 [1,1,0,0,0,0|0,0,2]=4 9065 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000754431 [1,1,0,0,0,0|0,0,2]=4 9066 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Br 1458a_100000749702_100000211773 [1,1,0,0,0,0|0,0,2]=4 9067 B14R1.34 C=CCCC(=O)Cc1cccc(c1)C 1458a_100000749702_100000211840 [1,1,0,0,0,0|0,0,2]=4 9068 B14R1.34 C=CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000754431 [1,1,0,0,0,0|0,0,2]=4 9069 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000754431 [1,1,0,0,0,0|0,0,2]=4 9070 B14R1.34 C=CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749702_100000181238 [1,1,0,0,0,0|0,0,2]=4 9071 B14R1.34 C=CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000754431 [1,1,0,0,0,0|0,0,2]=4 9072 B14R1.34 C=CCCC(=O)Cc1cccc(c1)F 1458a_100000749702_100000230114 [1,1,0,0,0,0|0,0,2]=4 9073 B14R1.34 C=CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000754431 [1,1,0,0,0,0|0,0,2]=4 9074 B14R1.34 C=CCCC(=O)Cc1cccc(c1)I 1458a_100000749702_100011218688 [1,1,0,0,0,0|0,0,2]=4 9075 B14R1.34 C=CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000754431 [1,1,0,0,0,0|0,0,2]=4 9076 B14R1.34 C=CCCC(=O)Cc1cccc(c1)O 1458a_100000749702_100011660834 [1,1,0,0,0,0|0,0,2]=4 9077 B14R1.34 CC#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000748600 [1,1,0,0,0,0|0,0,2]=4 9078 B14R1.34 CC#CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000748600 [1,1,0,0,0,0|0,0,2]=4 9079 B14R1.34 CC#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000748600 [1,1,0,0,0,0|0,0,2]=4 9080 B14R1.34 CC#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000748600 [1,1,0,0,0,0|0,0,2]=4 9081 B14R1.34 CC#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000748600 [1,1,0,0,0,0|0,0,2]=4 9082 B14R1.34 CC#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000748600 [1,1,0,0,0,0|0,0,2]=4 9083 B14R1.34 CC=CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000070051 [1,1,0,0,0,0|0,0,2]=4 9084 B14R1.34 CC=CCC(=O)Cc1cccc(c1)Br 1458a_100121576822_100000211773 [1,1,0,0,0,0|0,0,2]=4 9085 B14R1.34 CC=CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000070051 [1,1,0,0,0,0|0,0,2]=4 9086 B14R1.34 CC=CCC(=O)Cc1cccc(c1)C 1458a_100121576822_100000211840 [1,1,0,0,0,0|0,0,2]=4 9087 B14R1.34 CC=CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000070051 [1,1,0,0,0,0|0,0,2]=4 9088 B14R1.34 CC=CCC(=O)Cc1cccc(c1)Cl 1458a_100121576822_100000181238 [1,1,0,0,0,0|0,0,2]=4 9089 B14R1.34 CC=CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000070051 [1,1,0,0,0,0|0,0,2]=4 9090 B14R1.34 CC=CCC(=O)Cc1cccc(c1)F 1458a_100121576822_100000230114 [1,1,0,0,0,0|0,0,2]=4 9091 B14R1.34 CC=CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000070051 [1,1,0,0,0,0|0,0,2]=4 9092 B14R1.34 CC=CCC(=O)Cc1cccc(c1)I 1458a_100121576822_100011218688 [1,1,0,0,0,0|0,0,2]=4 9093 B14R1.34 CC=CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000070051 [1,1,0,0,0,0|0,0,2]=4 9094 B14R1.34 CC=CCC(=O)Cc1cccc(c1)O 1458a_100121576822_100011660834 [1,1,0,0,0,0|0,0,2]=4 9095 B14R1.34 CCC#CC(=O)Cc1cccc(c1)Br 1458a_100011827653_100000211773 [1,1,0,0,0,0|0,0,2]=4 9096 B14R1.34 CCC#CC(=O)Cc1cccc(c1)C 1458a_100011827653_100000211840 [1,1,0,0,0,0|0,0,2]=4 9097 B14R1.34 CCC#CC(=O)Cc1cccc(c1)Cl 1458a_100011827653_100000181238 [1,1,0,0,0,0|0,0,2]=4 9098 B14R1.34 CCC#CC(=O)Cc1cccc(c1)F 1458a_100011827653_100000230114 [1,1,0,0,0,0|0,0,2]=4 9099 B14R1.34 CCC#CC(=O)Cc1cccc(c1)I 1458a_100011827653_100011218688 [1,1,0,0,0,0|0,0,2]=4 9100 B14R1.34 CCC#CC(=O)Cc1cccc(c1)O 1458a_100011827653_100011660834 [1,1,0,0,0,0|0,0,2]=4 9101 B14R1.34 CCC=CC(=O)Cc1cccc(c1)Br 1458a_100000212282_100000211773 [1,1,0,0,0,0|0,0,2]=4 9102 B14R1.34 CCC=CC(=O)Cc1cccc(c1)C 1458a_100000212282_100000211840 [1,1,0,0,0,0|0,0,2]=4 9103 B14R1.34 CCC=CC(=O)Cc1cccc(c1)Cl 1458a_100000212282_100000181238 [1,1,0,0,0,0|0,0,2]=4 9104 B14R1.34 CCC=CC(=O)Cc1cccc(c1)F 1458a_100000212282_100000230114 [1,1,0,0,0,0|0,0,2]=4 9105 B14R1.34 CCC=CC(=O)Cc1cccc(c1)I 1458a_100000212282_100011218688 [1,1,0,0,0,0|0,0,2]=4 9106 B14R1.34 CCC=CC(=O)Cc1cccc(c1)O 1458a_100000212282_100011660834 [1,1,0,0,0,0|0,0,2]=4 9107 B14R1.34 CCCCC(=Cc1cccc(c1)Br)Br 271570a_206741709834_100000691529 [1,1,0,0,0,0|1,0,1]=4 9108 B14R1.34 CCCCC(=Cc1cccc(c1)C)Br 271570a_206741709834_100011215228 [1,1,0,0,0,0|1,0,1]=4 9109 B14R1.34 CCCCC(=Cc1cccc(c1)Cl)Br 271570a_206741709834_100000699651 [1,1,0,0,0,0|1,0,1]=4 9110 B14R1.34 CCCCC(=Cc1cccc(c1)F)Br 271570a_206741709834_100000685547 [1,1,0,0,0,0|1,0,1]=4 9111 B14R1.34 CCCCC(=Cc1cccc(c1)N)Br 271570a_206741709834_100000210019 [1,1,0,0,0,0|1,0,1]=4 9112 B14R1.34 CCCCC(=Cc1cccc(c1)O)Br 271570a_206741709834_100000211634 [1,1,0,0,0,0|1,0,1]=4 9113 B14R1.34 CCCCC(=Cc1cccc(c1)[S])Br 271570a_206741709834_114929384022 [1,1,0,0,0,0|1,0,1]=4 9114 B14R1.34 CCCCC(=O)Cc1cc(ccn1)Br 1458a_100000210183_100010173614 [1,1,0,0,0,0|1,0,0]=3 9115 B14R1.34 CCCCC(=O)Cc1cc(ccn1)C 1458a_100000210183_100000718516 [1,1,0,0,0,0|1,0,0]=3 9116 B14R1.34 CCCCC(=O)Cc1cc(ccn1)Cl 1458a_100000210183_100016988179 [1,1,0,0,0,0|1,0,0]=3 9117 B14R1.34 CCCCC(=O)Cc1cccc(c1)Br 1458a_100000210183_100000211773 [1,1,0,0,0,0|0,0,0]=2 9118 B14R1.34 CCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210211 [1,1,0,0,0,0|0,0,0]=2 9119 B14R1.34 CCCCC(=O)Cc1cccc(c1)C 1458a_100000210183_100000211840 [1,1,0,0,0,0|0,0,0]=2 9120 B14R1.34 CCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210211 [1,1,0,0,0,0|0,0,0]=2 9121 B14R1.34 CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000210183_100000181238 [1,1,0,0,0,0|0,0,0]=2 9122 B14R1.34 CCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210211 [1,1,0,0,0,0|0,0,0]=2 9123 B14R1.34 CCCCC(=O)Cc1cccc(c1)F 1458a_100000210183_100000230114 [1,1,0,0,0,0|0,0,0]=2 9124 B14R1.34 CCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210211 [1,1,0,0,0,0|0,0,0]=2 9125 B14R1.34 CCCCC(=O)Cc1cccc(c1)I 1458a_100000210183_100011218688 [1,1,0,0,0,0|0,0,0]=2 9126 B14R1.34 CCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210211 [1,1,0,0,0,0|0,0,0]=2 9127 B14R1.34 CCCCC(=O)Cc1cccc(c1)O 1458a_100000210183_100011660834 [1,1,0,0,0,0|0,0,0]=2 9128 B14R1.34 CCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210211 [1,1,0,0,0,0|0,0,0]=2 9129 B14R1.34 CCCCC(=O)Cc1cccc(n1)Br 1458a_100000210183_100009889011 [1,1,0,0,0,0|1,0,0]=3 9130 B14R1.34 CCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210211 [1,1,0,0,0,0|1,0,0]=3 9131 B14R1.34 CCCCC(=O)Cc1cccc(n1)C 1458a_100000210183_100000757606 [1,1,0,0,0,0|1,0,0]=3 9132 B14R1.34 CCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210211 [1,1,0,0,0,0|1,0,0]=3 9133 B14R1.34 CCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210211 [1,1,0,0,0,0|1,0,0]=3 9134 B14R1.34 CCCCC(=O)Cc1cccc(n1)Cl 1458a_100000210183_100000086093 [1,1,0,0,0,0|1,0,0]=3 9135 B14R1.34 CCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210211 [1,1,0,0,0,0|1,0,0]=3 9136 B14R1.34 CCCCC(=O)Cc1cccc(n1)F 1458a_100000210183_100009819644 [1,1,0,0,0,0|1,0,0]=3 9137 B14R1.34 CCCCC(=O)Cc1ccnc(c1)Br 1458a_100000210183_100010243470 [1,1,0,0,0,0|1,0,0]=3 9138 B14R1.34 CCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210211 [1,1,0,0,0,0|1,0,0]=3 9139 B14R1.34 CCCCC(=O)Cc1ccnc(c1)C 1458a_100000210183_200020672517 [1,1,0,0,0,0|1,0,0]=3 9140 B14R1.34 CCCCC(=O)Cc1ccnc(c1)Cl 1458a_100000210183_100000764220 [1,1,0,0,0,0|1,0,0]=3 9141 B14R1.34 CCCCC(=O)Cc1ccnc(n1)Cl 1458a_100000210183_100000099655 [1,1,0,0,0,0|2,0,0]=4 9142 B14R1.34 CCCCC(=O)Cc1cncc(c1)Br 1458a_100000210183_100011740620 [1,1,0,0,0,0|1,0,0]=3 9143 B14R1.34 CCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210211 [1,1,0,0,0,0|1,0,0]=3 9144 B14R1.34 CCCCC(=O)Cc1cncc(c1)C 1458a_100000210183_100000716715 [1,1,0,0,0,0|1,0,0]=3 9145 B14R1.34 CCCCC(=O)Cc1cncc(c1)Cl 1458a_100000210183_100016992070 [1,1,0,0,0,0|1,0,0]=3 9146 B14R1.34 CCCCC(=O)Cc1cncc(c1)F 1458a_100000210183_100000725299 [1,1,0,0,0,0|1,0,0]=3 9147 B14R1.34 CCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210211 [1,1,0,0,0,0|1,0,0]=3 9148 B14R1.34 CCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210183 [1,1,0,0,0,0|1,0,0]=3 9149 B14R1.34 CCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210183 [1,1,0,0,0,0|1,0,0]=3 9150 B14R1.34 CCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210183 [1,1,0,0,0,0|1,0,0]=3 9151 B14R1.34 CCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210183 [1,1,0,0,0,0|1,0,0]=3 9152 B14R1.34 CCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210183 [1,1,0,0,0,0|1,0,0]=3 9153 B14R1.34 CCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210183 [1,1,0,0,0,0|1,0,0]=3 9154 B14R1.34 CCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210183 [1,1,0,0,0,0|1,0,0]=3 9155 B14R1.34 CCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210183 [1,1,0,0,0,0|1,0,0]=3 9156 B14R1.34 CCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210183 [1,1,0,0,0,0|1,0,0]=3 9157 B14R1.34 CCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210183 [1,1,0,0,0,0|1,0,0]=3 9158 B14R1.34 CCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210183 [1,1,0,0,0,0|1,0,0]=3 9159 B14R1.34 CCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210183 [1,1,0,0,0,0|1,0,0]=3 9160 B14R1.34 CCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210183 [1,1,0,0,0,0|1,0,0]=3 9161 B14R1.34 CCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210183 [1,1,0,0,0,0|1,0,0]=3 9162 B14R1.34 CCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210183 [1,1,0,0,0,0|1,0,0]=3 9163 B14R1.34 CCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210183 [1,1,0,0,0,0|1,0,0]=3 9164 B14R1.34 CCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210183 [1,1,0,0,0,0|1,0,0]=3 9165 B14R1.34 CCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210183 [1,1,0,0,0,0|1,0,0]=3 9166 B14R1.34 CCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210183 [1,1,0,0,0,0|1,0,0]=3 9167 B14R1.34 CCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210183 [1,1,0,0,0,0|1,0,0]=3 9168 B14R1.34 CCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210183 [1,1,0,0,0,0|1,0,0]=3 9169 B14R1.34 CCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210183 [1,1,0,0,0,0|1,0,0]=3 9170 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 2230a_100000187585_100000210211 [1,1,0,0,0,0|2,0,0]=4 9171 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 2230a_100000207549_100000698116 [1,1,0,0,0,0|2,0,0]=4 9172 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 2230a_100015186518_200000210301 [1,1,0,0,0,0|2,0,0]=4 9173 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 269982a_100000187585_100000210211 [1,1,0,0,0,0|2,0,0]=4 9174 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 269982a_100000207549_100000211773 [1,1,0,0,0,0|2,0,0]=4 9175 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 269982a_100015186518_200000210301 [1,1,0,0,0,0|2,0,0]=4 9176 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 26a_100000207549_100000210342 [1,1,0,0,0,0|2,0,0]=4 9177 B14R1.34 CCCCN(C)Cc1cccc(c1)Br 270004a_100000207549_100000210085 [1,1,0,0,0,0|2,0,0]=4 9178 B14R1.34 CCCCN(C)Cc1cccc(c1)C 2230a_100000207549_100000211840 [1,1,0,0,0,0|2,0,0]=4 9179 B14R1.34 CCCCN(C)Cc1cccc(c1)C 2230a_102495364743_100000210211 [1,1,0,0,0,0|2,0,0]=4 9180 B14R1.34 CCCCN(C)Cc1cccc(c1)C 269982a_100000207549_100000211840 [1,1,0,0,0,0|2,0,0]=4 9181 B14R1.34 CCCCN(C)Cc1cccc(c1)C 269982a_102495364743_100000210211 [1,1,0,0,0,0|2,0,0]=4 9182 B14R1.34 CCCCN(C)Cc1cccc(c1)C 270004a_100000207549_100000211157 [1,1,0,0,0,0|2,0,0]=4 9183 B14R1.34 CCCCN(C)Cc1cccc(c1)C 34a_102495364743_100000210210 [1,1,0,0,0,0|2,0,0]=4 9184 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 2230a_100000207549_100000181238 [1,1,0,0,0,0|2,0,0]=4 9185 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 2230a_100020629429_100000210211 [1,1,0,0,0,0|2,0,0]=4 9186 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 2230a_200015183148_200000210301 [1,1,0,0,0,0|2,0,0]=4 9187 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 269982a_100000207549_100000181238 [1,1,0,0,0,0|2,0,0]=4 9188 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100000210211 [1,1,0,0,0,0|2,0,0]=4 9189 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 269982a_200015183148_200000210301 [1,1,0,0,0,0|2,0,0]=4 9190 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 270004a_100000207549_100000210801 [1,1,0,0,0,0|2,0,0]=4 9191 B14R1.34 CCCCN(C)Cc1cccc(c1)Cl 34a_200015183148_200000210301 [1,1,0,0,0,0|2,0,0]=4 9192 B14R1.34 CCCCN(C)Cc1cccc(c1)F 2230a_100000184398_100000210211 [1,1,0,0,0,0|2,0,0]=4 9193 B14R1.34 CCCCN(C)Cc1cccc(c1)F 2230a_100000207549_100000230114 [1,1,0,0,0,0|2,0,0]=4 9194 B14R1.34 CCCCN(C)Cc1cccc(c1)F 269982a_100000184398_100000210211 [1,1,0,0,0,0|2,0,0]=4 9195 B14R1.34 CCCCN(C)Cc1cccc(c1)F 269982a_100000207549_100000230114 [1,1,0,0,0,0|2,0,0]=4 9196 B14R1.34 CCCCN(C)Cc1cccc(c1)F 270004a_100000207549_100000210812 [1,1,0,0,0,0|2,0,0]=4 9197 B14R1.34 CCCCN(C)Cc1cccc(c1)F 34a_100000184398_100000210210 [1,1,0,0,0,0|2,0,0]=4 9198 B14R1.34 CCCCN(C)Cc1cccc(c1)I 2230a_100000207549_100011218688 [1,1,0,0,0,0|2,0,0]=4 9199 B14R1.34 CCCCN(C)Cc1cccc(c1)I 269982a_100000207549_100011218688 [1,1,0,0,0,0|2,0,0]=4 9200 B14R1.34 CCCCN(C)Cc1cccc(c1)I 270004a_100000207549_100000014684 [1,1,0,0,0,0|2,0,0]=4 9201 B14R1.34 CCCCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210211 [1,1,0,0,0,0|2,0,0]=4 9202 B14R1.34 CCCCN(C)Cc1cccc(c1)O 2230a_100000207549_100011660834 [1,1,0,0,0,0|2,0,0]=4 9203 B14R1.34 CCCCN(C)Cc1cccc(c1)O 269982a_100000207540_100000210211 [1,1,0,0,0,0|2,0,0]=4 9204 B14R1.34 CCCCN(C)Cc1cccc(c1)O 269982a_100000207549_100000084143 [1,1,0,0,0,0|2,0,0]=4 9205 B14R1.34 CCCCN(C)Cc1cccc(c1)O 270004a_100000207549_100000188321 [1,1,0,0,0,0|2,0,0]=4 9206 B14R1.34 CCCCN([13CH3])Cc1cccc(c1)Br 2230a_100015186518_200025704644 [1,1,0,0,0,0|2,0,0]=4 9207 B14R1.34 CCCCN([13CH3])Cc1cccc(c1)Br 269982a_100015186518_200025704644 [1,1,0,0,0,0|2,0,0]=4 9208 B14R1.34 CCCCN([13CH3])Cc1cccc(c1)Cl 2230a_200015183148_200025704644 [1,1,0,0,0,0|2,0,0]=4 9209 B14R1.34 CCCCN([13CH3])Cc1cccc(c1)Cl 269982a_200015183148_200025704644 [1,1,0,0,0,0|2,0,0]=4 9210 B14R1.34 CCCCN([13CH3])Cc1cccc(c1)Cl 34a_200015183148_200025704644 [1,1,0,0,0,0|2,0,0]=4 9211 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br 11a_100020643023_100000747190 [1,1,0,0,0,0|1,0,0]=3 9212 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br 240690a_100020643023_100000747190 [1,1,0,0,0,0|1,0,0]=3 9213 B14R1.34 CCCNC(=O)Cc1cccc(c1)Br 527a_100020643023_100000747190 [1,1,0,0,0,0|1,0,0]=3 9214 B14R1.34 CCCNC(=O)Cc1cccc(c1)C 11a_100020643023_100011206899 [1,1,0,0,0,0|1,0,0]=3 9215 B14R1.34 CCCNC(=O)Cc1cccc(c1)C 1626a_100020643023_100011206899 [1,1,0,0,0,0|1,0,0]=3 9216 B14R1.34 CCCNC(=O)Cc1cccc(c1)C 240690a_100020643023_100011206899 [1,1,0,0,0,0|1,0,0]=3 9217 B14R1.34 CCCNC(=O)Cc1cccc(c1)C 527a_100020643023_100011206899 [1,1,0,0,0,0|1,0,0]=3 9218 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl 11a_100020643023_100000749307 [1,1,0,0,0,0|1,0,0]=3 9219 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl 1626a_100020643023_100000749307 [1,1,0,0,0,0|1,0,0]=3 9220 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl 240690a_100020643023_100000749307 [1,1,0,0,0,0|1,0,0]=3 9221 B14R1.34 CCCNC(=O)Cc1cccc(c1)Cl 527a_100020643023_100000749307 [1,1,0,0,0,0|1,0,0]=3 9222 B14R1.34 CCCNC(=O)Cc1cccc(c1)F 11a_100020643023_100000211661 [1,1,0,0,0,0|1,0,0]=3 9223 B14R1.34 CCCNC(=O)Cc1cccc(c1)F 1626a_100020643023_100000211661 [1,1,0,0,0,0|1,0,0]=3 9224 B14R1.34 CCCNC(=O)Cc1cccc(c1)F 240690a_100020643023_100000211661 [1,1,0,0,0,0|1,0,0]=3 9225 B14R1.34 CCCNC(=O)Cc1cccc(c1)F 527a_100020643023_100000211661 [1,1,0,0,0,0|1,0,0]=3 9226 B14R1.34 CCCNC(=O)Cc1cccc(c1)I 11a_100020643023_100000238430 [1,1,0,0,0,0|1,0,0]=3 9227 B14R1.34 CCCNC(=O)Cc1cccc(c1)I 1626a_100020643023_100000238430 [1,1,0,0,0,0|1,0,0]=3 9228 B14R1.34 CCCNC(=O)Cc1cccc(c1)I 240690a_100020643023_100000238430 [1,1,0,0,0,0|1,0,0]=3 9229 B14R1.34 CCCNC(=O)Cc1cccc(c1)I 527a_100020643023_100000238430 [1,1,0,0,0,0|1,0,0]=3 9230 B14R1.34 CCCNC(=O)Cc1cccc(c1)O 240690a_100020643023_100000745134 [1,1,0,0,0,0|1,0,0]=3 9231 B14R1.34 CCCNC(=O)Cc1cccc(c1)O 527a_100020643023_100000745134 [1,1,0,0,0,0|1,0,0]=3 9232 B14R1.34 CCCNC(=O)Cc1cccc(n1)Br 11a_100020643023_100010201708 [1,1,0,0,0,0|2,0,0]=4 9233 B14R1.34 CCCNC(=O)Cc1cccc(n1)Br 240690a_100020643023_100010201708 [1,1,0,0,0,0|2,0,0]=4 9234 B14R1.34 CCCNC(=O)Cc1cccc(n1)Br 527a_100020643023_100010201708 [1,1,0,0,0,0|2,0,0]=4 9235 B14R1.34 CCCNC(=O)Cc1cccc(n1)C 11a_100020643023_100012001110 [1,1,0,0,0,0|2,0,0]=4 9236 B14R1.34 CCCNC(=O)Cc1cccc(n1)C 1626a_100020643023_100012001110 [1,1,0,0,0,0|2,0,0]=4 9237 B14R1.34 CCCNC(=O)Cc1cccc(n1)C 240690a_100020643023_100012001110 [1,1,0,0,0,0|2,0,0]=4 9238 B14R1.34 CCCNC(=O)Cc1cccc(n1)C 527a_100020643023_100012001110 [1,1,0,0,0,0|2,0,0]=4 9239 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl 11a_100020643023_100000090259 [1,1,0,0,0,0|2,0,0]=4 9240 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl 1626a_100020643023_100000090259 [1,1,0,0,0,0|2,0,0]=4 9241 B14R1.34 CCCNC(=O)Cc1cccc(n1)Cl 240690a_100020643023_100000090259 [1,1,0,0,0,0|2,0,0]=4 9242 B14R1.34 CCCNC(=O)Cc1cccc(n1)F 11a_100020643023_100000096803 [1,1,0,0,0,0|2,0,0]=4 9243 B14R1.34 CCCNC(=O)Cc1cccc(n1)F 1626a_100020643023_100000096803 [1,1,0,0,0,0|2,0,0]=4 9244 B14R1.34 CCCNC(=O)Cc1cccc(n1)F 240690a_100020643023_100000096803 [1,1,0,0,0,0|2,0,0]=4 9245 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Br 11a_100020643023_100010126891 [1,1,0,0,0,0|2,0,0]=4 9246 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Br 240690a_100020643023_100010126891 [1,1,0,0,0,0|2,0,0]=4 9247 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Br 527a_100020643023_100010126891 [1,1,0,0,0,0|2,0,0]=4 9248 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Cl 11a_100020643023_100000085289 [1,1,0,0,0,0|2,0,0]=4 9249 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Cl 1626a_100020643023_100000085289 [1,1,0,0,0,0|2,0,0]=4 9250 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Cl 240690a_100020643023_100000085289 [1,1,0,0,0,0|2,0,0]=4 9251 B14R1.34 CCCNC(=O)Cc1ccnc(c1)Cl 527a_100020643023_100000085289 [1,1,0,0,0,0|2,0,0]=4 9252 B14R1.34 CCCNC(=O)Cc1cncc(c1)Br 11a_100020643023_100000239331 [1,1,0,0,0,0|2,0,0]=4 9253 B14R1.34 CCCNC(=O)Cc1cncc(c1)Br 240690a_100020643023_100000239331 [1,1,0,0,0,0|2,0,0]=4 9254 B14R1.34 CCCNC(=O)Cc1cncc(c1)Br 527a_100020643023_100000239331 [1,1,0,0,0,0|2,0,0]=4 9255 B14R1.34 CCCNC(=O)Cc1cncc(c1)F 11a_100020643023_100011667516 [1,1,0,0,0,0|2,0,0]=4 9256 B14R1.34 CCCNC(=O)Cc1cncc(c1)F 240690a_100020643023_100011667516 [1,1,0,0,0,0|2,0,0]=4 9257 B14R1.34 CCCNC(=O)Cc1cncc(c1)F 527a_100020643023_100011667516 [1,1,0,0,0,0|2,0,0]=4 9258 B14R1.34 CCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100020643023 [1,1,0,0,0,0|2,0,0]=4 9259 B14R1.34 CCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100020643023 [1,1,0,0,0,0|2,0,0]=4 9260 B14R1.34 CCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100020643023 [1,1,0,0,0,0|2,0,0]=4 9261 B14R1.34 CCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100020643023 [1,1,0,0,0,0|2,0,0]=4 9262 B14R1.34 CCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100020643023 [1,1,0,0,0,0|2,0,0]=4 9263 B14R1.34 CCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100020643023 [1,1,0,0,0,0|2,0,0]=4 9264 B14R1.34 CCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100020643023 [1,1,0,0,0,0|2,0,0]=4 9265 B14R1.34 CCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100020643023 [1,1,0,0,0,0|2,0,0]=4 9266 B14R1.34 CCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100020643023 [1,1,0,0,0,0|2,0,0]=4 9267 B14R1.34 CCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100020643023 [1,1,0,0,0,0|2,0,0]=4 9268 B14R1.34 CCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100020643023 [1,1,0,0,0,0|2,0,0]=4 9269 B14R1.34 CCNCC(=O)Nc1cccc(c1)Br 2230a_100015525214_100000183509 [1,1,0,0,0,0|2,0,0]=4 9270 B14R1.34 CCNCC(=O)Nc1cccc(c1)C 2230a_100015525214_100000182861 [1,1,0,0,0,0|2,0,0]=4 9271 B14R1.34 CCNCC(=O)Nc1cccc(c1)Cl 2230a_100015525214_100000182995 [1,1,0,0,0,0|2,0,0]=4 9272 B14R1.34 CCNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_100000210202 [1,1,0,0,0,0|2,0,0]=4 9273 B14R1.34 CCNCC(=O)Nc1cccc(c1)F 2230a_100000168492_100000210202 [1,1,0,0,0,0|2,0,0]=4 9274 B14R1.34 CCNCC(=O)Nc1cccc(c1)F 2230a_100015525214_100000183335 [1,1,0,0,0,0|2,0,0]=4 9275 B14R1.34 CCNCC(=O)Nc1cccc(c1)F 34a_100000168492_100000210202 [1,1,0,0,0,0|2,0,0]=4 9276 B14R1.34 CCNCC(=O)Nc1cccc(c1)O 2230a_100015525214_100011236192 [1,1,0,0,0,0|2,0,0]=4 9277 B14R1.34 CCNNC(=O)Cc1cccc(c1)Br 22a_100000756455_100000747190 [1,1,0,0,0,0|2,0,0]=4 9278 B14R1.34 CCNNC(=O)Cc1cccc(c1)C 22a_100000756455_100011206899 [1,1,0,0,0,0|2,0,0]=4 9279 B14R1.34 CCNNC(=O)Cc1cccc(c1)Cl 22a_100000756455_100000749307 [1,1,0,0,0,0|2,0,0]=4 9280 B14R1.34 CCNNC(=O)Cc1cccc(c1)F 22a_100000756455_100000211661 [1,1,0,0,0,0|2,0,0]=4 9281 B14R1.34 CCNNC(=O)Cc1cccc(c1)I 22a_100000756455_100000238430 [1,1,0,0,0,0|2,0,0]=4 9282 B14R1.34 CCNNC(=O)Cc1cccc(c1)O 22a_100000756455_100000745134 [1,1,0,0,0,0|2,0,0]=4 9283 B14R1.34 CCOCC(=O)Cc1cc(ccn1)Br 1458a_100000211967_100010173614 [1,1,0,0,0,0|2,0,0]=4 9284 B14R1.34 CCOCC(=O)Cc1cc(ccn1)C 1458a_100000211967_100000718516 [1,1,0,0,0,0|2,0,0]=4 9285 B14R1.34 CCOCC(=O)Cc1cc(ccn1)Cl 1458a_100000211967_100016988179 [1,1,0,0,0,0|2,0,0]=4 9286 B14R1.34 CCOCC(=O)Cc1cccc(c1)Br 1458a_100000211967_100000211773 [1,1,0,0,0,0|1,0,0]=3 9287 B14R1.34 CCOCC(=O)Cc1cccc(c1)C 1458a_100000211967_100000211840 [1,1,0,0,0,0|1,0,0]=3 9288 B14R1.34 CCOCC(=O)Cc1cccc(c1)Cl 1458a_100000211967_100000181238 [1,1,0,0,0,0|1,0,0]=3 9289 B14R1.34 CCOCC(=O)Cc1cccc(c1)F 1458a_100000211967_100000230114 [1,1,0,0,0,0|1,0,0]=3 9290 B14R1.34 CCOCC(=O)Cc1cccc(c1)I 1458a_100000211967_100011218688 [1,1,0,0,0,0|1,0,0]=3 9291 B14R1.34 CCOCC(=O)Cc1cccc(c1)O 1458a_100000211967_100011660834 [1,1,0,0,0,0|1,0,0]=3 9292 B14R1.34 CCOCC(=O)Cc1cccc(n1)Br 1458a_100000211967_100009889011 [1,1,0,0,0,0|2,0,0]=4 9293 B14R1.34 CCOCC(=O)Cc1cccc(n1)C 1458a_100000211967_100000757606 [1,1,0,0,0,0|2,0,0]=4 9294 B14R1.34 CCOCC(=O)Cc1cccc(n1)Cl 1458a_100000211967_100000086093 [1,1,0,0,0,0|2,0,0]=4 9295 B14R1.34 CCOCC(=O)Cc1cccc(n1)F 1458a_100000211967_100009819644 [1,1,0,0,0,0|2,0,0]=4 9296 B14R1.34 CCOCC(=O)Cc1ccnc(c1)Br 1458a_100000211967_100010243470 [1,1,0,0,0,0|2,0,0]=4 9297 B14R1.34 CCOCC(=O)Cc1ccnc(c1)C 1458a_100000211967_200020672517 [1,1,0,0,0,0|2,0,0]=4 9298 B14R1.34 CCOCC(=O)Cc1ccnc(c1)Cl 1458a_100000211967_100000764220 [1,1,0,0,0,0|2,0,0]=4 9299 B14R1.34 CCOCC(=O)Cc1cncc(c1)Br 1458a_100000211967_100011740620 [1,1,0,0,0,0|2,0,0]=4 9300 B14R1.34 CCOCC(=O)Cc1cncc(c1)C 1458a_100000211967_100000716715 [1,1,0,0,0,0|2,0,0]=4 9301 B14R1.34 CCOCC(=O)Cc1cncc(c1)Cl 1458a_100000211967_100016992070 [1,1,0,0,0,0|2,0,0]=4 9302 B14R1.34 CCOCC(=O)Cc1cncc(c1)F 1458a_100000211967_100000725299 [1,1,0,0,0,0|2,0,0]=4 9303 B14R1.34 CCOCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000211967 [1,1,0,0,0,0|2,0,0]=4 9304 B14R1.34 CCOCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000211967 [1,1,0,0,0,0|2,0,0]=4 9305 B14R1.34 CCOCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000211967 [1,1,0,0,0,0|2,0,0]=4 9306 B14R1.34 CCOCC(=O)Nc1cccc(c1)Br 34a_100121572206_100000183509 [1,1,0,0,0,0|2,0,0]=4 9307 B14R1.34 CCOCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000211967 [1,1,0,0,0,0|2,0,0]=4 9308 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 11a_100000188690_100000211967 [1,1,0,0,0,0|2,0,0]=4 9309 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000211967 [1,1,0,0,0,0|2,0,0]=4 9310 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 22a_100000188690_100000211967 [1,1,0,0,0,0|2,0,0]=4 9311 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100000210202 [1,1,0,0,0,0|2,0,0]=4 9312 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 34a_100121572206_100000182861 [1,1,0,0,0,0|2,0,0]=4 9313 B14R1.34 CCOCC(=O)Nc1cccc(c1)C 527a_100000188690_100000211967 [1,1,0,0,0,0|2,0,0]=4 9314 B14R1.34 CCOCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000211967 [1,1,0,0,0,0|2,0,0]=4 9315 B14R1.34 CCOCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000211967 [1,1,0,0,0,0|2,0,0]=4 9316 B14R1.34 CCOCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000211967 [1,1,0,0,0,0|2,0,0]=4 9317 B14R1.34 CCOCC(=O)Nc1cccc(c1)Cl 34a_100121572206_100000182995 [1,1,0,0,0,0|2,0,0]=4 9318 B14R1.34 CCOCC(=O)Nc1cccc(c1)F 11a_100000210047_100000211967 [1,1,0,0,0,0|2,0,0]=4 9319 B14R1.34 CCOCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000211967 [1,1,0,0,0,0|2,0,0]=4 9320 B14R1.34 CCOCC(=O)Nc1cccc(c1)F 22a_100000210047_100000211967 [1,1,0,0,0,0|2,0,0]=4 9321 B14R1.34 CCOCC(=O)Nc1cccc(c1)F 34a_100121572206_100000183335 [1,1,0,0,0,0|2,0,0]=4 9322 B14R1.34 CCOCC(=O)Nc1cccc(c1)F 527a_100000210047_100000211967 [1,1,0,0,0,0|2,0,0]=4 9323 B14R1.34 CCOCC(=O)Nc1cccc(c1)I 11a_100000211102_100000211967 [1,1,0,0,0,0|2,0,0]=4 9324 B14R1.34 CCOCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000211967 [1,1,0,0,0,0|2,0,0]=4 9325 B14R1.34 CCOCC(=O)Nc1cccc(c1)I 22a_100000211102_100000211967 [1,1,0,0,0,0|2,0,0]=4 9326 B14R1.34 CCOCC(=O)Nc1cccc(c1)I 527a_100000211102_100000211967 [1,1,0,0,0,0|2,0,0]=4 9327 B14R1.34 CCOCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000211967 [1,1,0,0,0,0|2,0,0]=4 9328 B14R1.34 CCOCC(=O)Nc1cccc(c1)O 22a_100000210217_100000211967 [1,1,0,0,0,0|2,0,0]=4 9329 B14R1.34 CCOCC(=O)Nc1cccc(c1)O 34a_100121572206_100011236192 [1,1,0,0,0,0|2,0,0]=4 9330 B14R1.34 CCOCC(=O)Nc1cccc(c1)O 527a_100000210217_100000211967 [1,1,0,0,0,0|2,0,0]=4 9331 B14R1.34 CCSCC(=O)Cc1cc(ccn1)Br 1458a_100000230394_100010173614 [1,1,0,0,0,0|2,0,0]=4 9332 B14R1.34 CCSCC(=O)Cc1cc(ccn1)C 1458a_100000230394_100000718516 [1,1,0,0,0,0|2,0,0]=4 9333 B14R1.34 CCSCC(=O)Cc1cc(ccn1)Cl 1458a_100000230394_100016988179 [1,1,0,0,0,0|2,0,0]=4 9334 B14R1.34 CCSCC(=O)Cc1cccc(c1)Br 1458a_100000230394_100000211773 [1,1,0,0,0,0|1,0,0]=3 9335 B14R1.34 CCSCC(=O)Cc1cccc(c1)C 1458a_100000230394_100000211840 [1,1,0,0,0,0|1,0,0]=3 9336 B14R1.34 CCSCC(=O)Cc1cccc(c1)Cl 1458a_100000230394_100000181238 [1,1,0,0,0,0|1,0,0]=3 9337 B14R1.34 CCSCC(=O)Cc1cccc(c1)F 1458a_100000230394_100000230114 [1,1,0,0,0,0|1,0,0]=3 9338 B14R1.34 CCSCC(=O)Cc1cccc(c1)I 1458a_100000230394_100011218688 [1,1,0,0,0,0|1,0,0]=3 9339 B14R1.34 CCSCC(=O)Cc1cccc(c1)O 1458a_100000230394_100011660834 [1,1,0,0,0,0|1,0,0]=3 9340 B14R1.34 CCSCC(=O)Cc1cccc(n1)Br 1458a_100000230394_100009889011 [1,1,0,0,0,0|2,0,0]=4 9341 B14R1.34 CCSCC(=O)Cc1cccc(n1)C 1458a_100000230394_100000757606 [1,1,0,0,0,0|2,0,0]=4 9342 B14R1.34 CCSCC(=O)Cc1cccc(n1)Cl 1458a_100000230394_100000086093 [1,1,0,0,0,0|2,0,0]=4 9343 B14R1.34 CCSCC(=O)Cc1cccc(n1)F 1458a_100000230394_100009819644 [1,1,0,0,0,0|2,0,0]=4 9344 B14R1.34 CCSCC(=O)Cc1ccnc(c1)Br 1458a_100000230394_100010243470 [1,1,0,0,0,0|2,0,0]=4 9345 B14R1.34 CCSCC(=O)Cc1ccnc(c1)C 1458a_100000230394_200020672517 [1,1,0,0,0,0|2,0,0]=4 9346 B14R1.34 CCSCC(=O)Cc1ccnc(c1)Cl 1458a_100000230394_100000764220 [1,1,0,0,0,0|2,0,0]=4 9347 B14R1.34 CCSCC(=O)Cc1cncc(c1)Br 1458a_100000230394_100011740620 [1,1,0,0,0,0|2,0,0]=4 9348 B14R1.34 CCSCC(=O)Cc1cncc(c1)C 1458a_100000230394_100000716715 [1,1,0,0,0,0|2,0,0]=4 9349 B14R1.34 CCSCC(=O)Cc1cncc(c1)Cl 1458a_100000230394_100016992070 [1,1,0,0,0,0|2,0,0]=4 9350 B14R1.34 CCSCC(=O)Cc1cncc(c1)F 1458a_100000230394_100000725299 [1,1,0,0,0,0|2,0,0]=4 9351 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000230394 [1,1,0,0,0,0|2,0,0]=4 9352 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000230394 [1,1,0,0,0,0|2,0,0]=4 9353 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000230394 [1,1,0,0,0,0|2,0,0]=4 9354 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000230394 [1,1,0,0,0,0|2,0,0]=4 9355 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 62a_100000183509_100000210202 [1,1,0,0,0,0|2,0,0]=4 9356 B14R1.34 CCSCC(=O)Nc1cccc(c1)Br 62a_100000210202_100000183509 [1,1,0,0,0,0|2,0,0]=4 9357 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000230394 [1,1,0,0,0,0|2,0,0]=4 9358 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000230394 [1,1,0,0,0,0|2,0,0]=4 9359 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000230394 [1,1,0,0,0,0|2,0,0]=4 9360 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000230394 [1,1,0,0,0,0|2,0,0]=4 9361 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 62a_100000210202_100000182861 [1,1,0,0,0,0|2,0,0]=4 9362 B14R1.34 CCSCC(=O)Nc1cccc(c1)C 62a_100000243722_100000210202 [1,1,0,0,0,0|2,0,0]=4 9363 B14R1.34 CCSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000230394 [1,1,0,0,0,0|2,0,0]=4 9364 B14R1.34 CCSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000230394 [1,1,0,0,0,0|2,0,0]=4 9365 B14R1.34 CCSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000230394 [1,1,0,0,0,0|2,0,0]=4 9366 B14R1.34 CCSCC(=O)Nc1cccc(c1)Cl 62a_100000210202_100000182995 [1,1,0,0,0,0|2,0,0]=4 9367 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000230394 [1,1,0,0,0,0|2,0,0]=4 9368 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000230394 [1,1,0,0,0,0|2,0,0]=4 9369 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000230394 [1,1,0,0,0,0|2,0,0]=4 9370 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000230394 [1,1,0,0,0,0|2,0,0]=4 9371 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 62a_100000183335_100000210202 [1,1,0,0,0,0|2,0,0]=4 9372 B14R1.34 CCSCC(=O)Nc1cccc(c1)F 62a_100000210202_100000183335 [1,1,0,0,0,0|2,0,0]=4 9373 B14R1.34 CCSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000230394 [1,1,0,0,0,0|2,0,0]=4 9374 B14R1.34 CCSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000230394 [1,1,0,0,0,0|2,0,0]=4 9375 B14R1.34 CCSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000230394 [1,1,0,0,0,0|2,0,0]=4 9376 B14R1.34 CCSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000230394 [1,1,0,0,0,0|2,0,0]=4 9377 B14R1.34 CCSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000230394 [1,1,0,0,0,0|2,0,0]=4 9378 B14R1.34 CCSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000230394 [1,1,0,0,0,0|2,0,0]=4 9379 B14R1.34 CCSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000230394 [1,1,0,0,0,0|2,0,0]=4 9380 B14R1.34 CCSCC(=O)Nc1cccc(c1)O 62a_100000210202_100011236192 [1,1,0,0,0,0|2,0,0]=4 9381 B14R1.34 CNCCC(=O)Nc1cccc(c1)C 2230a_106832991635_100011194834 [1,1,0,0,0,0|2,0,0]=4 9382 B14R1.34 CNCCC(=O)Nc1cccc(c1)C 2230a_200015186421_200000210301 [1,1,0,0,0,0|2,0,0]=4 9383 B14R1.34 CNCCC(=O)Nc1cccc(c1)C 34a_100102657272_100011194834 [1,1,0,0,0,0|2,0,0]=4 9384 B14R1.34 CNCCC(=O)Nc1cccc(c1)C 34a_200015186421_200000210301 [1,1,0,0,0,0|2,0,0]=4 9385 B14R1.34 CNCCC(=O)Nc1cccc(c1)C 7a_106832991635_100011194834 [1,1,0,0,0,0|2,0,0]=4 9386 B14R1.34 CNCCC(=O)Nc1cccc(c1)Cl 2230a_106832991635_100000242061 [1,1,0,0,0,0|2,0,0]=4 9387 B14R1.34 CNCCC(=O)Nc1cccc(c1)Cl 34a_100102657272_100000242061 [1,1,0,0,0,0|2,0,0]=4 9388 B14R1.34 CNCCC(=O)Nc1cccc(c1)Cl 7a_106832991635_100000242061 [1,1,0,0,0,0|2,0,0]=4 9389 B14R1.34 CNCCC(=O)Nc1cccc(c1)F 2230a_100015185233_200000210301 [1,1,0,0,0,0|2,0,0]=4 9390 B14R1.34 CNCCC(=O)Nc1cccc(c1)F 2230a_106832991635_100000242062 [1,1,0,0,0,0|2,0,0]=4 9391 B14R1.34 CNCCC(=O)Nc1cccc(c1)F 34a_100015185233_200000210301 [1,1,0,0,0,0|2,0,0]=4 9392 B14R1.34 CNCCC(=O)Nc1cccc(c1)F 34a_100102657272_100000242062 [1,1,0,0,0,0|2,0,0]=4 9393 B14R1.34 CNCCC(=O)Nc1cccc(c1)F 7a_106832991635_100000242062 [1,1,0,0,0,0|2,0,0]=4 9394 B14R1.34 CNCCC(=O)Nc1cccc(c1)O 2230a_106832991635_200011436826 [1,1,0,0,0,0|2,0,0]=4 9395 B14R1.34 CNCCC(=O)Nc1cccc(c1)O 34a_100102657272_200011436826 [1,1,0,0,0,0|2,0,0]=4 9396 B14R1.34 CNCCC(=O)Nc1cccc(c1)O 7a_106832991635_200011436826 [1,1,0,0,0,0|2,0,0]=4 9397 B14R1.34 COCCC(=O)Cc1cc(ccn1)Br 1458a_100000749529_100010173614 [1,1,0,0,0,0|2,0,0]=4 9398 B14R1.34 COCCC(=O)Cc1cc(ccn1)C 1458a_100000749529_100000718516 [1,1,0,0,0,0|2,0,0]=4 9399 B14R1.34 COCCC(=O)Cc1cc(ccn1)Cl 1458a_100000749529_100016988179 [1,1,0,0,0,0|2,0,0]=4 9400 B14R1.34 COCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000233755 [1,1,0,0,0,0|1,0,0]=3 9401 B14R1.34 COCCC(=O)Cc1cccc(c1)Br 1458a_100000749529_100000211773 [1,1,0,0,0,0|1,0,0]=3 9402 B14R1.34 COCCC(=O)Cc1cccc(c1)C 1458a_100000749529_100000211840 [1,1,0,0,0,0|1,0,0]=3 9403 B14R1.34 COCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000233755 [1,1,0,0,0,0|1,0,0]=3 9404 B14R1.34 COCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000233755 [1,1,0,0,0,0|1,0,0]=3 9405 B14R1.34 COCCC(=O)Cc1cccc(c1)Cl 1458a_100000749529_100000181238 [1,1,0,0,0,0|1,0,0]=3 9406 B14R1.34 COCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000233755 [1,1,0,0,0,0|1,0,0]=3 9407 B14R1.34 COCCC(=O)Cc1cccc(c1)F 1458a_100000749529_100000230114 [1,1,0,0,0,0|1,0,0]=3 9408 B14R1.34 COCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000233755 [1,1,0,0,0,0|1,0,0]=3 9409 B14R1.34 COCCC(=O)Cc1cccc(c1)I 1458a_100000749529_100011218688 [1,1,0,0,0,0|1,0,0]=3 9410 B14R1.34 COCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000233755 [1,1,0,0,0,0|1,0,0]=3 9411 B14R1.34 COCCC(=O)Cc1cccc(c1)O 1458a_100000749529_100011660834 [1,1,0,0,0,0|1,0,0]=3 9412 B14R1.34 COCCC(=O)Cc1cccc(n1)Br 1458a_100000749529_100009889011 [1,1,0,0,0,0|2,0,0]=4 9413 B14R1.34 COCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000233755 [1,1,0,0,0,0|2,0,0]=4 9414 B14R1.34 COCCC(=O)Cc1cccc(n1)C 1458a_100000749529_100000757606 [1,1,0,0,0,0|2,0,0]=4 9415 B14R1.34 COCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000233755 [1,1,0,0,0,0|2,0,0]=4 9416 B14R1.34 COCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000233755 [1,1,0,0,0,0|2,0,0]=4 9417 B14R1.34 COCCC(=O)Cc1cccc(n1)Cl 1458a_100000749529_100000086093 [1,1,0,0,0,0|2,0,0]=4 9418 B14R1.34 COCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000233755 [1,1,0,0,0,0|2,0,0]=4 9419 B14R1.34 COCCC(=O)Cc1cccc(n1)F 1458a_100000749529_100009819644 [1,1,0,0,0,0|2,0,0]=4 9420 B14R1.34 COCCC(=O)Cc1ccnc(c1)Br 1458a_100000749529_100010243470 [1,1,0,0,0,0|2,0,0]=4 9421 B14R1.34 COCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000233755 [1,1,0,0,0,0|2,0,0]=4 9422 B14R1.34 COCCC(=O)Cc1ccnc(c1)C 1458a_100000749529_200020672517 [1,1,0,0,0,0|2,0,0]=4 9423 B14R1.34 COCCC(=O)Cc1ccnc(c1)Cl 1458a_100000749529_100000764220 [1,1,0,0,0,0|2,0,0]=4 9424 B14R1.34 COCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000233755 [1,1,0,0,0,0|2,0,0]=4 9425 B14R1.34 COCCC(=O)Cc1cncc(c1)Br 1458a_100000749529_100011740620 [1,1,0,0,0,0|2,0,0]=4 9426 B14R1.34 COCCC(=O)Cc1cncc(c1)C 1458a_100000749529_100000716715 [1,1,0,0,0,0|2,0,0]=4 9427 B14R1.34 COCCC(=O)Cc1cncc(c1)Cl 1458a_100000749529_100016992070 [1,1,0,0,0,0|2,0,0]=4 9428 B14R1.34 COCCC(=O)Cc1cncc(c1)F 1458a_100000749529_100000725299 [1,1,0,0,0,0|2,0,0]=4 9429 B14R1.34 COCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000233755 [1,1,0,0,0,0|2,0,0]=4 9430 B14R1.34 COCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000749529 [1,1,0,0,0,0|2,0,0]=4 9431 B14R1.34 COCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000749529 [1,1,0,0,0,0|2,0,0]=4 9432 B14R1.34 COCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000749529 [1,1,0,0,0,0|2,0,0]=4 9433 B14R1.34 COCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000749529 [1,1,0,0,0,0|2,0,0]=4 9434 B14R1.34 COCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000749529 [1,1,0,0,0,0|2,0,0]=4 9435 B14R1.34 COCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000749529 [1,1,0,0,0,0|2,0,0]=4 9436 B14R1.34 COCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000749529 [1,1,0,0,0,0|2,0,0]=4 9437 B14R1.34 COCCC(=O)Nc1cccc(c1)C 34a_100138415774_100011194834 [1,1,0,0,0,0|2,0,0]=4 9438 B14R1.34 COCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000749529 [1,1,0,0,0,0|2,0,0]=4 9439 B14R1.34 COCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000749529 [1,1,0,0,0,0|2,0,0]=4 9440 B14R1.34 COCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000749529 [1,1,0,0,0,0|2,0,0]=4 9441 B14R1.34 COCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000749529 [1,1,0,0,0,0|2,0,0]=4 9442 B14R1.34 COCCC(=O)Nc1cccc(c1)Cl 34a_100138415774_100000242061 [1,1,0,0,0,0|2,0,0]=4 9443 B14R1.34 COCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000749529 [1,1,0,0,0,0|2,0,0]=4 9444 B14R1.34 COCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000749529 [1,1,0,0,0,0|2,0,0]=4 9445 B14R1.34 COCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000749529 [1,1,0,0,0,0|2,0,0]=4 9446 B14R1.34 COCCC(=O)Nc1cccc(c1)F 34a_100138415774_100000242062 [1,1,0,0,0,0|2,0,0]=4 9447 B14R1.34 COCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000749529 [1,1,0,0,0,0|2,0,0]=4 9448 B14R1.34 COCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000749529 [1,1,0,0,0,0|2,0,0]=4 9449 B14R1.34 COCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000749529 [1,1,0,0,0,0|2,0,0]=4 9450 B14R1.34 COCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000749529 [1,1,0,0,0,0|2,0,0]=4 9451 B14R1.34 COCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000749529 [1,1,0,0,0,0|2,0,0]=4 9452 B14R1.34 COCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000749529 [1,1,0,0,0,0|2,0,0]=4 9453 B14R1.34 COCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000749529 [1,1,0,0,0,0|2,0,0]=4 9454 B14R1.34 COCCC(=O)Nc1cccc(c1)O 34a_100138415774_200011436826 [1,1,0,0,0,0|2,0,0]=4 9455 B14R1.34 COCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000749529 [1,1,0,0,0,0|2,0,0]=4 9456 B14R1.34 CSCCC(=O)Cc1cc(ccn1)Br 1458a_100000174002_100010173614 [1,1,0,0,0,0|2,0,0]=4 9457 B14R1.34 CSCCC(=O)Cc1cc(ccn1)C 1458a_100000174002_100000718516 [1,1,0,0,0,0|2,0,0]=4 9458 B14R1.34 CSCCC(=O)Cc1cc(ccn1)Cl 1458a_100000174002_100016988179 [1,1,0,0,0,0|2,0,0]=4 9459 B14R1.34 CSCCC(=O)Cc1cccc(c1)Br 1458a_100000174002_100000211773 [1,1,0,0,0,0|1,0,0]=3 9460 B14R1.34 CSCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000751147 [1,1,0,0,0,0|1,0,0]=3 9461 B14R1.34 CSCCC(=O)Cc1cccc(c1)C 1458a_100000174002_100000211840 [1,1,0,0,0,0|1,0,0]=3 9462 B14R1.34 CSCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000751147 [1,1,0,0,0,0|1,0,0]=3 9463 B14R1.34 CSCCC(=O)Cc1cccc(c1)Cl 1458a_100000174002_100000181238 [1,1,0,0,0,0|1,0,0]=3 9464 B14R1.34 CSCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000751147 [1,1,0,0,0,0|1,0,0]=3 9465 B14R1.34 CSCCC(=O)Cc1cccc(c1)F 1458a_100000174002_100000230114 [1,1,0,0,0,0|1,0,0]=3 9466 B14R1.34 CSCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000751147 [1,1,0,0,0,0|1,0,0]=3 9467 B14R1.34 CSCCC(=O)Cc1cccc(c1)I 1458a_100000174002_100011218688 [1,1,0,0,0,0|1,0,0]=3 9468 B14R1.34 CSCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000751147 [1,1,0,0,0,0|1,0,0]=3 9469 B14R1.34 CSCCC(=O)Cc1cccc(c1)O 1458a_100000174002_100011660834 [1,1,0,0,0,0|1,0,0]=3 9470 B14R1.34 CSCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000751147 [1,1,0,0,0,0|1,0,0]=3 9471 B14R1.34 CSCCC(=O)Cc1cccc(n1)Br 1458a_100000174002_100009889011 [1,1,0,0,0,0|2,0,0]=4 9472 B14R1.34 CSCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000751147 [1,1,0,0,0,0|2,0,0]=4 9473 B14R1.34 CSCCC(=O)Cc1cccc(n1)C 1458a_100000174002_100000757606 [1,1,0,0,0,0|2,0,0]=4 9474 B14R1.34 CSCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000751147 [1,1,0,0,0,0|2,0,0]=4 9475 B14R1.34 CSCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000751147 [1,1,0,0,0,0|2,0,0]=4 9476 B14R1.34 CSCCC(=O)Cc1cccc(n1)Cl 1458a_100000174002_100000086093 [1,1,0,0,0,0|2,0,0]=4 9477 B14R1.34 CSCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000751147 [1,1,0,0,0,0|2,0,0]=4 9478 B14R1.34 CSCCC(=O)Cc1cccc(n1)F 1458a_100000174002_100009819644 [1,1,0,0,0,0|2,0,0]=4 9479 B14R1.34 CSCCC(=O)Cc1ccnc(c1)Br 1458a_100000174002_100010243470 [1,1,0,0,0,0|2,0,0]=4 9480 B14R1.34 CSCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000751147 [1,1,0,0,0,0|2,0,0]=4 9481 B14R1.34 CSCCC(=O)Cc1ccnc(c1)C 1458a_100000174002_200020672517 [1,1,0,0,0,0|2,0,0]=4 9482 B14R1.34 CSCCC(=O)Cc1ccnc(c1)Cl 1458a_100000174002_100000764220 [1,1,0,0,0,0|2,0,0]=4 9483 B14R1.34 CSCCC(=O)Cc1cncc(c1)Br 1458a_100000174002_100011740620 [1,1,0,0,0,0|2,0,0]=4 9484 B14R1.34 CSCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000751147 [1,1,0,0,0,0|2,0,0]=4 9485 B14R1.34 CSCCC(=O)Cc1cncc(c1)C 1458a_100000174002_100000716715 [1,1,0,0,0,0|2,0,0]=4 9486 B14R1.34 CSCCC(=O)Cc1cncc(c1)Cl 1458a_100000174002_100016992070 [1,1,0,0,0,0|2,0,0]=4 9487 B14R1.34 CSCCC(=O)Cc1cncc(c1)F 1458a_100000174002_100000725299 [1,1,0,0,0,0|2,0,0]=4 9488 B14R1.34 CSCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000751147 [1,1,0,0,0,0|2,0,0]=4 9489 B14R1.34 CSCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000174002 [1,1,0,0,0,0|2,0,0]=4 9490 B14R1.34 CSCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000174002 [1,1,0,0,0,0|2,0,0]=4 9491 B14R1.34 CSCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000174002 [1,1,0,0,0,0|2,0,0]=4 9492 B14R1.34 CSCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000174002 [1,1,0,0,0,0|2,0,0]=4 9493 B14R1.34 CSCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000174002 [1,1,0,0,0,0|2,0,0]=4 9494 B14R1.34 CSCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000174002 [1,1,0,0,0,0|2,0,0]=4 9495 B14R1.34 CSCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000174002 [1,1,0,0,0,0|2,0,0]=4 9496 B14R1.34 CSCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000174002 [1,1,0,0,0,0|2,0,0]=4 9497 B14R1.34 CSCCC(=O)Nc1cccc(c1)C 62a_200000210301_100011194834 [1,1,0,0,0,0|2,0,0]=4 9498 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000174002 [1,1,0,0,0,0|2,0,0]=4 9499 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000174002 [1,1,0,0,0,0|2,0,0]=4 9500 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000174002 [1,1,0,0,0,0|2,0,0]=4 9501 B14R1.34 CSCCC(=O)Nc1cccc(c1)Cl 62a_200000210301_100000242061 [1,1,0,0,0,0|2,0,0]=4 9502 B14R1.34 CSCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000174002 [1,1,0,0,0,0|2,0,0]=4 9503 B14R1.34 CSCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000174002 [1,1,0,0,0,0|2,0,0]=4 9504 B14R1.34 CSCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000174002 [1,1,0,0,0,0|2,0,0]=4 9505 B14R1.34 CSCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000174002 [1,1,0,0,0,0|2,0,0]=4 9506 B14R1.34 CSCCC(=O)Nc1cccc(c1)F 62a_200000210301_100000242062 [1,1,0,0,0,0|2,0,0]=4 9507 B14R1.34 CSCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000174002 [1,1,0,0,0,0|2,0,0]=4 9508 B14R1.34 CSCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000174002 [1,1,0,0,0,0|2,0,0]=4 9509 B14R1.34 CSCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000174002 [1,1,0,0,0,0|2,0,0]=4 9510 B14R1.34 CSCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000174002 [1,1,0,0,0,0|2,0,0]=4 9511 B14R1.34 CSCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000174002 [1,1,0,0,0,0|2,0,0]=4 9512 B14R1.34 CSCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000174002 [1,1,0,0,0,0|2,0,0]=4 9513 B14R1.34 CSCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000174002 [1,1,0,0,0,0|2,0,0]=4 9514 B14R1.34 CSCCC(=O)Nc1cccc(c1)O 62a_200000210301_200011436826 [1,1,0,0,0,0|2,0,0]=4 9515 B14R1.34 Cc1cccc(c1)CC(=O)CCC#N 1458a_100011206899_100011215226 [1,1,0,0,0,0|1,0,1]=4 9516 B14R1.34 Cc1cccc(c1)CC(=O)CCC#N 1458a_100011934036_100000211840 [1,1,0,0,0,0|1,0,1]=4 9517 B14R1.34 Cc1cccc(c1)CC(=O)CCCF 1458a_100011206899_100011934791 [1,1,0,0,0,0|1,0,0]=3 9518 B14R1.34 Cc1cccc(c1)CC(=O)CCCO 1458a_100011206899_100011215043 [1,1,0,0,0,0|1,0,0]=3 9519 B14R1.34 Cc1cccc(c1)CC(=O)NCCF 11a_100000724931_100011206899 [1,1,0,0,0,0|2,0,0]=4 9520 B14R1.34 Cc1cccc(c1)CC(=O)NCCF 1626a_100000724931_100011206899 [1,1,0,0,0,0|2,0,0]=4 9521 B14R1.34 Cc1cccc(c1)CC(=O)NCCF 240690a_100000724931_100011206899 [1,1,0,0,0,0|2,0,0]=4 9522 B14R1.34 Cc1cccc(c1)CC(=O)NCCF 527a_100000724931_100011206899 [1,1,0,0,0,0|2,0,0]=4 9523 B14R1.34 Cc1cccc(c1)CC(=O)NCCO 240690a_100000210304_100011206899 [1,1,0,0,0,0|2,0,0]=4 9524 B14R1.34 Cc1cccc(c1)CC(=O)NCCO 527a_100000210304_100011206899 [1,1,0,0,0,0|2,0,0]=4 9525 B14R1.34 Cc1cccc(c1)NC(=O)CCN[13CH3] 2230a_200015186421_200025704644 [1,1,0,0,0,0|2,0,0]=4 9526 B14R1.34 Cc1cccc(c1)NC(=O)CCN[13CH3] 34a_200015186421_200025704644 [1,1,0,0,0,0|2,0,0]=4 9527 B14R1.34 Cc1cccc(c1)NC(=O)CCS[13CH3] 62a_200025704644_100011194834 [1,1,0,0,0,0|2,0,0]=4 9528 B14R1.34 Cc1cccc(n1)CC(=O)CCCF 1458a_100012001110_100011934791 [1,1,0,0,0,0|2,0,0]=4 9529 B14R1.34 Cc1cccc(n1)CC(=O)CCCO 1458a_100012001110_100011215043 [1,1,0,0,0,0|2,0,0]=4 9530 B14R1.34 N#CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215226 [1,1,0,0,0,0|1,0,1]=4 9531 B14R1.34 N#CCCC(=O)Cc1cccc(c1)Br 1458a_100011934036_100000211773 [1,1,0,0,0,0|1,0,1]=4 9532 B14R1.34 N#CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215226 [1,1,0,0,0,0|1,0,1]=4 9533 B14R1.34 N#CCCC(=O)Cc1cccc(c1)Cl 1458a_100011934036_100000181238 [1,1,0,0,0,0|1,0,1]=4 9534 B14R1.34 N#CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215226 [1,1,0,0,0,0|1,0,1]=4 9535 B14R1.34 N#CCCC(=O)Cc1cccc(c1)F 1458a_100011934036_100000230114 [1,1,0,0,0,0|1,0,1]=4 9536 B14R1.34 N#CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215226 [1,1,0,0,0,0|1,0,1]=4 9537 B14R1.34 N#CCCC(=O)Cc1cccc(c1)I 1458a_100011934036_100011218688 [1,1,0,0,0,0|1,0,1]=4 9538 B14R1.34 N#CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215226 [1,1,0,0,0,0|1,0,1]=4 9539 B14R1.34 N#CCCC(=O)Cc1cccc(c1)O 1458a_100011934036_100011660834 [1,1,0,0,0,0|1,0,1]=4 9540 B14R1.34 O=C(CCCF)Cc1cccc(c1)Br 1458a_100000747190_100011934791 [1,1,0,0,0,0|1,0,0]=3 9541 B14R1.34 O=C(CCCF)Cc1cccc(c1)Cl 1458a_100000749307_100011934791 [1,1,0,0,0,0|1,0,0]=3 9542 B14R1.34 O=C(CCCF)Cc1cccc(c1)F 1458a_100000211661_100011934791 [1,1,0,0,0,0|1,0,0]=3 9543 B14R1.34 O=C(CCCF)Cc1cccc(c1)I 1458a_100000238430_100011934791 [1,1,0,0,0,0|1,0,0]=3 9544 B14R1.34 O=C(CCCF)Cc1cccc(c1)O 1458a_100000745134_100011934791 [1,1,0,0,0,0|1,0,0]=3 9545 B14R1.34 O=C(CCCF)Cc1cccc(n1)Br 1458a_100010201708_100011934791 [1,1,0,0,0,0|2,0,0]=4 9546 B14R1.34 O=C(CCCF)Cc1cccc(n1)Cl 1458a_100000090259_100011934791 [1,1,0,0,0,0|2,0,0]=4 9547 B14R1.34 O=C(CCCF)Cc1cccc(n1)F 1458a_100000096803_100011934791 [1,1,0,0,0,0|2,0,0]=4 9548 B14R1.34 O=C(CCCF)Cc1ccnc(c1)Br 1458a_100010126891_100011934791 [1,1,0,0,0,0|2,0,0]=4 9549 B14R1.34 O=C(CCCF)Cc1cncc(c1)Br 1458a_100000239331_100011934791 [1,1,0,0,0,0|2,0,0]=4 9550 B14R1.34 O=C(CCCF)Cc1cncc(c1)F 1458a_100011667516_100011934791 [1,1,0,0,0,0|2,0,0]=4 9551 B14R1.34 O=C(CCCO)Cc1cccc(c1)Br 1458a_100000747190_100011215043 [1,1,0,0,0,0|1,0,0]=3 9552 B14R1.34 O=C(CCCO)Cc1cccc(c1)Cl 1458a_100000749307_100011215043 [1,1,0,0,0,0|1,0,0]=3 9553 B14R1.34 O=C(CCCO)Cc1cccc(c1)F 1458a_100000211661_100011215043 [1,1,0,0,0,0|1,0,0]=3 9554 B14R1.34 O=C(CCCO)Cc1cccc(c1)I 1458a_100000238430_100011215043 [1,1,0,0,0,0|1,0,0]=3 9555 B14R1.34 O=C(CCCO)Cc1cccc(c1)O 1458a_100000745134_100011215043 [1,1,0,0,0,0|1,0,0]=3 9556 B14R1.34 O=C(CCCO)Cc1cccc(n1)Br 1458a_100010201708_100011215043 [1,1,0,0,0,0|2,0,0]=4 9557 B14R1.34 O=C(CCCO)Cc1cccc(n1)Cl 1458a_100000090259_100011215043 [1,1,0,0,0,0|2,0,0]=4 9558 B14R1.34 O=C(CCCO)Cc1cccc(n1)F 1458a_100000096803_100011215043 [1,1,0,0,0,0|2,0,0]=4 9559 B14R1.34 O=C(CCCO)Cc1ccnc(c1)Br 1458a_100010126891_100011215043 [1,1,0,0,0,0|2,0,0]=4 9560 B14R1.34 O=C(CCCO)Cc1cncc(c1)Br 1458a_100000239331_100011215043 [1,1,0,0,0,0|2,0,0]=4 9561 B14R1.34 O=C(CCCO)Cc1cncc(c1)F 1458a_100011667516_100011215043 [1,1,0,0,0,0|2,0,0]=4 9562 B14R1.34 O=C(Cc1cccc(c1)Br)NCCF 11a_100000724931_100000747190 [1,1,0,0,0,0|2,0,0]=4 9563 B14R1.34 O=C(Cc1cccc(c1)Br)NCCF 240690a_100000724931_100000747190 [1,1,0,0,0,0|2,0,0]=4 9564 B14R1.34 O=C(Cc1cccc(c1)Br)NCCF 527a_100000724931_100000747190 [1,1,0,0,0,0|2,0,0]=4 9565 B14R1.34 O=C(Cc1cccc(c1)Br)NCCO 240690a_100000210304_100000747190 [1,1,0,0,0,0|2,0,0]=4 9566 B14R1.34 O=C(Cc1cccc(c1)Br)NCCO 527a_100000210304_100000747190 [1,1,0,0,0,0|2,0,0]=4 9567 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF 11a_100000724931_100000749307 [1,1,0,0,0,0|2,0,0]=4 9568 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF 1626a_100000724931_100000749307 [1,1,0,0,0,0|2,0,0]=4 9569 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF 240690a_100000724931_100000749307 [1,1,0,0,0,0|2,0,0]=4 9570 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCF 527a_100000724931_100000749307 [1,1,0,0,0,0|2,0,0]=4 9571 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCO 240690a_100000210304_100000749307 [1,1,0,0,0,0|2,0,0]=4 9572 B14R1.34 O=C(Cc1cccc(c1)Cl)NCCO 527a_100000210304_100000749307 [1,1,0,0,0,0|2,0,0]=4 9573 B14R1.34 O=C(Cc1cccc(c1)F)NCCF 11a_100000724931_100000211661 [1,1,0,0,0,0|2,0,0]=4 9574 B14R1.34 O=C(Cc1cccc(c1)F)NCCF 1626a_100000724931_100000211661 [1,1,0,0,0,0|2,0,0]=4 9575 B14R1.34 O=C(Cc1cccc(c1)F)NCCF 240690a_100000724931_100000211661 [1,1,0,0,0,0|2,0,0]=4 9576 B14R1.34 O=C(Cc1cccc(c1)F)NCCF 527a_100000724931_100000211661 [1,1,0,0,0,0|2,0,0]=4 9577 B14R1.34 O=C(Cc1cccc(c1)F)NCCO 240690a_100000210304_100000211661 [1,1,0,0,0,0|2,0,0]=4 9578 B14R1.34 O=C(Cc1cccc(c1)F)NCCO 527a_100000210304_100000211661 [1,1,0,0,0,0|2,0,0]=4 9579 B14R1.34 O=C(Cc1cccc(c1)I)NCCF 11a_100000724931_100000238430 [1,1,0,0,0,0|2,0,0]=4 9580 B14R1.34 O=C(Cc1cccc(c1)I)NCCF 1626a_100000724931_100000238430 [1,1,0,0,0,0|2,0,0]=4 9581 B14R1.34 O=C(Cc1cccc(c1)I)NCCF 240690a_100000724931_100000238430 [1,1,0,0,0,0|2,0,0]=4 9582 B14R1.34 O=C(Cc1cccc(c1)I)NCCF 527a_100000724931_100000238430 [1,1,0,0,0,0|2,0,0]=4 9583 B14R1.34 O=C(Cc1cccc(c1)I)NCCO 240690a_100000210304_100000238430 [1,1,0,0,0,0|2,0,0]=4 9584 B14R1.34 O=C(Cc1cccc(c1)I)NCCO 527a_100000210304_100000238430 [1,1,0,0,0,0|2,0,0]=4 9585 B14R1.34 O=C(Cc1cccc(c1)O)NCCF 240690a_100000724931_100000745134 [1,1,0,0,0,0|2,0,0]=4 9586 B14R1.34 O=C(Cc1cccc(c1)O)NCCF 527a_100000724931_100000745134 [1,1,0,0,0,0|2,0,0]=4 9587 B14R1.34 O=C(Cc1cccc(c1)O)NCCO 240690a_100000210304_100000745134 [1,1,0,0,0,0|2,0,0]=4 9588 B14R1.34 O=C(Cc1cccc(c1)O)NCCO 527a_100000210304_100000745134 [1,1,0,0,0,0|2,0,0]=4 9589 B14R1.34 [13CH3]NCCC(=O)Nc1cccc(c1)F 2230a_100015185233_200025704644 [1,1,0,0,0,0|2,0,0]=4 9590 B14R1.34 [13CH3]NCCC(=O)Nc1cccc(c1)F 34a_100015185233_200025704644 [1,1,0,0,0,0|2,0,0]=4 9591 B14R1.34 [13CH3]SCCC(=O)Nc1cccc(c1)Cl 62a_200025704644_100000242061 [1,1,0,0,0,0|2,0,0]=4 9592 B14R1.34 [13CH3]SCCC(=O)Nc1cccc(c1)F 62a_200025704644_100000242062 [1,1,0,0,0,0|2,0,0]=4 9593 B14R1.34 [13CH3]SCCC(=O)Nc1cccc(c1)O 62a_200025704644_200011436826 [1,1,0,0,0,0|2,0,0]=4 9594 B14R1.60 C=CCC(C)C(=O)Cc1ccccc1 1458a_100011216819_100015291786 [1,1,0,0,0,0|0,0,2]=4 9595 B14R1.60 CC(CCO)C(=O)C[n+]1ccccc1 1458a_200000086051_100009893172 [1,1,0,0,0,0|2,0,0]=4 9596 B14R1.60 CC(CCO)C(=O)Cc1ccccn1 1458a_100000233486_100009893172 [1,1,0,0,0,0|2,0,0]=4 9597 B14R1.60 CC(CCO)C(=O)Cc1cccnc1 1458a_100000737805_100009893172 [1,1,0,0,0,0|2,0,0]=4 9598 B14R1.60 CC/C=C(\C)/C(=O)Cc1ccccc1 1458a_100016988807_100015291786 [1,1,0,0,0,0|0,0,2]=4 9599 B14R1.60 CCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210303 [1,1,0,0,0,0|1,0,1]=4 9600 B14R1.60 CCCC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_100000766640 [1,1,0,0,0,0|1,0,0]=3 9601 B14R1.60 CCCC(C)C(=O)Cc1ccccc1 1458a_100000210906_100015291786 [1,1,0,0,0,0|0,0,0]=2 9602 B14R1.60 CCCC(C)C(=O)Cc1ccccn1 1458a_100000210906_100000721315 [1,1,0,0,0,0|1,0,0]=3 9603 B14R1.60 CCCC(C)C(=O)Cc1ccccn1 1458a_100000233486_100000766640 [1,1,0,0,0,0|1,0,0]=3 9604 B14R1.60 CCCC(C)C(=O)Cc1cccnc1 1458a_100000210906_100000733263 [1,1,0,0,0,0|1,0,0]=3 9605 B14R1.60 CCCC(C)C(=O)Cc1cccnc1 1458a_100000737805_100000766640 [1,1,0,0,0,0|1,0,0]=3 9606 B14R1.60 CCCC(C)C(=O)Cc1cccnn1 1458a_100000210906_100016990269 [1,1,0,0,0,0|2,0,0]=4 9607 B14R1.60 CCCC(C)C(=O)Cc1ccncc1 1458a_100000210906_100000705612 [1,1,0,0,0,0|1,0,0]=3 9608 B14R1.60 CCCC(C)C(=O)Cc1cnccn1 1458a_100000210906_100016995436 [1,1,0,0,0,0|2,0,0]=4 9609 B14R1.60 CCCC(C)C(=O)Cc1cncnc1 1458a_100000210906_100015196519 [1,1,0,0,0,0|2,0,0]=4 9610 B14R1.60 CCCC(C)C(=O)Cc1cncnc1 1458a_100000721575_100000766640 [1,1,0,0,0,0|2,0,0]=4 9611 B14R1.60 CCCC(C)C(=O)Cc1ncccn1 1458a_100000210906_100000703007 [1,1,0,0,0,0|2,0,0]=4 9612 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 11a_100000106764_100000210906 [1,1,0,0,0,0|1,0,0]=3 9613 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000210906 [1,1,0,0,0,0|1,0,0]=3 9614 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 22a_100000106764_100000210906 [1,1,0,0,0,0|1,0,0]=3 9615 B14R1.60 CCCC(C)C(=O)Nc1ccccc1 527a_100000106764_100000210906 [1,1,0,0,0,0|1,0,0]=3 9616 B14R1.60 CCCC(C)N(C)Cc1ccccc1 2230a_100000186898_100000766640 [1,1,0,0,0,0|2,0,0]=4 9617 B14R1.60 CCCC(C)N(C)Cc1ccccc1 2230a_200015183821_200000210301 [1,1,0,0,0,0|2,0,0]=4 9618 B14R1.60 CCCC(C)N(C)Cc1ccccc1 269982a_100000186898_100000766640 [1,1,0,0,0,0|2,0,0]=4 9619 B14R1.60 CCCC(C)N(C)Cc1ccccc1 269982a_200015183821_200000210301 [1,1,0,0,0,0|2,0,0]=4 9620 B14R1.60 CCCC(C)N(C)Cc1ccccc1 270004a_100000186898_100000211909 [1,1,0,0,0,0|2,0,0]=4 9621 B14R1.60 CCCC(C)N([13CH3])Cc1ccccc1 2230a_200015183821_200025704644 [1,1,0,0,0,0|2,0,0]=4 9622 B14R1.60 CCCC(C)N([13CH3])Cc1ccccc1 269982a_200015183821_200025704644 [1,1,0,0,0,0|2,0,0]=4 9623 B14R1.60 CCCN(C)C(=O)C[n+]1ccccc1 11a_100000747261_200000086051 [1,1,0,0,0,0|2,0,0]=4 9624 B14R1.60 CCCN(C)C(=O)C[n+]1ccccc1 240690a_100000747261_200000086051 [1,1,0,0,0,0|2,0,0]=4 9625 B14R1.60 CCCN(C)C(=O)C[n+]1ccccc1 527a_100000747261_200000086051 [1,1,0,0,0,0|2,0,0]=4 9626 B14R1.60 CCCN(C)C(=O)Cc1ccccn1 11a_100000747261_100000233486 [1,1,0,0,0,0|2,0,0]=4 9627 B14R1.60 CCCN(C)C(=O)Cc1cccnc1 11a_100000747261_100000737805 [1,1,0,0,0,0|2,0,0]=4 9628 B14R1.60 CCCN(C)C(=O)Cc1cccnc1 240690a_100000747261_100000737805 [1,1,0,0,0,0|2,0,0]=4 9629 B14R1.60 CCCN(C)C(=O)Cc1cccnc1 527a_100000747261_100000737805 [1,1,0,0,0,0|2,0,0]=4 9630 B14R1.60 CCCN(C)C(=O)Cc1ccncc1 11a_100000747261_100011201483 [1,1,0,0,0,0|2,0,0]=4 9631 B14R1.60 CCCN(C)C(=O)Cc1ccncc1 240690a_100000747261_100011201483 [1,1,0,0,0,0|2,0,0]=4 9632 B14R1.60 CCCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000747261 [1,1,0,0,0,0|2,0,0]=4 9633 B14R1.60 CCC[C@H](O)C(=O)Cc1ccccc1 1458a_100009822183_100015291786 [1,1,0,0,0,0|0,0,0]=2 9634 B14R1.60 CCC[C@H](O)C(=O)Cc1ccccn1 1458a_100009822183_100000721315 [1,1,0,0,0,0|1,0,0]=3 9635 B14R1.60 CCC[C@H](O)C(=O)Cc1cccnc1 1458a_100009822183_100000733263 [1,1,0,0,0,0|1,0,0]=3 9636 B14R1.60 CCC[C@H](O)C(=O)Cc1cccnn1 1458a_100009822183_100016990269 [1,1,0,0,0,0|2,0,0]=4 9637 B14R1.60 CCC[C@H](O)C(=O)Cc1ccncc1 1458a_100009822183_100000705612 [1,1,0,0,0,0|1,0,0]=3 9638 B14R1.60 CCC[C@H](O)C(=O)Cc1cnccn1 1458a_100009822183_100016995436 [1,1,0,0,0,0|2,0,0]=4 9639 B14R1.60 CCC[C@H](O)C(=O)Cc1cncnc1 1458a_100009822183_100015196519 [1,1,0,0,0,0|2,0,0]=4 9640 B14R1.60 CCC[C@H](O)C(=O)Cc1ncccn1 1458a_100009822183_100000703007 [1,1,0,0,0,0|2,0,0]=4 9641 B14R1.60 CCC[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_100009822183 [1,1,0,0,0,0|1,0,0]=3 9642 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 1458a_200011297158_100015291786 [1,1,0,0,0,0|1,0,1]=4 9643 B14R1.60 CCNC(C)C(=O)Nc1ccccc1 2230a_100000754830_100000210202 [1,1,0,0,0,0|2,0,0]=4 9644 B14R1.60 CCNC(C)C(=O)Nc1ccccc1 2230a_100015525214_100000183986 [1,1,0,0,0,0|2,0,0]=4 9645 B14R1.60 CCNC(C)C(=O)Nc1ccccc1 34a_100000754830_100000210202 [1,1,0,0,0,0|2,0,0]=4 9646 B14R1.60 CCOC(C)C(=O)Cc1ccccc1 1458a_100000739345_100015291786 [1,1,0,0,0,0|1,0,0]=3 9647 B14R1.60 CCOC(C)C(=O)Cc1ccccn1 1458a_100000739345_100000721315 [1,1,0,0,0,0|2,0,0]=4 9648 B14R1.60 CCOC(C)C(=O)Cc1cccnc1 1458a_100000739345_100000733263 [1,1,0,0,0,0|2,0,0]=4 9649 B14R1.60 CCOC(C)C(=O)Cc1ccncc1 1458a_100000739345_100000705612 [1,1,0,0,0,0|2,0,0]=4 9650 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 11a_100000106764_100000739345 [1,1,0,0,0,0|2,0,0]=4 9651 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000739345 [1,1,0,0,0,0|2,0,0]=4 9652 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 22a_100000106764_100000739345 [1,1,0,0,0,0|2,0,0]=4 9653 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 34a_100121572206_100000183986 [1,1,0,0,0,0|2,0,0]=4 9654 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 527a_100000106764_100000739345 [1,1,0,0,0,0|2,0,0]=4 9655 B14R1.60 CCSC(C)C(=O)Cc1ccccc1 1458a_100000230601_100015291786 [1,1,0,0,0,0|1,0,0]=3 9656 B14R1.60 CCSC(C)C(=O)Cc1ccccn1 1458a_100000230601_100000721315 [1,1,0,0,0,0|2,0,0]=4 9657 B14R1.60 CCSC(C)C(=O)Cc1cccnc1 1458a_100000230601_100000733263 [1,1,0,0,0,0|2,0,0]=4 9658 B14R1.60 CCSC(C)C(=O)Cc1ccncc1 1458a_100000230601_100000705612 [1,1,0,0,0,0|2,0,0]=4 9659 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 11a_100000106764_100000230601 [1,1,0,0,0,0|2,0,0]=4 9660 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000230601 [1,1,0,0,0,0|2,0,0]=4 9661 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 22a_100000106764_100000230601 [1,1,0,0,0,0|2,0,0]=4 9662 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 527a_100000106764_100000230601 [1,1,0,0,0,0|2,0,0]=4 9663 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 62a_100000183986_100000210202 [1,1,0,0,0,0|2,0,0]=4 9664 B14R1.60 CCSC(C)C(=O)Nc1ccccc1 62a_100000210202_100000183986 [1,1,0,0,0,0|2,0,0]=4 9665 B14R1.60 COCC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_100000765312 [1,1,0,0,0,0|2,0,0]=4 9666 B14R1.60 COCC(C)C(=O)Cc1ccccc1 1458a_100000751857_100015291786 [1,1,0,0,0,0|1,0,0]=3 9667 B14R1.60 COCC(C)C(=O)Cc1ccccn1 1458a_100000233486_100000765312 [1,1,0,0,0,0|2,0,0]=4 9668 B14R1.60 COCC(C)C(=O)Cc1ccccn1 1458a_100000751857_100000721315 [1,1,0,0,0,0|2,0,0]=4 9669 B14R1.60 COCC(C)C(=O)Cc1cccnc1 1458a_100000737805_100000765312 [1,1,0,0,0,0|2,0,0]=4 9670 B14R1.60 COCC(C)C(=O)Cc1cccnc1 1458a_100000751857_100000733263 [1,1,0,0,0,0|2,0,0]=4 9671 B14R1.60 COCC(C)C(=O)Cc1ccncc1 1458a_100000751857_100000705612 [1,1,0,0,0,0|2,0,0]=4 9672 B14R1.60 COCC(C)C(=O)Nc1ccccc1 11a_100000106764_100000751857 [1,1,0,0,0,0|2,0,0]=4 9673 B14R1.60 COCC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000751857 [1,1,0,0,0,0|2,0,0]=4 9674 B14R1.60 COCC(C)C(=O)Nc1ccccc1 22a_100000106764_100000751857 [1,1,0,0,0,0|2,0,0]=4 9675 B14R1.60 COCC(C)C(=O)Nc1ccccc1 527a_100000106764_100000751857 [1,1,0,0,0,0|2,0,0]=4 9676 B14R1.60 CSCC(C)C(=O)Cc1ccccc1 1458a_100000753918_100015291786 [1,1,0,0,0,0|1,0,0]=3 9677 B14R1.60 CSCC(C)C(=O)Cc1ccccn1 1458a_100000753918_100000721315 [1,1,0,0,0,0|2,0,0]=4 9678 B14R1.60 CSCC(C)C(=O)Cc1cccnc1 1458a_100000753918_100000733263 [1,1,0,0,0,0|2,0,0]=4 9679 B14R1.60 CSCC(C)C(=O)Cc1ccncc1 1458a_100000753918_100000705612 [1,1,0,0,0,0|2,0,0]=4 9680 B14R1.60 CSCC(C)C(=O)Nc1ccccc1 11a_100000106764_100000753918 [1,1,0,0,0,0|2,0,0]=4 9681 B14R1.60 CSCC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000753918 [1,1,0,0,0,0|2,0,0]=4 9682 B14R1.60 CSCC(C)C(=O)Nc1ccccc1 22a_100000106764_100000753918 [1,1,0,0,0,0|2,0,0]=4 9683 B14R1.60 CSCC(C)C(=O)Nc1ccccc1 527a_100000106764_100000753918 [1,1,0,0,0,0|2,0,0]=4 9684 B14R1.166 C#CCCC(=O)C(C)c1ccccc1 1458a_100000692101_100000230085 [1,1,0,0,0,0|0,0,2]=4 9685 B14R1.166 C#CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000753159 [1,1,0,0,0,0|0,0,2]=4 9686 B14R1.166 C#CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000753159 [1,1,0,0,0,0|0,0,2]=4 9687 B14R1.166 C#CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000753159 [1,1,0,0,0,0|0,0,2]=4 9688 B14R1.166 C/C=C/CC(=O)C(F)c1ccccc1 1458a_100000698975_100102629194 [1,1,0,0,0,0|0,0,2]=4 9689 B14R1.166 C/C=C/CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100102629194 [1,1,0,0,0,0|0,0,2]=4 9690 B14R1.166 C/C=C/CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100102629194 [1,1,0,0,0,0|0,0,2]=4 9691 B14R1.166 C=C(C(=O)CCCC)c1ccccc1 1458a_100000065200_100000210211 [1,1,0,0,0,0|0,0,1]=3 9692 B14R1.166 C=C(C(=O)CCCF)c1ccccc1 1458a_100000065200_100011934791 [1,1,0,0,0,0|1,0,1]=4 9693 B14R1.166 C=C(C(=O)CCCO)c1ccccc1 1458a_100000065200_100011215043 [1,1,0,0,0,0|1,0,1]=4 9694 B14R1.166 C=C(C(=O)CCOC)c1ccccc1 1458a_100000065200_100000233755 [1,1,0,0,0,0|1,0,1]=4 9695 B14R1.166 C=C(C(=O)CCSC)c1ccccc1 1458a_100000065200_100000751147 [1,1,0,0,0,0|1,0,1]=4 9696 B14R1.166 C=C(C(=O)NCCC)c1ccccc1 1626a_100020643023_100000065200 [1,1,0,0,0,0|1,0,1]=4 9697 B14R1.166 C=CCCC(=O)C(C)c1ccccc1 1458a_100000749702_100000230085 [1,1,0,0,0,0|0,0,2]=4 9698 B14R1.166 C=CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000754431 [1,1,0,0,0,0|0,0,2]=4 9699 B14R1.166 C=CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000754431 [1,1,0,0,0,0|0,0,2]=4 9700 B14R1.166 C=CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000754431 [1,1,0,0,0,0|0,0,2]=4 9701 B14R1.166 CC#CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000748600 [1,1,0,0,0,0|0,0,2]=4 9702 B14R1.166 CC#CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000748600 [1,1,0,0,0,0|0,0,2]=4 9703 B14R1.166 CC#CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000748600 [1,1,0,0,0,0|0,0,2]=4 9704 B14R1.166 CC(C(=O)CCC#N)c1ccccc1 1458a_100011934036_100000230085 [1,1,0,0,0,0|1,0,1]=4 9705 B14R1.166 CC(C(=O)CCCF)c1ccccn1 1458a_100000722050_100011934791 [1,1,0,0,0,0|2,0,0]=4 9706 B14R1.166 CC(C(=O)CCCO)c1ccccn1 1458a_100000722050_100011215043 [1,1,0,0,0,0|2,0,0]=4 9707 B14R1.166 CC=CCC(=O)C(C)c1ccccc1 1458a_100121576822_100000230085 [1,1,0,0,0,0|0,0,2]=4 9708 B14R1.166 CC=CCC(=O)C(F)c1ccccc1 1458a_100000698975_100000070051 [1,1,0,0,0,0|0,0,2]=4 9709 B14R1.166 CC=CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000070051 [1,1,0,0,0,0|0,0,2]=4 9710 B14R1.166 CC=CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000070051 [1,1,0,0,0,0|0,0,2]=4 9711 B14R1.166 CCC#CC(=O)C(C)c1ccccc1 1458a_100011827653_100000230085 [1,1,0,0,0,0|0,0,2]=4 9712 B14R1.166 CCC=CC(=O)C(C)c1ccccc1 1458a_100000212282_100000230085 [1,1,0,0,0,0|0,0,2]=4 9713 B14R1.166 CCCCC(=O)C(C)c1ccccc1 1458a_100000210183_100000230085 [1,1,0,0,0,0|0,0,0]=2 9714 B14R1.166 CCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210211 [1,1,0,0,0,0|1,0,0]=3 9715 B14R1.166 CCCCC(=O)C(C)c1cnccn1 1458a_100000210183_200000703233 [1,1,0,0,0,0|2,0,0]=4 9716 B14R1.166 CCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210211 [1,1,0,0,0,0|0,0,0]=2 9717 B14R1.166 CCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000210183 [1,1,0,0,0,0|1,0,0]=3 9718 B14R1.166 CCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210183 [1,1,0,0,0,0|1,0,0]=3 9719 B14R1.166 CCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000210183 [1,1,0,0,0,0|1,0,0]=3 9720 B14R1.166 CCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210211 [1,1,0,0,0,0|0,0,0]=2 9721 B14R1.166 CCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210211 [1,1,0,0,0,0|0,0,0]=2 9722 B14R1.166 CCCCN(C)C(C)c1ccccc1 2230a_100000195388_100000210211 [1,1,0,0,0,0|2,0,0]=4 9723 B14R1.166 CCCCN(C)C(C)c1ccccc1 2230a_100000207549_100000230085 [1,1,0,0,0,0|2,0,0]=4 9724 B14R1.166 CCCCN(C)C(C)c1ccccc1 269982a_100000195388_100000210211 [1,1,0,0,0,0|2,0,0]=4 9725 B14R1.166 CCCCN(C)C(C)c1ccccc1 269982a_100000207549_100000230085 [1,1,0,0,0,0|2,0,0]=4 9726 B14R1.166 CCCNC(=O)C(C)c1ccccn1 11a_100020643023_100000722050 [1,1,0,0,0,0|2,0,0]=4 9727 B14R1.166 CCCNC(=O)C(C)c1ccccn1 1626a_100020643023_100000722050 [1,1,0,0,0,0|2,0,0]=4 9728 B14R1.166 CCCNC(=O)C(C)c1ccccn1 240690a_100020643023_100000722050 [1,1,0,0,0,0|2,0,0]=4 9729 B14R1.166 CCCNC(=O)C(C)c1ccccn1 527a_100020643023_100000722050 [1,1,0,0,0,0|2,0,0]=4 9730 B14R1.166 CCCNC(=O)C(F)c1ccccc1 11a_100020643023_100000698975 [1,1,0,0,0,0|1,0,0]=3 9731 B14R1.166 CCCNC(=O)C(F)c1ccccc1 1626a_100020643023_100000698975 [1,1,0,0,0,0|1,0,0]=3 9732 B14R1.166 CCCNC(=O)C(F)c1ccccc1 240690a_100020643023_100000698975 [1,1,0,0,0,0|1,0,0]=3 9733 B14R1.166 CCCNC(=O)C(F)c1ccccc1 527a_100020643023_100000698975 [1,1,0,0,0,0|1,0,0]=3 9734 B14R1.166 CCCNC(=O)N(C)c1ccccc1 512a_100020643023_100000210012 [1,1,0,0,0,0|2,0,0]=4 9735 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 11a_100020643023_100000751047 [1,1,0,0,0,0|1,0,0]=3 9736 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 1626a_100020643023_100000751047 [1,1,0,0,0,0|1,0,0]=3 9737 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 240690a_100020643023_100000751047 [1,1,0,0,0,0|1,0,0]=3 9738 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 527a_100020643023_100000751047 [1,1,0,0,0,0|1,0,0]=3 9739 B14R1.166 CCCNC(=O)[C@H](O)c1ccccc1 240690a_100020643023_100000684486 [1,1,0,0,0,0|1,0,0]=3 9740 B14R1.166 CCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000210303 [1,1,0,0,0,0|1,0,1]=4 9741 B14R1.166 CCNCC(=O)N(C)c1ccccc1 2230a_100015525214_100000183487 [1,1,0,0,0,0|2,0,0]=4 9742 B14R1.166 CCNCC(=O)N(C)c1ccccc1 2230a_200000174886_100000210202 [1,1,0,0,0,0|2,0,0]=4 9743 B14R1.166 CCNNC(=O)C(F)c1ccccc1 22a_100000756455_100000698975 [1,1,0,0,0,0|2,0,0]=4 9744 B14R1.166 CCNNC(=O)[C@@H](C)c1ccccc1 22a_100000756455_100000751047 [1,1,0,0,0,0|2,0,0]=4 9745 B14R1.166 CCNNC(=O)[C@H](O)c1ccccc1 22a_100000756455_100000684486 [1,1,0,0,0,0|2,0,0]=4 9746 B14R1.166 CCOCC(=O)C(C)c1ccccc1 1458a_100000211967_100000230085 [1,1,0,0,0,0|1,0,0]=3 9747 B14R1.166 CCOCC(=O)N(C)c1ccccc1 11a_100000210012_100000211967 [1,1,0,0,0,0|2,0,0]=4 9748 B14R1.166 CCOCC(=O)N(C)c1ccccc1 1626a_100000210012_100000211967 [1,1,0,0,0,0|2,0,0]=4 9749 B14R1.166 CCOCC(=O)N(C)c1ccccc1 22a_100000210012_100000211967 [1,1,0,0,0,0|2,0,0]=4 9750 B14R1.166 CCOCC(=O)N(C)c1ccccc1 34a_100121572206_100000183487 [1,1,0,0,0,0|2,0,0]=4 9751 B14R1.166 CCSCC(=O)C(C)c1ccccc1 1458a_100000230394_100000230085 [1,1,0,0,0,0|1,0,0]=3 9752 B14R1.166 CCSCC(=O)N(C)c1ccccc1 11a_100000210012_100000230394 [1,1,0,0,0,0|2,0,0]=4 9753 B14R1.166 CCSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000230394 [1,1,0,0,0,0|2,0,0]=4 9754 B14R1.166 CCSCC(=O)N(C)c1ccccc1 22a_100000210012_100000230394 [1,1,0,0,0,0|2,0,0]=4 9755 B14R1.166 CCSCC(=O)N(C)c1ccccc1 62a_100000183487_100000210202 [1,1,0,0,0,0|2,0,0]=4 9756 B14R1.166 CCSCC(=O)N(C)c1ccccc1 62a_100000210202_100000183487 [1,1,0,0,0,0|2,0,0]=4 9757 B14R1.166 CN(C(=O)CCS[13CH3])c1ccccc1 62a_100000691765_200025704644 [1,1,0,0,0,0|2,0,0]=4 9758 B14R1.166 CN(C(=O)CCS[13CH3])c1ccccc1 62a_200025704644_100000691765 [1,1,0,0,0,0|2,0,0]=4 9759 B14R1.166 CNCCC(=O)N(C)c1ccccc1 2230a_106832991635_100000691765 [1,1,0,0,0,0|2,0,0]=4 9760 B14R1.166 CNCCC(=O)N(C)c1ccccc1 34a_100102657272_100000691765 [1,1,0,0,0,0|2,0,0]=4 9761 B14R1.166 CNCCC(=O)N(C)c1ccccc1 7a_106832991635_100000691765 [1,1,0,0,0,0|2,0,0]=4 9762 B14R1.166 COCCC(=O)C(C)c1ccccc1 1458a_100000749529_100000230085 [1,1,0,0,0,0|1,0,0]=3 9763 B14R1.166 COCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000233755 [1,1,0,0,0,0|2,0,0]=4 9764 B14R1.166 COCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000233755 [1,1,0,0,0,0|1,0,0]=3 9765 B14R1.166 COCCC(=O)N(C)c1ccccc1 11a_100000210012_100000749529 [1,1,0,0,0,0|2,0,0]=4 9766 B14R1.166 COCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000749529 [1,1,0,0,0,0|2,0,0]=4 9767 B14R1.166 COCCC(=O)N(C)c1ccccc1 22a_100000210012_100000749529 [1,1,0,0,0,0|2,0,0]=4 9768 B14R1.166 COCCC(=O)N(C)c1ccccc1 34a_100138415774_100000691765 [1,1,0,0,0,0|2,0,0]=4 9769 B14R1.166 COCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000233755 [1,1,0,0,0,0|1,0,0]=3 9770 B14R1.166 COCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000233755 [1,1,0,0,0,0|1,0,0]=3 9771 B14R1.166 CSCCC(=O)C(C)c1ccccc1 1458a_100000174002_100000230085 [1,1,0,0,0,0|1,0,0]=3 9772 B14R1.166 CSCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000751147 [1,1,0,0,0,0|2,0,0]=4 9773 B14R1.166 CSCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000751147 [1,1,0,0,0,0|1,0,0]=3 9774 B14R1.166 CSCCC(=O)N(C)c1ccccc1 11a_100000210012_100000174002 [1,1,0,0,0,0|2,0,0]=4 9775 B14R1.166 CSCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000174002 [1,1,0,0,0,0|2,0,0]=4 9776 B14R1.166 CSCCC(=O)N(C)c1ccccc1 22a_100000210012_100000174002 [1,1,0,0,0,0|2,0,0]=4 9777 B14R1.166 CSCCC(=O)N(C)c1ccccc1 62a_100000691765_200000210301 [1,1,0,0,0,0|2,0,0]=4 9778 B14R1.166 CSCCC(=O)N(C)c1ccccc1 62a_200000210301_100000691765 [1,1,0,0,0,0|2,0,0]=4 9779 B14R1.166 CSCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000751147 [1,1,0,0,0,0|1,0,0]=3 9780 B14R1.166 CSCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000751147 [1,1,0,0,0,0|1,0,0]=3 9781 B14R1.166 C[C@H](C(=O)CCC#N)c1ccccc1 1458a_100000751047_100011215226 [1,1,0,0,0,0|1,0,1]=4 9782 B14R1.166 C[C@H](C(=O)CCCF)c1ccccc1 1458a_100000751047_100011934791 [1,1,0,0,0,0|1,0,0]=3 9783 B14R1.166 C[C@H](C(=O)CCCO)c1ccccc1 1458a_100000751047_100011215043 [1,1,0,0,0,0|1,0,0]=3 9784 B14R1.166 C[C@H](C(=O)NCCF)c1ccccc1 11a_100000724931_100000751047 [1,1,0,0,0,0|2,0,0]=4 9785 B14R1.166 C[C@H](C(=O)NCCF)c1ccccc1 1626a_100000724931_100000751047 [1,1,0,0,0,0|2,0,0]=4 9786 B14R1.166 C[C@H](C(=O)NCCF)c1ccccc1 240690a_100000724931_100000751047 [1,1,0,0,0,0|2,0,0]=4 9787 B14R1.166 C[C@H](C(=O)NCCF)c1ccccc1 527a_100000724931_100000751047 [1,1,0,0,0,0|2,0,0]=4 9788 B14R1.166 C[C@H](C(=O)NCCO)c1ccccc1 240690a_100000210304_100000751047 [1,1,0,0,0,0|2,0,0]=4 9789 B14R1.166 C[C@H](C(=O)NCCO)c1ccccc1 527a_100000210304_100000751047 [1,1,0,0,0,0|2,0,0]=4 9790 B14R1.166 N#CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215226 [1,1,0,0,0,0|1,0,1]=4 9791 B14R1.166 N#CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215226 [1,1,0,0,0,0|1,0,1]=4 9792 B14R1.166 O=C(CCCF)C(F)c1ccccc1 1458a_100000698975_100011934791 [1,1,0,0,0,0|1,0,0]=3 9793 B14R1.166 O=C(CCCF)[C@H](O)c1ccccc1 1458a_100000684486_100011934791 [1,1,0,0,0,0|1,0,0]=3 9794 B14R1.166 O=C(CCCO)C(F)c1ccccc1 1458a_100000698975_100011215043 [1,1,0,0,0,0|1,0,0]=3 9795 B14R1.166 O=C(CCCO)[C@H](O)c1ccccc1 1458a_100000684486_100011215043 [1,1,0,0,0,0|1,0,0]=3 9796 B14R1.166 O=C(NCCF)C(F)c1ccccc1 11a_100000724931_100000698975 [1,1,0,0,0,0|2,0,0]=4 9797 B14R1.166 O=C(NCCF)C(F)c1ccccc1 1626a_100000724931_100000698975 [1,1,0,0,0,0|2,0,0]=4 9798 B14R1.166 O=C(NCCF)C(F)c1ccccc1 240690a_100000724931_100000698975 [1,1,0,0,0,0|2,0,0]=4 9799 B14R1.166 O=C(NCCF)C(F)c1ccccc1 527a_100000724931_100000698975 [1,1,0,0,0,0|2,0,0]=4 9800 B14R1.166 O=C(NCCF)[C@H](O)c1ccccc1 240690a_100000724931_100000684486 [1,1,0,0,0,0|2,0,0]=4 9801 B14R1.166 O=C(NCCO)C(F)c1ccccc1 240690a_100000210304_100000698975 [1,1,0,0,0,0|2,0,0]=4 9802 B14R1.166 O=C(NCCO)C(F)c1ccccc1 527a_100000210304_100000698975 [1,1,0,0,0,0|2,0,0]=4 9803 B14R1.166 O=C(NCCO)[C@H](O)c1ccccc1 240690a_100000210304_100000684486 [1,1,0,0,0,0|2,0,0]=4 9804 B14R1.423 C=C(C)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000730704 [1,1,0,0,0,0|1,0,1]=4 9805 B14R1.423 C=C(C)CCC(=O)Cc1ccccc1 1458a_200000688413_100015291786 [1,1,0,0,0,0|0,0,1]=3 9806 B14R1.423 C=C(C)CCC(=O)Cc1ccccn1 1458a_100000233486_100000730704 [1,1,0,0,0,0|1,0,1]=4 9807 B14R1.423 C=C(C)CCC(=O)Cc1ccccn1 1458a_200000688413_100000721315 [1,1,0,0,0,0|1,0,1]=4 9808 B14R1.423 C=C(C)CCC(=O)Cc1cccnc1 1458a_100000737805_100000730704 [1,1,0,0,0,0|1,0,1]=4 9809 B14R1.423 C=C(C)CCC(=O)Cc1cccnc1 1458a_200000688413_100000733263 [1,1,0,0,0,0|1,0,1]=4 9810 B14R1.423 C=C(C)CCC(=O)Cc1ccncc1 1458a_200000688413_100000705612 [1,1,0,0,0,0|1,0,1]=4 9811 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 11a_100000106764_200000688413 [1,1,0,0,0,0|1,0,1]=4 9812 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 1626a_100000106764_200000688413 [1,1,0,0,0,0|1,0,1]=4 9813 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 22a_100000106764_200000688413 [1,1,0,0,0,0|1,0,1]=4 9814 B14R1.423 C=C(C)CCC(=O)Nc1ccccc1 527a_100000106764_200000688413 [1,1,0,0,0,0|1,0,1]=4 9815 B14R1.423 CC(=CCC(=O)Cc1ccccc1)C 1458a_100011220947_100015291786 [1,1,0,0,0,0|0,0,2]=4 9816 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000070787_100000242058 [1,1,0,0,0,0|1,0,1]=4 9817 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200000210301 [1,1,0,0,0,0|1,0,1]=4 9818 B14R1.423 CC(=O)CCC(=O)Oc1ccccc1 1458a_100000070787_200000035796 [1,1,0,0,0,0|1,0,1]=4 9819 B14R1.423 CC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200000210301 [1,1,0,0,0,0|1,0,1]=4 9820 B14R1.423 CC(=O)NCC(=O)Cc1ccccc1 1458a_100000194580_100015291786 [1,1,0,0,0,0|1,0,1]=4 9821 B14R1.423 CC(=O)OCC(=O)Cc1ccccc1 1458a_100000183556_100015291786 [1,1,0,0,0,0|1,0,1]=4 9822 B14R1.423 CC(=O)SCC(=O)Cc1ccccc1 1458a_100000049016_100015291786 [1,1,0,0,0,0|1,0,1]=4 9823 B14R1.423 CC(Br)COC(C)Cc1ccccc1 34a_100012180447_200011218536 [1,1,0,0,0,0|1,0,1]=4 9824 B14R1.423 CC(C)C=CC(=O)Cc1ccccc1 1458a_100016268746_100015291786 [1,1,0,0,0,0|0,0,2]=4 9825 B14R1.423 CC(C)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210312 [1,1,0,0,0,0|1,0,0]=3 9826 B14R1.423 CC(C)CCC(=O)Cc1ccccc1 1458a_100000181311_100015291786 [1,1,0,0,0,0|0,0,0]=2 9827 B14R1.423 CC(C)CCC(=O)Cc1ccccn1 1458a_100000181311_100000721315 [1,1,0,0,0,0|1,0,0]=3 9828 B14R1.423 CC(C)CCC(=O)Cc1ccccn1 1458a_100000233486_100000210312 [1,1,0,0,0,0|1,0,0]=3 9829 B14R1.423 CC(C)CCC(=O)Cc1cccnc1 1458a_100000181311_100000733263 [1,1,0,0,0,0|1,0,0]=3 9830 B14R1.423 CC(C)CCC(=O)Cc1cccnc1 1458a_100000737805_100000210312 [1,1,0,0,0,0|1,0,0]=3 9831 B14R1.423 CC(C)CCC(=O)Cc1cccnn1 1458a_100000181311_100016990269 [1,1,0,0,0,0|2,0,0]=4 9832 B14R1.423 CC(C)CCC(=O)Cc1ccncc1 1458a_100000181311_100000705612 [1,1,0,0,0,0|1,0,0]=3 9833 B14R1.423 CC(C)CCC(=O)Cc1cnccn1 1458a_100000181311_100016995436 [1,1,0,0,0,0|2,0,0]=4 9834 B14R1.423 CC(C)CCC(=O)Cc1cncnc1 1458a_100000181311_100015196519 [1,1,0,0,0,0|2,0,0]=4 9835 B14R1.423 CC(C)CCC(=O)Cc1cncnc1 1458a_100000721575_100000210312 [1,1,0,0,0,0|2,0,0]=4 9836 B14R1.423 CC(C)CCC(=O)Cc1ncccn1 1458a_100000181311_100000703007 [1,1,0,0,0,0|2,0,0]=4 9837 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000181311 [1,1,0,0,0,0|1,0,0]=3 9838 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 1626a_100000106764_100000181311 [1,1,0,0,0,0|1,0,0]=3 9839 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000181311 [1,1,0,0,0,0|1,0,0]=3 9840 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000181311 [1,1,0,0,0,0|1,0,0]=3 9841 B14R1.423 CC(C)CCN(C)Cc1ccccc1 2230a_100000186898_100000210312 [1,1,0,0,0,0|2,0,0]=4 9842 B14R1.423 CC(C)CCN(C)Cc1ccccc1 2230a_100000742789_100015291786 [1,1,0,0,0,0|2,0,0]=4 9843 B14R1.423 CC(C)CCN(C)Cc1ccccc1 269982a_100000186898_100000210312 [1,1,0,0,0,0|2,0,0]=4 9844 B14R1.423 CC(C)CCN(C)Cc1ccccc1 269982a_100000742789_100000211182 [1,1,0,0,0,0|2,0,0]=4 9845 B14R1.423 CC(C)CCN(C)Cc1ccccc1 270004a_100000742789_100015611070 [1,1,0,0,0,0|2,0,0]=4 9846 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 11a_100000210953_200000086051 [1,1,0,0,0,0|2,0,0]=4 9847 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 240690a_100000210953_200000086051 [1,1,0,0,0,0|2,0,0]=4 9848 B14R1.423 CC(C)CNC(=O)C[n+]1ccccc1 527a_100000210953_200000086051 [1,1,0,0,0,0|2,0,0]=4 9849 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 11a_100000210953_100000233486 [1,1,0,0,0,0|2,0,0]=4 9850 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 11a_100000210953_100000737805 [1,1,0,0,0,0|2,0,0]=4 9851 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 240690a_100000210953_100000737805 [1,1,0,0,0,0|2,0,0]=4 9852 B14R1.423 CC(C)CNC(=O)Cc1cccnc1 527a_100000210953_100000737805 [1,1,0,0,0,0|2,0,0]=4 9853 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 11a_100000210953_100011201483 [1,1,0,0,0,0|2,0,0]=4 9854 B14R1.423 CC(C)CNC(=O)Cc1ccncc1 240690a_100000210953_100011201483 [1,1,0,0,0,0|2,0,0]=4 9855 B14R1.423 CC(C)CNC(=O)Nc1ccccc1 2430a_100000106764_100000210953 [1,1,0,0,0,0|2,0,0]=4 9856 B14R1.423 CC(C)COC(C)Cc1ccccc1 34a_100000210257_200011218536 [1,1,0,0,0,0|1,0,1]=4 9857 B14R1.423 CC(C)COC(C)Cc1ccccc1 34a_100000748627_100000210624 [1,1,0,0,0,0|1,0,1]=4 9858 B14R1.423 CC(C)COC(C)Cc1ccccc1 7a_100000748627_100000210760 [1,1,0,0,0,0|1,0,1]=4 9859 B14R1.423 CC(C)NCC(=O)Cc1ccccc1 2230a_100138425928_100000233483 [1,1,0,0,0,0|1,0,0]=3 9860 B14R1.423 CC(C)NCC(=O)Nc1ccccc1 2230a_100138425928_100000182850 [1,1,0,0,0,0|2,0,0]=4 9861 B14R1.423 CC(C)NCC(=O)Nc1ccccc1 34a_100138425928_100000182850 [1,1,0,0,0,0|2,0,0]=4 9862 B14R1.423 CC(C)NCC(=O)Oc1ccccc1 2230a_100138425928_100009813826 [1,1,0,0,0,0|2,0,0]=4 9863 B14R1.423 CC(C)NCC(=O)Oc1ccccc1 34a_100138425928_100009813826 [1,1,0,0,0,0|2,0,0]=4 9864 B14R1.423 CC(C)OCC(=O)Cc1ccccc1 1458a_100000745533_100015291786 [1,1,0,0,0,0|1,0,0]=3 9865 B14R1.423 CC(C)OCC(=O)Cc1ccccn1 1458a_100000745533_100000721315 [1,1,0,0,0,0|2,0,0]=4 9866 B14R1.423 CC(C)OCC(=O)Cc1cccnc1 1458a_100000745533_100000733263 [1,1,0,0,0,0|2,0,0]=4 9867 B14R1.423 CC(C)OCC(=O)Cc1ccncc1 1458a_100000745533_100000705612 [1,1,0,0,0,0|2,0,0]=4 9868 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 11a_100000106764_100000745533 [1,1,0,0,0,0|2,0,0]=4 9869 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 1626a_100000106764_100000745533 [1,1,0,0,0,0|2,0,0]=4 9870 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 22a_100000106764_100000745533 [1,1,0,0,0,0|2,0,0]=4 9871 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 34a_100000212225_100000182850 [1,1,0,0,0,0|2,0,0]=4 9872 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100000210206 [1,1,0,0,0,0|2,0,0]=4 9873 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 527a_100000106764_100000745533 [1,1,0,0,0,0|2,0,0]=4 9874 B14R1.423 CC(C)OCC(=O)Oc1ccccc1 34a_100000212225_100009813826 [1,1,0,0,0,0|2,0,0]=4 9875 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 1458a_100000241585_100015291786 [1,1,0,0,0,0|1,0,0]=3 9876 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 62a_100000210206_100000233483 [1,1,0,0,0,0|1,0,0]=3 9877 B14R1.423 CC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000210206 [1,1,0,0,0,0|1,0,0]=3 9878 B14R1.423 CC(C)SCC(=O)Cc1ccccn1 1458a_100000241585_100000721315 [1,1,0,0,0,0|2,0,0]=4 9879 B14R1.423 CC(C)SCC(=O)Cc1cccnc1 1458a_100000241585_100000733263 [1,1,0,0,0,0|2,0,0]=4 9880 B14R1.423 CC(C)SCC(=O)Cc1ccncc1 1458a_100000241585_100000705612 [1,1,0,0,0,0|2,0,0]=4 9881 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 11a_100000106764_100000241585 [1,1,0,0,0,0|2,0,0]=4 9882 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 1626a_100000106764_100000241585 [1,1,0,0,0,0|2,0,0]=4 9883 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 22a_100000106764_100000241585 [1,1,0,0,0,0|2,0,0]=4 9884 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 527a_100000106764_100000241585 [1,1,0,0,0,0|2,0,0]=4 9885 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 62a_100000210206_100000182850 [1,1,0,0,0,0|2,0,0]=4 9886 B14R1.423 CC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000210206 [1,1,0,0,0,0|2,0,0]=4 9887 B14R1.423 CC(C)SCC(=O)Oc1ccccc1 62a_100000210206_100009813826 [1,1,0,0,0,0|2,0,0]=4 9888 B14R1.423 CC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000210206 [1,1,0,0,0,0|2,0,0]=4 9889 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)Cl 34a_100016084084_200011218536 [1,1,0,0,0,0|1,0,1]=4 9890 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)N 34a_100000737577_200011218536 [1,1,0,0,0,0|1,0,1]=4 9891 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 34a_100000748627_100009817552 [1,1,0,0,0,0|1,0,1]=4 9892 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 7a_100000748627_100009817552 [1,1,0,0,0,0|1,0,1]=4 9893 B14R1.423 CC(F)COC(C)Cc1ccccc1 34a_100015925927_200011218536 [1,1,0,0,0,0|1,0,1]=4 9894 B14R1.423 CC(O)CCC(=O)C[n+]1ccccc1 1458a_200000086051_100012276601 [1,1,0,0,0,0|1,0,0]=3 9895 B14R1.423 CC(O)CCC(=O)Cc1ccccn1 1458a_100000233486_100012276601 [1,1,0,0,0,0|1,0,0]=3 9896 B14R1.423 CC(O)CCC(=O)Cc1cccnc1 1458a_100000737805_100012276601 [1,1,0,0,0,0|1,0,0]=3 9897 B14R1.423 CC(O)CCC(=O)Cc1cncnc1 1458a_100000721575_100012276601 [1,1,0,0,0,0|2,0,0]=4 9898 B14R1.423 CC(O)CCC(=O)Nc1ccccc1 1626a_100000106764_100000718519 [1,1,0,0,0,0|1,0,0]=3 9899 B14R1.423 CC(O)CCN(C)Cc1ccccc1 2230a_100000186898_100012276601 [1,1,0,0,0,0|2,0,0]=4 9900 B14R1.423 CC(O)CCN(C)Cc1ccccc1 269982a_100000186898_100012276601 [1,1,0,0,0,0|2,0,0]=4 9901 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 11a_100000210904_200000086051 [1,1,0,0,0,0|2,0,0]=4 9902 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 240690a_100000210904_200000086051 [1,1,0,0,0,0|2,0,0]=4 9903 B14R1.423 CC(O)CNC(=O)C[n+]1ccccc1 527a_100000210904_200000086051 [1,1,0,0,0,0|2,0,0]=4 9904 B14R1.423 CC(O)CNC(=O)Cc1ccccn1 11a_100000210904_100000233486 [1,1,0,0,0,0|2,0,0]=4 9905 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 11a_100000210904_100000737805 [1,1,0,0,0,0|2,0,0]=4 9906 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 240690a_100000210904_100000737805 [1,1,0,0,0,0|2,0,0]=4 9907 B14R1.423 CC(O)CNC(=O)Cc1cccnc1 527a_100000210904_100000737805 [1,1,0,0,0,0|2,0,0]=4 9908 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 11a_100000210904_100011201483 [1,1,0,0,0,0|2,0,0]=4 9909 B14R1.423 CC(O)CNC(=O)Cc1ccncc1 240690a_100000210904_100011201483 [1,1,0,0,0,0|2,0,0]=4 9910 B14R1.423 CC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000210904 [1,1,0,0,0,0|2,0,0]=4 9911 B14R1.423 CC(O)COC(C)Cc1ccccc1 34a_100000748627_100011218427 [1,1,0,0,0,0|1,0,1]=4 9912 B14R1.423 CC(O)COC(C)Cc1ccccc1 7a_100000748627_100011218427 [1,1,0,0,0,0|1,0,1]=4 9913 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 11a_100000106764_100000689311 [1,1,0,0,0,0|2,0,0]=4 9914 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 2230a_100102631434_100000242058 [1,1,0,0,0,0|2,0,0]=4 9915 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 22a_100000106764_100000689311 [1,1,0,0,0,0|2,0,0]=4 9916 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 269982a_100102631434_100000242058 [1,1,0,0,0,0|2,0,0]=4 9917 B14R1.423 CN(C)CCC(=O)Nc1ccccc1 527a_100000106764_100000689311 [1,1,0,0,0,0|2,0,0]=4 9918 B14R1.423 CN(C)CCC(=O)Oc1ccccc1 2230a_100102631434_200000035796 [1,1,0,0,0,0|2,0,0]=4 9919 B14R1.423 CN(C)CCC(=O)Oc1ccccc1 269982a_100102631434_200000035796 [1,1,0,0,0,0|2,0,0]=4 9920 B14R1.423 C[S+](C)CCC(=O)Cc1ccccc1 1458a_100009452791_100015291786 [1,1,0,0,0,0|1,0,0]=3 9921 B14R1.423 C[S+](C)CCC(=O)Cc1ccccn1 1458a_100009452791_100000721315 [1,1,0,0,0,0|2,0,0]=4 9922 B14R1.423 C[S+](C)CCC(=O)Cc1cccnc1 1458a_100009452791_100000733263 [1,1,0,0,0,0|2,0,0]=4 9923 B14R1.423 C[S+](C)CCC(=O)Cc1ccncc1 1458a_100009452791_100000705612 [1,1,0,0,0,0|2,0,0]=4 9924 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 11a_100000106764_100009452791 [1,1,0,0,0,0|2,0,0]=4 9925 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 1626a_100000106764_100009452791 [1,1,0,0,0,0|2,0,0]=4 9926 B14R1.423 C[S+](C)CCC(=O)Nc1ccccc1 22a_100000106764_100009452791 [1,1,0,0,0,0|2,0,0]=4 9927 B14R1.423 NC(=O)CCC(=O)Cc1ccccc1 1458a_100011215257_100015291786 [1,1,0,0,0,0|1,0,1]=4 9928 B14R1.423 O=C(CC[N+](=O)[O-])Cc1ccccc1 1458a_200000064761_100015291786 [1,1,0,0,0,0|2,0,0]=4 9929 B14R1.423 O=C(COC(F)F)Cc1ccccc1 1458a_200000719455_100015291786 [1,1,0,0,0,0|2,0,0]=4 9930 B14R1.423 O=C(CSC(F)F)Cc1ccccc1 1458a_114828291038_100015291786 [1,1,0,0,0,0|2,0,0]=4 9931 B14R1.423 [13CH3]C(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200025704644 [1,1,0,0,0,0|1,0,1]=4 9932 B14R1.423 [13CH3]C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200025704644 [1,1,0,0,0,0|1,0,1]=4 9933 B14R1.467 C#CC(Cc1ccccc1)OCCC 34a_100000685211_100000210303 [1,1,0,0,0,0|1,0,1]=4 9934 B14R1.467 C#CC(Cc1ccccc1)OCCC 7a_100000685211_100000210303 [1,1,0,0,0,0|1,0,1]=4 9935 B14R1.467 CCCCC(Cc1ccccc1)NC 270004a_106832991635_200011218368 [1,1,0,0,0,0|1,0,1]=4 9936 B14R1.467 CCCCN(CC)Cc1ccccc1 2230a_100000186914_100000210211 [1,1,0,0,0,0|2,0,0]=4 9937 B14R1.467 CCCCN(CC)Cc1ccccc1 2230a_100000207695_100015291786 [1,1,0,0,0,0|2,0,0]=4 9938 B14R1.467 CCCCN(CC)Cc1ccccc1 2230a_200000196024_100000210202 [1,1,0,0,0,0|2,0,0]=4 9939 B14R1.467 CCCCN(CC)Cc1ccccc1 269982a_100000186914_100000210211 [1,1,0,0,0,0|2,0,0]=4 9940 B14R1.467 CCCCN(CC)Cc1ccccc1 269982a_100000207695_100000211182 [1,1,0,0,0,0|2,0,0]=4 9941 B14R1.467 CCCCN(CC)Cc1ccccc1 269982a_200000196024_100000204670 [1,1,0,0,0,0|2,0,0]=4 9942 B14R1.467 CCCCN(CC)Cc1ccccc1 270004a_100000207695_100015611070 [1,1,0,0,0,0|2,0,0]=4 9943 B14R1.467 CCCCN(CF)Cc1ccccc1 269982a_200000196024_100015361967 [1,1,0,0,0,0|2,0,0]=4 9944 B14R1.467 CCCOC(CC)Cc1ccccc1 7a_100000760156_100000210303 [1,1,0,0,0,0|1,0,1]=4 9945 B14R1.467 CCCOC(CN)Cc1ccccc1 34a_100000752270_100000210303 [1,1,0,0,0,0|1,0,1]=4 9946 B14R1.467 CCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210303 [1,1,0,0,0,0|1,0,1]=4 9947 B14R1.743 C=CC(C)CC(=O)Cc1ccccc1 1458a_100011934298_100015291786 [1,1,0,0,0,0|0,0,2]=4 9948 B14R1.743 CCC(=CC(=O)Cc1ccccc1)C 1458a_100020758463_100015291786 [1,1,0,0,0,0|0,0,2]=4 9949 B14R1.743 CCC(=O)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000747405 [1,1,0,0,0,0|1,0,1]=4 9950 B14R1.743 CCC(=O)CC(=O)Cc1ccccc1 1458a_100000210414_100000233483 [1,1,0,0,0,0|0,0,1]=3 9951 B14R1.743 CCC(=O)CC(=O)Cc1ccccn1 1458a_100000233486_100000747405 [1,1,0,0,0,0|1,0,1]=4 9952 B14R1.743 CCC(=O)CC(=O)Cc1cccnc1 1458a_100000737805_100000747405 [1,1,0,0,0,0|1,0,1]=4 9953 B14R1.743 CCC(=O)CC(=O)Nc1ccccc1 1458a_100000210414_100000182850 [1,1,0,0,0,0|1,0,1]=4 9954 B14R1.743 CCC(=O)CC(=O)Oc1ccccc1 1458a_100000210414_100009813826 [1,1,0,0,0,0|1,0,1]=4 9955 B14R1.743 CCC(C)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000748023 [1,1,0,0,0,0|1,0,0]=3 9956 B14R1.743 CCC(C)CC(=O)Cc1ccccc1 1458a_100000708755_100015291786 [1,1,0,0,0,0|0,0,0]=2 9957 B14R1.743 CCC(C)CC(=O)Cc1ccccn1 1458a_100000233486_100000748023 [1,1,0,0,0,0|1,0,0]=3 9958 B14R1.743 CCC(C)CC(=O)Cc1ccccn1 1458a_100000708755_100000721315 [1,1,0,0,0,0|1,0,0]=3 9959 B14R1.743 CCC(C)CC(=O)Cc1cccnc1 1458a_100000708755_100000733263 [1,1,0,0,0,0|1,0,0]=3 9960 B14R1.743 CCC(C)CC(=O)Cc1cccnc1 1458a_100000737805_100000748023 [1,1,0,0,0,0|1,0,0]=3 9961 B14R1.743 CCC(C)CC(=O)Cc1cccnn1 1458a_100000708755_100016990269 [1,1,0,0,0,0|2,0,0]=4 9962 B14R1.743 CCC(C)CC(=O)Cc1ccncc1 1458a_100000708755_100000705612 [1,1,0,0,0,0|1,0,0]=3 9963 B14R1.743 CCC(C)CC(=O)Cc1cnccn1 1458a_100000708755_100016995436 [1,1,0,0,0,0|2,0,0]=4 9964 B14R1.743 CCC(C)CC(=O)Cc1cncnc1 1458a_100000708755_100015196519 [1,1,0,0,0,0|2,0,0]=4 9965 B14R1.743 CCC(C)CC(=O)Cc1cncnc1 1458a_100000721575_100000748023 [1,1,0,0,0,0|2,0,0]=4 9966 B14R1.743 CCC(C)CC(=O)Cc1ncccn1 1458a_100000708755_100000703007 [1,1,0,0,0,0|2,0,0]=4 9967 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 11a_100000106764_100000708755 [1,1,0,0,0,0|1,0,0]=3 9968 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 1626a_100000106764_100000708755 [1,1,0,0,0,0|1,0,0]=3 9969 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 22a_100000106764_100000708755 [1,1,0,0,0,0|1,0,0]=3 9970 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 527a_100000106764_100000708755 [1,1,0,0,0,0|1,0,0]=3 9971 B14R1.743 CCC(C)CN(C)Cc1ccccc1 2230a_100000186898_100000748023 [1,1,0,0,0,0|2,0,0]=4 9972 B14R1.743 CCC(C)CN(C)Cc1ccccc1 2230a_100000753921_100015291786 [1,1,0,0,0,0|2,0,0]=4 9973 B14R1.743 CCC(C)CN(C)Cc1ccccc1 269982a_100000186898_100000748023 [1,1,0,0,0,0|2,0,0]=4 9974 B14R1.743 CCC(C)CN(C)Cc1ccccc1 269982a_100000753921_100000211182 [1,1,0,0,0,0|2,0,0]=4 9975 B14R1.743 CCC(C)CN(C)Cc1ccccc1 270004a_100000186898_100000243153 [1,1,0,0,0,0|2,0,0]=4 9976 B14R1.743 CCC(C)CN(C)Cc1ccccc1 270004a_100000753921_100015611070 [1,1,0,0,0,0|2,0,0]=4 9977 B14R1.743 CCC(C)NC(=O)C[n+]1ccccc1 11a_100000209981_200000086051 [1,1,0,0,0,0|2,0,0]=4 9978 B14R1.743 CCC(C)NC(=O)C[n+]1ccccc1 240690a_100000209981_200000086051 [1,1,0,0,0,0|2,0,0]=4 9979 B14R1.743 CCC(C)NC(=O)C[n+]1ccccc1 527a_100000209981_200000086051 [1,1,0,0,0,0|2,0,0]=4 9980 B14R1.743 CCC(C)NC(=O)Cc1ccccn1 11a_100000209981_100000233486 [1,1,0,0,0,0|2,0,0]=4 9981 B14R1.743 CCC(C)NC(=O)Cc1cccnc1 11a_100000209981_100000737805 [1,1,0,0,0,0|2,0,0]=4 9982 B14R1.743 CCC(C)NC(=O)Cc1cccnc1 240690a_100000209981_100000737805 [1,1,0,0,0,0|2,0,0]=4 9983 B14R1.743 CCC(C)NC(=O)Cc1cccnc1 527a_100000209981_100000737805 [1,1,0,0,0,0|2,0,0]=4 9984 B14R1.743 CCC(C)NC(=O)Cc1ccncc1 11a_100000209981_100011201483 [1,1,0,0,0,0|2,0,0]=4 9985 B14R1.743 CCC(C)NC(=O)Cc1ccncc1 240690a_100000209981_100011201483 [1,1,0,0,0,0|2,0,0]=4 9986 B14R1.743 CCC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000209981 [1,1,0,0,0,0|2,0,0]=4 9987 B14R1.743 CCC(C)OC(C)Cc1ccccc1 34a_100000748627_100011215416 [1,1,0,0,0,0|1,0,1]=4 9988 B14R1.743 CCC(C)OC(C)Cc1ccccc1 7a_100000210228_200011218536 [1,1,0,0,0,0|1,0,1]=4 9989 B14R1.743 CCC(C)OC(C)Cc1ccccc1 7a_100000748627_100000758301 [1,1,0,0,0,0|1,0,1]=4 9990 B14R1.743 CCC(O)CC(=O)C[n+]1ccccc1 1458a_200000086051_100011218378 [1,1,0,0,0,0|1,0,0]=3 9991 B14R1.743 CCC(O)CC(=O)Cc1ccccc1 1458a_100011667805_100015291786 [1,1,0,0,0,0|0,0,0]=2 9992 B14R1.743 CCC(O)CC(=O)Cc1ccccn1 1458a_100000233486_100011218378 [1,1,0,0,0,0|1,0,0]=3 9993 B14R1.743 CCC(O)CC(=O)Cc1ccccn1 1458a_100011667805_100000721315 [1,1,0,0,0,0|1,0,0]=3 9994 B14R1.743 CCC(O)CC(=O)Cc1cccnc1 1458a_100000737805_100011218378 [1,1,0,0,0,0|1,0,0]=3 9995 B14R1.743 CCC(O)CC(=O)Cc1cccnc1 1458a_100011667805_100000733263 [1,1,0,0,0,0|1,0,0]=3 9996 B14R1.743 CCC(O)CC(=O)Cc1cccnn1 1458a_100011667805_100016990269 [1,1,0,0,0,0|2,0,0]=4 9997 B14R1.743 CCC(O)CC(=O)Cc1ccncc1 1458a_100011667805_100000705612 [1,1,0,0,0,0|1,0,0]=3 9998 B14R1.743 CCC(O)CC(=O)Cc1cnccn1 1458a_100011667805_100016995436 [1,1,0,0,0,0|2,0,0]=4 9999 B14R1.743 CCC(O)CC(=O)Cc1cncnc1 1458a_100000721575_100011218378 [1,1,0,0,0,0|2,0,0]=4 10000 B14R1.743 CCC(O)CC(=O)Cc1cncnc1 1458a_100011667805_100015196519 [1,1,0,0,0,0|2,0,0]=4 10001 B14R1.743 CCC(O)CC(=O)Cc1ncccn1 1458a_100011667805_100000703007 [1,1,0,0,0,0|2,0,0]=4 10002 B14R1.743 CCC(O)CC(=O)Nc1ccccc1 1626a_100000106764_100011667805 [1,1,0,0,0,0|1,0,0]=3 10003 B14R1.743 CCC(O)CC(=O)Nc1ccccc1 22a_100000106764_100011667805 [1,1,0,0,0,0|1,0,0]=3 10004 B14R1.743 CCC(O)CN(C)Cc1ccccc1 2230a_100000186898_100011218378 [1,1,0,0,0,0|2,0,0]=4 10005 B14R1.743 CCC(O)CN(C)Cc1ccccc1 269982a_100000186898_100011218378 [1,1,0,0,0,0|2,0,0]=4 10006 B14R1.743 CCN(C)CC(=O)Cc1ccccc1 1458a_100116209913_100015291786 [1,1,0,0,0,0|1,0,0]=3 10007 B14R1.743 CCN(C)CC(=O)Cc1ccccc1 2230a_100000225621_100000233483 [1,1,0,0,0,0|1,0,0]=3 10008 B14R1.743 CCN(C)CC(=O)Cc1ccccc1 269982a_100000225621_100000233483 [1,1,0,0,0,0|1,0,0]=3 10009 B14R1.743 CCN(C)CC(=O)Cc1ccccn1 1458a_100116209913_100000721315 [1,1,0,0,0,0|2,0,0]=4 10010 B14R1.743 CCN(C)CC(=O)Cc1cccnc1 1458a_100116209913_100000733263 [1,1,0,0,0,0|2,0,0]=4 10011 B14R1.743 CCN(C)CC(=O)Cc1ccncc1 1458a_100116209913_100000705612 [1,1,0,0,0,0|2,0,0]=4 10012 B14R1.743 CCN(C)CC(=O)Nc1ccccc1 2230a_100000225621_100000182850 [1,1,0,0,0,0|2,0,0]=4 10013 B14R1.743 CCN(C)CC(=O)Nc1ccccc1 22a_100000106764_100116209913 [1,1,0,0,0,0|2,0,0]=4 10014 B14R1.743 CCN(C)CC(=O)Nc1ccccc1 269982a_100000225621_100000182850 [1,1,0,0,0,0|2,0,0]=4 10015 B14R1.743 CCN(C)CC(=O)Nc1ccccc1 527a_100000106764_100116209913 [1,1,0,0,0,0|2,0,0]=4 10016 B14R1.743 CCN(C)CC(=O)Oc1ccccc1 2230a_100000225621_100009813826 [1,1,0,0,0,0|2,0,0]=4 10017 B14R1.743 CCN(C)CC(=O)Oc1ccccc1 269982a_100000225621_100009813826 [1,1,0,0,0,0|2,0,0]=4 10018 B14R1.743 CC[C@H](C)CC(=O)C[n+]1ccccc1 1458a_200000086051_100009816398 [1,1,0,0,0,0|1,0,0]=3 10019 B14R1.743 CC[C@H](C)CC(=O)Cc1ccccn1 1458a_100000233486_100009816398 [1,1,0,0,0,0|1,0,0]=3 10020 B14R1.743 CC[C@H](C)CC(=O)Cc1cccnc1 1458a_100000737805_100009816398 [1,1,0,0,0,0|1,0,0]=3 10021 B14R1.743 CC[C@H](C)CC(=O)Cc1cncnc1 1458a_100000721575_100009816398 [1,1,0,0,0,0|2,0,0]=4 10022 B14R1.743 CC[C@H](C)CN(C)Cc1ccccc1 2230a_100000186898_100009816398 [1,1,0,0,0,0|2,0,0]=4 10023 B14R1.743 CC[C@H](C)CN(C)Cc1ccccc1 269982a_100000186898_100009816398 [1,1,0,0,0,0|2,0,0]=4 10024 B14R1.743 COC(=O)CC(=O)Cc1ccccc1 1458a_100000211351_100015291786 [1,1,0,0,0,0|1,0,1]=4 10025 B14R1.743 C[C@@H](CO)CC(=O)C[n+]1ccccc1 1458a_200000086051_100000059175 [1,1,0,0,0,0|2,0,0]=4 10026 B14R1.743 C[C@@H](CO)CC(=O)Cc1ccccn1 1458a_100000233486_100000059175 [1,1,0,0,0,0|2,0,0]=4 10027 B14R1.743 C[C@@H](CO)CC(=O)Cc1cccnc1 1458a_100000737805_100000059175 [1,1,0,0,0,0|2,0,0]=4 10028 B14R1.743 O=C(CO)CC(=O)Cc1ccccc1 1458a_100000210174_100000233483 [1,1,0,0,0,0|1,0,1]=4 10029 B14R1.946 C#CCCC(=O)Cc1ccccc1Br 1458a_100000692101_100000184730 [1,1,0,0,0,0|0,0,2]=4 10030 B14R1.946 C#CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000753159 [1,1,0,0,0,0|0,0,2]=4 10031 B14R1.946 C#CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000753159 [1,1,0,0,0,0|0,0,2]=4 10032 B14R1.946 C#CCCC(=O)Cc1ccccc1C 1458a_100000692101_100000211839 [1,1,0,0,0,0|0,0,2]=4 10033 B14R1.946 C#CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000753159 [1,1,0,0,0,0|0,0,2]=4 10034 B14R1.946 C#CCCC(=O)Cc1ccccc1Cl 1458a_100000692101_100000187162 [1,1,0,0,0,0|0,0,2]=4 10035 B14R1.946 C#CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000753159 [1,1,0,0,0,0|0,0,2]=4 10036 B14R1.946 C#CCCC(=O)Cc1ccccc1F 1458a_100000692101_100000187165 [1,1,0,0,0,0|0,0,2]=4 10037 B14R1.946 C#CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000753159 [1,1,0,0,0,0|0,0,2]=4 10038 B14R1.946 C#CCCC(=O)Cc1ccccc1I 1458a_100000692101_100011216222 [1,1,0,0,0,0|0,0,2]=4 10039 B14R1.946 C#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000753159 [1,1,0,0,0,0|0,0,2]=4 10040 B14R1.946 C/C=C/CC(=O)Cc1ccccc1Br 1458a_100000751119_100102629194 [1,1,0,0,0,0|0,0,2]=4 10041 B14R1.946 C/C=C/CC(=O)Cc1ccccc1C 1458a_100000212180_100102629194 [1,1,0,0,0,0|0,0,2]=4 10042 B14R1.946 C/C=C/CC(=O)Cc1ccccc1Cl 1458a_100000183793_100102629194 [1,1,0,0,0,0|0,0,2]=4 10043 B14R1.946 C/C=C/CC(=O)Cc1ccccc1F 1458a_100000212012_100102629194 [1,1,0,0,0,0|0,0,2]=4 10044 B14R1.946 C/C=C/CC(=O)Cc1ccccc1I 1458a_100000036491_100102629194 [1,1,0,0,0,0|0,0,2]=4 10045 B14R1.946 C/C=C/CC(=O)Cc1ccccc1O 1458a_100000743006_100102629194 [1,1,0,0,0,0|0,0,2]=4 10046 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000749702_100000184730 [1,1,0,0,0,0|0,0,2]=4 10047 B14R1.946 C=CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000754431 [1,1,0,0,0,0|0,0,2]=4 10048 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000212180_100000754431 [1,1,0,0,0,0|0,0,2]=4 10049 B14R1.946 C=CCCC(=O)Cc1ccccc1C 1458a_100000749702_100000211839 [1,1,0,0,0,0|0,0,2]=4 10050 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000754431 [1,1,0,0,0,0|0,0,2]=4 10051 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000749702_100000187162 [1,1,0,0,0,0|0,0,2]=4 10052 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000754431 [1,1,0,0,0,0|0,0,2]=4 10053 B14R1.946 C=CCCC(=O)Cc1ccccc1F 1458a_100000749702_100000187165 [1,1,0,0,0,0|0,0,2]=4 10054 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000754431 [1,1,0,0,0,0|0,0,2]=4 10055 B14R1.946 C=CCCC(=O)Cc1ccccc1I 1458a_100000749702_100011216222 [1,1,0,0,0,0|0,0,2]=4 10056 B14R1.946 C=CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000754431 [1,1,0,0,0,0|0,0,2]=4 10057 B14R1.946 CC#CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000748600 [1,1,0,0,0,0|0,0,2]=4 10058 B14R1.946 CC#CCC(=O)Cc1ccccc1C 1458a_100000212180_100000748600 [1,1,0,0,0,0|0,0,2]=4 10059 B14R1.946 CC#CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000748600 [1,1,0,0,0,0|0,0,2]=4 10060 B14R1.946 CC#CCC(=O)Cc1ccccc1F 1458a_100000212012_100000748600 [1,1,0,0,0,0|0,0,2]=4 10061 B14R1.946 CC#CCC(=O)Cc1ccccc1I 1458a_100000036491_100000748600 [1,1,0,0,0,0|0,0,2]=4 10062 B14R1.946 CC#CCC(=O)Cc1ccccc1O 1458a_100000743006_100000748600 [1,1,0,0,0,0|0,0,2]=4 10063 B14R1.946 CC=CCC(=O)Cc1ccccc1Br 1458a_100000751119_100000070051 [1,1,0,0,0,0|0,0,2]=4 10064 B14R1.946 CC=CCC(=O)Cc1ccccc1Br 1458a_100121576822_100000184730 [1,1,0,0,0,0|0,0,2]=4 10065 B14R1.946 CC=CCC(=O)Cc1ccccc1C 1458a_100000212180_100000070051 [1,1,0,0,0,0|0,0,2]=4 10066 B14R1.946 CC=CCC(=O)Cc1ccccc1C 1458a_100121576822_100000211839 [1,1,0,0,0,0|0,0,2]=4 10067 B14R1.946 CC=CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000070051 [1,1,0,0,0,0|0,0,2]=4 10068 B14R1.946 CC=CCC(=O)Cc1ccccc1Cl 1458a_100121576822_100000187162 [1,1,0,0,0,0|0,0,2]=4 10069 B14R1.946 CC=CCC(=O)Cc1ccccc1F 1458a_100000212012_100000070051 [1,1,0,0,0,0|0,0,2]=4 10070 B14R1.946 CC=CCC(=O)Cc1ccccc1F 1458a_100121576822_100000187165 [1,1,0,0,0,0|0,0,2]=4 10071 B14R1.946 CC=CCC(=O)Cc1ccccc1I 1458a_100000036491_100000070051 [1,1,0,0,0,0|0,0,2]=4 10072 B14R1.946 CC=CCC(=O)Cc1ccccc1I 1458a_100121576822_100011216222 [1,1,0,0,0,0|0,0,2]=4 10073 B14R1.946 CC=CCC(=O)Cc1ccccc1O 1458a_100000743006_100000070051 [1,1,0,0,0,0|0,0,2]=4 10074 B14R1.946 CCC#CC(=O)Cc1ccccc1Br 1458a_100011827653_100000184730 [1,1,0,0,0,0|0,0,2]=4 10075 B14R1.946 CCC#CC(=O)Cc1ccccc1C 1458a_100011827653_100000211839 [1,1,0,0,0,0|0,0,2]=4 10076 B14R1.946 CCC#CC(=O)Cc1ccccc1Cl 1458a_100011827653_100000187162 [1,1,0,0,0,0|0,0,2]=4 10077 B14R1.946 CCC#CC(=O)Cc1ccccc1F 1458a_100011827653_100000187165 [1,1,0,0,0,0|0,0,2]=4 10078 B14R1.946 CCC#CC(=O)Cc1ccccc1I 1458a_100011827653_100011216222 [1,1,0,0,0,0|0,0,2]=4 10079 B14R1.946 CCC=CC(=O)Cc1ccccc1Br 1458a_100000212282_100000184730 [1,1,0,0,0,0|0,0,2]=4 10080 B14R1.946 CCC=CC(=O)Cc1ccccc1C 1458a_100000212282_100000211839 [1,1,0,0,0,0|0,0,2]=4 10081 B14R1.946 CCC=CC(=O)Cc1ccccc1Cl 1458a_100000212282_100000187162 [1,1,0,0,0,0|0,0,2]=4 10082 B14R1.946 CCC=CC(=O)Cc1ccccc1F 1458a_100000212282_100000187165 [1,1,0,0,0,0|0,0,2]=4 10083 B14R1.946 CCC=CC(=O)Cc1ccccc1I 1458a_100000212282_100011216222 [1,1,0,0,0,0|0,0,2]=4 10084 B14R1.946 CCCCC(=Cc1ccccc1Br)Br 271570a_206741709834_100000695589 [1,1,0,0,0,0|1,0,1]=4 10085 B14R1.946 CCCCC(=Cc1ccccc1C)Br 271570a_206741709834_100000210755 [1,1,0,0,0,0|1,0,1]=4 10086 B14R1.946 CCCCC(=Cc1ccccc1Cl)Br 271570a_206741709834_100000764095 [1,1,0,0,0,0|1,0,1]=4 10087 B14R1.946 CCCCC(=Cc1ccccc1F)Br 271570a_206741709834_100011215700 [1,1,0,0,0,0|1,0,1]=4 10088 B14R1.946 CCCCC(=Cc1ccccc1N)Br 271570a_206741709834_100000210017 [1,1,0,0,0,0|1,0,1]=4 10089 B14R1.946 CCCCC(=Cc1ccccc1O)Br 271570a_206741709834_100000739446 [1,1,0,0,0,0|1,0,1]=4 10090 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000210183_100000184730 [1,1,0,0,0,0|0,0,0]=2 10091 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210211 [1,1,0,0,0,0|0,0,0]=2 10092 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000210183_100000211839 [1,1,0,0,0,0|0,0,0]=2 10093 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210211 [1,1,0,0,0,0|0,0,0]=2 10094 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210211 [1,1,0,0,0,0|0,0,0]=2 10095 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000210183_100000187162 [1,1,0,0,0,0|0,0,0]=2 10096 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000210183_100000187165 [1,1,0,0,0,0|0,0,0]=2 10097 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210211 [1,1,0,0,0,0|0,0,0]=2 10098 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210211 [1,1,0,0,0,0|0,0,0]=2 10099 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000210183_100011216222 [1,1,0,0,0,0|0,0,0]=2 10100 B14R1.946 CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210211 [1,1,0,0,0,0|0,0,0]=2 10101 B14R1.946 CCCCC(=O)Cc1cccnc1Br 1458a_100000210183_100010140945 [1,1,0,0,0,0|1,0,0]=3 10102 B14R1.946 CCCCC(=O)Cc1cccnc1C 1458a_100000210183_100000732876 [1,1,0,0,0,0|1,0,0]=3 10103 B14R1.946 CCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210211 [1,1,0,0,0,0|1,0,0]=3 10104 B14R1.946 CCCCC(=O)Cc1cccnc1Cl 1458a_100000210183_100000045678 [1,1,0,0,0,0|1,0,0]=3 10105 B14R1.946 CCCCC(=O)Cc1cccnc1F 1458a_100000210183_100000099810 [1,1,0,0,0,0|1,0,0]=3 10106 B14R1.946 CCCCC(=O)Cc1ccncc1C 1458a_100000210183_100020672808 [1,1,0,0,0,0|1,0,0]=3 10107 B14R1.946 CCCCC(=O)Cc1ccncc1Cl 1458a_100000210183_100000763264 [1,1,0,0,0,0|1,0,0]=3 10108 B14R1.946 CCCCC(=O)Cc1cnccc1C 1458a_100000210183_100000690890 [1,1,0,0,0,0|1,0,0]=3 10109 B14R1.946 CCCCC(=O)Cc1ncccc1Br 1458a_100000210183_100025702911 [1,1,0,0,0,0|1,0,0]=3 10110 B14R1.946 CCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210211 [1,1,0,0,0,0|1,0,0]=3 10111 B14R1.946 CCCCC(=O)Cc1ncccc1C 1458a_100000210183_100000696600 [1,1,0,0,0,0|1,0,0]=3 10112 B14R1.946 CCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210211 [1,1,0,0,0,0|1,0,0]=3 10113 B14R1.946 CCCCC(=O)Cc1ncccc1Cl 1458a_100000210183_100000099807 [1,1,0,0,0,0|1,0,0]=3 10114 B14R1.946 CCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210211 [1,1,0,0,0,0|1,0,0]=3 10115 B14R1.946 CCCCC(=O)Cc1ncccc1F 1458a_100000210183_100000104219 [1,1,0,0,0,0|1,0,0]=3 10116 B14R1.946 CCCCC(=O)Cc1ncccc1O 1458a_100000210183_200020655725 [1,1,0,0,0,0|1,0,0]=3 10117 B14R1.946 CCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210211 [1,1,0,0,0,0|1,0,0]=3 10118 B14R1.946 CCCCC(=O)Cn1cccnc1=O 1458a_100000738077_100000210211 [1,1,0,0,0,0|2,0,0]=4 10119 B14R1.946 CCCCC(=O)Cn1ncccc1=O 1458a_100000238584_100000210211 [1,1,0,0,0,0|2,0,0]=4 10120 B14R1.946 CCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000210183 [1,1,0,0,0,0|1,0,0]=3 10121 B14R1.946 CCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210183 [1,1,0,0,0,0|1,0,0]=3 10122 B14R1.946 CCCCC(=O)Nc1ccccc1C 11a_100015192222_100000210183 [1,1,0,0,0,0|1,0,0]=3 10123 B14R1.946 CCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000210183 [1,1,0,0,0,0|1,0,0]=3 10124 B14R1.946 CCCCC(=O)Nc1ccccc1C 22a_100015192222_100000210183 [1,1,0,0,0,0|1,0,0]=3 10125 B14R1.946 CCCCC(=O)Nc1ccccc1C 527a_100015192222_100000210183 [1,1,0,0,0,0|1,0,0]=3 10126 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210183 [1,1,0,0,0,0|1,0,0]=3 10127 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210183 [1,1,0,0,0,0|1,0,0]=3 10128 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210183 [1,1,0,0,0,0|1,0,0]=3 10129 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210183 [1,1,0,0,0,0|1,0,0]=3 10130 B14R1.946 CCCCC(=O)Nc1ccccc1F 11a_100000210422_100000210183 [1,1,0,0,0,0|1,0,0]=3 10131 B14R1.946 CCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000210183 [1,1,0,0,0,0|1,0,0]=3 10132 B14R1.946 CCCCC(=O)Nc1ccccc1F 22a_100000210422_100000210183 [1,1,0,0,0,0|1,0,0]=3 10133 B14R1.946 CCCCC(=O)Nc1ccccc1F 527a_100000210422_100000210183 [1,1,0,0,0,0|1,0,0]=3 10134 B14R1.946 CCCCC(=O)Nc1ccccc1I 11a_100000210053_100000210183 [1,1,0,0,0,0|1,0,0]=3 10135 B14R1.946 CCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000210183 [1,1,0,0,0,0|1,0,0]=3 10136 B14R1.946 CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000210183 [1,1,0,0,0,0|1,0,0]=3 10137 B14R1.946 CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000210183 [1,1,0,0,0,0|1,0,0]=3 10138 B14R1.946 CCCCN(C)Cc1ccccc1Br 2230a_100000184654_100000210211 [1,1,0,0,0,0|2,0,0]=4 10139 B14R1.946 CCCCN(C)Cc1ccccc1Br 2230a_100000207549_100000184730 [1,1,0,0,0,0|2,0,0]=4 10140 B14R1.946 CCCCN(C)Cc1ccccc1Br 269982a_100000184654_100000210211 [1,1,0,0,0,0|2,0,0]=4 10141 B14R1.946 CCCCN(C)Cc1ccccc1Br 269982a_100000207549_100000184730 [1,1,0,0,0,0|2,0,0]=4 10142 B14R1.946 CCCCN(C)Cc1ccccc1Br 26a_100000207549_100000181306 [1,1,0,0,0,0|2,0,0]=4 10143 B14R1.946 CCCCN(C)Cc1ccccc1Br 270004a_100000207549_100000211189 [1,1,0,0,0,0|2,0,0]=4 10144 B14R1.946 CCCCN(C)Cc1ccccc1C 2230a_100000184421_100000210211 [1,1,0,0,0,0|2,0,0]=4 10145 B14R1.946 CCCCN(C)Cc1ccccc1C 2230a_100000207549_100000211839 [1,1,0,0,0,0|2,0,0]=4 10146 B14R1.946 CCCCN(C)Cc1ccccc1C 2230a_100015184623_200000210301 [1,1,0,0,0,0|2,0,0]=4 10147 B14R1.946 CCCCN(C)Cc1ccccc1C 269982a_100000184421_100000210211 [1,1,0,0,0,0|2,0,0]=4 10148 B14R1.946 CCCCN(C)Cc1ccccc1C 269982a_100000207549_100000211839 [1,1,0,0,0,0|2,0,0]=4 10149 B14R1.946 CCCCN(C)Cc1ccccc1C 269982a_100015184623_200000210301 [1,1,0,0,0,0|2,0,0]=4 10150 B14R1.946 CCCCN(C)Cc1ccccc1C 270004a_100000207549_100000211143 [1,1,0,0,0,0|2,0,0]=4 10151 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210211 [1,1,0,0,0,0|2,0,0]=4 10152 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000196027_200000210301 [1,1,0,0,0,0|2,0,0]=4 10153 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000207549_100000187162 [1,1,0,0,0,0|2,0,0]=4 10154 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000184507_100000210211 [1,1,0,0,0,0|2,0,0]=4 10155 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000196027_200000210301 [1,1,0,0,0,0|2,0,0]=4 10156 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000207549_100000187162 [1,1,0,0,0,0|2,0,0]=4 10157 B14R1.946 CCCCN(C)Cc1ccccc1Cl 26a_100000207549_100000210172 [1,1,0,0,0,0|2,0,0]=4 10158 B14R1.946 CCCCN(C)Cc1ccccc1Cl 270004a_100000207549_100000210073 [1,1,0,0,0,0|2,0,0]=4 10159 B14R1.946 CCCCN(C)Cc1ccccc1F 2230a_100000207549_100000211605 [1,1,0,0,0,0|2,0,0]=4 10160 B14R1.946 CCCCN(C)Cc1ccccc1F 2230a_100000742528_100000210211 [1,1,0,0,0,0|2,0,0]=4 10161 B14R1.946 CCCCN(C)Cc1ccccc1F 2230a_100000750065_200000210301 [1,1,0,0,0,0|2,0,0]=4 10162 B14R1.946 CCCCN(C)Cc1ccccc1F 269982a_100000207549_100000211605 [1,1,0,0,0,0|2,0,0]=4 10163 B14R1.946 CCCCN(C)Cc1ccccc1F 269982a_100000742528_100000210211 [1,1,0,0,0,0|2,0,0]=4 10164 B14R1.946 CCCCN(C)Cc1ccccc1F 269982a_100000750065_200000210301 [1,1,0,0,0,0|2,0,0]=4 10165 B14R1.946 CCCCN(C)Cc1ccccc1F 270004a_100000207549_100000210811 [1,1,0,0,0,0|2,0,0]=4 10166 B14R1.946 CCCCN(C)Cc1ccccc1F 34a_100000742528_100000210210 [1,1,0,0,0,0|2,0,0]=4 10167 B14R1.946 CCCCN(C)Cc1ccccc1F 34a_100000750065_200000210301 [1,1,0,0,0,0|2,0,0]=4 10168 B14R1.946 CCCCN(C)Cc1ccccc1I 2230a_100000207549_100011215278 [1,1,0,0,0,0|2,0,0]=4 10169 B14R1.946 CCCCN(C)Cc1ccccc1I 269982a_100000207549_100011215278 [1,1,0,0,0,0|2,0,0]=4 10170 B14R1.946 CCCCN(C)Cc1ccccc1I 270004a_100000207549_100000010305 [1,1,0,0,0,0|2,0,0]=4 10171 B14R1.946 CCCCN(C)Cc1ccccc1O 2230a_100015189988_100000210211 [1,1,0,0,0,0|2,0,0]=4 10172 B14R1.946 CCCCN(C)Cc1ccccc1O 269982a_100015189988_100000210211 [1,1,0,0,0,0|2,0,0]=4 10173 B14R1.946 CCCCN([13CH3])Cc1ccccc1C 2230a_100015184623_200025704644 [1,1,0,0,0,0|2,0,0]=4 10174 B14R1.946 CCCCN([13CH3])Cc1ccccc1C 269982a_100015184623_200025704644 [1,1,0,0,0,0|2,0,0]=4 10175 B14R1.946 CCCCN([13CH3])Cc1ccccc1Cl 2230a_100000196027_200025704644 [1,1,0,0,0,0|2,0,0]=4 10176 B14R1.946 CCCCN([13CH3])Cc1ccccc1Cl 269982a_100000196027_200025704644 [1,1,0,0,0,0|2,0,0]=4 10177 B14R1.946 CCCCN([13CH3])Cc1ccccc1F 2230a_100000750065_200025704644 [1,1,0,0,0,0|2,0,0]=4 10178 B14R1.946 CCCCN([13CH3])Cc1ccccc1F 269982a_100000750065_200025704644 [1,1,0,0,0,0|2,0,0]=4 10179 B14R1.946 CCCCN([13CH3])Cc1ccccc1F 34a_100000750065_200025704644 [1,1,0,0,0,0|2,0,0]=4 10180 B14R1.946 CCCNC(=O)Cc1ccccc1Br 11a_100020643023_100000751119 [1,1,0,0,0,0|1,0,0]=3 10181 B14R1.946 CCCNC(=O)Cc1ccccc1Br 240690a_100020643023_100000751119 [1,1,0,0,0,0|1,0,0]=3 10182 B14R1.946 CCCNC(=O)Cc1ccccc1Br 527a_100020643023_100000751119 [1,1,0,0,0,0|1,0,0]=3 10183 B14R1.946 CCCNC(=O)Cc1ccccc1C 11a_100020643023_100000212180 [1,1,0,0,0,0|1,0,0]=3 10184 B14R1.946 CCCNC(=O)Cc1ccccc1C 1626a_100020643023_100000212180 [1,1,0,0,0,0|1,0,0]=3 10185 B14R1.946 CCCNC(=O)Cc1ccccc1C 240690a_100020643023_100000212180 [1,1,0,0,0,0|1,0,0]=3 10186 B14R1.946 CCCNC(=O)Cc1ccccc1C 527a_100020643023_100000212180 [1,1,0,0,0,0|1,0,0]=3 10187 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 11a_100020643023_100000183793 [1,1,0,0,0,0|1,0,0]=3 10188 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 1626a_100020643023_100000183793 [1,1,0,0,0,0|1,0,0]=3 10189 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 240690a_100020643023_100000183793 [1,1,0,0,0,0|1,0,0]=3 10190 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 527a_100020643023_100000183793 [1,1,0,0,0,0|1,0,0]=3 10191 B14R1.946 CCCNC(=O)Cc1ccccc1F 11a_100020643023_100000212012 [1,1,0,0,0,0|1,0,0]=3 10192 B14R1.946 CCCNC(=O)Cc1ccccc1F 1626a_100020643023_100000212012 [1,1,0,0,0,0|1,0,0]=3 10193 B14R1.946 CCCNC(=O)Cc1ccccc1F 240690a_100020643023_100000212012 [1,1,0,0,0,0|1,0,0]=3 10194 B14R1.946 CCCNC(=O)Cc1ccccc1F 527a_100020643023_100000212012 [1,1,0,0,0,0|1,0,0]=3 10195 B14R1.946 CCCNC(=O)Cc1ccccc1I 11a_100020643023_100000036491 [1,1,0,0,0,0|1,0,0]=3 10196 B14R1.946 CCCNC(=O)Cc1ccccc1I 1626a_100020643023_100000036491 [1,1,0,0,0,0|1,0,0]=3 10197 B14R1.946 CCCNC(=O)Cc1ccccc1I 240690a_100020643023_100000036491 [1,1,0,0,0,0|1,0,0]=3 10198 B14R1.946 CCCNC(=O)Cc1ccccc1I 527a_100020643023_100000036491 [1,1,0,0,0,0|1,0,0]=3 10199 B14R1.946 CCCNC(=O)Cc1ccccc1O 240690a_100020643023_100000743006 [1,1,0,0,0,0|1,0,0]=3 10200 B14R1.946 CCCNC(=O)Cc1ccccc1O 527a_100020643023_100000743006 [1,1,0,0,0,0|1,0,0]=3 10201 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 11a_100020643023_100000093521 [1,1,0,0,0,0|2,0,0]=4 10202 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 1626a_100020643023_100000093521 [1,1,0,0,0,0|2,0,0]=4 10203 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 240690a_100020643023_100000093521 [1,1,0,0,0,0|2,0,0]=4 10204 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 527a_100020643023_100000093521 [1,1,0,0,0,0|2,0,0]=4 10205 B14R1.946 CCCNC(=O)Cc1ncccc1Br 11a_100020643023_200012357574 [1,1,0,0,0,0|2,0,0]=4 10206 B14R1.946 CCCNC(=O)Cc1ncccc1Br 240690a_100020643023_200012357574 [1,1,0,0,0,0|2,0,0]=4 10207 B14R1.946 CCCNC(=O)Cc1ncccc1C 11a_100020643023_200000722269 [1,1,0,0,0,0|2,0,0]=4 10208 B14R1.946 CCCNC(=O)Cc1ncccc1C 1626a_100020643023_200000722269 [1,1,0,0,0,0|2,0,0]=4 10209 B14R1.946 CCCNC(=O)Cc1ncccc1C 240690a_100020643023_200000722269 [1,1,0,0,0,0|2,0,0]=4 10210 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 11a_100020643023_100011998755 [1,1,0,0,0,0|2,0,0]=4 10211 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 240690a_100020643023_100011998755 [1,1,0,0,0,0|2,0,0]=4 10212 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 527a_100020643023_100011998755 [1,1,0,0,0,0|2,0,0]=4 10213 B14R1.946 CCCNC(=O)Cn1ccccc1=O 1626a_100020643023_100000189665 [1,1,0,0,0,0|2,0,0]=4 10214 B14R1.946 CCCNC(=O)Cn1ccccc1=O 240690a_100020643023_100000189665 [1,1,0,0,0,0|2,0,0]=4 10215 B14R1.946 CCCNC(=O)Cn1ccccc1=O 527a_100020643023_100000189665 [1,1,0,0,0,0|2,0,0]=4 10216 B14R1.946 CCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100020643023 [1,1,0,0,0,0|2,0,0]=4 10217 B14R1.946 CCCNC(=O)Nc1ccccc1C 2430a_100015192222_100020643023 [1,1,0,0,0,0|2,0,0]=4 10218 B14R1.946 CCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020643023 [1,1,0,0,0,0|2,0,0]=4 10219 B14R1.946 CCCNC(=O)Nc1ccccc1F 2430a_100000210422_100020643023 [1,1,0,0,0,0|2,0,0]=4 10220 B14R1.946 CCCNC(=O)Nc1ccccc1I 2430a_100000210053_100020643023 [1,1,0,0,0,0|2,0,0]=4 10221 B14R1.946 CCCNC(=O)Nc1ccccc1O 2430a_100000185747_100020643023 [1,1,0,0,0,0|2,0,0]=4 10222 B14R1.946 CCNCC(=O)Cc1ccccc1Br 2230a_100015525214_100000700504 [1,1,0,0,0,0|1,0,0]=3 10223 B14R1.946 CCNCC(=O)Cc1ccccc1C 2230a_100015525214_100011223134 [1,1,0,0,0,0|1,0,0]=3 10224 B14R1.946 CCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210202 [1,1,0,0,0,0|2,0,0]=4 10225 B14R1.946 CCNCC(=O)Nc1ccccc1Br 2230a_100015525214_100000182372 [1,1,0,0,0,0|2,0,0]=4 10226 B14R1.946 CCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210202 [1,1,0,0,0,0|2,0,0]=4 10227 B14R1.946 CCNCC(=O)Nc1ccccc1C 2230a_100015525214_100000183529 [1,1,0,0,0,0|2,0,0]=4 10228 B14R1.946 CCNCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000182448 [1,1,0,0,0,0|2,0,0]=4 10229 B14R1.946 CCNCC(=O)Nc1ccccc1F 2230a_100015525214_100000182988 [1,1,0,0,0,0|2,0,0]=4 10230 B14R1.946 CCNCC(=O)Nc1ccccc1I 2230a_100015525214_100000180142 [1,1,0,0,0,0|2,0,0]=4 10231 B14R1.946 CCNNC(=O)Cc1ccccc1Br 22a_100000756455_100000751119 [1,1,0,0,0,0|2,0,0]=4 10232 B14R1.946 CCNNC(=O)Cc1ccccc1C 22a_100000756455_100000212180 [1,1,0,0,0,0|2,0,0]=4 10233 B14R1.946 CCNNC(=O)Cc1ccccc1Cl 22a_100000756455_100000183793 [1,1,0,0,0,0|2,0,0]=4 10234 B14R1.946 CCNNC(=O)Cc1ccccc1F 22a_100000756455_100000212012 [1,1,0,0,0,0|2,0,0]=4 10235 B14R1.946 CCNNC(=O)Cc1ccccc1I 22a_100000756455_100000036491 [1,1,0,0,0,0|2,0,0]=4 10236 B14R1.946 CCNNC(=O)Cc1ccccc1O 22a_100000756455_100000743006 [1,1,0,0,0,0|2,0,0]=4 10237 B14R1.946 CCOCC(=O)Cc1ccccc1Br 1458a_100000211967_100000184730 [1,1,0,0,0,0|1,0,0]=3 10238 B14R1.946 CCOCC(=O)Cc1ccccc1Br 34a_100121572206_100000700504 [1,1,0,0,0,0|1,0,0]=3 10239 B14R1.946 CCOCC(=O)Cc1ccccc1C 1458a_100000211967_100000211839 [1,1,0,0,0,0|1,0,0]=3 10240 B14R1.946 CCOCC(=O)Cc1ccccc1Cl 1458a_100000211967_100000187162 [1,1,0,0,0,0|1,0,0]=3 10241 B14R1.946 CCOCC(=O)Cc1ccccc1F 1458a_100000211967_100000187165 [1,1,0,0,0,0|1,0,0]=3 10242 B14R1.946 CCOCC(=O)Cc1ccccc1I 1458a_100000211967_100011216222 [1,1,0,0,0,0|1,0,0]=3 10243 B14R1.946 CCOCC(=O)Cc1cccnc1Br 1458a_100000211967_100010140945 [1,1,0,0,0,0|2,0,0]=4 10244 B14R1.946 CCOCC(=O)Cc1cccnc1C 1458a_100000211967_100000732876 [1,1,0,0,0,0|2,0,0]=4 10245 B14R1.946 CCOCC(=O)Cc1cccnc1Cl 1458a_100000211967_100000045678 [1,1,0,0,0,0|2,0,0]=4 10246 B14R1.946 CCOCC(=O)Cc1cccnc1F 1458a_100000211967_100000099810 [1,1,0,0,0,0|2,0,0]=4 10247 B14R1.946 CCOCC(=O)Cc1ccncc1C 1458a_100000211967_100020672808 [1,1,0,0,0,0|2,0,0]=4 10248 B14R1.946 CCOCC(=O)Cc1ccncc1Cl 1458a_100000211967_100000763264 [1,1,0,0,0,0|2,0,0]=4 10249 B14R1.946 CCOCC(=O)Cc1cnccc1C 1458a_100000211967_100000690890 [1,1,0,0,0,0|2,0,0]=4 10250 B14R1.946 CCOCC(=O)Cc1ncccc1Br 1458a_100000211967_100025702911 [1,1,0,0,0,0|2,0,0]=4 10251 B14R1.946 CCOCC(=O)Cc1ncccc1C 1458a_100000211967_100000696600 [1,1,0,0,0,0|2,0,0]=4 10252 B14R1.946 CCOCC(=O)Cc1ncccc1Cl 1458a_100000211967_100000099807 [1,1,0,0,0,0|2,0,0]=4 10253 B14R1.946 CCOCC(=O)Cc1ncccc1F 1458a_100000211967_100000104219 [1,1,0,0,0,0|2,0,0]=4 10254 B14R1.946 CCOCC(=O)Cc1ncccc1O 1458a_100000211967_200020655725 [1,1,0,0,0,0|2,0,0]=4 10255 B14R1.946 CCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000211967 [1,1,0,0,0,0|2,0,0]=4 10256 B14R1.946 CCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211967 [1,1,0,0,0,0|2,0,0]=4 10257 B14R1.946 CCOCC(=O)Nc1ccccc1C 11a_100015192222_100000211967 [1,1,0,0,0,0|2,0,0]=4 10258 B14R1.946 CCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000211967 [1,1,0,0,0,0|2,0,0]=4 10259 B14R1.946 CCOCC(=O)Nc1ccccc1C 22a_100015192222_100000211967 [1,1,0,0,0,0|2,0,0]=4 10260 B14R1.946 CCOCC(=O)Nc1ccccc1C 34a_100121572206_100000183529 [1,1,0,0,0,0|2,0,0]=4 10261 B14R1.946 CCOCC(=O)Nc1ccccc1C 527a_100015192222_100000211967 [1,1,0,0,0,0|2,0,0]=4 10262 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211967 [1,1,0,0,0,0|2,0,0]=4 10263 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211967 [1,1,0,0,0,0|2,0,0]=4 10264 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211967 [1,1,0,0,0,0|2,0,0]=4 10265 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 34a_100121572206_100000182448 [1,1,0,0,0,0|2,0,0]=4 10266 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211967 [1,1,0,0,0,0|2,0,0]=4 10267 B14R1.946 CCOCC(=O)Nc1ccccc1F 11a_100000210422_100000211967 [1,1,0,0,0,0|2,0,0]=4 10268 B14R1.946 CCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000211967 [1,1,0,0,0,0|2,0,0]=4 10269 B14R1.946 CCOCC(=O)Nc1ccccc1F 22a_100000210422_100000211967 [1,1,0,0,0,0|2,0,0]=4 10270 B14R1.946 CCOCC(=O)Nc1ccccc1F 34a_100121572206_100000243840 [1,1,0,0,0,0|2,0,0]=4 10271 B14R1.946 CCOCC(=O)Nc1ccccc1F 527a_100000210422_100000211967 [1,1,0,0,0,0|2,0,0]=4 10272 B14R1.946 CCOCC(=O)Nc1ccccc1I 11a_100000210053_100000211967 [1,1,0,0,0,0|2,0,0]=4 10273 B14R1.946 CCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000211967 [1,1,0,0,0,0|2,0,0]=4 10274 B14R1.946 CCOCC(=O)Nc1ccccc1I 34a_100121572206_100000180142 [1,1,0,0,0,0|2,0,0]=4 10275 B14R1.946 CCOCC(=O)Nc1ccccc1O 22a_100000185747_100000211967 [1,1,0,0,0,0|2,0,0]=4 10276 B14R1.946 CCOCC(=O)Nc1ccccc1O 527a_100000185747_100000211967 [1,1,0,0,0,0|2,0,0]=4 10277 B14R1.946 CCSCC(=O)Cc1ccccc1Br 1458a_100000230394_100000184730 [1,1,0,0,0,0|1,0,0]=3 10278 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000210202_100000700504 [1,1,0,0,0,0|1,0,0]=3 10279 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210202 [1,1,0,0,0,0|1,0,0]=3 10280 B14R1.946 CCSCC(=O)Cc1ccccc1C 1458a_100000230394_100000211839 [1,1,0,0,0,0|1,0,0]=3 10281 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100000210202_100011223134 [1,1,0,0,0,0|1,0,0]=3 10282 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210202 [1,1,0,0,0,0|1,0,0]=3 10283 B14R1.946 CCSCC(=O)Cc1ccccc1Cl 1458a_100000230394_100000187162 [1,1,0,0,0,0|1,0,0]=3 10284 B14R1.946 CCSCC(=O)Cc1ccccc1F 1458a_100000230394_100000187165 [1,1,0,0,0,0|1,0,0]=3 10285 B14R1.946 CCSCC(=O)Cc1ccccc1I 1458a_100000230394_100011216222 [1,1,0,0,0,0|1,0,0]=3 10286 B14R1.946 CCSCC(=O)Cc1cccnc1Br 1458a_100000230394_100010140945 [1,1,0,0,0,0|2,0,0]=4 10287 B14R1.946 CCSCC(=O)Cc1cccnc1C 1458a_100000230394_100000732876 [1,1,0,0,0,0|2,0,0]=4 10288 B14R1.946 CCSCC(=O)Cc1cccnc1Cl 1458a_100000230394_100000045678 [1,1,0,0,0,0|2,0,0]=4 10289 B14R1.946 CCSCC(=O)Cc1cccnc1F 1458a_100000230394_100000099810 [1,1,0,0,0,0|2,0,0]=4 10290 B14R1.946 CCSCC(=O)Cc1ccncc1C 1458a_100000230394_100020672808 [1,1,0,0,0,0|2,0,0]=4 10291 B14R1.946 CCSCC(=O)Cc1ccncc1Cl 1458a_100000230394_100000763264 [1,1,0,0,0,0|2,0,0]=4 10292 B14R1.946 CCSCC(=O)Cc1cnccc1C 1458a_100000230394_100000690890 [1,1,0,0,0,0|2,0,0]=4 10293 B14R1.946 CCSCC(=O)Cc1ncccc1Br 1458a_100000230394_100025702911 [1,1,0,0,0,0|2,0,0]=4 10294 B14R1.946 CCSCC(=O)Cc1ncccc1C 1458a_100000230394_100000696600 [1,1,0,0,0,0|2,0,0]=4 10295 B14R1.946 CCSCC(=O)Cc1ncccc1Cl 1458a_100000230394_100000099807 [1,1,0,0,0,0|2,0,0]=4 10296 B14R1.946 CCSCC(=O)Cc1ncccc1F 1458a_100000230394_100000104219 [1,1,0,0,0,0|2,0,0]=4 10297 B14R1.946 CCSCC(=O)Cc1ncccc1O 1458a_100000230394_200020655725 [1,1,0,0,0,0|2,0,0]=4 10298 B14R1.946 CCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000230394 [1,1,0,0,0,0|2,0,0]=4 10299 B14R1.946 CCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000230394 [1,1,0,0,0,0|2,0,0]=4 10300 B14R1.946 CCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210202 [1,1,0,0,0,0|2,0,0]=4 10301 B14R1.946 CCSCC(=O)Nc1ccccc1Br 62a_100000210202_100000182372 [1,1,0,0,0,0|2,0,0]=4 10302 B14R1.946 CCSCC(=O)Nc1ccccc1C 11a_100015192222_100000230394 [1,1,0,0,0,0|2,0,0]=4 10303 B14R1.946 CCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000230394 [1,1,0,0,0,0|2,0,0]=4 10304 B14R1.946 CCSCC(=O)Nc1ccccc1C 22a_100015192222_100000230394 [1,1,0,0,0,0|2,0,0]=4 10305 B14R1.946 CCSCC(=O)Nc1ccccc1C 527a_100015192222_100000230394 [1,1,0,0,0,0|2,0,0]=4 10306 B14R1.946 CCSCC(=O)Nc1ccccc1C 62a_100000210202_100000183529 [1,1,0,0,0,0|2,0,0]=4 10307 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230394 [1,1,0,0,0,0|2,0,0]=4 10308 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230394 [1,1,0,0,0,0|2,0,0]=4 10309 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230394 [1,1,0,0,0,0|2,0,0]=4 10310 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230394 [1,1,0,0,0,0|2,0,0]=4 10311 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_100000210202_100000182448 [1,1,0,0,0,0|2,0,0]=4 10312 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210202 [1,1,0,0,0,0|2,0,0]=4 10313 B14R1.946 CCSCC(=O)Nc1ccccc1F 11a_100000210422_100000230394 [1,1,0,0,0,0|2,0,0]=4 10314 B14R1.946 CCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000230394 [1,1,0,0,0,0|2,0,0]=4 10315 B14R1.946 CCSCC(=O)Nc1ccccc1F 22a_100000210422_100000230394 [1,1,0,0,0,0|2,0,0]=4 10316 B14R1.946 CCSCC(=O)Nc1ccccc1F 527a_100000210422_100000230394 [1,1,0,0,0,0|2,0,0]=4 10317 B14R1.946 CCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210202 [1,1,0,0,0,0|2,0,0]=4 10318 B14R1.946 CCSCC(=O)Nc1ccccc1F 62a_100000210202_100000182988 [1,1,0,0,0,0|2,0,0]=4 10319 B14R1.946 CCSCC(=O)Nc1ccccc1I 11a_100000210053_100000230394 [1,1,0,0,0,0|2,0,0]=4 10320 B14R1.946 CCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000230394 [1,1,0,0,0,0|2,0,0]=4 10321 B14R1.946 CCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210202 [1,1,0,0,0,0|2,0,0]=4 10322 B14R1.946 CCSCC(=O)Nc1ccccc1I 62a_100000210202_100000180142 [1,1,0,0,0,0|2,0,0]=4 10323 B14R1.946 CCSCC(=O)Nc1ccccc1O 22a_100000185747_100000230394 [1,1,0,0,0,0|2,0,0]=4 10324 B14R1.946 CCSCC(=O)Nc1ccccc1O 527a_100000185747_100000230394 [1,1,0,0,0,0|2,0,0]=4 10325 B14R1.946 CCSCC(=O)Nc1ccccc1O 62a_100000210202_100000014494 [1,1,0,0,0,0|2,0,0]=4 10326 B14R1.946 CNCCC(=O)Nc1ccccc1Br 2230a_106832991635_100000181489 [1,1,0,0,0,0|2,0,0]=4 10327 B14R1.946 CNCCC(=O)Nc1ccccc1Br 7a_106832991635_100000181489 [1,1,0,0,0,0|2,0,0]=4 10328 B14R1.946 CNCCC(=O)Nc1ccccc1C 2230a_106832991635_200011206476 [1,1,0,0,0,0|2,0,0]=4 10329 B14R1.946 CNCCC(=O)Nc1ccccc1C 2230a_200015185780_200000210301 [1,1,0,0,0,0|2,0,0]=4 10330 B14R1.946 CNCCC(=O)Nc1ccccc1C 34a_200015185780_200000210301 [1,1,0,0,0,0|2,0,0]=4 10331 B14R1.946 CNCCC(=O)Nc1ccccc1C 7a_106832991635_200011206476 [1,1,0,0,0,0|2,0,0]=4 10332 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 2230a_106832991635_100000242055 [1,1,0,0,0,0|2,0,0]=4 10333 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 7a_106832991635_100000242055 [1,1,0,0,0,0|2,0,0]=4 10334 B14R1.946 CNCCC(=O)Nc1ccccc1F 2230a_100015185137_200000210301 [1,1,0,0,0,0|2,0,0]=4 10335 B14R1.946 CNCCC(=O)Nc1ccccc1F 2230a_106832991635_100000242066 [1,1,0,0,0,0|2,0,0]=4 10336 B14R1.946 CNCCC(=O)Nc1ccccc1F 34a_100015185137_200000210301 [1,1,0,0,0,0|2,0,0]=4 10337 B14R1.946 CNCCC(=O)Nc1ccccc1F 7a_106832991635_100000242066 [1,1,0,0,0,0|2,0,0]=4 10338 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000749529_100000184730 [1,1,0,0,0,0|1,0,0]=3 10339 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000233755 [1,1,0,0,0,0|1,0,0]=3 10340 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000212180_100000233755 [1,1,0,0,0,0|1,0,0]=3 10341 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000749529_100000211839 [1,1,0,0,0,0|1,0,0]=3 10342 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000233755 [1,1,0,0,0,0|1,0,0]=3 10343 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000749529_100000187162 [1,1,0,0,0,0|1,0,0]=3 10344 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000212012_100000233755 [1,1,0,0,0,0|1,0,0]=3 10345 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000749529_100000187165 [1,1,0,0,0,0|1,0,0]=3 10346 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000036491_100000233755 [1,1,0,0,0,0|1,0,0]=3 10347 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000749529_100011216222 [1,1,0,0,0,0|1,0,0]=3 10348 B14R1.946 COCCC(=O)Cc1ccccc1O 1458a_100000743006_100000233755 [1,1,0,0,0,0|1,0,0]=3 10349 B14R1.946 COCCC(=O)Cc1cccnc1Br 1458a_100000749529_100010140945 [1,1,0,0,0,0|2,0,0]=4 10350 B14R1.946 COCCC(=O)Cc1cccnc1C 1458a_100000749529_100000732876 [1,1,0,0,0,0|2,0,0]=4 10351 B14R1.946 COCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000233755 [1,1,0,0,0,0|2,0,0]=4 10352 B14R1.946 COCCC(=O)Cc1cccnc1Cl 1458a_100000749529_100000045678 [1,1,0,0,0,0|2,0,0]=4 10353 B14R1.946 COCCC(=O)Cc1cccnc1F 1458a_100000749529_100000099810 [1,1,0,0,0,0|2,0,0]=4 10354 B14R1.946 COCCC(=O)Cc1ccncc1C 1458a_100000749529_100020672808 [1,1,0,0,0,0|2,0,0]=4 10355 B14R1.946 COCCC(=O)Cc1ccncc1Cl 1458a_100000749529_100000763264 [1,1,0,0,0,0|2,0,0]=4 10356 B14R1.946 COCCC(=O)Cc1cnccc1C 1458a_100000749529_100000690890 [1,1,0,0,0,0|2,0,0]=4 10357 B14R1.946 COCCC(=O)Cc1ncccc1Br 1458a_100000749529_100025702911 [1,1,0,0,0,0|2,0,0]=4 10358 B14R1.946 COCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000233755 [1,1,0,0,0,0|2,0,0]=4 10359 B14R1.946 COCCC(=O)Cc1ncccc1C 1458a_100000749529_100000696600 [1,1,0,0,0,0|2,0,0]=4 10360 B14R1.946 COCCC(=O)Cc1ncccc1C 1458a_200000722269_100000233755 [1,1,0,0,0,0|2,0,0]=4 10361 B14R1.946 COCCC(=O)Cc1ncccc1Cl 1458a_100000749529_100000099807 [1,1,0,0,0,0|2,0,0]=4 10362 B14R1.946 COCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000233755 [1,1,0,0,0,0|2,0,0]=4 10363 B14R1.946 COCCC(=O)Cc1ncccc1F 1458a_100000749529_100000104219 [1,1,0,0,0,0|2,0,0]=4 10364 B14R1.946 COCCC(=O)Cc1ncccc1O 1458a_100000749529_200020655725 [1,1,0,0,0,0|2,0,0]=4 10365 B14R1.946 COCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000233755 [1,1,0,0,0,0|2,0,0]=4 10366 B14R1.946 COCCC(=O)Nc1ccccc1Br 11a_100000210017_100000749529 [1,1,0,0,0,0|2,0,0]=4 10367 B14R1.946 COCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000749529 [1,1,0,0,0,0|2,0,0]=4 10368 B14R1.946 COCCC(=O)Nc1ccccc1C 11a_100015192222_100000749529 [1,1,0,0,0,0|2,0,0]=4 10369 B14R1.946 COCCC(=O)Nc1ccccc1C 1626a_100015192222_100000749529 [1,1,0,0,0,0|2,0,0]=4 10370 B14R1.946 COCCC(=O)Nc1ccccc1C 22a_100015192222_100000749529 [1,1,0,0,0,0|2,0,0]=4 10371 B14R1.946 COCCC(=O)Nc1ccccc1C 527a_100015192222_100000749529 [1,1,0,0,0,0|2,0,0]=4 10372 B14R1.946 COCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749529 [1,1,0,0,0,0|2,0,0]=4 10373 B14R1.946 COCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749529 [1,1,0,0,0,0|2,0,0]=4 10374 B14R1.946 COCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749529 [1,1,0,0,0,0|2,0,0]=4 10375 B14R1.946 COCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749529 [1,1,0,0,0,0|2,0,0]=4 10376 B14R1.946 COCCC(=O)Nc1ccccc1F 11a_100000210422_100000749529 [1,1,0,0,0,0|2,0,0]=4 10377 B14R1.946 COCCC(=O)Nc1ccccc1F 1626a_100000210422_100000749529 [1,1,0,0,0,0|2,0,0]=4 10378 B14R1.946 COCCC(=O)Nc1ccccc1F 22a_100000210422_100000749529 [1,1,0,0,0,0|2,0,0]=4 10379 B14R1.946 COCCC(=O)Nc1ccccc1F 527a_100000210422_100000749529 [1,1,0,0,0,0|2,0,0]=4 10380 B14R1.946 COCCC(=O)Nc1ccccc1I 11a_100000210053_100000749529 [1,1,0,0,0,0|2,0,0]=4 10381 B14R1.946 COCCC(=O)Nc1ccccc1I 1626a_100000210053_100000749529 [1,1,0,0,0,0|2,0,0]=4 10382 B14R1.946 COCCC(=O)Nc1ccccc1O 22a_100000185747_100000749529 [1,1,0,0,0,0|2,0,0]=4 10383 B14R1.946 COCCC(=O)Nc1ccccc1O 527a_100000185747_100000749529 [1,1,0,0,0,0|2,0,0]=4 10384 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000174002_100000184730 [1,1,0,0,0,0|1,0,0]=3 10385 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000751147 [1,1,0,0,0,0|1,0,0]=3 10386 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000174002_100000211839 [1,1,0,0,0,0|1,0,0]=3 10387 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000751147 [1,1,0,0,0,0|1,0,0]=3 10388 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000174002_100000187162 [1,1,0,0,0,0|1,0,0]=3 10389 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000751147 [1,1,0,0,0,0|1,0,0]=3 10390 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000174002_100000187165 [1,1,0,0,0,0|1,0,0]=3 10391 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000751147 [1,1,0,0,0,0|1,0,0]=3 10392 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000751147 [1,1,0,0,0,0|1,0,0]=3 10393 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000174002_100011216222 [1,1,0,0,0,0|1,0,0]=3 10394 B14R1.946 CSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000751147 [1,1,0,0,0,0|1,0,0]=3 10395 B14R1.946 CSCCC(=O)Cc1cccnc1Br 1458a_100000174002_100010140945 [1,1,0,0,0,0|2,0,0]=4 10396 B14R1.946 CSCCC(=O)Cc1cccnc1C 1458a_100000174002_100000732876 [1,1,0,0,0,0|2,0,0]=4 10397 B14R1.946 CSCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000751147 [1,1,0,0,0,0|2,0,0]=4 10398 B14R1.946 CSCCC(=O)Cc1cccnc1Cl 1458a_100000174002_100000045678 [1,1,0,0,0,0|2,0,0]=4 10399 B14R1.946 CSCCC(=O)Cc1cccnc1F 1458a_100000174002_100000099810 [1,1,0,0,0,0|2,0,0]=4 10400 B14R1.946 CSCCC(=O)Cc1ccncc1C 1458a_100000174002_100020672808 [1,1,0,0,0,0|2,0,0]=4 10401 B14R1.946 CSCCC(=O)Cc1ccncc1Cl 1458a_100000174002_100000763264 [1,1,0,0,0,0|2,0,0]=4 10402 B14R1.946 CSCCC(=O)Cc1cnccc1C 1458a_100000174002_100000690890 [1,1,0,0,0,0|2,0,0]=4 10403 B14R1.946 CSCCC(=O)Cc1ncccc1Br 1458a_100000174002_100025702911 [1,1,0,0,0,0|2,0,0]=4 10404 B14R1.946 CSCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000751147 [1,1,0,0,0,0|2,0,0]=4 10405 B14R1.946 CSCCC(=O)Cc1ncccc1C 1458a_100000174002_100000696600 [1,1,0,0,0,0|2,0,0]=4 10406 B14R1.946 CSCCC(=O)Cc1ncccc1C 1458a_200000722269_100000751147 [1,1,0,0,0,0|2,0,0]=4 10407 B14R1.946 CSCCC(=O)Cc1ncccc1Cl 1458a_100000174002_100000099807 [1,1,0,0,0,0|2,0,0]=4 10408 B14R1.946 CSCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000751147 [1,1,0,0,0,0|2,0,0]=4 10409 B14R1.946 CSCCC(=O)Cc1ncccc1F 1458a_100000174002_100000104219 [1,1,0,0,0,0|2,0,0]=4 10410 B14R1.946 CSCCC(=O)Cc1ncccc1O 1458a_100000174002_200020655725 [1,1,0,0,0,0|2,0,0]=4 10411 B14R1.946 CSCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000751147 [1,1,0,0,0,0|2,0,0]=4 10412 B14R1.946 CSCCC(=O)Nc1ccccc1Br 11a_100000210017_100000174002 [1,1,0,0,0,0|2,0,0]=4 10413 B14R1.946 CSCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000174002 [1,1,0,0,0,0|2,0,0]=4 10414 B14R1.946 CSCCC(=O)Nc1ccccc1Br 62a_100000181489_200000210301 [1,1,0,0,0,0|2,0,0]=4 10415 B14R1.946 CSCCC(=O)Nc1ccccc1Br 62a_200000210301_100000181489 [1,1,0,0,0,0|2,0,0]=4 10416 B14R1.946 CSCCC(=O)Nc1ccccc1C 11a_100015192222_100000174002 [1,1,0,0,0,0|2,0,0]=4 10417 B14R1.946 CSCCC(=O)Nc1ccccc1C 1626a_100015192222_100000174002 [1,1,0,0,0,0|2,0,0]=4 10418 B14R1.946 CSCCC(=O)Nc1ccccc1C 22a_100015192222_100000174002 [1,1,0,0,0,0|2,0,0]=4 10419 B14R1.946 CSCCC(=O)Nc1ccccc1C 527a_100015192222_100000174002 [1,1,0,0,0,0|2,0,0]=4 10420 B14R1.946 CSCCC(=O)Nc1ccccc1C 62a_200000210301_200011206476 [1,1,0,0,0,0|2,0,0]=4 10421 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000174002 [1,1,0,0,0,0|2,0,0]=4 10422 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000174002 [1,1,0,0,0,0|2,0,0]=4 10423 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000174002 [1,1,0,0,0,0|2,0,0]=4 10424 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000174002 [1,1,0,0,0,0|2,0,0]=4 10425 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 62a_200000210301_100000242055 [1,1,0,0,0,0|2,0,0]=4 10426 B14R1.946 CSCCC(=O)Nc1ccccc1F 11a_100000210422_100000174002 [1,1,0,0,0,0|2,0,0]=4 10427 B14R1.946 CSCCC(=O)Nc1ccccc1F 1626a_100000210422_100000174002 [1,1,0,0,0,0|2,0,0]=4 10428 B14R1.946 CSCCC(=O)Nc1ccccc1F 22a_100000210422_100000174002 [1,1,0,0,0,0|2,0,0]=4 10429 B14R1.946 CSCCC(=O)Nc1ccccc1F 527a_100000210422_100000174002 [1,1,0,0,0,0|2,0,0]=4 10430 B14R1.946 CSCCC(=O)Nc1ccccc1F 62a_100011216740_200000210301 [1,1,0,0,0,0|2,0,0]=4 10431 B14R1.946 CSCCC(=O)Nc1ccccc1F 62a_200000210301_100000242066 [1,1,0,0,0,0|2,0,0]=4 10432 B14R1.946 CSCCC(=O)Nc1ccccc1I 11a_100000210053_100000174002 [1,1,0,0,0,0|2,0,0]=4 10433 B14R1.946 CSCCC(=O)Nc1ccccc1I 1626a_100000210053_100000174002 [1,1,0,0,0,0|2,0,0]=4 10434 B14R1.946 CSCCC(=O)Nc1ccccc1O 22a_100000185747_100000174002 [1,1,0,0,0,0|2,0,0]=4 10435 B14R1.946 CSCCC(=O)Nc1ccccc1O 527a_100000185747_100000174002 [1,1,0,0,0,0|2,0,0]=4 10436 B14R1.946 Cc1ccccc1CC(=O)CCC#N 1458a_100000212180_100011215226 [1,1,0,0,0,0|1,0,1]=4 10437 B14R1.946 Cc1ccccc1CC(=O)CCC#N 1458a_100011934036_100000211839 [1,1,0,0,0,0|1,0,1]=4 10438 B14R1.946 Cc1ccccc1CC(=O)CCCF 1458a_100000212180_100011934791 [1,1,0,0,0,0|1,0,0]=3 10439 B14R1.946 Cc1ccccc1CC(=O)CCCO 1458a_100000212180_100011215043 [1,1,0,0,0,0|1,0,0]=3 10440 B14R1.946 Cc1ccccc1CC(=O)CSCF 62a_100011223134_100015361967 [1,1,0,0,0,0|2,0,0]=4 10441 B14R1.946 Cc1ccccc1CC(=O)CSCF 62a_100015361967_100011223134 [1,1,0,0,0,0|2,0,0]=4 10442 B14R1.946 Cc1ccccc1CC(=O)NCCF 11a_100000724931_100000212180 [1,1,0,0,0,0|2,0,0]=4 10443 B14R1.946 Cc1ccccc1CC(=O)NCCF 1626a_100000724931_100000212180 [1,1,0,0,0,0|2,0,0]=4 10444 B14R1.946 Cc1ccccc1CC(=O)NCCF 240690a_100000724931_100000212180 [1,1,0,0,0,0|2,0,0]=4 10445 B14R1.946 Cc1ccccc1CC(=O)NCCF 527a_100000724931_100000212180 [1,1,0,0,0,0|2,0,0]=4 10446 B14R1.946 Cc1ccccc1CC(=O)NCCO 240690a_100000210304_100000212180 [1,1,0,0,0,0|2,0,0]=4 10447 B14R1.946 Cc1ccccc1CC(=O)NCCO 527a_100000210304_100000212180 [1,1,0,0,0,0|2,0,0]=4 10448 B14R1.946 Cc1ccccc1NC(=O)CCN[13CH3] 2230a_200015185780_200025704644 [1,1,0,0,0,0|2,0,0]=4 10449 B14R1.946 Cc1ccccc1NC(=O)CCN[13CH3] 34a_200015185780_200025704644 [1,1,0,0,0,0|2,0,0]=4 10450 B14R1.946 Cc1ccccc1NC(=O)CCS[13CH3] 62a_200025704644_200011206476 [1,1,0,0,0,0|2,0,0]=4 10451 B14R1.946 Cc1cccnc1CC(=O)CCCF 1458a_200000722269_100011934791 [1,1,0,0,0,0|2,0,0]=4 10452 B14R1.946 Cc1cccnc1CC(=O)CCCO 1458a_200000722269_100011215043 [1,1,0,0,0,0|2,0,0]=4 10453 B14R1.946 N#CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215226 [1,1,0,0,0,0|1,0,1]=4 10454 B14R1.946 N#CCCC(=O)Cc1ccccc1Br 1458a_100011934036_100000184730 [1,1,0,0,0,0|1,0,1]=4 10455 B14R1.946 N#CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215226 [1,1,0,0,0,0|1,0,1]=4 10456 B14R1.946 N#CCCC(=O)Cc1ccccc1Cl 1458a_100011934036_100000187162 [1,1,0,0,0,0|1,0,1]=4 10457 B14R1.946 N#CCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215226 [1,1,0,0,0,0|1,0,1]=4 10458 B14R1.946 N#CCCC(=O)Cc1ccccc1F 1458a_100011934036_100000187165 [1,1,0,0,0,0|1,0,1]=4 10459 B14R1.946 N#CCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215226 [1,1,0,0,0,0|1,0,1]=4 10460 B14R1.946 N#CCCC(=O)Cc1ccccc1I 1458a_100011934036_100011216222 [1,1,0,0,0,0|1,0,1]=4 10461 B14R1.946 N#CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215226 [1,1,0,0,0,0|1,0,1]=4 10462 B14R1.946 O=C(CCCF)Cc1ccccc1Br 1458a_100000751119_100011934791 [1,1,0,0,0,0|1,0,0]=3 10463 B14R1.946 O=C(CCCF)Cc1ccccc1Cl 1458a_100000183793_100011934791 [1,1,0,0,0,0|1,0,0]=3 10464 B14R1.946 O=C(CCCF)Cc1ccccc1F 1458a_100000212012_100011934791 [1,1,0,0,0,0|1,0,0]=3 10465 B14R1.946 O=C(CCCF)Cc1ccccc1I 1458a_100000036491_100011934791 [1,1,0,0,0,0|1,0,0]=3 10466 B14R1.946 O=C(CCCF)Cc1ccccc1O 1458a_100000743006_100011934791 [1,1,0,0,0,0|1,0,0]=3 10467 B14R1.946 O=C(CCCF)Cc1cccnc1Cl 1458a_100000093521_100011934791 [1,1,0,0,0,0|2,0,0]=4 10468 B14R1.946 O=C(CCCF)Cc1ncccc1Br 1458a_200012357574_100011934791 [1,1,0,0,0,0|2,0,0]=4 10469 B14R1.946 O=C(CCCF)Cc1ncccc1Cl 1458a_100011998755_100011934791 [1,1,0,0,0,0|2,0,0]=4 10470 B14R1.946 O=C(CCCF)Cn1ccccc1=O 1458a_100000189665_100011934791 [1,1,0,0,0,0|2,0,0]=4 10471 B14R1.946 O=C(CCCO)Cc1ccccc1Br 1458a_100000751119_100011215043 [1,1,0,0,0,0|1,0,0]=3 10472 B14R1.946 O=C(CCCO)Cc1ccccc1Cl 1458a_100000183793_100011215043 [1,1,0,0,0,0|1,0,0]=3 10473 B14R1.946 O=C(CCCO)Cc1ccccc1F 1458a_100000212012_100011215043 [1,1,0,0,0,0|1,0,0]=3 10474 B14R1.946 O=C(CCCO)Cc1ccccc1I 1458a_100000036491_100011215043 [1,1,0,0,0,0|1,0,0]=3 10475 B14R1.946 O=C(CCCO)Cc1ccccc1O 1458a_100000743006_100011215043 [1,1,0,0,0,0|1,0,0]=3 10476 B14R1.946 O=C(CCCO)Cc1cccnc1Cl 1458a_100000093521_100011215043 [1,1,0,0,0,0|2,0,0]=4 10477 B14R1.946 O=C(CCCO)Cc1ncccc1Br 1458a_200012357574_100011215043 [1,1,0,0,0,0|2,0,0]=4 10478 B14R1.946 O=C(CCCO)Cc1ncccc1Cl 1458a_100011998755_100011215043 [1,1,0,0,0,0|2,0,0]=4 10479 B14R1.946 O=C(CCCO)Cn1ccccc1=O 1458a_100000189665_100011215043 [1,1,0,0,0,0|2,0,0]=4 10480 B14R1.946 O=C(CSCF)Cc1ccccc1Br 62a_100000700504_100015361967 [1,1,0,0,0,0|2,0,0]=4 10481 B14R1.946 O=C(CSCF)Cc1ccccc1Br 62a_100015361967_100000700504 [1,1,0,0,0,0|2,0,0]=4 10482 B14R1.946 O=C(Cc1ccccc1Br)NCCF 11a_100000724931_100000751119 [1,1,0,0,0,0|2,0,0]=4 10483 B14R1.946 O=C(Cc1ccccc1Br)NCCF 240690a_100000724931_100000751119 [1,1,0,0,0,0|2,0,0]=4 10484 B14R1.946 O=C(Cc1ccccc1Br)NCCF 527a_100000724931_100000751119 [1,1,0,0,0,0|2,0,0]=4 10485 B14R1.946 O=C(Cc1ccccc1Br)NCCO 240690a_100000210304_100000751119 [1,1,0,0,0,0|2,0,0]=4 10486 B14R1.946 O=C(Cc1ccccc1Br)NCCO 527a_100000210304_100000751119 [1,1,0,0,0,0|2,0,0]=4 10487 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 11a_100000724931_100000183793 [1,1,0,0,0,0|2,0,0]=4 10488 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 1626a_100000724931_100000183793 [1,1,0,0,0,0|2,0,0]=4 10489 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 240690a_100000724931_100000183793 [1,1,0,0,0,0|2,0,0]=4 10490 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 527a_100000724931_100000183793 [1,1,0,0,0,0|2,0,0]=4 10491 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 240690a_100000210304_100000183793 [1,1,0,0,0,0|2,0,0]=4 10492 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 527a_100000210304_100000183793 [1,1,0,0,0,0|2,0,0]=4 10493 B14R1.946 O=C(Cc1ccccc1F)NCCF 11a_100000724931_100000212012 [1,1,0,0,0,0|2,0,0]=4 10494 B14R1.946 O=C(Cc1ccccc1F)NCCF 1626a_100000724931_100000212012 [1,1,0,0,0,0|2,0,0]=4 10495 B14R1.946 O=C(Cc1ccccc1F)NCCF 240690a_100000724931_100000212012 [1,1,0,0,0,0|2,0,0]=4 10496 B14R1.946 O=C(Cc1ccccc1F)NCCF 527a_100000724931_100000212012 [1,1,0,0,0,0|2,0,0]=4 10497 B14R1.946 O=C(Cc1ccccc1F)NCCO 240690a_100000210304_100000212012 [1,1,0,0,0,0|2,0,0]=4 10498 B14R1.946 O=C(Cc1ccccc1F)NCCO 527a_100000210304_100000212012 [1,1,0,0,0,0|2,0,0]=4 10499 B14R1.946 O=C(Cc1ccccc1I)NCCF 11a_100000724931_100000036491 [1,1,0,0,0,0|2,0,0]=4 10500 B14R1.946 O=C(Cc1ccccc1I)NCCF 1626a_100000724931_100000036491 [1,1,0,0,0,0|2,0,0]=4 10501 B14R1.946 O=C(Cc1ccccc1I)NCCF 240690a_100000724931_100000036491 [1,1,0,0,0,0|2,0,0]=4 10502 B14R1.946 O=C(Cc1ccccc1I)NCCF 527a_100000724931_100000036491 [1,1,0,0,0,0|2,0,0]=4 10503 B14R1.946 O=C(Cc1ccccc1I)NCCO 240690a_100000210304_100000036491 [1,1,0,0,0,0|2,0,0]=4 10504 B14R1.946 O=C(Cc1ccccc1I)NCCO 527a_100000210304_100000036491 [1,1,0,0,0,0|2,0,0]=4 10505 B14R1.946 O=C(Cc1ccccc1O)NCCF 240690a_100000724931_100000743006 [1,1,0,0,0,0|2,0,0]=4 10506 B14R1.946 O=C(Cc1ccccc1O)NCCF 527a_100000724931_100000743006 [1,1,0,0,0,0|2,0,0]=4 10507 B14R1.946 O=C(Cc1ccccc1O)NCCO 240690a_100000210304_100000743006 [1,1,0,0,0,0|2,0,0]=4 10508 B14R1.946 O=C(Cc1ccccc1O)NCCO 527a_100000210304_100000743006 [1,1,0,0,0,0|2,0,0]=4 10509 B14R1.946 [13CH3]NCCC(=O)Nc1ccccc1F 2230a_100015185137_200025704644 [1,1,0,0,0,0|2,0,0]=4 10510 B14R1.946 [13CH3]NCCC(=O)Nc1ccccc1F 34a_100015185137_200025704644 [1,1,0,0,0,0|2,0,0]=4 10511 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Br 62a_100000181489_200025704644 [1,1,0,0,0,0|2,0,0]=4 10512 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Br 62a_200025704644_100000181489 [1,1,0,0,0,0|2,0,0]=4 10513 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Cl 62a_200025704644_100000242055 [1,1,0,0,0,0|2,0,0]=4 10514 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1F 62a_100011216740_200025704644 [1,1,0,0,0,0|2,0,0]=4 10515 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1F 62a_200025704644_100000242066 [1,1,0,0,0,0|2,0,0]=4 10516 B14R1.4528 CCCCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000212082 [1,1,0,0,0,0|2,0,0]=4 10517 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 270084a_100020643023_100000211737 [1,1,0,0,0,0|2,0,0]=4 10518 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 274078a_100020643023_100000211737 [1,1,0,0,0,0|2,0,0]=4 10519 B14R1.4528 CCCNS(=O)(=O)Cc1ccccc1 40a_100020643023_100000235865 [1,1,0,0,0,0|2,0,0]=4 10520 B14R1.4528 CCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000210303 [1,1,0,0,0,0|1,0,1]=4 10521 B14R1.19 CCCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210326 [0,1,0,0,1,0|1,0,0]=3 10522 B14R1.19 CCCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210326 [0,1,0,0,1,0|1,0,0]=3 10523 B14R1.19 CCCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210326 [0,1,0,0,1,0|1,0,0]=3 10524 B14R1.19 CCCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210326 [0,1,0,0,1,0|1,0,0]=3 10525 B14R1.19 CCCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210326 [0,1,0,0,1,0|1,0,0]=3 10526 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210326 [0,1,0,0,1,0|1,0,0]=3 10527 B14R1.19 CCCCCC(=O)c1ccc(cc1)O 271570a_203496583355_200011267725 [0,1,0,0,1,0|1,0,0]=3 10528 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 11a_100000102301_100000185839 [0,1,0,0,1,0|1,0,0]=3 10529 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 1626a_100000102301_100000185839 [0,1,0,0,1,0|1,0,0]=3 10530 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 240690a_100000102301_100000185839 [0,1,0,0,1,0|1,0,0]=3 10531 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br 527a_100000102301_100000185839 [0,1,0,0,1,0|1,0,0]=3 10532 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 11a_100000102301_100000188618 [0,1,0,0,1,0|1,0,0]=3 10533 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 1626a_100000102301_100000188618 [0,1,0,0,1,0|1,0,0]=3 10534 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 240690a_100000102301_100000188618 [0,1,0,0,1,0|1,0,0]=3 10535 B14R1.19 CCCCNC(=O)c1ccc(cc1)C 527a_100000102301_100000188618 [0,1,0,0,1,0|1,0,0]=3 10536 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 11a_100000102301_100000210187 [0,1,0,0,1,0|1,0,0]=3 10537 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 1626a_100000102301_100000210187 [0,1,0,0,1,0|1,0,0]=3 10538 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 240690a_100000102301_100000210187 [0,1,0,0,1,0|1,0,0]=3 10539 B14R1.19 CCCCNC(=O)c1ccc(cc1)Cl 527a_100000102301_100000210187 [0,1,0,0,1,0|1,0,0]=3 10540 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 11a_100000102301_100000187176 [0,1,0,0,1,0|1,0,0]=3 10541 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 1626a_100000102301_100000187176 [0,1,0,0,1,0|1,0,0]=3 10542 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 240690a_100000102301_100000187176 [0,1,0,0,1,0|1,0,0]=3 10543 B14R1.19 CCCCNC(=O)c1ccc(cc1)F 527a_100000102301_100000187176 [0,1,0,0,1,0|1,0,0]=3 10544 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 11a_100000102301_100000187904 [0,1,0,0,1,0|1,0,0]=3 10545 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 1626a_100000102301_100000187904 [0,1,0,0,1,0|1,0,0]=3 10546 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 240690a_100000102301_100000187904 [0,1,0,0,1,0|1,0,0]=3 10547 B14R1.19 CCCCNC(=O)c1ccc(cc1)I 527a_100000102301_100000187904 [0,1,0,0,1,0|1,0,0]=3 10548 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 240690a_100000102301_100000212099 [0,1,0,0,1,0|1,0,0]=3 10549 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000154866 [0,1,0,0,1,0|1,0,0]=3 10550 B14R1.19 CCCCNC(=O)c1ccc(cc1)O 527a_100000102301_100000212099 [0,1,0,0,1,0|1,0,0]=3 10551 B14R1.19 CCCCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781281 [0,1,0,0,1,0|2,0,0]=4 10552 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 34a_100000210227_100000755118 [0,1,0,0,1,0|1,0,1]=4 10553 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210210 [0,1,0,0,1,0|1,0,1]=4 10554 B14R1.19 CCCCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210211 [0,1,0,0,1,0|1,0,1]=4 10555 B14R1.19 CCCCOC(C)c1ccc(cc1)C 34a_100000210227_100011261388 [0,1,0,0,1,0|1,0,1]=4 10556 B14R1.19 CCCCOC(C)c1ccc(cc1)C 7a_100000210227_100011261388 [0,1,0,0,1,0|1,0,1]=4 10557 B14R1.19 CCCCOC(C)c1ccc(cc1)Cl 7a_100000210227_100000684792 [0,1,0,0,1,0|1,0,1]=4 10558 B14R1.19 CCCCOC(C)c1ccc(cc1)F 34a_100000181323_100000210210 [0,1,0,0,1,0|1,0,1]=4 10559 B14R1.19 CCCCOC(C)c1ccc(cc1)F 34a_100000210227_100000743420 [0,1,0,0,1,0|1,0,1]=4 10560 B14R1.19 CCCCOC(C)c1ccc(cc1)F 7a_100000181323_100000210211 [0,1,0,0,1,0|1,0,1]=4 10561 B14R1.19 CCCCOC(C)c1ccc(cc1)F 7a_100000210227_100000743420 [0,1,0,0,1,0|1,0,1]=4 10562 B14R1.19 CCCCOC(C)c1ccc(cc1)N 34a_100011216399_100000210210 [0,1,0,0,1,0|1,0,1]=4 10563 B14R1.19 CCCCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210210 [0,1,0,0,1,0|1,0,1]=4 10564 B14R1.19 CCCCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210211 [0,1,0,0,1,0|1,0,1]=4 10565 B14R1.19 CCCCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210210 [0,1,0,0,1,0|1,0,1]=4 10566 B14R1.19 CCCCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210211 [0,1,0,0,1,0|1,0,1]=4 10567 B14R1.19 CCCNNC(=O)c1ccc(cc1)Br 22a_100000740057_100000185839 [0,1,0,0,1,0|2,0,0]=4 10568 B14R1.19 CCCNNC(=O)c1ccc(cc1)C 22a_100000740057_100000188618 [0,1,0,0,1,0|2,0,0]=4 10569 B14R1.19 CCCNNC(=O)c1ccc(cc1)Cl 22a_100000740057_100000210187 [0,1,0,0,1,0|2,0,0]=4 10570 B14R1.19 CCCNNC(=O)c1ccc(cc1)F 22a_100000740057_100000187176 [0,1,0,0,1,0|2,0,0]=4 10571 B14R1.19 CCCNNC(=O)c1ccc(cc1)I 22a_100000740057_100000187904 [0,1,0,0,1,0|2,0,0]=4 10572 B14R1.19 CCCNNC(=O)c1ccc(cc1)O 22a_100000740057_100000212099 [0,1,0,0,1,0|2,0,0]=4 10573 B14R1.19 CCCOCC(=O)c1ccc(cc1)Br 34a_100000210258_100000188085 [0,1,0,0,1,0|2,0,0]=4 10574 B14R1.19 CCCOCC(=O)c1ccc(cc1)C 34a_100000210258_100000211441 [0,1,0,0,1,0|2,0,0]=4 10575 B14R1.19 CCCOCC(=O)c1ccc(cc1)F 34a_100000246311_100000210303 [0,1,0,0,1,0|2,0,0]=4 10576 B14R1.19 CCCOCC(=O)c1ccc(cc1)I 34a_100000210258_100011216261 [0,1,0,0,1,0|2,0,0]=4 10577 B14R1.19 CCCOCC(=O)c1ccc(cc1)O 34a_100000210258_100009814261 [0,1,0,0,1,0|2,0,0]=4 10578 B14R1.19 CCCSCC(=O)c1ccc(cc1)Br 62a_100000188085_100000210303 [0,1,0,0,1,0|2,0,0]=4 10579 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000210303_100000211441 [0,1,0,0,1,0|2,0,0]=4 10580 B14R1.19 CCCSCC(=O)c1ccc(cc1)C 62a_100000211441_100000210303 [0,1,0,0,1,0|2,0,0]=4 10581 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000210303_100000211071 [0,1,0,0,1,0|2,0,0]=4 10582 B14R1.19 CCCSCC(=O)c1ccc(cc1)Cl 62a_100000211071_100000210303 [0,1,0,0,1,0|2,0,0]=4 10583 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000210303_100000211279 [0,1,0,0,1,0|2,0,0]=4 10584 B14R1.19 CCCSCC(=O)c1ccc(cc1)F 62a_100000211279_100000210303 [0,1,0,0,1,0|2,0,0]=4 10585 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100000210303_100011216261 [0,1,0,0,1,0|2,0,0]=4 10586 B14R1.19 CCCSCC(=O)c1ccc(cc1)I 62a_100011216261_100000210303 [0,1,0,0,1,0|2,0,0]=4 10587 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100000210303_100009814261 [0,1,0,0,1,0|2,0,0]=4 10588 B14R1.19 CCCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210303 [0,1,0,0,1,0|2,0,0]=4 10589 B14R1.19 CCNCCC(=O)c1ccc(cc1)C 2230a_100015525214_100000701375 [0,1,0,0,1,0|2,0,0]=4 10590 B14R1.19 CCNCCC(=O)c1ccc(cc1)F 2230a_100015525214_100000211231 [0,1,0,0,1,0|2,0,0]=4 10591 B14R1.19 CCNCCC(=O)c1ccc(cc1)O 2230a_100015525214_100009879949 [0,1,0,0,1,0|2,0,0]=4 10592 B14R1.19 CCOCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215890 [0,1,0,0,1,0|2,0,0]=4 10593 B14R1.19 CCOCCC(=O)c1ccc(cc1)C 1458a_100000188618_100011215890 [0,1,0,0,1,0|2,0,0]=4 10594 B14R1.19 CCOCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215890 [0,1,0,0,1,0|2,0,0]=4 10595 B14R1.19 CCOCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215890 [0,1,0,0,1,0|2,0,0]=4 10596 B14R1.19 CCOCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215890 [0,1,0,0,1,0|2,0,0]=4 10597 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215890 [0,1,0,0,1,0|2,0,0]=4 10598 B14R1.19 CCOCCC(=O)c1ccc(cc1)O 271570a_203496583355_100018808408 [0,1,0,0,1,0|2,0,0]=4 10599 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000757381 [0,1,0,0,1,0|2,0,0]=4 10600 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100000210202_100011215963 [0,1,0,0,1,0|2,0,0]=4 10601 B14R1.19 CCSCCC(=O)c1ccc(cc1)Br 62a_100011215963_100000210202 [0,1,0,0,1,0|2,0,0]=4 10602 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000757381 [0,1,0,0,1,0|2,0,0]=4 10603 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000210202_100000701375 [0,1,0,0,1,0|2,0,0]=4 10604 B14R1.19 CCSCCC(=O)c1ccc(cc1)C 62a_100000701375_100000210202 [0,1,0,0,1,0|2,0,0]=4 10605 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000757381 [0,1,0,0,1,0|2,0,0]=4 10606 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100000210202_100011216492 [0,1,0,0,1,0|2,0,0]=4 10607 B14R1.19 CCSCCC(=O)c1ccc(cc1)Cl 62a_100011216492_100000210202 [0,1,0,0,1,0|2,0,0]=4 10608 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000757381 [0,1,0,0,1,0|2,0,0]=4 10609 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000210202_100000211231 [0,1,0,0,1,0|2,0,0]=4 10610 B14R1.19 CCSCCC(=O)c1ccc(cc1)F 62a_100000211231_100000210202 [0,1,0,0,1,0|2,0,0]=4 10611 B14R1.19 CCSCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000757381 [0,1,0,0,1,0|2,0,0]=4 10612 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000757381 [0,1,0,0,1,0|2,0,0]=4 10613 B14R1.19 CCSCCC(=O)c1ccc(cc1)O 62a_100000210202_100009879949 [0,1,0,0,1,0|2,0,0]=4 10614 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 2230a_106832991635_100000211046 [0,1,0,0,1,0|2,0,0]=4 10615 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 34a_100102657272_100000211046 [0,1,0,0,1,0|2,0,0]=4 10616 B14R1.19 CNCCCC(=O)c1ccc(cc1)Br 7a_106832991635_100000211046 [0,1,0,0,1,0|2,0,0]=4 10617 B14R1.19 CNCCCC(=O)c1ccc(cc1)Cl 7a_106832991635_200011217871 [0,1,0,0,1,0|2,0,0]=4 10618 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 2230a_106832991635_100000211961 [0,1,0,0,1,0|2,0,0]=4 10619 B14R1.19 CNCCCC(=O)c1ccc(cc1)F 7a_106832991635_100000211961 [0,1,0,0,1,0|2,0,0]=4 10620 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 2230a_106832991635_100000039620 [0,1,0,0,1,0|2,0,0]=4 10621 B14R1.19 CNCCCC(=O)c1ccc(cc1)O 7a_106832991635_100000039620 [0,1,0,0,1,0|2,0,0]=4 10622 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200000210301 [0,1,0,0,1,0|2,0,0]=4 10623 B14R1.19 CNCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200000210301 [0,1,0,0,1,0|2,0,0]=4 10624 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200000210301 [0,1,0,0,1,0|2,0,0]=4 10625 B14R1.19 CNCCNC(=O)c1ccc(cc1)F 34a_100000753910_200000210301 [0,1,0,0,1,0|2,0,0]=4 10626 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000740836 [0,1,0,0,1,0|2,0,0]=4 10627 B14R1.19 COCCCC(=O)c1ccc(cc1)Br 34a_100138415774_100000211046 [0,1,0,0,1,0|2,0,0]=4 10628 B14R1.19 COCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000740836 [0,1,0,0,1,0|2,0,0]=4 10629 B14R1.19 COCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000740836 [0,1,0,0,1,0|2,0,0]=4 10630 B14R1.19 COCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000740836 [0,1,0,0,1,0|2,0,0]=4 10631 B14R1.19 COCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000740836 [0,1,0,0,1,0|2,0,0]=4 10632 B14R1.19 COCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000740836 [0,1,0,0,1,0|2,0,0]=4 10633 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 1626a_100000209980_100000185839 [0,1,0,0,1,0|2,0,0]=4 10634 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 240690a_100000209980_100000185839 [0,1,0,0,1,0|2,0,0]=4 10635 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200000210301 [0,1,0,0,1,0|2,0,0]=4 10636 B14R1.19 COCCNC(=O)c1ccc(cc1)Br 527a_100000209980_100000185839 [0,1,0,0,1,0|2,0,0]=4 10637 B14R1.19 COCCNC(=O)c1ccc(cc1)C 1626a_100000209980_100000188618 [0,1,0,0,1,0|2,0,0]=4 10638 B14R1.19 COCCNC(=O)c1ccc(cc1)C 240690a_100000209980_100000188618 [0,1,0,0,1,0|2,0,0]=4 10639 B14R1.19 COCCNC(=O)c1ccc(cc1)C 34a_200000158910_200000210301 [0,1,0,0,1,0|2,0,0]=4 10640 B14R1.19 COCCNC(=O)c1ccc(cc1)C 527a_100000209980_100000188618 [0,1,0,0,1,0|2,0,0]=4 10641 B14R1.19 COCCNC(=O)c1ccc(cc1)C 7a_200000158910_200000210301 [0,1,0,0,1,0|2,0,0]=4 10642 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 1626a_100000209980_100000210187 [0,1,0,0,1,0|2,0,0]=4 10643 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 240690a_100000209980_100000210187 [0,1,0,0,1,0|2,0,0]=4 10644 B14R1.19 COCCNC(=O)c1ccc(cc1)Cl 527a_100000209980_100000210187 [0,1,0,0,1,0|2,0,0]=4 10645 B14R1.19 COCCNC(=O)c1ccc(cc1)F 1626a_100000209980_100000187176 [0,1,0,0,1,0|2,0,0]=4 10646 B14R1.19 COCCNC(=O)c1ccc(cc1)F 240690a_100000209980_100000187176 [0,1,0,0,1,0|2,0,0]=4 10647 B14R1.19 COCCNC(=O)c1ccc(cc1)F 527a_100000209980_100000187176 [0,1,0,0,1,0|2,0,0]=4 10648 B14R1.19 COCCNC(=O)c1ccc(cc1)I 1626a_100000209980_100000187904 [0,1,0,0,1,0|2,0,0]=4 10649 B14R1.19 COCCNC(=O)c1ccc(cc1)I 240690a_100000209980_100000187904 [0,1,0,0,1,0|2,0,0]=4 10650 B14R1.19 COCCNC(=O)c1ccc(cc1)I 527a_100000209980_100000187904 [0,1,0,0,1,0|2,0,0]=4 10651 B14R1.19 COCCNC(=O)c1ccc(cc1)N 34a_100000740983_200000210301 [0,1,0,0,1,0|2,0,0]=4 10652 B14R1.19 COCCNC(=O)c1ccc(cc1)O 240690a_100000209980_100000212099 [0,1,0,0,1,0|2,0,0]=4 10653 B14R1.19 COCCNC(=O)c1ccc(cc1)O 527a_100000209980_100000212099 [0,1,0,0,1,0|2,0,0]=4 10654 B14R1.19 COCCOC(=O)c1ccc(cc1)C 7a_200000031072_200000210301 [0,1,0,0,1,0|1,0,0]=3 10655 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200000210301 [0,1,0,0,1,0|2,0,0]=4 10656 B14R1.19 CSCCCC(=O)c1ccc(cc1)Br 62a_200000210301_100000211046 [0,1,0,0,1,0|2,0,0]=4 10657 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200000210301_200011217871 [0,1,0,0,1,0|2,0,0]=4 10658 B14R1.19 CSCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200000210301 [0,1,0,0,1,0|2,0,0]=4 10659 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_100000211961_200000210301 [0,1,0,0,1,0|2,0,0]=4 10660 B14R1.19 CSCCCC(=O)c1ccc(cc1)F 62a_200000210301_100000211961 [0,1,0,0,1,0|2,0,0]=4 10661 B14R1.19 CSCCCC(=O)c1ccc(cc1)O 62a_200000210301_100000039620 [0,1,0,0,1,0|2,0,0]=4 10662 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 11a_100020590264_100000185839 [0,1,0,0,1,0|2,0,0]=4 10663 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 1626a_100020590264_100000185839 [0,1,0,0,1,0|2,0,0]=4 10664 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 240690a_100020590264_100000185839 [0,1,0,0,1,0|2,0,0]=4 10665 B14R1.19 CSCCNC(=O)c1ccc(cc1)Br 527a_100020590264_100000185839 [0,1,0,0,1,0|2,0,0]=4 10666 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 11a_100020590264_100000188618 [0,1,0,0,1,0|2,0,0]=4 10667 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 1626a_100020590264_100000188618 [0,1,0,0,1,0|2,0,0]=4 10668 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 240690a_100020590264_100000188618 [0,1,0,0,1,0|2,0,0]=4 10669 B14R1.19 CSCCNC(=O)c1ccc(cc1)C 527a_100020590264_100000188618 [0,1,0,0,1,0|2,0,0]=4 10670 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 11a_100020590264_100000210187 [0,1,0,0,1,0|2,0,0]=4 10671 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 1626a_100020590264_100000210187 [0,1,0,0,1,0|2,0,0]=4 10672 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 240690a_100020590264_100000210187 [0,1,0,0,1,0|2,0,0]=4 10673 B14R1.19 CSCCNC(=O)c1ccc(cc1)Cl 527a_100020590264_100000210187 [0,1,0,0,1,0|2,0,0]=4 10674 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 11a_100020590264_100000187176 [0,1,0,0,1,0|2,0,0]=4 10675 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 1626a_100020590264_100000187176 [0,1,0,0,1,0|2,0,0]=4 10676 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 240690a_100020590264_100000187176 [0,1,0,0,1,0|2,0,0]=4 10677 B14R1.19 CSCCNC(=O)c1ccc(cc1)F 527a_100020590264_100000187176 [0,1,0,0,1,0|2,0,0]=4 10678 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 11a_100020590264_100000187904 [0,1,0,0,1,0|2,0,0]=4 10679 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 1626a_100020590264_100000187904 [0,1,0,0,1,0|2,0,0]=4 10680 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 240690a_100020590264_100000187904 [0,1,0,0,1,0|2,0,0]=4 10681 B14R1.19 CSCCNC(=O)c1ccc(cc1)I 527a_100020590264_100000187904 [0,1,0,0,1,0|2,0,0]=4 10682 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 240690a_100020590264_100000212099 [0,1,0,0,1,0|2,0,0]=4 10683 B14R1.19 CSCCNC(=O)c1ccc(cc1)O 527a_100020590264_100000212099 [0,1,0,0,1,0|2,0,0]=4 10684 B14R1.19 Cc1ccc(cc1)C(=O)CCCCF 1458a_100000188618_100000729493 [0,1,0,0,1,0|2,0,0]=4 10685 B14R1.19 Cc1ccc(cc1)C(=O)CCCCO 1458a_100000188618_100000210776 [0,1,0,0,1,0|2,0,0]=4 10686 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 11a_100015189416_100000188618 [0,1,0,0,1,0|2,0,0]=4 10687 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 1626a_100015189416_100000188618 [0,1,0,0,1,0|2,0,0]=4 10688 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 240690a_100015189416_100000188618 [0,1,0,0,1,0|2,0,0]=4 10689 B14R1.19 Cc1ccc(cc1)C(=O)NCCCF 527a_100015189416_100000188618 [0,1,0,0,1,0|2,0,0]=4 10690 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 240690a_100000182051_100000188618 [0,1,0,0,1,0|2,0,0]=4 10691 B14R1.19 Cc1ccc(cc1)C(=O)NCCCO 527a_100000182051_100000188618 [0,1,0,0,1,0|2,0,0]=4 10692 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 34a_200000158910_200025704644 [0,1,0,0,1,0|2,0,0]=4 10693 B14R1.19 Cc1ccc(cc1)C(=O)NCCO[13CH3] 7a_200000158910_200025704644 [0,1,0,0,1,0|2,0,0]=4 10694 B14R1.19 Cc1ccc(cc1)C(=O)OCCO[13CH3] 7a_200000031072_200025704644 [0,1,0,0,1,0|1,0,0]=3 10695 B14R1.19 O=C(CCCCF)c1ccc(cc1)Br 1458a_100000185839_100000729493 [0,1,0,0,1,0|2,0,0]=4 10696 B14R1.19 O=C(CCCCF)c1ccc(cc1)Cl 1458a_100000210187_100000729493 [0,1,0,0,1,0|2,0,0]=4 10697 B14R1.19 O=C(CCCCF)c1ccc(cc1)F 1458a_100000187176_100000729493 [0,1,0,0,1,0|2,0,0]=4 10698 B14R1.19 O=C(CCCCF)c1ccc(cc1)I 1458a_100000187904_100000729493 [0,1,0,0,1,0|2,0,0]=4 10699 B14R1.19 O=C(CCCCF)c1ccc(cc1)O 1458a_100000212099_100000729493 [0,1,0,0,1,0|2,0,0]=4 10700 B14R1.19 O=C(CCCCO)c1ccc(cc1)Br 1458a_100000185839_100000210776 [0,1,0,0,1,0|2,0,0]=4 10701 B14R1.19 O=C(CCCCO)c1ccc(cc1)Cl 1458a_100000210187_100000210776 [0,1,0,0,1,0|2,0,0]=4 10702 B14R1.19 O=C(CCCCO)c1ccc(cc1)F 1458a_100000187176_100000210776 [0,1,0,0,1,0|2,0,0]=4 10703 B14R1.19 O=C(CCCCO)c1ccc(cc1)I 1458a_100000187904_100000210776 [0,1,0,0,1,0|2,0,0]=4 10704 B14R1.19 O=C(CCCCO)c1ccc(cc1)O 1458a_100000212099_100000210776 [0,1,0,0,1,0|2,0,0]=4 10705 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 11a_100015189416_100000185839 [0,1,0,0,1,0|2,0,0]=4 10706 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 1626a_100015189416_100000185839 [0,1,0,0,1,0|2,0,0]=4 10707 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 240690a_100015189416_100000185839 [0,1,0,0,1,0|2,0,0]=4 10708 B14R1.19 O=C(NCCCF)c1ccc(cc1)Br 527a_100015189416_100000185839 [0,1,0,0,1,0|2,0,0]=4 10709 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 11a_100015189416_100000210187 [0,1,0,0,1,0|2,0,0]=4 10710 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 1626a_100015189416_100000210187 [0,1,0,0,1,0|2,0,0]=4 10711 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 240690a_100015189416_100000210187 [0,1,0,0,1,0|2,0,0]=4 10712 B14R1.19 O=C(NCCCF)c1ccc(cc1)Cl 527a_100015189416_100000210187 [0,1,0,0,1,0|2,0,0]=4 10713 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 11a_100015189416_100000187176 [0,1,0,0,1,0|2,0,0]=4 10714 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 1626a_100015189416_100000187176 [0,1,0,0,1,0|2,0,0]=4 10715 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 240690a_100015189416_100000187176 [0,1,0,0,1,0|2,0,0]=4 10716 B14R1.19 O=C(NCCCF)c1ccc(cc1)F 527a_100015189416_100000187176 [0,1,0,0,1,0|2,0,0]=4 10717 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 11a_100015189416_100000187904 [0,1,0,0,1,0|2,0,0]=4 10718 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 1626a_100015189416_100000187904 [0,1,0,0,1,0|2,0,0]=4 10719 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 240690a_100015189416_100000187904 [0,1,0,0,1,0|2,0,0]=4 10720 B14R1.19 O=C(NCCCF)c1ccc(cc1)I 527a_100015189416_100000187904 [0,1,0,0,1,0|2,0,0]=4 10721 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 240690a_100015189416_100000212099 [0,1,0,0,1,0|2,0,0]=4 10722 B14R1.19 O=C(NCCCF)c1ccc(cc1)O 527a_100015189416_100000212099 [0,1,0,0,1,0|2,0,0]=4 10723 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 240690a_100000182051_100000185839 [0,1,0,0,1,0|2,0,0]=4 10724 B14R1.19 O=C(NCCCO)c1ccc(cc1)Br 527a_100000182051_100000185839 [0,1,0,0,1,0|2,0,0]=4 10725 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 240690a_100000182051_100000210187 [0,1,0,0,1,0|2,0,0]=4 10726 B14R1.19 O=C(NCCCO)c1ccc(cc1)Cl 527a_100000182051_100000210187 [0,1,0,0,1,0|2,0,0]=4 10727 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 240690a_100000182051_100000187176 [0,1,0,0,1,0|2,0,0]=4 10728 B14R1.19 O=C(NCCCO)c1ccc(cc1)F 527a_100000182051_100000187176 [0,1,0,0,1,0|2,0,0]=4 10729 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 240690a_100000182051_100000187904 [0,1,0,0,1,0|2,0,0]=4 10730 B14R1.19 O=C(NCCCO)c1ccc(cc1)I 527a_100000182051_100000187904 [0,1,0,0,1,0|2,0,0]=4 10731 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 240690a_100000182051_100000212099 [0,1,0,0,1,0|2,0,0]=4 10732 B14R1.19 O=C(NCCCO)c1ccc(cc1)O 527a_100000182051_100000212099 [0,1,0,0,1,0|2,0,0]=4 10733 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 2230a_100000736292_200025704644 [0,1,0,0,1,0|2,0,0]=4 10734 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)Cl 34a_100000736292_200025704644 [0,1,0,0,1,0|2,0,0]=4 10735 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 2230a_100000753910_200025704644 [0,1,0,0,1,0|2,0,0]=4 10736 B14R1.19 [13CH3]NCCNC(=O)c1ccc(cc1)F 34a_100000753910_200025704644 [0,1,0,0,1,0|2,0,0]=4 10737 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)Br 34a_200000158904_200025704644 [0,1,0,0,1,0|2,0,0]=4 10738 B14R1.19 [13CH3]OCCNC(=O)c1ccc(cc1)N 34a_100000740983_200025704644 [0,1,0,0,1,0|2,0,0]=4 10739 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_100000211046_200025704644 [0,1,0,0,1,0|2,0,0]=4 10740 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Br 62a_200025704644_100000211046 [0,1,0,0,1,0|2,0,0]=4 10741 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200011217871_200025704644 [0,1,0,0,1,0|2,0,0]=4 10742 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)Cl 62a_200025704644_200011217871 [0,1,0,0,1,0|2,0,0]=4 10743 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_100000211961_200025704644 [0,1,0,0,1,0|2,0,0]=4 10744 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)F 62a_200025704644_100000211961 [0,1,0,0,1,0|2,0,0]=4 10745 B14R1.19 [13CH3]SCCCC(=O)c1ccc(cc1)O 62a_200025704644_100000039620 [0,1,0,0,1,0|2,0,0]=4 10746 B14R1.19 [2H]C(OCCCC)c1ccc(cc1)F 34a_217856618577_100000210210 [0,1,0,0,1,0|1,0,1]=4 10747 B14R1.19 [2H]C(OCCCC)c1ccc(cc1)F 7a_217856618577_100000210211 [0,1,0,0,1,0|1,0,1]=4 10748 B14R1.20 CCCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210326 [0,1,0,0,1,0|1,0,0]=3 10749 B14R1.20 CCCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210326 [0,1,0,0,1,0|1,0,0]=3 10750 B14R1.20 CCCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210326 [0,1,0,0,1,0|1,0,0]=3 10751 B14R1.20 CCCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210326 [0,1,0,0,1,0|1,0,0]=3 10752 B14R1.20 CCCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210326 [0,1,0,0,1,0|1,0,0]=3 10753 B14R1.20 CCCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210326 [0,1,0,0,1,0|1,0,0]=3 10754 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 11a_100000102301_100000210664 [0,1,0,0,1,0|1,0,0]=3 10755 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 1626a_100000102301_100000210664 [0,1,0,0,1,0|1,0,0]=3 10756 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 240690a_100000102301_100000210664 [0,1,0,0,1,0|1,0,0]=3 10757 B14R1.20 CCCCNC(=O)c1cccc(c1)Br 527a_100000102301_100000210664 [0,1,0,0,1,0|1,0,0]=3 10758 B14R1.20 CCCCNC(=O)c1cccc(c1)C 11a_100000102301_100000189346 [0,1,0,0,1,0|1,0,0]=3 10759 B14R1.20 CCCCNC(=O)c1cccc(c1)C 1626a_100000102301_100000189346 [0,1,0,0,1,0|1,0,0]=3 10760 B14R1.20 CCCCNC(=O)c1cccc(c1)C 240690a_100000102301_100000189346 [0,1,0,0,1,0|1,0,0]=3 10761 B14R1.20 CCCCNC(=O)c1cccc(c1)C 527a_100000102301_100000189346 [0,1,0,0,1,0|1,0,0]=3 10762 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 11a_100000102301_100000210390 [0,1,0,0,1,0|1,0,0]=3 10763 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 1626a_100000102301_100000210390 [0,1,0,0,1,0|1,0,0]=3 10764 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 240690a_100000102301_100000210390 [0,1,0,0,1,0|1,0,0]=3 10765 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl 527a_100000102301_100000210390 [0,1,0,0,1,0|1,0,0]=3 10766 B14R1.20 CCCCNC(=O)c1cccc(c1)F 11a_100000102301_100000210950 [0,1,0,0,1,0|1,0,0]=3 10767 B14R1.20 CCCCNC(=O)c1cccc(c1)F 1626a_100000102301_100000210950 [0,1,0,0,1,0|1,0,0]=3 10768 B14R1.20 CCCCNC(=O)c1cccc(c1)F 240690a_100000102301_100000210950 [0,1,0,0,1,0|1,0,0]=3 10769 B14R1.20 CCCCNC(=O)c1cccc(c1)F 527a_100000102301_100000210950 [0,1,0,0,1,0|1,0,0]=3 10770 B14R1.20 CCCCNC(=O)c1cccc(c1)I 11a_100000102301_100000184098 [0,1,0,0,1,0|1,0,0]=3 10771 B14R1.20 CCCCNC(=O)c1cccc(c1)I 1626a_100000102301_100000184098 [0,1,0,0,1,0|1,0,0]=3 10772 B14R1.20 CCCCNC(=O)c1cccc(c1)I 240690a_100000102301_100000184098 [0,1,0,0,1,0|1,0,0]=3 10773 B14R1.20 CCCCNC(=O)c1cccc(c1)I 527a_100000102301_100000184098 [0,1,0,0,1,0|1,0,0]=3 10774 B14R1.20 CCCCNC(=O)c1cccc(c1)O 240690a_100000102301_100000183914 [0,1,0,0,1,0|1,0,0]=3 10775 B14R1.20 CCCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000154868 [0,1,0,0,1,0|1,0,0]=3 10776 B14R1.20 CCCCNC(=O)c1cccc(c1)O 527a_100000102301_100000183914 [0,1,0,0,1,0|1,0,0]=3 10777 B14R1.20 CCCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000154871 [0,1,0,0,1,0|2,0,0]=4 10778 B14R1.20 CCCCOC(C)c1cccc(c1)Br 34a_100000246457_100000210210 [0,1,0,0,1,0|1,0,1]=4 10779 B14R1.20 CCCCOC(C)c1cccc(c1)Br 7a_100000246457_100000210211 [0,1,0,0,1,0|1,0,1]=4 10780 B14R1.20 CCCCOC(C)c1cccc(c1)C 34a_100000757818_100000210210 [0,1,0,0,1,0|1,0,1]=4 10781 B14R1.20 CCCCOC(C)c1cccc(c1)C 7a_100000757818_100000210211 [0,1,0,0,1,0|1,0,1]=4 10782 B14R1.20 CCCCOC(C)c1cccc(c1)F 34a_100000744526_100000210210 [0,1,0,0,1,0|1,0,1]=4 10783 B14R1.20 CCCCOC(C)c1cccc(c1)F 7a_100000744526_100000210211 [0,1,0,0,1,0|1,0,1]=4 10784 B14R1.20 CCCCOC(C)c1cccc(c1)I 34a_100013085317_100000210210 [0,1,0,0,1,0|1,0,1]=4 10785 B14R1.20 CCCCOC(C)c1cccc(c1)I 7a_100013085317_100000210211 [0,1,0,0,1,0|1,0,1]=4 10786 B14R1.20 CCCCOC(C)c1cccc(c1)N 34a_100011217120_100000210210 [0,1,0,0,1,0|1,0,1]=4 10787 B14R1.20 CCCCOC(C)c1cccc(c1)N 7a_100011217120_100000210211 [0,1,0,0,1,0|1,0,1]=4 10788 B14R1.20 CCCCO[C@H](C)c1cccc(c1)Cl 34a_100000747380_100000210210 [0,1,0,0,1,0|1,0,1]=4 10789 B14R1.20 CCCCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000210211 [0,1,0,0,1,0|1,0,1]=4 10790 B14R1.20 CCCNNC(=O)c1cccc(c1)Br 22a_100000740057_100000210664 [0,1,0,0,1,0|2,0,0]=4 10791 B14R1.20 CCCNNC(=O)c1cccc(c1)C 22a_100000740057_100000189346 [0,1,0,0,1,0|2,0,0]=4 10792 B14R1.20 CCCNNC(=O)c1cccc(c1)Cl 22a_100000740057_100000210390 [0,1,0,0,1,0|2,0,0]=4 10793 B14R1.20 CCCNNC(=O)c1cccc(c1)F 22a_100000740057_100000210950 [0,1,0,0,1,0|2,0,0]=4 10794 B14R1.20 CCCNNC(=O)c1cccc(c1)I 22a_100000740057_100000184098 [0,1,0,0,1,0|2,0,0]=4 10795 B14R1.20 CCCNNC(=O)c1cccc(c1)O 22a_100000740057_100000183914 [0,1,0,0,1,0|2,0,0]=4 10796 B14R1.20 CCCOCC(=O)c1cccc(c1)Br 34a_100000210258_100000212080 [0,1,0,0,1,0|2,0,0]=4 10797 B14R1.20 CCCOCC(=O)c1cccc(c1)C 34a_100000210258_100000739480 [0,1,0,0,1,0|2,0,0]=4 10798 B14R1.20 CCCOCC(=O)c1cccc(c1)Cl 34a_100000210258_100000211444 [0,1,0,0,1,0|2,0,0]=4 10799 B14R1.20 CCCOCC(=O)c1cccc(c1)Cl 7a_200011592804_100000210303 [0,1,0,0,1,0|2,0,0]=4 10800 B14R1.20 CCCOCC(=O)c1cccc(c1)F 34a_100000210258_100000215616 [0,1,0,0,1,0|2,0,0]=4 10801 B14R1.20 CCCOCC(=O)c1cccc(c1)F 34a_100011592800_100000210303 [0,1,0,0,1,0|2,0,0]=4 10802 B14R1.20 CCCOCC(=O)c1cccc(c1)F 7a_100011592800_100000210303 [0,1,0,0,1,0|2,0,0]=4 10803 B14R1.20 CCCOCC(=O)c1cccc(c1)O 34a_100000210258_100009813753 [0,1,0,0,1,0|2,0,0]=4 10804 B14R1.20 CCCSCC(=O)c1cccc(c1)Br 62a_100000210303_100000212080 [0,1,0,0,1,0|2,0,0]=4 10805 B14R1.20 CCCSCC(=O)c1cccc(c1)Br 62a_100000212080_100000210303 [0,1,0,0,1,0|2,0,0]=4 10806 B14R1.20 CCCSCC(=O)c1cccc(c1)C 62a_100000210303_100000739480 [0,1,0,0,1,0|2,0,0]=4 10807 B14R1.20 CCCSCC(=O)c1cccc(c1)C 62a_100000739480_100000210303 [0,1,0,0,1,0|2,0,0]=4 10808 B14R1.20 CCCSCC(=O)c1cccc(c1)Cl 62a_100000210303_100000211444 [0,1,0,0,1,0|2,0,0]=4 10809 B14R1.20 CCCSCC(=O)c1cccc(c1)Cl 62a_100000211444_100000210303 [0,1,0,0,1,0|2,0,0]=4 10810 B14R1.20 CCCSCC(=O)c1cccc(c1)F 62a_100000210303_100000215616 [0,1,0,0,1,0|2,0,0]=4 10811 B14R1.20 CCCSCC(=O)c1cccc(c1)F 62a_100000215616_100000210303 [0,1,0,0,1,0|2,0,0]=4 10812 B14R1.20 CCCSCC(=O)c1cccc(c1)O 62a_100000210303_100009813753 [0,1,0,0,1,0|2,0,0]=4 10813 B14R1.20 CCCSCC(=O)c1cccc(c1)O 62a_100009813753_100000210303 [0,1,0,0,1,0|2,0,0]=4 10814 B14R1.20 CCOCCC(=O)c1cccc(c1)Br 1458a_100000210664_100011215890 [0,1,0,0,1,0|2,0,0]=4 10815 B14R1.20 CCOCCC(=O)c1cccc(c1)C 1458a_100000189346_100011215890 [0,1,0,0,1,0|2,0,0]=4 10816 B14R1.20 CCOCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011215890 [0,1,0,0,1,0|2,0,0]=4 10817 B14R1.20 CCOCCC(=O)c1cccc(c1)F 1458a_100000210950_100011215890 [0,1,0,0,1,0|2,0,0]=4 10818 B14R1.20 CCOCCC(=O)c1cccc(c1)I 1458a_100000184098_100011215890 [0,1,0,0,1,0|2,0,0]=4 10819 B14R1.20 CCOCCC(=O)c1cccc(c1)O 1458a_100000183914_100011215890 [0,1,0,0,1,0|2,0,0]=4 10820 B14R1.20 CCSCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000757381 [0,1,0,0,1,0|2,0,0]=4 10821 B14R1.20 CCSCCC(=O)c1cccc(c1)C 1458a_100000189346_100000757381 [0,1,0,0,1,0|2,0,0]=4 10822 B14R1.20 CCSCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000757381 [0,1,0,0,1,0|2,0,0]=4 10823 B14R1.20 CCSCCC(=O)c1cccc(c1)F 1458a_100000210950_100000757381 [0,1,0,0,1,0|2,0,0]=4 10824 B14R1.20 CCSCCC(=O)c1cccc(c1)I 1458a_100000184098_100000757381 [0,1,0,0,1,0|2,0,0]=4 10825 B14R1.20 CCSCCC(=O)c1cccc(c1)O 1458a_100000183914_100000757381 [0,1,0,0,1,0|2,0,0]=4 10826 B14R1.20 COCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000740836 [0,1,0,0,1,0|2,0,0]=4 10827 B14R1.20 COCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000740836 [0,1,0,0,1,0|2,0,0]=4 10828 B14R1.20 COCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000740836 [0,1,0,0,1,0|2,0,0]=4 10829 B14R1.20 COCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000740836 [0,1,0,0,1,0|2,0,0]=4 10830 B14R1.20 COCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000740836 [0,1,0,0,1,0|2,0,0]=4 10831 B14R1.20 COCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000740836 [0,1,0,0,1,0|2,0,0]=4 10832 B14R1.20 COCCNC(=O)c1cccc(c1)Br 1626a_100000209980_100000210664 [0,1,0,0,1,0|2,0,0]=4 10833 B14R1.20 COCCNC(=O)c1cccc(c1)Br 240690a_100000209980_100000210664 [0,1,0,0,1,0|2,0,0]=4 10834 B14R1.20 COCCNC(=O)c1cccc(c1)Br 34a_200000158903_200000210301 [0,1,0,0,1,0|2,0,0]=4 10835 B14R1.20 COCCNC(=O)c1cccc(c1)Br 527a_100000209980_100000210664 [0,1,0,0,1,0|2,0,0]=4 10836 B14R1.20 COCCNC(=O)c1cccc(c1)Br 7a_200000158903_200000210301 [0,1,0,0,1,0|2,0,0]=4 10837 B14R1.20 COCCNC(=O)c1cccc(c1)C 1626a_100000209980_100000189346 [0,1,0,0,1,0|2,0,0]=4 10838 B14R1.20 COCCNC(=O)c1cccc(c1)C 240690a_100000209980_100000189346 [0,1,0,0,1,0|2,0,0]=4 10839 B14R1.20 COCCNC(=O)c1cccc(c1)C 527a_100000209980_100000189346 [0,1,0,0,1,0|2,0,0]=4 10840 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 1626a_100000209980_100000210390 [0,1,0,0,1,0|2,0,0]=4 10841 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 240690a_100000209980_100000210390 [0,1,0,0,1,0|2,0,0]=4 10842 B14R1.20 COCCNC(=O)c1cccc(c1)Cl 527a_100000209980_100000210390 [0,1,0,0,1,0|2,0,0]=4 10843 B14R1.20 COCCNC(=O)c1cccc(c1)F 1626a_100000209980_100000210950 [0,1,0,0,1,0|2,0,0]=4 10844 B14R1.20 COCCNC(=O)c1cccc(c1)F 240690a_100000209980_100000210950 [0,1,0,0,1,0|2,0,0]=4 10845 B14R1.20 COCCNC(=O)c1cccc(c1)F 527a_100000209980_100000210950 [0,1,0,0,1,0|2,0,0]=4 10846 B14R1.20 COCCNC(=O)c1cccc(c1)I 1626a_100000209980_100000184098 [0,1,0,0,1,0|2,0,0]=4 10847 B14R1.20 COCCNC(=O)c1cccc(c1)I 240690a_100000209980_100000184098 [0,1,0,0,1,0|2,0,0]=4 10848 B14R1.20 COCCNC(=O)c1cccc(c1)I 527a_100000209980_100000184098 [0,1,0,0,1,0|2,0,0]=4 10849 B14R1.20 COCCNC(=O)c1cccc(c1)O 240690a_100000209980_100000183914 [0,1,0,0,1,0|2,0,0]=4 10850 B14R1.20 COCCNC(=O)c1cccc(c1)O 527a_100000209980_100000183914 [0,1,0,0,1,0|2,0,0]=4 10851 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 11a_100020590264_100000210664 [0,1,0,0,1,0|2,0,0]=4 10852 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 1626a_100020590264_100000210664 [0,1,0,0,1,0|2,0,0]=4 10853 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 240690a_100020590264_100000210664 [0,1,0,0,1,0|2,0,0]=4 10854 B14R1.20 CSCCNC(=O)c1cccc(c1)Br 527a_100020590264_100000210664 [0,1,0,0,1,0|2,0,0]=4 10855 B14R1.20 CSCCNC(=O)c1cccc(c1)C 11a_100020590264_100000189346 [0,1,0,0,1,0|2,0,0]=4 10856 B14R1.20 CSCCNC(=O)c1cccc(c1)C 1626a_100020590264_100000189346 [0,1,0,0,1,0|2,0,0]=4 10857 B14R1.20 CSCCNC(=O)c1cccc(c1)C 240690a_100020590264_100000189346 [0,1,0,0,1,0|2,0,0]=4 10858 B14R1.20 CSCCNC(=O)c1cccc(c1)C 527a_100020590264_100000189346 [0,1,0,0,1,0|2,0,0]=4 10859 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 11a_100020590264_100000210390 [0,1,0,0,1,0|2,0,0]=4 10860 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 1626a_100020590264_100000210390 [0,1,0,0,1,0|2,0,0]=4 10861 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 240690a_100020590264_100000210390 [0,1,0,0,1,0|2,0,0]=4 10862 B14R1.20 CSCCNC(=O)c1cccc(c1)Cl 527a_100020590264_100000210390 [0,1,0,0,1,0|2,0,0]=4 10863 B14R1.20 CSCCNC(=O)c1cccc(c1)F 11a_100020590264_100000210950 [0,1,0,0,1,0|2,0,0]=4 10864 B14R1.20 CSCCNC(=O)c1cccc(c1)F 1626a_100020590264_100000210950 [0,1,0,0,1,0|2,0,0]=4 10865 B14R1.20 CSCCNC(=O)c1cccc(c1)F 240690a_100020590264_100000210950 [0,1,0,0,1,0|2,0,0]=4 10866 B14R1.20 CSCCNC(=O)c1cccc(c1)F 527a_100020590264_100000210950 [0,1,0,0,1,0|2,0,0]=4 10867 B14R1.20 CSCCNC(=O)c1cccc(c1)I 11a_100020590264_100000184098 [0,1,0,0,1,0|2,0,0]=4 10868 B14R1.20 CSCCNC(=O)c1cccc(c1)I 1626a_100020590264_100000184098 [0,1,0,0,1,0|2,0,0]=4 10869 B14R1.20 CSCCNC(=O)c1cccc(c1)I 240690a_100020590264_100000184098 [0,1,0,0,1,0|2,0,0]=4 10870 B14R1.20 CSCCNC(=O)c1cccc(c1)I 527a_100020590264_100000184098 [0,1,0,0,1,0|2,0,0]=4 10871 B14R1.20 CSCCNC(=O)c1cccc(c1)O 240690a_100020590264_100000183914 [0,1,0,0,1,0|2,0,0]=4 10872 B14R1.20 CSCCNC(=O)c1cccc(c1)O 527a_100020590264_100000183914 [0,1,0,0,1,0|2,0,0]=4 10873 B14R1.20 Cc1cccc(c1)C(=O)CCCCF 1458a_100000189346_100000729493 [0,1,0,0,1,0|2,0,0]=4 10874 B14R1.20 Cc1cccc(c1)C(=O)CCCCO 1458a_100000189346_100000210776 [0,1,0,0,1,0|2,0,0]=4 10875 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 11a_100015189416_100000189346 [0,1,0,0,1,0|2,0,0]=4 10876 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 1626a_100015189416_100000189346 [0,1,0,0,1,0|2,0,0]=4 10877 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 240690a_100015189416_100000189346 [0,1,0,0,1,0|2,0,0]=4 10878 B14R1.20 Cc1cccc(c1)C(=O)NCCCF 527a_100015189416_100000189346 [0,1,0,0,1,0|2,0,0]=4 10879 B14R1.20 Cc1cccc(c1)C(=O)NCCCO 240690a_100000182051_100000189346 [0,1,0,0,1,0|2,0,0]=4 10880 B14R1.20 Cc1cccc(c1)C(=O)NCCCO 527a_100000182051_100000189346 [0,1,0,0,1,0|2,0,0]=4 10881 B14R1.20 NCCCNC(=O)c1cccc(c1)O 271570a_203496583355_100000748816 [0,1,0,0,1,0|2,0,0]=4 10882 B14R1.20 O=C(CCCCF)c1cccc(c1)Br 1458a_100000210664_100000729493 [0,1,0,0,1,0|2,0,0]=4 10883 B14R1.20 O=C(CCCCF)c1cccc(c1)Cl 1458a_100000210390_100000729493 [0,1,0,0,1,0|2,0,0]=4 10884 B14R1.20 O=C(CCCCF)c1cccc(c1)F 1458a_100000210950_100000729493 [0,1,0,0,1,0|2,0,0]=4 10885 B14R1.20 O=C(CCCCF)c1cccc(c1)I 1458a_100000184098_100000729493 [0,1,0,0,1,0|2,0,0]=4 10886 B14R1.20 O=C(CCCCF)c1cccc(c1)O 1458a_100000183914_100000729493 [0,1,0,0,1,0|2,0,0]=4 10887 B14R1.20 O=C(CCCCO)c1cccc(c1)Br 1458a_100000210664_100000210776 [0,1,0,0,1,0|2,0,0]=4 10888 B14R1.20 O=C(CCCCO)c1cccc(c1)Cl 1458a_100000210390_100000210776 [0,1,0,0,1,0|2,0,0]=4 10889 B14R1.20 O=C(CCCCO)c1cccc(c1)F 1458a_100000210950_100000210776 [0,1,0,0,1,0|2,0,0]=4 10890 B14R1.20 O=C(CCCCO)c1cccc(c1)I 1458a_100000184098_100000210776 [0,1,0,0,1,0|2,0,0]=4 10891 B14R1.20 O=C(CCCCO)c1cccc(c1)O 1458a_100000183914_100000210776 [0,1,0,0,1,0|2,0,0]=4 10892 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 11a_100015189416_100000210664 [0,1,0,0,1,0|2,0,0]=4 10893 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 1626a_100015189416_100000210664 [0,1,0,0,1,0|2,0,0]=4 10894 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 240690a_100015189416_100000210664 [0,1,0,0,1,0|2,0,0]=4 10895 B14R1.20 O=C(NCCCF)c1cccc(c1)Br 527a_100015189416_100000210664 [0,1,0,0,1,0|2,0,0]=4 10896 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 11a_100015189416_100000210390 [0,1,0,0,1,0|2,0,0]=4 10897 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 1626a_100015189416_100000210390 [0,1,0,0,1,0|2,0,0]=4 10898 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 240690a_100015189416_100000210390 [0,1,0,0,1,0|2,0,0]=4 10899 B14R1.20 O=C(NCCCF)c1cccc(c1)Cl 527a_100015189416_100000210390 [0,1,0,0,1,0|2,0,0]=4 10900 B14R1.20 O=C(NCCCF)c1cccc(c1)F 11a_100015189416_100000210950 [0,1,0,0,1,0|2,0,0]=4 10901 B14R1.20 O=C(NCCCF)c1cccc(c1)F 1626a_100015189416_100000210950 [0,1,0,0,1,0|2,0,0]=4 10902 B14R1.20 O=C(NCCCF)c1cccc(c1)F 240690a_100015189416_100000210950 [0,1,0,0,1,0|2,0,0]=4 10903 B14R1.20 O=C(NCCCF)c1cccc(c1)F 527a_100015189416_100000210950 [0,1,0,0,1,0|2,0,0]=4 10904 B14R1.20 O=C(NCCCF)c1cccc(c1)I 11a_100015189416_100000184098 [0,1,0,0,1,0|2,0,0]=4 10905 B14R1.20 O=C(NCCCF)c1cccc(c1)I 1626a_100015189416_100000184098 [0,1,0,0,1,0|2,0,0]=4 10906 B14R1.20 O=C(NCCCF)c1cccc(c1)I 240690a_100015189416_100000184098 [0,1,0,0,1,0|2,0,0]=4 10907 B14R1.20 O=C(NCCCF)c1cccc(c1)I 527a_100015189416_100000184098 [0,1,0,0,1,0|2,0,0]=4 10908 B14R1.20 O=C(NCCCF)c1cccc(c1)O 240690a_100015189416_100000183914 [0,1,0,0,1,0|2,0,0]=4 10909 B14R1.20 O=C(NCCCF)c1cccc(c1)O 527a_100015189416_100000183914 [0,1,0,0,1,0|2,0,0]=4 10910 B14R1.20 O=C(NCCCO)c1cccc(c1)Br 240690a_100000182051_100000210664 [0,1,0,0,1,0|2,0,0]=4 10911 B14R1.20 O=C(NCCCO)c1cccc(c1)Br 527a_100000182051_100000210664 [0,1,0,0,1,0|2,0,0]=4 10912 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl 240690a_100000182051_100000210390 [0,1,0,0,1,0|2,0,0]=4 10913 B14R1.20 O=C(NCCCO)c1cccc(c1)Cl 527a_100000182051_100000210390 [0,1,0,0,1,0|2,0,0]=4 10914 B14R1.20 O=C(NCCCO)c1cccc(c1)F 240690a_100000182051_100000210950 [0,1,0,0,1,0|2,0,0]=4 10915 B14R1.20 O=C(NCCCO)c1cccc(c1)F 527a_100000182051_100000210950 [0,1,0,0,1,0|2,0,0]=4 10916 B14R1.20 O=C(NCCCO)c1cccc(c1)I 240690a_100000182051_100000184098 [0,1,0,0,1,0|2,0,0]=4 10917 B14R1.20 O=C(NCCCO)c1cccc(c1)I 527a_100000182051_100000184098 [0,1,0,0,1,0|2,0,0]=4 10918 B14R1.20 O=C(NCCCO)c1cccc(c1)O 240690a_100000182051_100000183914 [0,1,0,0,1,0|2,0,0]=4 10919 B14R1.20 O=C(NCCCO)c1cccc(c1)O 527a_100000182051_100000183914 [0,1,0,0,1,0|2,0,0]=4 10920 B14R1.20 [13CH3]OCCNC(=O)c1cccc(c1)Br 34a_200000158903_200025704644 [0,1,0,0,1,0|2,0,0]=4 10921 B14R1.20 [13CH3]OCCNC(=O)c1cccc(c1)Br 7a_200000158903_200025704644 [0,1,0,0,1,0|2,0,0]=4 10922 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000747444 [0,1,0,0,1,0|1,0,1]=4 10923 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 1458a_100000211992_100000211460 [0,1,0,0,1,0|1,0,1]=4 10924 B14R1.29 CCCC(C)CC(=O)c1ccccc1 1458a_100000185807_100011216630 [0,1,0,0,1,0|1,0,0]=3 10925 B14R1.29 CCCC(C)NC(=O)c1ccccc1 11a_100000741246_100000185807 [0,1,0,0,1,0|1,0,0]=3 10926 B14R1.29 CCCC(C)NC(=O)c1ccccc1 1626a_100000741246_100000185807 [0,1,0,0,1,0|1,0,0]=3 10927 B14R1.29 CCCC(C)NC(=O)c1ccccc1 240690a_100000741246_100000185807 [0,1,0,0,1,0|1,0,0]=3 10928 B14R1.29 CCCC(C)NC(=O)c1ccccc1 527a_100000741246_100000185807 [0,1,0,0,1,0|1,0,0]=3 10929 B14R1.29 CCCC(C)OC(C)c1ccccc1 34a_100000764384_100000211855 [0,1,0,0,1,0|1,0,1]=4 10930 B14R1.29 CCCC(C)OC(C)c1ccccc1 7a_100000764384_100000230085 [0,1,0,0,1,0|1,0,1]=4 10931 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000766640 [0,1,0,0,1,0|1,0,1]=4 10932 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000766640 [0,1,0,0,1,0|1,0,1]=4 10933 B14R1.29 CCCN(C)CC(=O)c1ccccc1 269982a_100000747261_100000211460 [0,1,0,0,1,0|2,0,0]=4 10934 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 11a_100000764878_100000185807 [0,1,0,0,1,0|2,0,0]=4 10935 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 1626a_100000764878_100000185807 [0,1,0,0,1,0|2,0,0]=4 10936 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 240690a_100000764878_100000185807 [0,1,0,0,1,0|2,0,0]=4 10937 B14R1.29 COC[C@@H](C)NC(=O)c1ccccc1 527a_100000764878_100000185807 [0,1,0,0,1,0|2,0,0]=4 10938 B14R1.29 C[C@H](CCO)NC(=O)c1ccccc1 240690a_100000706166_100000185807 [0,1,0,0,1,0|2,0,0]=4 10939 B14R1.29 C[C@H](CCO)NC(=O)c1ccccc1 527a_100000706166_100000185807 [0,1,0,0,1,0|2,0,0]=4 10940 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 270084a_100000102301_100000210345 [0,1,0,0,1,0|2,0,0]=4 10941 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 274078a_100000102301_100000210345 [0,1,0,0,1,0|2,0,0]=4 10942 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 40a_100000102301_100000032697 [0,1,0,0,1,0|2,0,0]=4 10943 B14R1.46 CCCCOC(C)(C)c1ccccc1 7a_100000694644_100000210211 [0,1,0,0,1,0|1,0,1]=4 10944 B14R1.46 CCCCOC(F)(F)c1ccccc1 7a_100000210227_100000036403 [0,1,0,0,1,0|1,0,1]=4 10945 B14R1.46 CNCCOS(=O)(=O)c1ccccc1 34a_100102657272_200000070464 [0,1,0,0,1,0|2,0,0]=4 10946 B14R1.46 CNCCOS(=O)(=O)c1ccccc1 7a_106832991635_200000070464 [0,1,0,0,1,0|2,0,0]=4 10947 B14R1.46 COCCOS(=O)(=O)c1ccccc1 34a_100138415774_200000070464 [0,1,0,0,1,0|2,0,0]=4 10948 B14R1.46 CSCCOS(=O)(=O)c1ccccc1 62a_200000210301_200000070464 [0,1,0,0,1,0|2,0,0]=4 10949 B14R1.46 [13CH3]SCCOS(=O)(=O)c1ccccc1 62a_200025704644_200000070464 [0,1,0,0,1,0|2,0,0]=4 10950 B14R1.121 C#CC(OCCCC)c1ccccc1 34a_100011219616_100000210210 [0,1,0,0,1,0|1,0,1]=4 10951 B14R1.121 C#CC(OCCCC)c1ccccc1 7a_100011219616_100000210211 [0,1,0,0,1,0|1,0,1]=4 10952 B14R1.121 C=CC(OCCCC)c1ccccc1 34a_100011215659_100000210210 [0,1,0,0,1,0|1,0,1]=4 10953 B14R1.121 C=CC(OCCCC)c1ccccc1 7a_100011215659_100000210211 [0,1,0,0,1,0|1,0,1]=4 10954 B14R1.121 CCCCOC(C#N)c1ccccc1 7a_100011217353_100000210211 [0,1,0,0,1,0|1,0,1]=4 10955 B14R1.121 CCCCOC(CBr)c1ccccc1 7a_100000185958_100000210211 [0,1,0,0,1,0|1,0,1]=4 10956 B14R1.121 CCCCOC(CC)c1ccccc1 34a_100000698172_100000210210 [0,1,0,0,1,0|1,0,1]=4 10957 B14R1.121 CCCCOC(CC)c1ccccc1 7a_100000698172_100000210211 [0,1,0,0,1,0|1,0,1]=4 10958 B14R1.121 CCCCOC(CN)c1ccccc1 34a_100000210709_100000210210 [0,1,0,0,1,0|1,0,1]=4 10959 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210210 [0,1,0,0,1,0|1,0,1]=4 10960 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210211 [0,1,0,0,1,0|1,0,1]=4 10961 B14R1.163 CC(CCC(=O)c1ccccc1)O[13CH3] 7a_200012571355_200025704644 [0,1,0,0,1,0|2,0,0]=4 10962 B14R1.163 CC(CO)CNC(=O)c1ccccc1 240690a_100000744482_100000185807 [0,1,0,0,1,0|2,0,0]=4 10963 B14R1.163 CC(CO)CNC(=O)c1ccccc1 527a_100000744482_100000185807 [0,1,0,0,1,0|2,0,0]=4 10964 B14R1.163 CCC(=O)CCC(=O)c1ccccc1 1458a_100000210414_100000750707 [0,1,0,0,1,0|1,0,1]=4 10965 B14R1.163 CCC(=O)CNC(=O)c1ccccc1 1458a_100000182045_100000210202 [0,1,0,0,1,0|1,0,1]=4 10966 B14R1.163 CCC(=O)COC(=O)c1ccccc1 1458a_100000210414_100000073877 [0,1,0,0,1,0|0,0,1]=3 10967 B14R1.163 CCC(C)CNC(=O)c1ccccc1 11a_100020588543_100000185807 [0,1,0,0,1,0|1,0,0]=3 10968 B14R1.163 CCC(C)CNC(=O)c1ccccc1 1626a_100020588543_100000185807 [0,1,0,0,1,0|1,0,0]=3 10969 B14R1.163 CCC(C)CNC(=O)c1ccccc1 240690a_100020588543_100000185807 [0,1,0,0,1,0|1,0,0]=3 10970 B14R1.163 CCC(C)CNC(=O)c1ccccc1 527a_100020588543_100000185807 [0,1,0,0,1,0|1,0,0]=3 10971 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000748023 [0,1,0,0,1,0|1,0,1]=4 10972 B14R1.163 CCC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000748023 [0,1,0,0,1,0|1,0,1]=4 10973 B14R1.163 CCC(C)NNC(=O)c1ccccc1 22a_100000718999_100000185807 [0,1,0,0,1,0|2,0,0]=4 10974 B14R1.163 CCC(C)OCC(=O)c1ccccc1 7a_100000210228_100000211460 [0,1,0,0,1,0|2,0,0]=4 10975 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000211460_100000758301 [0,1,0,0,1,0|2,0,0]=4 10976 B14R1.163 CCC(C)SCC(=O)c1ccccc1 62a_100000758301_100000211460 [0,1,0,0,1,0|2,0,0]=4 10977 B14R1.163 CCC(O)CNC(=O)c1ccccc1 11a_100011218483_100000185807 [0,1,0,0,1,0|1,0,0]=3 10978 B14R1.163 CCC(O)CNC(=O)c1ccccc1 240690a_100011218483_100000185807 [0,1,0,0,1,0|1,0,0]=3 10979 B14R1.163 CCC(O)CNC(=O)c1ccccc1 527a_100011218483_100000185807 [0,1,0,0,1,0|1,0,0]=3 10980 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 34a_100000761318_100011218378 [0,1,0,0,1,0|1,0,1]=4 10981 B14R1.163 CCC(O)CO[C@H](C)c1ccccc1 7a_100000761318_100011218378 [0,1,0,0,1,0|1,0,1]=4 10982 B14R1.163 CCN(C)CCC(=O)c1ccccc1 2230a_100000225621_100000750707 [0,1,0,0,1,0|2,0,0]=4 10983 B14R1.163 CCN(C)CCC(=O)c1ccccc1 269982a_100000225621_100000750707 [0,1,0,0,1,0|2,0,0]=4 10984 B14R1.163 CCN(C)COC(=O)c1ccccc1 269982a_100000225621_100000073877 [0,1,0,0,1,0|1,0,0]=3 10985 B14R1.163 CC[C@H](C)COC(C)c1ccccc1 7a_100009816381_100000230085 [0,1,0,0,1,0|1,0,1]=4 10986 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 34a_100000761318_100009816398 [0,1,0,0,1,0|1,0,1]=4 10987 B14R1.163 CC[C@H](C)CO[C@H](C)c1ccccc1 7a_100000761318_100009816398 [0,1,0,0,1,0|1,0,1]=4 10988 B14R1.163 CNC(C)COC(=O)c1ccccc1 270004a_106832991635_100000000904 [0,1,0,0,1,0|1,0,0]=3 10989 B14R1.163 COC(C)CCC(=O)c1ccccc1 7a_200012571355_200000210301 [0,1,0,0,1,0|2,0,0]=4 10990 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 11a_100020591295_100000185807 [0,1,0,0,1,0|2,0,0]=4 10991 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 1626a_100020591295_100000185807 [0,1,0,0,1,0|2,0,0]=4 10992 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 240690a_100020591295_100000185807 [0,1,0,0,1,0|2,0,0]=4 10993 B14R1.163 CO[C@H](C)CNC(=O)c1ccccc1 527a_100020591295_100000185807 [0,1,0,0,1,0|2,0,0]=4 10994 B14R1.163 O=C(CO)COC(=O)c1ccccc1 1458a_100000210174_100000073877 [0,1,0,0,1,0|1,0,1]=4 10995 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 240690a_100015665980_100000185807 [0,1,0,0,1,0|2,0,0]=4 10996 B14R1.163 O=C(NC[C@@H](F)CO)c1ccccc1 527a_100015665980_100000185807 [0,1,0,0,1,0|2,0,0]=4 10997 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 240690a_100020644852_100000185807 [0,1,0,0,1,0|2,0,0]=4 10998 B14R1.163 O=C(NC[C@H](O)CO)c1ccccc1 527a_100020644852_100000185807 [0,1,0,0,1,0|2,0,0]=4 10999 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000070787_100000211006 [0,1,0,0,1,0|1,0,1]=4 11000 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011215641 [0,1,0,0,1,0|1,0,1]=4 11001 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000070787_200011215302 [0,1,0,0,1,0|1,0,1]=4 11002 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200000210301 [0,1,0,0,1,0|1,0,1]=4 11003 B14R1.420 CC(=O)CCOC(=O)c1ccccc1 1458a_100000070787_100000184176 [0,1,0,0,1,0|0,0,1]=3 11004 B14R1.420 CC(Br)CCOC(C)c1ccccc1 34a_100009893172_100000211855 [0,1,0,0,1,0|1,0,1]=4 11005 B14R1.420 CC(C)CCCC(=O)c1ccccc1 1458a_100000185807_100011214892 [0,1,0,0,1,0|1,0,0]=3 11006 B14R1.420 CC(C)CCNC(=O)c1ccccc1 11a_100000210545_100000185807 [0,1,0,0,1,0|1,0,0]=3 11007 B14R1.420 CC(C)CCNC(=O)c1ccccc1 1626a_100000210545_100000185807 [0,1,0,0,1,0|1,0,0]=3 11008 B14R1.420 CC(C)CCNC(=O)c1ccccc1 240690a_100000210545_100000185807 [0,1,0,0,1,0|1,0,0]=3 11009 B14R1.420 CC(C)CCNC(=O)c1ccccc1 527a_100000210545_100000185807 [0,1,0,0,1,0|1,0,0]=3 11010 B14R1.420 CC(C)CCOC(C)c1ccccc1 34a_100000210254_100000211855 [0,1,0,0,1,0|1,0,1]=4 11011 B14R1.420 CC(C)CCOC(C)c1ccccc1 7a_100000210254_100000230085 [0,1,0,0,1,0|1,0,1]=4 11012 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 34a_100000761318_100000210312 [0,1,0,0,1,0|1,0,1]=4 11013 B14R1.420 CC(C)CCO[C@H](C)c1ccccc1 7a_100000761318_100000210626 [0,1,0,0,1,0|1,0,1]=4 11014 B14R1.420 CC(C)CNNC(=O)c1ccccc1 22a_100000696102_100000185807 [0,1,0,0,1,0|2,0,0]=4 11015 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000210624_100000211460 [0,1,0,0,1,0|2,0,0]=4 11016 B14R1.420 CC(C)CSCC(=O)c1ccccc1 62a_100000211460_100000210760 [0,1,0,0,1,0|2,0,0]=4 11017 B14R1.420 CC(C)NCCC(=O)c1ccccc1 2230a_100138425928_100000750707 [0,1,0,0,1,0|2,0,0]=4 11018 B14R1.420 CC(C)OCCC(=O)c1ccccc1 1458a_100000185807_100000211751 [0,1,0,0,1,0|2,0,0]=4 11019 B14R1.420 CC(C)SCCC(=O)c1ccccc1 1458a_100000185807_100000730970 [0,1,0,0,1,0|2,0,0]=4 11020 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000210206_100000750707 [0,1,0,0,1,0|2,0,0]=4 11021 B14R1.420 CC(C)SCCC(=O)c1ccccc1 62a_100000750707_100000210206 [0,1,0,0,1,0|2,0,0]=4 11022 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000073877_100000210206 [0,1,0,0,1,0|1,0,0]=3 11023 B14R1.420 CC(C)SCOC(=O)c1ccccc1 62a_100000210206_100000073877 [0,1,0,0,1,0|1,0,0]=3 11024 B14R1.420 CC(O)CCCC(=O)c1ccccc1 1458a_100000185807_200000718107 [0,1,0,0,1,0|1,0,0]=3 11025 B14R1.420 CC(O)CCNC(=O)c1ccccc1 240690a_200000755665_100000185807 [0,1,0,0,1,0|1,0,0]=3 11026 B14R1.420 CC(O)CCNC(=O)c1ccccc1 527a_200000755665_100000185807 [0,1,0,0,1,0|1,0,0]=3 11027 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 34a_100000761318_100012276601 [0,1,0,0,1,0|1,0,1]=4 11028 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 7a_100000761318_100012276601 [0,1,0,0,1,0|1,0,1]=4 11029 B14R1.420 CC(O)CNNC(=O)c1ccccc1 22a_200000730056_100000185807 [0,1,0,0,1,0|2,0,0]=4 11030 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100000211460_100011218427 [0,1,0,0,1,0|2,0,0]=4 11031 B14R1.420 CC(O)CSCC(=O)c1ccccc1 62a_100011218427_100000211460 [0,1,0,0,1,0|2,0,0]=4 11032 B14R1.420 CC(OCC[C@@H](C)N)c1ccccc1 34a_100000706166_100000211855 [0,1,0,0,1,0|1,0,1]=4 11033 B14R1.420 CN(C)CCCC(=O)c1ccccc1 1458a_100000185807_100000695564 [0,1,0,0,1,0|2,0,0]=4 11034 B14R1.420 CN(C)CCCC(=O)c1ccccc1 2230a_100102631434_100000211006 [0,1,0,0,1,0|2,0,0]=4 11035 B14R1.420 CN(C)CCCC(=O)c1ccccc1 269982a_100102631434_100000211006 [0,1,0,0,1,0|2,0,0]=4 11036 B14R1.420 CN(C)CCNC(=O)c1ccccc1 240690a_100000210585_100000185807 [0,1,0,0,1,0|2,0,0]=4 11037 B14R1.420 CN(C)CCNC(=O)c1ccccc1 269982a_100102631434_200011215302 [0,1,0,0,1,0|2,0,0]=4 11038 B14R1.420 CN(C)CCNC(=O)c1ccccc1 527a_100000210585_100000185807 [0,1,0,0,1,0|2,0,0]=4 11039 B14R1.420 CN(C)CCOC(=O)c1ccccc1 269982a_100102631434_100009812718 [0,1,0,0,1,0|1,0,0]=3 11040 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100000211460_100009817552 [0,1,0,0,1,0|2,0,0]=4 11041 B14R1.420 C[C@@H](O)CSCC(=O)c1ccccc1 62a_100009817552_100000211460 [0,1,0,0,1,0|2,0,0]=4 11042 B14R1.420 [13CH3]C(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200025704644 [0,1,0,0,1,0|1,0,1]=4 11043 B14R1.1035 CCCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210326 [0,1,0,0,1,0|1,0,0]=3 11044 B14R1.1035 CCCCCC(=O)c1ccccc1C 1458a_100000212026_100000210326 [0,1,0,0,1,0|1,0,0]=3 11045 B14R1.1035 CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210326 [0,1,0,0,1,0|1,0,0]=3 11046 B14R1.1035 CCCCCC(=O)c1ccccc1F 1458a_100000188656_100000210326 [0,1,0,0,1,0|1,0,0]=3 11047 B14R1.1035 CCCCCC(=O)c1ccccc1I 1458a_100000187884_100000210326 [0,1,0,0,1,0|1,0,0]=3 11048 B14R1.1035 CCCCCC(=O)c1ccccc1O 1458a_100015234032_100000210326 [0,1,0,0,1,0|1,0,0]=3 11049 B14R1.1035 CCCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210326 [0,1,0,0,1,0|1,0,0]=3 11050 B14R1.1035 CCCCNC(=O)c1ccccc1Br 11a_100000102301_100000188424 [0,1,0,0,1,0|1,0,0]=3 11051 B14R1.1035 CCCCNC(=O)c1ccccc1Br 1626a_100000102301_100000188424 [0,1,0,0,1,0|1,0,0]=3 11052 B14R1.1035 CCCCNC(=O)c1ccccc1Br 240690a_100000102301_100000188424 [0,1,0,0,1,0|1,0,0]=3 11053 B14R1.1035 CCCCNC(=O)c1ccccc1Br 527a_100000102301_100000188424 [0,1,0,0,1,0|1,0,0]=3 11054 B14R1.1035 CCCCNC(=O)c1ccccc1C 11a_100000102301_100000212026 [0,1,0,0,1,0|1,0,0]=3 11055 B14R1.1035 CCCCNC(=O)c1ccccc1C 1626a_100000102301_100000212026 [0,1,0,0,1,0|1,0,0]=3 11056 B14R1.1035 CCCCNC(=O)c1ccccc1C 240690a_100000102301_100000212026 [0,1,0,0,1,0|1,0,0]=3 11057 B14R1.1035 CCCCNC(=O)c1ccccc1C 527a_100000102301_100000212026 [0,1,0,0,1,0|1,0,0]=3 11058 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 11a_100000102301_100000185844 [0,1,0,0,1,0|1,0,0]=3 11059 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 1626a_100000102301_100000185844 [0,1,0,0,1,0|1,0,0]=3 11060 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 240690a_100000102301_100000185844 [0,1,0,0,1,0|1,0,0]=3 11061 B14R1.1035 CCCCNC(=O)c1ccccc1Cl 527a_100000102301_100000185844 [0,1,0,0,1,0|1,0,0]=3 11062 B14R1.1035 CCCCNC(=O)c1ccccc1F 11a_100000102301_100000188656 [0,1,0,0,1,0|1,0,0]=3 11063 B14R1.1035 CCCCNC(=O)c1ccccc1F 1626a_100000102301_100000188656 [0,1,0,0,1,0|1,0,0]=3 11064 B14R1.1035 CCCCNC(=O)c1ccccc1F 240690a_100000102301_100000188656 [0,1,0,0,1,0|1,0,0]=3 11065 B14R1.1035 CCCCNC(=O)c1ccccc1F 527a_100000102301_100000188656 [0,1,0,0,1,0|1,0,0]=3 11066 B14R1.1035 CCCCNC(=O)c1ccccc1I 11a_100000102301_100000187884 [0,1,0,0,1,0|1,0,0]=3 11067 B14R1.1035 CCCCNC(=O)c1ccccc1I 1626a_100000102301_100000187884 [0,1,0,0,1,0|1,0,0]=3 11068 B14R1.1035 CCCCNC(=O)c1ccccc1I 240690a_100000102301_100000187884 [0,1,0,0,1,0|1,0,0]=3 11069 B14R1.1035 CCCCNC(=O)c1ccccc1I 527a_100000102301_100000187884 [0,1,0,0,1,0|1,0,0]=3 11070 B14R1.1035 CCCCNC(=O)c1ccccc1O 240690a_100000102301_100015234032 [0,1,0,0,1,0|1,0,0]=3 11071 B14R1.1035 CCCCNC(=O)c1ccccc1O 271570a_203496583355_200000154865 [0,1,0,0,1,0|1,0,0]=3 11072 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 1626a_100000102301_100009911694 [0,1,0,0,1,0|1,0,0]=3 11073 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 240690a_100000102301_100009911694 [0,1,0,0,1,0|1,0,0]=3 11074 B14R1.1035 CCCCNC(=O)c1ccccc1[O-] 527a_100000102301_100009911694 [0,1,0,0,1,0|1,0,0]=3 11075 B14R1.1035 CCCCOC(C)c1ccccc1Br 34a_100000702211_100000210210 [0,1,0,0,1,0|1,0,1]=4 11076 B14R1.1035 CCCCOC(C)c1ccccc1Br 7a_100000702211_100000210211 [0,1,0,0,1,0|1,0,1]=4 11077 B14R1.1035 CCCCOC(C)c1ccccc1C 34a_100000742021_100000210210 [0,1,0,0,1,0|1,0,1]=4 11078 B14R1.1035 CCCCOC(C)c1ccccc1C 7a_100000742021_100000210211 [0,1,0,0,1,0|1,0,1]=4 11079 B14R1.1035 CCCCOC(C)c1ccccc1Cl 34a_100000740796_100000210210 [0,1,0,0,1,0|1,0,1]=4 11080 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000210227_100000181259 [0,1,0,0,1,0|1,0,1]=4 11081 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000740796_100000210211 [0,1,0,0,1,0|1,0,1]=4 11082 B14R1.1035 CCCCOC(C)c1ccccc1F 34a_100000210227_200000741388 [0,1,0,0,1,0|1,0,1]=4 11083 B14R1.1035 CCCCOC(C)c1ccccc1F 34a_100000697922_100000210210 [0,1,0,0,1,0|1,0,1]=4 11084 B14R1.1035 CCCCOC(C)c1ccccc1F 7a_100000210227_200000741388 [0,1,0,0,1,0|1,0,1]=4 11085 B14R1.1035 CCCCOC(C)c1ccccc1F 7a_100000697922_100000210211 [0,1,0,0,1,0|1,0,1]=4 11086 B14R1.1035 CCCCOC(C)c1ccccc1N 7a_100011405641_100000210211 [0,1,0,0,1,0|1,0,1]=4 11087 B14R1.1035 CCCNNC(=O)c1ccccc1Br 22a_100000740057_100000188424 [0,1,0,0,1,0|2,0,0]=4 11088 B14R1.1035 CCCNNC(=O)c1ccccc1C 22a_100000740057_100000212026 [0,1,0,0,1,0|2,0,0]=4 11089 B14R1.1035 CCCNNC(=O)c1ccccc1Cl 22a_100000740057_100000185844 [0,1,0,0,1,0|2,0,0]=4 11090 B14R1.1035 CCCNNC(=O)c1ccccc1F 22a_100000740057_100000188656 [0,1,0,0,1,0|2,0,0]=4 11091 B14R1.1035 CCCNNC(=O)c1ccccc1I 22a_100000740057_100000187884 [0,1,0,0,1,0|2,0,0]=4 11092 B14R1.1035 CCCNNC(=O)c1ccccc1O 22a_100000740057_100015234032 [0,1,0,0,1,0|2,0,0]=4 11093 B14R1.1035 CCCNNC(=O)c1ccccc1[O-] 22a_100000740057_100009911694 [0,1,0,0,1,0|2,0,0]=4 11094 B14R1.1035 CCCOCC(=O)c1ccccc1Br 34a_100000210258_100000199116 [0,1,0,0,1,0|2,0,0]=4 11095 B14R1.1035 CCCOCC(=O)c1ccccc1C 34a_100000210258_100000741374 [0,1,0,0,1,0|2,0,0]=4 11096 B14R1.1035 CCCOCC(=O)c1ccccc1Cl 34a_100000210258_100000211432 [0,1,0,0,1,0|2,0,0]=4 11097 B14R1.1035 CCCOCC(=O)c1ccccc1F 34a_100000210258_100000204681 [0,1,0,0,1,0|2,0,0]=4 11098 B14R1.1035 CCCSCC(=O)c1ccccc1Br 62a_100000199116_100000210303 [0,1,0,0,1,0|2,0,0]=4 11099 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000210303_100000741374 [0,1,0,0,1,0|2,0,0]=4 11100 B14R1.1035 CCCSCC(=O)c1ccccc1C 62a_100000741374_100000210303 [0,1,0,0,1,0|2,0,0]=4 11101 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000210303_100000211432 [0,1,0,0,1,0|2,0,0]=4 11102 B14R1.1035 CCCSCC(=O)c1ccccc1Cl 62a_100000211432_100000210303 [0,1,0,0,1,0|2,0,0]=4 11103 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000204681_100000210303 [0,1,0,0,1,0|2,0,0]=4 11104 B14R1.1035 CCCSCC(=O)c1ccccc1F 62a_100000210303_100000204681 [0,1,0,0,1,0|2,0,0]=4 11105 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000188908_100000210303 [0,1,0,0,1,0|2,0,0]=4 11106 B14R1.1035 CCCSCC(=O)c1ccccc1O 62a_100000210303_100000188908 [0,1,0,0,1,0|2,0,0]=4 11107 B14R1.1035 CCNCCC(=O)c1ccccc1F 2230a_100015525214_100000086012 [0,1,0,0,1,0|2,0,0]=4 11108 B14R1.1035 CCOCCC(=O)c1ccccc1Br 1458a_100000188424_100011215890 [0,1,0,0,1,0|2,0,0]=4 11109 B14R1.1035 CCOCCC(=O)c1ccccc1C 1458a_100000212026_100011215890 [0,1,0,0,1,0|2,0,0]=4 11110 B14R1.1035 CCOCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215890 [0,1,0,0,1,0|2,0,0]=4 11111 B14R1.1035 CCOCCC(=O)c1ccccc1F 1458a_100000188656_100011215890 [0,1,0,0,1,0|2,0,0]=4 11112 B14R1.1035 CCOCCC(=O)c1ccccc1I 1458a_100000187884_100011215890 [0,1,0,0,1,0|2,0,0]=4 11113 B14R1.1035 CCOCCC(=O)c1ccccc1O 1458a_100015234032_100011215890 [0,1,0,0,1,0|2,0,0]=4 11114 B14R1.1035 CCOCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215890 [0,1,0,0,1,0|2,0,0]=4 11115 B14R1.1035 CCSCCC(=O)c1ccccc1Br 1458a_100000188424_100000757381 [0,1,0,0,1,0|2,0,0]=4 11116 B14R1.1035 CCSCCC(=O)c1ccccc1C 1458a_100000212026_100000757381 [0,1,0,0,1,0|2,0,0]=4 11117 B14R1.1035 CCSCCC(=O)c1ccccc1Cl 1458a_100000185844_100000757381 [0,1,0,0,1,0|2,0,0]=4 11118 B14R1.1035 CCSCCC(=O)c1ccccc1F 1458a_100000188656_100000757381 [0,1,0,0,1,0|2,0,0]=4 11119 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000086012_100000210202 [0,1,0,0,1,0|2,0,0]=4 11120 B14R1.1035 CCSCCC(=O)c1ccccc1F 62a_100000210202_100000086012 [0,1,0,0,1,0|2,0,0]=4 11121 B14R1.1035 CCSCCC(=O)c1ccccc1I 1458a_100000187884_100000757381 [0,1,0,0,1,0|2,0,0]=4 11122 B14R1.1035 CCSCCC(=O)c1ccccc1O 1458a_100015234032_100000757381 [0,1,0,0,1,0|2,0,0]=4 11123 B14R1.1035 CCSCCC(=O)c1ccccc1O 62a_100000210202_100009873196 [0,1,0,0,1,0|2,0,0]=4 11124 B14R1.1035 CCSCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000757381 [0,1,0,0,1,0|2,0,0]=4 11125 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 2230a_100000737833_200000210301 [0,1,0,0,1,0|2,0,0]=4 11126 B14R1.1035 CNCCNC(=O)c1ccccc1Cl 34a_100000737833_200000210301 [0,1,0,0,1,0|2,0,0]=4 11127 B14R1.1035 COCCCC(=O)c1ccccc1Br 1458a_100000188424_100000740836 [0,1,0,0,1,0|2,0,0]=4 11128 B14R1.1035 COCCCC(=O)c1ccccc1C 1458a_100000212026_100000740836 [0,1,0,0,1,0|2,0,0]=4 11129 B14R1.1035 COCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000740836 [0,1,0,0,1,0|2,0,0]=4 11130 B14R1.1035 COCCCC(=O)c1ccccc1F 1458a_100000188656_100000740836 [0,1,0,0,1,0|2,0,0]=4 11131 B14R1.1035 COCCCC(=O)c1ccccc1I 1458a_100000187884_100000740836 [0,1,0,0,1,0|2,0,0]=4 11132 B14R1.1035 COCCCC(=O)c1ccccc1O 1458a_100015234032_100000740836 [0,1,0,0,1,0|2,0,0]=4 11133 B14R1.1035 COCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000740836 [0,1,0,0,1,0|2,0,0]=4 11134 B14R1.1035 COCCNC(=O)c1ccccc1Br 1626a_100000209980_100000188424 [0,1,0,0,1,0|2,0,0]=4 11135 B14R1.1035 COCCNC(=O)c1ccccc1Br 240690a_100000209980_100000188424 [0,1,0,0,1,0|2,0,0]=4 11136 B14R1.1035 COCCNC(=O)c1ccccc1Br 34a_200000158863_200000210301 [0,1,0,0,1,0|2,0,0]=4 11137 B14R1.1035 COCCNC(=O)c1ccccc1Br 527a_100000209980_100000188424 [0,1,0,0,1,0|2,0,0]=4 11138 B14R1.1035 COCCNC(=O)c1ccccc1Br 7a_200000158863_200000210301 [0,1,0,0,1,0|2,0,0]=4 11139 B14R1.1035 COCCNC(=O)c1ccccc1C 1626a_100000209980_100000212026 [0,1,0,0,1,0|2,0,0]=4 11140 B14R1.1035 COCCNC(=O)c1ccccc1C 240690a_100000209980_100000212026 [0,1,0,0,1,0|2,0,0]=4 11141 B14R1.1035 COCCNC(=O)c1ccccc1C 527a_100000209980_100000212026 [0,1,0,0,1,0|2,0,0]=4 11142 B14R1.1035 COCCNC(=O)c1ccccc1Cl 1626a_100000209980_100000185844 [0,1,0,0,1,0|2,0,0]=4 11143 B14R1.1035 COCCNC(=O)c1ccccc1Cl 240690a_100000209980_100000185844 [0,1,0,0,1,0|2,0,0]=4 11144 B14R1.1035 COCCNC(=O)c1ccccc1Cl 527a_100000209980_100000185844 [0,1,0,0,1,0|2,0,0]=4 11145 B14R1.1035 COCCNC(=O)c1ccccc1F 1626a_100000209980_100000188656 [0,1,0,0,1,0|2,0,0]=4 11146 B14R1.1035 COCCNC(=O)c1ccccc1F 240690a_100000209980_100000188656 [0,1,0,0,1,0|2,0,0]=4 11147 B14R1.1035 COCCNC(=O)c1ccccc1F 527a_100000209980_100000188656 [0,1,0,0,1,0|2,0,0]=4 11148 B14R1.1035 COCCNC(=O)c1ccccc1I 1626a_100000209980_100000187884 [0,1,0,0,1,0|2,0,0]=4 11149 B14R1.1035 COCCNC(=O)c1ccccc1I 240690a_100000209980_100000187884 [0,1,0,0,1,0|2,0,0]=4 11150 B14R1.1035 COCCNC(=O)c1ccccc1I 527a_100000209980_100000187884 [0,1,0,0,1,0|2,0,0]=4 11151 B14R1.1035 COCCNC(=O)c1ccccc1O 240690a_100000209980_100015234032 [0,1,0,0,1,0|2,0,0]=4 11152 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 1626a_100000209980_100009911694 [0,1,0,0,1,0|2,0,0]=4 11153 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 240690a_100000209980_100009911694 [0,1,0,0,1,0|2,0,0]=4 11154 B14R1.1035 COCCNC(=O)c1ccccc1[O-] 527a_100000209980_100009911694 [0,1,0,0,1,0|2,0,0]=4 11155 B14R1.1035 CSCCNC(=O)c1ccccc1Br 11a_100020590264_100000188424 [0,1,0,0,1,0|2,0,0]=4 11156 B14R1.1035 CSCCNC(=O)c1ccccc1Br 1626a_100020590264_100000188424 [0,1,0,0,1,0|2,0,0]=4 11157 B14R1.1035 CSCCNC(=O)c1ccccc1Br 240690a_100020590264_100000188424 [0,1,0,0,1,0|2,0,0]=4 11158 B14R1.1035 CSCCNC(=O)c1ccccc1Br 527a_100020590264_100000188424 [0,1,0,0,1,0|2,0,0]=4 11159 B14R1.1035 CSCCNC(=O)c1ccccc1C 11a_100020590264_100000212026 [0,1,0,0,1,0|2,0,0]=4 11160 B14R1.1035 CSCCNC(=O)c1ccccc1C 1626a_100020590264_100000212026 [0,1,0,0,1,0|2,0,0]=4 11161 B14R1.1035 CSCCNC(=O)c1ccccc1C 240690a_100020590264_100000212026 [0,1,0,0,1,0|2,0,0]=4 11162 B14R1.1035 CSCCNC(=O)c1ccccc1C 527a_100020590264_100000212026 [0,1,0,0,1,0|2,0,0]=4 11163 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 11a_100020590264_100000185844 [0,1,0,0,1,0|2,0,0]=4 11164 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 1626a_100020590264_100000185844 [0,1,0,0,1,0|2,0,0]=4 11165 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 240690a_100020590264_100000185844 [0,1,0,0,1,0|2,0,0]=4 11166 B14R1.1035 CSCCNC(=O)c1ccccc1Cl 527a_100020590264_100000185844 [0,1,0,0,1,0|2,0,0]=4 11167 B14R1.1035 CSCCNC(=O)c1ccccc1F 11a_100020590264_100000188656 [0,1,0,0,1,0|2,0,0]=4 11168 B14R1.1035 CSCCNC(=O)c1ccccc1F 1626a_100020590264_100000188656 [0,1,0,0,1,0|2,0,0]=4 11169 B14R1.1035 CSCCNC(=O)c1ccccc1F 240690a_100020590264_100000188656 [0,1,0,0,1,0|2,0,0]=4 11170 B14R1.1035 CSCCNC(=O)c1ccccc1F 527a_100020590264_100000188656 [0,1,0,0,1,0|2,0,0]=4 11171 B14R1.1035 CSCCNC(=O)c1ccccc1I 11a_100020590264_100000187884 [0,1,0,0,1,0|2,0,0]=4 11172 B14R1.1035 CSCCNC(=O)c1ccccc1I 1626a_100020590264_100000187884 [0,1,0,0,1,0|2,0,0]=4 11173 B14R1.1035 CSCCNC(=O)c1ccccc1I 240690a_100020590264_100000187884 [0,1,0,0,1,0|2,0,0]=4 11174 B14R1.1035 CSCCNC(=O)c1ccccc1I 527a_100020590264_100000187884 [0,1,0,0,1,0|2,0,0]=4 11175 B14R1.1035 CSCCNC(=O)c1ccccc1O 240690a_100020590264_100015234032 [0,1,0,0,1,0|2,0,0]=4 11176 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 1626a_100020590264_100009911694 [0,1,0,0,1,0|2,0,0]=4 11177 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 240690a_100020590264_100009911694 [0,1,0,0,1,0|2,0,0]=4 11178 B14R1.1035 CSCCNC(=O)c1ccccc1[O-] 527a_100020590264_100009911694 [0,1,0,0,1,0|2,0,0]=4 11179 B14R1.1035 Cc1ccccc1C(=O)CCCCF 1458a_100000212026_100000729493 [0,1,0,0,1,0|2,0,0]=4 11180 B14R1.1035 Cc1ccccc1C(=O)CCCCO 1458a_100000212026_100000210776 [0,1,0,0,1,0|2,0,0]=4 11181 B14R1.1035 Cc1ccccc1C(=O)NCCCF 11a_100015189416_100000212026 [0,1,0,0,1,0|2,0,0]=4 11182 B14R1.1035 Cc1ccccc1C(=O)NCCCF 1626a_100015189416_100000212026 [0,1,0,0,1,0|2,0,0]=4 11183 B14R1.1035 Cc1ccccc1C(=O)NCCCF 240690a_100015189416_100000212026 [0,1,0,0,1,0|2,0,0]=4 11184 B14R1.1035 Cc1ccccc1C(=O)NCCCF 527a_100015189416_100000212026 [0,1,0,0,1,0|2,0,0]=4 11185 B14R1.1035 Cc1ccccc1C(=O)NCCCO 240690a_100000182051_100000212026 [0,1,0,0,1,0|2,0,0]=4 11186 B14R1.1035 Cc1ccccc1C(=O)NCCCO 527a_100000182051_100000212026 [0,1,0,0,1,0|2,0,0]=4 11187 B14R1.1035 O=C(CCCCF)c1ccccc1Br 1458a_100000188424_100000729493 [0,1,0,0,1,0|2,0,0]=4 11188 B14R1.1035 O=C(CCCCF)c1ccccc1Cl 1458a_100000185844_100000729493 [0,1,0,0,1,0|2,0,0]=4 11189 B14R1.1035 O=C(CCCCF)c1ccccc1F 1458a_100000188656_100000729493 [0,1,0,0,1,0|2,0,0]=4 11190 B14R1.1035 O=C(CCCCF)c1ccccc1I 1458a_100000187884_100000729493 [0,1,0,0,1,0|2,0,0]=4 11191 B14R1.1035 O=C(CCCCF)c1ccccc1O 1458a_100015234032_100000729493 [0,1,0,0,1,0|2,0,0]=4 11192 B14R1.1035 O=C(CCCCF)c1ccccc1[O-] 1458a_100009911694_100000729493 [0,1,0,0,1,0|2,0,0]=4 11193 B14R1.1035 O=C(CCCCO)c1ccccc1Br 1458a_100000188424_100000210776 [0,1,0,0,1,0|2,0,0]=4 11194 B14R1.1035 O=C(CCCCO)c1ccccc1Cl 1458a_100000185844_100000210776 [0,1,0,0,1,0|2,0,0]=4 11195 B14R1.1035 O=C(CCCCO)c1ccccc1F 1458a_100000188656_100000210776 [0,1,0,0,1,0|2,0,0]=4 11196 B14R1.1035 O=C(CCCCO)c1ccccc1I 1458a_100000187884_100000210776 [0,1,0,0,1,0|2,0,0]=4 11197 B14R1.1035 O=C(CCCCO)c1ccccc1O 1458a_100015234032_100000210776 [0,1,0,0,1,0|2,0,0]=4 11198 B14R1.1035 O=C(CCCCO)c1ccccc1[O-] 1458a_100009911694_100000210776 [0,1,0,0,1,0|2,0,0]=4 11199 B14R1.1035 O=C(NCCCF)c1ccccc1Br 11a_100015189416_100000188424 [0,1,0,0,1,0|2,0,0]=4 11200 B14R1.1035 O=C(NCCCF)c1ccccc1Br 1626a_100015189416_100000188424 [0,1,0,0,1,0|2,0,0]=4 11201 B14R1.1035 O=C(NCCCF)c1ccccc1Br 240690a_100015189416_100000188424 [0,1,0,0,1,0|2,0,0]=4 11202 B14R1.1035 O=C(NCCCF)c1ccccc1Br 527a_100015189416_100000188424 [0,1,0,0,1,0|2,0,0]=4 11203 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 11a_100015189416_100000185844 [0,1,0,0,1,0|2,0,0]=4 11204 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 1626a_100015189416_100000185844 [0,1,0,0,1,0|2,0,0]=4 11205 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 240690a_100015189416_100000185844 [0,1,0,0,1,0|2,0,0]=4 11206 B14R1.1035 O=C(NCCCF)c1ccccc1Cl 527a_100015189416_100000185844 [0,1,0,0,1,0|2,0,0]=4 11207 B14R1.1035 O=C(NCCCF)c1ccccc1F 11a_100015189416_100000188656 [0,1,0,0,1,0|2,0,0]=4 11208 B14R1.1035 O=C(NCCCF)c1ccccc1F 1626a_100015189416_100000188656 [0,1,0,0,1,0|2,0,0]=4 11209 B14R1.1035 O=C(NCCCF)c1ccccc1F 240690a_100015189416_100000188656 [0,1,0,0,1,0|2,0,0]=4 11210 B14R1.1035 O=C(NCCCF)c1ccccc1F 527a_100015189416_100000188656 [0,1,0,0,1,0|2,0,0]=4 11211 B14R1.1035 O=C(NCCCF)c1ccccc1I 11a_100015189416_100000187884 [0,1,0,0,1,0|2,0,0]=4 11212 B14R1.1035 O=C(NCCCF)c1ccccc1I 1626a_100015189416_100000187884 [0,1,0,0,1,0|2,0,0]=4 11213 B14R1.1035 O=C(NCCCF)c1ccccc1I 240690a_100015189416_100000187884 [0,1,0,0,1,0|2,0,0]=4 11214 B14R1.1035 O=C(NCCCF)c1ccccc1I 527a_100015189416_100000187884 [0,1,0,0,1,0|2,0,0]=4 11215 B14R1.1035 O=C(NCCCF)c1ccccc1O 240690a_100015189416_100015234032 [0,1,0,0,1,0|2,0,0]=4 11216 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 1626a_100015189416_100009911694 [0,1,0,0,1,0|2,0,0]=4 11217 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 240690a_100015189416_100009911694 [0,1,0,0,1,0|2,0,0]=4 11218 B14R1.1035 O=C(NCCCF)c1ccccc1[O-] 527a_100015189416_100009911694 [0,1,0,0,1,0|2,0,0]=4 11219 B14R1.1035 O=C(NCCCO)c1ccccc1Br 240690a_100000182051_100000188424 [0,1,0,0,1,0|2,0,0]=4 11220 B14R1.1035 O=C(NCCCO)c1ccccc1Br 527a_100000182051_100000188424 [0,1,0,0,1,0|2,0,0]=4 11221 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 240690a_100000182051_100000185844 [0,1,0,0,1,0|2,0,0]=4 11222 B14R1.1035 O=C(NCCCO)c1ccccc1Cl 527a_100000182051_100000185844 [0,1,0,0,1,0|2,0,0]=4 11223 B14R1.1035 O=C(NCCCO)c1ccccc1F 240690a_100000182051_100000188656 [0,1,0,0,1,0|2,0,0]=4 11224 B14R1.1035 O=C(NCCCO)c1ccccc1F 527a_100000182051_100000188656 [0,1,0,0,1,0|2,0,0]=4 11225 B14R1.1035 O=C(NCCCO)c1ccccc1I 240690a_100000182051_100000187884 [0,1,0,0,1,0|2,0,0]=4 11226 B14R1.1035 O=C(NCCCO)c1ccccc1I 527a_100000182051_100000187884 [0,1,0,0,1,0|2,0,0]=4 11227 B14R1.1035 O=C(NCCCO)c1ccccc1O 240690a_100000182051_100015234032 [0,1,0,0,1,0|2,0,0]=4 11228 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 240690a_100000182051_100009911694 [0,1,0,0,1,0|2,0,0]=4 11229 B14R1.1035 O=C(NCCCO)c1ccccc1[O-] 527a_100000182051_100009911694 [0,1,0,0,1,0|2,0,0]=4 11230 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 2230a_100000737833_200025704644 [0,1,0,0,1,0|2,0,0]=4 11231 B14R1.1035 [13CH3]NCCNC(=O)c1ccccc1Cl 34a_100000737833_200025704644 [0,1,0,0,1,0|2,0,0]=4 11232 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 34a_200000158863_200025704644 [0,1,0,0,1,0|2,0,0]=4 11233 B14R1.1035 [13CH3]OCCNC(=O)c1ccccc1Br 7a_200000158863_200025704644 [0,1,0,0,1,0|2,0,0]=4 11234 B14R1.92 CCCCC=CC(=O)Cc1ccsc1 1458a_100016266645_100011233845 [0,1,0,0,1,0|2,0,0]=4 11235 B14R1.92 CCCCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210757 [0,1,0,0,1,0|2,0,0]=4 11236 B14R1.92 CCCCCCC(=O)Cc1ccco1 1458a_100011217309_100000210757 [0,1,0,0,1,0|2,0,0]=4 11237 B14R1.92 CCCCCCC(=O)Cc1cccs1 1458a_100000210189_100000210757 [0,1,0,0,1,0|2,0,0]=4 11238 B14R1.92 CCCCCCC(=O)Cc1ccoc1 1458a_100000684892_100000210757 [0,1,0,0,1,0|2,0,0]=4 11239 B14R1.92 CCCCCCC(=O)Cc1ccsc1 1458a_100000184062_100000210757 [0,1,0,0,1,0|2,0,0]=4 11240 B14R1.92 CCCCCCC(=O)Cc1ccsc1 1458a_100102632555_100011233845 [0,1,0,0,1,0|2,0,0]=4 11241 B14R1.92 CCCCCCC(=O)Cn1cccc1 1458a_100011196272_100000210757 [0,1,0,0,1,0|2,0,0]=4 11242 B14R1.92 CCCCCNC(=O)Cc1ccc[nH]1 11a_100000209983_100000238377 [0,1,0,0,1,0|2,0,0]=4 11243 B14R1.92 CCCCCNC(=O)Cc1ccc[nH]1 240690a_100000209983_100000238377 [0,1,0,0,1,0|2,0,0]=4 11244 B14R1.92 CCCCCNC(=O)Cc1ccc[nH]1 527a_100000209983_100000238377 [0,1,0,0,1,0|2,0,0]=4 11245 B14R1.92 CCCCCNC(=O)Cc1ccco1 11a_100000209983_100011217309 [0,1,0,0,1,0|2,0,0]=4 11246 B14R1.92 CCCCCNC(=O)Cc1ccco1 527a_100000209983_100011217309 [0,1,0,0,1,0|2,0,0]=4 11247 B14R1.92 CCCCCNC(=O)Cc1cccs1 11a_100000209983_100000210189 [0,1,0,0,1,0|2,0,0]=4 11248 B14R1.92 CCCCCNC(=O)Cc1cccs1 1626a_100000209983_100000210189 [0,1,0,0,1,0|2,0,0]=4 11249 B14R1.92 CCCCCNC(=O)Cc1cccs1 240690a_100000209983_100000210189 [0,1,0,0,1,0|2,0,0]=4 11250 B14R1.92 CCCCCNC(=O)Cc1ccoc1 11a_100000209983_100000684892 [0,1,0,0,1,0|2,0,0]=4 11251 B14R1.92 CCCCCNC(=O)Cc1ccoc1 1626a_100000209983_100000684892 [0,1,0,0,1,0|2,0,0]=4 11252 B14R1.92 CCCCCNC(=O)Cc1ccoc1 240690a_100000209983_100000684892 [0,1,0,0,1,0|2,0,0]=4 11253 B14R1.92 CCCCCNC(=O)Cc1ccoc1 527a_100000209983_100000684892 [0,1,0,0,1,0|2,0,0]=4 11254 B14R1.92 CCCCCNC(=O)Cc1ccsc1 11a_100000209983_100000184062 [0,1,0,0,1,0|2,0,0]=4 11255 B14R1.92 CCCCCNC(=O)Cc1ccsc1 1626a_100000209983_100000184062 [0,1,0,0,1,0|2,0,0]=4 11256 B14R1.92 CCCCCNC(=O)Cc1ccsc1 240690a_100000209983_100000184062 [0,1,0,0,1,0|2,0,0]=4 11257 B14R1.92 CCCCCNC(=O)Cc1ccsc1 527a_100000209983_100000184062 [0,1,0,0,1,0|2,0,0]=4 11258 B14R1.92 CCCCCNC(=O)Cn1cccc1 11a_100000209983_100011196272 [0,1,0,0,1,0|2,0,0]=4 11259 B14R1.92 CCCCCNC(=O)Cn1cccc1 1626a_100000209983_100011196272 [0,1,0,0,1,0|2,0,0]=4 11260 B14R1.92 CCCCCNC(=O)Cn1cccc1 527a_100000209983_100011196272 [0,1,0,0,1,0|2,0,0]=4 11261 B14R1.92 CCCCNNC(=O)Cc1ccc[nH]1 22a_100025702795_100000238377 [0,1,0,0,1,0|2,0,0]=4 11262 B14R1.92 CCCCNNC(=O)Cc1ccco1 22a_100025702795_100011217309 [0,1,0,0,1,0|2,0,0]=4 11263 B14R1.92 CCCCNNC(=O)Cc1cccs1 22a_100025702795_100000210189 [0,1,0,0,1,0|2,0,0]=4 11264 B14R1.92 CCCCNNC(=O)Cc1ccoc1 22a_100025702795_100000684892 [0,1,0,0,1,0|2,0,0]=4 11265 B14R1.92 CCCCNNC(=O)Cc1ccsc1 22a_100025702795_100000184062 [0,1,0,0,1,0|2,0,0]=4 11266 B14R1.92 CCCCNNC(=O)Cn1cccc1 22a_100025702795_100011196272 [0,1,0,0,1,0|2,0,0]=4 11267 B14R1.92 CCCCOCC(=O)Cc1c[nH]cn1 1458a_100000757543_100000707719 [0,1,0,0,1,0|2,0,0]=4 11268 B14R1.92 CCCCOCC(=O)Cc1c[nH]cn1 1458a_100015291406_100011995733 [0,1,0,0,1,0|2,0,0]=4 11269 B14R1.92 CCCCOCC(=O)Cc1ccc[nH]1 1458a_100000238377_100011995733 [0,1,0,0,1,0|1,0,0]=3 11270 B14R1.92 CCCCOCC(=O)Cc1ccco1 1458a_100011217309_100011995733 [0,1,0,0,1,0|1,0,0]=3 11271 B14R1.92 CCCCOCC(=O)Cc1cccs1 1458a_100000210189_100011995733 [0,1,0,0,1,0|1,0,0]=3 11272 B14R1.92 CCCCOCC(=O)Cc1ccn[nH]1 1458a_100000752941_100011995733 [0,1,0,0,1,0|2,0,0]=4 11273 B14R1.92 CCCCOCC(=O)Cc1ccn[nH]1 1458a_100000757543_100000728653 [0,1,0,0,1,0|2,0,0]=4 11274 B14R1.92 CCCCOCC(=O)Cc1ccoc1 1458a_100000684892_100011995733 [0,1,0,0,1,0|1,0,0]=3 11275 B14R1.92 CCCCOCC(=O)Cc1ccon1 1458a_100000757543_100000234950 [0,1,0,0,1,0|2,0,0]=4 11276 B14R1.92 CCCCOCC(=O)Cc1ccsc1 1458a_100000184062_100011995733 [0,1,0,0,1,0|1,0,0]=3 11277 B14R1.92 CCCCOCC(=O)Cc1ccsc1 1458a_100000757543_100011233845 [0,1,0,0,1,0|1,0,0]=3 11278 B14R1.92 CCCCOCC(=O)Cc1cncs1 1458a_100000757543_100015185245 [0,1,0,0,1,0|2,0,0]=4 11279 B14R1.92 CCCCOCC(=O)Cc1cscn1 1458a_100000757543_100000205941 [0,1,0,0,1,0|2,0,0]=4 11280 B14R1.92 CCCCOCC(=O)Cc1cscn1 1458a_100011438297_100011995733 [0,1,0,0,1,0|2,0,0]=4 11281 B14R1.92 CCCCOCC(=O)Cc1ncco1 1458a_100000757543_103436540062 [0,1,0,0,1,0|2,0,0]=4 11282 B14R1.92 CCCCOCC(=O)Cc1nccs1 1458a_100000757543_100015184050 [0,1,0,0,1,0|2,0,0]=4 11283 B14R1.92 CCCCOCC(=O)Cn1cccc1 1458a_100011196272_100011995733 [0,1,0,0,1,0|1,0,0]=3 11284 B14R1.92 CCCCOCC(=O)Cn1cccn1 1458a_100000233772_100011995733 [0,1,0,0,1,0|2,0,0]=4 11285 B14R1.92 CCCCOCC(=O)Cn1ccnc1 1458a_100000739072_100011995733 [0,1,0,0,1,0|2,0,0]=4 11286 B14R1.92 CCCCSCC(=O)Cc1ccsc1 1458a_100000191162_100011233845 [0,1,0,0,1,0|1,1,0]=4 11287 B14R1.92 CCCOCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100011215938 [0,1,0,0,1,0|2,0,0]=4 11288 B14R1.92 CCCOCCC(=O)Cc1ccco1 1458a_100011217309_100011215938 [0,1,0,0,1,0|2,0,0]=4 11289 B14R1.92 CCCOCCC(=O)Cc1cccs1 1458a_100000210189_100011215938 [0,1,0,0,1,0|2,0,0]=4 11290 B14R1.92 CCCOCCC(=O)Cc1ccoc1 1458a_100000684892_100011215938 [0,1,0,0,1,0|2,0,0]=4 11291 B14R1.92 CCCOCCC(=O)Cc1ccsc1 1458a_100000184062_100011215938 [0,1,0,0,1,0|2,0,0]=4 11292 B14R1.92 CCCOCCC(=O)Cn1cccc1 1458a_100011196272_100011215938 [0,1,0,0,1,0|2,0,0]=4 11293 B14R1.92 CCOCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100012232248 [0,1,0,0,1,0|2,0,0]=4 11294 B14R1.92 CCOCCCC(=O)Cc1ccco1 1458a_100011217309_100012232248 [0,1,0,0,1,0|2,0,0]=4 11295 B14R1.92 CCOCCCC(=O)Cc1cccs1 1458a_100000210189_100012232248 [0,1,0,0,1,0|2,0,0]=4 11296 B14R1.92 CCOCCCC(=O)Cc1ccoc1 1458a_100000684892_100012232248 [0,1,0,0,1,0|2,0,0]=4 11297 B14R1.92 CCOCCCC(=O)Cc1ccsc1 1458a_100000184062_100012232248 [0,1,0,0,1,0|2,0,0]=4 11298 B14R1.92 CCOCCCC(=O)Cn1cccc1 1458a_100011196272_100012232248 [0,1,0,0,1,0|2,0,0]=4 11299 B14R1.92 CCOCCNC(=O)Cc1ccc[nH]1 11a_100011200944_100000238377 [0,1,0,0,1,0|2,0,0]=4 11300 B14R1.92 CCOCCNC(=O)Cc1ccc[nH]1 240690a_100011200944_100000238377 [0,1,0,0,1,0|2,0,0]=4 11301 B14R1.92 CCOCCNC(=O)Cc1ccc[nH]1 527a_100011200944_100000238377 [0,1,0,0,1,0|2,0,0]=4 11302 B14R1.92 CCOCCNC(=O)Cc1ccco1 11a_100011200944_100011217309 [0,1,0,0,1,0|2,0,0]=4 11303 B14R1.92 CCOCCNC(=O)Cc1ccco1 527a_100011200944_100011217309 [0,1,0,0,1,0|2,0,0]=4 11304 B14R1.92 CCOCCNC(=O)Cc1cccs1 11a_100011200944_100000210189 [0,1,0,0,1,0|2,0,0]=4 11305 B14R1.92 CCOCCNC(=O)Cc1cccs1 1626a_102516460346_100000210189 [0,1,0,0,1,0|2,0,0]=4 11306 B14R1.92 CCOCCNC(=O)Cc1cccs1 240690a_100011200944_100000210189 [0,1,0,0,1,0|2,0,0]=4 11307 B14R1.92 CCOCCNC(=O)Cc1ccoc1 11a_100011200944_100000684892 [0,1,0,0,1,0|2,0,0]=4 11308 B14R1.92 CCOCCNC(=O)Cc1ccoc1 1626a_102516460346_100000684892 [0,1,0,0,1,0|2,0,0]=4 11309 B14R1.92 CCOCCNC(=O)Cc1ccoc1 240690a_100011200944_100000684892 [0,1,0,0,1,0|2,0,0]=4 11310 B14R1.92 CCOCCNC(=O)Cc1ccoc1 527a_100011200944_100000684892 [0,1,0,0,1,0|2,0,0]=4 11311 B14R1.92 CCOCCNC(=O)Cc1ccsc1 11a_100011200944_100000184062 [0,1,0,0,1,0|2,0,0]=4 11312 B14R1.92 CCOCCNC(=O)Cc1ccsc1 1626a_102516460346_100000184062 [0,1,0,0,1,0|2,0,0]=4 11313 B14R1.92 CCOCCNC(=O)Cc1ccsc1 240690a_100011200944_100000184062 [0,1,0,0,1,0|2,0,0]=4 11314 B14R1.92 CCOCCNC(=O)Cc1ccsc1 527a_100011200944_100000184062 [0,1,0,0,1,0|2,0,0]=4 11315 B14R1.92 CCOCCNC(=O)Cn1cccc1 11a_100011200944_100011196272 [0,1,0,0,1,0|2,0,0]=4 11316 B14R1.92 CCOCCNC(=O)Cn1cccc1 1626a_102516460346_100011196272 [0,1,0,0,1,0|2,0,0]=4 11317 B14R1.92 CCOCCNC(=O)Cn1cccc1 527a_100011200944_100011196272 [0,1,0,0,1,0|2,0,0]=4 11318 B14R1.92 CCSCCNC(=O)Cc1ccc[nH]1 11a_100000106463_100000238377 [0,1,0,0,1,0|2,0,0]=4 11319 B14R1.92 CCSCCNC(=O)Cc1ccc[nH]1 240690a_100000106463_100000238377 [0,1,0,0,1,0|2,0,0]=4 11320 B14R1.92 CCSCCNC(=O)Cc1ccc[nH]1 527a_100000106463_100000238377 [0,1,0,0,1,0|2,0,0]=4 11321 B14R1.92 CCSCCNC(=O)Cc1ccco1 11a_100000106463_100011217309 [0,1,0,0,1,0|2,0,0]=4 11322 B14R1.92 CCSCCNC(=O)Cc1ccco1 527a_100000106463_100011217309 [0,1,0,0,1,0|2,0,0]=4 11323 B14R1.92 CCSCCNC(=O)Cc1cccs1 11a_100000106463_100000210189 [0,1,0,0,1,0|2,0,0]=4 11324 B14R1.92 CCSCCNC(=O)Cc1cccs1 1626a_100000106463_100000210189 [0,1,0,0,1,0|2,0,0]=4 11325 B14R1.92 CCSCCNC(=O)Cc1cccs1 240690a_100000106463_100000210189 [0,1,0,0,1,0|2,0,0]=4 11326 B14R1.92 CCSCCNC(=O)Cc1ccoc1 11a_100000106463_100000684892 [0,1,0,0,1,0|2,0,0]=4 11327 B14R1.92 CCSCCNC(=O)Cc1ccoc1 1626a_100000106463_100000684892 [0,1,0,0,1,0|2,0,0]=4 11328 B14R1.92 CCSCCNC(=O)Cc1ccoc1 240690a_100000106463_100000684892 [0,1,0,0,1,0|2,0,0]=4 11329 B14R1.92 CCSCCNC(=O)Cc1ccoc1 527a_100000106463_100000684892 [0,1,0,0,1,0|2,0,0]=4 11330 B14R1.92 CCSCCNC(=O)Cc1ccsc1 11a_100000106463_100000184062 [0,1,0,0,1,0|2,0,0]=4 11331 B14R1.92 CCSCCNC(=O)Cc1ccsc1 1626a_100000106463_100000184062 [0,1,0,0,1,0|2,0,0]=4 11332 B14R1.92 CCSCCNC(=O)Cc1ccsc1 240690a_100000106463_100000184062 [0,1,0,0,1,0|2,0,0]=4 11333 B14R1.92 CCSCCNC(=O)Cc1ccsc1 527a_100000106463_100000184062 [0,1,0,0,1,0|2,0,0]=4 11334 B14R1.92 CCSCCNC(=O)Cn1cccc1 11a_100000106463_100011196272 [0,1,0,0,1,0|2,0,0]=4 11335 B14R1.92 CCSCCNC(=O)Cn1cccc1 1626a_100000106463_100011196272 [0,1,0,0,1,0|2,0,0]=4 11336 B14R1.92 CCSCCNC(=O)Cn1cccc1 527a_100000106463_100011196272 [0,1,0,0,1,0|2,0,0]=4 11337 B14R1.92 COCCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000755781 [0,1,0,0,1,0|2,0,0]=4 11338 B14R1.92 COCCCCC(=O)Cc1ccco1 1458a_100011217309_100000755781 [0,1,0,0,1,0|2,0,0]=4 11339 B14R1.92 COCCCCC(=O)Cc1cccs1 1458a_100000210189_100000755781 [0,1,0,0,1,0|2,0,0]=4 11340 B14R1.92 COCCCCC(=O)Cc1ccoc1 1458a_100000684892_100000755781 [0,1,0,0,1,0|2,0,0]=4 11341 B14R1.92 COCCCCC(=O)Cc1ccsc1 1458a_100000184062_100000755781 [0,1,0,0,1,0|2,0,0]=4 11342 B14R1.92 COCCCCC(=O)Cn1cccc1 1458a_100011196272_100000755781 [0,1,0,0,1,0|2,0,0]=4 11343 B14R1.92 COCCCNC(=O)Cc1ccc[nH]1 240690a_100150723488_100000238377 [0,1,0,0,1,0|2,0,0]=4 11344 B14R1.92 COCCCNC(=O)Cc1ccc[nH]1 527a_100150723488_100000238377 [0,1,0,0,1,0|2,0,0]=4 11345 B14R1.92 COCCCNC(=O)Cc1ccco1 527a_100150723488_100011217309 [0,1,0,0,1,0|2,0,0]=4 11346 B14R1.92 COCCCNC(=O)Cc1cccs1 1626a_100150723488_100000210189 [0,1,0,0,1,0|2,0,0]=4 11347 B14R1.92 COCCCNC(=O)Cc1cccs1 240690a_100150723488_100000210189 [0,1,0,0,1,0|2,0,0]=4 11348 B14R1.92 COCCCNC(=O)Cc1ccoc1 1626a_100150723488_100000684892 [0,1,0,0,1,0|2,0,0]=4 11349 B14R1.92 COCCCNC(=O)Cc1ccoc1 240690a_100150723488_100000684892 [0,1,0,0,1,0|2,0,0]=4 11350 B14R1.92 COCCCNC(=O)Cc1ccoc1 527a_100150723488_100000684892 [0,1,0,0,1,0|2,0,0]=4 11351 B14R1.92 COCCCNC(=O)Cc1ccsc1 1626a_100150723488_100000184062 [0,1,0,0,1,0|2,0,0]=4 11352 B14R1.92 COCCCNC(=O)Cc1ccsc1 240690a_100150723488_100000184062 [0,1,0,0,1,0|2,0,0]=4 11353 B14R1.92 COCCCNC(=O)Cc1ccsc1 527a_100150723488_100000184062 [0,1,0,0,1,0|2,0,0]=4 11354 B14R1.92 COCCCNC(=O)Cn1cccc1 1626a_100150723488_100011196272 [0,1,0,0,1,0|2,0,0]=4 11355 B14R1.92 COCCCNC(=O)Cn1cccc1 527a_100150723488_100011196272 [0,1,0,0,1,0|2,0,0]=4 11356 B14R1.92 COCCOCC(=O)Cc1ccsc1 1458a_100000211095_100011233845 [0,1,0,0,1,0|2,0,0]=4 11357 B14R1.92 CSCCCNC(=O)Cc1ccc[nH]1 11a_100000749238_100000238377 [0,1,0,0,1,0|2,0,0]=4 11358 B14R1.92 CSCCCNC(=O)Cc1ccc[nH]1 240690a_100000749238_100000238377 [0,1,0,0,1,0|2,0,0]=4 11359 B14R1.92 CSCCCNC(=O)Cc1ccc[nH]1 527a_100000749238_100000238377 [0,1,0,0,1,0|2,0,0]=4 11360 B14R1.92 CSCCCNC(=O)Cc1ccco1 11a_100000749238_100011217309 [0,1,0,0,1,0|2,0,0]=4 11361 B14R1.92 CSCCCNC(=O)Cc1ccco1 527a_100000749238_100011217309 [0,1,0,0,1,0|2,0,0]=4 11362 B14R1.92 CSCCCNC(=O)Cc1cccs1 11a_100000749238_100000210189 [0,1,0,0,1,0|2,0,0]=4 11363 B14R1.92 CSCCCNC(=O)Cc1cccs1 1626a_100000749238_100000210189 [0,1,0,0,1,0|2,0,0]=4 11364 B14R1.92 CSCCCNC(=O)Cc1cccs1 240690a_100000749238_100000210189 [0,1,0,0,1,0|2,0,0]=4 11365 B14R1.92 CSCCCNC(=O)Cc1ccoc1 11a_100000749238_100000684892 [0,1,0,0,1,0|2,0,0]=4 11366 B14R1.92 CSCCCNC(=O)Cc1ccoc1 1626a_100000749238_100000684892 [0,1,0,0,1,0|2,0,0]=4 11367 B14R1.92 CSCCCNC(=O)Cc1ccoc1 240690a_100000749238_100000684892 [0,1,0,0,1,0|2,0,0]=4 11368 B14R1.92 CSCCCNC(=O)Cc1ccoc1 527a_100000749238_100000684892 [0,1,0,0,1,0|2,0,0]=4 11369 B14R1.92 CSCCCNC(=O)Cc1ccsc1 11a_100000749238_100000184062 [0,1,0,0,1,0|2,0,0]=4 11370 B14R1.92 CSCCCNC(=O)Cc1ccsc1 1626a_100000749238_100000184062 [0,1,0,0,1,0|2,0,0]=4 11371 B14R1.92 CSCCCNC(=O)Cc1ccsc1 240690a_100000749238_100000184062 [0,1,0,0,1,0|2,0,0]=4 11372 B14R1.92 CSCCCNC(=O)Cc1ccsc1 527a_100000749238_100000184062 [0,1,0,0,1,0|2,0,0]=4 11373 B14R1.92 CSCCCNC(=O)Cn1cccc1 11a_100000749238_100011196272 [0,1,0,0,1,0|2,0,0]=4 11374 B14R1.92 CSCCCNC(=O)Cn1cccc1 1626a_100000749238_100011196272 [0,1,0,0,1,0|2,0,0]=4 11375 B14R1.92 CSCCCNC(=O)Cn1cccc1 527a_100000749238_100011196272 [0,1,0,0,1,0|2,0,0]=4 11376 B14R1.92 O=C(CCCCCF)Cc1ccc[nH]1 1458a_100000238377_100000729378 [0,1,0,0,1,0|2,0,0]=4 11377 B14R1.92 O=C(CCCCCF)Cc1ccco1 1458a_100011217309_100000729378 [0,1,0,0,1,0|2,0,0]=4 11378 B14R1.92 O=C(CCCCCF)Cc1cccs1 1458a_100000210189_100000729378 [0,1,0,0,1,0|2,0,0]=4 11379 B14R1.92 O=C(CCCCCF)Cc1ccoc1 1458a_100000684892_100000729378 [0,1,0,0,1,0|2,0,0]=4 11380 B14R1.92 O=C(CCCCCF)Cc1ccsc1 1458a_100000184062_100000729378 [0,1,0,0,1,0|2,0,0]=4 11381 B14R1.92 O=C(CCCCCF)Cn1cccc1 1458a_100011196272_100000729378 [0,1,0,0,1,0|2,0,0]=4 11382 B14R1.92 O=C(CCCCCO)Cc1ccc[nH]1 1458a_100000238377_100000746330 [0,1,0,0,1,0|2,0,0]=4 11383 B14R1.92 O=C(CCCCCO)Cc1ccco1 1458a_100011217309_100000746330 [0,1,0,0,1,0|2,0,0]=4 11384 B14R1.92 O=C(CCCCCO)Cc1cccs1 1458a_100000210189_100000746330 [0,1,0,0,1,0|2,0,0]=4 11385 B14R1.92 O=C(CCCCCO)Cc1ccoc1 1458a_100000684892_100000746330 [0,1,0,0,1,0|2,0,0]=4 11386 B14R1.92 O=C(CCCCCO)Cc1ccsc1 1458a_100000184062_100000746330 [0,1,0,0,1,0|2,0,0]=4 11387 B14R1.92 O=C(CCCCCO)Cc1ccsc1 1458a_100102619762_100011233845 [0,1,0,0,1,0|2,0,0]=4 11388 B14R1.92 O=C(CCCCCO)Cn1cccc1 1458a_100011196272_100000746330 [0,1,0,0,1,0|2,0,0]=4 11389 B14R1.92 O=C(Cc1ccc[nH]1)NCCCCO 240690a_100000750430_100000238377 [0,1,0,0,1,0|2,0,0]=4 11390 B14R1.92 O=C(Cc1ccc[nH]1)NCCCCO 527a_100000750430_100000238377 [0,1,0,0,1,0|2,0,0]=4 11391 B14R1.92 O=C(Cc1ccco1)NCCCCO 527a_100000750430_100011217309 [0,1,0,0,1,0|2,0,0]=4 11392 B14R1.92 O=C(Cc1cccs1)NCCCCO 240690a_100000750430_100000210189 [0,1,0,0,1,0|2,0,0]=4 11393 B14R1.92 O=C(Cc1ccoc1)NCCCCO 240690a_100000750430_100000684892 [0,1,0,0,1,0|2,0,0]=4 11394 B14R1.92 O=C(Cc1ccoc1)NCCCCO 527a_100000750430_100000684892 [0,1,0,0,1,0|2,0,0]=4 11395 B14R1.92 O=C(Cc1ccsc1)NCCCCO 240690a_100000750430_100000184062 [0,1,0,0,1,0|2,0,0]=4 11396 B14R1.92 O=C(Cc1ccsc1)NCCCCO 527a_100000750430_100000184062 [0,1,0,0,1,0|2,0,0]=4 11397 B14R1.92 O=C(Cn1cccc1)NCCCCO 527a_100000750430_100011196272 [0,1,0,0,1,0|2,0,0]=4 11398 B14R1.107 CCCCCC(=O)C(C)n1cccc1 1458a_100000243804_100000210326 [0,1,0,0,1,0|2,0,0]=4 11399 B14R1.107 CCCCNC(=O)C(C)n1cccc1 11a_100000102301_100000243804 [0,1,0,0,1,0|2,0,0]=4 11400 B14R1.107 CCCCNC(=O)C(C)n1cccc1 1626a_100000102301_100000243804 [0,1,0,0,1,0|2,0,0]=4 11401 B14R1.107 CCCCNC(=O)C(C)n1cccc1 240690a_100000102301_100000243804 [0,1,0,0,1,0|2,0,0]=4 11402 B14R1.107 CCCCNC(=O)C(C)n1cccc1 527a_100000102301_100000243804 [0,1,0,0,1,0|2,0,0]=4 11403 B14R1.157 CCCCCC(=O)Cc1cc(cs1)Br 1458a_100000212188_100000746031 [0,1,0,0,1,0|2,0,0]=4 11404 B14R1.157 CCCCCC(=O)Cc1cc(cs1)Br 1458a_100011542370_100000210326 [0,1,0,0,1,0|2,0,0]=4 11405 B14R1.157 CCCCCC(=O)Cc1ccc(s1)Br 1458a_100000212188_100000708592 [0,1,0,0,1,0|2,0,0]=4 11406 B14R1.157 CCCCCC(=O)Cc1ccc(s1)Br 1458a_100000238643_100000210326 [0,1,0,0,1,0|2,0,0]=4 11407 B14R1.157 CCCCCC(=O)Cc1ccc(s1)Cl 1458a_100000212188_100000185097 [0,1,0,0,1,0|2,0,0]=4 11408 B14R1.157 CCCCCC(=O)Cc1ccc(s1)Cl 1458a_100000238644_100000210326 [0,1,0,0,1,0|2,0,0]=4 11409 B14R1.157 CCCCNC(=O)Cc1cc(cs1)Br 11a_100000102301_100011542370 [0,1,0,0,1,0|2,0,0]=4 11410 B14R1.157 CCCCNC(=O)Cc1cc(cs1)Br 1626a_100000102301_100011542370 [0,1,0,0,1,0|2,0,0]=4 11411 B14R1.157 CCCCNC(=O)Cc1cc(cs1)Br 240690a_100000102301_100011542370 [0,1,0,0,1,0|2,0,0]=4 11412 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Br 11a_100000102301_100000238643 [0,1,0,0,1,0|2,0,0]=4 11413 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Br 1626a_100000102301_100000238643 [0,1,0,0,1,0|2,0,0]=4 11414 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Cl 11a_100000102301_100000238644 [0,1,0,0,1,0|2,0,0]=4 11415 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Cl 1626a_100000102301_100000238644 [0,1,0,0,1,0|2,0,0]=4 11416 B14R1.157 CCCCNC(=O)Cc1ccc(s1)Cl 240690a_100000102301_100000238644 [0,1,0,0,1,0|2,0,0]=4 11417 B14R1.454 CCCCC(C)C(=O)Cc1ccc[nH]1 1458a_100000238377_200011215066 [0,1,0,0,1,0|2,0,0]=4 11418 B14R1.454 CCCCC(C)C(=O)Cc1ccco1 1458a_100011217309_200011215066 [0,1,0,0,1,0|2,0,0]=4 11419 B14R1.454 CCCCC(C)C(=O)Cc1cccs1 1458a_100000210189_200011215066 [0,1,0,0,1,0|2,0,0]=4 11420 B14R1.454 CCCCC(C)C(=O)Cc1ccoc1 1458a_100000684892_200011215066 [0,1,0,0,1,0|2,0,0]=4 11421 B14R1.454 CCCCC(C)C(=O)Cc1ccsc1 1458a_100000184062_200011215066 [0,1,0,0,1,0|2,0,0]=4 11422 B14R1.454 CCCCC(C)C(=O)Cc1ccsc1 1458a_100000725509_100011233845 [0,1,0,0,1,0|2,0,0]=4 11423 B14R1.454 CCCCC(C)C(=O)Cn1cccc1 1458a_100011196272_200011215066 [0,1,0,0,1,0|2,0,0]=4 11424 B14R1.454 CCCCC(O)C(=O)Cc1ccsc1 1458a_100000720857_100011233845 [0,1,0,0,1,0|2,0,0]=4 11425 B14R1.454 CCCCN(C)C(=O)Cc1ccc[nH]1 11a_100000207549_100000238377 [0,1,0,0,1,0|2,0,0]=4 11426 B14R1.454 CCCCN(C)C(=O)Cc1ccc[nH]1 240690a_100000207549_100000238377 [0,1,0,0,1,0|2,0,0]=4 11427 B14R1.454 CCCCN(C)C(=O)Cc1ccc[nH]1 527a_100000207549_100000238377 [0,1,0,0,1,0|2,0,0]=4 11428 B14R1.454 CCCCN(C)C(=O)Cc1ccco1 11a_100000207549_100011217309 [0,1,0,0,1,0|2,0,0]=4 11429 B14R1.454 CCCCN(C)C(=O)Cc1ccco1 527a_100000207549_100011217309 [0,1,0,0,1,0|2,0,0]=4 11430 B14R1.454 CCCCN(C)C(=O)Cc1cccs1 11a_100000207549_100000210189 [0,1,0,0,1,0|2,0,0]=4 11431 B14R1.454 CCCCN(C)C(=O)Cc1cccs1 1626a_100000207549_100000210189 [0,1,0,0,1,0|2,0,0]=4 11432 B14R1.454 CCCCN(C)C(=O)Cc1cccs1 240690a_100000207549_100000210189 [0,1,0,0,1,0|2,0,0]=4 11433 B14R1.454 CCCCN(C)C(=O)Cc1ccoc1 11a_100000207549_100000684892 [0,1,0,0,1,0|2,0,0]=4 11434 B14R1.454 CCCCN(C)C(=O)Cc1ccoc1 1626a_100000207549_100000684892 [0,1,0,0,1,0|2,0,0]=4 11435 B14R1.454 CCCCN(C)C(=O)Cc1ccoc1 240690a_100000207549_100000684892 [0,1,0,0,1,0|2,0,0]=4 11436 B14R1.454 CCCCN(C)C(=O)Cc1ccoc1 527a_100000207549_100000684892 [0,1,0,0,1,0|2,0,0]=4 11437 B14R1.454 CCCCN(C)C(=O)Cc1ccsc1 11a_100000207549_100000184062 [0,1,0,0,1,0|2,0,0]=4 11438 B14R1.454 CCCCN(C)C(=O)Cc1ccsc1 1626a_100000207549_100000184062 [0,1,0,0,1,0|2,0,0]=4 11439 B14R1.454 CCCCN(C)C(=O)Cc1ccsc1 240690a_100000207549_100000184062 [0,1,0,0,1,0|2,0,0]=4 11440 B14R1.454 CCCCN(C)C(=O)Cc1ccsc1 527a_100000207549_100000184062 [0,1,0,0,1,0|2,0,0]=4 11441 B14R1.454 CCCCN(C)C(=O)Cn1cccc1 11a_100000207549_100011196272 [0,1,0,0,1,0|2,0,0]=4 11442 B14R1.454 CCCCN(C)C(=O)Cn1cccc1 1626a_100000207549_100011196272 [0,1,0,0,1,0|2,0,0]=4 11443 B14R1.454 CCCCN(C)C(=O)Cn1cccc1 527a_100000207549_100011196272 [0,1,0,0,1,0|2,0,0]=4 11444 B14R1.621 CCCC(C)CC(=O)Cc1ccc[nH]1 1458a_100000238377_100011216630 [0,1,0,0,1,0|2,0,0]=4 11445 B14R1.621 CCCC(C)CC(=O)Cc1ccco1 1458a_100011217309_100011216630 [0,1,0,0,1,0|2,0,0]=4 11446 B14R1.621 CCCC(C)CC(=O)Cc1cccs1 1458a_100000210189_100011216630 [0,1,0,0,1,0|2,0,0]=4 11447 B14R1.621 CCCC(C)CC(=O)Cc1ccoc1 1458a_100000684892_100011216630 [0,1,0,0,1,0|2,0,0]=4 11448 B14R1.621 CCCC(C)CC(=O)Cc1ccsc1 1458a_100000184062_100011216630 [0,1,0,0,1,0|2,0,0]=4 11449 B14R1.621 CCCC(C)CC(=O)Cc1ccsc1 1458a_100000748435_100011233845 [0,1,0,0,1,0|2,0,0]=4 11450 B14R1.621 CCCC(C)CC(=O)Cn1cccc1 1458a_100011196272_100011216630 [0,1,0,0,1,0|2,0,0]=4 11451 B14R1.621 CCCC(C)NC(=O)Cc1ccc[nH]1 11a_100000741246_100000238377 [0,1,0,0,1,0|2,0,0]=4 11452 B14R1.621 CCCC(C)NC(=O)Cc1ccc[nH]1 240690a_100000741246_100000238377 [0,1,0,0,1,0|2,0,0]=4 11453 B14R1.621 CCCC(C)NC(=O)Cc1ccc[nH]1 527a_100000741246_100000238377 [0,1,0,0,1,0|2,0,0]=4 11454 B14R1.621 CCCC(C)NC(=O)Cc1ccco1 11a_100000741246_100011217309 [0,1,0,0,1,0|2,0,0]=4 11455 B14R1.621 CCCC(C)NC(=O)Cc1ccco1 527a_100000741246_100011217309 [0,1,0,0,1,0|2,0,0]=4 11456 B14R1.621 CCCC(C)NC(=O)Cc1cccs1 11a_100000741246_100000210189 [0,1,0,0,1,0|2,0,0]=4 11457 B14R1.621 CCCC(C)NC(=O)Cc1cccs1 1626a_100000741246_100000210189 [0,1,0,0,1,0|2,0,0]=4 11458 B14R1.621 CCCC(C)NC(=O)Cc1cccs1 240690a_100000741246_100000210189 [0,1,0,0,1,0|2,0,0]=4 11459 B14R1.621 CCCC(C)NC(=O)Cc1ccoc1 11a_100000741246_100000684892 [0,1,0,0,1,0|2,0,0]=4 11460 B14R1.621 CCCC(C)NC(=O)Cc1ccoc1 1626a_100000741246_100000684892 [0,1,0,0,1,0|2,0,0]=4 11461 B14R1.621 CCCC(C)NC(=O)Cc1ccoc1 240690a_100000741246_100000684892 [0,1,0,0,1,0|2,0,0]=4 11462 B14R1.621 CCCC(C)NC(=O)Cc1ccoc1 527a_100000741246_100000684892 [0,1,0,0,1,0|2,0,0]=4 11463 B14R1.621 CCCC(C)NC(=O)Cc1ccsc1 11a_100000741246_100000184062 [0,1,0,0,1,0|2,0,0]=4 11464 B14R1.621 CCCC(C)NC(=O)Cc1ccsc1 1626a_100000741246_100000184062 [0,1,0,0,1,0|2,0,0]=4 11465 B14R1.621 CCCC(C)NC(=O)Cc1ccsc1 240690a_100000741246_100000184062 [0,1,0,0,1,0|2,0,0]=4 11466 B14R1.621 CCCC(C)NC(=O)Cc1ccsc1 527a_100000741246_100000184062 [0,1,0,0,1,0|2,0,0]=4 11467 B14R1.621 CCCC(C)NC(=O)Cn1cccc1 11a_100000741246_100011196272 [0,1,0,0,1,0|2,0,0]=4 11468 B14R1.621 CCCC(C)NC(=O)Cn1cccc1 1626a_100000741246_100011196272 [0,1,0,0,1,0|2,0,0]=4 11469 B14R1.621 CCCC(C)NC(=O)Cn1cccc1 527a_100000741246_100011196272 [0,1,0,0,1,0|2,0,0]=4 11470 B14R1.731 CCC(C)CCC(=O)Cc1ccsc1 1458a_100000701222_100011233845 [0,1,0,0,1,0|2,0,0]=4 11471 B14R1.731 CCC(C)CNC(=O)Cc1ccc[nH]1 11a_100020588543_100000238377 [0,1,0,0,1,0|2,0,0]=4 11472 B14R1.731 CCC(C)CNC(=O)Cc1ccc[nH]1 240690a_100020588543_100000238377 [0,1,0,0,1,0|2,0,0]=4 11473 B14R1.731 CCC(C)CNC(=O)Cc1ccc[nH]1 527a_100020588543_100000238377 [0,1,0,0,1,0|2,0,0]=4 11474 B14R1.731 CCC(C)CNC(=O)Cc1ccco1 11a_100020588543_100011217309 [0,1,0,0,1,0|2,0,0]=4 11475 B14R1.731 CCC(C)CNC(=O)Cc1ccco1 527a_100020588543_100011217309 [0,1,0,0,1,0|2,0,0]=4 11476 B14R1.731 CCC(C)CNC(=O)Cc1cccs1 11a_100020588543_100000210189 [0,1,0,0,1,0|2,0,0]=4 11477 B14R1.731 CCC(C)CNC(=O)Cc1cccs1 1626a_100020588543_100000210189 [0,1,0,0,1,0|2,0,0]=4 11478 B14R1.731 CCC(C)CNC(=O)Cc1cccs1 240690a_100020588543_100000210189 [0,1,0,0,1,0|2,0,0]=4 11479 B14R1.731 CCC(C)CNC(=O)Cc1ccoc1 11a_100020588543_100000684892 [0,1,0,0,1,0|2,0,0]=4 11480 B14R1.731 CCC(C)CNC(=O)Cc1ccoc1 1626a_100020588543_100000684892 [0,1,0,0,1,0|2,0,0]=4 11481 B14R1.731 CCC(C)CNC(=O)Cc1ccoc1 240690a_100020588543_100000684892 [0,1,0,0,1,0|2,0,0]=4 11482 B14R1.731 CCC(C)CNC(=O)Cc1ccoc1 527a_100020588543_100000684892 [0,1,0,0,1,0|2,0,0]=4 11483 B14R1.731 CCC(C)CNC(=O)Cc1ccsc1 11a_100020588543_100000184062 [0,1,0,0,1,0|2,0,0]=4 11484 B14R1.731 CCC(C)CNC(=O)Cc1ccsc1 1626a_100020588543_100000184062 [0,1,0,0,1,0|2,0,0]=4 11485 B14R1.731 CCC(C)CNC(=O)Cc1ccsc1 240690a_100020588543_100000184062 [0,1,0,0,1,0|2,0,0]=4 11486 B14R1.731 CCC(C)CNC(=O)Cc1ccsc1 527a_100020588543_100000184062 [0,1,0,0,1,0|2,0,0]=4 11487 B14R1.731 CCC(C)CNC(=O)Cn1cccc1 11a_100020588543_100011196272 [0,1,0,0,1,0|2,0,0]=4 11488 B14R1.731 CCC(C)CNC(=O)Cn1cccc1 1626a_100020588543_100011196272 [0,1,0,0,1,0|2,0,0]=4 11489 B14R1.731 CCC(C)CNC(=O)Cn1cccc1 527a_100020588543_100011196272 [0,1,0,0,1,0|2,0,0]=4 11490 B14R1.731 CCC(O)CNC(=O)Cc1ccc[nH]1 11a_100011218483_100000238377 [0,1,0,0,1,0|2,0,0]=4 11491 B14R1.731 CCC(O)CNC(=O)Cc1ccc[nH]1 240690a_100011218483_100000238377 [0,1,0,0,1,0|2,0,0]=4 11492 B14R1.731 CCC(O)CNC(=O)Cc1ccc[nH]1 527a_100011218483_100000238377 [0,1,0,0,1,0|2,0,0]=4 11493 B14R1.731 CCC(O)CNC(=O)Cc1ccco1 11a_100011218483_100011217309 [0,1,0,0,1,0|2,0,0]=4 11494 B14R1.731 CCC(O)CNC(=O)Cc1ccco1 527a_100011218483_100011217309 [0,1,0,0,1,0|2,0,0]=4 11495 B14R1.731 CCC(O)CNC(=O)Cc1cccs1 11a_100011218483_100000210189 [0,1,0,0,1,0|2,0,0]=4 11496 B14R1.731 CCC(O)CNC(=O)Cc1cccs1 240690a_100011218483_100000210189 [0,1,0,0,1,0|2,0,0]=4 11497 B14R1.731 CCC(O)CNC(=O)Cc1ccoc1 11a_100011218483_100000684892 [0,1,0,0,1,0|2,0,0]=4 11498 B14R1.731 CCC(O)CNC(=O)Cc1ccoc1 240690a_100011218483_100000684892 [0,1,0,0,1,0|2,0,0]=4 11499 B14R1.731 CCC(O)CNC(=O)Cc1ccoc1 527a_100011218483_100000684892 [0,1,0,0,1,0|2,0,0]=4 11500 B14R1.731 CCC(O)CNC(=O)Cc1ccsc1 11a_100011218483_100000184062 [0,1,0,0,1,0|2,0,0]=4 11501 B14R1.731 CCC(O)CNC(=O)Cc1ccsc1 240690a_100011218483_100000184062 [0,1,0,0,1,0|2,0,0]=4 11502 B14R1.731 CCC(O)CNC(=O)Cc1ccsc1 527a_100011218483_100000184062 [0,1,0,0,1,0|2,0,0]=4 11503 B14R1.731 CCC(O)CNC(=O)Cn1cccc1 11a_100011218483_100011196272 [0,1,0,0,1,0|2,0,0]=4 11504 B14R1.731 CCC(O)CNC(=O)Cn1cccc1 527a_100011218483_100011196272 [0,1,0,0,1,0|2,0,0]=4 11505 B14R1.810 CC(C)CCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100011214892 [0,1,0,0,1,0|2,0,0]=4 11506 B14R1.810 CC(C)CCCC(=O)Cc1ccco1 1458a_100011217309_100011214892 [0,1,0,0,1,0|2,0,0]=4 11507 B14R1.810 CC(C)CCCC(=O)Cc1cccs1 1458a_100000210189_100011214892 [0,1,0,0,1,0|2,0,0]=4 11508 B14R1.810 CC(C)CCCC(=O)Cc1ccoc1 1458a_100000684892_100011214892 [0,1,0,0,1,0|2,0,0]=4 11509 B14R1.810 CC(C)CCCC(=O)Cc1ccsc1 1458a_100000184062_100011214892 [0,1,0,0,1,0|2,0,0]=4 11510 B14R1.810 CC(C)CCCC(=O)Cc1ccsc1 1458a_100011216857_100011233845 [0,1,0,0,1,0|2,0,0]=4 11511 B14R1.810 CC(C)CCCC(=O)Cn1cccc1 1458a_100011196272_100011214892 [0,1,0,0,1,0|2,0,0]=4 11512 B14R1.810 CC(C)CCNC(=O)Cc1ccc[nH]1 11a_100000210545_100000238377 [0,1,0,0,1,0|2,0,0]=4 11513 B14R1.810 CC(C)CCNC(=O)Cc1ccc[nH]1 240690a_100000210545_100000238377 [0,1,0,0,1,0|2,0,0]=4 11514 B14R1.810 CC(C)CCNC(=O)Cc1ccc[nH]1 527a_100000210545_100000238377 [0,1,0,0,1,0|2,0,0]=4 11515 B14R1.810 CC(C)CCNC(=O)Cc1ccco1 11a_100000210545_100011217309 [0,1,0,0,1,0|2,0,0]=4 11516 B14R1.810 CC(C)CCNC(=O)Cc1ccco1 527a_100000210545_100011217309 [0,1,0,0,1,0|2,0,0]=4 11517 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 11a_100000210545_100000210189 [0,1,0,0,1,0|2,0,0]=4 11518 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 1626a_100000210545_100000210189 [0,1,0,0,1,0|2,0,0]=4 11519 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 240690a_100000210545_100000210189 [0,1,0,0,1,0|2,0,0]=4 11520 B14R1.810 CC(C)CCNC(=O)Cc1ccoc1 11a_100000210545_100000684892 [0,1,0,0,1,0|2,0,0]=4 11521 B14R1.810 CC(C)CCNC(=O)Cc1ccoc1 1626a_100000210545_100000684892 [0,1,0,0,1,0|2,0,0]=4 11522 B14R1.810 CC(C)CCNC(=O)Cc1ccoc1 240690a_100000210545_100000684892 [0,1,0,0,1,0|2,0,0]=4 11523 B14R1.810 CC(C)CCNC(=O)Cc1ccoc1 527a_100000210545_100000684892 [0,1,0,0,1,0|2,0,0]=4 11524 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 11a_100000210545_100000184062 [0,1,0,0,1,0|2,0,0]=4 11525 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 1626a_100000210545_100000184062 [0,1,0,0,1,0|2,0,0]=4 11526 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 240690a_100000210545_100000184062 [0,1,0,0,1,0|2,0,0]=4 11527 B14R1.810 CC(C)CCNC(=O)Cc1ccsc1 527a_100000210545_100000184062 [0,1,0,0,1,0|2,0,0]=4 11528 B14R1.810 CC(C)CCNC(=O)Cn1cccc1 11a_100000210545_100011196272 [0,1,0,0,1,0|2,0,0]=4 11529 B14R1.810 CC(C)CCNC(=O)Cn1cccc1 1626a_100000210545_100011196272 [0,1,0,0,1,0|2,0,0]=4 11530 B14R1.810 CC(C)CCNC(=O)Cn1cccc1 527a_100000210545_100011196272 [0,1,0,0,1,0|2,0,0]=4 11531 B14R1.810 CC(O)CCCC(=O)Cc1ccc[nH]1 1458a_100000238377_200000718107 [0,1,0,0,1,0|2,0,0]=4 11532 B14R1.810 CC(O)CCCC(=O)Cc1ccco1 1458a_100011217309_200000718107 [0,1,0,0,1,0|2,0,0]=4 11533 B14R1.810 CC(O)CCCC(=O)Cc1cccs1 1458a_100000210189_200000718107 [0,1,0,0,1,0|2,0,0]=4 11534 B14R1.810 CC(O)CCCC(=O)Cc1ccoc1 1458a_100000684892_200000718107 [0,1,0,0,1,0|2,0,0]=4 11535 B14R1.810 CC(O)CCCC(=O)Cc1ccsc1 1458a_100000184062_200000718107 [0,1,0,0,1,0|2,0,0]=4 11536 B14R1.810 CC(O)CCCC(=O)Cn1cccc1 1458a_100011196272_200000718107 [0,1,0,0,1,0|2,0,0]=4 11537 B14R1.810 CC(O)CCNC(=O)Cc1ccc[nH]1 240690a_200000755665_100000238377 [0,1,0,0,1,0|2,0,0]=4 11538 B14R1.810 CC(O)CCNC(=O)Cc1ccc[nH]1 527a_200000755665_100000238377 [0,1,0,0,1,0|2,0,0]=4 11539 B14R1.810 CC(O)CCNC(=O)Cc1ccco1 527a_200000755665_100011217309 [0,1,0,0,1,0|2,0,0]=4 11540 B14R1.810 CC(O)CCNC(=O)Cc1cccs1 240690a_200000755665_100000210189 [0,1,0,0,1,0|2,0,0]=4 11541 B14R1.810 CC(O)CCNC(=O)Cc1ccoc1 240690a_200000755665_100000684892 [0,1,0,0,1,0|2,0,0]=4 11542 B14R1.810 CC(O)CCNC(=O)Cc1ccoc1 527a_200000755665_100000684892 [0,1,0,0,1,0|2,0,0]=4 11543 B14R1.810 CC(O)CCNC(=O)Cc1ccsc1 240690a_200000755665_100000184062 [0,1,0,0,1,0|2,0,0]=4 11544 B14R1.810 CC(O)CCNC(=O)Cc1ccsc1 527a_200000755665_100000184062 [0,1,0,0,1,0|2,0,0]=4 11545 B14R1.810 CC(O)CCNC(=O)Cn1cccc1 527a_200000755665_100011196272 [0,1,0,0,1,0|2,0,0]=4 11546 B14R1.1047 CCCCCC(=O)Cc1ccsc1Br 1458a_100000212188_100009814289 [0,1,0,0,1,0|2,0,0]=4 11547 B14R1.1047 CCCCCC(=O)Cc1ccsc1Cl 1458a_100000212188_100010167017 [0,1,0,0,1,0|2,0,0]=4 11548 B16R1.35 CC(CC(=O)CCCCF)c1ccccc1 1458a_100000183687_100000729493 [0,1,0,0,0,1|2,0,0]=4 11549 B16R1.35 CC(CC(=O)CCCCO)c1ccccc1 1458a_100000183687_100000210776 [0,1,0,0,0,1|2,0,0]=4 11550 B16R1.35 CC(CC(=O)CCCCO)c1ccccc1 1458a_100000695505_100000756946 [0,1,0,0,0,1|2,0,0]=4 11551 B16R1.35 CC(CC(=O)NCCCF)c1ccccc1 11a_100015189416_100000183687 [0,1,0,0,0,1|2,0,0]=4 11552 B16R1.35 CC(CC(=O)NCCCF)c1ccccc1 1626a_100015189416_100000183687 [0,1,0,0,0,1|2,0,0]=4 11553 B16R1.35 CC(CC(=O)NCCCF)c1ccccc1 240690a_100015189416_100000183687 [0,1,0,0,0,1|2,0,0]=4 11554 B16R1.35 CC(CC(=O)NCCCF)c1ccccc1 527a_100015189416_100000183687 [0,1,0,0,0,1|2,0,0]=4 11555 B16R1.35 CC(CC(=O)NCCCO)c1ccccc1 240690a_100000182051_100000183687 [0,1,0,0,0,1|2,0,0]=4 11556 B16R1.35 CC(CC(=O)NCCCO)c1ccccc1 527a_100000182051_100000183687 [0,1,0,0,0,1|2,0,0]=4 11557 B16R1.35 CCCC#CC(=O)CC(=O)c1ccccc1 1458a_200011218047_100000211460 [0,1,0,0,0,1|1,0,1]=4 11558 B16R1.35 CCCC#CC(=O)CC(C)c1ccccc1 1458a_200011218047_100000756946 [0,1,0,0,0,1|1,0,1]=4 11559 B16R1.35 CCCC#CC(=O)CC(O)c1ccccc1 1458a_200011218047_100000185958 [0,1,0,0,0,1|1,0,1]=4 11560 B16R1.35 CCCC#CC(=O)C[C@@H](O)c1ccccc1 1458a_200011218047_100011933945 [0,1,0,0,0,1|1,0,1]=4 11561 B16R1.35 CCCC#CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_200011218047 [0,1,0,0,0,1|1,0,1]=4 11562 B16R1.35 CCCC=CC(=O)CC(=O)c1ccccc1 1458a_100000212230_100000211460 [0,1,0,0,0,1|1,0,1]=4 11563 B16R1.35 CCCC=CC(=O)CC(C)c1ccccc1 1458a_100000212230_100000756946 [0,1,0,0,0,1|1,0,1]=4 11564 B16R1.35 CCCC=CC(=O)CC(O)c1ccccc1 1458a_100000212230_100000185958 [0,1,0,0,0,1|1,0,1]=4 11565 B16R1.35 CCCC=CC(=O)C[C@@H](O)c1ccccc1 1458a_100000212230_100011933945 [0,1,0,0,0,1|1,0,1]=4 11566 B16R1.35 CCCC=CC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000212230 [0,1,0,0,0,1|1,0,1]=4 11567 B16R1.35 CCCC=CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000212230 [0,1,0,0,0,1|1,0,1]=4 11568 B16R1.35 CCCC=CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000212230 [0,1,0,0,0,1|1,0,1]=4 11569 B16R1.35 CCCCCC(=O)C=C(C)c1ccccc1 1458a_100000743005_100000210326 [0,1,0,0,0,1|1,0,1]=4 11570 B16R1.35 CCCCCC(=O)CC(=O)c1ccccc1 1458a_100000185807_200012276598 [0,1,0,0,0,1|1,0,0]=3 11571 B16R1.35 CCCCCC(=O)CC(=O)c1ccccc1 1458a_100000212188_100000211460 [0,1,0,0,0,1|1,0,0]=3 11572 B16R1.35 CCCCCC(=O)CC(=O)c1ccccn1 1458a_100000212188_100000027445 [0,1,0,0,0,1|2,0,0]=4 11573 B16R1.35 CCCCCC(=O)CC(=O)c1cccnc1 1458a_100000212188_100015188593 [0,1,0,0,0,1|2,0,0]=4 11574 B16R1.35 CCCCCC(=O)CC(=O)c1ccncc1 1458a_100000212188_100000027454 [0,1,0,0,0,1|2,0,0]=4 11575 B16R1.35 CCCCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210326 [0,1,0,0,0,1|1,0,0]=3 11576 B16R1.35 CCCCCC(=O)CC(C)c1ccccc1 1458a_100000212188_100000756946 [0,1,0,0,0,1|1,0,0]=3 11577 B16R1.35 CCCCCC(=O)CC(O)c1ccccc1 1458a_100000212188_100000185958 [0,1,0,0,0,1|1,0,0]=3 11578 B16R1.35 CCCCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000210326 [0,1,0,0,0,1|1,0,0]=3 11579 B16R1.35 CCCCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000210326 [0,1,0,0,0,1|1,0,0]=3 11580 B16R1.35 CCCCCC(=O)CN(C)c1ccccc1 2230a_100000210012_200012276598 [0,1,0,0,0,1|1,0,0]=3 11581 B16R1.35 CCCCCC(=O)CN(C)c1ccccc1 269982a_100000210012_200012276598 [0,1,0,0,0,1|1,0,0]=3 11582 B16R1.35 CCCCCC(=O)CN(C)c1ccccc1 34a_100000210012_200012276598 [0,1,0,0,0,1|1,0,0]=3 11583 B16R1.35 CCCCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000212188_100011933945 [0,1,0,0,0,1|1,0,0]=3 11584 B16R1.35 CCCCCC(=O)NC(C)c1ccccn1 11a_100000181244_100000212188 [0,1,0,0,0,1|2,0,0]=4 11585 B16R1.35 CCCCCC(=O)NC(C)c1ccccn1 1626a_100000181244_100000212188 [0,1,0,0,0,1|2,0,0]=4 11586 B16R1.35 CCCCCC(=O)NC(C)c1ccccn1 240690a_100000181244_100000212188 [0,1,0,0,0,1|2,0,0]=4 11587 B16R1.35 CCCCCC(=O)NC(C)c1ccccn1 527a_100000181244_100000212188 [0,1,0,0,0,1|2,0,0]=4 11588 B16R1.35 CCCCCC(=O)NC(C)c1cccnc1 11a_100000195435_100000212188 [0,1,0,0,0,1|2,0,0]=4 11589 B16R1.35 CCCCCC(=O)NC(C)c1cccnc1 240690a_100000195435_100000212188 [0,1,0,0,0,1|2,0,0]=4 11590 B16R1.35 CCCCCC(=O)NC(C)c1cccnc1 527a_100000195435_100000212188 [0,1,0,0,0,1|2,0,0]=4 11591 B16R1.35 CCCCCC(=O)NC(C)c1ccncc1 240690a_100000181269_100000212188 [0,1,0,0,0,1|2,0,0]=4 11592 B16R1.35 CCCCCC(=O)NC(C)c1ccncc1 527a_100000181269_100000212188 [0,1,0,0,0,1|2,0,0]=4 11593 B16R1.35 CCCCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000212188 [0,1,0,0,0,1|1,0,0]=3 11594 B16R1.35 CCCCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000212188 [0,1,0,0,0,1|1,0,0]=3 11595 B16R1.35 CCCCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000212188 [0,1,0,0,0,1|1,0,0]=3 11596 B16R1.35 CCCCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000212188 [0,1,0,0,0,1|1,0,0]=3 11597 B16R1.35 CCCCNC(=O)C=C(C)c1ccccc1 11a_100000102301_100000743005 [0,1,0,0,0,1|1,0,1]=4 11598 B16R1.35 CCCCNC(=O)C=C(C)c1ccccc1 1626a_100000102301_100000743005 [0,1,0,0,0,1|1,0,1]=4 11599 B16R1.35 CCCCNC(=O)C=C(C)c1ccccc1 240690a_100000102301_100000743005 [0,1,0,0,0,1|1,0,1]=4 11600 B16R1.35 CCCCNC(=O)C=C(C)c1ccccc1 527a_100000102301_100000743005 [0,1,0,0,0,1|1,0,1]=4 11601 B16R1.35 CCCCNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000182744 [0,1,0,0,0,1|1,0,0]=3 11602 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 11a_100000102301_100000183687 [0,1,0,0,0,1|1,0,0]=3 11603 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 1626a_100000102301_100000183687 [0,1,0,0,0,1|1,0,0]=3 11604 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 240690a_100000102301_100000183687 [0,1,0,0,0,1|1,0,0]=3 11605 B16R1.35 CCCCNC(=O)CC(C)c1ccccc1 527a_100000102301_100000183687 [0,1,0,0,0,1|1,0,0]=3 11606 B16R1.35 CCCCNC(=O)CC(O)c1ccccc1 240690a_100000102301_100000690199 [0,1,0,0,0,1|1,0,0]=3 11607 B16R1.35 CCCCNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000182744 [0,1,0,0,0,1|1,0,0]=3 11608 B16R1.35 CCCCNC(=O)CN(C)c1ccccc1 240690a_100000102301_100000745425 [0,1,0,0,0,1|1,0,0]=3 11609 B16R1.35 CCCCNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000182744 [0,1,0,0,0,1|1,0,0]=3 11610 B16R1.35 CCCCNC(=O)CN(C)c1ccccc1 34a_100000210012_100000182744 [0,1,0,0,0,1|1,0,0]=3 11611 B16R1.35 CCCCNC(=O)CN(C)c1ccccc1 527a_100000102301_100000745425 [0,1,0,0,0,1|1,0,0]=3 11612 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 2708a_100000102301_100000181244 [0,1,0,0,0,1|2,0,0]=4 11613 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 2708a_100000181244_100000102301 [0,1,0,0,0,1|2,0,0]=4 11614 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 273464a_100000102301_100000181244 [0,1,0,0,0,1|2,0,0]=4 11615 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 273464a_100000181244_100000102301 [0,1,0,0,0,1|2,0,0]=4 11616 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 512a_100000102301_100000181244 [0,1,0,0,0,1|2,0,0]=4 11617 B16R1.35 CCCCNC(=O)NC(C)c1ccccn1 512a_100000181244_100000102301 [0,1,0,0,0,1|2,0,0]=4 11618 B16R1.35 CCCCNC(=O)NC(C)c1cccnc1 2708a_100000102301_100000195435 [0,1,0,0,0,1|2,0,0]=4 11619 B16R1.35 CCCCNC(=O)NC(C)c1cccnc1 2708a_100000195435_100000102301 [0,1,0,0,0,1|2,0,0]=4 11620 B16R1.35 CCCCNC(=O)NC(C)c1cccnc1 273464a_100000102301_100000195435 [0,1,0,0,0,1|2,0,0]=4 11621 B16R1.35 CCCCNC(=O)NC(C)c1cccnc1 273464a_100000195435_100000102301 [0,1,0,0,0,1|2,0,0]=4 11622 B16R1.35 CCCCNC(=O)NC(C)c1cccnc1 512a_100000102301_100000195435 [0,1,0,0,0,1|2,0,0]=4 11623 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 2708a_100000102301_100000181269 [0,1,0,0,0,1|2,0,0]=4 11624 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 2708a_100000181269_100000102301 [0,1,0,0,0,1|2,0,0]=4 11625 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 273464a_100000102301_100000181269 [0,1,0,0,0,1|2,0,0]=4 11626 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 273464a_100000181269_100000102301 [0,1,0,0,0,1|2,0,0]=4 11627 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 512a_100000102301_100000181269 [0,1,0,0,0,1|2,0,0]=4 11628 B16R1.35 CCCCNC(=O)NC(C)c1ccncc1 512a_100000181269_100000102301 [0,1,0,0,0,1|2,0,0]=4 11629 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 2708a_100000102301_100000751104 [0,1,0,0,0,1|1,0,0]=3 11630 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_100000102301 [0,1,0,0,0,1|1,0,0]=3 11631 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 273464a_100000102301_100000751104 [0,1,0,0,0,1|1,0,0]=3 11632 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100000102301 [0,1,0,0,0,1|1,0,0]=3 11633 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 512a_100000102301_100000751104 [0,1,0,0,0,1|1,0,0]=3 11634 B16R1.35 CCCCNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100000102301 [0,1,0,0,0,1|1,0,0]=3 11635 B16R1.35 CCCCOC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000211628 [0,1,0,0,0,1|0,0,0]=2 11636 B16R1.35 CCCCOC(=O)CN(C)c1ccccc1 2230a_100000210012_100000211628 [0,1,0,0,0,1|0,0,0]=2 11637 B16R1.35 CCCCOC(=O)CN(C)c1ccccc1 269982a_100000210012_100000211628 [0,1,0,0,0,1|0,0,0]=2 11638 B16R1.35 CCCCOC(=O)CN(C)c1ccccc1 34a_100000210012_100000211628 [0,1,0,0,0,1|0,0,0]=2 11639 B16R1.35 CCCNNC(=O)CC(C)c1ccccc1 22a_100000740057_100000183687 [0,1,0,0,0,1|2,0,0]=4 11640 B16R1.35 CCCNNC(=O)CC(O)c1ccccc1 22a_100000740057_100000690199 [0,1,0,0,0,1|2,0,0]=4 11641 B16R1.35 CCCNNC(=O)CN(C)c1ccccc1 22a_100000740057_100000745425 [0,1,0,0,0,1|2,0,0]=4 11642 B16R1.35 CCCNNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100000740057 [0,1,0,0,0,1|2,0,0]=4 11643 B16R1.35 CCCNNC(=O)N[C@H](C)c1ccccc1 512a_100000740057_100000751104 [0,1,0,0,0,1|2,0,0]=4 11644 B16R1.35 CCCNNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100000740057 [0,1,0,0,0,1|2,0,0]=4 11645 B16R1.35 CCCOCC(=O)CC(=O)c1ccccc1 1458a_100000745993_100000211460 [0,1,0,0,0,1|2,0,0]=4 11646 B16R1.35 CCCOCC(=O)CC(C)c1ccccc1 1458a_100000745993_100000756946 [0,1,0,0,0,1|2,0,0]=4 11647 B16R1.35 CCCOCC(=O)CC(O)c1ccccc1 1458a_100000745993_100000185958 [0,1,0,0,0,1|2,0,0]=4 11648 B16R1.35 CCCOCC(=O)C[C@@H](O)c1ccccc1 1458a_100000745993_100011933945 [0,1,0,0,0,1|2,0,0]=4 11649 B16R1.35 CCCOCC(=O)NC(C)c1ccccc1 34a_100000210258_200000243715 [0,1,0,0,0,1|2,0,0]=4 11650 B16R1.35 CCCOCC(=O)N[C@@H](C)c1ccccc1 34a_100000210258_100011939912 [0,1,0,0,0,1|2,0,0]=4 11651 B16R1.35 CCCOCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000745993 [0,1,0,0,0,1|2,0,0]=4 11652 B16R1.35 CCCOCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000745993 [0,1,0,0,0,1|2,0,0]=4 11653 B16R1.35 CCCOCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000745993 [0,1,0,0,0,1|2,0,0]=4 11654 B16R1.35 CCCOCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000745993 [0,1,0,0,0,1|2,0,0]=4 11655 B16R1.35 CCCSCC(=O)CC(=O)c1ccccc1 1458a_100000217233_100000211460 [0,1,0,0,0,1|2,0,0]=4 11656 B16R1.35 CCCSCC(=O)CC(C)c1ccccc1 1458a_100000217233_100000756946 [0,1,0,0,0,1|2,0,0]=4 11657 B16R1.35 CCCSCC(=O)CC(O)c1ccccc1 1458a_100000217233_100000185958 [0,1,0,0,0,1|2,0,0]=4 11658 B16R1.35 CCCSCC(=O)C[C@@H](O)c1ccccc1 1458a_100000217233_100011933945 [0,1,0,0,0,1|2,0,0]=4 11659 B16R1.35 CCCSCC(=O)NC(C)c1ccccc1 62a_100000210303_200000243715 [0,1,0,0,0,1|2,0,0]=4 11660 B16R1.35 CCCSCC(=O)NC(C)c1ccccc1 62a_200000243715_100000210303 [0,1,0,0,0,1|2,0,0]=4 11661 B16R1.35 CCCSCC(=O)N[C@@H](C)c1ccccc1 62a_100000210303_100011939912 [0,1,0,0,0,1|2,0,0]=4 11662 B16R1.35 CCCSCC(=O)N[C@@H](C)c1ccccc1 62a_100011939912_100000210303 [0,1,0,0,0,1|2,0,0]=4 11663 B16R1.35 CCCSCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000217233 [0,1,0,0,0,1|2,0,0]=4 11664 B16R1.35 CCCSCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000217233 [0,1,0,0,0,1|2,0,0]=4 11665 B16R1.35 CCCSCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000217233 [0,1,0,0,0,1|2,0,0]=4 11666 B16R1.35 CCCSCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000217233 [0,1,0,0,0,1|2,0,0]=4 11667 B16R1.35 CCNCCC(=O)NC(C)c1ccccc1 2230a_100015525214_100000242056 [0,1,0,0,0,1|2,0,0]=4 11668 B16R1.35 CCOCCC(=O)CC(=O)c1ccccc1 1458a_100000749530_100000211460 [0,1,0,0,0,1|2,0,0]=4 11669 B16R1.35 CCOCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100011215890 [0,1,0,0,0,1|2,0,0]=4 11670 B16R1.35 CCOCCC(=O)CC(C)c1ccccc1 1458a_100000749530_100000756946 [0,1,0,0,0,1|2,0,0]=4 11671 B16R1.35 CCOCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100011215890 [0,1,0,0,0,1|2,0,0]=4 11672 B16R1.35 CCOCCC(=O)CC(O)c1ccccc1 1458a_100000749530_100000185958 [0,1,0,0,0,1|2,0,0]=4 11673 B16R1.35 CCOCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100011215890 [0,1,0,0,0,1|2,0,0]=4 11674 B16R1.35 CCOCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000749530_100011933945 [0,1,0,0,0,1|2,0,0]=4 11675 B16R1.35 CCOCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000749530 [0,1,0,0,0,1|2,0,0]=4 11676 B16R1.35 CCOCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000749530 [0,1,0,0,0,1|2,0,0]=4 11677 B16R1.35 CCOCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000749530 [0,1,0,0,0,1|2,0,0]=4 11678 B16R1.35 CCOCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000749530 [0,1,0,0,0,1|2,0,0]=4 11679 B16R1.35 CCSCCC(=O)CC(=O)c1ccccc1 1458a_100000230768_100000211460 [0,1,0,0,0,1|2,0,0]=4 11680 B16R1.35 CCSCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000757381 [0,1,0,0,0,1|2,0,0]=4 11681 B16R1.35 CCSCCC(=O)CC(C)c1ccccc1 1458a_100000230768_100000756946 [0,1,0,0,0,1|2,0,0]=4 11682 B16R1.35 CCSCCC(=O)CC(O)c1ccccc1 1458a_100000230768_100000185958 [0,1,0,0,0,1|2,0,0]=4 11683 B16R1.35 CCSCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000757381 [0,1,0,0,0,1|2,0,0]=4 11684 B16R1.35 CCSCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000757381 [0,1,0,0,0,1|2,0,0]=4 11685 B16R1.35 CCSCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000230768_100011933945 [0,1,0,0,0,1|2,0,0]=4 11686 B16R1.35 CCSCCC(=O)NC(C)c1ccccc1 62a_100000210202_100000242056 [0,1,0,0,0,1|2,0,0]=4 11687 B16R1.35 CCSCCC(=O)NC(C)c1ccccc1 62a_100000242056_100000210202 [0,1,0,0,0,1|2,0,0]=4 11688 B16R1.35 CCSCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000230768 [0,1,0,0,0,1|2,0,0]=4 11689 B16R1.35 CCSCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000230768 [0,1,0,0,0,1|2,0,0]=4 11690 B16R1.35 CCSCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000230768 [0,1,0,0,0,1|2,0,0]=4 11691 B16R1.35 CCSCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000230768 [0,1,0,0,0,1|2,0,0]=4 11692 B16R1.35 CN(CC(=O)CCCCF)c1ccccc1 1458a_100000745425_100000729493 [0,1,0,0,0,1|2,0,0]=4 11693 B16R1.35 CN(CC(=O)CCCCO)c1ccccc1 1458a_100000745425_100000210776 [0,1,0,0,0,1|2,0,0]=4 11694 B16R1.35 CN(CC(=O)NCCCF)c1ccccc1 240690a_100015189416_100000745425 [0,1,0,0,0,1|2,0,0]=4 11695 B16R1.35 CN(CC(=O)NCCCF)c1ccccc1 527a_100015189416_100000745425 [0,1,0,0,0,1|2,0,0]=4 11696 B16R1.35 CN(CC(=O)NCCCO)c1ccccc1 240690a_100000182051_100000745425 [0,1,0,0,0,1|2,0,0]=4 11697 B16R1.35 CN(CC(=O)NCCCO)c1ccccc1 527a_100000182051_100000745425 [0,1,0,0,0,1|2,0,0]=4 11698 B16R1.35 COCCCC(=O)CC(=O)c1ccccc1 1458a_100000741012_100000211460 [0,1,0,0,0,1|2,0,0]=4 11699 B16R1.35 COCCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000740836 [0,1,0,0,0,1|2,0,0]=4 11700 B16R1.35 COCCCC(=O)CC(C)c1ccccc1 1458a_100000741012_100000756946 [0,1,0,0,0,1|2,0,0]=4 11701 B16R1.35 COCCCC(=O)CC(O)c1ccccc1 1458a_100000690199_100000740836 [0,1,0,0,0,1|2,0,0]=4 11702 B16R1.35 COCCCC(=O)CC(O)c1ccccc1 1458a_100000741012_100000185958 [0,1,0,0,0,1|2,0,0]=4 11703 B16R1.35 COCCCC(=O)CN(C)c1ccccc1 1458a_100000745425_100000740836 [0,1,0,0,0,1|2,0,0]=4 11704 B16R1.35 COCCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000741012_100011933945 [0,1,0,0,0,1|2,0,0]=4 11705 B16R1.35 COCCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000741012 [0,1,0,0,0,1|2,0,0]=4 11706 B16R1.35 COCCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000741012 [0,1,0,0,0,1|2,0,0]=4 11707 B16R1.35 COCCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000741012 [0,1,0,0,0,1|2,0,0]=4 11708 B16R1.35 COCCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000741012 [0,1,0,0,0,1|2,0,0]=4 11709 B16R1.35 COCCNC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000183275 [0,1,0,0,0,1|2,0,0]=4 11710 B16R1.35 COCCNC(=O)CC(C)c1ccccc1 1626a_100000209980_100000183687 [0,1,0,0,0,1|2,0,0]=4 11711 B16R1.35 COCCNC(=O)CC(C)c1ccccc1 240690a_100000209980_100000183687 [0,1,0,0,0,1|2,0,0]=4 11712 B16R1.35 COCCNC(=O)CC(C)c1ccccc1 527a_100000209980_100000183687 [0,1,0,0,0,1|2,0,0]=4 11713 B16R1.35 COCCNC(=O)CC(O)c1ccccc1 240690a_100000209980_100000690199 [0,1,0,0,0,1|2,0,0]=4 11714 B16R1.35 COCCNC(=O)CN(C)c1ccccc1 2230a_100000210012_100000183275 [0,1,0,0,0,1|2,0,0]=4 11715 B16R1.35 COCCNC(=O)CN(C)c1ccccc1 240690a_100000209980_100000745425 [0,1,0,0,0,1|2,0,0]=4 11716 B16R1.35 COCCNC(=O)CN(C)c1ccccc1 269982a_100000210012_100000183275 [0,1,0,0,0,1|2,0,0]=4 11717 B16R1.35 COCCNC(=O)CN(C)c1ccccc1 34a_100000210012_100000183275 [0,1,0,0,0,1|2,0,0]=4 11718 B16R1.35 COCCNC(=O)CN(C)c1ccccc1 527a_100000209980_100000745425 [0,1,0,0,0,1|2,0,0]=4 11719 B16R1.35 COCCNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_100000209980 [0,1,0,0,0,1|2,0,0]=4 11720 B16R1.35 COCCNC(=O)N[C@H](C)c1ccccc1 273464a_100000209980_100000751104 [0,1,0,0,0,1|2,0,0]=4 11721 B16R1.35 COCCNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100000209980 [0,1,0,0,0,1|2,0,0]=4 11722 B16R1.35 COCCOC(=O)CC(=O)c1ccccc1 1458a_100000185807_200000040189 [0,1,0,0,0,1|1,0,0]=3 11723 B16R1.35 COCCOC(=O)CN(C)c1ccccc1 2230a_100000210012_200000040189 [0,1,0,0,0,1|1,0,0]=3 11724 B16R1.35 COCCOC(=O)CN(C)c1ccccc1 269982a_100000210012_200000040189 [0,1,0,0,0,1|1,0,0]=3 11725 B16R1.35 COCCOC(=O)CN(C)c1ccccc1 34a_100000210012_200000040189 [0,1,0,0,0,1|1,0,0]=3 11726 B16R1.35 CSCCCC(=O)CC(=O)c1ccccc1 1458a_100000173376_100000211460 [0,1,0,0,0,1|2,0,0]=4 11727 B16R1.35 CSCCCC(=O)CC(C)c1ccccc1 1458a_100000173376_100000756946 [0,1,0,0,0,1|2,0,0]=4 11728 B16R1.35 CSCCCC(=O)CC(O)c1ccccc1 1458a_100000173376_100000185958 [0,1,0,0,0,1|2,0,0]=4 11729 B16R1.35 CSCCCC(=O)C[C@@H](O)c1ccccc1 1458a_100000173376_100011933945 [0,1,0,0,0,1|2,0,0]=4 11730 B16R1.35 CSCCCC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100000173376 [0,1,0,0,0,1|2,0,0]=4 11731 B16R1.35 CSCCCC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100000173376 [0,1,0,0,0,1|2,0,0]=4 11732 B16R1.35 CSCCCC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100000173376 [0,1,0,0,0,1|2,0,0]=4 11733 B16R1.35 CSCCCC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100000173376 [0,1,0,0,0,1|2,0,0]=4 11734 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 11a_100020590264_100000183687 [0,1,0,0,0,1|2,0,0]=4 11735 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 1626a_100020590264_100000183687 [0,1,0,0,0,1|2,0,0]=4 11736 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 240690a_100020590264_100000183687 [0,1,0,0,0,1|2,0,0]=4 11737 B16R1.35 CSCCNC(=O)CC(C)c1ccccc1 527a_100020590264_100000183687 [0,1,0,0,0,1|2,0,0]=4 11738 B16R1.35 CSCCNC(=O)CC(O)c1ccccc1 240690a_100020590264_100000690199 [0,1,0,0,0,1|2,0,0]=4 11739 B16R1.35 CSCCNC(=O)CN(C)c1ccccc1 240690a_100020590264_100000745425 [0,1,0,0,0,1|2,0,0]=4 11740 B16R1.35 CSCCNC(=O)CN(C)c1ccccc1 527a_100020590264_100000745425 [0,1,0,0,0,1|2,0,0]=4 11741 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 2708a_100000751104_100020590264 [0,1,0,0,0,1|2,0,0]=4 11742 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 2708a_100020590264_100000751104 [0,1,0,0,0,1|2,0,0]=4 11743 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100020590264 [0,1,0,0,0,1|2,0,0]=4 11744 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 273464a_100020590264_100000751104 [0,1,0,0,0,1|2,0,0]=4 11745 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 512a_100000751104_100020590264 [0,1,0,0,0,1|2,0,0]=4 11746 B16R1.35 CSCCNC(=O)N[C@H](C)c1ccccc1 512a_100020590264_100000751104 [0,1,0,0,0,1|2,0,0]=4 11747 B16R1.35 C[C@@H](NC(=O)CCCCO)c1ccccc1 1626a_100000751104_100000695505 [0,1,0,0,0,1|2,0,0]=4 11748 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 2708a_100000751104_100015189416 [0,1,0,0,0,1|2,0,0]=4 11749 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 2708a_100015189416_100000751104 [0,1,0,0,0,1|2,0,0]=4 11750 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 273464a_100000751104_100015189416 [0,1,0,0,0,1|2,0,0]=4 11751 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 273464a_100015189416_100000751104 [0,1,0,0,0,1|2,0,0]=4 11752 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 512a_100000751104_100015189416 [0,1,0,0,0,1|2,0,0]=4 11753 B16R1.35 C[C@@H](NC(=O)NCCCF)c1ccccc1 512a_100015189416_100000751104 [0,1,0,0,0,1|2,0,0]=4 11754 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 2708a_100000751104_100000182051 [0,1,0,0,0,1|2,0,0]=4 11755 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 273464a_100000182051_100000751104 [0,1,0,0,0,1|2,0,0]=4 11756 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 273464a_100000751104_100000182051 [0,1,0,0,0,1|2,0,0]=4 11757 B16R1.35 C[C@@H](NC(=O)NCCCO)c1ccccc1 512a_100000751104_100000182051 [0,1,0,0,0,1|2,0,0]=4 11758 B16R1.35 O=C(CC(O)c1ccccc1)NCCCF 240690a_100015189416_100000690199 [0,1,0,0,0,1|2,0,0]=4 11759 B16R1.35 O=C(CC(O)c1ccccc1)NCCCO 240690a_100000182051_100000690199 [0,1,0,0,0,1|2,0,0]=4 11760 B16R1.35 O=C(CCCCF)CC(O)c1ccccc1 1458a_100000690199_100000729493 [0,1,0,0,0,1|2,0,0]=4 11761 B16R1.35 O=C(CCCCO)CC(=O)c1ccccc1 1458a_100000695505_100000211460 [0,1,0,0,0,1|2,0,0]=4 11762 B16R1.35 O=C(CCCCO)CC(O)c1ccccc1 1458a_100000690199_100000210776 [0,1,0,0,0,1|2,0,0]=4 11763 B16R1.35 O=C(CCCCO)CC(O)c1ccccc1 1458a_100000695505_100000185958 [0,1,0,0,0,1|2,0,0]=4 11764 B16R1.35 O=C(CCCCO)C[C@@H](O)c1ccccc1 1458a_100000695505_100011933945 [0,1,0,0,0,1|2,0,0]=4 11765 B16R1.51 CCCC#CC(=O)CCc1ccc(cc1)Br 1458a_200011218047_100011740612 [0,1,0,0,0,1|1,0,1]=4 11766 B16R1.51 CCCC#CC(=O)CCc1ccc(cc1)C 1458a_200011218047_100011713686 [0,1,0,0,0,1|1,0,1]=4 11767 B16R1.51 CCCC#CC(=O)CCc1ccc(cc1)Cl 1458a_200011218047_100011713675 [0,1,0,0,0,1|1,0,1]=4 11768 B16R1.51 CCCC#CC(=O)CCc1ccc(cc1)F 1458a_200011218047_100011217392 [0,1,0,0,0,1|1,0,1]=4 11769 B16R1.51 CCCC#CC(=O)CCc1ccc(cc1)O 1458a_200011218047_100009816426 [0,1,0,0,0,1|1,0,1]=4 11770 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_200011218047 [0,1,0,0,0,1|1,0,1]=4 11771 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)C 240690a_100000174908_200011218047 [0,1,0,0,0,1|1,0,1]=4 11772 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_200011218047 [0,1,0,0,0,1|1,0,1]=4 11773 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)F 240690a_100000174882_200011218047 [0,1,0,0,0,1|1,0,1]=4 11774 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)I 240690a_100016989417_200011218047 [0,1,0,0,0,1|1,0,1]=4 11775 B16R1.51 CCCC#CC(=O)NCc1ccc(cc1)O 240690a_100000185549_200011218047 [0,1,0,0,0,1|1,0,1]=4 11776 B16R1.51 CCCC=CC(=O)CCc1ccc(cc1)Br 1458a_100000212230_100011740612 [0,1,0,0,0,1|1,0,1]=4 11777 B16R1.51 CCCC=CC(=O)CCc1ccc(cc1)C 1458a_100000212230_100011713686 [0,1,0,0,0,1|1,0,1]=4 11778 B16R1.51 CCCC=CC(=O)CCc1ccc(cc1)Cl 1458a_100000212230_100011713675 [0,1,0,0,0,1|1,0,1]=4 11779 B16R1.51 CCCC=CC(=O)CCc1ccc(cc1)F 1458a_100000212230_100011217392 [0,1,0,0,0,1|1,0,1]=4 11780 B16R1.51 CCCC=CC(=O)CCc1ccc(cc1)O 1458a_100000212230_100009816426 [0,1,0,0,0,1|1,0,1]=4 11781 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000212230 [0,1,0,0,0,1|1,0,1]=4 11782 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000212230 [0,1,0,0,0,1|1,0,1]=4 11783 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000212230 [0,1,0,0,0,1|1,0,1]=4 11784 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)C 11a_100000174908_100000212230 [0,1,0,0,0,1|1,0,1]=4 11785 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000212230 [0,1,0,0,0,1|1,0,1]=4 11786 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000212230 [0,1,0,0,0,1|1,0,1]=4 11787 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000212230 [0,1,0,0,0,1|1,0,1]=4 11788 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000212230 [0,1,0,0,0,1|1,0,1]=4 11789 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000212230 [0,1,0,0,0,1|1,0,1]=4 11790 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)F 11a_100000174882_100000212230 [0,1,0,0,0,1|1,0,1]=4 11791 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000212230 [0,1,0,0,0,1|1,0,1]=4 11792 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000212230 [0,1,0,0,0,1|1,0,1]=4 11793 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)I 11a_100016989417_100000212230 [0,1,0,0,0,1|1,0,1]=4 11794 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000212230 [0,1,0,0,0,1|1,0,1]=4 11795 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000212230 [0,1,0,0,0,1|1,0,1]=4 11796 B16R1.51 CCCC=CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000212230 [0,1,0,0,0,1|1,0,1]=4 11797 B16R1.51 CCCCCC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_100000210326 [0,1,0,0,0,1|1,0,1]=4 11798 B16R1.51 CCCCCC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_100000210326 [0,1,0,0,0,1|1,0,1]=4 11799 B16R1.51 CCCCCC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_100000210326 [0,1,0,0,0,1|1,0,1]=4 11800 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_100000210326 [0,1,0,0,0,1|1,0,1]=4 11801 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)Br 6a_100000186029_100011215151 [0,1,0,0,0,1|1,0,1]=4 11802 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_100000210326 [0,1,0,0,0,1|1,0,1]=4 11803 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_100000210326 [0,1,0,0,0,1|1,0,1]=4 11804 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_100000210326 [0,1,0,0,0,1|1,0,1]=4 11805 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)F 6a_100000210084_100011215151 [0,1,0,0,0,1|1,0,1]=4 11806 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_100000210326 [0,1,0,0,0,1|1,0,1]=4 11807 B16R1.51 CCCCCC(=O)C=Cc1ccc(cc1)I 6a_100000188517_100011215151 [0,1,0,0,0,1|1,0,1]=4 11808 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)Br 1458a_100000212188_100011740612 [0,1,0,0,0,1|1,0,0]=3 11809 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000210326 [0,1,0,0,0,1|1,0,0]=3 11810 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)C 1458a_100000212188_100011713686 [0,1,0,0,0,1|1,0,0]=3 11811 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000210326 [0,1,0,0,0,1|1,0,0]=3 11812 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000212188_100011713675 [0,1,0,0,0,1|1,0,0]=3 11813 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000210326 [0,1,0,0,0,1|1,0,0]=3 11814 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000210326 [0,1,0,0,0,1|1,0,0]=3 11815 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)F 1458a_100000212188_100011217392 [0,1,0,0,0,1|1,0,0]=3 11816 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000210326 [0,1,0,0,0,1|1,0,0]=3 11817 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)O 1458a_100000212188_100009816426 [0,1,0,0,0,1|1,0,0]=3 11818 B16R1.51 CCCCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000210326 [0,1,0,0,0,1|1,0,0]=3 11819 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)Br 2230a_100000210018_200012276598 [0,1,0,0,0,1|1,0,0]=3 11820 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)Br 34a_100000210018_200012276598 [0,1,0,0,0,1|1,0,0]=3 11821 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)C 34a_100000124888_200012276598 [0,1,0,0,0,1|1,0,0]=3 11822 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_200012276598 [0,1,0,0,0,1|1,0,0]=3 11823 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)Cl 34a_100000210052_200012276598 [0,1,0,0,0,1|1,0,0]=3 11824 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)F 34a_100000185862_200012276598 [0,1,0,0,0,1|1,0,0]=3 11825 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)I 34a_100000185761_200012276598 [0,1,0,0,0,1|1,0,0]=3 11826 B16R1.51 CCCCCC(=O)CNc1ccc(cc1)O 34a_100000185829_200012276598 [0,1,0,0,0,1|1,0,0]=3 11827 B16R1.51 CCCCCC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_200012276598 [0,1,0,0,0,1|2,0,0]=4 11828 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000210326 [0,1,0,0,0,1|1,0,0]=3 11829 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Br 34a_100000185759_200012276598 [0,1,0,0,0,1|1,0,0]=3 11830 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Br 7a_100000185759_200012276598 [0,1,0,0,0,1|1,0,0]=3 11831 B16R1.51 CCCCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000210326 [0,1,0,0,0,1|1,0,0]=3 11832 B16R1.51 CCCCCC(=O)COc1ccc(cc1)C 34a_100000210336_200012276598 [0,1,0,0,0,1|1,0,0]=3 11833 B16R1.51 CCCCCC(=O)COc1ccc(cc1)C 7a_100000210336_200012276598 [0,1,0,0,0,1|1,0,0]=3 11834 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000210326 [0,1,0,0,0,1|1,0,0]=3 11835 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Cl 34a_100000210216_200012276598 [0,1,0,0,0,1|1,0,0]=3 11836 B16R1.51 CCCCCC(=O)COc1ccc(cc1)Cl 7a_100000210216_200012276598 [0,1,0,0,0,1|1,0,0]=3 11837 B16R1.51 CCCCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000210326 [0,1,0,0,0,1|1,0,0]=3 11838 B16R1.51 CCCCCC(=O)COc1ccc(cc1)F 34a_100000210339_200012276598 [0,1,0,0,0,1|1,0,0]=3 11839 B16R1.51 CCCCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000210326 [0,1,0,0,0,1|1,0,0]=3 11840 B16R1.51 CCCCCC(=O)COc1ccc(cc1)I 34a_100000212066_200012276598 [0,1,0,0,0,1|1,0,0]=3 11841 B16R1.51 CCCCCC(=O)COc1ccc(cc1)I 7a_100000212066_200012276598 [0,1,0,0,0,1|1,0,0]=3 11842 B16R1.51 CCCCCC(=O)COc1ccc(cc1)N 34a_100000185829_200012276598 [0,1,0,0,0,1|1,0,0]=3 11843 B16R1.51 CCCCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000210326 [0,1,0,0,0,1|1,0,0]=3 11844 B16R1.51 CCCCCC(=O)COc1ccc(cn1)C 34a_100000759353_200012276598 [0,1,0,0,0,1|2,0,0]=4 11845 B16R1.51 CCCCCC(=O)COc1ccc(cn1)Cl 34a_100011215309_200012276598 [0,1,0,0,0,1|2,0,0]=4 11846 B16R1.51 CCCCCC(=O)COc1ccc(cn1)F 34a_100000742473_200012276598 [0,1,0,0,0,1|2,0,0]=4 11847 B16R1.51 CCCCCC(=O)COc1ccc(cn1)N 34a_100000729260_200012276598 [0,1,0,0,0,1|2,0,0]=4 11848 B16R1.51 CCCCCC(=O)COc1ccc(nc1)Br 34a_100000685995_200012276598 [0,1,0,0,0,1|2,0,0]=4 11849 B16R1.51 CCCCCC(=O)COc1ccc(nc1)Br 7a_100000685995_200012276598 [0,1,0,0,0,1|2,0,0]=4 11850 B16R1.51 CCCCCC(=O)COc1ccc(nc1)C 34a_100000745506_200012276598 [0,1,0,0,0,1|2,0,0]=4 11851 B16R1.51 CCCCCC(=O)COc1ccc(nc1)C 7a_100000745506_200012276598 [0,1,0,0,0,1|2,0,0]=4 11852 B16R1.51 CCCCCC(=O)COc1ccc(nc1)Cl 34a_100000744096_200012276598 [0,1,0,0,0,1|2,0,0]=4 11853 B16R1.51 CCCCCC(=O)COc1ccc(nc1)Cl 7a_100000744096_200012276598 [0,1,0,0,0,1|2,0,0]=4 11854 B16R1.51 CCCCCC(=O)COc1ccc(nc1)F 34a_100000688820_200012276598 [0,1,0,0,0,1|2,0,0]=4 11855 B16R1.51 CCCCCC(=O)COc1ccc(nc1)F 7a_100000688820_200012276598 [0,1,0,0,0,1|2,0,0]=4 11856 B16R1.51 CCCCCC(=O)COc1ccc(nc1)I 34a_100000687607_200012276598 [0,1,0,0,0,1|2,0,0]=4 11857 B16R1.51 CCCCCC(=O)COc1ccc(nc1)I 7a_100000687607_200012276598 [0,1,0,0,0,1|2,0,0]=4 11858 B16R1.51 CCCCCC(=O)COc1ccc(nc1)N 34a_100015188713_200012276598 [0,1,0,0,0,1|2,0,0]=4 11859 B16R1.51 CCCCCC(=O)COc1ccc(nc1)N 7a_100015188713_200012276598 [0,1,0,0,0,1|2,0,0]=4 11860 B16R1.51 CCCCCC(=O)CSc1cc[n+](cc1)[O-] 62a_200012276598_100000039755 [0,1,0,0,0,1|2,0,0]=4 11861 B16R1.51 CCCCCC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_200012276598 [0,1,0,0,0,1|2,0,0]=4 11862 B16R1.51 CCCCCC(=O)CSc1ccc(=O)[nH]c1 62a_200012276598_100000212171 [0,1,0,0,0,1|2,0,0]=4 11863 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000210326 [0,1,0,0,0,1|1,0,0]=3 11864 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Br 62a_100000752885_200012276598 [0,1,0,0,0,1|1,0,0]=3 11865 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Br 62a_200012276598_100000752885 [0,1,0,0,0,1|1,0,0]=3 11866 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000210326 [0,1,0,0,0,1|1,0,0]=3 11867 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)C 62a_100000186775_200012276598 [0,1,0,0,0,1|1,0,0]=3 11868 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)C 62a_200012276598_100000186775 [0,1,0,0,0,1|1,0,0]=3 11869 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000210326 [0,1,0,0,0,1|1,0,0]=3 11870 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Cl 62a_100000755918_200012276598 [0,1,0,0,0,1|1,0,0]=3 11871 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)Cl 62a_200012276598_100000755918 [0,1,0,0,0,1|1,0,0]=3 11872 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000210326 [0,1,0,0,0,1|1,0,0]=3 11873 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)F 62a_100000211213_200012276598 [0,1,0,0,0,1|1,0,0]=3 11874 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)F 62a_200012276598_100000211213 [0,1,0,0,0,1|1,0,0]=3 11875 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)N 62a_100000185761_200012276598 [0,1,0,0,0,1|1,0,0]=3 11876 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)N 62a_200012276598_100000185761 [0,1,0,0,0,1|1,0,0]=3 11877 B16R1.51 CCCCCC(=O)CSc1ccc(cc1)O 62a_200012276598_100000185759 [0,1,0,0,0,1|1,0,0]=3 11878 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)Br 62a_100000686858_200012276598 [0,1,0,0,0,1|2,0,0]=4 11879 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)Br 62a_200012276598_100000686858 [0,1,0,0,0,1|2,0,0]=4 11880 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)C 62a_100011192072_200012276598 [0,1,0,0,0,1|2,0,0]=4 11881 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)C 62a_200012276598_100000754016 [0,1,0,0,0,1|2,0,0]=4 11882 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)Cl 62a_100011356976_200012276598 [0,1,0,0,0,1|2,0,0]=4 11883 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)Cl 62a_200012276598_100011356976 [0,1,0,0,0,1|2,0,0]=4 11884 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)F 62a_100000744514_200012276598 [0,1,0,0,0,1|2,0,0]=4 11885 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)F 62a_200012276598_100000744514 [0,1,0,0,0,1|2,0,0]=4 11886 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)N 62a_100000737798_200012276598 [0,1,0,0,0,1|2,0,0]=4 11887 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)N 62a_200012276598_100000737798 [0,1,0,0,0,1|2,0,0]=4 11888 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)O 62a_100000685995_200012276598 [0,1,0,0,0,1|2,0,0]=4 11889 B16R1.51 CCCCCC(=O)CSc1ccc(cn1)O 62a_200012276598_100000744096 [0,1,0,0,0,1|2,0,0]=4 11890 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)Br 62a_100009814638_200012276598 [0,1,0,0,0,1|2,0,0]=4 11891 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)Br 62a_200012276598_100009814638 [0,1,0,0,0,1|2,0,0]=4 11892 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)C 62a_100000751577_200012276598 [0,1,0,0,0,1|2,0,0]=4 11893 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)C 62a_200012276598_100000751577 [0,1,0,0,0,1|2,0,0]=4 11894 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)Cl 62a_100000034144_200012276598 [0,1,0,0,0,1|2,0,0]=4 11895 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)Cl 62a_200012276598_100000034144 [0,1,0,0,0,1|2,0,0]=4 11896 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)F 62a_100000042367_200012276598 [0,1,0,0,0,1|2,0,0]=4 11897 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)F 62a_200012276598_100000042367 [0,1,0,0,0,1|2,0,0]=4 11898 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)N 62a_100000187370_200012276598 [0,1,0,0,0,1|2,0,0]=4 11899 B16R1.51 CCCCCC(=O)CSc1ccc(nc1)N 62a_200012276598_100000187370 [0,1,0,0,0,1|2,0,0]=4 11900 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000212188 [0,1,0,0,0,1|1,0,0]=3 11901 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000212188 [0,1,0,0,0,1|1,0,0]=3 11902 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000212188 [0,1,0,0,0,1|1,0,0]=3 11903 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000212188 [0,1,0,0,0,1|1,0,0]=3 11904 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000212188 [0,1,0,0,0,1|1,0,0]=3 11905 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000212188 [0,1,0,0,0,1|1,0,0]=3 11906 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000212188 [0,1,0,0,0,1|1,0,0]=3 11907 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000212188 [0,1,0,0,0,1|1,0,0]=3 11908 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000212188 [0,1,0,0,0,1|1,0,0]=3 11909 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000212188 [0,1,0,0,0,1|1,0,0]=3 11910 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000212188 [0,1,0,0,0,1|1,0,0]=3 11911 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000212188 [0,1,0,0,0,1|1,0,0]=3 11912 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000212188 [0,1,0,0,0,1|1,0,0]=3 11913 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000212188 [0,1,0,0,0,1|1,0,0]=3 11914 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000212188 [0,1,0,0,0,1|1,0,0]=3 11915 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000212188 [0,1,0,0,0,1|1,0,0]=3 11916 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000212188 [0,1,0,0,0,1|1,0,0]=3 11917 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000212188 [0,1,0,0,0,1|1,0,0]=3 11918 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000212188 [0,1,0,0,0,1|1,0,0]=3 11919 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000212188 [0,1,0,0,0,1|1,0,0]=3 11920 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000212188 [0,1,0,0,0,1|1,0,0]=3 11921 B16R1.51 CCCCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000212188 [0,1,0,0,0,1|1,0,0]=3 11922 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Br 11a_100015188789_100000212188 [0,1,0,0,0,1|2,0,0]=4 11923 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Br 1626a_100015188789_100000212188 [0,1,0,0,0,1|2,0,0]=4 11924 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Br 240690a_100015188789_100000212188 [0,1,0,0,0,1|2,0,0]=4 11925 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Br 527a_100015188789_100000212188 [0,1,0,0,0,1|2,0,0]=4 11926 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)C 11a_100015187455_100000212188 [0,1,0,0,0,1|2,0,0]=4 11927 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)C 1626a_100015187455_100000212188 [0,1,0,0,0,1|2,0,0]=4 11928 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)C 240690a_100015187455_100000212188 [0,1,0,0,0,1|2,0,0]=4 11929 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)C 527a_100015187455_100000212188 [0,1,0,0,0,1|2,0,0]=4 11930 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Cl 11a_100000697193_100000212188 [0,1,0,0,0,1|2,0,0]=4 11931 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Cl 1626a_100000697193_100000212188 [0,1,0,0,0,1|2,0,0]=4 11932 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100000212188 [0,1,0,0,0,1|2,0,0]=4 11933 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)Cl 527a_100000697193_100000212188 [0,1,0,0,0,1|2,0,0]=4 11934 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)F 11a_100020620131_100000212188 [0,1,0,0,0,1|2,0,0]=4 11935 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)F 1626a_100020620131_100000212188 [0,1,0,0,0,1|2,0,0]=4 11936 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)F 240690a_100020620131_100000212188 [0,1,0,0,0,1|2,0,0]=4 11937 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)F 527a_100020620131_100000212188 [0,1,0,0,0,1|2,0,0]=4 11938 B16R1.51 CCCCCC(=O)NCc1ccc(cn1)O 240690a_100020605196_100000212188 [0,1,0,0,0,1|2,0,0]=4 11939 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Br 11a_100009817727_100000212188 [0,1,0,0,0,1|2,0,0]=4 11940 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Br 240690a_100009817727_100000212188 [0,1,0,0,0,1|2,0,0]=4 11941 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Br 527a_100009817727_100000212188 [0,1,0,0,0,1|2,0,0]=4 11942 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)C 11a_100000740942_100000212188 [0,1,0,0,0,1|2,0,0]=4 11943 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)C 1626a_100000740942_100000212188 [0,1,0,0,0,1|2,0,0]=4 11944 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)C 240690a_100000740942_100000212188 [0,1,0,0,0,1|2,0,0]=4 11945 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)C 527a_100000740942_100000212188 [0,1,0,0,0,1|2,0,0]=4 11946 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Cl 11a_100000735879_100000212188 [0,1,0,0,0,1|2,0,0]=4 11947 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Cl 1626a_100000735879_100000212188 [0,1,0,0,0,1|2,0,0]=4 11948 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100000212188 [0,1,0,0,0,1|2,0,0]=4 11949 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)Cl 527a_100000735879_100000212188 [0,1,0,0,0,1|2,0,0]=4 11950 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)F 11a_100000101913_100000212188 [0,1,0,0,0,1|2,0,0]=4 11951 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)F 1626a_100000101913_100000212188 [0,1,0,0,0,1|2,0,0]=4 11952 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)F 240690a_100000101913_100000212188 [0,1,0,0,0,1|2,0,0]=4 11953 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)F 527a_100000101913_100000212188 [0,1,0,0,0,1|2,0,0]=4 11954 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)O 11a_100000757128_100000212188 [0,1,0,0,0,1|2,0,0]=4 11955 B16R1.51 CCCCCC(=O)NCc1ccc(nc1)O 240690a_100000757128_100000212188 [0,1,0,0,0,1|2,0,0]=4 11956 B16R1.51 CCCCCC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000212188 [0,1,0,0,0,1|2,0,0]=4 11957 B16R1.51 CCCCCC(=O)NNc1ccc(cc1)C 22a_100000683527_100000212188 [0,1,0,0,0,1|2,0,0]=4 11958 B16R1.51 CCCCCC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000212188 [0,1,0,0,0,1|2,0,0]=4 11959 B16R1.51 CCCCCC(=O)NNc1ccc(cc1)F 22a_100000728448_100000212188 [0,1,0,0,0,1|2,0,0]=4 11960 B16R1.51 CCCCCC(=O)NNc1ccc(cc1)I 22a_100016988836_100000212188 [0,1,0,0,0,1|2,0,0]=4 11961 B16R1.51 CCCCNC(=O)C#Cc1ccc(cc1)Cl 240690a_100000102301_100011892723 [0,1,0,0,0,1|1,0,1]=4 11962 B16R1.51 CCCCNC(=O)C#Cc1ccc(cc1)F 240690a_100000102301_100000238512 [0,1,0,0,0,1|1,0,1]=4 11963 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Br 11a_100000102301_100016267368 [0,1,0,0,0,1|1,0,1]=4 11964 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Br 1626a_100000102301_100016267368 [0,1,0,0,0,1|1,0,1]=4 11965 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)C 11a_100000102301_100000716854 [0,1,0,0,0,1|1,0,1]=4 11966 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)C 1626a_100000102301_100000716854 [0,1,0,0,0,1|1,0,1]=4 11967 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)C 240690a_100000102301_100000716854 [0,1,0,0,0,1|1,0,1]=4 11968 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Cl 11a_100000102301_100000184863 [0,1,0,0,0,1|1,0,1]=4 11969 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Cl 1626a_100000102301_100000184863 [0,1,0,0,0,1|1,0,1]=4 11970 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)Cl 240690a_100000102301_100000184863 [0,1,0,0,0,1|1,0,1]=4 11971 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)F 11a_100000102301_100000182136 [0,1,0,0,0,1|1,0,1]=4 11972 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)F 1626a_100000102301_100000182136 [0,1,0,0,0,1|1,0,1]=4 11973 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)F 240690a_100000102301_100000182136 [0,1,0,0,0,1|1,0,1]=4 11974 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)I 11a_100000102301_100102526154 [0,1,0,0,0,1|1,0,1]=4 11975 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)I 1626a_100000102301_100102526154 [0,1,0,0,0,1|1,0,1]=4 11976 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)I 240690a_100000102301_100102526154 [0,1,0,0,0,1|1,0,1]=4 11977 B16R1.51 CCCCNC(=O)C=Cc1ccc(cc1)O 240690a_100000102301_100016269017 [0,1,0,0,0,1|1,0,1]=4 11978 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br 11a_100000102301_100000217147 [0,1,0,0,0,1|1,0,0]=3 11979 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br 1626a_100000102301_100000217147 [0,1,0,0,0,1|1,0,0]=3 11980 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br 240690a_100000102301_100000217147 [0,1,0,0,0,1|1,0,0]=3 11981 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Br 527a_100000102301_100000217147 [0,1,0,0,0,1|1,0,0]=3 11982 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C 11a_100000102301_100000234883 [0,1,0,0,0,1|1,0,0]=3 11983 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C 1626a_100000102301_100000234883 [0,1,0,0,0,1|1,0,0]=3 11984 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C 240690a_100000102301_100000234883 [0,1,0,0,0,1|1,0,0]=3 11985 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)C 527a_100000102301_100000234883 [0,1,0,0,0,1|1,0,0]=3 11986 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Cl 11a_100000102301_100000235379 [0,1,0,0,0,1|1,0,0]=3 11987 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Cl 1626a_100000102301_100000235379 [0,1,0,0,0,1|1,0,0]=3 11988 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Cl 240690a_100000102301_100000235379 [0,1,0,0,0,1|1,0,0]=3 11989 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)Cl 527a_100000102301_100000235379 [0,1,0,0,0,1|1,0,0]=3 11990 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F 11a_100000102301_100000198493 [0,1,0,0,0,1|1,0,0]=3 11991 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F 1626a_100000102301_100000198493 [0,1,0,0,0,1|1,0,0]=3 11992 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F 240690a_100000102301_100000198493 [0,1,0,0,0,1|1,0,0]=3 11993 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)F 527a_100000102301_100000198493 [0,1,0,0,0,1|1,0,0]=3 11994 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)I 11a_100000102301_100011217499 [0,1,0,0,0,1|1,0,0]=3 11995 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)I 1626a_100000102301_100011217499 [0,1,0,0,0,1|1,0,0]=3 11996 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)I 240690a_100000102301_100011217499 [0,1,0,0,0,1|1,0,0]=3 11997 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)I 527a_100000102301_100011217499 [0,1,0,0,0,1|1,0,0]=3 11998 B16R1.51 CCCCNC(=O)CCc1ccc(cc1)O 240690a_100000102301_100000742835 [0,1,0,0,0,1|1,0,0]=3 11999 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000182744 [0,1,0,0,0,1|1,0,0]=3 12000 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000182744 [0,1,0,0,0,1|1,0,0]=3 12001 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000182744 [0,1,0,0,0,1|1,0,0]=3 12002 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000182744 [0,1,0,0,0,1|1,0,0]=3 12003 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000182744 [0,1,0,0,0,1|1,0,0]=3 12004 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000182744 [0,1,0,0,0,1|1,0,0]=3 12005 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000182744 [0,1,0,0,0,1|1,0,0]=3 12006 B16R1.51 CCCCNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000182744 [0,1,0,0,0,1|1,0,0]=3 12007 B16R1.51 CCCCNC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000182744 [0,1,0,0,0,1|2,0,0]=4 12008 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 11a_100000102301_100000182358 [0,1,0,0,0,1|1,0,0]=3 12009 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 1626a_100000102301_100000182358 [0,1,0,0,0,1|1,0,0]=3 12010 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 240690a_100000102301_100000182358 [0,1,0,0,0,1|1,0,0]=3 12011 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000182744 [0,1,0,0,0,1|1,0,0]=3 12012 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 527a_100000102301_100000182358 [0,1,0,0,0,1|1,0,0]=3 12013 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000182744 [0,1,0,0,0,1|1,0,0]=3 12014 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 11a_100000102301_100000182360 [0,1,0,0,0,1|1,0,0]=3 12015 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 1626a_100000102301_100000182360 [0,1,0,0,0,1|1,0,0]=3 12016 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 240690a_100000102301_100000182360 [0,1,0,0,0,1|1,0,0]=3 12017 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 34a_100000210336_100000182744 [0,1,0,0,0,1|1,0,0]=3 12018 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 527a_100000102301_100000182360 [0,1,0,0,0,1|1,0,0]=3 12019 B16R1.51 CCCCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000182744 [0,1,0,0,0,1|1,0,0]=3 12020 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 11a_100000102301_100016990877 [0,1,0,0,0,1|1,0,0]=3 12021 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 1626a_100000102301_100016990877 [0,1,0,0,0,1|1,0,0]=3 12022 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 240690a_100000102301_100016990877 [0,1,0,0,0,1|1,0,0]=3 12023 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000182744 [0,1,0,0,0,1|1,0,0]=3 12024 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 527a_100000102301_100016990877 [0,1,0,0,0,1|1,0,0]=3 12025 B16R1.51 CCCCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000182744 [0,1,0,0,0,1|1,0,0]=3 12026 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F 11a_100000102301_100000184765 [0,1,0,0,0,1|1,0,0]=3 12027 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F 1626a_100000102301_100000184765 [0,1,0,0,0,1|1,0,0]=3 12028 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F 240690a_100000102301_100000184765 [0,1,0,0,0,1|1,0,0]=3 12029 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F 34a_100000210339_100000182744 [0,1,0,0,0,1|1,0,0]=3 12030 B16R1.51 CCCCNC(=O)COc1ccc(cc1)F 527a_100000102301_100000184765 [0,1,0,0,0,1|1,0,0]=3 12031 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 11a_100000102301_100000184369 [0,1,0,0,0,1|1,0,0]=3 12032 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 1626a_100000102301_100000184369 [0,1,0,0,0,1|1,0,0]=3 12033 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 240690a_100000102301_100000184369 [0,1,0,0,0,1|1,0,0]=3 12034 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 34a_100000212066_100000182744 [0,1,0,0,0,1|1,0,0]=3 12035 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 527a_100000102301_100000184369 [0,1,0,0,0,1|1,0,0]=3 12036 B16R1.51 CCCCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000182744 [0,1,0,0,0,1|1,0,0]=3 12037 B16R1.51 CCCCNC(=O)COc1ccc(cc1)N 34a_100000185829_100000182744 [0,1,0,0,0,1|1,0,0]=3 12038 B16R1.51 CCCCNC(=O)COc1ccc(cc1)O 240690a_100000102301_100000031633 [0,1,0,0,0,1|1,0,0]=3 12039 B16R1.51 CCCCNC(=O)COc1ccc(cc1)O 527a_100000102301_100000031633 [0,1,0,0,0,1|1,0,0]=3 12040 B16R1.51 CCCCNC(=O)COc1ccc(cn1)C 34a_100000759353_100000182744 [0,1,0,0,0,1|2,0,0]=4 12041 B16R1.51 CCCCNC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000182744 [0,1,0,0,0,1|2,0,0]=4 12042 B16R1.51 CCCCNC(=O)COc1ccc(cn1)F 34a_100000742473_100000182744 [0,1,0,0,0,1|2,0,0]=4 12043 B16R1.51 CCCCNC(=O)COc1ccc(cn1)N 34a_100000729260_100000182744 [0,1,0,0,0,1|2,0,0]=4 12044 B16R1.51 CCCCNC(=O)COc1ccc(nc1)Br 34a_100000685995_100000182744 [0,1,0,0,0,1|2,0,0]=4 12045 B16R1.51 CCCCNC(=O)COc1ccc(nc1)Br 7a_100000685995_100000182744 [0,1,0,0,0,1|2,0,0]=4 12046 B16R1.51 CCCCNC(=O)COc1ccc(nc1)C 34a_100000745506_100000182744 [0,1,0,0,0,1|2,0,0]=4 12047 B16R1.51 CCCCNC(=O)COc1ccc(nc1)C 7a_100000745506_100000182744 [0,1,0,0,0,1|2,0,0]=4 12048 B16R1.51 CCCCNC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000182744 [0,1,0,0,0,1|2,0,0]=4 12049 B16R1.51 CCCCNC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000182744 [0,1,0,0,0,1|2,0,0]=4 12050 B16R1.51 CCCCNC(=O)COc1ccc(nc1)F 34a_100000688820_100000182744 [0,1,0,0,0,1|2,0,0]=4 12051 B16R1.51 CCCCNC(=O)COc1ccc(nc1)F 7a_100000688820_100000182744 [0,1,0,0,0,1|2,0,0]=4 12052 B16R1.51 CCCCNC(=O)COc1ccc(nc1)I 34a_100000687607_100000182744 [0,1,0,0,0,1|2,0,0]=4 12053 B16R1.51 CCCCNC(=O)COc1ccc(nc1)I 7a_100000687607_100000182744 [0,1,0,0,0,1|2,0,0]=4 12054 B16R1.51 CCCCNC(=O)COc1ccc(nc1)N 34a_100015188713_100000182744 [0,1,0,0,0,1|2,0,0]=4 12055 B16R1.51 CCCCNC(=O)COc1ccc(nc1)N 7a_100015188713_100000182744 [0,1,0,0,0,1|2,0,0]=4 12056 B16R1.51 CCCCNC(=O)CSc1cc[n+](cc1)[O-] 62a_100000182744_100000039755 [0,1,0,0,0,1|2,0,0]=4 12057 B16R1.51 CCCCNC(=O)CSc1ccc(=O)[nH]c1 62a_100000182744_100000212171 [0,1,0,0,0,1|2,0,0]=4 12058 B16R1.51 CCCCNC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000182744 [0,1,0,0,0,1|2,0,0]=4 12059 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 11a_100000102301_100000179496 [0,1,0,0,0,1|1,0,0]=3 12060 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 1626a_100000102301_100000179496 [0,1,0,0,0,1|1,0,0]=3 12061 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 240690a_100000102301_100000179496 [0,1,0,0,0,1|1,0,0]=3 12062 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 527a_100000102301_100000179496 [0,1,0,0,0,1|1,0,0]=3 12063 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 62a_100000182744_100000752885 [0,1,0,0,0,1|1,0,0]=3 12064 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000182744 [0,1,0,0,0,1|1,0,0]=3 12065 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 11a_100000102301_100000179497 [0,1,0,0,0,1|1,0,0]=3 12066 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 1626a_100000102301_100000179497 [0,1,0,0,0,1|1,0,0]=3 12067 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 240690a_100000102301_100000179497 [0,1,0,0,0,1|1,0,0]=3 12068 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 527a_100000102301_100000179497 [0,1,0,0,0,1|1,0,0]=3 12069 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 62a_100000182744_100000186775 [0,1,0,0,0,1|1,0,0]=3 12070 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000182744 [0,1,0,0,0,1|1,0,0]=3 12071 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 11a_100000102301_100000178402 [0,1,0,0,0,1|1,0,0]=3 12072 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 1626a_100000102301_100000178402 [0,1,0,0,0,1|1,0,0]=3 12073 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 240690a_100000102301_100000178402 [0,1,0,0,0,1|1,0,0]=3 12074 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 527a_100000102301_100000178402 [0,1,0,0,0,1|1,0,0]=3 12075 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 62a_100000182744_100000755918 [0,1,0,0,0,1|1,0,0]=3 12076 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000182744 [0,1,0,0,0,1|1,0,0]=3 12077 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 11a_100000102301_100000691584 [0,1,0,0,0,1|1,0,0]=3 12078 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 1626a_100000102301_100000691584 [0,1,0,0,0,1|1,0,0]=3 12079 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 240690a_100000102301_100000691584 [0,1,0,0,0,1|1,0,0]=3 12080 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 527a_100000102301_100000691584 [0,1,0,0,0,1|1,0,0]=3 12081 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 62a_100000182744_100000211213 [0,1,0,0,0,1|1,0,0]=3 12082 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000182744 [0,1,0,0,0,1|1,0,0]=3 12083 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)N 62a_100000182744_100000185761 [0,1,0,0,0,1|1,0,0]=3 12084 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000182744 [0,1,0,0,0,1|1,0,0]=3 12085 B16R1.51 CCCCNC(=O)CSc1ccc(cc1)O 62a_100000182744_100000185759 [0,1,0,0,0,1|1,0,0]=3 12086 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)Br 62a_100000182744_100000686858 [0,1,0,0,0,1|2,0,0]=4 12087 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000182744 [0,1,0,0,0,1|2,0,0]=4 12088 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)C 62a_100000182744_100000754016 [0,1,0,0,0,1|2,0,0]=4 12089 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)C 62a_100011192072_100000182744 [0,1,0,0,0,1|2,0,0]=4 12090 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)Cl 62a_100000182744_100011356976 [0,1,0,0,0,1|2,0,0]=4 12091 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000182744 [0,1,0,0,0,1|2,0,0]=4 12092 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)F 62a_100000182744_100000744514 [0,1,0,0,0,1|2,0,0]=4 12093 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)F 62a_100000744514_100000182744 [0,1,0,0,0,1|2,0,0]=4 12094 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)N 62a_100000182744_100000737798 [0,1,0,0,0,1|2,0,0]=4 12095 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)N 62a_100000737798_100000182744 [0,1,0,0,0,1|2,0,0]=4 12096 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)O 62a_100000182744_100000744096 [0,1,0,0,0,1|2,0,0]=4 12097 B16R1.51 CCCCNC(=O)CSc1ccc(cn1)O 62a_100000685995_100000182744 [0,1,0,0,0,1|2,0,0]=4 12098 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)Br 62a_100000182744_100009814638 [0,1,0,0,0,1|2,0,0]=4 12099 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000182744 [0,1,0,0,0,1|2,0,0]=4 12100 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)C 62a_100000182744_100000751577 [0,1,0,0,0,1|2,0,0]=4 12101 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)C 62a_100000751577_100000182744 [0,1,0,0,0,1|2,0,0]=4 12102 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000182744 [0,1,0,0,0,1|2,0,0]=4 12103 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)Cl 62a_100000182744_100000034144 [0,1,0,0,0,1|2,0,0]=4 12104 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)F 62a_100000042367_100000182744 [0,1,0,0,0,1|2,0,0]=4 12105 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)F 62a_100000182744_100000042367 [0,1,0,0,0,1|2,0,0]=4 12106 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)N 62a_100000182744_100000187370 [0,1,0,0,0,1|2,0,0]=4 12107 B16R1.51 CCCCNC(=O)CSc1ccc(nc1)N 62a_100000187370_100000182744 [0,1,0,0,0,1|2,0,0]=4 12108 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 2708a_100000102301_100000174875 [0,1,0,0,0,1|1,0,0]=3 12109 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_100000102301 [0,1,0,0,0,1|1,0,0]=3 12110 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 273464a_100000102301_100000174875 [0,1,0,0,0,1|1,0,0]=3 12111 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100000102301 [0,1,0,0,0,1|1,0,0]=3 12112 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 512a_100000102301_100000174875 [0,1,0,0,0,1|1,0,0]=3 12113 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100000102301 [0,1,0,0,0,1|1,0,0]=3 12114 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 2708a_100000102301_100000174908 [0,1,0,0,0,1|1,0,0]=3 12115 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 2708a_100000174908_100000102301 [0,1,0,0,0,1|1,0,0]=3 12116 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 273464a_100000102301_100000174908 [0,1,0,0,0,1|1,0,0]=3 12117 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100000102301 [0,1,0,0,0,1|1,0,0]=3 12118 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 512a_100000102301_100000174908 [0,1,0,0,0,1|1,0,0]=3 12119 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)C 512a_100000174908_100000102301 [0,1,0,0,0,1|1,0,0]=3 12120 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Cl 2708a_100000102301_100000174871 [0,1,0,0,0,1|1,0,0]=3 12121 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100000102301 [0,1,0,0,0,1|1,0,0]=3 12122 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000102301_100000174871 [0,1,0,0,0,1|1,0,0]=3 12123 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000102301 [0,1,0,0,0,1|1,0,0]=3 12124 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)Cl 512a_100000102301_100000174871 [0,1,0,0,0,1|1,0,0]=3 12125 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 2708a_100000102301_100000174882 [0,1,0,0,0,1|1,0,0]=3 12126 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 2708a_100000174882_100000102301 [0,1,0,0,0,1|1,0,0]=3 12127 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 273464a_100000102301_100000174882 [0,1,0,0,0,1|1,0,0]=3 12128 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100000102301 [0,1,0,0,0,1|1,0,0]=3 12129 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 512a_100000102301_100000174882 [0,1,0,0,0,1|1,0,0]=3 12130 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)F 512a_100000174882_100000102301 [0,1,0,0,0,1|1,0,0]=3 12131 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 2708a_100000102301_100016989417 [0,1,0,0,0,1|1,0,0]=3 12132 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 2708a_100016989417_100000102301 [0,1,0,0,0,1|1,0,0]=3 12133 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 273464a_100000102301_100016989417 [0,1,0,0,0,1|1,0,0]=3 12134 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100000102301 [0,1,0,0,0,1|1,0,0]=3 12135 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 512a_100000102301_100016989417 [0,1,0,0,0,1|1,0,0]=3 12136 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)I 512a_100016989417_100000102301 [0,1,0,0,0,1|1,0,0]=3 12137 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)O 2708a_100000102301_100000185549 [0,1,0,0,0,1|1,0,0]=3 12138 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)O 2708a_100000185549_100000102301 [0,1,0,0,0,1|1,0,0]=3 12139 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)O 273464a_100000102301_100000185549 [0,1,0,0,0,1|1,0,0]=3 12140 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100000102301 [0,1,0,0,0,1|1,0,0]=3 12141 B16R1.51 CCCCNC(=O)NCc1ccc(cc1)O 512a_100000102301_100000185549 [0,1,0,0,0,1|1,0,0]=3 12142 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 2708a_100000102301_100015188789 [0,1,0,0,0,1|2,0,0]=4 12143 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 2708a_100015188789_100000102301 [0,1,0,0,0,1|2,0,0]=4 12144 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 273464a_100000102301_100015188789 [0,1,0,0,0,1|2,0,0]=4 12145 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 273464a_100015188789_100000102301 [0,1,0,0,0,1|2,0,0]=4 12146 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 512a_100000102301_100015188789 [0,1,0,0,0,1|2,0,0]=4 12147 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Br 512a_100015188789_100000102301 [0,1,0,0,0,1|2,0,0]=4 12148 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 2708a_100000102301_100015187455 [0,1,0,0,0,1|2,0,0]=4 12149 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 2708a_100015187455_100000102301 [0,1,0,0,0,1|2,0,0]=4 12150 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 273464a_100000102301_100015187455 [0,1,0,0,0,1|2,0,0]=4 12151 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 273464a_100015187455_100000102301 [0,1,0,0,0,1|2,0,0]=4 12152 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 512a_100000102301_100015187455 [0,1,0,0,0,1|2,0,0]=4 12153 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)C 512a_100015187455_100000102301 [0,1,0,0,0,1|2,0,0]=4 12154 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 2708a_100000102301_100000697193 [0,1,0,0,0,1|2,0,0]=4 12155 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 2708a_100000697193_100000102301 [0,1,0,0,0,1|2,0,0]=4 12156 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 273464a_100000102301_100000697193 [0,1,0,0,0,1|2,0,0]=4 12157 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 273464a_100000697193_100000102301 [0,1,0,0,0,1|2,0,0]=4 12158 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 512a_100000102301_100000697193 [0,1,0,0,0,1|2,0,0]=4 12159 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)Cl 512a_100000697193_100000102301 [0,1,0,0,0,1|2,0,0]=4 12160 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 2708a_100000102301_100020620131 [0,1,0,0,0,1|2,0,0]=4 12161 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 2708a_100020620131_100000102301 [0,1,0,0,0,1|2,0,0]=4 12162 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 273464a_100000102301_100020620131 [0,1,0,0,0,1|2,0,0]=4 12163 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 273464a_100020620131_100000102301 [0,1,0,0,0,1|2,0,0]=4 12164 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 512a_100000102301_100020620131 [0,1,0,0,0,1|2,0,0]=4 12165 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)F 512a_100020620131_100000102301 [0,1,0,0,0,1|2,0,0]=4 12166 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)O 2708a_100000102301_100020605196 [0,1,0,0,0,1|2,0,0]=4 12167 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)O 2708a_100020605196_100000102301 [0,1,0,0,0,1|2,0,0]=4 12168 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)O 273464a_100000102301_100020605196 [0,1,0,0,0,1|2,0,0]=4 12169 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)O 273464a_100020605196_100000102301 [0,1,0,0,0,1|2,0,0]=4 12170 B16R1.51 CCCCNC(=O)NCc1ccc(cn1)O 512a_100000102301_100020605196 [0,1,0,0,0,1|2,0,0]=4 12171 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 2708a_100000102301_100009817727 [0,1,0,0,0,1|2,0,0]=4 12172 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 2708a_100009817727_100000102301 [0,1,0,0,0,1|2,0,0]=4 12173 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 273464a_100000102301_100009817727 [0,1,0,0,0,1|2,0,0]=4 12174 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 273464a_100009817727_100000102301 [0,1,0,0,0,1|2,0,0]=4 12175 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 512a_100000102301_100009817727 [0,1,0,0,0,1|2,0,0]=4 12176 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Br 512a_100009817727_100000102301 [0,1,0,0,0,1|2,0,0]=4 12177 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 2708a_100000102301_100000740942 [0,1,0,0,0,1|2,0,0]=4 12178 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 2708a_100000740942_100000102301 [0,1,0,0,0,1|2,0,0]=4 12179 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 273464a_100000102301_100000740942 [0,1,0,0,0,1|2,0,0]=4 12180 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 273464a_100000740942_100000102301 [0,1,0,0,0,1|2,0,0]=4 12181 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 512a_100000102301_100000740942 [0,1,0,0,0,1|2,0,0]=4 12182 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)C 512a_100000740942_100000102301 [0,1,0,0,0,1|2,0,0]=4 12183 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 2708a_100000102301_100000735879 [0,1,0,0,0,1|2,0,0]=4 12184 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 2708a_100000735879_100000102301 [0,1,0,0,0,1|2,0,0]=4 12185 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 273464a_100000102301_100000735879 [0,1,0,0,0,1|2,0,0]=4 12186 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 273464a_100000735879_100000102301 [0,1,0,0,0,1|2,0,0]=4 12187 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 512a_100000102301_100000735879 [0,1,0,0,0,1|2,0,0]=4 12188 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)Cl 512a_100000735879_100000102301 [0,1,0,0,0,1|2,0,0]=4 12189 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 2708a_100000101913_100000102301 [0,1,0,0,0,1|2,0,0]=4 12190 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 2708a_100000102301_100000101913 [0,1,0,0,0,1|2,0,0]=4 12191 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 273464a_100000101913_100000102301 [0,1,0,0,0,1|2,0,0]=4 12192 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 273464a_100000102301_100000101913 [0,1,0,0,0,1|2,0,0]=4 12193 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 512a_100000101913_100000102301 [0,1,0,0,0,1|2,0,0]=4 12194 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)F 512a_100000102301_100000101913 [0,1,0,0,0,1|2,0,0]=4 12195 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)O 2708a_100000102301_100000757128 [0,1,0,0,0,1|2,0,0]=4 12196 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)O 2708a_100000757128_100000102301 [0,1,0,0,0,1|2,0,0]=4 12197 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)O 273464a_100000102301_100000757128 [0,1,0,0,0,1|2,0,0]=4 12198 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)O 273464a_100000757128_100000102301 [0,1,0,0,0,1|2,0,0]=4 12199 B16R1.51 CCCCNC(=O)NCc1ccc(nc1)O 512a_100000102301_100000757128 [0,1,0,0,0,1|2,0,0]=4 12200 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)Br 273464a_100000102301_100000735608 [0,1,0,0,0,1|2,0,0]=4 12201 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)Br 512a_100000102301_100000735608 [0,1,0,0,0,1|2,0,0]=4 12202 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)C 273464a_100000102301_100000683527 [0,1,0,0,0,1|2,0,0]=4 12203 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)C 512a_100000102301_100000683527 [0,1,0,0,0,1|2,0,0]=4 12204 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)Cl 273464a_100000102301_100000683521 [0,1,0,0,0,1|2,0,0]=4 12205 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)Cl 512a_100000102301_100000683521 [0,1,0,0,0,1|2,0,0]=4 12206 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)F 273464a_100000102301_100000728448 [0,1,0,0,0,1|2,0,0]=4 12207 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)F 512a_100000102301_100000728448 [0,1,0,0,0,1|2,0,0]=4 12208 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)I 273464a_100000102301_100016988836 [0,1,0,0,0,1|2,0,0]=4 12209 B16R1.51 CCCCNC(=O)NNc1ccc(cc1)I 512a_100000102301_100016988836 [0,1,0,0,0,1|2,0,0]=4 12210 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000211628 [0,1,0,0,0,1|0,0,0]=2 12211 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000211628 [0,1,0,0,0,1|0,0,0]=2 12212 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)C 34a_100000124888_100000211628 [0,1,0,0,0,1|0,0,0]=2 12213 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000211628 [0,1,0,0,0,1|0,0,0]=2 12214 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000211628 [0,1,0,0,0,1|0,0,0]=2 12215 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)F 34a_100000185862_100000211628 [0,1,0,0,0,1|0,0,0]=2 12216 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)I 34a_100000185761_100000211628 [0,1,0,0,0,1|0,0,0]=2 12217 B16R1.51 CCCCOC(=O)CNc1ccc(cc1)O 34a_100000185829_100000211628 [0,1,0,0,0,1|0,0,0]=2 12218 B16R1.51 CCCCOC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_100000211628 [0,1,0,0,0,1|1,0,0]=3 12219 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Br 34a_100000185759_100000211628 [0,1,0,0,0,1|0,0,0]=2 12220 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Br 7a_100000185759_100000211628 [0,1,0,0,0,1|0,0,0]=2 12221 B16R1.51 CCCCOC(=O)COc1ccc(cc1)C 34a_100000210336_100000211628 [0,1,0,0,0,1|0,0,0]=2 12222 B16R1.51 CCCCOC(=O)COc1ccc(cc1)C 7a_100000210336_100000211628 [0,1,0,0,0,1|0,0,0]=2 12223 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000211628 [0,1,0,0,0,1|0,0,0]=2 12224 B16R1.51 CCCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000211628 [0,1,0,0,0,1|0,0,0]=2 12225 B16R1.51 CCCCOC(=O)COc1ccc(cc1)F 34a_100000210339_100000211628 [0,1,0,0,0,1|0,0,0]=2 12226 B16R1.51 CCCCOC(=O)COc1ccc(cc1)I 34a_100000212066_100000211628 [0,1,0,0,0,1|0,0,0]=2 12227 B16R1.51 CCCCOC(=O)COc1ccc(cc1)I 7a_100000212066_100000211628 [0,1,0,0,0,1|0,0,0]=2 12228 B16R1.51 CCCCOC(=O)COc1ccc(cc1)N 34a_100000185829_100000211628 [0,1,0,0,0,1|0,0,0]=2 12229 B16R1.51 CCCCOC(=O)COc1ccc(cn1)C 34a_100000759353_100000211628 [0,1,0,0,0,1|1,0,0]=3 12230 B16R1.51 CCCCOC(=O)COc1ccc(cn1)Cl 34a_100011215309_100000211628 [0,1,0,0,0,1|1,0,0]=3 12231 B16R1.51 CCCCOC(=O)COc1ccc(cn1)F 34a_100000742473_100000211628 [0,1,0,0,0,1|1,0,0]=3 12232 B16R1.51 CCCCOC(=O)COc1ccc(cn1)N 34a_100000729260_100000211628 [0,1,0,0,0,1|1,0,0]=3 12233 B16R1.51 CCCCOC(=O)COc1ccc(nc1)Br 34a_100000685995_100000211628 [0,1,0,0,0,1|1,0,0]=3 12234 B16R1.51 CCCCOC(=O)COc1ccc(nc1)Br 7a_100000685995_100000211628 [0,1,0,0,0,1|1,0,0]=3 12235 B16R1.51 CCCCOC(=O)COc1ccc(nc1)C 34a_100000745506_100000211628 [0,1,0,0,0,1|1,0,0]=3 12236 B16R1.51 CCCCOC(=O)COc1ccc(nc1)C 7a_100000745506_100000211628 [0,1,0,0,0,1|1,0,0]=3 12237 B16R1.51 CCCCOC(=O)COc1ccc(nc1)Cl 34a_100000744096_100000211628 [0,1,0,0,0,1|1,0,0]=3 12238 B16R1.51 CCCCOC(=O)COc1ccc(nc1)Cl 7a_100000744096_100000211628 [0,1,0,0,0,1|1,0,0]=3 12239 B16R1.51 CCCCOC(=O)COc1ccc(nc1)F 34a_100000688820_100000211628 [0,1,0,0,0,1|1,0,0]=3 12240 B16R1.51 CCCCOC(=O)COc1ccc(nc1)F 7a_100000688820_100000211628 [0,1,0,0,0,1|1,0,0]=3 12241 B16R1.51 CCCCOC(=O)COc1ccc(nc1)I 34a_100000687607_100000211628 [0,1,0,0,0,1|1,0,0]=3 12242 B16R1.51 CCCCOC(=O)COc1ccc(nc1)I 7a_100000687607_100000211628 [0,1,0,0,0,1|1,0,0]=3 12243 B16R1.51 CCCCOC(=O)COc1ccc(nc1)N 34a_100015188713_100000211628 [0,1,0,0,0,1|1,0,0]=3 12244 B16R1.51 CCCCOC(=O)COc1ccc(nc1)N 7a_100015188713_100000211628 [0,1,0,0,0,1|1,0,0]=3 12245 B16R1.51 CCCCOC(=O)COc1cnc(cn1)Br 34a_100011934580_100000211628 [0,1,0,0,0,1|2,0,0]=4 12246 B16R1.51 CCCCOC(=O)COc1cnc(cn1)Cl 34a_100015839800_100000211628 [0,1,0,0,0,1|2,0,0]=4 12247 B16R1.51 CCCCOC(=O)COc1cnc(nc1)Br 34a_100000730009_100000211628 [0,1,0,0,0,1|2,0,0]=4 12248 B16R1.51 CCCCOC(=O)COc1cnc(nc1)Br 7a_100000730009_100000211628 [0,1,0,0,0,1|2,0,0]=4 12249 B16R1.51 CCCCOC(=O)COc1cnc(nc1)C 34a_100000062939_100000211628 [0,1,0,0,0,1|2,0,0]=4 12250 B16R1.51 CCCCOC(=O)COc1cnc(nc1)C 7a_100000062939_100000211628 [0,1,0,0,0,1|2,0,0]=4 12251 B16R1.51 CCCCOC(=O)COc1cnc(nc1)Cl 34a_100000092845_100000211628 [0,1,0,0,0,1|2,0,0]=4 12252 B16R1.51 CCCCOC(=O)COc1cnc(nc1)Cl 7a_100000092845_100000211628 [0,1,0,0,0,1|2,0,0]=4 12253 B16R1.51 CCCCOC(=O)COc1cnc(nc1)F 34a_200009874573_100000211628 [0,1,0,0,0,1|2,0,0]=4 12254 B16R1.51 CCCCOC(=O)COc1cnc(nc1)F 7a_200009874573_100000211628 [0,1,0,0,0,1|2,0,0]=4 12255 B16R1.51 CCCCOC(=O)COc1cnc(nc1)N 34a_100000087137_100000211628 [0,1,0,0,0,1|2,0,0]=4 12256 B16R1.51 CCCCOC(=O)COc1cnc(nc1)N 7a_100000087137_100000211628 [0,1,0,0,0,1|2,0,0]=4 12257 B16R1.51 CCCCOC(=O)COc1ncc(cn1)F 34a_100011934040_100000211628 [0,1,0,0,0,1|2,0,0]=4 12258 B16R1.51 CCCCOC(=O)CSc1cc[n+](cc1)[O-] 62a_100000211628_100000039755 [0,1,0,0,0,1|1,0,0]=3 12259 B16R1.51 CCCCOC(=O)CSc1ccc(=O)[nH]c1 62a_100000211628_100000212171 [0,1,0,0,0,1|1,0,0]=3 12260 B16R1.51 CCCCOC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000211628 [0,1,0,0,0,1|1,0,0]=3 12261 B16R1.51 CCCCOC(=O)CSc1ccc(=O)[nH]n1 62a_100000211628_100009820020 [0,1,0,0,0,1|2,0,0]=4 12262 B16R1.51 CCCCOC(=O)CSc1ccc(=O)[nH]n1 62a_100009820020_100000211628 [0,1,0,0,0,1|2,0,0]=4 12263 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)Br 62a_100000211628_100000752885 [0,1,0,0,0,1|0,0,0]=2 12264 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000211628 [0,1,0,0,0,1|0,0,0]=2 12265 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)C 62a_100000186775_100000211628 [0,1,0,0,0,1|0,0,0]=2 12266 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)C 62a_100000211628_100000186775 [0,1,0,0,0,1|0,0,0]=2 12267 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)Cl 62a_100000211628_100000755918 [0,1,0,0,0,1|0,0,0]=2 12268 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000211628 [0,1,0,0,0,1|0,0,0]=2 12269 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)F 62a_100000211213_100000211628 [0,1,0,0,0,1|0,0,0]=2 12270 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)F 62a_100000211628_100000211213 [0,1,0,0,0,1|0,0,0]=2 12271 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)N 62a_100000185761_100000211628 [0,1,0,0,0,1|0,0,0]=2 12272 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)N 62a_100000211628_100000185761 [0,1,0,0,0,1|0,0,0]=2 12273 B16R1.51 CCCCOC(=O)CSc1ccc(cc1)O 62a_100000211628_100000185759 [0,1,0,0,0,1|0,0,0]=2 12274 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)Br 62a_100000211628_100000686858 [0,1,0,0,0,1|1,0,0]=3 12275 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)Br 62a_100000686858_100000211628 [0,1,0,0,0,1|1,0,0]=3 12276 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)C 62a_100000211628_100000754016 [0,1,0,0,0,1|1,0,0]=3 12277 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)C 62a_100011192072_100000211628 [0,1,0,0,0,1|1,0,0]=3 12278 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)Cl 62a_100000211628_100011356976 [0,1,0,0,0,1|1,0,0]=3 12279 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)Cl 62a_100011356976_100000211628 [0,1,0,0,0,1|1,0,0]=3 12280 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)F 62a_100000211628_100000744514 [0,1,0,0,0,1|1,0,0]=3 12281 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)F 62a_100000744514_100000211628 [0,1,0,0,0,1|1,0,0]=3 12282 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)N 62a_100000211628_100000737798 [0,1,0,0,0,1|1,0,0]=3 12283 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)N 62a_100000737798_100000211628 [0,1,0,0,0,1|1,0,0]=3 12284 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)O 62a_100000211628_100000744096 [0,1,0,0,0,1|1,0,0]=3 12285 B16R1.51 CCCCOC(=O)CSc1ccc(cn1)O 62a_100000685995_100000211628 [0,1,0,0,0,1|1,0,0]=3 12286 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)Br 62a_100000211628_100009814638 [0,1,0,0,0,1|1,0,0]=3 12287 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)Br 62a_100009814638_100000211628 [0,1,0,0,0,1|1,0,0]=3 12288 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)C 62a_100000211628_100000751577 [0,1,0,0,0,1|1,0,0]=3 12289 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)C 62a_100000751577_100000211628 [0,1,0,0,0,1|1,0,0]=3 12290 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)Cl 62a_100000034144_100000211628 [0,1,0,0,0,1|1,0,0]=3 12291 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)Cl 62a_100000211628_100000034144 [0,1,0,0,0,1|1,0,0]=3 12292 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)F 62a_100000042367_100000211628 [0,1,0,0,0,1|1,0,0]=3 12293 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)F 62a_100000211628_100000042367 [0,1,0,0,0,1|1,0,0]=3 12294 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)N 62a_100000187370_100000211628 [0,1,0,0,0,1|1,0,0]=3 12295 B16R1.51 CCCCOC(=O)CSc1ccc(nc1)N 62a_100000211628_100000187370 [0,1,0,0,0,1|1,0,0]=3 12296 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)C 62a_100000211628_100000744512 [0,1,0,0,0,1|2,0,0]=4 12297 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)C 62a_100000744512_100000211628 [0,1,0,0,0,1|2,0,0]=4 12298 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)Cl 62a_100000068654_100000211628 [0,1,0,0,0,1|2,0,0]=4 12299 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)Cl 62a_100000211628_100000068654 [0,1,0,0,0,1|2,0,0]=4 12300 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)N 62a_100000211628_100010219413 [0,1,0,0,0,1|2,0,0]=4 12301 B16R1.51 CCCCOC(=O)CSc1ccc(nn1)N 62a_100010219413_100000211628 [0,1,0,0,0,1|2,0,0]=4 12302 B16R1.51 CCCCOC(=O)CSc1cnc(=O)[nH]c1 62a_100000211628_102495366499 [0,1,0,0,0,1|2,0,0]=4 12303 B16R1.51 CCCCOC(=O)CSc1cnc(=O)[nH]c1 62a_102495366499_100000211628 [0,1,0,0,0,1|2,0,0]=4 12304 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)Br 62a_100000211628_100010187541 [0,1,0,0,0,1|2,0,0]=4 12305 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)Br 62a_100010187541_100000211628 [0,1,0,0,0,1|2,0,0]=4 12306 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)C 62a_100000211628_100011999403 [0,1,0,0,0,1|2,0,0]=4 12307 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)C 62a_100011999403_100000211628 [0,1,0,0,0,1|2,0,0]=4 12308 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)Cl 62a_100000211628_100010214907 [0,1,0,0,0,1|2,0,0]=4 12309 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)Cl 62a_100010214907_100000211628 [0,1,0,0,0,1|2,0,0]=4 12310 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)F 62a_100000211628_100009856528 [0,1,0,0,0,1|2,0,0]=4 12311 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)F 62a_100009856528_100000211628 [0,1,0,0,0,1|2,0,0]=4 12312 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)N 62a_100000211628_100000744751 [0,1,0,0,0,1|2,0,0]=4 12313 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)N 62a_100000744751_100000211628 [0,1,0,0,0,1|2,0,0]=4 12314 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)O 62a_100000211628_100015839800 [0,1,0,0,0,1|2,0,0]=4 12315 B16R1.51 CCCCOC(=O)CSc1cnc(cn1)O 62a_100011934580_100000211628 [0,1,0,0,0,1|2,0,0]=4 12316 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)Br 62a_100000211628_200012349914 [0,1,0,0,0,1|2,0,0]=4 12317 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)Br 62a_200012349914_100000211628 [0,1,0,0,0,1|2,0,0]=4 12318 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)C 62a_100000211628_100000686985 [0,1,0,0,0,1|2,0,0]=4 12319 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)C 62a_100000686985_100000211628 [0,1,0,0,0,1|2,0,0]=4 12320 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)Cl 62a_100000059775_100000211628 [0,1,0,0,0,1|2,0,0]=4 12321 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)Cl 62a_100000211628_100000059775 [0,1,0,0,0,1|2,0,0]=4 12322 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)F 62a_100000211628_100000685262 [0,1,0,0,0,1|2,0,0]=4 12323 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)F 62a_100000685262_100000211628 [0,1,0,0,0,1|2,0,0]=4 12324 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)N 62a_100000211628_100000766020 [0,1,0,0,0,1|2,0,0]=4 12325 B16R1.51 CCCCOC(=O)CSc1cnc(nc1)N 62a_100000766020_100000211628 [0,1,0,0,0,1|2,0,0]=4 12326 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)Br 62a_100000211628_100000690281 [0,1,0,0,0,1|2,0,0]=4 12327 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)Br 62a_100000690281_100000211628 [0,1,0,0,0,1|2,0,0]=4 12328 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)C 62a_100000061069_100000211628 [0,1,0,0,0,1|2,0,0]=4 12329 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)C 62a_100000211628_100000061069 [0,1,0,0,0,1|2,0,0]=4 12330 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)Cl 62a_100000211628_100011356929 [0,1,0,0,0,1|2,0,0]=4 12331 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)Cl 62a_100011356929_100000211628 [0,1,0,0,0,1|2,0,0]=4 12332 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)F 62a_100000211628_100000685220 [0,1,0,0,0,1|2,0,0]=4 12333 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)F 62a_100000685220_100000211628 [0,1,0,0,0,1|2,0,0]=4 12334 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)N 62a_100000068403_100000211628 [0,1,0,0,0,1|2,0,0]=4 12335 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)N 62a_100000211628_100000068403 [0,1,0,0,0,1|2,0,0]=4 12336 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)O 62a_100000211628_100000092845 [0,1,0,0,0,1|2,0,0]=4 12337 B16R1.51 CCCCOC(=O)CSc1ncc(cn1)O 62a_100000730009_100000211628 [0,1,0,0,0,1|2,0,0]=4 12338 B16R1.51 CCCCOC(C)COc1ccc(cc1)C 34a_100011217472_100000210210 [0,1,0,0,0,1|1,0,1]=4 12339 B16R1.51 CCCCOC(C)COc1ccc(cc1)C 7a_100011217472_100000210211 [0,1,0,0,0,1|1,0,1]=4 12340 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)Br 22a_100000740057_100000217147 [0,1,0,0,0,1|2,0,0]=4 12341 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)C 22a_100000740057_100000234883 [0,1,0,0,0,1|2,0,0]=4 12342 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)Cl 22a_100000740057_100000235379 [0,1,0,0,0,1|2,0,0]=4 12343 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)F 22a_100000740057_100000198493 [0,1,0,0,0,1|2,0,0]=4 12344 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)I 22a_100000740057_100011217499 [0,1,0,0,0,1|2,0,0]=4 12345 B16R1.51 CCCNNC(=O)CCc1ccc(cc1)O 22a_100000740057_100000742835 [0,1,0,0,0,1|2,0,0]=4 12346 B16R1.51 CCCNNC(=O)COc1ccc(cc1)Br 22a_100000740057_100000182358 [0,1,0,0,0,1|2,0,0]=4 12347 B16R1.51 CCCNNC(=O)COc1ccc(cc1)C 22a_100000740057_100000182360 [0,1,0,0,0,1|2,0,0]=4 12348 B16R1.51 CCCNNC(=O)COc1ccc(cc1)Cl 22a_100000740057_100016990877 [0,1,0,0,0,1|2,0,0]=4 12349 B16R1.51 CCCNNC(=O)COc1ccc(cc1)F 22a_100000740057_100000184765 [0,1,0,0,0,1|2,0,0]=4 12350 B16R1.51 CCCNNC(=O)COc1ccc(cc1)I 22a_100000740057_100000184369 [0,1,0,0,0,1|2,0,0]=4 12351 B16R1.51 CCCNNC(=O)COc1ccc(cc1)O 22a_100000740057_100000031633 [0,1,0,0,0,1|2,0,0]=4 12352 B16R1.51 CCCNNC(=O)CSc1ccc(cc1)Br 22a_100000740057_100000179496 [0,1,0,0,0,1|2,0,0]=4 12353 B16R1.51 CCCNNC(=O)CSc1ccc(cc1)C 22a_100000740057_100000179497 [0,1,0,0,0,1|2,0,0]=4 12354 B16R1.51 CCCNNC(=O)CSc1ccc(cc1)Cl 22a_100000740057_100000178402 [0,1,0,0,0,1|2,0,0]=4 12355 B16R1.51 CCCNNC(=O)CSc1ccc(cc1)F 22a_100000740057_100000691584 [0,1,0,0,0,1|2,0,0]=4 12356 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100000740057 [0,1,0,0,0,1|2,0,0]=4 12357 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100000740057 [0,1,0,0,0,1|2,0,0]=4 12358 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)Br 512a_100000740057_100000174875 [0,1,0,0,0,1|2,0,0]=4 12359 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100000740057 [0,1,0,0,0,1|2,0,0]=4 12360 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)C 512a_100000174908_100000740057 [0,1,0,0,0,1|2,0,0]=4 12361 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)C 512a_100000740057_100000174908 [0,1,0,0,0,1|2,0,0]=4 12362 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000740057 [0,1,0,0,0,1|2,0,0]=4 12363 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)Cl 512a_100000740057_100000174871 [0,1,0,0,0,1|2,0,0]=4 12364 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100000740057 [0,1,0,0,0,1|2,0,0]=4 12365 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)F 512a_100000174882_100000740057 [0,1,0,0,0,1|2,0,0]=4 12366 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)F 512a_100000740057_100000174882 [0,1,0,0,0,1|2,0,0]=4 12367 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100000740057 [0,1,0,0,0,1|2,0,0]=4 12368 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)I 512a_100000740057_100016989417 [0,1,0,0,0,1|2,0,0]=4 12369 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)I 512a_100016989417_100000740057 [0,1,0,0,0,1|2,0,0]=4 12370 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100000740057 [0,1,0,0,0,1|2,0,0]=4 12371 B16R1.51 CCCNNC(=O)NCc1ccc(cc1)O 512a_100000740057_100000185549 [0,1,0,0,0,1|2,0,0]=4 12372 B16R1.51 CCCOCC(=O)CCc1ccc(cc1)Br 1458a_100000745993_100011740612 [0,1,0,0,0,1|2,0,0]=4 12373 B16R1.51 CCCOCC(=O)CCc1ccc(cc1)C 1458a_100000745993_100011713686 [0,1,0,0,0,1|2,0,0]=4 12374 B16R1.51 CCCOCC(=O)CCc1ccc(cc1)Cl 1458a_100000745993_100011713675 [0,1,0,0,0,1|2,0,0]=4 12375 B16R1.51 CCCOCC(=O)CCc1ccc(cc1)F 1458a_100000745993_100011217392 [0,1,0,0,0,1|2,0,0]=4 12376 B16R1.51 CCCOCC(=O)CCc1ccc(cc1)O 1458a_100000745993_100009816426 [0,1,0,0,0,1|2,0,0]=4 12377 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000745993 [0,1,0,0,0,1|2,0,0]=4 12378 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000745993 [0,1,0,0,0,1|2,0,0]=4 12379 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000745993 [0,1,0,0,0,1|2,0,0]=4 12380 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000745993 [0,1,0,0,0,1|2,0,0]=4 12381 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000745993 [0,1,0,0,0,1|2,0,0]=4 12382 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000745993 [0,1,0,0,0,1|2,0,0]=4 12383 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000745993 [0,1,0,0,0,1|2,0,0]=4 12384 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)C 34a_100000210258_100000183211 [0,1,0,0,0,1|2,0,0]=4 12385 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000745993 [0,1,0,0,0,1|2,0,0]=4 12386 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000745993 [0,1,0,0,0,1|2,0,0]=4 12387 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000745993 [0,1,0,0,0,1|2,0,0]=4 12388 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000745993 [0,1,0,0,0,1|2,0,0]=4 12389 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Cl 34a_100000210258_100000183476 [0,1,0,0,0,1|2,0,0]=4 12390 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000745993 [0,1,0,0,0,1|2,0,0]=4 12391 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000745993 [0,1,0,0,0,1|2,0,0]=4 12392 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000745993 [0,1,0,0,0,1|2,0,0]=4 12393 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000745993 [0,1,0,0,0,1|2,0,0]=4 12394 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)F 34a_100000210258_100000182461 [0,1,0,0,0,1|2,0,0]=4 12395 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000745993 [0,1,0,0,0,1|2,0,0]=4 12396 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000745993 [0,1,0,0,0,1|2,0,0]=4 12397 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000745993 [0,1,0,0,0,1|2,0,0]=4 12398 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000745993 [0,1,0,0,0,1|2,0,0]=4 12399 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000745993 [0,1,0,0,0,1|2,0,0]=4 12400 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000745993 [0,1,0,0,0,1|2,0,0]=4 12401 B16R1.51 CCCOCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000745993 [0,1,0,0,0,1|2,0,0]=4 12402 B16R1.51 CCCSCC(=O)CCc1ccc(cc1)Br 1458a_100000217233_100011740612 [0,1,0,0,0,1|2,0,0]=4 12403 B16R1.51 CCCSCC(=O)CCc1ccc(cc1)C 1458a_100000217233_100011713686 [0,1,0,0,0,1|2,0,0]=4 12404 B16R1.51 CCCSCC(=O)CCc1ccc(cc1)Cl 1458a_100000217233_100011713675 [0,1,0,0,0,1|2,0,0]=4 12405 B16R1.51 CCCSCC(=O)CCc1ccc(cc1)F 1458a_100000217233_100011217392 [0,1,0,0,0,1|2,0,0]=4 12406 B16R1.51 CCCSCC(=O)CCc1ccc(cc1)O 1458a_100000217233_100009816426 [0,1,0,0,0,1|2,0,0]=4 12407 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000217233 [0,1,0,0,0,1|2,0,0]=4 12408 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000217233 [0,1,0,0,0,1|2,0,0]=4 12409 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000217233 [0,1,0,0,0,1|2,0,0]=4 12410 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000217233 [0,1,0,0,0,1|2,0,0]=4 12411 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000217233 [0,1,0,0,0,1|2,0,0]=4 12412 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000217233 [0,1,0,0,0,1|2,0,0]=4 12413 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000217233 [0,1,0,0,0,1|2,0,0]=4 12414 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000217233 [0,1,0,0,0,1|2,0,0]=4 12415 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 62a_100000183211_100000210303 [0,1,0,0,0,1|2,0,0]=4 12416 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)C 62a_100000210303_100000183211 [0,1,0,0,0,1|2,0,0]=4 12417 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000217233 [0,1,0,0,0,1|2,0,0]=4 12418 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000217233 [0,1,0,0,0,1|2,0,0]=4 12419 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000217233 [0,1,0,0,0,1|2,0,0]=4 12420 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000217233 [0,1,0,0,0,1|2,0,0]=4 12421 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 62a_100000183476_100000210303 [0,1,0,0,0,1|2,0,0]=4 12422 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)Cl 62a_100000210303_100000183476 [0,1,0,0,0,1|2,0,0]=4 12423 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000217233 [0,1,0,0,0,1|2,0,0]=4 12424 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000217233 [0,1,0,0,0,1|2,0,0]=4 12425 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000217233 [0,1,0,0,0,1|2,0,0]=4 12426 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000217233 [0,1,0,0,0,1|2,0,0]=4 12427 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 62a_100000182461_100000210303 [0,1,0,0,0,1|2,0,0]=4 12428 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)F 62a_100000210303_100000182461 [0,1,0,0,0,1|2,0,0]=4 12429 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000217233 [0,1,0,0,0,1|2,0,0]=4 12430 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000217233 [0,1,0,0,0,1|2,0,0]=4 12431 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000217233 [0,1,0,0,0,1|2,0,0]=4 12432 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000217233 [0,1,0,0,0,1|2,0,0]=4 12433 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000217233 [0,1,0,0,0,1|2,0,0]=4 12434 B16R1.51 CCCSCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000217233 [0,1,0,0,0,1|2,0,0]=4 12435 B16R1.51 CCNCCC(=O)NCc1ccc(cc1)C 2230a_100015525214_100011194906 [0,1,0,0,0,1|2,0,0]=4 12436 B16R1.51 CCNCCC(=O)NCc1ccc(cc1)Cl 2230a_100015525214_200011235835 [0,1,0,0,0,1|2,0,0]=4 12437 B16R1.51 CCNCCC(=O)NCc1ccc(cc1)F 2230a_100015525214_200011194857 [0,1,0,0,0,1|2,0,0]=4 12438 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100011215890 [0,1,0,0,0,1|2,0,0]=4 12439 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)Br 1458a_100000749530_100011740612 [0,1,0,0,0,1|2,0,0]=4 12440 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100011215890 [0,1,0,0,0,1|2,0,0]=4 12441 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)C 1458a_100000749530_100011713686 [0,1,0,0,0,1|2,0,0]=4 12442 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100011215890 [0,1,0,0,0,1|2,0,0]=4 12443 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)Cl 1458a_100000749530_100011713675 [0,1,0,0,0,1|2,0,0]=4 12444 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100011215890 [0,1,0,0,0,1|2,0,0]=4 12445 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)F 1458a_100000749530_100011217392 [0,1,0,0,0,1|2,0,0]=4 12446 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100011215890 [0,1,0,0,0,1|2,0,0]=4 12447 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100011215890 [0,1,0,0,0,1|2,0,0]=4 12448 B16R1.51 CCOCCC(=O)CCc1ccc(cc1)O 1458a_100000749530_100009816426 [0,1,0,0,0,1|2,0,0]=4 12449 B16R1.51 CCOCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100011215890 [0,1,0,0,0,1|2,0,0]=4 12450 B16R1.51 CCOCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100011215890 [0,1,0,0,0,1|2,0,0]=4 12451 B16R1.51 CCOCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100011215890 [0,1,0,0,0,1|2,0,0]=4 12452 B16R1.51 CCOCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100011215890 [0,1,0,0,0,1|2,0,0]=4 12453 B16R1.51 CCOCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100011215890 [0,1,0,0,0,1|2,0,0]=4 12454 B16R1.51 CCOCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100011215890 [0,1,0,0,0,1|2,0,0]=4 12455 B16R1.51 CCOCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100011215890 [0,1,0,0,0,1|2,0,0]=4 12456 B16R1.51 CCOCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100011215890 [0,1,0,0,0,1|2,0,0]=4 12457 B16R1.51 CCOCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100011215890 [0,1,0,0,0,1|2,0,0]=4 12458 B16R1.51 CCOCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100011215890 [0,1,0,0,0,1|2,0,0]=4 12459 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000749530 [0,1,0,0,0,1|2,0,0]=4 12460 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000749530 [0,1,0,0,0,1|2,0,0]=4 12461 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000749530 [0,1,0,0,0,1|2,0,0]=4 12462 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000749530 [0,1,0,0,0,1|2,0,0]=4 12463 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000749530 [0,1,0,0,0,1|2,0,0]=4 12464 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000749530 [0,1,0,0,0,1|2,0,0]=4 12465 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000749530 [0,1,0,0,0,1|2,0,0]=4 12466 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)C 34a_100121572206_100011194906 [0,1,0,0,0,1|2,0,0]=4 12467 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000749530 [0,1,0,0,0,1|2,0,0]=4 12468 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000749530 [0,1,0,0,0,1|2,0,0]=4 12469 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000749530 [0,1,0,0,0,1|2,0,0]=4 12470 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000749530 [0,1,0,0,0,1|2,0,0]=4 12471 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Cl 34a_100121572206_200011235835 [0,1,0,0,0,1|2,0,0]=4 12472 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000749530 [0,1,0,0,0,1|2,0,0]=4 12473 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000749530 [0,1,0,0,0,1|2,0,0]=4 12474 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000749530 [0,1,0,0,0,1|2,0,0]=4 12475 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000749530 [0,1,0,0,0,1|2,0,0]=4 12476 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)F 34a_100121572206_200011194857 [0,1,0,0,0,1|2,0,0]=4 12477 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000749530 [0,1,0,0,0,1|2,0,0]=4 12478 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000749530 [0,1,0,0,0,1|2,0,0]=4 12479 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000749530 [0,1,0,0,0,1|2,0,0]=4 12480 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000749530 [0,1,0,0,0,1|2,0,0]=4 12481 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000749530 [0,1,0,0,0,1|2,0,0]=4 12482 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000749530 [0,1,0,0,0,1|2,0,0]=4 12483 B16R1.51 CCOCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000749530 [0,1,0,0,0,1|2,0,0]=4 12484 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000757381 [0,1,0,0,0,1|2,0,0]=4 12485 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)Br 1458a_100000230768_100011740612 [0,1,0,0,0,1|2,0,0]=4 12486 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)C 1458a_100000230768_100011713686 [0,1,0,0,0,1|2,0,0]=4 12487 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000757381 [0,1,0,0,0,1|2,0,0]=4 12488 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)Cl 1458a_100000230768_100011713675 [0,1,0,0,0,1|2,0,0]=4 12489 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000757381 [0,1,0,0,0,1|2,0,0]=4 12490 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000757381 [0,1,0,0,0,1|2,0,0]=4 12491 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)F 1458a_100000230768_100011217392 [0,1,0,0,0,1|2,0,0]=4 12492 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000757381 [0,1,0,0,0,1|2,0,0]=4 12493 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)O 1458a_100000230768_100009816426 [0,1,0,0,0,1|2,0,0]=4 12494 B16R1.51 CCSCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000757381 [0,1,0,0,0,1|2,0,0]=4 12495 B16R1.51 CCSCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000757381 [0,1,0,0,0,1|2,0,0]=4 12496 B16R1.51 CCSCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000757381 [0,1,0,0,0,1|2,0,0]=4 12497 B16R1.51 CCSCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000757381 [0,1,0,0,0,1|2,0,0]=4 12498 B16R1.51 CCSCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000757381 [0,1,0,0,0,1|2,0,0]=4 12499 B16R1.51 CCSCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000757381 [0,1,0,0,0,1|2,0,0]=4 12500 B16R1.51 CCSCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000757381 [0,1,0,0,0,1|2,0,0]=4 12501 B16R1.51 CCSCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000757381 [0,1,0,0,0,1|2,0,0]=4 12502 B16R1.51 CCSCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000757381 [0,1,0,0,0,1|2,0,0]=4 12503 B16R1.51 CCSCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000757381 [0,1,0,0,0,1|2,0,0]=4 12504 B16R1.51 CCSCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000757381 [0,1,0,0,0,1|2,0,0]=4 12505 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000230768 [0,1,0,0,0,1|2,0,0]=4 12506 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000230768 [0,1,0,0,0,1|2,0,0]=4 12507 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000230768 [0,1,0,0,0,1|2,0,0]=4 12508 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000230768 [0,1,0,0,0,1|2,0,0]=4 12509 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000230768 [0,1,0,0,0,1|2,0,0]=4 12510 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000230768 [0,1,0,0,0,1|2,0,0]=4 12511 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000230768 [0,1,0,0,0,1|2,0,0]=4 12512 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000230768 [0,1,0,0,0,1|2,0,0]=4 12513 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 62a_100000210202_100011194906 [0,1,0,0,0,1|2,0,0]=4 12514 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)C 62a_100011194906_100000210202 [0,1,0,0,0,1|2,0,0]=4 12515 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000230768 [0,1,0,0,0,1|2,0,0]=4 12516 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000230768 [0,1,0,0,0,1|2,0,0]=4 12517 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000230768 [0,1,0,0,0,1|2,0,0]=4 12518 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000230768 [0,1,0,0,0,1|2,0,0]=4 12519 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 62a_100000210202_200011235835 [0,1,0,0,0,1|2,0,0]=4 12520 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)Cl 62a_200011235835_100000210202 [0,1,0,0,0,1|2,0,0]=4 12521 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000230768 [0,1,0,0,0,1|2,0,0]=4 12522 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000230768 [0,1,0,0,0,1|2,0,0]=4 12523 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000230768 [0,1,0,0,0,1|2,0,0]=4 12524 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000230768 [0,1,0,0,0,1|2,0,0]=4 12525 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 62a_100000210202_200011194857 [0,1,0,0,0,1|2,0,0]=4 12526 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)F 62a_200011194857_100000210202 [0,1,0,0,0,1|2,0,0]=4 12527 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000230768 [0,1,0,0,0,1|2,0,0]=4 12528 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000230768 [0,1,0,0,0,1|2,0,0]=4 12529 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000230768 [0,1,0,0,0,1|2,0,0]=4 12530 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000230768 [0,1,0,0,0,1|2,0,0]=4 12531 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000230768 [0,1,0,0,0,1|2,0,0]=4 12532 B16R1.51 CCSCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000230768 [0,1,0,0,0,1|2,0,0]=4 12533 B16R1.51 COCCCC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000740836 [0,1,0,0,0,1|2,0,0]=4 12534 B16R1.51 COCCCC(=O)CCc1ccc(cc1)Br 1458a_100000741012_100011740612 [0,1,0,0,0,1|2,0,0]=4 12535 B16R1.51 COCCCC(=O)CCc1ccc(cc1)C 1458a_100000234883_100000740836 [0,1,0,0,0,1|2,0,0]=4 12536 B16R1.51 COCCCC(=O)CCc1ccc(cc1)C 1458a_100000741012_100011713686 [0,1,0,0,0,1|2,0,0]=4 12537 B16R1.51 COCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000740836 [0,1,0,0,0,1|2,0,0]=4 12538 B16R1.51 COCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000741012_100011713675 [0,1,0,0,0,1|2,0,0]=4 12539 B16R1.51 COCCCC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000740836 [0,1,0,0,0,1|2,0,0]=4 12540 B16R1.51 COCCCC(=O)CCc1ccc(cc1)F 1458a_100000741012_100011217392 [0,1,0,0,0,1|2,0,0]=4 12541 B16R1.51 COCCCC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000740836 [0,1,0,0,0,1|2,0,0]=4 12542 B16R1.51 COCCCC(=O)CCc1ccc(cc1)O 1458a_100000741012_100009816426 [0,1,0,0,0,1|2,0,0]=4 12543 B16R1.51 COCCCC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000740836 [0,1,0,0,0,1|2,0,0]=4 12544 B16R1.51 COCCCC(=O)COc1ccc(cc1)Br 1458a_100000182358_100000740836 [0,1,0,0,0,1|2,0,0]=4 12545 B16R1.51 COCCCC(=O)COc1ccc(cc1)C 1458a_100000182360_100000740836 [0,1,0,0,0,1|2,0,0]=4 12546 B16R1.51 COCCCC(=O)COc1ccc(cc1)Cl 1458a_100016990877_100000740836 [0,1,0,0,0,1|2,0,0]=4 12547 B16R1.51 COCCCC(=O)COc1ccc(cc1)F 1458a_100000184765_100000740836 [0,1,0,0,0,1|2,0,0]=4 12548 B16R1.51 COCCCC(=O)COc1ccc(cc1)I 1458a_100000184369_100000740836 [0,1,0,0,0,1|2,0,0]=4 12549 B16R1.51 COCCCC(=O)COc1ccc(cc1)O 1458a_100000031633_100000740836 [0,1,0,0,0,1|2,0,0]=4 12550 B16R1.51 COCCCC(=O)CSc1ccc(cc1)Br 1458a_100000179496_100000740836 [0,1,0,0,0,1|2,0,0]=4 12551 B16R1.51 COCCCC(=O)CSc1ccc(cc1)C 1458a_100000179497_100000740836 [0,1,0,0,0,1|2,0,0]=4 12552 B16R1.51 COCCCC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_100000740836 [0,1,0,0,0,1|2,0,0]=4 12553 B16R1.51 COCCCC(=O)CSc1ccc(cc1)F 1458a_100000691584_100000740836 [0,1,0,0,0,1|2,0,0]=4 12554 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000741012 [0,1,0,0,0,1|2,0,0]=4 12555 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000741012 [0,1,0,0,0,1|2,0,0]=4 12556 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000741012 [0,1,0,0,0,1|2,0,0]=4 12557 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000741012 [0,1,0,0,0,1|2,0,0]=4 12558 B16R1.51 COCCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000741012 [0,1,0,0,0,1|2,0,0]=4 12559 B16R1.51 COCCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000741012 [0,1,0,0,0,1|2,0,0]=4 12560 B16R1.51 COCCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000741012 [0,1,0,0,0,1|2,0,0]=4 12561 B16R1.51 COCCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000741012 [0,1,0,0,0,1|2,0,0]=4 12562 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000741012 [0,1,0,0,0,1|2,0,0]=4 12563 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000741012 [0,1,0,0,0,1|2,0,0]=4 12564 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000741012 [0,1,0,0,0,1|2,0,0]=4 12565 B16R1.51 COCCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000741012 [0,1,0,0,0,1|2,0,0]=4 12566 B16R1.51 COCCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000741012 [0,1,0,0,0,1|2,0,0]=4 12567 B16R1.51 COCCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000741012 [0,1,0,0,0,1|2,0,0]=4 12568 B16R1.51 COCCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000741012 [0,1,0,0,0,1|2,0,0]=4 12569 B16R1.51 COCCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000741012 [0,1,0,0,0,1|2,0,0]=4 12570 B16R1.51 COCCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000741012 [0,1,0,0,0,1|2,0,0]=4 12571 B16R1.51 COCCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000741012 [0,1,0,0,0,1|2,0,0]=4 12572 B16R1.51 COCCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000741012 [0,1,0,0,0,1|2,0,0]=4 12573 B16R1.51 COCCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000741012 [0,1,0,0,0,1|2,0,0]=4 12574 B16R1.51 COCCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000741012 [0,1,0,0,0,1|2,0,0]=4 12575 B16R1.51 COCCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000741012 [0,1,0,0,0,1|2,0,0]=4 12576 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Br 1626a_100000209980_100000217147 [0,1,0,0,0,1|2,0,0]=4 12577 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Br 240690a_100000209980_100000217147 [0,1,0,0,0,1|2,0,0]=4 12578 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Br 527a_100000209980_100000217147 [0,1,0,0,0,1|2,0,0]=4 12579 B16R1.51 COCCNC(=O)CCc1ccc(cc1)C 1626a_100000209980_100000234883 [0,1,0,0,0,1|2,0,0]=4 12580 B16R1.51 COCCNC(=O)CCc1ccc(cc1)C 240690a_100000209980_100000234883 [0,1,0,0,0,1|2,0,0]=4 12581 B16R1.51 COCCNC(=O)CCc1ccc(cc1)C 527a_100000209980_100000234883 [0,1,0,0,0,1|2,0,0]=4 12582 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Cl 1626a_100000209980_100000235379 [0,1,0,0,0,1|2,0,0]=4 12583 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Cl 240690a_100000209980_100000235379 [0,1,0,0,0,1|2,0,0]=4 12584 B16R1.51 COCCNC(=O)CCc1ccc(cc1)Cl 527a_100000209980_100000235379 [0,1,0,0,0,1|2,0,0]=4 12585 B16R1.51 COCCNC(=O)CCc1ccc(cc1)F 1626a_100000209980_100000198493 [0,1,0,0,0,1|2,0,0]=4 12586 B16R1.51 COCCNC(=O)CCc1ccc(cc1)F 240690a_100000209980_100000198493 [0,1,0,0,0,1|2,0,0]=4 12587 B16R1.51 COCCNC(=O)CCc1ccc(cc1)F 527a_100000209980_100000198493 [0,1,0,0,0,1|2,0,0]=4 12588 B16R1.51 COCCNC(=O)CCc1ccc(cc1)I 1626a_100000209980_100011217499 [0,1,0,0,0,1|2,0,0]=4 12589 B16R1.51 COCCNC(=O)CCc1ccc(cc1)I 240690a_100000209980_100011217499 [0,1,0,0,0,1|2,0,0]=4 12590 B16R1.51 COCCNC(=O)CCc1ccc(cc1)I 527a_100000209980_100011217499 [0,1,0,0,0,1|2,0,0]=4 12591 B16R1.51 COCCNC(=O)CCc1ccc(cc1)O 240690a_100000209980_100000742835 [0,1,0,0,0,1|2,0,0]=4 12592 B16R1.51 COCCNC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000183275 [0,1,0,0,0,1|2,0,0]=4 12593 B16R1.51 COCCNC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000183275 [0,1,0,0,0,1|2,0,0]=4 12594 B16R1.51 COCCNC(=O)CNc1ccc(cc1)C 34a_100000124888_100000183275 [0,1,0,0,0,1|2,0,0]=4 12595 B16R1.51 COCCNC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000183275 [0,1,0,0,0,1|2,0,0]=4 12596 B16R1.51 COCCNC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000183275 [0,1,0,0,0,1|2,0,0]=4 12597 B16R1.51 COCCNC(=O)CNc1ccc(cc1)F 34a_100000185862_100000183275 [0,1,0,0,0,1|2,0,0]=4 12598 B16R1.51 COCCNC(=O)CNc1ccc(cc1)I 34a_100000185761_100000183275 [0,1,0,0,0,1|2,0,0]=4 12599 B16R1.51 COCCNC(=O)CNc1ccc(cc1)O 34a_100000185829_100000183275 [0,1,0,0,0,1|2,0,0]=4 12600 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 1626a_100000209980_100000182358 [0,1,0,0,0,1|2,0,0]=4 12601 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 240690a_100000209980_100000182358 [0,1,0,0,0,1|2,0,0]=4 12602 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 34a_100000185759_100000183275 [0,1,0,0,0,1|2,0,0]=4 12603 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 34a_200000158804_200000210301 [0,1,0,0,0,1|2,0,0]=4 12604 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 527a_100000209980_100000182358 [0,1,0,0,0,1|2,0,0]=4 12605 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 7a_100000185759_100000183275 [0,1,0,0,0,1|2,0,0]=4 12606 B16R1.51 COCCNC(=O)COc1ccc(cc1)Br 7a_200000158804_200000210301 [0,1,0,0,0,1|2,0,0]=4 12607 B16R1.51 COCCNC(=O)COc1ccc(cc1)C 1626a_100000209980_100000182360 [0,1,0,0,0,1|2,0,0]=4 12608 B16R1.51 COCCNC(=O)COc1ccc(cc1)C 240690a_100000209980_100000182360 [0,1,0,0,0,1|2,0,0]=4 12609 B16R1.51 COCCNC(=O)COc1ccc(cc1)C 34a_100000210336_100000183275 [0,1,0,0,0,1|2,0,0]=4 12610 B16R1.51 COCCNC(=O)COc1ccc(cc1)C 527a_100000209980_100000182360 [0,1,0,0,0,1|2,0,0]=4 12611 B16R1.51 COCCNC(=O)COc1ccc(cc1)C 7a_100000210336_100000183275 [0,1,0,0,0,1|2,0,0]=4 12612 B16R1.51 COCCNC(=O)COc1ccc(cc1)Cl 1626a_100000209980_100016990877 [0,1,0,0,0,1|2,0,0]=4 12613 B16R1.51 COCCNC(=O)COc1ccc(cc1)Cl 240690a_100000209980_100016990877 [0,1,0,0,0,1|2,0,0]=4 12614 B16R1.51 COCCNC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000183275 [0,1,0,0,0,1|2,0,0]=4 12615 B16R1.51 COCCNC(=O)COc1ccc(cc1)Cl 527a_100000209980_100016990877 [0,1,0,0,0,1|2,0,0]=4 12616 B16R1.51 COCCNC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000183275 [0,1,0,0,0,1|2,0,0]=4 12617 B16R1.51 COCCNC(=O)COc1ccc(cc1)F 1626a_100000209980_100000184765 [0,1,0,0,0,1|2,0,0]=4 12618 B16R1.51 COCCNC(=O)COc1ccc(cc1)F 240690a_100000209980_100000184765 [0,1,0,0,0,1|2,0,0]=4 12619 B16R1.51 COCCNC(=O)COc1ccc(cc1)F 34a_100000210339_100000183275 [0,1,0,0,0,1|2,0,0]=4 12620 B16R1.51 COCCNC(=O)COc1ccc(cc1)F 527a_100000209980_100000184765 [0,1,0,0,0,1|2,0,0]=4 12621 B16R1.51 COCCNC(=O)COc1ccc(cc1)I 1626a_100000209980_100000184369 [0,1,0,0,0,1|2,0,0]=4 12622 B16R1.51 COCCNC(=O)COc1ccc(cc1)I 240690a_100000209980_100000184369 [0,1,0,0,0,1|2,0,0]=4 12623 B16R1.51 COCCNC(=O)COc1ccc(cc1)I 34a_100000212066_100000183275 [0,1,0,0,0,1|2,0,0]=4 12624 B16R1.51 COCCNC(=O)COc1ccc(cc1)I 527a_100000209980_100000184369 [0,1,0,0,0,1|2,0,0]=4 12625 B16R1.51 COCCNC(=O)COc1ccc(cc1)I 7a_100000212066_100000183275 [0,1,0,0,0,1|2,0,0]=4 12626 B16R1.51 COCCNC(=O)COc1ccc(cc1)N 34a_100000185829_100000183275 [0,1,0,0,0,1|2,0,0]=4 12627 B16R1.51 COCCNC(=O)COc1ccc(cc1)O 240690a_100000209980_100000031633 [0,1,0,0,0,1|2,0,0]=4 12628 B16R1.51 COCCNC(=O)COc1ccc(cc1)O 527a_100000209980_100000031633 [0,1,0,0,0,1|2,0,0]=4 12629 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Br 1626a_100000209980_100000179496 [0,1,0,0,0,1|2,0,0]=4 12630 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Br 240690a_100000209980_100000179496 [0,1,0,0,0,1|2,0,0]=4 12631 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Br 527a_100000209980_100000179496 [0,1,0,0,0,1|2,0,0]=4 12632 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Br 62a_100000183275_100000752885 [0,1,0,0,0,1|2,0,0]=4 12633 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000183275 [0,1,0,0,0,1|2,0,0]=4 12634 B16R1.51 COCCNC(=O)CSc1ccc(cc1)C 1626a_100000209980_100000179497 [0,1,0,0,0,1|2,0,0]=4 12635 B16R1.51 COCCNC(=O)CSc1ccc(cc1)C 240690a_100000209980_100000179497 [0,1,0,0,0,1|2,0,0]=4 12636 B16R1.51 COCCNC(=O)CSc1ccc(cc1)C 527a_100000209980_100000179497 [0,1,0,0,0,1|2,0,0]=4 12637 B16R1.51 COCCNC(=O)CSc1ccc(cc1)C 62a_100000183275_100000186775 [0,1,0,0,0,1|2,0,0]=4 12638 B16R1.51 COCCNC(=O)CSc1ccc(cc1)C 62a_100000186775_100000183275 [0,1,0,0,0,1|2,0,0]=4 12639 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Cl 1626a_100000209980_100000178402 [0,1,0,0,0,1|2,0,0]=4 12640 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Cl 240690a_100000209980_100000178402 [0,1,0,0,0,1|2,0,0]=4 12641 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Cl 527a_100000209980_100000178402 [0,1,0,0,0,1|2,0,0]=4 12642 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Cl 62a_100000183275_100000755918 [0,1,0,0,0,1|2,0,0]=4 12643 B16R1.51 COCCNC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000183275 [0,1,0,0,0,1|2,0,0]=4 12644 B16R1.51 COCCNC(=O)CSc1ccc(cc1)F 1626a_100000209980_100000691584 [0,1,0,0,0,1|2,0,0]=4 12645 B16R1.51 COCCNC(=O)CSc1ccc(cc1)F 240690a_100000209980_100000691584 [0,1,0,0,0,1|2,0,0]=4 12646 B16R1.51 COCCNC(=O)CSc1ccc(cc1)F 527a_100000209980_100000691584 [0,1,0,0,0,1|2,0,0]=4 12647 B16R1.51 COCCNC(=O)CSc1ccc(cc1)F 62a_100000183275_100000211213 [0,1,0,0,0,1|2,0,0]=4 12648 B16R1.51 COCCNC(=O)CSc1ccc(cc1)F 62a_100000211213_100000183275 [0,1,0,0,0,1|2,0,0]=4 12649 B16R1.51 COCCNC(=O)CSc1ccc(cc1)N 62a_100000183275_100000185761 [0,1,0,0,0,1|2,0,0]=4 12650 B16R1.51 COCCNC(=O)CSc1ccc(cc1)N 62a_100000185761_100000183275 [0,1,0,0,0,1|2,0,0]=4 12651 B16R1.51 COCCNC(=O)CSc1ccc(cc1)O 62a_100000183275_100000185759 [0,1,0,0,0,1|2,0,0]=4 12652 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_100000209980 [0,1,0,0,0,1|2,0,0]=4 12653 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100000209980 [0,1,0,0,0,1|2,0,0]=4 12654 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Br 273464a_100000209980_100000174875 [0,1,0,0,0,1|2,0,0]=4 12655 B16R1.51 COCCNC(=O)NCc1ccc(cc1)C 2708a_100000174908_100000209980 [0,1,0,0,0,1|2,0,0]=4 12656 B16R1.51 COCCNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100000209980 [0,1,0,0,0,1|2,0,0]=4 12657 B16R1.51 COCCNC(=O)NCc1ccc(cc1)C 273464a_100000209980_100000174908 [0,1,0,0,0,1|2,0,0]=4 12658 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100000209980 [0,1,0,0,0,1|2,0,0]=4 12659 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100000209980 [0,1,0,0,0,1|2,0,0]=4 12660 B16R1.51 COCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000209980_100000174871 [0,1,0,0,0,1|2,0,0]=4 12661 B16R1.51 COCCNC(=O)NCc1ccc(cc1)F 2708a_100000174882_100000209980 [0,1,0,0,0,1|2,0,0]=4 12662 B16R1.51 COCCNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100000209980 [0,1,0,0,0,1|2,0,0]=4 12663 B16R1.51 COCCNC(=O)NCc1ccc(cc1)F 273464a_100000209980_100000174882 [0,1,0,0,0,1|2,0,0]=4 12664 B16R1.51 COCCNC(=O)NCc1ccc(cc1)I 2708a_100016989417_100000209980 [0,1,0,0,0,1|2,0,0]=4 12665 B16R1.51 COCCNC(=O)NCc1ccc(cc1)I 273464a_100000209980_100016989417 [0,1,0,0,0,1|2,0,0]=4 12666 B16R1.51 COCCNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100000209980 [0,1,0,0,0,1|2,0,0]=4 12667 B16R1.51 COCCNC(=O)NCc1ccc(cc1)O 2708a_100000185549_100000209980 [0,1,0,0,0,1|2,0,0]=4 12668 B16R1.51 COCCNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100000209980 [0,1,0,0,0,1|2,0,0]=4 12669 B16R1.51 COCCNC(=O)NCc1ccc(cc1)O 273464a_100000209980_100000185549 [0,1,0,0,0,1|2,0,0]=4 12670 B16R1.51 COCCOC(=O)CNc1ccc(cc1)Br 2230a_100000210018_200000040189 [0,1,0,0,0,1|1,0,0]=3 12671 B16R1.51 COCCOC(=O)CNc1ccc(cc1)Br 34a_100000210018_200000040189 [0,1,0,0,0,1|1,0,0]=3 12672 B16R1.51 COCCOC(=O)CNc1ccc(cc1)C 34a_100000124888_200000040189 [0,1,0,0,0,1|1,0,0]=3 12673 B16R1.51 COCCOC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_200000040189 [0,1,0,0,0,1|1,0,0]=3 12674 B16R1.51 COCCOC(=O)CNc1ccc(cc1)Cl 34a_100000210052_200000040189 [0,1,0,0,0,1|1,0,0]=3 12675 B16R1.51 COCCOC(=O)CNc1ccc(cc1)F 34a_100000185862_200000040189 [0,1,0,0,0,1|1,0,0]=3 12676 B16R1.51 COCCOC(=O)CNc1ccc(cc1)I 34a_100000185761_200000040189 [0,1,0,0,0,1|1,0,0]=3 12677 B16R1.51 COCCOC(=O)CNc1ccc(cc1)O 34a_100000185829_200000040189 [0,1,0,0,0,1|1,0,0]=3 12678 B16R1.51 COCCOC(=O)COc1ccc(=O)[nH]c1 34a_100000075641_200000040189 [0,1,0,0,0,1|2,0,0]=4 12679 B16R1.51 COCCOC(=O)COc1ccc(cc1)Br 34a_100000185759_200000040189 [0,1,0,0,0,1|1,0,0]=3 12680 B16R1.51 COCCOC(=O)COc1ccc(cc1)Br 7a_100000185759_200000040189 [0,1,0,0,0,1|1,0,0]=3 12681 B16R1.51 COCCOC(=O)COc1ccc(cc1)C 34a_100000210336_200000040189 [0,1,0,0,0,1|1,0,0]=3 12682 B16R1.51 COCCOC(=O)COc1ccc(cc1)C 7a_100000210336_200000040189 [0,1,0,0,0,1|1,0,0]=3 12683 B16R1.51 COCCOC(=O)COc1ccc(cc1)Cl 34a_100000210216_200000040189 [0,1,0,0,0,1|1,0,0]=3 12684 B16R1.51 COCCOC(=O)COc1ccc(cc1)Cl 7a_100000210216_200000040189 [0,1,0,0,0,1|1,0,0]=3 12685 B16R1.51 COCCOC(=O)COc1ccc(cc1)F 34a_100000210339_200000040189 [0,1,0,0,0,1|1,0,0]=3 12686 B16R1.51 COCCOC(=O)COc1ccc(cc1)I 34a_100000212066_200000040189 [0,1,0,0,0,1|1,0,0]=3 12687 B16R1.51 COCCOC(=O)COc1ccc(cc1)I 7a_100000212066_200000040189 [0,1,0,0,0,1|1,0,0]=3 12688 B16R1.51 COCCOC(=O)COc1ccc(cc1)N 34a_100000185829_200000040189 [0,1,0,0,0,1|1,0,0]=3 12689 B16R1.51 COCCOC(=O)COc1ccc(cn1)C 34a_100000759353_200000040189 [0,1,0,0,0,1|2,0,0]=4 12690 B16R1.51 COCCOC(=O)COc1ccc(cn1)Cl 34a_100011215309_200000040189 [0,1,0,0,0,1|2,0,0]=4 12691 B16R1.51 COCCOC(=O)COc1ccc(cn1)F 34a_100000742473_200000040189 [0,1,0,0,0,1|2,0,0]=4 12692 B16R1.51 COCCOC(=O)COc1ccc(cn1)N 34a_100000729260_200000040189 [0,1,0,0,0,1|2,0,0]=4 12693 B16R1.51 COCCOC(=O)COc1ccc(nc1)Br 34a_100000685995_200000040189 [0,1,0,0,0,1|2,0,0]=4 12694 B16R1.51 COCCOC(=O)COc1ccc(nc1)Br 7a_100000685995_200000040189 [0,1,0,0,0,1|2,0,0]=4 12695 B16R1.51 COCCOC(=O)COc1ccc(nc1)C 34a_100000745506_200000040189 [0,1,0,0,0,1|2,0,0]=4 12696 B16R1.51 COCCOC(=O)COc1ccc(nc1)C 7a_100000745506_200000040189 [0,1,0,0,0,1|2,0,0]=4 12697 B16R1.51 COCCOC(=O)COc1ccc(nc1)Cl 34a_100000744096_200000040189 [0,1,0,0,0,1|2,0,0]=4 12698 B16R1.51 COCCOC(=O)COc1ccc(nc1)Cl 7a_100000744096_200000040189 [0,1,0,0,0,1|2,0,0]=4 12699 B16R1.51 COCCOC(=O)COc1ccc(nc1)F 34a_100000688820_200000040189 [0,1,0,0,0,1|2,0,0]=4 12700 B16R1.51 COCCOC(=O)COc1ccc(nc1)F 7a_100000688820_200000040189 [0,1,0,0,0,1|2,0,0]=4 12701 B16R1.51 COCCOC(=O)COc1ccc(nc1)I 34a_100000687607_200000040189 [0,1,0,0,0,1|2,0,0]=4 12702 B16R1.51 COCCOC(=O)COc1ccc(nc1)I 7a_100000687607_200000040189 [0,1,0,0,0,1|2,0,0]=4 12703 B16R1.51 COCCOC(=O)COc1ccc(nc1)N 34a_100015188713_200000040189 [0,1,0,0,0,1|2,0,0]=4 12704 B16R1.51 COCCOC(=O)COc1ccc(nc1)N 7a_100015188713_200000040189 [0,1,0,0,0,1|2,0,0]=4 12705 B16R1.51 COCCOC(=O)CSc1cc[n+](cc1)[O-] 62a_200000040189_100000039755 [0,1,0,0,0,1|2,0,0]=4 12706 B16R1.51 COCCOC(=O)CSc1ccc(=O)[nH]c1 62a_100000212171_200000040189 [0,1,0,0,0,1|2,0,0]=4 12707 B16R1.51 COCCOC(=O)CSc1ccc(=O)[nH]c1 62a_200000040189_100000212171 [0,1,0,0,0,1|2,0,0]=4 12708 B16R1.51 COCCOC(=O)CSc1ccc(cc1)Br 62a_100000752885_200000040189 [0,1,0,0,0,1|1,0,0]=3 12709 B16R1.51 COCCOC(=O)CSc1ccc(cc1)Br 62a_200000040189_100000752885 [0,1,0,0,0,1|1,0,0]=3 12710 B16R1.51 COCCOC(=O)CSc1ccc(cc1)C 62a_100000186775_200000040189 [0,1,0,0,0,1|1,0,0]=3 12711 B16R1.51 COCCOC(=O)CSc1ccc(cc1)C 62a_200000040189_100000186775 [0,1,0,0,0,1|1,0,0]=3 12712 B16R1.51 COCCOC(=O)CSc1ccc(cc1)Cl 62a_100000755918_200000040189 [0,1,0,0,0,1|1,0,0]=3 12713 B16R1.51 COCCOC(=O)CSc1ccc(cc1)Cl 62a_200000040189_100000755918 [0,1,0,0,0,1|1,0,0]=3 12714 B16R1.51 COCCOC(=O)CSc1ccc(cc1)F 62a_100000211213_200000040189 [0,1,0,0,0,1|1,0,0]=3 12715 B16R1.51 COCCOC(=O)CSc1ccc(cc1)F 62a_200000040189_100000211213 [0,1,0,0,0,1|1,0,0]=3 12716 B16R1.51 COCCOC(=O)CSc1ccc(cc1)N 62a_100000185761_200000040189 [0,1,0,0,0,1|1,0,0]=3 12717 B16R1.51 COCCOC(=O)CSc1ccc(cc1)N 62a_200000040189_100000185761 [0,1,0,0,0,1|1,0,0]=3 12718 B16R1.51 COCCOC(=O)CSc1ccc(cc1)O 62a_200000040189_100000185759 [0,1,0,0,0,1|1,0,0]=3 12719 B16R1.51 COCCOC(=O)CSc1ccc(cn1)Br 62a_100000686858_200000040189 [0,1,0,0,0,1|2,0,0]=4 12720 B16R1.51 COCCOC(=O)CSc1ccc(cn1)Br 62a_200000040189_100000686858 [0,1,0,0,0,1|2,0,0]=4 12721 B16R1.51 COCCOC(=O)CSc1ccc(cn1)C 62a_100011192072_200000040189 [0,1,0,0,0,1|2,0,0]=4 12722 B16R1.51 COCCOC(=O)CSc1ccc(cn1)C 62a_200000040189_100000754016 [0,1,0,0,0,1|2,0,0]=4 12723 B16R1.51 COCCOC(=O)CSc1ccc(cn1)Cl 62a_100011356976_200000040189 [0,1,0,0,0,1|2,0,0]=4 12724 B16R1.51 COCCOC(=O)CSc1ccc(cn1)Cl 62a_200000040189_100011356976 [0,1,0,0,0,1|2,0,0]=4 12725 B16R1.51 COCCOC(=O)CSc1ccc(cn1)F 62a_100000744514_200000040189 [0,1,0,0,0,1|2,0,0]=4 12726 B16R1.51 COCCOC(=O)CSc1ccc(cn1)F 62a_200000040189_100000744514 [0,1,0,0,0,1|2,0,0]=4 12727 B16R1.51 COCCOC(=O)CSc1ccc(cn1)N 62a_100000737798_200000040189 [0,1,0,0,0,1|2,0,0]=4 12728 B16R1.51 COCCOC(=O)CSc1ccc(cn1)N 62a_200000040189_100000737798 [0,1,0,0,0,1|2,0,0]=4 12729 B16R1.51 COCCOC(=O)CSc1ccc(cn1)O 62a_100000685995_200000040189 [0,1,0,0,0,1|2,0,0]=4 12730 B16R1.51 COCCOC(=O)CSc1ccc(cn1)O 62a_200000040189_100000744096 [0,1,0,0,0,1|2,0,0]=4 12731 B16R1.51 COCCOC(=O)CSc1ccc(nc1)Br 62a_100009814638_200000040189 [0,1,0,0,0,1|2,0,0]=4 12732 B16R1.51 COCCOC(=O)CSc1ccc(nc1)Br 62a_200000040189_100009814638 [0,1,0,0,0,1|2,0,0]=4 12733 B16R1.51 COCCOC(=O)CSc1ccc(nc1)C 62a_100000751577_200000040189 [0,1,0,0,0,1|2,0,0]=4 12734 B16R1.51 COCCOC(=O)CSc1ccc(nc1)C 62a_200000040189_100000751577 [0,1,0,0,0,1|2,0,0]=4 12735 B16R1.51 COCCOC(=O)CSc1ccc(nc1)Cl 62a_100000034144_200000040189 [0,1,0,0,0,1|2,0,0]=4 12736 B16R1.51 COCCOC(=O)CSc1ccc(nc1)Cl 62a_200000040189_100000034144 [0,1,0,0,0,1|2,0,0]=4 12737 B16R1.51 COCCOC(=O)CSc1ccc(nc1)F 62a_100000042367_200000040189 [0,1,0,0,0,1|2,0,0]=4 12738 B16R1.51 COCCOC(=O)CSc1ccc(nc1)F 62a_200000040189_100000042367 [0,1,0,0,0,1|2,0,0]=4 12739 B16R1.51 COCCOC(=O)CSc1ccc(nc1)N 62a_100000187370_200000040189 [0,1,0,0,0,1|2,0,0]=4 12740 B16R1.51 COCCOC(=O)CSc1ccc(nc1)N 62a_200000040189_100000187370 [0,1,0,0,0,1|2,0,0]=4 12741 B16R1.51 CSCCCC(=O)CCc1ccc(cc1)Br 1458a_100000173376_100011740612 [0,1,0,0,0,1|2,0,0]=4 12742 B16R1.51 CSCCCC(=O)CCc1ccc(cc1)C 1458a_100000173376_100011713686 [0,1,0,0,0,1|2,0,0]=4 12743 B16R1.51 CSCCCC(=O)CCc1ccc(cc1)Cl 1458a_100000173376_100011713675 [0,1,0,0,0,1|2,0,0]=4 12744 B16R1.51 CSCCCC(=O)CCc1ccc(cc1)F 1458a_100000173376_100011217392 [0,1,0,0,0,1|2,0,0]=4 12745 B16R1.51 CSCCCC(=O)CCc1ccc(cc1)O 1458a_100000173376_100009816426 [0,1,0,0,0,1|2,0,0]=4 12746 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Br 11a_100000174875_100000173376 [0,1,0,0,0,1|2,0,0]=4 12747 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100000173376 [0,1,0,0,0,1|2,0,0]=4 12748 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100000173376 [0,1,0,0,0,1|2,0,0]=4 12749 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Br 527a_100000174875_100000173376 [0,1,0,0,0,1|2,0,0]=4 12750 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)C 11a_100000174908_100000173376 [0,1,0,0,0,1|2,0,0]=4 12751 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)C 1626a_100000174908_100000173376 [0,1,0,0,0,1|2,0,0]=4 12752 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)C 240690a_100000174908_100000173376 [0,1,0,0,0,1|2,0,0]=4 12753 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)C 527a_100000174908_100000173376 [0,1,0,0,0,1|2,0,0]=4 12754 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100000173376 [0,1,0,0,0,1|2,0,0]=4 12755 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100000173376 [0,1,0,0,0,1|2,0,0]=4 12756 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100000173376 [0,1,0,0,0,1|2,0,0]=4 12757 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100000173376 [0,1,0,0,0,1|2,0,0]=4 12758 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)F 11a_100000174882_100000173376 [0,1,0,0,0,1|2,0,0]=4 12759 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)F 1626a_100000174882_100000173376 [0,1,0,0,0,1|2,0,0]=4 12760 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)F 240690a_100000174882_100000173376 [0,1,0,0,0,1|2,0,0]=4 12761 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)F 527a_100000174882_100000173376 [0,1,0,0,0,1|2,0,0]=4 12762 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)I 11a_100016989417_100000173376 [0,1,0,0,0,1|2,0,0]=4 12763 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)I 1626a_100016989417_100000173376 [0,1,0,0,0,1|2,0,0]=4 12764 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)I 240690a_100016989417_100000173376 [0,1,0,0,0,1|2,0,0]=4 12765 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)I 527a_100016989417_100000173376 [0,1,0,0,0,1|2,0,0]=4 12766 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)O 240690a_100000185549_100000173376 [0,1,0,0,0,1|2,0,0]=4 12767 B16R1.51 CSCCCC(=O)NCc1ccc(cc1)O 527a_100000185549_100000173376 [0,1,0,0,0,1|2,0,0]=4 12768 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br 11a_100020590264_100000217147 [0,1,0,0,0,1|2,0,0]=4 12769 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br 1626a_100020590264_100000217147 [0,1,0,0,0,1|2,0,0]=4 12770 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br 240690a_100020590264_100000217147 [0,1,0,0,0,1|2,0,0]=4 12771 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Br 527a_100020590264_100000217147 [0,1,0,0,0,1|2,0,0]=4 12772 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C 11a_100020590264_100000234883 [0,1,0,0,0,1|2,0,0]=4 12773 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C 1626a_100020590264_100000234883 [0,1,0,0,0,1|2,0,0]=4 12774 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C 240690a_100020590264_100000234883 [0,1,0,0,0,1|2,0,0]=4 12775 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)C 527a_100020590264_100000234883 [0,1,0,0,0,1|2,0,0]=4 12776 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Cl 11a_100020590264_100000235379 [0,1,0,0,0,1|2,0,0]=4 12777 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Cl 1626a_100020590264_100000235379 [0,1,0,0,0,1|2,0,0]=4 12778 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Cl 240690a_100020590264_100000235379 [0,1,0,0,0,1|2,0,0]=4 12779 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)Cl 527a_100020590264_100000235379 [0,1,0,0,0,1|2,0,0]=4 12780 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F 11a_100020590264_100000198493 [0,1,0,0,0,1|2,0,0]=4 12781 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F 1626a_100020590264_100000198493 [0,1,0,0,0,1|2,0,0]=4 12782 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F 240690a_100020590264_100000198493 [0,1,0,0,0,1|2,0,0]=4 12783 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)F 527a_100020590264_100000198493 [0,1,0,0,0,1|2,0,0]=4 12784 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)I 11a_100020590264_100011217499 [0,1,0,0,0,1|2,0,0]=4 12785 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)I 1626a_100020590264_100011217499 [0,1,0,0,0,1|2,0,0]=4 12786 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)I 240690a_100020590264_100011217499 [0,1,0,0,0,1|2,0,0]=4 12787 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)I 527a_100020590264_100011217499 [0,1,0,0,0,1|2,0,0]=4 12788 B16R1.51 CSCCNC(=O)CCc1ccc(cc1)O 240690a_100020590264_100000742835 [0,1,0,0,0,1|2,0,0]=4 12789 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Br 11a_100020590264_100000182358 [0,1,0,0,0,1|2,0,0]=4 12790 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Br 1626a_100020590264_100000182358 [0,1,0,0,0,1|2,0,0]=4 12791 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Br 240690a_100020590264_100000182358 [0,1,0,0,0,1|2,0,0]=4 12792 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Br 527a_100020590264_100000182358 [0,1,0,0,0,1|2,0,0]=4 12793 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C 11a_100020590264_100000182360 [0,1,0,0,0,1|2,0,0]=4 12794 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C 1626a_100020590264_100000182360 [0,1,0,0,0,1|2,0,0]=4 12795 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C 240690a_100020590264_100000182360 [0,1,0,0,0,1|2,0,0]=4 12796 B16R1.51 CSCCNC(=O)COc1ccc(cc1)C 527a_100020590264_100000182360 [0,1,0,0,0,1|2,0,0]=4 12797 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Cl 11a_100020590264_100016990877 [0,1,0,0,0,1|2,0,0]=4 12798 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Cl 1626a_100020590264_100016990877 [0,1,0,0,0,1|2,0,0]=4 12799 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Cl 240690a_100020590264_100016990877 [0,1,0,0,0,1|2,0,0]=4 12800 B16R1.51 CSCCNC(=O)COc1ccc(cc1)Cl 527a_100020590264_100016990877 [0,1,0,0,0,1|2,0,0]=4 12801 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F 11a_100020590264_100000184765 [0,1,0,0,0,1|2,0,0]=4 12802 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F 1626a_100020590264_100000184765 [0,1,0,0,0,1|2,0,0]=4 12803 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F 240690a_100020590264_100000184765 [0,1,0,0,0,1|2,0,0]=4 12804 B16R1.51 CSCCNC(=O)COc1ccc(cc1)F 527a_100020590264_100000184765 [0,1,0,0,0,1|2,0,0]=4 12805 B16R1.51 CSCCNC(=O)COc1ccc(cc1)I 11a_100020590264_100000184369 [0,1,0,0,0,1|2,0,0]=4 12806 B16R1.51 CSCCNC(=O)COc1ccc(cc1)I 1626a_100020590264_100000184369 [0,1,0,0,0,1|2,0,0]=4 12807 B16R1.51 CSCCNC(=O)COc1ccc(cc1)I 240690a_100020590264_100000184369 [0,1,0,0,0,1|2,0,0]=4 12808 B16R1.51 CSCCNC(=O)COc1ccc(cc1)I 527a_100020590264_100000184369 [0,1,0,0,0,1|2,0,0]=4 12809 B16R1.51 CSCCNC(=O)COc1ccc(cc1)O 240690a_100020590264_100000031633 [0,1,0,0,0,1|2,0,0]=4 12810 B16R1.51 CSCCNC(=O)COc1ccc(cc1)O 527a_100020590264_100000031633 [0,1,0,0,0,1|2,0,0]=4 12811 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Br 11a_100020590264_100000179496 [0,1,0,0,0,1|2,0,0]=4 12812 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Br 1626a_100020590264_100000179496 [0,1,0,0,0,1|2,0,0]=4 12813 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Br 240690a_100020590264_100000179496 [0,1,0,0,0,1|2,0,0]=4 12814 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Br 527a_100020590264_100000179496 [0,1,0,0,0,1|2,0,0]=4 12815 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C 11a_100020590264_100000179497 [0,1,0,0,0,1|2,0,0]=4 12816 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C 1626a_100020590264_100000179497 [0,1,0,0,0,1|2,0,0]=4 12817 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C 240690a_100020590264_100000179497 [0,1,0,0,0,1|2,0,0]=4 12818 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)C 527a_100020590264_100000179497 [0,1,0,0,0,1|2,0,0]=4 12819 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Cl 11a_100020590264_100000178402 [0,1,0,0,0,1|2,0,0]=4 12820 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Cl 1626a_100020590264_100000178402 [0,1,0,0,0,1|2,0,0]=4 12821 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Cl 240690a_100020590264_100000178402 [0,1,0,0,0,1|2,0,0]=4 12822 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)Cl 527a_100020590264_100000178402 [0,1,0,0,0,1|2,0,0]=4 12823 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)F 11a_100020590264_100000691584 [0,1,0,0,0,1|2,0,0]=4 12824 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)F 1626a_100020590264_100000691584 [0,1,0,0,0,1|2,0,0]=4 12825 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)F 240690a_100020590264_100000691584 [0,1,0,0,0,1|2,0,0]=4 12826 B16R1.51 CSCCNC(=O)CSc1ccc(cc1)F 527a_100020590264_100000691584 [0,1,0,0,0,1|2,0,0]=4 12827 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 2708a_100000174875_100020590264 [0,1,0,0,0,1|2,0,0]=4 12828 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 2708a_100020590264_100000174875 [0,1,0,0,0,1|2,0,0]=4 12829 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 273464a_100000174875_100020590264 [0,1,0,0,0,1|2,0,0]=4 12830 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 273464a_100020590264_100000174875 [0,1,0,0,0,1|2,0,0]=4 12831 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 512a_100000174875_100020590264 [0,1,0,0,0,1|2,0,0]=4 12832 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Br 512a_100020590264_100000174875 [0,1,0,0,0,1|2,0,0]=4 12833 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 2708a_100000174908_100020590264 [0,1,0,0,0,1|2,0,0]=4 12834 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 2708a_100020590264_100000174908 [0,1,0,0,0,1|2,0,0]=4 12835 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 273464a_100000174908_100020590264 [0,1,0,0,0,1|2,0,0]=4 12836 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 273464a_100020590264_100000174908 [0,1,0,0,0,1|2,0,0]=4 12837 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 512a_100000174908_100020590264 [0,1,0,0,0,1|2,0,0]=4 12838 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)C 512a_100020590264_100000174908 [0,1,0,0,0,1|2,0,0]=4 12839 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Cl 2708a_100000174871_100020590264 [0,1,0,0,0,1|2,0,0]=4 12840 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Cl 2708a_100020590264_100000174871 [0,1,0,0,0,1|2,0,0]=4 12841 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Cl 273464a_100000174871_100020590264 [0,1,0,0,0,1|2,0,0]=4 12842 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Cl 273464a_100020590264_100000174871 [0,1,0,0,0,1|2,0,0]=4 12843 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)Cl 512a_100020590264_100000174871 [0,1,0,0,0,1|2,0,0]=4 12844 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 2708a_100000174882_100020590264 [0,1,0,0,0,1|2,0,0]=4 12845 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 2708a_100020590264_100000174882 [0,1,0,0,0,1|2,0,0]=4 12846 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 273464a_100000174882_100020590264 [0,1,0,0,0,1|2,0,0]=4 12847 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 273464a_100020590264_100000174882 [0,1,0,0,0,1|2,0,0]=4 12848 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 512a_100000174882_100020590264 [0,1,0,0,0,1|2,0,0]=4 12849 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)F 512a_100020590264_100000174882 [0,1,0,0,0,1|2,0,0]=4 12850 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 2708a_100016989417_100020590264 [0,1,0,0,0,1|2,0,0]=4 12851 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 2708a_100020590264_100016989417 [0,1,0,0,0,1|2,0,0]=4 12852 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 273464a_100016989417_100020590264 [0,1,0,0,0,1|2,0,0]=4 12853 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 273464a_100020590264_100016989417 [0,1,0,0,0,1|2,0,0]=4 12854 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 512a_100016989417_100020590264 [0,1,0,0,0,1|2,0,0]=4 12855 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)I 512a_100020590264_100016989417 [0,1,0,0,0,1|2,0,0]=4 12856 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)O 2708a_100000185549_100020590264 [0,1,0,0,0,1|2,0,0]=4 12857 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)O 2708a_100020590264_100000185549 [0,1,0,0,0,1|2,0,0]=4 12858 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)O 273464a_100000185549_100020590264 [0,1,0,0,0,1|2,0,0]=4 12859 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)O 273464a_100020590264_100000185549 [0,1,0,0,0,1|2,0,0]=4 12860 B16R1.51 CSCCNC(=O)NCc1ccc(cc1)O 512a_100020590264_100000185549 [0,1,0,0,0,1|2,0,0]=4 12861 B16R1.51 Cc1ccc(cc1)CCC(=O)CCCCF 1458a_100000234883_100000729493 [0,1,0,0,0,1|2,0,0]=4 12862 B16R1.51 Cc1ccc(cc1)CCC(=O)CCCCO 1458a_100000234883_100000210776 [0,1,0,0,0,1|2,0,0]=4 12863 B16R1.51 Cc1ccc(cc1)CCC(=O)CCCCO 1458a_100000695505_100011713686 [0,1,0,0,0,1|2,0,0]=4 12864 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCF 11a_100015189416_100000234883 [0,1,0,0,0,1|2,0,0]=4 12865 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCF 1626a_100015189416_100000234883 [0,1,0,0,0,1|2,0,0]=4 12866 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCF 240690a_100015189416_100000234883 [0,1,0,0,0,1|2,0,0]=4 12867 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCF 527a_100015189416_100000234883 [0,1,0,0,0,1|2,0,0]=4 12868 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCO 240690a_100000182051_100000234883 [0,1,0,0,0,1|2,0,0]=4 12869 B16R1.51 Cc1ccc(cc1)CCC(=O)NCCCO 527a_100000182051_100000234883 [0,1,0,0,0,1|2,0,0]=4 12870 B16R1.51 Cc1ccc(cc1)CNC(=O)CCCCO 1626a_100000174908_100000695505 [0,1,0,0,0,1|2,0,0]=4 12871 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 2708a_100000174908_100015189416 [0,1,0,0,0,1|2,0,0]=4 12872 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 2708a_100015189416_100000174908 [0,1,0,0,0,1|2,0,0]=4 12873 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 273464a_100000174908_100015189416 [0,1,0,0,0,1|2,0,0]=4 12874 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 273464a_100015189416_100000174908 [0,1,0,0,0,1|2,0,0]=4 12875 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 512a_100000174908_100015189416 [0,1,0,0,0,1|2,0,0]=4 12876 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCF 512a_100015189416_100000174908 [0,1,0,0,0,1|2,0,0]=4 12877 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO 2708a_100000174908_100000182051 [0,1,0,0,0,1|2,0,0]=4 12878 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO 273464a_100000174908_100000182051 [0,1,0,0,0,1|2,0,0]=4 12879 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO 273464a_100000182051_100000174908 [0,1,0,0,0,1|2,0,0]=4 12880 B16R1.51 Cc1ccc(cc1)CNC(=O)NCCCO 512a_100000174908_100000182051 [0,1,0,0,0,1|2,0,0]=4 12881 B16R1.51 Cc1ccc(cc1)OCC(=O)CCCCF 1458a_100000182360_100000729493 [0,1,0,0,0,1|2,0,0]=4 12882 B16R1.51 Cc1ccc(cc1)OCC(=O)CCCCO 1458a_100000182360_100000210776 [0,1,0,0,0,1|2,0,0]=4 12883 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCF 11a_100015189416_100000182360 [0,1,0,0,0,1|2,0,0]=4 12884 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCF 1626a_100015189416_100000182360 [0,1,0,0,0,1|2,0,0]=4 12885 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCF 240690a_100015189416_100000182360 [0,1,0,0,0,1|2,0,0]=4 12886 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCF 527a_100015189416_100000182360 [0,1,0,0,0,1|2,0,0]=4 12887 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCO 240690a_100000182051_100000182360 [0,1,0,0,0,1|2,0,0]=4 12888 B16R1.51 Cc1ccc(cc1)OCC(=O)NCCCO 527a_100000182051_100000182360 [0,1,0,0,0,1|2,0,0]=4 12889 B16R1.51 Cc1ccc(cc1)SCC(=O)CCCCF 1458a_100000179497_100000729493 [0,1,0,0,0,1|2,0,0]=4 12890 B16R1.51 Cc1ccc(cc1)SCC(=O)CCCCO 1458a_100000179497_100000210776 [0,1,0,0,0,1|2,0,0]=4 12891 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCF 11a_100015189416_100000179497 [0,1,0,0,0,1|2,0,0]=4 12892 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCF 1626a_100015189416_100000179497 [0,1,0,0,0,1|2,0,0]=4 12893 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCF 240690a_100015189416_100000179497 [0,1,0,0,0,1|2,0,0]=4 12894 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCF 527a_100015189416_100000179497 [0,1,0,0,0,1|2,0,0]=4 12895 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCO 240690a_100000182051_100000179497 [0,1,0,0,0,1|2,0,0]=4 12896 B16R1.51 Cc1ccc(cc1)SCC(=O)NCCCO 527a_100000182051_100000179497 [0,1,0,0,0,1|2,0,0]=4 12897 B16R1.51 O=C(CCCCF)CCc1ccc(cc1)Br 1458a_100000217147_100000729493 [0,1,0,0,0,1|2,0,0]=4 12898 B16R1.51 O=C(CCCCF)CCc1ccc(cc1)Cl 1458a_100000235379_100000729493 [0,1,0,0,0,1|2,0,0]=4 12899 B16R1.51 O=C(CCCCF)CCc1ccc(cc1)F 1458a_100000198493_100000729493 [0,1,0,0,0,1|2,0,0]=4 12900 B16R1.51 O=C(CCCCF)CCc1ccc(cc1)I 1458a_100011217499_100000729493 [0,1,0,0,0,1|2,0,0]=4 12901 B16R1.51 O=C(CCCCF)CCc1ccc(cc1)O 1458a_100000742835_100000729493 [0,1,0,0,0,1|2,0,0]=4 12902 B16R1.51 O=C(CCCCF)COc1ccc(cc1)Br 1458a_100000182358_100000729493 [0,1,0,0,0,1|2,0,0]=4 12903 B16R1.51 O=C(CCCCF)COc1ccc(cc1)Cl 1458a_100016990877_100000729493 [0,1,0,0,0,1|2,0,0]=4 12904 B16R1.51 O=C(CCCCF)COc1ccc(cc1)F 1458a_100000184765_100000729493 [0,1,0,0,0,1|2,0,0]=4 12905 B16R1.51 O=C(CCCCF)COc1ccc(cc1)I 1458a_100000184369_100000729493 [0,1,0,0,0,1|2,0,0]=4 12906 B16R1.51 O=C(CCCCF)COc1ccc(cc1)O 1458a_100000031633_100000729493 [0,1,0,0,0,1|2,0,0]=4 12907 B16R1.51 O=C(CCCCF)CSc1ccc(cc1)Br 1458a_100000179496_100000729493 [0,1,0,0,0,1|2,0,0]=4 12908 B16R1.51 O=C(CCCCF)CSc1ccc(cc1)Cl 1458a_100000178402_100000729493 [0,1,0,0,0,1|2,0,0]=4 12909 B16R1.51 O=C(CCCCF)CSc1ccc(cc1)F 1458a_100000691584_100000729493 [0,1,0,0,0,1|2,0,0]=4 12910 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)Br 1458a_100000217147_100000210776 [0,1,0,0,0,1|2,0,0]=4 12911 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)Br 1458a_100000695505_100011740612 [0,1,0,0,0,1|2,0,0]=4 12912 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)Cl 1458a_100000235379_100000210776 [0,1,0,0,0,1|2,0,0]=4 12913 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)Cl 1458a_100000695505_100011713675 [0,1,0,0,0,1|2,0,0]=4 12914 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)F 1458a_100000198493_100000210776 [0,1,0,0,0,1|2,0,0]=4 12915 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)F 1458a_100000695505_100011217392 [0,1,0,0,0,1|2,0,0]=4 12916 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)I 1458a_100011217499_100000210776 [0,1,0,0,0,1|2,0,0]=4 12917 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)O 1458a_100000695505_100009816426 [0,1,0,0,0,1|2,0,0]=4 12918 B16R1.51 O=C(CCCCO)CCc1ccc(cc1)O 1458a_100000742835_100000210776 [0,1,0,0,0,1|2,0,0]=4 12919 B16R1.51 O=C(CCCCO)COc1ccc(cc1)Br 1458a_100000182358_100000210776 [0,1,0,0,0,1|2,0,0]=4 12920 B16R1.51 O=C(CCCCO)COc1ccc(cc1)Cl 1458a_100016990877_100000210776 [0,1,0,0,0,1|2,0,0]=4 12921 B16R1.51 O=C(CCCCO)COc1ccc(cc1)F 1458a_100000184765_100000210776 [0,1,0,0,0,1|2,0,0]=4 12922 B16R1.51 O=C(CCCCO)COc1ccc(cc1)I 1458a_100000184369_100000210776 [0,1,0,0,0,1|2,0,0]=4 12923 B16R1.51 O=C(CCCCO)COc1ccc(cc1)O 1458a_100000031633_100000210776 [0,1,0,0,0,1|2,0,0]=4 12924 B16R1.51 O=C(CCCCO)CSc1ccc(cc1)Br 1458a_100000179496_100000210776 [0,1,0,0,0,1|2,0,0]=4 12925 B16R1.51 O=C(CCCCO)CSc1ccc(cc1)Cl 1458a_100000178402_100000210776 [0,1,0,0,0,1|2,0,0]=4 12926 B16R1.51 O=C(CCCCO)CSc1ccc(cc1)F 1458a_100000691584_100000210776 [0,1,0,0,0,1|2,0,0]=4 12927 B16R1.51 O=C(CCCCO)NCc1ccc(cc1)Br 1626a_100000174875_100000695505 [0,1,0,0,0,1|2,0,0]=4 12928 B16R1.51 O=C(CCCCO)NCc1ccc(cc1)Cl 1626a_100000174871_100000695505 [0,1,0,0,0,1|2,0,0]=4 12929 B16R1.51 O=C(CCCCO)NCc1ccc(cc1)F 1626a_100000174882_100000695505 [0,1,0,0,0,1|2,0,0]=4 12930 B16R1.51 O=C(CCCCO)NCc1ccc(cc1)I 1626a_100016989417_100000695505 [0,1,0,0,0,1|2,0,0]=4 12931 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCF 11a_100015189416_100000217147 [0,1,0,0,0,1|2,0,0]=4 12932 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCF 1626a_100015189416_100000217147 [0,1,0,0,0,1|2,0,0]=4 12933 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCF 240690a_100015189416_100000217147 [0,1,0,0,0,1|2,0,0]=4 12934 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCF 527a_100015189416_100000217147 [0,1,0,0,0,1|2,0,0]=4 12935 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCO 240690a_100000182051_100000217147 [0,1,0,0,0,1|2,0,0]=4 12936 B16R1.51 O=C(CCc1ccc(cc1)Br)NCCCO 527a_100000182051_100000217147 [0,1,0,0,0,1|2,0,0]=4 12937 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCF 11a_100015189416_100000235379 [0,1,0,0,0,1|2,0,0]=4 12938 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCF 1626a_100015189416_100000235379 [0,1,0,0,0,1|2,0,0]=4 12939 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCF 240690a_100015189416_100000235379 [0,1,0,0,0,1|2,0,0]=4 12940 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCF 527a_100015189416_100000235379 [0,1,0,0,0,1|2,0,0]=4 12941 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCO 240690a_100000182051_100000235379 [0,1,0,0,0,1|2,0,0]=4 12942 B16R1.51 O=C(CCc1ccc(cc1)Cl)NCCCO 527a_100000182051_100000235379 [0,1,0,0,0,1|2,0,0]=4 12943 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCF 11a_100015189416_100000198493 [0,1,0,0,0,1|2,0,0]=4 12944 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCF 1626a_100015189416_100000198493 [0,1,0,0,0,1|2,0,0]=4 12945 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCF 240690a_100015189416_100000198493 [0,1,0,0,0,1|2,0,0]=4 12946 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCF 527a_100015189416_100000198493 [0,1,0,0,0,1|2,0,0]=4 12947 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCO 240690a_100000182051_100000198493 [0,1,0,0,0,1|2,0,0]=4 12948 B16R1.51 O=C(CCc1ccc(cc1)F)NCCCO 527a_100000182051_100000198493 [0,1,0,0,0,1|2,0,0]=4 12949 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCF 11a_100015189416_100011217499 [0,1,0,0,0,1|2,0,0]=4 12950 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCF 1626a_100015189416_100011217499 [0,1,0,0,0,1|2,0,0]=4 12951 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCF 240690a_100015189416_100011217499 [0,1,0,0,0,1|2,0,0]=4 12952 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCF 527a_100015189416_100011217499 [0,1,0,0,0,1|2,0,0]=4 12953 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCO 240690a_100000182051_100011217499 [0,1,0,0,0,1|2,0,0]=4 12954 B16R1.51 O=C(CCc1ccc(cc1)I)NCCCO 527a_100000182051_100011217499 [0,1,0,0,0,1|2,0,0]=4 12955 B16R1.51 O=C(CCc1ccc(cc1)O)NCCCF 240690a_100015189416_100000742835 [0,1,0,0,0,1|2,0,0]=4 12956 B16R1.51 O=C(CCc1ccc(cc1)O)NCCCO 240690a_100000182051_100000742835 [0,1,0,0,0,1|2,0,0]=4 12957 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCF 11a_100015189416_100000182358 [0,1,0,0,0,1|2,0,0]=4 12958 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCF 1626a_100015189416_100000182358 [0,1,0,0,0,1|2,0,0]=4 12959 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCF 240690a_100015189416_100000182358 [0,1,0,0,0,1|2,0,0]=4 12960 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCF 527a_100015189416_100000182358 [0,1,0,0,0,1|2,0,0]=4 12961 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCO 240690a_100000182051_100000182358 [0,1,0,0,0,1|2,0,0]=4 12962 B16R1.51 O=C(COc1ccc(cc1)Br)NCCCO 527a_100000182051_100000182358 [0,1,0,0,0,1|2,0,0]=4 12963 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCF 11a_100015189416_100016990877 [0,1,0,0,0,1|2,0,0]=4 12964 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCF 1626a_100015189416_100016990877 [0,1,0,0,0,1|2,0,0]=4 12965 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCF 240690a_100015189416_100016990877 [0,1,0,0,0,1|2,0,0]=4 12966 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCF 527a_100015189416_100016990877 [0,1,0,0,0,1|2,0,0]=4 12967 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCO 240690a_100000182051_100016990877 [0,1,0,0,0,1|2,0,0]=4 12968 B16R1.51 O=C(COc1ccc(cc1)Cl)NCCCO 527a_100000182051_100016990877 [0,1,0,0,0,1|2,0,0]=4 12969 B16R1.51 O=C(COc1ccc(cc1)F)NCCCF 11a_100015189416_100000184765 [0,1,0,0,0,1|2,0,0]=4 12970 B16R1.51 O=C(COc1ccc(cc1)F)NCCCF 1626a_100015189416_100000184765 [0,1,0,0,0,1|2,0,0]=4 12971 B16R1.51 O=C(COc1ccc(cc1)F)NCCCF 240690a_100015189416_100000184765 [0,1,0,0,0,1|2,0,0]=4 12972 B16R1.51 O=C(COc1ccc(cc1)F)NCCCF 527a_100015189416_100000184765 [0,1,0,0,0,1|2,0,0]=4 12973 B16R1.51 O=C(COc1ccc(cc1)F)NCCCO 240690a_100000182051_100000184765 [0,1,0,0,0,1|2,0,0]=4 12974 B16R1.51 O=C(COc1ccc(cc1)F)NCCCO 527a_100000182051_100000184765 [0,1,0,0,0,1|2,0,0]=4 12975 B16R1.51 O=C(COc1ccc(cc1)I)NCCCF 11a_100015189416_100000184369 [0,1,0,0,0,1|2,0,0]=4 12976 B16R1.51 O=C(COc1ccc(cc1)I)NCCCF 1626a_100015189416_100000184369 [0,1,0,0,0,1|2,0,0]=4 12977 B16R1.51 O=C(COc1ccc(cc1)I)NCCCF 240690a_100015189416_100000184369 [0,1,0,0,0,1|2,0,0]=4 12978 B16R1.51 O=C(COc1ccc(cc1)I)NCCCF 527a_100015189416_100000184369 [0,1,0,0,0,1|2,0,0]=4 12979 B16R1.51 O=C(COc1ccc(cc1)I)NCCCO 240690a_100000182051_100000184369 [0,1,0,0,0,1|2,0,0]=4 12980 B16R1.51 O=C(COc1ccc(cc1)I)NCCCO 527a_100000182051_100000184369 [0,1,0,0,0,1|2,0,0]=4 12981 B16R1.51 O=C(COc1ccc(cc1)O)NCCCF 240690a_100015189416_100000031633 [0,1,0,0,0,1|2,0,0]=4 12982 B16R1.51 O=C(COc1ccc(cc1)O)NCCCF 527a_100015189416_100000031633 [0,1,0,0,0,1|2,0,0]=4 12983 B16R1.51 O=C(COc1ccc(cc1)O)NCCCO 240690a_100000182051_100000031633 [0,1,0,0,0,1|2,0,0]=4 12984 B16R1.51 O=C(COc1ccc(cc1)O)NCCCO 527a_100000182051_100000031633 [0,1,0,0,0,1|2,0,0]=4 12985 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCF 11a_100015189416_100000179496 [0,1,0,0,0,1|2,0,0]=4 12986 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCF 1626a_100015189416_100000179496 [0,1,0,0,0,1|2,0,0]=4 12987 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCF 240690a_100015189416_100000179496 [0,1,0,0,0,1|2,0,0]=4 12988 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCF 527a_100015189416_100000179496 [0,1,0,0,0,1|2,0,0]=4 12989 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCO 240690a_100000182051_100000179496 [0,1,0,0,0,1|2,0,0]=4 12990 B16R1.51 O=C(CSc1ccc(cc1)Br)NCCCO 527a_100000182051_100000179496 [0,1,0,0,0,1|2,0,0]=4 12991 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCF 11a_100015189416_100000178402 [0,1,0,0,0,1|2,0,0]=4 12992 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCF 1626a_100015189416_100000178402 [0,1,0,0,0,1|2,0,0]=4 12993 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCF 240690a_100015189416_100000178402 [0,1,0,0,0,1|2,0,0]=4 12994 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCF 527a_100015189416_100000178402 [0,1,0,0,0,1|2,0,0]=4 12995 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCO 240690a_100000182051_100000178402 [0,1,0,0,0,1|2,0,0]=4 12996 B16R1.51 O=C(CSc1ccc(cc1)Cl)NCCCO 527a_100000182051_100000178402 [0,1,0,0,0,1|2,0,0]=4 12997 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCF 11a_100015189416_100000691584 [0,1,0,0,0,1|2,0,0]=4 12998 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCF 1626a_100015189416_100000691584 [0,1,0,0,0,1|2,0,0]=4 12999 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCF 240690a_100015189416_100000691584 [0,1,0,0,0,1|2,0,0]=4 13000 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCF 527a_100015189416_100000691584 [0,1,0,0,0,1|2,0,0]=4 13001 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCO 240690a_100000182051_100000691584 [0,1,0,0,0,1|2,0,0]=4 13002 B16R1.51 O=C(CSc1ccc(cc1)F)NCCCO 527a_100000182051_100000691584 [0,1,0,0,0,1|2,0,0]=4 13003 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 2708a_100000174875_100015189416 [0,1,0,0,0,1|2,0,0]=4 13004 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 2708a_100015189416_100000174875 [0,1,0,0,0,1|2,0,0]=4 13005 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 273464a_100000174875_100015189416 [0,1,0,0,0,1|2,0,0]=4 13006 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 273464a_100015189416_100000174875 [0,1,0,0,0,1|2,0,0]=4 13007 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 512a_100000174875_100015189416 [0,1,0,0,0,1|2,0,0]=4 13008 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Br 512a_100015189416_100000174875 [0,1,0,0,0,1|2,0,0]=4 13009 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Cl 2708a_100000174871_100015189416 [0,1,0,0,0,1|2,0,0]=4 13010 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Cl 2708a_100015189416_100000174871 [0,1,0,0,0,1|2,0,0]=4 13011 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Cl 273464a_100000174871_100015189416 [0,1,0,0,0,1|2,0,0]=4 13012 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Cl 273464a_100015189416_100000174871 [0,1,0,0,0,1|2,0,0]=4 13013 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)Cl 512a_100015189416_100000174871 [0,1,0,0,0,1|2,0,0]=4 13014 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 2708a_100000174882_100015189416 [0,1,0,0,0,1|2,0,0]=4 13015 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 2708a_100015189416_100000174882 [0,1,0,0,0,1|2,0,0]=4 13016 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 273464a_100000174882_100015189416 [0,1,0,0,0,1|2,0,0]=4 13017 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 273464a_100015189416_100000174882 [0,1,0,0,0,1|2,0,0]=4 13018 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 512a_100000174882_100015189416 [0,1,0,0,0,1|2,0,0]=4 13019 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)F 512a_100015189416_100000174882 [0,1,0,0,0,1|2,0,0]=4 13020 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 2708a_100015189416_100016989417 [0,1,0,0,0,1|2,0,0]=4 13021 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 2708a_100016989417_100015189416 [0,1,0,0,0,1|2,0,0]=4 13022 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 273464a_100015189416_100016989417 [0,1,0,0,0,1|2,0,0]=4 13023 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 273464a_100016989417_100015189416 [0,1,0,0,0,1|2,0,0]=4 13024 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 512a_100015189416_100016989417 [0,1,0,0,0,1|2,0,0]=4 13025 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)I 512a_100016989417_100015189416 [0,1,0,0,0,1|2,0,0]=4 13026 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)O 2708a_100000185549_100015189416 [0,1,0,0,0,1|2,0,0]=4 13027 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)O 2708a_100015189416_100000185549 [0,1,0,0,0,1|2,0,0]=4 13028 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)O 273464a_100000185549_100015189416 [0,1,0,0,0,1|2,0,0]=4 13029 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)O 273464a_100015189416_100000185549 [0,1,0,0,0,1|2,0,0]=4 13030 B16R1.51 O=C(NCCCF)NCc1ccc(cc1)O 512a_100015189416_100000185549 [0,1,0,0,0,1|2,0,0]=4 13031 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Br 2708a_100000174875_100000182051 [0,1,0,0,0,1|2,0,0]=4 13032 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Br 273464a_100000174875_100000182051 [0,1,0,0,0,1|2,0,0]=4 13033 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Br 273464a_100000182051_100000174875 [0,1,0,0,0,1|2,0,0]=4 13034 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Br 512a_100000174875_100000182051 [0,1,0,0,0,1|2,0,0]=4 13035 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Cl 2708a_100000174871_100000182051 [0,1,0,0,0,1|2,0,0]=4 13036 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Cl 273464a_100000174871_100000182051 [0,1,0,0,0,1|2,0,0]=4 13037 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)Cl 273464a_100000182051_100000174871 [0,1,0,0,0,1|2,0,0]=4 13038 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)F 2708a_100000174882_100000182051 [0,1,0,0,0,1|2,0,0]=4 13039 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)F 273464a_100000174882_100000182051 [0,1,0,0,0,1|2,0,0]=4 13040 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)F 273464a_100000182051_100000174882 [0,1,0,0,0,1|2,0,0]=4 13041 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)F 512a_100000174882_100000182051 [0,1,0,0,0,1|2,0,0]=4 13042 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)I 2708a_100016989417_100000182051 [0,1,0,0,0,1|2,0,0]=4 13043 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)I 273464a_100000182051_100016989417 [0,1,0,0,0,1|2,0,0]=4 13044 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)I 273464a_100016989417_100000182051 [0,1,0,0,0,1|2,0,0]=4 13045 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)I 512a_100016989417_100000182051 [0,1,0,0,0,1|2,0,0]=4 13046 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)O 2708a_100000185549_100000182051 [0,1,0,0,0,1|2,0,0]=4 13047 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)O 273464a_100000182051_100000185549 [0,1,0,0,0,1|2,0,0]=4 13048 B16R1.51 O=C(NCCCO)NCc1ccc(cc1)O 273464a_100000185549_100000182051 [0,1,0,0,0,1|2,0,0]=4 13049 B16R1.51 [13CH3]OCCNC(=O)COc1ccc(cc1)Br 34a_200000158804_200025704644 [0,1,0,0,0,1|2,0,0]=4 13050 B16R1.51 [13CH3]OCCNC(=O)COc1ccc(cc1)Br 7a_200000158804_200025704644 [0,1,0,0,0,1|2,0,0]=4 13051 B16R1.52 CCCC#CC(=O)CCc1cccc(c1)Br 1458a_200011218047_100011740638 [0,1,0,0,0,1|1,0,1]=4 13052 B16R1.52 CCCC#CC(=O)CCc1cccc(c1)C 1458a_200011218047_100011713685 [0,1,0,0,0,1|1,0,1]=4 13053 B16R1.52 CCCC#CC(=O)CCc1cccc(c1)Cl 1458a_200011218047_100011713710 [0,1,0,0,0,1|1,0,1]=4 13054 B16R1.52 CCCC#CC(=O)CCc1cccc(c1)F 1458a_200011218047_100011217235 [0,1,0,0,0,1|1,0,1]=4 13055 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)Br 240690a_100000174977_200011218047 [0,1,0,0,0,1|1,0,1]=4 13056 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)C 240690a_100000185548_200011218047 [0,1,0,0,0,1|1,0,1]=4 13057 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_200011218047 [0,1,0,0,0,1|1,0,1]=4 13058 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)F 240690a_100000174948_200011218047 [0,1,0,0,0,1|1,0,1]=4 13059 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)I 240690a_100000106179_200011218047 [0,1,0,0,0,1|1,0,1]=4 13060 B16R1.52 CCCC#CC(=O)NCc1cccc(c1)O 240690a_100000743036_200011218047 [0,1,0,0,0,1|1,0,1]=4 13061 B16R1.52 CCCC=CC(=O)CCc1cccc(c1)Br 1458a_100000212230_100011740638 [0,1,0,0,0,1|1,0,1]=4 13062 B16R1.52 CCCC=CC(=O)CCc1cccc(c1)C 1458a_100000212230_100011713685 [0,1,0,0,0,1|1,0,1]=4 13063 B16R1.52 CCCC=CC(=O)CCc1cccc(c1)Cl 1458a_100000212230_100011713710 [0,1,0,0,0,1|1,0,1]=4 13064 B16R1.52 CCCC=CC(=O)CCc1cccc(c1)F 1458a_100000212230_100011217235 [0,1,0,0,0,1|1,0,1]=4 13065 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Br 11a_100000174977_100000212230 [0,1,0,0,0,1|1,0,1]=4 13066 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000212230 [0,1,0,0,0,1|1,0,1]=4 13067 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000212230 [0,1,0,0,0,1|1,0,1]=4 13068 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)C 11a_100000185548_100000212230 [0,1,0,0,0,1|1,0,1]=4 13069 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)C 1626a_100000185548_100000212230 [0,1,0,0,0,1|1,0,1]=4 13070 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)C 240690a_100000185548_100000212230 [0,1,0,0,0,1|1,0,1]=4 13071 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000212230 [0,1,0,0,0,1|1,0,1]=4 13072 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000212230 [0,1,0,0,0,1|1,0,1]=4 13073 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000212230 [0,1,0,0,0,1|1,0,1]=4 13074 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)F 11a_100000174948_100000212230 [0,1,0,0,0,1|1,0,1]=4 13075 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)F 1626a_100000174948_100000212230 [0,1,0,0,0,1|1,0,1]=4 13076 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)F 240690a_100000174948_100000212230 [0,1,0,0,0,1|1,0,1]=4 13077 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)I 11a_100000106179_100000212230 [0,1,0,0,0,1|1,0,1]=4 13078 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)I 1626a_100000106179_100000212230 [0,1,0,0,0,1|1,0,1]=4 13079 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)I 240690a_100000106179_100000212230 [0,1,0,0,0,1|1,0,1]=4 13080 B16R1.52 CCCC=CC(=O)NCc1cccc(c1)O 240690a_100000743036_100000212230 [0,1,0,0,0,1|1,0,1]=4 13081 B16R1.52 CCCCCC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_100000210326 [0,1,0,0,0,1|1,0,1]=4 13082 B16R1.52 CCCCCC(=O)C#Cc1cccc(c1)C 1458a_100011892726_100000210326 [0,1,0,0,0,1|1,0,1]=4 13083 B16R1.52 CCCCCC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_100000210326 [0,1,0,0,0,1|1,0,1]=4 13084 B16R1.52 CCCCCC(=O)C#Cc1cccc(c1)F 1458a_100011892744_100000210326 [0,1,0,0,0,1|1,0,1]=4 13085 B16R1.52 CCCCCC(=O)C#Cc1cccc(c1)O 1458a_200009909484_100000210326 [0,1,0,0,0,1|1,0,1]=4 13086 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_100000210326 [0,1,0,0,0,1|1,0,1]=4 13087 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)Br 6a_100000210085_100011215151 [0,1,0,0,0,1|1,0,1]=4 13088 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)C 1458a_100000690095_100000210326 [0,1,0,0,0,1|1,0,1]=4 13089 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_100000210326 [0,1,0,0,0,1|1,0,1]=4 13090 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)F 1458a_100000718793_100000210326 [0,1,0,0,0,1|1,0,1]=4 13091 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)F 6a_100000210812_100011215151 [0,1,0,0,0,1|1,0,1]=4 13092 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)I 1458a_100020647043_100000210326 [0,1,0,0,0,1|1,0,1]=4 13093 B16R1.52 CCCCCC(=O)C=Cc1cccc(c1)I 6a_100000014684_100011215151 [0,1,0,0,0,1|1,0,1]=4 13094 B16R1.52 CCCCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000210326 [0,1,0,0,0,1|1,0,0]=3 13095 B16R1.52 CCCCCC(=O)CCc1cccc(c1)Br 1458a_100000212188_100011740638 [0,1,0,0,0,1|1,0,0]=3 13096 B16R1.52 CCCCCC(=O)CCc1cccc(c1)C 1458a_100000212188_100011713685 [0,1,0,0,0,1|1,0,0]=3 13097 B16R1.52 CCCCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000210326 [0,1,0,0,0,1|1,0,0]=3 13098 B16R1.52 CCCCCC(=O)CCc1cccc(c1)Cl 1458a_100000212188_100011713710 [0,1,0,0,0,1|1,0,0]=3 13099 B16R1.52 CCCCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000210326 [0,1,0,0,0,1|1,0,0]=3 13100 B16R1.52 CCCCCC(=O)CCc1cccc(c1)F 1458a_100000212188_100011217235 [0,1,0,0,0,1|1,0,0]=3 13101 B16R1.52 CCCCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000210326 [0,1,0,0,0,1|1,0,0]=3 13102 B16R1.52 CCCCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000210326 [0,1,0,0,0,1|1,0,0]=3 13103 B16R1.52 CCCCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000210326 [0,1,0,0,0,1|1,0,0]=3 13104 B16R1.52 CCCCCC(=O)CNc1cccc(c1)Br 34a_100000210019_200012276598 [0,1,0,0,0,1|1,0,0]=3 13105 B16R1.52 CCCCCC(=O)CNc1cccc(c1)C 2230a_100000188690_200012276598 [0,1,0,0,0,1|1,0,0]=3 13106 B16R1.52 CCCCCC(=O)CNc1cccc(c1)C 34a_100000188690_200012276598 [0,1,0,0,0,1|1,0,0]=3 13107 B16R1.52 CCCCCC(=O)CNc1cccc(c1)Cl 34a_100000185859_200012276598 [0,1,0,0,0,1|1,0,0]=3 13108 B16R1.52 CCCCCC(=O)CNc1cccc(c1)F 34a_100000210047_200012276598 [0,1,0,0,0,1|1,0,0]=3 13109 B16R1.52 CCCCCC(=O)CNc1cccc(c1)I 34a_100000211102_200012276598 [0,1,0,0,0,1|1,0,0]=3 13110 B16R1.52 CCCCCC(=O)CNc1cccc(c1)O 34a_100000210217_200012276598 [0,1,0,0,0,1|1,0,0]=3 13111 B16R1.52 CCCCCC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_200012276598 [0,1,0,0,0,1|2,0,0]=4 13112 B16R1.52 CCCCCC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_200012276598 [0,1,0,0,0,1|2,0,0]=4 13113 B16R1.52 CCCCCC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_200012276598 [0,1,0,0,0,1|2,0,0]=4 13114 B16R1.52 CCCCCC(=O)COc1cccc(=O)[nH]1 34a_100000033347_200012276598 [0,1,0,0,0,1|2,0,0]=4 13115 B16R1.52 CCCCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210326 [0,1,0,0,0,1|1,0,0]=3 13116 B16R1.52 CCCCCC(=O)COc1cccc(c1)Br 34a_100000210342_200012276598 [0,1,0,0,0,1|1,0,0]=3 13117 B16R1.52 CCCCCC(=O)COc1cccc(c1)Br 7a_100000210342_200012276598 [0,1,0,0,0,1|1,0,0]=3 13118 B16R1.52 CCCCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210326 [0,1,0,0,0,1|1,0,0]=3 13119 B16R1.52 CCCCCC(=O)COc1cccc(c1)C 34a_100000210337_200012276598 [0,1,0,0,0,1|1,0,0]=3 13120 B16R1.52 CCCCCC(=O)COc1cccc(c1)C 7a_100000210337_200012276598 [0,1,0,0,0,1|1,0,0]=3 13121 B16R1.52 CCCCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210326 [0,1,0,0,0,1|1,0,0]=3 13122 B16R1.52 CCCCCC(=O)COc1cccc(c1)Cl 34a_100000210295_200012276598 [0,1,0,0,0,1|1,0,0]=3 13123 B16R1.52 CCCCCC(=O)COc1cccc(c1)Cl 7a_100000210295_200012276598 [0,1,0,0,0,1|1,0,0]=3 13124 B16R1.52 CCCCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210326 [0,1,0,0,0,1|1,0,0]=3 13125 B16R1.52 CCCCCC(=O)COc1cccc(c1)F 34a_100000210426_200012276598 [0,1,0,0,0,1|1,0,0]=3 13126 B16R1.52 CCCCCC(=O)COc1cccc(c1)F 7a_100000210426_200012276598 [0,1,0,0,0,1|1,0,0]=3 13127 B16R1.52 CCCCCC(=O)COc1cccc(c1)I 34a_100000211634_200012276598 [0,1,0,0,0,1|1,0,0]=3 13128 B16R1.52 CCCCCC(=O)COc1cccc(c1)I 7a_100000211634_200012276598 [0,1,0,0,0,1|1,0,0]=3 13129 B16R1.52 CCCCCC(=O)COc1cccc(c1)N 34a_100000210217_200012276598 [0,1,0,0,0,1|1,0,0]=3 13130 B16R1.52 CCCCCC(=O)COc1cccc(n1)F 34a_100011432558_200012276598 [0,1,0,0,0,1|2,0,0]=4 13131 B16R1.52 CCCCCC(=O)COc1ccnc(c1)C 34a_100000688365_200012276598 [0,1,0,0,0,1|2,0,0]=4 13132 B16R1.52 CCCCCC(=O)COc1ccnc(c1)Cl 34a_100000762945_200012276598 [0,1,0,0,0,1|2,0,0]=4 13133 B16R1.52 CCCCCC(=O)COc1ccnc(c1)F 34a_100000732698_200012276598 [0,1,0,0,0,1|2,0,0]=4 13134 B16R1.52 CCCCCC(=O)COc1ccnc(c1)N 34a_100011834064_200012276598 [0,1,0,0,0,1|2,0,0]=4 13135 B16R1.52 CCCCCC(=O)COc1cncc(c1)Br 34a_100000754920_200012276598 [0,1,0,0,0,1|2,0,0]=4 13136 B16R1.52 CCCCCC(=O)COc1cncc(c1)Br 7a_100000754920_200012276598 [0,1,0,0,0,1|2,0,0]=4 13137 B16R1.52 CCCCCC(=O)COc1cncc(c1)C 34a_100011830280_200012276598 [0,1,0,0,0,1|2,0,0]=4 13138 B16R1.52 CCCCCC(=O)COc1cncc(c1)C 7a_100011830280_200012276598 [0,1,0,0,0,1|2,0,0]=4 13139 B16R1.52 CCCCCC(=O)COc1cncc(c1)Cl 7a_100000032511_200012276598 [0,1,0,0,0,1|2,0,0]=4 13140 B16R1.52 CCCCCC(=O)COc1cncc(c1)F 34a_100011830296_200012276598 [0,1,0,0,0,1|2,0,0]=4 13141 B16R1.52 CCCCCC(=O)COc1cncc(c1)F 7a_100011830296_200012276598 [0,1,0,0,0,1|2,0,0]=4 13142 B16R1.52 CCCCCC(=O)COc1cncc(c1)N 34a_100011997051_200012276598 [0,1,0,0,0,1|2,0,0]=4 13143 B16R1.52 CCCCCC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_200012276598 [0,1,0,0,0,1|2,0,0]=4 13144 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)C 62a_100000750283_200012276598 [0,1,0,0,0,1|2,0,0]=4 13145 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)C 62a_200012276598_100000750283 [0,1,0,0,0,1|2,0,0]=4 13146 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)Cl 62a_100010167805_200012276598 [0,1,0,0,0,1|2,0,0]=4 13147 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)Cl 62a_200012276598_100010167805 [0,1,0,0,0,1|2,0,0]=4 13148 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)F 62a_100000764206_200012276598 [0,1,0,0,0,1|2,0,0]=4 13149 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)F 62a_200012276598_100000764206 [0,1,0,0,0,1|2,0,0]=4 13150 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)N 62a_100009814236_200012276598 [0,1,0,0,0,1|2,0,0]=4 13151 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)N 62a_200012276598_100009814236 [0,1,0,0,0,1|2,0,0]=4 13152 B16R1.52 CCCCCC(=O)CSc1cc(ccn1)O 62a_200012276598_100000762945 [0,1,0,0,0,1|2,0,0]=4 13153 B16R1.52 CCCCCC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_200012276598 [0,1,0,0,0,1|2,0,0]=4 13154 B16R1.52 CCCCCC(=O)CSc1cc[nH]c(=O)c1 62a_200012276598_100009816521 [0,1,0,0,0,1|2,0,0]=4 13155 B16R1.52 CCCCCC(=O)CSc1ccc[n+](c1)C 62a_100009996589_200012276598 [0,1,0,0,0,1|2,0,0]=4 13156 B16R1.52 CCCCCC(=O)CSc1ccc[n+](c1)C 62a_200012276598_100009996589 [0,1,0,0,0,1|2,0,0]=4 13157 B16R1.52 CCCCCC(=O)CSc1ccc[n+](c1)[O-] 62a_200012276598_100009815978 [0,1,0,0,0,1|2,0,0]=4 13158 B16R1.52 CCCCCC(=O)CSc1cccc(=O)[nH]1 62a_200012276598_100000752884 [0,1,0,0,0,1|2,0,0]=4 13159 B16R1.52 CCCCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000210326 [0,1,0,0,0,1|1,0,0]=3 13160 B16R1.52 CCCCCC(=O)CSc1cccc(c1)Br 62a_100000691529_200012276598 [0,1,0,0,0,1|1,0,0]=3 13161 B16R1.52 CCCCCC(=O)CSc1cccc(c1)Br 62a_200012276598_100000691529 [0,1,0,0,0,1|1,0,0]=3 13162 B16R1.52 CCCCCC(=O)CSc1cccc(c1)C 62a_100011215228_200012276598 [0,1,0,0,0,1|1,0,0]=3 13163 B16R1.52 CCCCCC(=O)CSc1cccc(c1)C 62a_200012276598_100011215228 [0,1,0,0,0,1|1,0,0]=3 13164 B16R1.52 CCCCCC(=O)CSc1cccc(c1)Cl 62a_100000699651_200012276598 [0,1,0,0,0,1|1,0,0]=3 13165 B16R1.52 CCCCCC(=O)CSc1cccc(c1)Cl 62a_200012276598_100000699651 [0,1,0,0,0,1|1,0,0]=3 13166 B16R1.52 CCCCCC(=O)CSc1cccc(c1)F 62a_100000685547_200012276598 [0,1,0,0,0,1|1,0,0]=3 13167 B16R1.52 CCCCCC(=O)CSc1cccc(c1)F 62a_200012276598_100000685547 [0,1,0,0,0,1|1,0,0]=3 13168 B16R1.52 CCCCCC(=O)CSc1cccc(c1)N 62a_100000210019_200012276598 [0,1,0,0,0,1|1,0,0]=3 13169 B16R1.52 CCCCCC(=O)CSc1cccc(c1)N 62a_200012276598_100000210019 [0,1,0,0,0,1|1,0,0]=3 13170 B16R1.52 CCCCCC(=O)CSc1cccc(c1)O 62a_200012276598_100000211634 [0,1,0,0,0,1|1,0,0]=3 13171 B16R1.52 CCCCCC(=O)CSc1cccc(c1)[S] 62a_114929384022_200012276598 [0,1,0,0,0,1|1,0,0]=3 13172 B16R1.52 CCCCCC(=O)CSc1cccc(c1)[S] 62a_200012276598_114929384022 [0,1,0,0,0,1|1,0,0]=3 13173 B16R1.52 CCCCCC(=O)CSc1cccc(n1)Br 62a_100000684672_200012276598 [0,1,0,0,0,1|2,0,0]=4 13174 B16R1.52 CCCCCC(=O)CSc1cccc(n1)Br 62a_200012276598_100000684672 [0,1,0,0,0,1|2,0,0]=4 13175 B16R1.52 CCCCCC(=O)CSc1cccc(n1)C 62a_100000742759_200012276598 [0,1,0,0,0,1|2,0,0]=4 13176 B16R1.52 CCCCCC(=O)CSc1cccc(n1)C 62a_200012276598_100000742759 [0,1,0,0,0,1|2,0,0]=4 13177 B16R1.52 CCCCCC(=O)CSc1cccc(n1)Cl 62a_100000051397_200012276598 [0,1,0,0,0,1|2,0,0]=4 13178 B16R1.52 CCCCCC(=O)CSc1cccc(n1)Cl 62a_200012276598_100000051397 [0,1,0,0,0,1|2,0,0]=4 13179 B16R1.52 CCCCCC(=O)CSc1cccc(n1)F 62a_100009815982_200012276598 [0,1,0,0,0,1|2,0,0]=4 13180 B16R1.52 CCCCCC(=O)CSc1cccc(n1)F 62a_200012276598_100009815982 [0,1,0,0,0,1|2,0,0]=4 13181 B16R1.52 CCCCCC(=O)CSc1cccc(n1)N 62a_100000740741_200012276598 [0,1,0,0,0,1|2,0,0]=4 13182 B16R1.52 CCCCCC(=O)CSc1cccc(n1)N 62a_200012276598_100000740741 [0,1,0,0,0,1|2,0,0]=4 13183 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)Br 62a_100009814637_200012276598 [0,1,0,0,0,1|2,0,0]=4 13184 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)Br 62a_200012276598_100009814637 [0,1,0,0,0,1|2,0,0]=4 13185 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)C 62a_100000758586_200012276598 [0,1,0,0,0,1|2,0,0]=4 13186 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)C 62a_200012276598_100000758586 [0,1,0,0,0,1|2,0,0]=4 13187 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)Cl 62a_100000035001_200012276598 [0,1,0,0,0,1|2,0,0]=4 13188 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)Cl 62a_200012276598_100000035001 [0,1,0,0,0,1|2,0,0]=4 13189 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)F 62a_100009816116_200012276598 [0,1,0,0,0,1|2,0,0]=4 13190 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)F 62a_200012276598_100009816116 [0,1,0,0,0,1|2,0,0]=4 13191 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)N 62a_100000049665_200012276598 [0,1,0,0,0,1|2,0,0]=4 13192 B16R1.52 CCCCCC(=O)CSc1ccnc(c1)N 62a_200012276598_100000049665 [0,1,0,0,0,1|2,0,0]=4 13193 B16R1.52 CCCCCC(=O)CSc1cncc(c1)Br 62a_100000728054_200012276598 [0,1,0,0,0,1|2,0,0]=4 13194 B16R1.52 CCCCCC(=O)CSc1cncc(c1)Br 62a_200012276598_100000728054 [0,1,0,0,0,1|2,0,0]=4 13195 B16R1.52 CCCCCC(=O)CSc1cncc(c1)C 62a_100000760492_200012276598 [0,1,0,0,0,1|2,0,0]=4 13196 B16R1.52 CCCCCC(=O)CSc1cncc(c1)C 62a_200012276598_100000760492 [0,1,0,0,0,1|2,0,0]=4 13197 B16R1.52 CCCCCC(=O)CSc1cncc(c1)Cl 62a_100000049639_200012276598 [0,1,0,0,0,1|2,0,0]=4 13198 B16R1.52 CCCCCC(=O)CSc1cncc(c1)Cl 62a_200012276598_100000049639 [0,1,0,0,0,1|2,0,0]=4 13199 B16R1.52 CCCCCC(=O)CSc1cncc(c1)F 62a_100000744099_200012276598 [0,1,0,0,0,1|2,0,0]=4 13200 B16R1.52 CCCCCC(=O)CSc1cncc(c1)F 62a_200012276598_100000744099 [0,1,0,0,0,1|2,0,0]=4 13201 B16R1.52 CCCCCC(=O)CSc1cncc(c1)N 62a_100000687067_200012276598 [0,1,0,0,0,1|2,0,0]=4 13202 B16R1.52 CCCCCC(=O)CSc1cncc(c1)N 62a_200012276598_100000687067 [0,1,0,0,0,1|2,0,0]=4 13203 B16R1.52 CCCCCC(=O)CSc1cncc(c1)O 62a_100000754920_200012276598 [0,1,0,0,0,1|2,0,0]=4 13204 B16R1.52 CCCCCC(=O)CSc1cncc(c1)O 62a_200012276598_100000754920 [0,1,0,0,0,1|2,0,0]=4 13205 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Br 11a_100009818019_100000212188 [0,1,0,0,0,1|2,0,0]=4 13206 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Br 1626a_100009818019_100000212188 [0,1,0,0,0,1|2,0,0]=4 13207 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Br 240690a_100009818019_100000212188 [0,1,0,0,0,1|2,0,0]=4 13208 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Br 527a_100009818019_100000212188 [0,1,0,0,0,1|2,0,0]=4 13209 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)C 11a_100011934573_100000212188 [0,1,0,0,0,1|2,0,0]=4 13210 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)C 1626a_100011934573_100000212188 [0,1,0,0,0,1|2,0,0]=4 13211 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)C 240690a_100011934573_100000212188 [0,1,0,0,0,1|2,0,0]=4 13212 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)C 527a_100011934573_100000212188 [0,1,0,0,0,1|2,0,0]=4 13213 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Cl 11a_100000085674_100000212188 [0,1,0,0,0,1|2,0,0]=4 13214 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Cl 1626a_100000085674_100000212188 [0,1,0,0,0,1|2,0,0]=4 13215 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Cl 240690a_100000085674_100000212188 [0,1,0,0,0,1|2,0,0]=4 13216 B16R1.52 CCCCCC(=O)NCc1cc(ccn1)Cl 527a_100000085674_100000212188 [0,1,0,0,0,1|2,0,0]=4 13217 B16R1.52 CCCCCC(=O)NCc1cccc(=O)[nH]1 11a_100000696482_100000212188 [0,1,0,0,0,1|2,0,0]=4 13218 B16R1.52 CCCCCC(=O)NCc1cccc(=O)[nH]1 1626a_100000696482_100000212188 [0,1,0,0,0,1|2,0,0]=4 13219 B16R1.52 CCCCCC(=O)NCc1cccc(=O)[nH]1 240690a_100000696482_100000212188 [0,1,0,0,0,1|2,0,0]=4 13220 B16R1.52 CCCCCC(=O)NCc1cccc(=O)[nH]1 527a_100000696482_100000212188 [0,1,0,0,0,1|2,0,0]=4 13221 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000212188 [0,1,0,0,0,1|1,0,0]=3 13222 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000212188 [0,1,0,0,0,1|1,0,0]=3 13223 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000212188 [0,1,0,0,0,1|1,0,0]=3 13224 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000212188 [0,1,0,0,0,1|1,0,0]=3 13225 B16R1.52 CCCCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000212188 [0,1,0,0,0,1|1,0,0]=3 13226 B16R1.52 CCCCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000212188 [0,1,0,0,0,1|1,0,0]=3 13227 B16R1.52 CCCCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000212188 [0,1,0,0,0,1|1,0,0]=3 13228 B16R1.52 CCCCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000212188 [0,1,0,0,0,1|1,0,0]=3 13229 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000212188 [0,1,0,0,0,1|1,0,0]=3 13230 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000212188 [0,1,0,0,0,1|1,0,0]=3 13231 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000212188 [0,1,0,0,0,1|1,0,0]=3 13232 B16R1.52 CCCCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000212188 [0,1,0,0,0,1|1,0,0]=3 13233 B16R1.52 CCCCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000212188 [0,1,0,0,0,1|1,0,0]=3 13234 B16R1.52 CCCCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000212188 [0,1,0,0,0,1|1,0,0]=3 13235 B16R1.52 CCCCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000212188 [0,1,0,0,0,1|1,0,0]=3 13236 B16R1.52 CCCCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000212188 [0,1,0,0,0,1|1,0,0]=3 13237 B16R1.52 CCCCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000212188 [0,1,0,0,0,1|1,0,0]=3 13238 B16R1.52 CCCCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000212188 [0,1,0,0,0,1|1,0,0]=3 13239 B16R1.52 CCCCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000212188 [0,1,0,0,0,1|1,0,0]=3 13240 B16R1.52 CCCCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000212188 [0,1,0,0,0,1|1,0,0]=3 13241 B16R1.52 CCCCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000212188 [0,1,0,0,0,1|1,0,0]=3 13242 B16R1.52 CCCCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000212188 [0,1,0,0,0,1|1,0,0]=3 13243 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Br 11a_100016987751_100000212188 [0,1,0,0,0,1|2,0,0]=4 13244 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Br 1626a_100016987751_100000212188 [0,1,0,0,0,1|2,0,0]=4 13245 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Br 240690a_100016987751_100000212188 [0,1,0,0,0,1|2,0,0]=4 13246 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Br 527a_100016987751_100000212188 [0,1,0,0,0,1|2,0,0]=4 13247 B16R1.52 CCCCCC(=O)NCc1cccc(n1)C 11a_100000701342_100000212188 [0,1,0,0,0,1|2,0,0]=4 13248 B16R1.52 CCCCCC(=O)NCc1cccc(n1)C 1626a_100000701342_100000212188 [0,1,0,0,0,1|2,0,0]=4 13249 B16R1.52 CCCCCC(=O)NCc1cccc(n1)C 240690a_100000701342_100000212188 [0,1,0,0,0,1|2,0,0]=4 13250 B16R1.52 CCCCCC(=O)NCc1cccc(n1)C 527a_100000701342_100000212188 [0,1,0,0,0,1|2,0,0]=4 13251 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Cl 11a_100016990191_100000212188 [0,1,0,0,0,1|2,0,0]=4 13252 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Cl 1626a_100016990191_100000212188 [0,1,0,0,0,1|2,0,0]=4 13253 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Cl 240690a_100016990191_100000212188 [0,1,0,0,0,1|2,0,0]=4 13254 B16R1.52 CCCCCC(=O)NCc1cccc(n1)Cl 527a_100016990191_100000212188 [0,1,0,0,0,1|2,0,0]=4 13255 B16R1.52 CCCCCC(=O)NCc1cccc(n1)F 11a_100015188798_100000212188 [0,1,0,0,0,1|2,0,0]=4 13256 B16R1.52 CCCCCC(=O)NCc1cccc(n1)F 1626a_100015188798_100000212188 [0,1,0,0,0,1|2,0,0]=4 13257 B16R1.52 CCCCCC(=O)NCc1cccc(n1)F 240690a_100015188798_100000212188 [0,1,0,0,0,1|2,0,0]=4 13258 B16R1.52 CCCCCC(=O)NCc1cccc(n1)F 527a_100015188798_100000212188 [0,1,0,0,0,1|2,0,0]=4 13259 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Br 11a_100025757509_100000212188 [0,1,0,0,0,1|2,0,0]=4 13260 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Br 240690a_100025757509_100000212188 [0,1,0,0,0,1|2,0,0]=4 13261 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Br 527a_100025757509_100000212188 [0,1,0,0,0,1|2,0,0]=4 13262 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)C 11a_100011934566_100000212188 [0,1,0,0,0,1|2,0,0]=4 13263 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)C 1626a_100011934566_100000212188 [0,1,0,0,0,1|2,0,0]=4 13264 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)C 240690a_100011934566_100000212188 [0,1,0,0,0,1|2,0,0]=4 13265 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)C 527a_100011934566_100000212188 [0,1,0,0,0,1|2,0,0]=4 13266 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Cl 11a_100015205668_100000212188 [0,1,0,0,0,1|2,0,0]=4 13267 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Cl 1626a_100015205668_100000212188 [0,1,0,0,0,1|2,0,0]=4 13268 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Cl 240690a_100015205668_100000212188 [0,1,0,0,0,1|2,0,0]=4 13269 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)Cl 527a_100015205668_100000212188 [0,1,0,0,0,1|2,0,0]=4 13270 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)F 11a_100015188774_100000212188 [0,1,0,0,0,1|2,0,0]=4 13271 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)F 1626a_100015188774_100000212188 [0,1,0,0,0,1|2,0,0]=4 13272 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)F 240690a_100015188774_100000212188 [0,1,0,0,0,1|2,0,0]=4 13273 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)F 527a_100015188774_100000212188 [0,1,0,0,0,1|2,0,0]=4 13274 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)O 11a_100000748557_100000212188 [0,1,0,0,0,1|2,0,0]=4 13275 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)O 240690a_100000748557_100000212188 [0,1,0,0,0,1|2,0,0]=4 13276 B16R1.52 CCCCCC(=O)NCc1ccnc(c1)O 527a_100000748557_100000212188 [0,1,0,0,0,1|2,0,0]=4 13277 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Br 11a_100011249555_100000212188 [0,1,0,0,0,1|2,0,0]=4 13278 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Br 240690a_100011249555_100000212188 [0,1,0,0,0,1|2,0,0]=4 13279 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Br 527a_100011249555_100000212188 [0,1,0,0,0,1|2,0,0]=4 13280 B16R1.52 CCCCCC(=O)NCc1cncc(c1)C 11a_100000692839_100000212188 [0,1,0,0,0,1|2,0,0]=4 13281 B16R1.52 CCCCCC(=O)NCc1cncc(c1)C 1626a_100000692839_100000212188 [0,1,0,0,0,1|2,0,0]=4 13282 B16R1.52 CCCCCC(=O)NCc1cncc(c1)C 240690a_100000692839_100000212188 [0,1,0,0,0,1|2,0,0]=4 13283 B16R1.52 CCCCCC(=O)NCc1cncc(c1)C 527a_100000692839_100000212188 [0,1,0,0,0,1|2,0,0]=4 13284 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Cl 11a_200020614424_100000212188 [0,1,0,0,0,1|2,0,0]=4 13285 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Cl 1626a_200020614424_100000212188 [0,1,0,0,0,1|2,0,0]=4 13286 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Cl 240690a_200020614424_100000212188 [0,1,0,0,0,1|2,0,0]=4 13287 B16R1.52 CCCCCC(=O)NCc1cncc(c1)Cl 527a_200020614424_100000212188 [0,1,0,0,0,1|2,0,0]=4 13288 B16R1.52 CCCCCC(=O)NCc1cncc(c1)F 11a_100011962886_100000212188 [0,1,0,0,0,1|2,0,0]=4 13289 B16R1.52 CCCCCC(=O)NCc1cncc(c1)F 1626a_100011962886_100000212188 [0,1,0,0,0,1|2,0,0]=4 13290 B16R1.52 CCCCCC(=O)NCc1cncc(c1)F 240690a_100011962886_100000212188 [0,1,0,0,0,1|2,0,0]=4 13291 B16R1.52 CCCCCC(=O)NCc1cncc(c1)F 527a_100011962886_100000212188 [0,1,0,0,0,1|2,0,0]=4 13292 B16R1.52 CCCCCC(=O)NNc1cccc(c1)Br 22a_100000217339_100000212188 [0,1,0,0,0,1|2,0,0]=4 13293 B16R1.52 CCCCCC(=O)NNc1cccc(c1)C 22a_100000681630_100000212188 [0,1,0,0,0,1|2,0,0]=4 13294 B16R1.52 CCCCCC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000212188 [0,1,0,0,0,1|2,0,0]=4 13295 B16R1.52 CCCCCC(=O)NNc1cccc(c1)F 22a_100000745080_100000212188 [0,1,0,0,0,1|2,0,0]=4 13296 B16R1.52 CCCCCC(=O)NNc1cccc(c1)I 22a_100020605690_100000212188 [0,1,0,0,0,1|2,0,0]=4 13297 B16R1.52 CCCCNC(=O)C#Cc1cccc(c1)C 240690a_100000102301_100011892726 [0,1,0,0,0,1|1,0,1]=4 13298 B16R1.52 CCCCNC(=O)C#Cc1cccc(c1)Cl 240690a_100000102301_100011892777 [0,1,0,0,0,1|1,0,1]=4 13299 B16R1.52 CCCCNC(=O)C#Cc1cccc(c1)F 240690a_100000102301_100011892744 [0,1,0,0,0,1|1,0,1]=4 13300 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Br 11a_100000102301_100016258244 [0,1,0,0,0,1|1,0,1]=4 13301 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Br 1626a_100000102301_100016258244 [0,1,0,0,0,1|1,0,1]=4 13302 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Br 240690a_100000102301_100016258244 [0,1,0,0,0,1|1,0,1]=4 13303 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)C 11a_100000102301_100000690095 [0,1,0,0,0,1|1,0,1]=4 13304 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)C 1626a_100000102301_100000690095 [0,1,0,0,0,1|1,0,1]=4 13305 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)C 240690a_100000102301_100000690095 [0,1,0,0,0,1|1,0,1]=4 13306 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Cl 11a_100000102301_100000184502 [0,1,0,0,0,1|1,0,1]=4 13307 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Cl 1626a_100000102301_100000184502 [0,1,0,0,0,1|1,0,1]=4 13308 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)Cl 240690a_100000102301_100000184502 [0,1,0,0,0,1|1,0,1]=4 13309 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)F 11a_100000102301_100000718793 [0,1,0,0,0,1|1,0,1]=4 13310 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)F 1626a_100000102301_100000718793 [0,1,0,0,0,1|1,0,1]=4 13311 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)F 240690a_100000102301_100000718793 [0,1,0,0,0,1|1,0,1]=4 13312 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)I 11a_100000102301_100020647043 [0,1,0,0,0,1|1,0,1]=4 13313 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)I 1626a_100000102301_100020647043 [0,1,0,0,0,1|1,0,1]=4 13314 B16R1.52 CCCCNC(=O)C=Cc1cccc(c1)I 240690a_100000102301_100020647043 [0,1,0,0,0,1|1,0,1]=4 13315 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br 11a_100000102301_100000184314 [0,1,0,0,0,1|1,0,0]=3 13316 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br 1626a_100000102301_100000184314 [0,1,0,0,0,1|1,0,0]=3 13317 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br 240690a_100000102301_100000184314 [0,1,0,0,0,1|1,0,0]=3 13318 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Br 527a_100000102301_100000184314 [0,1,0,0,0,1|1,0,0]=3 13319 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C 11a_100000102301_100000234952 [0,1,0,0,0,1|1,0,0]=3 13320 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C 1626a_100000102301_100000234952 [0,1,0,0,0,1|1,0,0]=3 13321 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C 240690a_100000102301_100000234952 [0,1,0,0,0,1|1,0,0]=3 13322 B16R1.52 CCCCNC(=O)CCc1cccc(c1)C 527a_100000102301_100000234952 [0,1,0,0,0,1|1,0,0]=3 13323 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Cl 11a_100000102301_100000235675 [0,1,0,0,0,1|1,0,0]=3 13324 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Cl 1626a_100000102301_100000235675 [0,1,0,0,0,1|1,0,0]=3 13325 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Cl 240690a_100000102301_100000235675 [0,1,0,0,0,1|1,0,0]=3 13326 B16R1.52 CCCCNC(=O)CCc1cccc(c1)Cl 527a_100000102301_100000235675 [0,1,0,0,0,1|1,0,0]=3 13327 B16R1.52 CCCCNC(=O)CCc1cccc(c1)F 11a_100000102301_100000235673 [0,1,0,0,0,1|1,0,0]=3 13328 B16R1.52 CCCCNC(=O)CCc1cccc(c1)F 1626a_100000102301_100000235673 [0,1,0,0,0,1|1,0,0]=3 13329 B16R1.52 CCCCNC(=O)CCc1cccc(c1)F 240690a_100000102301_100000235673 [0,1,0,0,0,1|1,0,0]=3 13330 B16R1.52 CCCCNC(=O)CCc1cccc(c1)F 527a_100000102301_100000235673 [0,1,0,0,0,1|1,0,0]=3 13331 B16R1.52 CCCCNC(=O)CCc1cccc(c1)I 11a_100000102301_100010007846 [0,1,0,0,0,1|1,0,0]=3 13332 B16R1.52 CCCCNC(=O)CCc1cccc(c1)I 1626a_100000102301_100010007846 [0,1,0,0,0,1|1,0,0]=3 13333 B16R1.52 CCCCNC(=O)CCc1cccc(c1)I 240690a_100000102301_100010007846 [0,1,0,0,0,1|1,0,0]=3 13334 B16R1.52 CCCCNC(=O)CCc1cccc(c1)I 527a_100000102301_100010007846 [0,1,0,0,0,1|1,0,0]=3 13335 B16R1.52 CCCCNC(=O)CCc1cccc(c1)O 240690a_100000102301_100011216126 [0,1,0,0,0,1|1,0,0]=3 13336 B16R1.52 CCCCNC(=O)CCc1cccc(c1)O 527a_100000102301_100011216126 [0,1,0,0,0,1|1,0,0]=3 13337 B16R1.52 CCCCNC(=O)CNc1cccc(c1)Br 34a_100000210019_100000182744 [0,1,0,0,0,1|1,0,0]=3 13338 B16R1.52 CCCCNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000182744 [0,1,0,0,0,1|1,0,0]=3 13339 B16R1.52 CCCCNC(=O)CNc1cccc(c1)C 34a_100000188690_100000182744 [0,1,0,0,0,1|1,0,0]=3 13340 B16R1.52 CCCCNC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000182744 [0,1,0,0,0,1|1,0,0]=3 13341 B16R1.52 CCCCNC(=O)CNc1cccc(c1)F 34a_100000210047_100000182744 [0,1,0,0,0,1|1,0,0]=3 13342 B16R1.52 CCCCNC(=O)CNc1cccc(c1)I 34a_100000211102_100000182744 [0,1,0,0,0,1|1,0,0]=3 13343 B16R1.52 CCCCNC(=O)CNc1cccc(c1)O 34a_100000210217_100000182744 [0,1,0,0,0,1|1,0,0]=3 13344 B16R1.52 CCCCNC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000182744 [0,1,0,0,0,1|2,0,0]=4 13345 B16R1.52 CCCCNC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000182744 [0,1,0,0,0,1|2,0,0]=4 13346 B16R1.52 CCCCNC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000182744 [0,1,0,0,0,1|2,0,0]=4 13347 B16R1.52 CCCCNC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000182744 [0,1,0,0,0,1|2,0,0]=4 13348 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 11a_100000102301_100000182359 [0,1,0,0,0,1|1,0,0]=3 13349 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 1626a_100000102301_100000182359 [0,1,0,0,0,1|1,0,0]=3 13350 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 240690a_100000102301_100000182359 [0,1,0,0,0,1|1,0,0]=3 13351 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 34a_100000210342_100000182744 [0,1,0,0,0,1|1,0,0]=3 13352 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 527a_100000102301_100000182359 [0,1,0,0,0,1|1,0,0]=3 13353 B16R1.52 CCCCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000182744 [0,1,0,0,0,1|1,0,0]=3 13354 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 11a_100000102301_100000183606 [0,1,0,0,0,1|1,0,0]=3 13355 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 1626a_100000102301_100000183606 [0,1,0,0,0,1|1,0,0]=3 13356 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 240690a_100000102301_100000183606 [0,1,0,0,0,1|1,0,0]=3 13357 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 34a_100000210337_100000182744 [0,1,0,0,0,1|1,0,0]=3 13358 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 527a_100000102301_100000183606 [0,1,0,0,0,1|1,0,0]=3 13359 B16R1.52 CCCCNC(=O)COc1cccc(c1)C 7a_100000210337_100000182744 [0,1,0,0,0,1|1,0,0]=3 13360 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 11a_100000102301_100000184978 [0,1,0,0,0,1|1,0,0]=3 13361 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 1626a_100000102301_100000184978 [0,1,0,0,0,1|1,0,0]=3 13362 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 240690a_100000102301_100000184978 [0,1,0,0,0,1|1,0,0]=3 13363 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000182744 [0,1,0,0,0,1|1,0,0]=3 13364 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 527a_100000102301_100000184978 [0,1,0,0,0,1|1,0,0]=3 13365 B16R1.52 CCCCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000182744 [0,1,0,0,0,1|1,0,0]=3 13366 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 11a_100000102301_100000182781 [0,1,0,0,0,1|1,0,0]=3 13367 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 1626a_100000102301_100000182781 [0,1,0,0,0,1|1,0,0]=3 13368 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 240690a_100000102301_100000182781 [0,1,0,0,0,1|1,0,0]=3 13369 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 34a_100000210426_100000182744 [0,1,0,0,0,1|1,0,0]=3 13370 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 527a_100000102301_100000182781 [0,1,0,0,0,1|1,0,0]=3 13371 B16R1.52 CCCCNC(=O)COc1cccc(c1)F 7a_100000210426_100000182744 [0,1,0,0,0,1|1,0,0]=3 13372 B16R1.52 CCCCNC(=O)COc1cccc(c1)I 34a_100000211634_100000182744 [0,1,0,0,0,1|1,0,0]=3 13373 B16R1.52 CCCCNC(=O)COc1cccc(c1)I 7a_100000211634_100000182744 [0,1,0,0,0,1|1,0,0]=3 13374 B16R1.52 CCCCNC(=O)COc1cccc(c1)N 34a_100000210217_100000182744 [0,1,0,0,0,1|1,0,0]=3 13375 B16R1.52 CCCCNC(=O)COc1cccc(n1)F 34a_100011432558_100000182744 [0,1,0,0,0,1|2,0,0]=4 13376 B16R1.52 CCCCNC(=O)COc1ccnc(c1)C 34a_100000688365_100000182744 [0,1,0,0,0,1|2,0,0]=4 13377 B16R1.52 CCCCNC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000182744 [0,1,0,0,0,1|2,0,0]=4 13378 B16R1.52 CCCCNC(=O)COc1ccnc(c1)F 34a_100000732698_100000182744 [0,1,0,0,0,1|2,0,0]=4 13379 B16R1.52 CCCCNC(=O)COc1ccnc(c1)N 34a_100011834064_100000182744 [0,1,0,0,0,1|2,0,0]=4 13380 B16R1.52 CCCCNC(=O)COc1cncc(c1)Br 34a_100000754920_100000182744 [0,1,0,0,0,1|2,0,0]=4 13381 B16R1.52 CCCCNC(=O)COc1cncc(c1)Br 7a_100000754920_100000182744 [0,1,0,0,0,1|2,0,0]=4 13382 B16R1.52 CCCCNC(=O)COc1cncc(c1)C 34a_100011830280_100000182744 [0,1,0,0,0,1|2,0,0]=4 13383 B16R1.52 CCCCNC(=O)COc1cncc(c1)C 7a_100011830280_100000182744 [0,1,0,0,0,1|2,0,0]=4 13384 B16R1.52 CCCCNC(=O)COc1cncc(c1)Cl 7a_100000032511_100000182744 [0,1,0,0,0,1|2,0,0]=4 13385 B16R1.52 CCCCNC(=O)COc1cncc(c1)F 34a_100011830296_100000182744 [0,1,0,0,0,1|2,0,0]=4 13386 B16R1.52 CCCCNC(=O)COc1cncc(c1)F 7a_100011830296_100000182744 [0,1,0,0,0,1|2,0,0]=4 13387 B16R1.52 CCCCNC(=O)COc1cncc(c1)N 34a_100011997051_100000182744 [0,1,0,0,0,1|2,0,0]=4 13388 B16R1.52 CCCCNC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000182744 [0,1,0,0,0,1|2,0,0]=4 13389 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)C 62a_100000182744_100000750283 [0,1,0,0,0,1|2,0,0]=4 13390 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)C 62a_100000750283_100000182744 [0,1,0,0,0,1|2,0,0]=4 13391 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)Cl 62a_100000182744_100010167805 [0,1,0,0,0,1|2,0,0]=4 13392 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000182744 [0,1,0,0,0,1|2,0,0]=4 13393 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)F 62a_100000182744_100000764206 [0,1,0,0,0,1|2,0,0]=4 13394 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)F 62a_100000764206_100000182744 [0,1,0,0,0,1|2,0,0]=4 13395 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)N 62a_100000182744_100009814236 [0,1,0,0,0,1|2,0,0]=4 13396 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)N 62a_100009814236_100000182744 [0,1,0,0,0,1|2,0,0]=4 13397 B16R1.52 CCCCNC(=O)CSc1cc(ccn1)O 62a_100000182744_100000762945 [0,1,0,0,0,1|2,0,0]=4 13398 B16R1.52 CCCCNC(=O)CSc1cc[nH]c(=O)c1 62a_100000182744_100009816521 [0,1,0,0,0,1|2,0,0]=4 13399 B16R1.52 CCCCNC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000182744 [0,1,0,0,0,1|2,0,0]=4 13400 B16R1.52 CCCCNC(=O)CSc1ccc[n+](c1)C 62a_100000182744_100009996589 [0,1,0,0,0,1|2,0,0]=4 13401 B16R1.52 CCCCNC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000182744 [0,1,0,0,0,1|2,0,0]=4 13402 B16R1.52 CCCCNC(=O)CSc1ccc[n+](c1)[O-] 62a_100000182744_100009815978 [0,1,0,0,0,1|2,0,0]=4 13403 B16R1.52 CCCCNC(=O)CSc1cccc(=O)[nH]1 62a_100000182744_100000752884 [0,1,0,0,0,1|2,0,0]=4 13404 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 11a_100000102301_100000760868 [0,1,0,0,0,1|1,0,0]=3 13405 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 1626a_100000102301_100000760868 [0,1,0,0,0,1|1,0,0]=3 13406 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 240690a_100000102301_100000760868 [0,1,0,0,0,1|1,0,0]=3 13407 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 527a_100000102301_100000760868 [0,1,0,0,0,1|1,0,0]=3 13408 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 62a_100000182744_100000691529 [0,1,0,0,0,1|1,0,0]=3 13409 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000182744 [0,1,0,0,0,1|1,0,0]=3 13410 B16R1.52 CCCCNC(=O)CSc1cccc(c1)C 62a_100000182744_100011215228 [0,1,0,0,0,1|1,0,0]=3 13411 B16R1.52 CCCCNC(=O)CSc1cccc(c1)C 62a_100011215228_100000182744 [0,1,0,0,0,1|1,0,0]=3 13412 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Cl 62a_100000182744_100000699651 [0,1,0,0,0,1|1,0,0]=3 13413 B16R1.52 CCCCNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000182744 [0,1,0,0,0,1|1,0,0]=3 13414 B16R1.52 CCCCNC(=O)CSc1cccc(c1)F 62a_100000182744_100000685547 [0,1,0,0,0,1|1,0,0]=3 13415 B16R1.52 CCCCNC(=O)CSc1cccc(c1)F 62a_100000685547_100000182744 [0,1,0,0,0,1|1,0,0]=3 13416 B16R1.52 CCCCNC(=O)CSc1cccc(c1)N 62a_100000182744_100000210019 [0,1,0,0,0,1|1,0,0]=3 13417 B16R1.52 CCCCNC(=O)CSc1cccc(c1)N 62a_100000210019_100000182744 [0,1,0,0,0,1|1,0,0]=3 13418 B16R1.52 CCCCNC(=O)CSc1cccc(c1)O 62a_100000182744_100000211634 [0,1,0,0,0,1|1,0,0]=3 13419 B16R1.52 CCCCNC(=O)CSc1cccc(c1)[S] 62a_100000182744_114929384022 [0,1,0,0,0,1|1,0,0]=3 13420 B16R1.52 CCCCNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000182744 [0,1,0,0,0,1|1,0,0]=3 13421 B16R1.52 CCCCNC(=O)CSc1cccc(n1)Br 62a_100000182744_100000684672 [0,1,0,0,0,1|2,0,0]=4 13422 B16R1.52 CCCCNC(=O)CSc1cccc(n1)Br 62a_100000684672_100000182744 [0,1,0,0,0,1|2,0,0]=4 13423 B16R1.52 CCCCNC(=O)CSc1cccc(n1)C 62a_100000182744_100000742759 [0,1,0,0,0,1|2,0,0]=4 13424 B16R1.52 CCCCNC(=O)CSc1cccc(n1)C 62a_100000742759_100000182744 [0,1,0,0,0,1|2,0,0]=4 13425 B16R1.52 CCCCNC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000182744 [0,1,0,0,0,1|2,0,0]=4 13426 B16R1.52 CCCCNC(=O)CSc1cccc(n1)Cl 62a_100000182744_100000051397 [0,1,0,0,0,1|2,0,0]=4 13427 B16R1.52 CCCCNC(=O)CSc1cccc(n1)F 62a_100000182744_100009815982 [0,1,0,0,0,1|2,0,0]=4 13428 B16R1.52 CCCCNC(=O)CSc1cccc(n1)F 62a_100009815982_100000182744 [0,1,0,0,0,1|2,0,0]=4 13429 B16R1.52 CCCCNC(=O)CSc1cccc(n1)N 62a_100000182744_100000740741 [0,1,0,0,0,1|2,0,0]=4 13430 B16R1.52 CCCCNC(=O)CSc1cccc(n1)N 62a_100000740741_100000182744 [0,1,0,0,0,1|2,0,0]=4 13431 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)Br 62a_100000182744_100009814637 [0,1,0,0,0,1|2,0,0]=4 13432 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000182744 [0,1,0,0,0,1|2,0,0]=4 13433 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)C 62a_100000182744_100000758586 [0,1,0,0,0,1|2,0,0]=4 13434 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)C 62a_100000758586_100000182744 [0,1,0,0,0,1|2,0,0]=4 13435 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000182744 [0,1,0,0,0,1|2,0,0]=4 13436 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)Cl 62a_100000182744_100000035001 [0,1,0,0,0,1|2,0,0]=4 13437 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)F 62a_100000182744_100009816116 [0,1,0,0,0,1|2,0,0]=4 13438 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)F 62a_100009816116_100000182744 [0,1,0,0,0,1|2,0,0]=4 13439 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)N 62a_100000049665_100000182744 [0,1,0,0,0,1|2,0,0]=4 13440 B16R1.52 CCCCNC(=O)CSc1ccnc(c1)N 62a_100000182744_100000049665 [0,1,0,0,0,1|2,0,0]=4 13441 B16R1.52 CCCCNC(=O)CSc1cncc(c1)Br 62a_100000182744_100000728054 [0,1,0,0,0,1|2,0,0]=4 13442 B16R1.52 CCCCNC(=O)CSc1cncc(c1)Br 62a_100000728054_100000182744 [0,1,0,0,0,1|2,0,0]=4 13443 B16R1.52 CCCCNC(=O)CSc1cncc(c1)C 62a_100000182744_100000760492 [0,1,0,0,0,1|2,0,0]=4 13444 B16R1.52 CCCCNC(=O)CSc1cncc(c1)C 62a_100000760492_100000182744 [0,1,0,0,0,1|2,0,0]=4 13445 B16R1.52 CCCCNC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000182744 [0,1,0,0,0,1|2,0,0]=4 13446 B16R1.52 CCCCNC(=O)CSc1cncc(c1)Cl 62a_100000182744_100000049639 [0,1,0,0,0,1|2,0,0]=4 13447 B16R1.52 CCCCNC(=O)CSc1cncc(c1)F 62a_100000182744_100000744099 [0,1,0,0,0,1|2,0,0]=4 13448 B16R1.52 CCCCNC(=O)CSc1cncc(c1)F 62a_100000744099_100000182744 [0,1,0,0,0,1|2,0,0]=4 13449 B16R1.52 CCCCNC(=O)CSc1cncc(c1)N 62a_100000182744_100000687067 [0,1,0,0,0,1|2,0,0]=4 13450 B16R1.52 CCCCNC(=O)CSc1cncc(c1)N 62a_100000687067_100000182744 [0,1,0,0,0,1|2,0,0]=4 13451 B16R1.52 CCCCNC(=O)CSc1cncc(c1)O 62a_100000182744_100000754920 [0,1,0,0,0,1|2,0,0]=4 13452 B16R1.52 CCCCNC(=O)CSc1cncc(c1)O 62a_100000754920_100000182744 [0,1,0,0,0,1|2,0,0]=4 13453 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 2708a_100000102301_100009818019 [0,1,0,0,0,1|2,0,0]=4 13454 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 2708a_100009818019_100000102301 [0,1,0,0,0,1|2,0,0]=4 13455 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 273464a_100000102301_100009818019 [0,1,0,0,0,1|2,0,0]=4 13456 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 273464a_100009818019_100000102301 [0,1,0,0,0,1|2,0,0]=4 13457 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 512a_100000102301_100009818019 [0,1,0,0,0,1|2,0,0]=4 13458 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Br 512a_100009818019_100000102301 [0,1,0,0,0,1|2,0,0]=4 13459 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 2708a_100000102301_100011934573 [0,1,0,0,0,1|2,0,0]=4 13460 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 2708a_100011934573_100000102301 [0,1,0,0,0,1|2,0,0]=4 13461 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 273464a_100000102301_100011934573 [0,1,0,0,0,1|2,0,0]=4 13462 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 273464a_100011934573_100000102301 [0,1,0,0,0,1|2,0,0]=4 13463 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 512a_100000102301_100011934573 [0,1,0,0,0,1|2,0,0]=4 13464 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)C 512a_100011934573_100000102301 [0,1,0,0,0,1|2,0,0]=4 13465 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Cl 2708a_100000102301_100000085674 [0,1,0,0,0,1|2,0,0]=4 13466 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Cl 273464a_100000102301_100000085674 [0,1,0,0,0,1|2,0,0]=4 13467 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Cl 512a_100000085674_100000102301 [0,1,0,0,0,1|2,0,0]=4 13468 B16R1.52 CCCCNC(=O)NCc1cc(ccn1)Cl 512a_100000102301_100000085674 [0,1,0,0,0,1|2,0,0]=4 13469 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 2708a_100000102301_100000696482 [0,1,0,0,0,1|2,0,0]=4 13470 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 2708a_100000696482_100000102301 [0,1,0,0,0,1|2,0,0]=4 13471 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 273464a_100000102301_100000696482 [0,1,0,0,0,1|2,0,0]=4 13472 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 273464a_100000696482_100000102301 [0,1,0,0,0,1|2,0,0]=4 13473 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 512a_100000102301_100000696482 [0,1,0,0,0,1|2,0,0]=4 13474 B16R1.52 CCCCNC(=O)NCc1cccc(=O)[nH]1 512a_100000696482_100000102301 [0,1,0,0,0,1|2,0,0]=4 13475 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 2708a_100000102301_100000174977 [0,1,0,0,0,1|1,0,0]=3 13476 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 2708a_100000174977_100000102301 [0,1,0,0,0,1|1,0,0]=3 13477 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 273464a_100000102301_100000174977 [0,1,0,0,0,1|1,0,0]=3 13478 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100000102301 [0,1,0,0,0,1|1,0,0]=3 13479 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 512a_100000102301_100000174977 [0,1,0,0,0,1|1,0,0]=3 13480 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Br 512a_100000174977_100000102301 [0,1,0,0,0,1|1,0,0]=3 13481 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 2708a_100000102301_100000185548 [0,1,0,0,0,1|1,0,0]=3 13482 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 2708a_100000185548_100000102301 [0,1,0,0,0,1|1,0,0]=3 13483 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 273464a_100000102301_100000185548 [0,1,0,0,0,1|1,0,0]=3 13484 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 273464a_100000185548_100000102301 [0,1,0,0,0,1|1,0,0]=3 13485 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 512a_100000102301_100000185548 [0,1,0,0,0,1|1,0,0]=3 13486 B16R1.52 CCCCNC(=O)NCc1cccc(c1)C 512a_100000185548_100000102301 [0,1,0,0,0,1|1,0,0]=3 13487 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 2708a_100000102301_100000174878 [0,1,0,0,0,1|1,0,0]=3 13488 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_100000102301 [0,1,0,0,0,1|1,0,0]=3 13489 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 273464a_100000102301_100000174878 [0,1,0,0,0,1|1,0,0]=3 13490 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100000102301 [0,1,0,0,0,1|1,0,0]=3 13491 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 512a_100000102301_100000174878 [0,1,0,0,0,1|1,0,0]=3 13492 B16R1.52 CCCCNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100000102301 [0,1,0,0,0,1|1,0,0]=3 13493 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 2708a_100000102301_100000174948 [0,1,0,0,0,1|1,0,0]=3 13494 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 2708a_100000174948_100000102301 [0,1,0,0,0,1|1,0,0]=3 13495 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 273464a_100000102301_100000174948 [0,1,0,0,0,1|1,0,0]=3 13496 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 273464a_100000174948_100000102301 [0,1,0,0,0,1|1,0,0]=3 13497 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 512a_100000102301_100000174948 [0,1,0,0,0,1|1,0,0]=3 13498 B16R1.52 CCCCNC(=O)NCc1cccc(c1)F 512a_100000174948_100000102301 [0,1,0,0,0,1|1,0,0]=3 13499 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 2708a_100000102301_100000106179 [0,1,0,0,0,1|1,0,0]=3 13500 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 2708a_100000106179_100000102301 [0,1,0,0,0,1|1,0,0]=3 13501 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 273464a_100000102301_100000106179 [0,1,0,0,0,1|1,0,0]=3 13502 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 273464a_100000106179_100000102301 [0,1,0,0,0,1|1,0,0]=3 13503 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 512a_100000102301_100000106179 [0,1,0,0,0,1|1,0,0]=3 13504 B16R1.52 CCCCNC(=O)NCc1cccc(c1)I 512a_100000106179_100000102301 [0,1,0,0,0,1|1,0,0]=3 13505 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 2708a_100000102301_100000743036 [0,1,0,0,0,1|1,0,0]=3 13506 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 2708a_100000743036_100000102301 [0,1,0,0,0,1|1,0,0]=3 13507 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 273464a_100000102301_100000743036 [0,1,0,0,0,1|1,0,0]=3 13508 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 273464a_100000743036_100000102301 [0,1,0,0,0,1|1,0,0]=3 13509 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 512a_100000102301_100000743036 [0,1,0,0,0,1|1,0,0]=3 13510 B16R1.52 CCCCNC(=O)NCc1cccc(c1)O 512a_100000743036_100000102301 [0,1,0,0,0,1|1,0,0]=3 13511 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 2708a_100000102301_100016987751 [0,1,0,0,0,1|2,0,0]=4 13512 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 2708a_100016987751_100000102301 [0,1,0,0,0,1|2,0,0]=4 13513 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 273464a_100000102301_100016987751 [0,1,0,0,0,1|2,0,0]=4 13514 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 273464a_100016987751_100000102301 [0,1,0,0,0,1|2,0,0]=4 13515 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 512a_100000102301_100016987751 [0,1,0,0,0,1|2,0,0]=4 13516 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Br 512a_100016987751_100000102301 [0,1,0,0,0,1|2,0,0]=4 13517 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 2708a_100000102301_100000701342 [0,1,0,0,0,1|2,0,0]=4 13518 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 2708a_100000701342_100000102301 [0,1,0,0,0,1|2,0,0]=4 13519 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 273464a_100000102301_100000701342 [0,1,0,0,0,1|2,0,0]=4 13520 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 273464a_100000701342_100000102301 [0,1,0,0,0,1|2,0,0]=4 13521 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 512a_100000102301_100000701342 [0,1,0,0,0,1|2,0,0]=4 13522 B16R1.52 CCCCNC(=O)NCc1cccc(n1)C 512a_100000701342_100000102301 [0,1,0,0,0,1|2,0,0]=4 13523 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 2708a_100000102301_100016990191 [0,1,0,0,0,1|2,0,0]=4 13524 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 2708a_100016990191_100000102301 [0,1,0,0,0,1|2,0,0]=4 13525 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 273464a_100000102301_100016990191 [0,1,0,0,0,1|2,0,0]=4 13526 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 273464a_100016990191_100000102301 [0,1,0,0,0,1|2,0,0]=4 13527 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 512a_100000102301_100016990191 [0,1,0,0,0,1|2,0,0]=4 13528 B16R1.52 CCCCNC(=O)NCc1cccc(n1)Cl 512a_100016990191_100000102301 [0,1,0,0,0,1|2,0,0]=4 13529 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 2708a_100000102301_100015188798 [0,1,0,0,0,1|2,0,0]=4 13530 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 2708a_100015188798_100000102301 [0,1,0,0,0,1|2,0,0]=4 13531 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 273464a_100000102301_100015188798 [0,1,0,0,0,1|2,0,0]=4 13532 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 273464a_100015188798_100000102301 [0,1,0,0,0,1|2,0,0]=4 13533 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 512a_100000102301_100015188798 [0,1,0,0,0,1|2,0,0]=4 13534 B16R1.52 CCCCNC(=O)NCc1cccc(n1)F 512a_100015188798_100000102301 [0,1,0,0,0,1|2,0,0]=4 13535 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 2708a_100000102301_100025757509 [0,1,0,0,0,1|2,0,0]=4 13536 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 2708a_100025757509_100000102301 [0,1,0,0,0,1|2,0,0]=4 13537 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 273464a_100000102301_100025757509 [0,1,0,0,0,1|2,0,0]=4 13538 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 273464a_100025757509_100000102301 [0,1,0,0,0,1|2,0,0]=4 13539 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 512a_100000102301_100025757509 [0,1,0,0,0,1|2,0,0]=4 13540 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Br 512a_100025757509_100000102301 [0,1,0,0,0,1|2,0,0]=4 13541 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 2708a_100000102301_100011934566 [0,1,0,0,0,1|2,0,0]=4 13542 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 2708a_100011934566_100000102301 [0,1,0,0,0,1|2,0,0]=4 13543 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 273464a_100000102301_100011934566 [0,1,0,0,0,1|2,0,0]=4 13544 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 273464a_100011934566_100000102301 [0,1,0,0,0,1|2,0,0]=4 13545 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 512a_100000102301_100011934566 [0,1,0,0,0,1|2,0,0]=4 13546 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)C 512a_100011934566_100000102301 [0,1,0,0,0,1|2,0,0]=4 13547 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 2708a_100000102301_100015205668 [0,1,0,0,0,1|2,0,0]=4 13548 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 2708a_100015205668_100000102301 [0,1,0,0,0,1|2,0,0]=4 13549 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 273464a_100000102301_100015205668 [0,1,0,0,0,1|2,0,0]=4 13550 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 273464a_100015205668_100000102301 [0,1,0,0,0,1|2,0,0]=4 13551 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 512a_100000102301_100015205668 [0,1,0,0,0,1|2,0,0]=4 13552 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)Cl 512a_100015205668_100000102301 [0,1,0,0,0,1|2,0,0]=4 13553 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 2708a_100000102301_100015188774 [0,1,0,0,0,1|2,0,0]=4 13554 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 2708a_100015188774_100000102301 [0,1,0,0,0,1|2,0,0]=4 13555 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 273464a_100000102301_100015188774 [0,1,0,0,0,1|2,0,0]=4 13556 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 273464a_100015188774_100000102301 [0,1,0,0,0,1|2,0,0]=4 13557 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 512a_100000102301_100015188774 [0,1,0,0,0,1|2,0,0]=4 13558 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)F 512a_100015188774_100000102301 [0,1,0,0,0,1|2,0,0]=4 13559 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 2708a_100000102301_100000748557 [0,1,0,0,0,1|2,0,0]=4 13560 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 2708a_100000748557_100000102301 [0,1,0,0,0,1|2,0,0]=4 13561 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 273464a_100000102301_100000748557 [0,1,0,0,0,1|2,0,0]=4 13562 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 273464a_100000748557_100000102301 [0,1,0,0,0,1|2,0,0]=4 13563 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 512a_100000102301_100000748557 [0,1,0,0,0,1|2,0,0]=4 13564 B16R1.52 CCCCNC(=O)NCc1ccnc(c1)O 512a_100000748557_100000102301 [0,1,0,0,0,1|2,0,0]=4 13565 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 2708a_100000102301_100011249555 [0,1,0,0,0,1|2,0,0]=4 13566 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 2708a_100011249555_100000102301 [0,1,0,0,0,1|2,0,0]=4 13567 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 273464a_100000102301_100011249555 [0,1,0,0,0,1|2,0,0]=4 13568 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 273464a_100011249555_100000102301 [0,1,0,0,0,1|2,0,0]=4 13569 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 512a_100000102301_100011249555 [0,1,0,0,0,1|2,0,0]=4 13570 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Br 512a_100011249555_100000102301 [0,1,0,0,0,1|2,0,0]=4 13571 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 2708a_100000102301_100000692839 [0,1,0,0,0,1|2,0,0]=4 13572 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 2708a_100000692839_100000102301 [0,1,0,0,0,1|2,0,0]=4 13573 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 273464a_100000102301_100000692839 [0,1,0,0,0,1|2,0,0]=4 13574 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 273464a_100000692839_100000102301 [0,1,0,0,0,1|2,0,0]=4 13575 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 512a_100000102301_100000692839 [0,1,0,0,0,1|2,0,0]=4 13576 B16R1.52 CCCCNC(=O)NCc1cncc(c1)C 512a_100000692839_100000102301 [0,1,0,0,0,1|2,0,0]=4 13577 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 2708a_100000102301_200020614424 [0,1,0,0,0,1|2,0,0]=4 13578 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 2708a_200020614424_100000102301 [0,1,0,0,0,1|2,0,0]=4 13579 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 273464a_100000102301_200020614424 [0,1,0,0,0,1|2,0,0]=4 13580 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 273464a_200020614424_100000102301 [0,1,0,0,0,1|2,0,0]=4 13581 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 512a_100000102301_200020614424 [0,1,0,0,0,1|2,0,0]=4 13582 B16R1.52 CCCCNC(=O)NCc1cncc(c1)Cl 512a_200020614424_100000102301 [0,1,0,0,0,1|2,0,0]=4 13583 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 2708a_100000102301_100011962886 [0,1,0,0,0,1|2,0,0]=4 13584 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 2708a_100011962886_100000102301 [0,1,0,0,0,1|2,0,0]=4 13585 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 273464a_100000102301_100011962886 [0,1,0,0,0,1|2,0,0]=4 13586 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 273464a_100011962886_100000102301 [0,1,0,0,0,1|2,0,0]=4 13587 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 512a_100000102301_100011962886 [0,1,0,0,0,1|2,0,0]=4 13588 B16R1.52 CCCCNC(=O)NCc1cncc(c1)F 512a_100011962886_100000102301 [0,1,0,0,0,1|2,0,0]=4 13589 B16R1.52 CCCCNC(=O)NNc1cccc(c1)Br 273464a_100000102301_100000217339 [0,1,0,0,0,1|2,0,0]=4 13590 B16R1.52 CCCCNC(=O)NNc1cccc(c1)Br 512a_100000102301_100000217339 [0,1,0,0,0,1|2,0,0]=4 13591 B16R1.52 CCCCNC(=O)NNc1cccc(c1)Br 512a_100000217339_100000102301 [0,1,0,0,0,1|2,0,0]=4 13592 B16R1.52 CCCCNC(=O)NNc1cccc(c1)C 273464a_100000102301_100000681630 [0,1,0,0,0,1|2,0,0]=4 13593 B16R1.52 CCCCNC(=O)NNc1cccc(c1)C 512a_100000102301_100000681630 [0,1,0,0,0,1|2,0,0]=4 13594 B16R1.52 CCCCNC(=O)NNc1cccc(c1)C 512a_100000681630_100000102301 [0,1,0,0,0,1|2,0,0]=4 13595 B16R1.52 CCCCNC(=O)NNc1cccc(c1)Cl 273464a_100000102301_100000184277 [0,1,0,0,0,1|2,0,0]=4 13596 B16R1.52 CCCCNC(=O)NNc1cccc(c1)Cl 512a_100000102301_100000184277 [0,1,0,0,0,1|2,0,0]=4 13597 B16R1.52 CCCCNC(=O)NNc1cccc(c1)F 273464a_100000102301_100000745080 [0,1,0,0,0,1|2,0,0]=4 13598 B16R1.52 CCCCNC(=O)NNc1cccc(c1)F 512a_100000102301_100000745080 [0,1,0,0,0,1|2,0,0]=4 13599 B16R1.52 CCCCNC(=O)NNc1cccc(c1)F 512a_100000745080_100000102301 [0,1,0,0,0,1|2,0,0]=4 13600 B16R1.52 CCCCNC(=O)NNc1cccc(c1)I 273464a_100000102301_100020605690 [0,1,0,0,0,1|2,0,0]=4 13601 B16R1.52 CCCCNC(=O)NNc1cccc(c1)I 512a_100000102301_100020605690 [0,1,0,0,0,1|2,0,0]=4 13602 B16R1.52 CCCCNC(=O)NNc1cccc(c1)I 512a_100020605690_100000102301 [0,1,0,0,0,1|2,0,0]=4 13603 B16R1.52 CCCCOC(=O)CNc1cccc(c1)Br 34a_100000210019_100000211628 [0,1,0,0,0,1|0,0,0]=2 13604 B16R1.52 CCCCOC(=O)CNc1cccc(c1)C 2230a_100000188690_100000211628 [0,1,0,0,0,1|0,0,0]=2 13605 B16R1.52 CCCCOC(=O)CNc1cccc(c1)C 34a_100000188690_100000211628 [0,1,0,0,0,1|0,0,0]=2 13606 B16R1.52 CCCCOC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000211628 [0,1,0,0,0,1|0,0,0]=2 13607 B16R1.52 CCCCOC(=O)CNc1cccc(c1)F 34a_100000210047_100000211628 [0,1,0,0,0,1|0,0,0]=2 13608 B16R1.52 CCCCOC(=O)CNc1cccc(c1)I 34a_100000211102_100000211628 [0,1,0,0,0,1|0,0,0]=2 13609 B16R1.52 CCCCOC(=O)CNc1cccc(c1)O 34a_100000210217_100000211628 [0,1,0,0,0,1|0,0,0]=2 13610 B16R1.52 CCCCOC(=O)COc1cc(cnn1)C 34a_100000766097_100000211628 [0,1,0,0,0,1|2,0,0]=4 13611 B16R1.52 CCCCOC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000211628 [0,1,0,0,0,1|1,0,0]=3 13612 B16R1.52 CCCCOC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000211628 [0,1,0,0,0,1|1,0,0]=3 13613 B16R1.52 CCCCOC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000211628 [0,1,0,0,0,1|1,0,0]=3 13614 B16R1.52 CCCCOC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000211628 [0,1,0,0,0,1|1,0,0]=3 13615 B16R1.52 CCCCOC(=O)COc1cccc(c1)Br 34a_100000210342_100000211628 [0,1,0,0,0,1|0,0,0]=2 13616 B16R1.52 CCCCOC(=O)COc1cccc(c1)Br 7a_100000210342_100000211628 [0,1,0,0,0,1|0,0,0]=2 13617 B16R1.52 CCCCOC(=O)COc1cccc(c1)C 34a_100000210337_100000211628 [0,1,0,0,0,1|0,0,0]=2 13618 B16R1.52 CCCCOC(=O)COc1cccc(c1)C 7a_100000210337_100000211628 [0,1,0,0,0,1|0,0,0]=2 13619 B16R1.52 CCCCOC(=O)COc1cccc(c1)Cl 34a_100000210295_100000211628 [0,1,0,0,0,1|0,0,0]=2 13620 B16R1.52 CCCCOC(=O)COc1cccc(c1)Cl 7a_100000210295_100000211628 [0,1,0,0,0,1|0,0,0]=2 13621 B16R1.52 CCCCOC(=O)COc1cccc(c1)F 34a_100000210426_100000211628 [0,1,0,0,0,1|0,0,0]=2 13622 B16R1.52 CCCCOC(=O)COc1cccc(c1)F 7a_100000210426_100000211628 [0,1,0,0,0,1|0,0,0]=2 13623 B16R1.52 CCCCOC(=O)COc1cccc(c1)I 34a_100000211634_100000211628 [0,1,0,0,0,1|0,0,0]=2 13624 B16R1.52 CCCCOC(=O)COc1cccc(c1)I 7a_100000211634_100000211628 [0,1,0,0,0,1|0,0,0]=2 13625 B16R1.52 CCCCOC(=O)COc1cccc(c1)N 34a_100000210217_100000211628 [0,1,0,0,0,1|0,0,0]=2 13626 B16R1.52 CCCCOC(=O)COc1cccc(n1)F 34a_100011432558_100000211628 [0,1,0,0,0,1|1,0,0]=3 13627 B16R1.52 CCCCOC(=O)COc1ccnc(c1)C 34a_100000688365_100000211628 [0,1,0,0,0,1|1,0,0]=3 13628 B16R1.52 CCCCOC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000211628 [0,1,0,0,0,1|1,0,0]=3 13629 B16R1.52 CCCCOC(=O)COc1ccnc(c1)F 34a_100000732698_100000211628 [0,1,0,0,0,1|1,0,0]=3 13630 B16R1.52 CCCCOC(=O)COc1ccnc(c1)N 34a_100011834064_100000211628 [0,1,0,0,0,1|1,0,0]=3 13631 B16R1.52 CCCCOC(=O)COc1cncc(c1)Br 34a_100000754920_100000211628 [0,1,0,0,0,1|1,0,0]=3 13632 B16R1.52 CCCCOC(=O)COc1cncc(c1)Br 7a_100000754920_100000211628 [0,1,0,0,0,1|1,0,0]=3 13633 B16R1.52 CCCCOC(=O)COc1cncc(c1)C 34a_100011830280_100000211628 [0,1,0,0,0,1|1,0,0]=3 13634 B16R1.52 CCCCOC(=O)COc1cncc(c1)C 7a_100011830280_100000211628 [0,1,0,0,0,1|1,0,0]=3 13635 B16R1.52 CCCCOC(=O)COc1cncc(c1)Cl 7a_100000032511_100000211628 [0,1,0,0,0,1|1,0,0]=3 13636 B16R1.52 CCCCOC(=O)COc1cncc(c1)F 34a_100011830296_100000211628 [0,1,0,0,0,1|1,0,0]=3 13637 B16R1.52 CCCCOC(=O)COc1cncc(c1)F 7a_100011830296_100000211628 [0,1,0,0,0,1|1,0,0]=3 13638 B16R1.52 CCCCOC(=O)COc1cncc(c1)N 34a_100011997051_100000211628 [0,1,0,0,0,1|1,0,0]=3 13639 B16R1.52 CCCCOC(=O)COc1cnnc(c1)Cl 34a_200010734679_100000211628 [0,1,0,0,0,1|2,0,0]=4 13640 B16R1.52 CCCCOC(=O)COc1cnnc(c1)N 34a_200015193112_100000211628 [0,1,0,0,0,1|2,0,0]=4 13641 B16R1.52 CCCCOC(=O)CSc1c[n+](ccn1)[O-] 62a_100000211628_100009880115 [0,1,0,0,0,1|2,0,0]=4 13642 B16R1.52 CCCCOC(=O)CSc1cc(=O)[nH]cn1 62a_100012002517_100000211628 [0,1,0,0,0,1|2,0,0]=4 13643 B16R1.52 CCCCOC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000211628 [0,1,0,0,0,1|1,0,0]=3 13644 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)C 62a_100000211628_100000750283 [0,1,0,0,0,1|1,0,0]=3 13645 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)C 62a_100000750283_100000211628 [0,1,0,0,0,1|1,0,0]=3 13646 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)Cl 62a_100000211628_100010167805 [0,1,0,0,0,1|1,0,0]=3 13647 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)Cl 62a_100010167805_100000211628 [0,1,0,0,0,1|1,0,0]=3 13648 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)F 62a_100000211628_100000764206 [0,1,0,0,0,1|1,0,0]=3 13649 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)F 62a_100000764206_100000211628 [0,1,0,0,0,1|1,0,0]=3 13650 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)N 62a_100000211628_100009814236 [0,1,0,0,0,1|1,0,0]=3 13651 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)N 62a_100009814236_100000211628 [0,1,0,0,0,1|1,0,0]=3 13652 B16R1.52 CCCCOC(=O)CSc1cc(ccn1)O 62a_100000211628_100000762945 [0,1,0,0,0,1|1,0,0]=3 13653 B16R1.52 CCCCOC(=O)CSc1cc(cnn1)C 62a_100000070100_100000211628 [0,1,0,0,0,1|2,0,0]=4 13654 B16R1.52 CCCCOC(=O)CSc1cc(cnn1)C 62a_100000211628_100000070100 [0,1,0,0,0,1|2,0,0]=4 13655 B16R1.52 CCCCOC(=O)CSc1cc(cnn1)N 62a_100000211628_100011996757 [0,1,0,0,0,1|2,0,0]=4 13656 B16R1.52 CCCCOC(=O)CSc1cc(cnn1)N 62a_100011996757_100000211628 [0,1,0,0,0,1|2,0,0]=4 13657 B16R1.52 CCCCOC(=O)CSc1cc(cnn1)O 62a_100000211628_200010734679 [0,1,0,0,0,1|2,0,0]=4 13658 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)C 62a_100000211628_100000744208 [0,1,0,0,0,1|2,0,0]=4 13659 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)C 62a_100000744208_100000211628 [0,1,0,0,0,1|2,0,0]=4 13660 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)Cl 62a_100000211628_100010161198 [0,1,0,0,0,1|2,0,0]=4 13661 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)Cl 62a_100010161198_100000211628 [0,1,0,0,0,1|2,0,0]=4 13662 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)F 62a_100000211628_200009880791 [0,1,0,0,0,1|2,0,0]=4 13663 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)F 62a_200009880791_100000211628 [0,1,0,0,0,1|2,0,0]=4 13664 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)N 62a_100000211628_100000701291 [0,1,0,0,0,1|2,0,0]=4 13665 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)N 62a_100000701291_100000211628 [0,1,0,0,0,1|2,0,0]=4 13666 B16R1.52 CCCCOC(=O)CSc1cc(ncn1)O 62a_100000211628_100000765262 [0,1,0,0,0,1|2,0,0]=4 13667 B16R1.52 CCCCOC(=O)CSc1cc[nH]c(=O)c1 62a_100000211628_100009816521 [0,1,0,0,0,1|1,0,0]=3 13668 B16R1.52 CCCCOC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000211628 [0,1,0,0,0,1|1,0,0]=3 13669 B16R1.52 CCCCOC(=O)CSc1cc[nH]c(=O)n1 62a_100000211628_200000134032 [0,1,0,0,0,1|2,0,0]=4 13670 B16R1.52 CCCCOC(=O)CSc1ccc[n+](c1)C 62a_100000211628_100009996589 [0,1,0,0,0,1|1,0,0]=3 13671 B16R1.52 CCCCOC(=O)CSc1ccc[n+](c1)C 62a_100009996589_100000211628 [0,1,0,0,0,1|1,0,0]=3 13672 B16R1.52 CCCCOC(=O)CSc1ccc[n+](c1)[O-] 62a_100000211628_100009815978 [0,1,0,0,0,1|1,0,0]=3 13673 B16R1.52 CCCCOC(=O)CSc1cccc(=O)[nH]1 62a_100000211628_100000752884 [0,1,0,0,0,1|1,0,0]=3 13674 B16R1.52 CCCCOC(=O)CSc1cccc(c1)Br 62a_100000211628_100000691529 [0,1,0,0,0,1|0,0,0]=2 13675 B16R1.52 CCCCOC(=O)CSc1cccc(c1)Br 62a_100000691529_100000211628 [0,1,0,0,0,1|0,0,0]=2 13676 B16R1.52 CCCCOC(=O)CSc1cccc(c1)C 62a_100000211628_100011215228 [0,1,0,0,0,1|0,0,0]=2 13677 B16R1.52 CCCCOC(=O)CSc1cccc(c1)C 62a_100011215228_100000211628 [0,1,0,0,0,1|0,0,0]=2 13678 B16R1.52 CCCCOC(=O)CSc1cccc(c1)Cl 62a_100000211628_100000699651 [0,1,0,0,0,1|0,0,0]=2 13679 B16R1.52 CCCCOC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000211628 [0,1,0,0,0,1|0,0,0]=2 13680 B16R1.52 CCCCOC(=O)CSc1cccc(c1)F 62a_100000211628_100000685547 [0,1,0,0,0,1|0,0,0]=2 13681 B16R1.52 CCCCOC(=O)CSc1cccc(c1)F 62a_100000685547_100000211628 [0,1,0,0,0,1|0,0,0]=2 13682 B16R1.52 CCCCOC(=O)CSc1cccc(c1)N 62a_100000210019_100000211628 [0,1,0,0,0,1|0,0,0]=2 13683 B16R1.52 CCCCOC(=O)CSc1cccc(c1)N 62a_100000211628_100000210019 [0,1,0,0,0,1|0,0,0]=2 13684 B16R1.52 CCCCOC(=O)CSc1cccc(c1)O 62a_100000211628_100000211634 [0,1,0,0,0,1|0,0,0]=2 13685 B16R1.52 CCCCOC(=O)CSc1cccc(c1)[S] 62a_100000211628_114929384022 [0,1,0,0,0,1|0,0,0]=2 13686 B16R1.52 CCCCOC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000211628 [0,1,0,0,0,1|0,0,0]=2 13687 B16R1.52 CCCCOC(=O)CSc1cccc(n1)Br 62a_100000211628_100000684672 [0,1,0,0,0,1|1,0,0]=3 13688 B16R1.52 CCCCOC(=O)CSc1cccc(n1)Br 62a_100000684672_100000211628 [0,1,0,0,0,1|1,0,0]=3 13689 B16R1.52 CCCCOC(=O)CSc1cccc(n1)C 62a_100000211628_100000742759 [0,1,0,0,0,1|1,0,0]=3 13690 B16R1.52 CCCCOC(=O)CSc1cccc(n1)C 62a_100000742759_100000211628 [0,1,0,0,0,1|1,0,0]=3 13691 B16R1.52 CCCCOC(=O)CSc1cccc(n1)Cl 62a_100000051397_100000211628 [0,1,0,0,0,1|1,0,0]=3 13692 B16R1.52 CCCCOC(=O)CSc1cccc(n1)Cl 62a_100000211628_100000051397 [0,1,0,0,0,1|1,0,0]=3 13693 B16R1.52 CCCCOC(=O)CSc1cccc(n1)F 62a_100000211628_100009815982 [0,1,0,0,0,1|1,0,0]=3 13694 B16R1.52 CCCCOC(=O)CSc1cccc(n1)F 62a_100009815982_100000211628 [0,1,0,0,0,1|1,0,0]=3 13695 B16R1.52 CCCCOC(=O)CSc1cccc(n1)N 62a_100000211628_100000740741 [0,1,0,0,0,1|1,0,0]=3 13696 B16R1.52 CCCCOC(=O)CSc1cccc(n1)N 62a_100000740741_100000211628 [0,1,0,0,0,1|1,0,0]=3 13697 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)Br 62a_100000211628_100009814637 [0,1,0,0,0,1|1,0,0]=3 13698 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)Br 62a_100009814637_100000211628 [0,1,0,0,0,1|1,0,0]=3 13699 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)C 62a_100000211628_100000758586 [0,1,0,0,0,1|1,0,0]=3 13700 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)C 62a_100000758586_100000211628 [0,1,0,0,0,1|1,0,0]=3 13701 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)Cl 62a_100000035001_100000211628 [0,1,0,0,0,1|1,0,0]=3 13702 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)Cl 62a_100000211628_100000035001 [0,1,0,0,0,1|1,0,0]=3 13703 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)F 62a_100000211628_100009816116 [0,1,0,0,0,1|1,0,0]=3 13704 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)F 62a_100009816116_100000211628 [0,1,0,0,0,1|1,0,0]=3 13705 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)N 62a_100000049665_100000211628 [0,1,0,0,0,1|1,0,0]=3 13706 B16R1.52 CCCCOC(=O)CSc1ccnc(c1)N 62a_100000211628_100000049665 [0,1,0,0,0,1|1,0,0]=3 13707 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)C 62a_100000211628_100000749937 [0,1,0,0,0,1|2,0,0]=4 13708 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)C 62a_100000749937_100000211628 [0,1,0,0,0,1|2,0,0]=4 13709 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)Cl 62a_100000211628_100010154678 [0,1,0,0,0,1|2,0,0]=4 13710 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)Cl 62a_100010154678_100000211628 [0,1,0,0,0,1|2,0,0]=4 13711 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)N 62a_100000055538_100000211628 [0,1,0,0,0,1|2,0,0]=4 13712 B16R1.52 CCCCOC(=O)CSc1ccnc(n1)N 62a_100000211628_100000055538 [0,1,0,0,0,1|2,0,0]=4 13713 B16R1.52 CCCCOC(=O)CSc1cn[nH]c(=O)c1 62a_100000211628_100010197405 [0,1,0,0,0,1|2,0,0]=4 13714 B16R1.52 CCCCOC(=O)CSc1cncc(c1)Br 62a_100000211628_100000728054 [0,1,0,0,0,1|1,0,0]=3 13715 B16R1.52 CCCCOC(=O)CSc1cncc(c1)Br 62a_100000728054_100000211628 [0,1,0,0,0,1|1,0,0]=3 13716 B16R1.52 CCCCOC(=O)CSc1cncc(c1)C 62a_100000211628_100000760492 [0,1,0,0,0,1|1,0,0]=3 13717 B16R1.52 CCCCOC(=O)CSc1cncc(c1)C 62a_100000760492_100000211628 [0,1,0,0,0,1|1,0,0]=3 13718 B16R1.52 CCCCOC(=O)CSc1cncc(c1)Cl 62a_100000049639_100000211628 [0,1,0,0,0,1|1,0,0]=3 13719 B16R1.52 CCCCOC(=O)CSc1cncc(c1)Cl 62a_100000211628_100000049639 [0,1,0,0,0,1|1,0,0]=3 13720 B16R1.52 CCCCOC(=O)CSc1cncc(c1)F 62a_100000211628_100000744099 [0,1,0,0,0,1|1,0,0]=3 13721 B16R1.52 CCCCOC(=O)CSc1cncc(c1)F 62a_100000744099_100000211628 [0,1,0,0,0,1|1,0,0]=3 13722 B16R1.52 CCCCOC(=O)CSc1cncc(c1)N 62a_100000211628_100000687067 [0,1,0,0,0,1|1,0,0]=3 13723 B16R1.52 CCCCOC(=O)CSc1cncc(c1)N 62a_100000687067_100000211628 [0,1,0,0,0,1|1,0,0]=3 13724 B16R1.52 CCCCOC(=O)CSc1cncc(c1)O 62a_100000211628_100000754920 [0,1,0,0,0,1|1,0,0]=3 13725 B16R1.52 CCCCOC(=O)CSc1cncc(c1)O 62a_100000754920_100000211628 [0,1,0,0,0,1|1,0,0]=3 13726 B16R1.52 CCCCOC(=O)CSc1cncc(n1)C 62a_100000211628_100000754123 [0,1,0,0,0,1|2,0,0]=4 13727 B16R1.52 CCCCOC(=O)CSc1cncc(n1)C 62a_100000754123_100000211628 [0,1,0,0,0,1|2,0,0]=4 13728 B16R1.52 CCCCOC(=O)CSc1cncc(n1)Cl 62a_100000211628_100010892449 [0,1,0,0,0,1|2,0,0]=4 13729 B16R1.52 CCCCOC(=O)CSc1cncc(n1)Cl 62a_100010892449_100000211628 [0,1,0,0,0,1|2,0,0]=4 13730 B16R1.52 CCCCOC(=O)CSc1cncc(n1)F 62a_100000211628_200009863489 [0,1,0,0,0,1|2,0,0]=4 13731 B16R1.52 CCCCOC(=O)CSc1cncc(n1)F 62a_200009863489_100000211628 [0,1,0,0,0,1|2,0,0]=4 13732 B16R1.52 CCCCOC(=O)CSc1cncc(n1)N 62a_100000211628_100000747728 [0,1,0,0,0,1|2,0,0]=4 13733 B16R1.52 CCCCOC(=O)CSc1cncc(n1)N 62a_100000747728_100000211628 [0,1,0,0,0,1|2,0,0]=4 13734 B16R1.52 CCCCOC(=O)CSc1cncc(n1)O 62a_100000211628_100011269956 [0,1,0,0,0,1|2,0,0]=4 13735 B16R1.52 CCCCOC(=O)CSc1cnnc(c1)N 62a_100000130277_100000211628 [0,1,0,0,0,1|2,0,0]=4 13736 B16R1.52 CCCCOC(=O)CSc1cnnc(c1)N 62a_100000211628_100000130277 [0,1,0,0,0,1|2,0,0]=4 13737 B16R1.52 CCCCOC(=O)CSc1nccc(n1)C 62a_100000211628_100011243806 [0,1,0,0,0,1|2,0,0]=4 13738 B16R1.52 CCCCOC(=O)CSc1nccc(n1)C 62a_100011243806_100000211628 [0,1,0,0,0,1|2,0,0]=4 13739 B16R1.52 CCCCOC(=O)CSc1nccc(n1)N 62a_100000211628_100000757536 [0,1,0,0,0,1|2,0,0]=4 13740 B16R1.52 CCCCOC(=O)CSc1nccc(n1)N 62a_100000757536_100000211628 [0,1,0,0,0,1|2,0,0]=4 13741 B16R1.52 CCCCOC(=O)CSc1nccc(n1)O 62a_100000211628_100011649813 [0,1,0,0,0,1|2,0,0]=4 13742 B16R1.52 CCCCOC(C)COc1cccc(c1)C 34a_200011219432_100000210210 [0,1,0,0,0,1|1,0,1]=4 13743 B16R1.52 CCCCOC(C)COc1cccc(c1)C 7a_200011219432_100000210211 [0,1,0,0,0,1|1,0,1]=4 13744 B16R1.52 CCCNNC(=O)CCc1cccc(c1)Br 22a_100000740057_100000184314 [0,1,0,0,0,1|2,0,0]=4 13745 B16R1.52 CCCNNC(=O)CCc1cccc(c1)C 22a_100000740057_100000234952 [0,1,0,0,0,1|2,0,0]=4 13746 B16R1.52 CCCNNC(=O)CCc1cccc(c1)Cl 22a_100000740057_100000235675 [0,1,0,0,0,1|2,0,0]=4 13747 B16R1.52 CCCNNC(=O)CCc1cccc(c1)F 22a_100000740057_100000235673 [0,1,0,0,0,1|2,0,0]=4 13748 B16R1.52 CCCNNC(=O)CCc1cccc(c1)I 22a_100000740057_100010007846 [0,1,0,0,0,1|2,0,0]=4 13749 B16R1.52 CCCNNC(=O)CCc1cccc(c1)O 22a_100000740057_100011216126 [0,1,0,0,0,1|2,0,0]=4 13750 B16R1.52 CCCNNC(=O)COc1cccc(c1)Br 22a_100000740057_100000182359 [0,1,0,0,0,1|2,0,0]=4 13751 B16R1.52 CCCNNC(=O)COc1cccc(c1)C 22a_100000740057_100000183606 [0,1,0,0,0,1|2,0,0]=4 13752 B16R1.52 CCCNNC(=O)COc1cccc(c1)Cl 22a_100000740057_100000184978 [0,1,0,0,0,1|2,0,0]=4 13753 B16R1.52 CCCNNC(=O)COc1cccc(c1)F 22a_100000740057_100000182781 [0,1,0,0,0,1|2,0,0]=4 13754 B16R1.52 CCCNNC(=O)CSc1cccc(c1)Br 22a_100000740057_100000760868 [0,1,0,0,0,1|2,0,0]=4 13755 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100000740057 [0,1,0,0,0,1|2,0,0]=4 13756 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Br 512a_100000174977_100000740057 [0,1,0,0,0,1|2,0,0]=4 13757 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Br 512a_100000740057_100000174977 [0,1,0,0,0,1|2,0,0]=4 13758 B16R1.52 CCCNNC(=O)NCc1cccc(c1)C 273464a_100000185548_100000740057 [0,1,0,0,0,1|2,0,0]=4 13759 B16R1.52 CCCNNC(=O)NCc1cccc(c1)C 512a_100000185548_100000740057 [0,1,0,0,0,1|2,0,0]=4 13760 B16R1.52 CCCNNC(=O)NCc1cccc(c1)C 512a_100000740057_100000185548 [0,1,0,0,0,1|2,0,0]=4 13761 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100000740057 [0,1,0,0,0,1|2,0,0]=4 13762 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100000740057 [0,1,0,0,0,1|2,0,0]=4 13763 B16R1.52 CCCNNC(=O)NCc1cccc(c1)Cl 512a_100000740057_100000174878 [0,1,0,0,0,1|2,0,0]=4 13764 B16R1.52 CCCNNC(=O)NCc1cccc(c1)F 273464a_100000174948_100000740057 [0,1,0,0,0,1|2,0,0]=4 13765 B16R1.52 CCCNNC(=O)NCc1cccc(c1)F 512a_100000174948_100000740057 [0,1,0,0,0,1|2,0,0]=4 13766 B16R1.52 CCCNNC(=O)NCc1cccc(c1)F 512a_100000740057_100000174948 [0,1,0,0,0,1|2,0,0]=4 13767 B16R1.52 CCCNNC(=O)NCc1cccc(c1)I 273464a_100000106179_100000740057 [0,1,0,0,0,1|2,0,0]=4 13768 B16R1.52 CCCNNC(=O)NCc1cccc(c1)I 512a_100000106179_100000740057 [0,1,0,0,0,1|2,0,0]=4 13769 B16R1.52 CCCNNC(=O)NCc1cccc(c1)I 512a_100000740057_100000106179 [0,1,0,0,0,1|2,0,0]=4 13770 B16R1.52 CCCNNC(=O)NCc1cccc(c1)O 273464a_100000743036_100000740057 [0,1,0,0,0,1|2,0,0]=4 13771 B16R1.52 CCCNNC(=O)NCc1cccc(c1)O 512a_100000740057_100000743036 [0,1,0,0,0,1|2,0,0]=4 13772 B16R1.52 CCCNNC(=O)NCc1cccc(c1)O 512a_100000743036_100000740057 [0,1,0,0,0,1|2,0,0]=4 13773 B16R1.52 CCCOCC(=O)CCc1cccc(c1)Br 1458a_100000745993_100011740638 [0,1,0,0,0,1|2,0,0]=4 13774 B16R1.52 CCCOCC(=O)CCc1cccc(c1)C 1458a_100000745993_100011713685 [0,1,0,0,0,1|2,0,0]=4 13775 B16R1.52 CCCOCC(=O)CCc1cccc(c1)Cl 1458a_100000745993_100011713710 [0,1,0,0,0,1|2,0,0]=4 13776 B16R1.52 CCCOCC(=O)CCc1cccc(c1)F 1458a_100000745993_100011217235 [0,1,0,0,0,1|2,0,0]=4 13777 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000745993 [0,1,0,0,0,1|2,0,0]=4 13778 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000745993 [0,1,0,0,0,1|2,0,0]=4 13779 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000745993 [0,1,0,0,0,1|2,0,0]=4 13780 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Br 34a_100000210258_100011263252 [0,1,0,0,0,1|2,0,0]=4 13781 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000745993 [0,1,0,0,0,1|2,0,0]=4 13782 B16R1.52 CCCOCC(=O)NCc1cccc(c1)C 11a_100000185548_100000745993 [0,1,0,0,0,1|2,0,0]=4 13783 B16R1.52 CCCOCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000745993 [0,1,0,0,0,1|2,0,0]=4 13784 B16R1.52 CCCOCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000745993 [0,1,0,0,0,1|2,0,0]=4 13785 B16R1.52 CCCOCC(=O)NCc1cccc(c1)C 34a_100000210258_100000754571 [0,1,0,0,0,1|2,0,0]=4 13786 B16R1.52 CCCOCC(=O)NCc1cccc(c1)C 527a_100000185548_100000745993 [0,1,0,0,0,1|2,0,0]=4 13787 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000745993 [0,1,0,0,0,1|2,0,0]=4 13788 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000745993 [0,1,0,0,0,1|2,0,0]=4 13789 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000745993 [0,1,0,0,0,1|2,0,0]=4 13790 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Cl 34a_100000210258_100000181154 [0,1,0,0,0,1|2,0,0]=4 13791 B16R1.52 CCCOCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000745993 [0,1,0,0,0,1|2,0,0]=4 13792 B16R1.52 CCCOCC(=O)NCc1cccc(c1)F 11a_100000174948_100000745993 [0,1,0,0,0,1|2,0,0]=4 13793 B16R1.52 CCCOCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000745993 [0,1,0,0,0,1|2,0,0]=4 13794 B16R1.52 CCCOCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000745993 [0,1,0,0,0,1|2,0,0]=4 13795 B16R1.52 CCCOCC(=O)NCc1cccc(c1)F 34a_100000210258_100000738998 [0,1,0,0,0,1|2,0,0]=4 13796 B16R1.52 CCCOCC(=O)NCc1cccc(c1)F 527a_100000174948_100000745993 [0,1,0,0,0,1|2,0,0]=4 13797 B16R1.52 CCCOCC(=O)NCc1cccc(c1)I 11a_100000106179_100000745993 [0,1,0,0,0,1|2,0,0]=4 13798 B16R1.52 CCCOCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000745993 [0,1,0,0,0,1|2,0,0]=4 13799 B16R1.52 CCCOCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000745993 [0,1,0,0,0,1|2,0,0]=4 13800 B16R1.52 CCCOCC(=O)NCc1cccc(c1)I 527a_100000106179_100000745993 [0,1,0,0,0,1|2,0,0]=4 13801 B16R1.52 CCCOCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000745993 [0,1,0,0,0,1|2,0,0]=4 13802 B16R1.52 CCCOCC(=O)NCc1cccc(c1)O 527a_100000743036_100000745993 [0,1,0,0,0,1|2,0,0]=4 13803 B16R1.52 CCCSCC(=O)CCc1cccc(c1)Br 1458a_100000217233_100011740638 [0,1,0,0,0,1|2,0,0]=4 13804 B16R1.52 CCCSCC(=O)CCc1cccc(c1)C 1458a_100000217233_100011713685 [0,1,0,0,0,1|2,0,0]=4 13805 B16R1.52 CCCSCC(=O)CCc1cccc(c1)Cl 1458a_100000217233_100011713710 [0,1,0,0,0,1|2,0,0]=4 13806 B16R1.52 CCCSCC(=O)CCc1cccc(c1)F 1458a_100000217233_100011217235 [0,1,0,0,0,1|2,0,0]=4 13807 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000217233 [0,1,0,0,0,1|2,0,0]=4 13808 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000217233 [0,1,0,0,0,1|2,0,0]=4 13809 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000217233 [0,1,0,0,0,1|2,0,0]=4 13810 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000217233 [0,1,0,0,0,1|2,0,0]=4 13811 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 62a_100000210303_100011263252 [0,1,0,0,0,1|2,0,0]=4 13812 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Br 62a_100011263252_100000210303 [0,1,0,0,0,1|2,0,0]=4 13813 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 11a_100000185548_100000217233 [0,1,0,0,0,1|2,0,0]=4 13814 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000217233 [0,1,0,0,0,1|2,0,0]=4 13815 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000217233 [0,1,0,0,0,1|2,0,0]=4 13816 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 527a_100000185548_100000217233 [0,1,0,0,0,1|2,0,0]=4 13817 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 62a_100000210303_100000754571 [0,1,0,0,0,1|2,0,0]=4 13818 B16R1.52 CCCSCC(=O)NCc1cccc(c1)C 62a_100000754571_100000210303 [0,1,0,0,0,1|2,0,0]=4 13819 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000217233 [0,1,0,0,0,1|2,0,0]=4 13820 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000217233 [0,1,0,0,0,1|2,0,0]=4 13821 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000217233 [0,1,0,0,0,1|2,0,0]=4 13822 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000217233 [0,1,0,0,0,1|2,0,0]=4 13823 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 62a_100000181154_100000210303 [0,1,0,0,0,1|2,0,0]=4 13824 B16R1.52 CCCSCC(=O)NCc1cccc(c1)Cl 62a_100000210303_100000181154 [0,1,0,0,0,1|2,0,0]=4 13825 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 11a_100000174948_100000217233 [0,1,0,0,0,1|2,0,0]=4 13826 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000217233 [0,1,0,0,0,1|2,0,0]=4 13827 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000217233 [0,1,0,0,0,1|2,0,0]=4 13828 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 527a_100000174948_100000217233 [0,1,0,0,0,1|2,0,0]=4 13829 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 62a_100000210303_100000738998 [0,1,0,0,0,1|2,0,0]=4 13830 B16R1.52 CCCSCC(=O)NCc1cccc(c1)F 62a_100000738998_100000210303 [0,1,0,0,0,1|2,0,0]=4 13831 B16R1.52 CCCSCC(=O)NCc1cccc(c1)I 11a_100000106179_100000217233 [0,1,0,0,0,1|2,0,0]=4 13832 B16R1.52 CCCSCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000217233 [0,1,0,0,0,1|2,0,0]=4 13833 B16R1.52 CCCSCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000217233 [0,1,0,0,0,1|2,0,0]=4 13834 B16R1.52 CCCSCC(=O)NCc1cccc(c1)I 527a_100000106179_100000217233 [0,1,0,0,0,1|2,0,0]=4 13835 B16R1.52 CCCSCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000217233 [0,1,0,0,0,1|2,0,0]=4 13836 B16R1.52 CCCSCC(=O)NCc1cccc(c1)O 527a_100000743036_100000217233 [0,1,0,0,0,1|2,0,0]=4 13837 B16R1.52 CCNCCC(=O)NCc1cccc(c1)Cl 2230a_100015525214_200011272484 [0,1,0,0,0,1|2,0,0]=4 13838 B16R1.52 CCOCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100011215890 [0,1,0,0,0,1|2,0,0]=4 13839 B16R1.52 CCOCCC(=O)CCc1cccc(c1)Br 1458a_100000749530_100011740638 [0,1,0,0,0,1|2,0,0]=4 13840 B16R1.52 CCOCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100011215890 [0,1,0,0,0,1|2,0,0]=4 13841 B16R1.52 CCOCCC(=O)CCc1cccc(c1)C 1458a_100000749530_100011713685 [0,1,0,0,0,1|2,0,0]=4 13842 B16R1.52 CCOCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100011215890 [0,1,0,0,0,1|2,0,0]=4 13843 B16R1.52 CCOCCC(=O)CCc1cccc(c1)Cl 1458a_100000749530_100011713710 [0,1,0,0,0,1|2,0,0]=4 13844 B16R1.52 CCOCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100011215890 [0,1,0,0,0,1|2,0,0]=4 13845 B16R1.52 CCOCCC(=O)CCc1cccc(c1)F 1458a_100000749530_100011217235 [0,1,0,0,0,1|2,0,0]=4 13846 B16R1.52 CCOCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100011215890 [0,1,0,0,0,1|2,0,0]=4 13847 B16R1.52 CCOCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100011215890 [0,1,0,0,0,1|2,0,0]=4 13848 B16R1.52 CCOCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100011215890 [0,1,0,0,0,1|2,0,0]=4 13849 B16R1.52 CCOCCC(=O)COc1cccc(c1)C 1458a_100000183606_100011215890 [0,1,0,0,0,1|2,0,0]=4 13850 B16R1.52 CCOCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100011215890 [0,1,0,0,0,1|2,0,0]=4 13851 B16R1.52 CCOCCC(=O)COc1cccc(c1)F 1458a_100000182781_100011215890 [0,1,0,0,0,1|2,0,0]=4 13852 B16R1.52 CCOCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100011215890 [0,1,0,0,0,1|2,0,0]=4 13853 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000749530 [0,1,0,0,0,1|2,0,0]=4 13854 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000749530 [0,1,0,0,0,1|2,0,0]=4 13855 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000749530 [0,1,0,0,0,1|2,0,0]=4 13856 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000749530 [0,1,0,0,0,1|2,0,0]=4 13857 B16R1.52 CCOCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000749530 [0,1,0,0,0,1|2,0,0]=4 13858 B16R1.52 CCOCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000749530 [0,1,0,0,0,1|2,0,0]=4 13859 B16R1.52 CCOCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000749530 [0,1,0,0,0,1|2,0,0]=4 13860 B16R1.52 CCOCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000749530 [0,1,0,0,0,1|2,0,0]=4 13861 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000749530 [0,1,0,0,0,1|2,0,0]=4 13862 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000749530 [0,1,0,0,0,1|2,0,0]=4 13863 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000749530 [0,1,0,0,0,1|2,0,0]=4 13864 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Cl 34a_100121572206_200011272484 [0,1,0,0,0,1|2,0,0]=4 13865 B16R1.52 CCOCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000749530 [0,1,0,0,0,1|2,0,0]=4 13866 B16R1.52 CCOCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000749530 [0,1,0,0,0,1|2,0,0]=4 13867 B16R1.52 CCOCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000749530 [0,1,0,0,0,1|2,0,0]=4 13868 B16R1.52 CCOCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000749530 [0,1,0,0,0,1|2,0,0]=4 13869 B16R1.52 CCOCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000749530 [0,1,0,0,0,1|2,0,0]=4 13870 B16R1.52 CCOCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000749530 [0,1,0,0,0,1|2,0,0]=4 13871 B16R1.52 CCOCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000749530 [0,1,0,0,0,1|2,0,0]=4 13872 B16R1.52 CCOCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000749530 [0,1,0,0,0,1|2,0,0]=4 13873 B16R1.52 CCOCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000749530 [0,1,0,0,0,1|2,0,0]=4 13874 B16R1.52 CCOCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000749530 [0,1,0,0,0,1|2,0,0]=4 13875 B16R1.52 CCOCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000749530 [0,1,0,0,0,1|2,0,0]=4 13876 B16R1.52 CCSCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000757381 [0,1,0,0,0,1|2,0,0]=4 13877 B16R1.52 CCSCCC(=O)CCc1cccc(c1)Br 1458a_100000230768_100011740638 [0,1,0,0,0,1|2,0,0]=4 13878 B16R1.52 CCSCCC(=O)CCc1cccc(c1)C 1458a_100000230768_100011713685 [0,1,0,0,0,1|2,0,0]=4 13879 B16R1.52 CCSCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000757381 [0,1,0,0,0,1|2,0,0]=4 13880 B16R1.52 CCSCCC(=O)CCc1cccc(c1)Cl 1458a_100000230768_100011713710 [0,1,0,0,0,1|2,0,0]=4 13881 B16R1.52 CCSCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000757381 [0,1,0,0,0,1|2,0,0]=4 13882 B16R1.52 CCSCCC(=O)CCc1cccc(c1)F 1458a_100000230768_100011217235 [0,1,0,0,0,1|2,0,0]=4 13883 B16R1.52 CCSCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000757381 [0,1,0,0,0,1|2,0,0]=4 13884 B16R1.52 CCSCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000757381 [0,1,0,0,0,1|2,0,0]=4 13885 B16R1.52 CCSCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000757381 [0,1,0,0,0,1|2,0,0]=4 13886 B16R1.52 CCSCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000757381 [0,1,0,0,0,1|2,0,0]=4 13887 B16R1.52 CCSCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000757381 [0,1,0,0,0,1|2,0,0]=4 13888 B16R1.52 CCSCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000757381 [0,1,0,0,0,1|2,0,0]=4 13889 B16R1.52 CCSCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000757381 [0,1,0,0,0,1|2,0,0]=4 13890 B16R1.52 CCSCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000757381 [0,1,0,0,0,1|2,0,0]=4 13891 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000230768 [0,1,0,0,0,1|2,0,0]=4 13892 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000230768 [0,1,0,0,0,1|2,0,0]=4 13893 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000230768 [0,1,0,0,0,1|2,0,0]=4 13894 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000230768 [0,1,0,0,0,1|2,0,0]=4 13895 B16R1.52 CCSCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000230768 [0,1,0,0,0,1|2,0,0]=4 13896 B16R1.52 CCSCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000230768 [0,1,0,0,0,1|2,0,0]=4 13897 B16R1.52 CCSCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000230768 [0,1,0,0,0,1|2,0,0]=4 13898 B16R1.52 CCSCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000230768 [0,1,0,0,0,1|2,0,0]=4 13899 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000230768 [0,1,0,0,0,1|2,0,0]=4 13900 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000230768 [0,1,0,0,0,1|2,0,0]=4 13901 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000230768 [0,1,0,0,0,1|2,0,0]=4 13902 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000230768 [0,1,0,0,0,1|2,0,0]=4 13903 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 62a_100000210202_200011272484 [0,1,0,0,0,1|2,0,0]=4 13904 B16R1.52 CCSCCC(=O)NCc1cccc(c1)Cl 62a_200011272484_100000210202 [0,1,0,0,0,1|2,0,0]=4 13905 B16R1.52 CCSCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000230768 [0,1,0,0,0,1|2,0,0]=4 13906 B16R1.52 CCSCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000230768 [0,1,0,0,0,1|2,0,0]=4 13907 B16R1.52 CCSCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000230768 [0,1,0,0,0,1|2,0,0]=4 13908 B16R1.52 CCSCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000230768 [0,1,0,0,0,1|2,0,0]=4 13909 B16R1.52 CCSCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000230768 [0,1,0,0,0,1|2,0,0]=4 13910 B16R1.52 CCSCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000230768 [0,1,0,0,0,1|2,0,0]=4 13911 B16R1.52 CCSCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000230768 [0,1,0,0,0,1|2,0,0]=4 13912 B16R1.52 CCSCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000230768 [0,1,0,0,0,1|2,0,0]=4 13913 B16R1.52 CCSCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000230768 [0,1,0,0,0,1|2,0,0]=4 13914 B16R1.52 CCSCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000230768 [0,1,0,0,0,1|2,0,0]=4 13915 B16R1.52 COCCCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000740836 [0,1,0,0,0,1|2,0,0]=4 13916 B16R1.52 COCCCC(=O)CCc1cccc(c1)Br 1458a_100000741012_100011740638 [0,1,0,0,0,1|2,0,0]=4 13917 B16R1.52 COCCCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000740836 [0,1,0,0,0,1|2,0,0]=4 13918 B16R1.52 COCCCC(=O)CCc1cccc(c1)C 1458a_100000741012_100011713685 [0,1,0,0,0,1|2,0,0]=4 13919 B16R1.52 COCCCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000740836 [0,1,0,0,0,1|2,0,0]=4 13920 B16R1.52 COCCCC(=O)CCc1cccc(c1)Cl 1458a_100000741012_100011713710 [0,1,0,0,0,1|2,0,0]=4 13921 B16R1.52 COCCCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000740836 [0,1,0,0,0,1|2,0,0]=4 13922 B16R1.52 COCCCC(=O)CCc1cccc(c1)F 1458a_100000741012_100011217235 [0,1,0,0,0,1|2,0,0]=4 13923 B16R1.52 COCCCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000740836 [0,1,0,0,0,1|2,0,0]=4 13924 B16R1.52 COCCCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000740836 [0,1,0,0,0,1|2,0,0]=4 13925 B16R1.52 COCCCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000740836 [0,1,0,0,0,1|2,0,0]=4 13926 B16R1.52 COCCCC(=O)COc1cccc(c1)C 1458a_100000183606_100000740836 [0,1,0,0,0,1|2,0,0]=4 13927 B16R1.52 COCCCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000740836 [0,1,0,0,0,1|2,0,0]=4 13928 B16R1.52 COCCCC(=O)COc1cccc(c1)F 1458a_100000182781_100000740836 [0,1,0,0,0,1|2,0,0]=4 13929 B16R1.52 COCCCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000740836 [0,1,0,0,0,1|2,0,0]=4 13930 B16R1.52 COCCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000741012 [0,1,0,0,0,1|2,0,0]=4 13931 B16R1.52 COCCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000741012 [0,1,0,0,0,1|2,0,0]=4 13932 B16R1.52 COCCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000741012 [0,1,0,0,0,1|2,0,0]=4 13933 B16R1.52 COCCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000741012 [0,1,0,0,0,1|2,0,0]=4 13934 B16R1.52 COCCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000741012 [0,1,0,0,0,1|2,0,0]=4 13935 B16R1.52 COCCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000741012 [0,1,0,0,0,1|2,0,0]=4 13936 B16R1.52 COCCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000741012 [0,1,0,0,0,1|2,0,0]=4 13937 B16R1.52 COCCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000741012 [0,1,0,0,0,1|2,0,0]=4 13938 B16R1.52 COCCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000741012 [0,1,0,0,0,1|2,0,0]=4 13939 B16R1.52 COCCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000741012 [0,1,0,0,0,1|2,0,0]=4 13940 B16R1.52 COCCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000741012 [0,1,0,0,0,1|2,0,0]=4 13941 B16R1.52 COCCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000741012 [0,1,0,0,0,1|2,0,0]=4 13942 B16R1.52 COCCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000741012 [0,1,0,0,0,1|2,0,0]=4 13943 B16R1.52 COCCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000741012 [0,1,0,0,0,1|2,0,0]=4 13944 B16R1.52 COCCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000741012 [0,1,0,0,0,1|2,0,0]=4 13945 B16R1.52 COCCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000741012 [0,1,0,0,0,1|2,0,0]=4 13946 B16R1.52 COCCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000741012 [0,1,0,0,0,1|2,0,0]=4 13947 B16R1.52 COCCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000741012 [0,1,0,0,0,1|2,0,0]=4 13948 B16R1.52 COCCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000741012 [0,1,0,0,0,1|2,0,0]=4 13949 B16R1.52 COCCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000741012 [0,1,0,0,0,1|2,0,0]=4 13950 B16R1.52 COCCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000741012 [0,1,0,0,0,1|2,0,0]=4 13951 B16R1.52 COCCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000741012 [0,1,0,0,0,1|2,0,0]=4 13952 B16R1.52 COCCNC(=O)CCc1cccc(c1)Br 1626a_100000209980_100000184314 [0,1,0,0,0,1|2,0,0]=4 13953 B16R1.52 COCCNC(=O)CCc1cccc(c1)Br 240690a_100000209980_100000184314 [0,1,0,0,0,1|2,0,0]=4 13954 B16R1.52 COCCNC(=O)CCc1cccc(c1)Br 527a_100000209980_100000184314 [0,1,0,0,0,1|2,0,0]=4 13955 B16R1.52 COCCNC(=O)CCc1cccc(c1)C 1626a_100000209980_100000234952 [0,1,0,0,0,1|2,0,0]=4 13956 B16R1.52 COCCNC(=O)CCc1cccc(c1)C 240690a_100000209980_100000234952 [0,1,0,0,0,1|2,0,0]=4 13957 B16R1.52 COCCNC(=O)CCc1cccc(c1)C 527a_100000209980_100000234952 [0,1,0,0,0,1|2,0,0]=4 13958 B16R1.52 COCCNC(=O)CCc1cccc(c1)Cl 1626a_100000209980_100000235675 [0,1,0,0,0,1|2,0,0]=4 13959 B16R1.52 COCCNC(=O)CCc1cccc(c1)Cl 240690a_100000209980_100000235675 [0,1,0,0,0,1|2,0,0]=4 13960 B16R1.52 COCCNC(=O)CCc1cccc(c1)Cl 527a_100000209980_100000235675 [0,1,0,0,0,1|2,0,0]=4 13961 B16R1.52 COCCNC(=O)CCc1cccc(c1)F 1626a_100000209980_100000235673 [0,1,0,0,0,1|2,0,0]=4 13962 B16R1.52 COCCNC(=O)CCc1cccc(c1)F 240690a_100000209980_100000235673 [0,1,0,0,0,1|2,0,0]=4 13963 B16R1.52 COCCNC(=O)CCc1cccc(c1)F 527a_100000209980_100000235673 [0,1,0,0,0,1|2,0,0]=4 13964 B16R1.52 COCCNC(=O)CCc1cccc(c1)I 1626a_100000209980_100010007846 [0,1,0,0,0,1|2,0,0]=4 13965 B16R1.52 COCCNC(=O)CCc1cccc(c1)I 240690a_100000209980_100010007846 [0,1,0,0,0,1|2,0,0]=4 13966 B16R1.52 COCCNC(=O)CCc1cccc(c1)I 527a_100000209980_100010007846 [0,1,0,0,0,1|2,0,0]=4 13967 B16R1.52 COCCNC(=O)CCc1cccc(c1)O 240690a_100000209980_100011216126 [0,1,0,0,0,1|2,0,0]=4 13968 B16R1.52 COCCNC(=O)CCc1cccc(c1)O 527a_100000209980_100011216126 [0,1,0,0,0,1|2,0,0]=4 13969 B16R1.52 COCCNC(=O)CNc1cccc(c1)Br 34a_100000210019_100000183275 [0,1,0,0,0,1|2,0,0]=4 13970 B16R1.52 COCCNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000183275 [0,1,0,0,0,1|2,0,0]=4 13971 B16R1.52 COCCNC(=O)CNc1cccc(c1)C 34a_100000188690_100000183275 [0,1,0,0,0,1|2,0,0]=4 13972 B16R1.52 COCCNC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000183275 [0,1,0,0,0,1|2,0,0]=4 13973 B16R1.52 COCCNC(=O)CNc1cccc(c1)F 34a_100000210047_100000183275 [0,1,0,0,0,1|2,0,0]=4 13974 B16R1.52 COCCNC(=O)CNc1cccc(c1)I 34a_100000211102_100000183275 [0,1,0,0,0,1|2,0,0]=4 13975 B16R1.52 COCCNC(=O)CNc1cccc(c1)O 34a_100000210217_100000183275 [0,1,0,0,0,1|2,0,0]=4 13976 B16R1.52 COCCNC(=O)COc1cccc(c1)Br 1626a_100000209980_100000182359 [0,1,0,0,0,1|2,0,0]=4 13977 B16R1.52 COCCNC(=O)COc1cccc(c1)Br 240690a_100000209980_100000182359 [0,1,0,0,0,1|2,0,0]=4 13978 B16R1.52 COCCNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183275 [0,1,0,0,0,1|2,0,0]=4 13979 B16R1.52 COCCNC(=O)COc1cccc(c1)Br 527a_100000209980_100000182359 [0,1,0,0,0,1|2,0,0]=4 13980 B16R1.52 COCCNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183275 [0,1,0,0,0,1|2,0,0]=4 13981 B16R1.52 COCCNC(=O)COc1cccc(c1)C 1626a_100000209980_100000183606 [0,1,0,0,0,1|2,0,0]=4 13982 B16R1.52 COCCNC(=O)COc1cccc(c1)C 240690a_100000209980_100000183606 [0,1,0,0,0,1|2,0,0]=4 13983 B16R1.52 COCCNC(=O)COc1cccc(c1)C 34a_100000210337_100000183275 [0,1,0,0,0,1|2,0,0]=4 13984 B16R1.52 COCCNC(=O)COc1cccc(c1)C 527a_100000209980_100000183606 [0,1,0,0,0,1|2,0,0]=4 13985 B16R1.52 COCCNC(=O)COc1cccc(c1)C 7a_100000210337_100000183275 [0,1,0,0,0,1|2,0,0]=4 13986 B16R1.52 COCCNC(=O)COc1cccc(c1)Cl 1626a_100000209980_100000184978 [0,1,0,0,0,1|2,0,0]=4 13987 B16R1.52 COCCNC(=O)COc1cccc(c1)Cl 240690a_100000209980_100000184978 [0,1,0,0,0,1|2,0,0]=4 13988 B16R1.52 COCCNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183275 [0,1,0,0,0,1|2,0,0]=4 13989 B16R1.52 COCCNC(=O)COc1cccc(c1)Cl 527a_100000209980_100000184978 [0,1,0,0,0,1|2,0,0]=4 13990 B16R1.52 COCCNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183275 [0,1,0,0,0,1|2,0,0]=4 13991 B16R1.52 COCCNC(=O)COc1cccc(c1)F 1626a_100000209980_100000182781 [0,1,0,0,0,1|2,0,0]=4 13992 B16R1.52 COCCNC(=O)COc1cccc(c1)F 240690a_100000209980_100000182781 [0,1,0,0,0,1|2,0,0]=4 13993 B16R1.52 COCCNC(=O)COc1cccc(c1)F 34a_100000210426_100000183275 [0,1,0,0,0,1|2,0,0]=4 13994 B16R1.52 COCCNC(=O)COc1cccc(c1)F 527a_100000209980_100000182781 [0,1,0,0,0,1|2,0,0]=4 13995 B16R1.52 COCCNC(=O)COc1cccc(c1)F 7a_100000210426_100000183275 [0,1,0,0,0,1|2,0,0]=4 13996 B16R1.52 COCCNC(=O)COc1cccc(c1)I 34a_100000211634_100000183275 [0,1,0,0,0,1|2,0,0]=4 13997 B16R1.52 COCCNC(=O)COc1cccc(c1)I 7a_100000211634_100000183275 [0,1,0,0,0,1|2,0,0]=4 13998 B16R1.52 COCCNC(=O)COc1cccc(c1)N 34a_100000210217_100000183275 [0,1,0,0,0,1|2,0,0]=4 13999 B16R1.52 COCCNC(=O)CSc1cccc(c1)Br 1626a_100000209980_100000760868 [0,1,0,0,0,1|2,0,0]=4 14000 B16R1.52 COCCNC(=O)CSc1cccc(c1)Br 240690a_100000209980_100000760868 [0,1,0,0,0,1|2,0,0]=4 14001 B16R1.52 COCCNC(=O)CSc1cccc(c1)Br 527a_100000209980_100000760868 [0,1,0,0,0,1|2,0,0]=4 14002 B16R1.52 COCCNC(=O)CSc1cccc(c1)Br 62a_100000183275_100000691529 [0,1,0,0,0,1|2,0,0]=4 14003 B16R1.52 COCCNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000183275 [0,1,0,0,0,1|2,0,0]=4 14004 B16R1.52 COCCNC(=O)CSc1cccc(c1)C 62a_100000183275_100011215228 [0,1,0,0,0,1|2,0,0]=4 14005 B16R1.52 COCCNC(=O)CSc1cccc(c1)C 62a_100011215228_100000183275 [0,1,0,0,0,1|2,0,0]=4 14006 B16R1.52 COCCNC(=O)CSc1cccc(c1)Cl 62a_100000183275_100000699651 [0,1,0,0,0,1|2,0,0]=4 14007 B16R1.52 COCCNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000183275 [0,1,0,0,0,1|2,0,0]=4 14008 B16R1.52 COCCNC(=O)CSc1cccc(c1)F 62a_100000183275_100000685547 [0,1,0,0,0,1|2,0,0]=4 14009 B16R1.52 COCCNC(=O)CSc1cccc(c1)F 62a_100000685547_100000183275 [0,1,0,0,0,1|2,0,0]=4 14010 B16R1.52 COCCNC(=O)CSc1cccc(c1)N 62a_100000183275_100000210019 [0,1,0,0,0,1|2,0,0]=4 14011 B16R1.52 COCCNC(=O)CSc1cccc(c1)N 62a_100000210019_100000183275 [0,1,0,0,0,1|2,0,0]=4 14012 B16R1.52 COCCNC(=O)CSc1cccc(c1)O 62a_100000183275_100000211634 [0,1,0,0,0,1|2,0,0]=4 14013 B16R1.52 COCCNC(=O)CSc1cccc(c1)[S] 62a_100000183275_114929384022 [0,1,0,0,0,1|2,0,0]=4 14014 B16R1.52 COCCNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000183275 [0,1,0,0,0,1|2,0,0]=4 14015 B16R1.52 COCCNC(=O)NCc1cccc(c1)Br 2708a_100000174977_100000209980 [0,1,0,0,0,1|2,0,0]=4 14016 B16R1.52 COCCNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100000209980 [0,1,0,0,0,1|2,0,0]=4 14017 B16R1.52 COCCNC(=O)NCc1cccc(c1)Br 273464a_100000209980_100000174977 [0,1,0,0,0,1|2,0,0]=4 14018 B16R1.52 COCCNC(=O)NCc1cccc(c1)C 2708a_100000185548_100000209980 [0,1,0,0,0,1|2,0,0]=4 14019 B16R1.52 COCCNC(=O)NCc1cccc(c1)C 273464a_100000185548_100000209980 [0,1,0,0,0,1|2,0,0]=4 14020 B16R1.52 COCCNC(=O)NCc1cccc(c1)C 273464a_100000209980_100000185548 [0,1,0,0,0,1|2,0,0]=4 14021 B16R1.52 COCCNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_100000209980 [0,1,0,0,0,1|2,0,0]=4 14022 B16R1.52 COCCNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100000209980 [0,1,0,0,0,1|2,0,0]=4 14023 B16R1.52 COCCNC(=O)NCc1cccc(c1)Cl 273464a_100000209980_100000174878 [0,1,0,0,0,1|2,0,0]=4 14024 B16R1.52 COCCNC(=O)NCc1cccc(c1)F 2708a_100000174948_100000209980 [0,1,0,0,0,1|2,0,0]=4 14025 B16R1.52 COCCNC(=O)NCc1cccc(c1)F 273464a_100000174948_100000209980 [0,1,0,0,0,1|2,0,0]=4 14026 B16R1.52 COCCNC(=O)NCc1cccc(c1)F 273464a_100000209980_100000174948 [0,1,0,0,0,1|2,0,0]=4 14027 B16R1.52 COCCNC(=O)NCc1cccc(c1)I 2708a_100000106179_100000209980 [0,1,0,0,0,1|2,0,0]=4 14028 B16R1.52 COCCNC(=O)NCc1cccc(c1)I 273464a_100000106179_100000209980 [0,1,0,0,0,1|2,0,0]=4 14029 B16R1.52 COCCNC(=O)NCc1cccc(c1)I 273464a_100000209980_100000106179 [0,1,0,0,0,1|2,0,0]=4 14030 B16R1.52 COCCNC(=O)NCc1cccc(c1)O 2708a_100000743036_100000209980 [0,1,0,0,0,1|2,0,0]=4 14031 B16R1.52 COCCNC(=O)NCc1cccc(c1)O 273464a_100000209980_100000743036 [0,1,0,0,0,1|2,0,0]=4 14032 B16R1.52 COCCNC(=O)NCc1cccc(c1)O 273464a_100000743036_100000209980 [0,1,0,0,0,1|2,0,0]=4 14033 B16R1.52 COCCOC(=O)CNc1cccc(c1)Br 34a_100000210019_200000040189 [0,1,0,0,0,1|1,0,0]=3 14034 B16R1.52 COCCOC(=O)CNc1cccc(c1)C 2230a_100000188690_200000040189 [0,1,0,0,0,1|1,0,0]=3 14035 B16R1.52 COCCOC(=O)CNc1cccc(c1)C 34a_100000188690_200000040189 [0,1,0,0,0,1|1,0,0]=3 14036 B16R1.52 COCCOC(=O)CNc1cccc(c1)Cl 34a_100000185859_200000040189 [0,1,0,0,0,1|1,0,0]=3 14037 B16R1.52 COCCOC(=O)CNc1cccc(c1)F 34a_100000210047_200000040189 [0,1,0,0,0,1|1,0,0]=3 14038 B16R1.52 COCCOC(=O)CNc1cccc(c1)I 34a_100000211102_200000040189 [0,1,0,0,0,1|1,0,0]=3 14039 B16R1.52 COCCOC(=O)CNc1cccc(c1)O 34a_100000210217_200000040189 [0,1,0,0,0,1|1,0,0]=3 14040 B16R1.52 COCCOC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_200000040189 [0,1,0,0,0,1|2,0,0]=4 14041 B16R1.52 COCCOC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_200000040189 [0,1,0,0,0,1|2,0,0]=4 14042 B16R1.52 COCCOC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_200000040189 [0,1,0,0,0,1|2,0,0]=4 14043 B16R1.52 COCCOC(=O)COc1cccc(=O)[nH]1 34a_100000033347_200000040189 [0,1,0,0,0,1|2,0,0]=4 14044 B16R1.52 COCCOC(=O)COc1cccc(c1)Br 34a_100000210342_200000040189 [0,1,0,0,0,1|1,0,0]=3 14045 B16R1.52 COCCOC(=O)COc1cccc(c1)Br 7a_100000210342_200000040189 [0,1,0,0,0,1|1,0,0]=3 14046 B16R1.52 COCCOC(=O)COc1cccc(c1)C 34a_100000210337_200000040189 [0,1,0,0,0,1|1,0,0]=3 14047 B16R1.52 COCCOC(=O)COc1cccc(c1)C 7a_100000210337_200000040189 [0,1,0,0,0,1|1,0,0]=3 14048 B16R1.52 COCCOC(=O)COc1cccc(c1)Cl 34a_100000210295_200000040189 [0,1,0,0,0,1|1,0,0]=3 14049 B16R1.52 COCCOC(=O)COc1cccc(c1)Cl 7a_100000210295_200000040189 [0,1,0,0,0,1|1,0,0]=3 14050 B16R1.52 COCCOC(=O)COc1cccc(c1)F 34a_100000210426_200000040189 [0,1,0,0,0,1|1,0,0]=3 14051 B16R1.52 COCCOC(=O)COc1cccc(c1)F 7a_100000210426_200000040189 [0,1,0,0,0,1|1,0,0]=3 14052 B16R1.52 COCCOC(=O)COc1cccc(c1)I 34a_100000211634_200000040189 [0,1,0,0,0,1|1,0,0]=3 14053 B16R1.52 COCCOC(=O)COc1cccc(c1)I 7a_100000211634_200000040189 [0,1,0,0,0,1|1,0,0]=3 14054 B16R1.52 COCCOC(=O)COc1cccc(c1)N 34a_100000210217_200000040189 [0,1,0,0,0,1|1,0,0]=3 14055 B16R1.52 COCCOC(=O)COc1cccc(n1)F 34a_100011432558_200000040189 [0,1,0,0,0,1|2,0,0]=4 14056 B16R1.52 COCCOC(=O)COc1ccnc(c1)C 34a_100000688365_200000040189 [0,1,0,0,0,1|2,0,0]=4 14057 B16R1.52 COCCOC(=O)COc1ccnc(c1)Cl 34a_100000762945_200000040189 [0,1,0,0,0,1|2,0,0]=4 14058 B16R1.52 COCCOC(=O)COc1ccnc(c1)F 34a_100000732698_200000040189 [0,1,0,0,0,1|2,0,0]=4 14059 B16R1.52 COCCOC(=O)COc1ccnc(c1)N 34a_100011834064_200000040189 [0,1,0,0,0,1|2,0,0]=4 14060 B16R1.52 COCCOC(=O)COc1cncc(c1)Br 34a_100000754920_200000040189 [0,1,0,0,0,1|2,0,0]=4 14061 B16R1.52 COCCOC(=O)COc1cncc(c1)Br 7a_100000754920_200000040189 [0,1,0,0,0,1|2,0,0]=4 14062 B16R1.52 COCCOC(=O)COc1cncc(c1)C 34a_100011830280_200000040189 [0,1,0,0,0,1|2,0,0]=4 14063 B16R1.52 COCCOC(=O)COc1cncc(c1)C 7a_100011830280_200000040189 [0,1,0,0,0,1|2,0,0]=4 14064 B16R1.52 COCCOC(=O)COc1cncc(c1)Cl 7a_100000032511_200000040189 [0,1,0,0,0,1|2,0,0]=4 14065 B16R1.52 COCCOC(=O)COc1cncc(c1)F 34a_100011830296_200000040189 [0,1,0,0,0,1|2,0,0]=4 14066 B16R1.52 COCCOC(=O)COc1cncc(c1)F 7a_100011830296_200000040189 [0,1,0,0,0,1|2,0,0]=4 14067 B16R1.52 COCCOC(=O)COc1cncc(c1)N 34a_100011997051_200000040189 [0,1,0,0,0,1|2,0,0]=4 14068 B16R1.52 COCCOC(=O)CSc1cc(=O)cc[nH]1 62a_100009817434_200000040189 [0,1,0,0,0,1|2,0,0]=4 14069 B16R1.52 COCCOC(=O)CSc1cc(ccn1)C 62a_100000750283_200000040189 [0,1,0,0,0,1|2,0,0]=4 14070 B16R1.52 COCCOC(=O)CSc1cc(ccn1)C 62a_200000040189_100000750283 [0,1,0,0,0,1|2,0,0]=4 14071 B16R1.52 COCCOC(=O)CSc1cc(ccn1)Cl 62a_100010167805_200000040189 [0,1,0,0,0,1|2,0,0]=4 14072 B16R1.52 COCCOC(=O)CSc1cc(ccn1)Cl 62a_200000040189_100010167805 [0,1,0,0,0,1|2,0,0]=4 14073 B16R1.52 COCCOC(=O)CSc1cc(ccn1)F 62a_100000764206_200000040189 [0,1,0,0,0,1|2,0,0]=4 14074 B16R1.52 COCCOC(=O)CSc1cc(ccn1)F 62a_200000040189_100000764206 [0,1,0,0,0,1|2,0,0]=4 14075 B16R1.52 COCCOC(=O)CSc1cc(ccn1)N 62a_100009814236_200000040189 [0,1,0,0,0,1|2,0,0]=4 14076 B16R1.52 COCCOC(=O)CSc1cc(ccn1)N 62a_200000040189_100009814236 [0,1,0,0,0,1|2,0,0]=4 14077 B16R1.52 COCCOC(=O)CSc1cc(ccn1)O 62a_200000040189_100000762945 [0,1,0,0,0,1|2,0,0]=4 14078 B16R1.52 COCCOC(=O)CSc1cc[nH]c(=O)c1 62a_100009816521_200000040189 [0,1,0,0,0,1|2,0,0]=4 14079 B16R1.52 COCCOC(=O)CSc1cc[nH]c(=O)c1 62a_200000040189_100009816521 [0,1,0,0,0,1|2,0,0]=4 14080 B16R1.52 COCCOC(=O)CSc1ccc[n+](c1)C 62a_100009996589_200000040189 [0,1,0,0,0,1|2,0,0]=4 14081 B16R1.52 COCCOC(=O)CSc1ccc[n+](c1)C 62a_200000040189_100009996589 [0,1,0,0,0,1|2,0,0]=4 14082 B16R1.52 COCCOC(=O)CSc1ccc[n+](c1)[O-] 62a_200000040189_100009815978 [0,1,0,0,0,1|2,0,0]=4 14083 B16R1.52 COCCOC(=O)CSc1cccc(=O)[nH]1 62a_200000040189_100000752884 [0,1,0,0,0,1|2,0,0]=4 14084 B16R1.52 COCCOC(=O)CSc1cccc(c1)Br 62a_100000691529_200000040189 [0,1,0,0,0,1|1,0,0]=3 14085 B16R1.52 COCCOC(=O)CSc1cccc(c1)Br 62a_200000040189_100000691529 [0,1,0,0,0,1|1,0,0]=3 14086 B16R1.52 COCCOC(=O)CSc1cccc(c1)C 62a_100011215228_200000040189 [0,1,0,0,0,1|1,0,0]=3 14087 B16R1.52 COCCOC(=O)CSc1cccc(c1)C 62a_200000040189_100011215228 [0,1,0,0,0,1|1,0,0]=3 14088 B16R1.52 COCCOC(=O)CSc1cccc(c1)Cl 62a_100000699651_200000040189 [0,1,0,0,0,1|1,0,0]=3 14089 B16R1.52 COCCOC(=O)CSc1cccc(c1)Cl 62a_200000040189_100000699651 [0,1,0,0,0,1|1,0,0]=3 14090 B16R1.52 COCCOC(=O)CSc1cccc(c1)F 62a_100000685547_200000040189 [0,1,0,0,0,1|1,0,0]=3 14091 B16R1.52 COCCOC(=O)CSc1cccc(c1)F 62a_200000040189_100000685547 [0,1,0,0,0,1|1,0,0]=3 14092 B16R1.52 COCCOC(=O)CSc1cccc(c1)N 62a_100000210019_200000040189 [0,1,0,0,0,1|1,0,0]=3 14093 B16R1.52 COCCOC(=O)CSc1cccc(c1)N 62a_200000040189_100000210019 [0,1,0,0,0,1|1,0,0]=3 14094 B16R1.52 COCCOC(=O)CSc1cccc(c1)O 62a_200000040189_100000211634 [0,1,0,0,0,1|1,0,0]=3 14095 B16R1.52 COCCOC(=O)CSc1cccc(c1)[S] 62a_114929384022_200000040189 [0,1,0,0,0,1|1,0,0]=3 14096 B16R1.52 COCCOC(=O)CSc1cccc(c1)[S] 62a_200000040189_114929384022 [0,1,0,0,0,1|1,0,0]=3 14097 B16R1.52 COCCOC(=O)CSc1cccc(n1)Br 62a_100000684672_200000040189 [0,1,0,0,0,1|2,0,0]=4 14098 B16R1.52 COCCOC(=O)CSc1cccc(n1)Br 62a_200000040189_100000684672 [0,1,0,0,0,1|2,0,0]=4 14099 B16R1.52 COCCOC(=O)CSc1cccc(n1)C 62a_100000742759_200000040189 [0,1,0,0,0,1|2,0,0]=4 14100 B16R1.52 COCCOC(=O)CSc1cccc(n1)C 62a_200000040189_100000742759 [0,1,0,0,0,1|2,0,0]=4 14101 B16R1.52 COCCOC(=O)CSc1cccc(n1)Cl 62a_100000051397_200000040189 [0,1,0,0,0,1|2,0,0]=4 14102 B16R1.52 COCCOC(=O)CSc1cccc(n1)Cl 62a_200000040189_100000051397 [0,1,0,0,0,1|2,0,0]=4 14103 B16R1.52 COCCOC(=O)CSc1cccc(n1)F 62a_100009815982_200000040189 [0,1,0,0,0,1|2,0,0]=4 14104 B16R1.52 COCCOC(=O)CSc1cccc(n1)F 62a_200000040189_100009815982 [0,1,0,0,0,1|2,0,0]=4 14105 B16R1.52 COCCOC(=O)CSc1cccc(n1)N 62a_100000740741_200000040189 [0,1,0,0,0,1|2,0,0]=4 14106 B16R1.52 COCCOC(=O)CSc1cccc(n1)N 62a_200000040189_100000740741 [0,1,0,0,0,1|2,0,0]=4 14107 B16R1.52 COCCOC(=O)CSc1ccnc(c1)Br 62a_100009814637_200000040189 [0,1,0,0,0,1|2,0,0]=4 14108 B16R1.52 COCCOC(=O)CSc1ccnc(c1)Br 62a_200000040189_100009814637 [0,1,0,0,0,1|2,0,0]=4 14109 B16R1.52 COCCOC(=O)CSc1ccnc(c1)C 62a_100000758586_200000040189 [0,1,0,0,0,1|2,0,0]=4 14110 B16R1.52 COCCOC(=O)CSc1ccnc(c1)C 62a_200000040189_100000758586 [0,1,0,0,0,1|2,0,0]=4 14111 B16R1.52 COCCOC(=O)CSc1ccnc(c1)Cl 62a_100000035001_200000040189 [0,1,0,0,0,1|2,0,0]=4 14112 B16R1.52 COCCOC(=O)CSc1ccnc(c1)Cl 62a_200000040189_100000035001 [0,1,0,0,0,1|2,0,0]=4 14113 B16R1.52 COCCOC(=O)CSc1ccnc(c1)F 62a_100009816116_200000040189 [0,1,0,0,0,1|2,0,0]=4 14114 B16R1.52 COCCOC(=O)CSc1ccnc(c1)F 62a_200000040189_100009816116 [0,1,0,0,0,1|2,0,0]=4 14115 B16R1.52 COCCOC(=O)CSc1ccnc(c1)N 62a_100000049665_200000040189 [0,1,0,0,0,1|2,0,0]=4 14116 B16R1.52 COCCOC(=O)CSc1ccnc(c1)N 62a_200000040189_100000049665 [0,1,0,0,0,1|2,0,0]=4 14117 B16R1.52 COCCOC(=O)CSc1cncc(c1)Br 62a_100000728054_200000040189 [0,1,0,0,0,1|2,0,0]=4 14118 B16R1.52 COCCOC(=O)CSc1cncc(c1)Br 62a_200000040189_100000728054 [0,1,0,0,0,1|2,0,0]=4 14119 B16R1.52 COCCOC(=O)CSc1cncc(c1)C 62a_100000760492_200000040189 [0,1,0,0,0,1|2,0,0]=4 14120 B16R1.52 COCCOC(=O)CSc1cncc(c1)C 62a_200000040189_100000760492 [0,1,0,0,0,1|2,0,0]=4 14121 B16R1.52 COCCOC(=O)CSc1cncc(c1)Cl 62a_100000049639_200000040189 [0,1,0,0,0,1|2,0,0]=4 14122 B16R1.52 COCCOC(=O)CSc1cncc(c1)Cl 62a_200000040189_100000049639 [0,1,0,0,0,1|2,0,0]=4 14123 B16R1.52 COCCOC(=O)CSc1cncc(c1)F 62a_100000744099_200000040189 [0,1,0,0,0,1|2,0,0]=4 14124 B16R1.52 COCCOC(=O)CSc1cncc(c1)F 62a_200000040189_100000744099 [0,1,0,0,0,1|2,0,0]=4 14125 B16R1.52 COCCOC(=O)CSc1cncc(c1)N 62a_100000687067_200000040189 [0,1,0,0,0,1|2,0,0]=4 14126 B16R1.52 COCCOC(=O)CSc1cncc(c1)N 62a_200000040189_100000687067 [0,1,0,0,0,1|2,0,0]=4 14127 B16R1.52 COCCOC(=O)CSc1cncc(c1)O 62a_100000754920_200000040189 [0,1,0,0,0,1|2,0,0]=4 14128 B16R1.52 COCCOC(=O)CSc1cncc(c1)O 62a_200000040189_100000754920 [0,1,0,0,0,1|2,0,0]=4 14129 B16R1.52 CSCCCC(=O)CCc1cccc(c1)Br 1458a_100000173376_100011740638 [0,1,0,0,0,1|2,0,0]=4 14130 B16R1.52 CSCCCC(=O)CCc1cccc(c1)C 1458a_100000173376_100011713685 [0,1,0,0,0,1|2,0,0]=4 14131 B16R1.52 CSCCCC(=O)CCc1cccc(c1)Cl 1458a_100000173376_100011713710 [0,1,0,0,0,1|2,0,0]=4 14132 B16R1.52 CSCCCC(=O)CCc1cccc(c1)F 1458a_100000173376_100011217235 [0,1,0,0,0,1|2,0,0]=4 14133 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000173376 [0,1,0,0,0,1|2,0,0]=4 14134 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000173376 [0,1,0,0,0,1|2,0,0]=4 14135 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000173376 [0,1,0,0,0,1|2,0,0]=4 14136 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000173376 [0,1,0,0,0,1|2,0,0]=4 14137 B16R1.52 CSCCCC(=O)NCc1cccc(c1)C 11a_100000185548_100000173376 [0,1,0,0,0,1|2,0,0]=4 14138 B16R1.52 CSCCCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000173376 [0,1,0,0,0,1|2,0,0]=4 14139 B16R1.52 CSCCCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000173376 [0,1,0,0,0,1|2,0,0]=4 14140 B16R1.52 CSCCCC(=O)NCc1cccc(c1)C 527a_100000185548_100000173376 [0,1,0,0,0,1|2,0,0]=4 14141 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000173376 [0,1,0,0,0,1|2,0,0]=4 14142 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000173376 [0,1,0,0,0,1|2,0,0]=4 14143 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000173376 [0,1,0,0,0,1|2,0,0]=4 14144 B16R1.52 CSCCCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000173376 [0,1,0,0,0,1|2,0,0]=4 14145 B16R1.52 CSCCCC(=O)NCc1cccc(c1)F 11a_100000174948_100000173376 [0,1,0,0,0,1|2,0,0]=4 14146 B16R1.52 CSCCCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000173376 [0,1,0,0,0,1|2,0,0]=4 14147 B16R1.52 CSCCCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000173376 [0,1,0,0,0,1|2,0,0]=4 14148 B16R1.52 CSCCCC(=O)NCc1cccc(c1)F 527a_100000174948_100000173376 [0,1,0,0,0,1|2,0,0]=4 14149 B16R1.52 CSCCCC(=O)NCc1cccc(c1)I 11a_100000106179_100000173376 [0,1,0,0,0,1|2,0,0]=4 14150 B16R1.52 CSCCCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000173376 [0,1,0,0,0,1|2,0,0]=4 14151 B16R1.52 CSCCCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000173376 [0,1,0,0,0,1|2,0,0]=4 14152 B16R1.52 CSCCCC(=O)NCc1cccc(c1)I 527a_100000106179_100000173376 [0,1,0,0,0,1|2,0,0]=4 14153 B16R1.52 CSCCCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000173376 [0,1,0,0,0,1|2,0,0]=4 14154 B16R1.52 CSCCCC(=O)NCc1cccc(c1)O 527a_100000743036_100000173376 [0,1,0,0,0,1|2,0,0]=4 14155 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br 11a_100020590264_100000184314 [0,1,0,0,0,1|2,0,0]=4 14156 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br 1626a_100020590264_100000184314 [0,1,0,0,0,1|2,0,0]=4 14157 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br 240690a_100020590264_100000184314 [0,1,0,0,0,1|2,0,0]=4 14158 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Br 527a_100020590264_100000184314 [0,1,0,0,0,1|2,0,0]=4 14159 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C 11a_100020590264_100000234952 [0,1,0,0,0,1|2,0,0]=4 14160 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C 1626a_100020590264_100000234952 [0,1,0,0,0,1|2,0,0]=4 14161 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C 240690a_100020590264_100000234952 [0,1,0,0,0,1|2,0,0]=4 14162 B16R1.52 CSCCNC(=O)CCc1cccc(c1)C 527a_100020590264_100000234952 [0,1,0,0,0,1|2,0,0]=4 14163 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Cl 11a_100020590264_100000235675 [0,1,0,0,0,1|2,0,0]=4 14164 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Cl 1626a_100020590264_100000235675 [0,1,0,0,0,1|2,0,0]=4 14165 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Cl 240690a_100020590264_100000235675 [0,1,0,0,0,1|2,0,0]=4 14166 B16R1.52 CSCCNC(=O)CCc1cccc(c1)Cl 527a_100020590264_100000235675 [0,1,0,0,0,1|2,0,0]=4 14167 B16R1.52 CSCCNC(=O)CCc1cccc(c1)F 11a_100020590264_100000235673 [0,1,0,0,0,1|2,0,0]=4 14168 B16R1.52 CSCCNC(=O)CCc1cccc(c1)F 1626a_100020590264_100000235673 [0,1,0,0,0,1|2,0,0]=4 14169 B16R1.52 CSCCNC(=O)CCc1cccc(c1)F 240690a_100020590264_100000235673 [0,1,0,0,0,1|2,0,0]=4 14170 B16R1.52 CSCCNC(=O)CCc1cccc(c1)F 527a_100020590264_100000235673 [0,1,0,0,0,1|2,0,0]=4 14171 B16R1.52 CSCCNC(=O)CCc1cccc(c1)I 11a_100020590264_100010007846 [0,1,0,0,0,1|2,0,0]=4 14172 B16R1.52 CSCCNC(=O)CCc1cccc(c1)I 1626a_100020590264_100010007846 [0,1,0,0,0,1|2,0,0]=4 14173 B16R1.52 CSCCNC(=O)CCc1cccc(c1)I 240690a_100020590264_100010007846 [0,1,0,0,0,1|2,0,0]=4 14174 B16R1.52 CSCCNC(=O)CCc1cccc(c1)I 527a_100020590264_100010007846 [0,1,0,0,0,1|2,0,0]=4 14175 B16R1.52 CSCCNC(=O)CCc1cccc(c1)O 240690a_100020590264_100011216126 [0,1,0,0,0,1|2,0,0]=4 14176 B16R1.52 CSCCNC(=O)CCc1cccc(c1)O 527a_100020590264_100011216126 [0,1,0,0,0,1|2,0,0]=4 14177 B16R1.52 CSCCNC(=O)COc1cccc(c1)Br 11a_100020590264_100000182359 [0,1,0,0,0,1|2,0,0]=4 14178 B16R1.52 CSCCNC(=O)COc1cccc(c1)Br 1626a_100020590264_100000182359 [0,1,0,0,0,1|2,0,0]=4 14179 B16R1.52 CSCCNC(=O)COc1cccc(c1)Br 240690a_100020590264_100000182359 [0,1,0,0,0,1|2,0,0]=4 14180 B16R1.52 CSCCNC(=O)COc1cccc(c1)Br 527a_100020590264_100000182359 [0,1,0,0,0,1|2,0,0]=4 14181 B16R1.52 CSCCNC(=O)COc1cccc(c1)C 11a_100020590264_100000183606 [0,1,0,0,0,1|2,0,0]=4 14182 B16R1.52 CSCCNC(=O)COc1cccc(c1)C 1626a_100020590264_100000183606 [0,1,0,0,0,1|2,0,0]=4 14183 B16R1.52 CSCCNC(=O)COc1cccc(c1)C 240690a_100020590264_100000183606 [0,1,0,0,0,1|2,0,0]=4 14184 B16R1.52 CSCCNC(=O)COc1cccc(c1)C 527a_100020590264_100000183606 [0,1,0,0,0,1|2,0,0]=4 14185 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl 11a_100020590264_100000184978 [0,1,0,0,0,1|2,0,0]=4 14186 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl 1626a_100020590264_100000184978 [0,1,0,0,0,1|2,0,0]=4 14187 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl 240690a_100020590264_100000184978 [0,1,0,0,0,1|2,0,0]=4 14188 B16R1.52 CSCCNC(=O)COc1cccc(c1)Cl 527a_100020590264_100000184978 [0,1,0,0,0,1|2,0,0]=4 14189 B16R1.52 CSCCNC(=O)COc1cccc(c1)F 11a_100020590264_100000182781 [0,1,0,0,0,1|2,0,0]=4 14190 B16R1.52 CSCCNC(=O)COc1cccc(c1)F 1626a_100020590264_100000182781 [0,1,0,0,0,1|2,0,0]=4 14191 B16R1.52 CSCCNC(=O)COc1cccc(c1)F 240690a_100020590264_100000182781 [0,1,0,0,0,1|2,0,0]=4 14192 B16R1.52 CSCCNC(=O)COc1cccc(c1)F 527a_100020590264_100000182781 [0,1,0,0,0,1|2,0,0]=4 14193 B16R1.52 CSCCNC(=O)CSc1cccc(c1)Br 11a_100020590264_100000760868 [0,1,0,0,0,1|2,0,0]=4 14194 B16R1.52 CSCCNC(=O)CSc1cccc(c1)Br 1626a_100020590264_100000760868 [0,1,0,0,0,1|2,0,0]=4 14195 B16R1.52 CSCCNC(=O)CSc1cccc(c1)Br 240690a_100020590264_100000760868 [0,1,0,0,0,1|2,0,0]=4 14196 B16R1.52 CSCCNC(=O)CSc1cccc(c1)Br 527a_100020590264_100000760868 [0,1,0,0,0,1|2,0,0]=4 14197 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 2708a_100000174977_100020590264 [0,1,0,0,0,1|2,0,0]=4 14198 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 2708a_100020590264_100000174977 [0,1,0,0,0,1|2,0,0]=4 14199 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100020590264 [0,1,0,0,0,1|2,0,0]=4 14200 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 273464a_100020590264_100000174977 [0,1,0,0,0,1|2,0,0]=4 14201 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 512a_100000174977_100020590264 [0,1,0,0,0,1|2,0,0]=4 14202 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Br 512a_100020590264_100000174977 [0,1,0,0,0,1|2,0,0]=4 14203 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 2708a_100000185548_100020590264 [0,1,0,0,0,1|2,0,0]=4 14204 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 2708a_100020590264_100000185548 [0,1,0,0,0,1|2,0,0]=4 14205 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 273464a_100000185548_100020590264 [0,1,0,0,0,1|2,0,0]=4 14206 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 273464a_100020590264_100000185548 [0,1,0,0,0,1|2,0,0]=4 14207 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 512a_100000185548_100020590264 [0,1,0,0,0,1|2,0,0]=4 14208 B16R1.52 CSCCNC(=O)NCc1cccc(c1)C 512a_100020590264_100000185548 [0,1,0,0,0,1|2,0,0]=4 14209 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_100020590264 [0,1,0,0,0,1|2,0,0]=4 14210 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 2708a_100020590264_100000174878 [0,1,0,0,0,1|2,0,0]=4 14211 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100020590264 [0,1,0,0,0,1|2,0,0]=4 14212 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 273464a_100020590264_100000174878 [0,1,0,0,0,1|2,0,0]=4 14213 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100020590264 [0,1,0,0,0,1|2,0,0]=4 14214 B16R1.52 CSCCNC(=O)NCc1cccc(c1)Cl 512a_100020590264_100000174878 [0,1,0,0,0,1|2,0,0]=4 14215 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 2708a_100000174948_100020590264 [0,1,0,0,0,1|2,0,0]=4 14216 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 2708a_100020590264_100000174948 [0,1,0,0,0,1|2,0,0]=4 14217 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 273464a_100000174948_100020590264 [0,1,0,0,0,1|2,0,0]=4 14218 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 273464a_100020590264_100000174948 [0,1,0,0,0,1|2,0,0]=4 14219 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 512a_100000174948_100020590264 [0,1,0,0,0,1|2,0,0]=4 14220 B16R1.52 CSCCNC(=O)NCc1cccc(c1)F 512a_100020590264_100000174948 [0,1,0,0,0,1|2,0,0]=4 14221 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 2708a_100000106179_100020590264 [0,1,0,0,0,1|2,0,0]=4 14222 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 2708a_100020590264_100000106179 [0,1,0,0,0,1|2,0,0]=4 14223 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 273464a_100000106179_100020590264 [0,1,0,0,0,1|2,0,0]=4 14224 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 273464a_100020590264_100000106179 [0,1,0,0,0,1|2,0,0]=4 14225 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 512a_100000106179_100020590264 [0,1,0,0,0,1|2,0,0]=4 14226 B16R1.52 CSCCNC(=O)NCc1cccc(c1)I 512a_100020590264_100000106179 [0,1,0,0,0,1|2,0,0]=4 14227 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 2708a_100000743036_100020590264 [0,1,0,0,0,1|2,0,0]=4 14228 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 2708a_100020590264_100000743036 [0,1,0,0,0,1|2,0,0]=4 14229 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 273464a_100000743036_100020590264 [0,1,0,0,0,1|2,0,0]=4 14230 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 273464a_100020590264_100000743036 [0,1,0,0,0,1|2,0,0]=4 14231 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 512a_100000743036_100020590264 [0,1,0,0,0,1|2,0,0]=4 14232 B16R1.52 CSCCNC(=O)NCc1cccc(c1)O 512a_100020590264_100000743036 [0,1,0,0,0,1|2,0,0]=4 14233 B16R1.52 Cc1cccc(c1)CCC(=O)CCCCF 1458a_100000234952_100000729493 [0,1,0,0,0,1|2,0,0]=4 14234 B16R1.52 Cc1cccc(c1)CCC(=O)CCCCO 1458a_100000234952_100000210776 [0,1,0,0,0,1|2,0,0]=4 14235 B16R1.52 Cc1cccc(c1)CCC(=O)CCCCO 1458a_100000695505_100011713685 [0,1,0,0,0,1|2,0,0]=4 14236 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCF 11a_100015189416_100000234952 [0,1,0,0,0,1|2,0,0]=4 14237 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCF 1626a_100015189416_100000234952 [0,1,0,0,0,1|2,0,0]=4 14238 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCF 240690a_100015189416_100000234952 [0,1,0,0,0,1|2,0,0]=4 14239 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCF 527a_100015189416_100000234952 [0,1,0,0,0,1|2,0,0]=4 14240 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCO 240690a_100000182051_100000234952 [0,1,0,0,0,1|2,0,0]=4 14241 B16R1.52 Cc1cccc(c1)CCC(=O)NCCCO 527a_100000182051_100000234952 [0,1,0,0,0,1|2,0,0]=4 14242 B16R1.52 Cc1cccc(c1)CNC(=O)CCCCO 1626a_100000185548_100000695505 [0,1,0,0,0,1|2,0,0]=4 14243 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 2708a_100000185548_100015189416 [0,1,0,0,0,1|2,0,0]=4 14244 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 2708a_100015189416_100000185548 [0,1,0,0,0,1|2,0,0]=4 14245 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 273464a_100000185548_100015189416 [0,1,0,0,0,1|2,0,0]=4 14246 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 273464a_100015189416_100000185548 [0,1,0,0,0,1|2,0,0]=4 14247 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 512a_100000185548_100015189416 [0,1,0,0,0,1|2,0,0]=4 14248 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCF 512a_100015189416_100000185548 [0,1,0,0,0,1|2,0,0]=4 14249 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO 2708a_100000185548_100000182051 [0,1,0,0,0,1|2,0,0]=4 14250 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO 273464a_100000182051_100000185548 [0,1,0,0,0,1|2,0,0]=4 14251 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO 273464a_100000185548_100000182051 [0,1,0,0,0,1|2,0,0]=4 14252 B16R1.52 Cc1cccc(c1)CNC(=O)NCCCO 512a_100000185548_100000182051 [0,1,0,0,0,1|2,0,0]=4 14253 B16R1.52 Cc1cccc(c1)OCC(=O)CCCCF 1458a_100000183606_100000729493 [0,1,0,0,0,1|2,0,0]=4 14254 B16R1.52 Cc1cccc(c1)OCC(=O)CCCCO 1458a_100000183606_100000210776 [0,1,0,0,0,1|2,0,0]=4 14255 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCF 11a_100015189416_100000183606 [0,1,0,0,0,1|2,0,0]=4 14256 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCF 1626a_100015189416_100000183606 [0,1,0,0,0,1|2,0,0]=4 14257 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCF 240690a_100015189416_100000183606 [0,1,0,0,0,1|2,0,0]=4 14258 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCF 527a_100015189416_100000183606 [0,1,0,0,0,1|2,0,0]=4 14259 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCO 240690a_100000182051_100000183606 [0,1,0,0,0,1|2,0,0]=4 14260 B16R1.52 Cc1cccc(c1)OCC(=O)NCCCO 527a_100000182051_100000183606 [0,1,0,0,0,1|2,0,0]=4 14261 B16R1.52 O=C(CCCCF)CCc1cccc(c1)Br 1458a_100000184314_100000729493 [0,1,0,0,0,1|2,0,0]=4 14262 B16R1.52 O=C(CCCCF)CCc1cccc(c1)Cl 1458a_100000235675_100000729493 [0,1,0,0,0,1|2,0,0]=4 14263 B16R1.52 O=C(CCCCF)CCc1cccc(c1)F 1458a_100000235673_100000729493 [0,1,0,0,0,1|2,0,0]=4 14264 B16R1.52 O=C(CCCCF)CCc1cccc(c1)I 1458a_100010007846_100000729493 [0,1,0,0,0,1|2,0,0]=4 14265 B16R1.52 O=C(CCCCF)CCc1cccc(c1)O 1458a_100011216126_100000729493 [0,1,0,0,0,1|2,0,0]=4 14266 B16R1.52 O=C(CCCCF)COc1cccc(c1)Br 1458a_100000182359_100000729493 [0,1,0,0,0,1|2,0,0]=4 14267 B16R1.52 O=C(CCCCF)COc1cccc(c1)Cl 1458a_100000184978_100000729493 [0,1,0,0,0,1|2,0,0]=4 14268 B16R1.52 O=C(CCCCF)COc1cccc(c1)F 1458a_100000182781_100000729493 [0,1,0,0,0,1|2,0,0]=4 14269 B16R1.52 O=C(CCCCF)CSc1cccc(c1)Br 1458a_100000760868_100000729493 [0,1,0,0,0,1|2,0,0]=4 14270 B16R1.52 O=C(CCCCO)CCc1cccc(c1)Br 1458a_100000184314_100000210776 [0,1,0,0,0,1|2,0,0]=4 14271 B16R1.52 O=C(CCCCO)CCc1cccc(c1)Br 1458a_100000695505_100011740638 [0,1,0,0,0,1|2,0,0]=4 14272 B16R1.52 O=C(CCCCO)CCc1cccc(c1)Cl 1458a_100000235675_100000210776 [0,1,0,0,0,1|2,0,0]=4 14273 B16R1.52 O=C(CCCCO)CCc1cccc(c1)Cl 1458a_100000695505_100011713710 [0,1,0,0,0,1|2,0,0]=4 14274 B16R1.52 O=C(CCCCO)CCc1cccc(c1)F 1458a_100000235673_100000210776 [0,1,0,0,0,1|2,0,0]=4 14275 B16R1.52 O=C(CCCCO)CCc1cccc(c1)F 1458a_100000695505_100011217235 [0,1,0,0,0,1|2,0,0]=4 14276 B16R1.52 O=C(CCCCO)CCc1cccc(c1)I 1458a_100010007846_100000210776 [0,1,0,0,0,1|2,0,0]=4 14277 B16R1.52 O=C(CCCCO)CCc1cccc(c1)O 1458a_100011216126_100000210776 [0,1,0,0,0,1|2,0,0]=4 14278 B16R1.52 O=C(CCCCO)COc1cccc(c1)Br 1458a_100000182359_100000210776 [0,1,0,0,0,1|2,0,0]=4 14279 B16R1.52 O=C(CCCCO)COc1cccc(c1)Cl 1458a_100000184978_100000210776 [0,1,0,0,0,1|2,0,0]=4 14280 B16R1.52 O=C(CCCCO)COc1cccc(c1)F 1458a_100000182781_100000210776 [0,1,0,0,0,1|2,0,0]=4 14281 B16R1.52 O=C(CCCCO)CSc1cccc(c1)Br 1458a_100000760868_100000210776 [0,1,0,0,0,1|2,0,0]=4 14282 B16R1.52 O=C(CCCCO)NCc1cccc(c1)Br 1626a_100000174977_100000695505 [0,1,0,0,0,1|2,0,0]=4 14283 B16R1.52 O=C(CCCCO)NCc1cccc(c1)Cl 1626a_100000174878_100000695505 [0,1,0,0,0,1|2,0,0]=4 14284 B16R1.52 O=C(CCCCO)NCc1cccc(c1)F 1626a_100000174948_100000695505 [0,1,0,0,0,1|2,0,0]=4 14285 B16R1.52 O=C(CCCCO)NCc1cccc(c1)I 1626a_100000106179_100000695505 [0,1,0,0,0,1|2,0,0]=4 14286 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCF 11a_100015189416_100000184314 [0,1,0,0,0,1|2,0,0]=4 14287 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCF 1626a_100015189416_100000184314 [0,1,0,0,0,1|2,0,0]=4 14288 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCF 240690a_100015189416_100000184314 [0,1,0,0,0,1|2,0,0]=4 14289 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCF 527a_100015189416_100000184314 [0,1,0,0,0,1|2,0,0]=4 14290 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCO 240690a_100000182051_100000184314 [0,1,0,0,0,1|2,0,0]=4 14291 B16R1.52 O=C(CCc1cccc(c1)Br)NCCCO 527a_100000182051_100000184314 [0,1,0,0,0,1|2,0,0]=4 14292 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCF 11a_100015189416_100000235675 [0,1,0,0,0,1|2,0,0]=4 14293 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCF 1626a_100015189416_100000235675 [0,1,0,0,0,1|2,0,0]=4 14294 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCF 240690a_100015189416_100000235675 [0,1,0,0,0,1|2,0,0]=4 14295 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCF 527a_100015189416_100000235675 [0,1,0,0,0,1|2,0,0]=4 14296 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCO 240690a_100000182051_100000235675 [0,1,0,0,0,1|2,0,0]=4 14297 B16R1.52 O=C(CCc1cccc(c1)Cl)NCCCO 527a_100000182051_100000235675 [0,1,0,0,0,1|2,0,0]=4 14298 B16R1.52 O=C(CCc1cccc(c1)F)NCCCF 11a_100015189416_100000235673 [0,1,0,0,0,1|2,0,0]=4 14299 B16R1.52 O=C(CCc1cccc(c1)F)NCCCF 1626a_100015189416_100000235673 [0,1,0,0,0,1|2,0,0]=4 14300 B16R1.52 O=C(CCc1cccc(c1)F)NCCCF 240690a_100015189416_100000235673 [0,1,0,0,0,1|2,0,0]=4 14301 B16R1.52 O=C(CCc1cccc(c1)F)NCCCF 527a_100015189416_100000235673 [0,1,0,0,0,1|2,0,0]=4 14302 B16R1.52 O=C(CCc1cccc(c1)F)NCCCO 240690a_100000182051_100000235673 [0,1,0,0,0,1|2,0,0]=4 14303 B16R1.52 O=C(CCc1cccc(c1)F)NCCCO 527a_100000182051_100000235673 [0,1,0,0,0,1|2,0,0]=4 14304 B16R1.52 O=C(CCc1cccc(c1)I)NCCCF 11a_100015189416_100010007846 [0,1,0,0,0,1|2,0,0]=4 14305 B16R1.52 O=C(CCc1cccc(c1)I)NCCCF 1626a_100015189416_100010007846 [0,1,0,0,0,1|2,0,0]=4 14306 B16R1.52 O=C(CCc1cccc(c1)I)NCCCF 240690a_100015189416_100010007846 [0,1,0,0,0,1|2,0,0]=4 14307 B16R1.52 O=C(CCc1cccc(c1)I)NCCCF 527a_100015189416_100010007846 [0,1,0,0,0,1|2,0,0]=4 14308 B16R1.52 O=C(CCc1cccc(c1)I)NCCCO 240690a_100000182051_100010007846 [0,1,0,0,0,1|2,0,0]=4 14309 B16R1.52 O=C(CCc1cccc(c1)I)NCCCO 527a_100000182051_100010007846 [0,1,0,0,0,1|2,0,0]=4 14310 B16R1.52 O=C(CCc1cccc(c1)O)NCCCF 240690a_100015189416_100011216126 [0,1,0,0,0,1|2,0,0]=4 14311 B16R1.52 O=C(CCc1cccc(c1)O)NCCCF 527a_100015189416_100011216126 [0,1,0,0,0,1|2,0,0]=4 14312 B16R1.52 O=C(CCc1cccc(c1)O)NCCCO 240690a_100000182051_100011216126 [0,1,0,0,0,1|2,0,0]=4 14313 B16R1.52 O=C(CCc1cccc(c1)O)NCCCO 527a_100000182051_100011216126 [0,1,0,0,0,1|2,0,0]=4 14314 B16R1.52 O=C(COc1cccc(c1)Br)NCCCF 11a_100015189416_100000182359 [0,1,0,0,0,1|2,0,0]=4 14315 B16R1.52 O=C(COc1cccc(c1)Br)NCCCF 1626a_100015189416_100000182359 [0,1,0,0,0,1|2,0,0]=4 14316 B16R1.52 O=C(COc1cccc(c1)Br)NCCCF 240690a_100015189416_100000182359 [0,1,0,0,0,1|2,0,0]=4 14317 B16R1.52 O=C(COc1cccc(c1)Br)NCCCF 527a_100015189416_100000182359 [0,1,0,0,0,1|2,0,0]=4 14318 B16R1.52 O=C(COc1cccc(c1)Br)NCCCO 240690a_100000182051_100000182359 [0,1,0,0,0,1|2,0,0]=4 14319 B16R1.52 O=C(COc1cccc(c1)Br)NCCCO 527a_100000182051_100000182359 [0,1,0,0,0,1|2,0,0]=4 14320 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCF 11a_100015189416_100000184978 [0,1,0,0,0,1|2,0,0]=4 14321 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCF 1626a_100015189416_100000184978 [0,1,0,0,0,1|2,0,0]=4 14322 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCF 240690a_100015189416_100000184978 [0,1,0,0,0,1|2,0,0]=4 14323 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCF 527a_100015189416_100000184978 [0,1,0,0,0,1|2,0,0]=4 14324 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCO 240690a_100000182051_100000184978 [0,1,0,0,0,1|2,0,0]=4 14325 B16R1.52 O=C(COc1cccc(c1)Cl)NCCCO 527a_100000182051_100000184978 [0,1,0,0,0,1|2,0,0]=4 14326 B16R1.52 O=C(COc1cccc(c1)F)NCCCF 11a_100015189416_100000182781 [0,1,0,0,0,1|2,0,0]=4 14327 B16R1.52 O=C(COc1cccc(c1)F)NCCCF 1626a_100015189416_100000182781 [0,1,0,0,0,1|2,0,0]=4 14328 B16R1.52 O=C(COc1cccc(c1)F)NCCCF 240690a_100015189416_100000182781 [0,1,0,0,0,1|2,0,0]=4 14329 B16R1.52 O=C(COc1cccc(c1)F)NCCCF 527a_100015189416_100000182781 [0,1,0,0,0,1|2,0,0]=4 14330 B16R1.52 O=C(COc1cccc(c1)F)NCCCO 240690a_100000182051_100000182781 [0,1,0,0,0,1|2,0,0]=4 14331 B16R1.52 O=C(COc1cccc(c1)F)NCCCO 527a_100000182051_100000182781 [0,1,0,0,0,1|2,0,0]=4 14332 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCF 11a_100015189416_100000760868 [0,1,0,0,0,1|2,0,0]=4 14333 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCF 1626a_100015189416_100000760868 [0,1,0,0,0,1|2,0,0]=4 14334 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCF 240690a_100015189416_100000760868 [0,1,0,0,0,1|2,0,0]=4 14335 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCF 527a_100015189416_100000760868 [0,1,0,0,0,1|2,0,0]=4 14336 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCO 240690a_100000182051_100000760868 [0,1,0,0,0,1|2,0,0]=4 14337 B16R1.52 O=C(CSc1cccc(c1)Br)NCCCO 527a_100000182051_100000760868 [0,1,0,0,0,1|2,0,0]=4 14338 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 2708a_100000174977_100015189416 [0,1,0,0,0,1|2,0,0]=4 14339 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 2708a_100015189416_100000174977 [0,1,0,0,0,1|2,0,0]=4 14340 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 273464a_100000174977_100015189416 [0,1,0,0,0,1|2,0,0]=4 14341 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 273464a_100015189416_100000174977 [0,1,0,0,0,1|2,0,0]=4 14342 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 512a_100000174977_100015189416 [0,1,0,0,0,1|2,0,0]=4 14343 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Br 512a_100015189416_100000174977 [0,1,0,0,0,1|2,0,0]=4 14344 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 2708a_100000174878_100015189416 [0,1,0,0,0,1|2,0,0]=4 14345 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 2708a_100015189416_100000174878 [0,1,0,0,0,1|2,0,0]=4 14346 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 273464a_100000174878_100015189416 [0,1,0,0,0,1|2,0,0]=4 14347 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 273464a_100015189416_100000174878 [0,1,0,0,0,1|2,0,0]=4 14348 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 512a_100000174878_100015189416 [0,1,0,0,0,1|2,0,0]=4 14349 B16R1.52 O=C(NCCCF)NCc1cccc(c1)Cl 512a_100015189416_100000174878 [0,1,0,0,0,1|2,0,0]=4 14350 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 2708a_100000174948_100015189416 [0,1,0,0,0,1|2,0,0]=4 14351 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 2708a_100015189416_100000174948 [0,1,0,0,0,1|2,0,0]=4 14352 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 273464a_100000174948_100015189416 [0,1,0,0,0,1|2,0,0]=4 14353 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 273464a_100015189416_100000174948 [0,1,0,0,0,1|2,0,0]=4 14354 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 512a_100000174948_100015189416 [0,1,0,0,0,1|2,0,0]=4 14355 B16R1.52 O=C(NCCCF)NCc1cccc(c1)F 512a_100015189416_100000174948 [0,1,0,0,0,1|2,0,0]=4 14356 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 2708a_100000106179_100015189416 [0,1,0,0,0,1|2,0,0]=4 14357 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 2708a_100015189416_100000106179 [0,1,0,0,0,1|2,0,0]=4 14358 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 273464a_100000106179_100015189416 [0,1,0,0,0,1|2,0,0]=4 14359 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 273464a_100015189416_100000106179 [0,1,0,0,0,1|2,0,0]=4 14360 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 512a_100000106179_100015189416 [0,1,0,0,0,1|2,0,0]=4 14361 B16R1.52 O=C(NCCCF)NCc1cccc(c1)I 512a_100015189416_100000106179 [0,1,0,0,0,1|2,0,0]=4 14362 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 2708a_100000743036_100015189416 [0,1,0,0,0,1|2,0,0]=4 14363 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 2708a_100015189416_100000743036 [0,1,0,0,0,1|2,0,0]=4 14364 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 273464a_100000743036_100015189416 [0,1,0,0,0,1|2,0,0]=4 14365 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 273464a_100015189416_100000743036 [0,1,0,0,0,1|2,0,0]=4 14366 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 512a_100000743036_100015189416 [0,1,0,0,0,1|2,0,0]=4 14367 B16R1.52 O=C(NCCCF)NCc1cccc(c1)O 512a_100015189416_100000743036 [0,1,0,0,0,1|2,0,0]=4 14368 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Br 2708a_100000174977_100000182051 [0,1,0,0,0,1|2,0,0]=4 14369 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Br 273464a_100000174977_100000182051 [0,1,0,0,0,1|2,0,0]=4 14370 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Br 273464a_100000182051_100000174977 [0,1,0,0,0,1|2,0,0]=4 14371 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Br 512a_100000174977_100000182051 [0,1,0,0,0,1|2,0,0]=4 14372 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Cl 2708a_100000174878_100000182051 [0,1,0,0,0,1|2,0,0]=4 14373 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Cl 273464a_100000174878_100000182051 [0,1,0,0,0,1|2,0,0]=4 14374 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Cl 273464a_100000182051_100000174878 [0,1,0,0,0,1|2,0,0]=4 14375 B16R1.52 O=C(NCCCO)NCc1cccc(c1)Cl 512a_100000174878_100000182051 [0,1,0,0,0,1|2,0,0]=4 14376 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F 2708a_100000174948_100000182051 [0,1,0,0,0,1|2,0,0]=4 14377 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F 273464a_100000174948_100000182051 [0,1,0,0,0,1|2,0,0]=4 14378 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F 273464a_100000182051_100000174948 [0,1,0,0,0,1|2,0,0]=4 14379 B16R1.52 O=C(NCCCO)NCc1cccc(c1)F 512a_100000174948_100000182051 [0,1,0,0,0,1|2,0,0]=4 14380 B16R1.52 O=C(NCCCO)NCc1cccc(c1)I 2708a_100000106179_100000182051 [0,1,0,0,0,1|2,0,0]=4 14381 B16R1.52 O=C(NCCCO)NCc1cccc(c1)I 273464a_100000106179_100000182051 [0,1,0,0,0,1|2,0,0]=4 14382 B16R1.52 O=C(NCCCO)NCc1cccc(c1)I 273464a_100000182051_100000106179 [0,1,0,0,0,1|2,0,0]=4 14383 B16R1.52 O=C(NCCCO)NCc1cccc(c1)I 512a_100000106179_100000182051 [0,1,0,0,0,1|2,0,0]=4 14384 B16R1.52 O=C(NCCCO)NCc1cccc(c1)O 2708a_100000743036_100000182051 [0,1,0,0,0,1|2,0,0]=4 14385 B16R1.52 O=C(NCCCO)NCc1cccc(c1)O 273464a_100000182051_100000743036 [0,1,0,0,0,1|2,0,0]=4 14386 B16R1.52 O=C(NCCCO)NCc1cccc(c1)O 273464a_100000743036_100000182051 [0,1,0,0,0,1|2,0,0]=4 14387 B16R1.52 O=C(NCCCO)NCc1cccc(c1)O 512a_100000743036_100000182051 [0,1,0,0,0,1|2,0,0]=4 14388 B16R1.608 CC(=O)CCCC(=O)CCc1ccccc1 1458a_100000185753_100011215641 [0,1,0,0,0,1|1,0,1]=4 14389 B16R1.608 CC(=O)CCCC(=O)COc1ccccc1 1458a_100000186222_100011215641 [0,1,0,0,0,1|1,0,1]=4 14390 B16R1.608 CC(=O)CCCC(=O)CSc1ccccc1 1458a_100000211596_100011215641 [0,1,0,0,0,1|1,0,1]=4 14391 B16R1.608 CC(=O)CCCC(=O)OCc1ccccc1 1458a_100000070787_100009813218 [0,1,0,0,0,1|1,0,1]=4 14392 B16R1.608 CC(=O)CCCC(=O)OCc1ccccc1 1458a_100010293158_200000210301 [0,1,0,0,0,1|1,0,1]=4 14393 B16R1.608 CC(=O)CCNC(=O)OCc1ccccc1 1458a_100000070787_100012357035 [0,1,0,0,0,1|1,0,1]=4 14394 B16R1.608 CC(=O)CCNC(=O)OCc1ccccc1 1458a_100000236050_200000210301 [0,1,0,0,0,1|1,0,1]=4 14395 B16R1.608 CC(Br)COCC(=O)CCc1ccccc1 34a_100012180447_100012361361 [0,1,0,0,0,1|2,0,0]=4 14396 B16R1.608 CC(Br)COCC(=O)NCc1ccccc1 34a_100012180447_100000183539 [0,1,0,0,0,1|2,0,0]=4 14397 B16R1.608 CC(Br)COCC(=O)OCc1ccccc1 34a_100012180447_100000753625 [0,1,0,0,0,1|2,0,0]=4 14398 B16R1.608 CC(C)CCCC(=O)C#Cc1ccccc1 1458a_100000736102_100011214892 [0,1,0,0,0,1|1,0,1]=4 14399 B16R1.608 CC(C)CCCC(=O)C=Cc1ccccc1 1458a_100000210462_100011214892 [0,1,0,0,0,1|1,0,1]=4 14400 B16R1.608 CC(C)CCCC(=O)CCc1ccccc1 1458a_100000185753_100011214892 [0,1,0,0,0,1|1,0,0]=3 14401 B16R1.608 CC(C)CCCC(=O)CCc1ccccc1 1458a_100011216857_100000765856 [0,1,0,0,0,1|1,0,0]=3 14402 B16R1.608 CC(C)CCCC(=O)CCc1ccccn1 1458a_100011216857_100015183660 [0,1,0,0,0,1|2,0,0]=4 14403 B16R1.608 CC(C)CCCC(=O)CCc1ccccn1 1458a_100015195070_100011214892 [0,1,0,0,0,1|2,0,0]=4 14404 B16R1.608 CC(C)CCCC(=O)CCc1cccnc1 1458a_100000198484_100011214892 [0,1,0,0,0,1|2,0,0]=4 14405 B16R1.608 CC(C)CCCC(=O)CCc1cccnc1 1458a_100011216857_200011713674 [0,1,0,0,0,1|2,0,0]=4 14406 B16R1.608 CC(C)CCCC(=O)CCc1ccncc1 1458a_100011216857_100000723409 [0,1,0,0,0,1|2,0,0]=4 14407 B16R1.608 CC(C)CCCC(=O)CCc1ccncc1 1458a_100011225043_100011214892 [0,1,0,0,0,1|2,0,0]=4 14408 B16R1.608 CC(C)CCCC(=O)COc1ccccc1 1458a_100000186222_100011214892 [0,1,0,0,0,1|1,0,0]=3 14409 B16R1.608 CC(C)CCCC(=O)COc1ccccn1 1458a_100102699861_100011214892 [0,1,0,0,0,1|2,0,0]=4 14410 B16R1.608 CC(C)CCCC(=O)COc1cccnc1 1458a_100015207166_100011214892 [0,1,0,0,0,1|2,0,0]=4 14411 B16R1.608 CC(C)CCCC(=O)CSc1ccccc1 1458a_100000211596_100011214892 [0,1,0,0,0,1|1,0,0]=3 14412 B16R1.608 CC(C)CCCC(=O)CSc1ccccn1 1458a_100000156281_100011214892 [0,1,0,0,0,1|2,0,0]=4 14413 B16R1.608 CC(C)CCCC(=O)CSc1ccncc1 1458a_100000211328_100011214892 [0,1,0,0,0,1|2,0,0]=4 14414 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 11a_100015324214_100011216857 [0,1,0,0,0,1|1,0,0]=3 14415 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 1626a_100015324214_100011216857 [0,1,0,0,0,1|1,0,0]=3 14416 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 240690a_100015324214_100011216857 [0,1,0,0,0,1|1,0,0]=3 14417 B16R1.608 CC(C)CCCC(=O)NCc1ccccc1 527a_100015324214_100011216857 [0,1,0,0,0,1|1,0,0]=3 14418 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 11a_100000210449_100011216857 [0,1,0,0,0,1|2,0,0]=4 14419 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 1626a_100000210449_100011216857 [0,1,0,0,0,1|2,0,0]=4 14420 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 240690a_100000210449_100011216857 [0,1,0,0,0,1|2,0,0]=4 14421 B16R1.608 CC(C)CCCC(=O)NCc1ccccn1 527a_100000210449_100011216857 [0,1,0,0,0,1|2,0,0]=4 14422 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 11a_100000210453_100011216857 [0,1,0,0,0,1|2,0,0]=4 14423 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 240690a_100000210453_100011216857 [0,1,0,0,0,1|2,0,0]=4 14424 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 527a_100000210453_100011216857 [0,1,0,0,0,1|2,0,0]=4 14425 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 11a_100000210450_100011216857 [0,1,0,0,0,1|2,0,0]=4 14426 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 1626a_100000210450_100011216857 [0,1,0,0,0,1|2,0,0]=4 14427 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 240690a_100000210450_100011216857 [0,1,0,0,0,1|2,0,0]=4 14428 B16R1.608 CC(C)CCCC(=O)NCc1ccncc1 527a_100000210450_100011216857 [0,1,0,0,0,1|2,0,0]=4 14429 B16R1.608 CC(C)CCCC(=O)NNc1ccccc1 22a_100015195140_100011216857 [0,1,0,0,0,1|2,0,0]=4 14430 B16R1.608 CC(C)CCNC(=O)C#Cc1ccccc1 240690a_100000210545_100000736102 [0,1,0,0,0,1|1,0,1]=4 14431 B16R1.608 CC(C)CCNC(=O)C=Cc1ccccc1 11a_100000210545_100000210462 [0,1,0,0,0,1|1,0,1]=4 14432 B16R1.608 CC(C)CCNC(=O)C=Cc1ccccc1 1626a_100000210545_100000210462 [0,1,0,0,0,1|1,0,1]=4 14433 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 11a_100000210545_100000185753 [0,1,0,0,0,1|1,0,0]=3 14434 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 1626a_100000210545_100000185753 [0,1,0,0,0,1|1,0,0]=3 14435 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 240690a_100000210545_100000185753 [0,1,0,0,0,1|1,0,0]=3 14436 B16R1.608 CC(C)CCNC(=O)CCc1ccccc1 527a_100000210545_100000185753 [0,1,0,0,0,1|1,0,0]=3 14437 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 11a_100000210545_100015195070 [0,1,0,0,0,1|2,0,0]=4 14438 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 240690a_100000210545_100015195070 [0,1,0,0,0,1|2,0,0]=4 14439 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 527a_100000210545_100015195070 [0,1,0,0,0,1|2,0,0]=4 14440 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 11a_100000210545_100000198484 [0,1,0,0,0,1|2,0,0]=4 14441 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 1626a_100000210545_100000198484 [0,1,0,0,0,1|2,0,0]=4 14442 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 240690a_100000210545_100000198484 [0,1,0,0,0,1|2,0,0]=4 14443 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 527a_100000210545_100000198484 [0,1,0,0,0,1|2,0,0]=4 14444 B16R1.608 CC(C)CCNC(=O)CCc1ccncc1 11a_100000210545_100011225043 [0,1,0,0,0,1|2,0,0]=4 14445 B16R1.608 CC(C)CCNC(=O)CCc1ccncc1 240690a_100000210545_100011225043 [0,1,0,0,0,1|2,0,0]=4 14446 B16R1.608 CC(C)CCNC(=O)CCc1ccncc1 527a_100000210545_100011225043 [0,1,0,0,0,1|2,0,0]=4 14447 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 11a_100000210545_100000186222 [0,1,0,0,0,1|1,0,0]=3 14448 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 1626a_100000210545_100000186222 [0,1,0,0,0,1|1,0,0]=3 14449 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 240690a_100000210545_100000186222 [0,1,0,0,0,1|1,0,0]=3 14450 B16R1.608 CC(C)CCNC(=O)COc1ccccc1 527a_100000210545_100000186222 [0,1,0,0,0,1|1,0,0]=3 14451 B16R1.608 CC(C)CCNC(=O)COc1ccccn1 1626a_100000210545_100102699861 [0,1,0,0,0,1|2,0,0]=4 14452 B16R1.608 CC(C)CCNC(=O)COc1ccccn1 240690a_100000210545_100102699861 [0,1,0,0,0,1|2,0,0]=4 14453 B16R1.608 CC(C)CCNC(=O)COc1ccccn1 527a_100000210545_100102699861 [0,1,0,0,0,1|2,0,0]=4 14454 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 11a_100000210545_100015207166 [0,1,0,0,0,1|2,0,0]=4 14455 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 1626a_100000210545_100015207166 [0,1,0,0,0,1|2,0,0]=4 14456 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 240690a_100000210545_100015207166 [0,1,0,0,0,1|2,0,0]=4 14457 B16R1.608 CC(C)CCNC(=O)COc1cccnc1 527a_100000210545_100015207166 [0,1,0,0,0,1|2,0,0]=4 14458 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 11a_100000210545_100000211596 [0,1,0,0,0,1|1,0,0]=3 14459 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 1626a_100000210545_100000211596 [0,1,0,0,0,1|1,0,0]=3 14460 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 240690a_100000210545_100000211596 [0,1,0,0,0,1|1,0,0]=3 14461 B16R1.608 CC(C)CCNC(=O)CSc1ccccc1 527a_100000210545_100000211596 [0,1,0,0,0,1|1,0,0]=3 14462 B16R1.608 CC(C)CCNC(=O)CSc1ccccn1 11a_100000210545_100000156281 [0,1,0,0,0,1|2,0,0]=4 14463 B16R1.608 CC(C)CCNC(=O)CSc1ccccn1 240690a_100000210545_100000156281 [0,1,0,0,0,1|2,0,0]=4 14464 B16R1.608 CC(C)CCNC(=O)CSc1ccccn1 527a_100000210545_100000156281 [0,1,0,0,0,1|2,0,0]=4 14465 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 11a_100000210545_100000211328 [0,1,0,0,0,1|2,0,0]=4 14466 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 1626a_100000210545_100000211328 [0,1,0,0,0,1|2,0,0]=4 14467 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 240690a_100000210545_100000211328 [0,1,0,0,0,1|2,0,0]=4 14468 B16R1.608 CC(C)CCNC(=O)CSc1ccncc1 527a_100000210545_100000211328 [0,1,0,0,0,1|2,0,0]=4 14469 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 2708a_100000210545_100015324214 [0,1,0,0,0,1|1,0,0]=3 14470 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 2708a_100015324214_100000210545 [0,1,0,0,0,1|1,0,0]=3 14471 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 273464a_100000210545_100015324214 [0,1,0,0,0,1|1,0,0]=3 14472 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 273464a_100015324214_100000210545 [0,1,0,0,0,1|1,0,0]=3 14473 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 512a_100000210545_100015324214 [0,1,0,0,0,1|1,0,0]=3 14474 B16R1.608 CC(C)CCNC(=O)NCc1ccccc1 512a_100015324214_100000210545 [0,1,0,0,0,1|1,0,0]=3 14475 B16R1.608 CC(C)CCNC(=O)NCc1ccccn1 2708a_100000210449_100000210545 [0,1,0,0,0,1|2,0,0]=4 14476 B16R1.608 CC(C)CCNC(=O)NCc1ccccn1 2708a_100000210545_100000210449 [0,1,0,0,0,1|2,0,0]=4 14477 B16R1.608 CC(C)CCNC(=O)NCc1ccccn1 273464a_100000210449_100000210545 [0,1,0,0,0,1|2,0,0]=4 14478 B16R1.608 CC(C)CCNC(=O)NCc1ccccn1 273464a_100000210545_100000210449 [0,1,0,0,0,1|2,0,0]=4 14479 B16R1.608 CC(C)CCNC(=O)NCc1ccccn1 512a_100000210545_100000210449 [0,1,0,0,0,1|2,0,0]=4 14480 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 2708a_100000210453_100000210545 [0,1,0,0,0,1|2,0,0]=4 14481 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 2708a_100000210545_100000210453 [0,1,0,0,0,1|2,0,0]=4 14482 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 273464a_100000210453_100000210545 [0,1,0,0,0,1|2,0,0]=4 14483 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 273464a_100000210545_100000210453 [0,1,0,0,0,1|2,0,0]=4 14484 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 512a_100000210453_100000210545 [0,1,0,0,0,1|2,0,0]=4 14485 B16R1.608 CC(C)CCNC(=O)NCc1cccnc1 512a_100000210545_100000210453 [0,1,0,0,0,1|2,0,0]=4 14486 B16R1.608 CC(C)CCNC(=O)NCc1ccncc1 2708a_100000210450_100000210545 [0,1,0,0,0,1|2,0,0]=4 14487 B16R1.608 CC(C)CCNC(=O)NCc1ccncc1 2708a_100000210545_100000210450 [0,1,0,0,0,1|2,0,0]=4 14488 B16R1.608 CC(C)CCNC(=O)NCc1ccncc1 273464a_100000210450_100000210545 [0,1,0,0,0,1|2,0,0]=4 14489 B16R1.608 CC(C)CCNC(=O)NCc1ccncc1 273464a_100000210545_100000210450 [0,1,0,0,0,1|2,0,0]=4 14490 B16R1.608 CC(C)CCNC(=O)NCc1ccncc1 512a_100000210545_100000210450 [0,1,0,0,0,1|2,0,0]=4 14491 B16R1.608 CC(C)CCNC(=O)NNc1ccccc1 273464a_100000210545_100015195140 [0,1,0,0,0,1|2,0,0]=4 14492 B16R1.608 CC(C)CCNC(=O)NNc1ccccc1 512a_100000210545_100015195140 [0,1,0,0,0,1|2,0,0]=4 14493 B16R1.608 CC(C)CCOC(C)COc1ccccc1 34a_100000210911_100000210312 [0,1,0,0,0,1|1,0,1]=4 14494 B16R1.608 CC(C)CCOC(C)COc1ccccc1 7a_100000210911_100000210626 [0,1,0,0,0,1|1,0,1]=4 14495 B16R1.608 CC(C)CCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000210312 [0,1,0,0,0,1|1,0,1]=4 14496 B16R1.608 CC(C)CCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000210626 [0,1,0,0,0,1|1,0,1]=4 14497 B16R1.608 CC(C)CNCC(=O)CCc1ccccc1 2230a_100000210953_100012361361 [0,1,0,0,0,1|2,0,0]=4 14498 B16R1.608 CC(C)CNCC(=O)CCc1ccccc1 34a_100000210953_100012361361 [0,1,0,0,0,1|2,0,0]=4 14499 B16R1.608 CC(C)CNCC(=O)NCc1ccccc1 2230a_100000210953_100000183539 [0,1,0,0,0,1|2,0,0]=4 14500 B16R1.608 CC(C)CNCC(=O)NCc1ccccc1 2230a_100000739245_100000210760 [0,1,0,0,0,1|2,0,0]=4 14501 B16R1.608 CC(C)CNCC(=O)NCc1ccccc1 270004a_100000739245_100000210432 [0,1,0,0,0,1|2,0,0]=4 14502 B16R1.608 CC(C)CNCC(=O)NCc1ccccc1 34a_100000210953_100000183539 [0,1,0,0,0,1|2,0,0]=4 14503 B16R1.608 CC(C)CNCC(=O)OCc1ccccc1 2230a_100000210953_100000753625 [0,1,0,0,0,1|2,0,0]=4 14504 B16R1.608 CC(C)CNCC(=O)OCc1ccccc1 34a_100000210953_100000753625 [0,1,0,0,0,1|2,0,0]=4 14505 B16R1.608 CC(C)CNNC(=O)CCc1ccccc1 22a_100000696102_100000185753 [0,1,0,0,0,1|2,0,0]=4 14506 B16R1.608 CC(C)CNNC(=O)COc1ccccc1 22a_100000696102_100000186222 [0,1,0,0,0,1|2,0,0]=4 14507 B16R1.608 CC(C)CNNC(=O)CSc1ccccc1 22a_100000696102_100000211596 [0,1,0,0,0,1|2,0,0]=4 14508 B16R1.608 CC(C)CNNC(=O)NCc1ccccc1 273464a_100015324214_100000696102 [0,1,0,0,0,1|2,0,0]=4 14509 B16R1.608 CC(C)CNNC(=O)NCc1ccccc1 512a_100000696102_100015324214 [0,1,0,0,0,1|2,0,0]=4 14510 B16R1.608 CC(C)CNNC(=O)NCc1ccccc1 512a_100015324214_100000696102 [0,1,0,0,0,1|2,0,0]=4 14511 B16R1.608 CC(C)COCC(=O)CCc1ccccc1 1458a_100011223364_100000765856 [0,1,0,0,0,1|2,0,0]=4 14512 B16R1.608 CC(C)COCC(=O)CCc1ccccc1 34a_100000210257_100012361361 [0,1,0,0,0,1|2,0,0]=4 14513 B16R1.608 CC(C)COCC(=O)NCc1ccccc1 11a_100015324214_100011223364 [0,1,0,0,0,1|2,0,0]=4 14514 B16R1.608 CC(C)COCC(=O)NCc1ccccc1 1626a_100015324214_100011223364 [0,1,0,0,0,1|2,0,0]=4 14515 B16R1.608 CC(C)COCC(=O)NCc1ccccc1 240690a_100015324214_100011223364 [0,1,0,0,0,1|2,0,0]=4 14516 B16R1.608 CC(C)COCC(=O)NCc1ccccc1 34a_100000210257_100000183539 [0,1,0,0,0,1|2,0,0]=4 14517 B16R1.608 CC(C)COCC(=O)NCc1ccccc1 527a_100015324214_100011223364 [0,1,0,0,0,1|2,0,0]=4 14518 B16R1.608 CC(C)COCC(=O)OCc1ccccc1 34a_100000210257_100000753625 [0,1,0,0,0,1|2,0,0]=4 14519 B16R1.608 CC(C)CSCC(=O)CCc1ccccc1 62a_100000210624_100012361361 [0,1,0,0,0,1|2,0,0]=4 14520 B16R1.608 CC(C)CSCC(=O)CCc1ccccc1 62a_100012361361_100000210760 [0,1,0,0,0,1|2,0,0]=4 14521 B16R1.608 CC(C)CSCC(=O)NCc1ccccc1 62a_100000183539_100000210760 [0,1,0,0,0,1|2,0,0]=4 14522 B16R1.608 CC(C)CSCC(=O)NCc1ccccc1 62a_100000210624_100000183539 [0,1,0,0,0,1|2,0,0]=4 14523 B16R1.608 CC(C)CSCC(=O)OCc1ccccc1 62a_100000210624_100000753625 [0,1,0,0,0,1|2,0,0]=4 14524 B16R1.608 CC(C)CSCC(=O)OCc1ccccc1 62a_100000753625_100000210760 [0,1,0,0,0,1|2,0,0]=4 14525 B16R1.608 CC(C)NCCC(=O)NCc1ccccc1 2230a_100025741942_100000210206 [0,1,0,0,0,1|2,0,0]=4 14526 B16R1.608 CC(C)NCCC(=O)NCc1ccccc1 34a_100025741942_100000210206 [0,1,0,0,0,1|2,0,0]=4 14527 B16R1.608 CC(C)NCCC(=O)OCc1ccccc1 2230a_100138425928_100009813219 [0,1,0,0,0,1|2,0,0]=4 14528 B16R1.608 CC(C)OCCC(=O)CCc1ccccc1 1458a_100000185753_100000211751 [0,1,0,0,0,1|2,0,0]=4 14529 B16R1.608 CC(C)OCCC(=O)COc1ccccc1 1458a_100000186222_100000211751 [0,1,0,0,0,1|2,0,0]=4 14530 B16R1.608 CC(C)OCCC(=O)CSc1ccccc1 1458a_100000211596_100000211751 [0,1,0,0,0,1|2,0,0]=4 14531 B16R1.608 CC(C)OCCC(=O)OCc1ccccc1 7a_100009831632_100000210206 [0,1,0,0,0,1|2,0,0]=4 14532 B16R1.608 CC(C)SCCC(=O)CCc1ccccc1 1458a_100000185753_100000730970 [0,1,0,0,0,1|2,0,0]=4 14533 B16R1.608 CC(C)SCCC(=O)COc1ccccc1 1458a_100000186222_100000730970 [0,1,0,0,0,1|2,0,0]=4 14534 B16R1.608 CC(C)SCCC(=O)CSc1ccccc1 1458a_100000211596_100000730970 [0,1,0,0,0,1|2,0,0]=4 14535 B16R1.608 CC(C)SCCC(=O)OCc1ccccc1 62a_100000210206_100009813219 [0,1,0,0,0,1|2,0,0]=4 14536 B16R1.608 CC(C)SCCC(=O)OCc1ccccc1 62a_100009813219_100000210206 [0,1,0,0,0,1|2,0,0]=4 14537 B16R1.608 CC(F)COCC(=O)CCc1ccccc1 34a_100015925927_100012361361 [0,1,0,0,0,1|2,0,0]=4 14538 B16R1.608 CC(F)COCC(=O)NCc1ccccc1 34a_100015925927_100000183539 [0,1,0,0,0,1|2,0,0]=4 14539 B16R1.608 CC(F)COCC(=O)OCc1ccccc1 34a_100015925927_100000753625 [0,1,0,0,0,1|2,0,0]=4 14540 B16R1.608 CC(O)CCCC(=O)C#Cc1ccccc1 1458a_100000736102_200000718107 [0,1,0,0,0,1|1,0,1]=4 14541 B16R1.608 CC(O)CCCC(=O)C=Cc1ccccc1 1458a_100000210462_200000718107 [0,1,0,0,0,1|1,0,1]=4 14542 B16R1.608 CC(O)CCCC(=O)CCc1ccccc1 1458a_100000185753_200000718107 [0,1,0,0,0,1|1,0,0]=3 14543 B16R1.608 CC(O)CCCC(=O)CCc1ccccn1 1458a_100015195070_200000718107 [0,1,0,0,0,1|2,0,0]=4 14544 B16R1.608 CC(O)CCCC(=O)CCc1cccnc1 1458a_100000198484_200000718107 [0,1,0,0,0,1|2,0,0]=4 14545 B16R1.608 CC(O)CCCC(=O)CCc1ccncc1 1458a_100011225043_200000718107 [0,1,0,0,0,1|2,0,0]=4 14546 B16R1.608 CC(O)CCCC(=O)COc1ccccc1 1458a_100000186222_200000718107 [0,1,0,0,0,1|1,0,0]=3 14547 B16R1.608 CC(O)CCCC(=O)COc1ccccn1 1458a_100102699861_200000718107 [0,1,0,0,0,1|2,0,0]=4 14548 B16R1.608 CC(O)CCCC(=O)COc1cccnc1 1458a_100015207166_200000718107 [0,1,0,0,0,1|2,0,0]=4 14549 B16R1.608 CC(O)CCCC(=O)CSc1ccccc1 1458a_100000211596_200000718107 [0,1,0,0,0,1|1,0,0]=3 14550 B16R1.608 CC(O)CCCC(=O)CSc1ccccn1 1458a_100000156281_200000718107 [0,1,0,0,0,1|2,0,0]=4 14551 B16R1.608 CC(O)CCCC(=O)CSc1ccncc1 1458a_100000211328_200000718107 [0,1,0,0,0,1|2,0,0]=4 14552 B16R1.608 CC(O)CCCC(=O)NCc1ccccc1 1626a_100015324214_100000761597 [0,1,0,0,0,1|1,0,0]=3 14553 B16R1.608 CC(O)CCCC(=O)NCc1ccccc1 527a_100015324214_100000761597 [0,1,0,0,0,1|1,0,0]=3 14554 B16R1.608 CC(O)CCCC(=O)NCc1ccccn1 1626a_100000210449_100000761597 [0,1,0,0,0,1|2,0,0]=4 14555 B16R1.608 CC(O)CCCC(=O)NCc1ccccn1 527a_100000210449_100000761597 [0,1,0,0,0,1|2,0,0]=4 14556 B16R1.608 CC(O)CCCC(=O)NCc1cccnc1 527a_100000210453_100000761597 [0,1,0,0,0,1|2,0,0]=4 14557 B16R1.608 CC(O)CCCC(=O)NCc1ccncc1 1626a_100000210450_100000761597 [0,1,0,0,0,1|2,0,0]=4 14558 B16R1.608 CC(O)CCCC(=O)NCc1ccncc1 527a_100000210450_100000761597 [0,1,0,0,0,1|2,0,0]=4 14559 B16R1.608 CC(O)CCCC(=O)NNc1ccccc1 22a_100015195140_100000761597 [0,1,0,0,0,1|2,0,0]=4 14560 B16R1.608 CC(O)CCNC(=O)C#Cc1ccccc1 240690a_200000755665_100000736102 [0,1,0,0,0,1|1,0,1]=4 14561 B16R1.608 CC(O)CCNC(=O)CCc1ccccc1 240690a_200000755665_100000185753 [0,1,0,0,0,1|1,0,0]=3 14562 B16R1.608 CC(O)CCNC(=O)CCc1ccccc1 527a_200000755665_100000185753 [0,1,0,0,0,1|1,0,0]=3 14563 B16R1.608 CC(O)CCNC(=O)CCc1ccccn1 240690a_200000755665_100015195070 [0,1,0,0,0,1|2,0,0]=4 14564 B16R1.608 CC(O)CCNC(=O)CCc1ccccn1 527a_200000755665_100015195070 [0,1,0,0,0,1|2,0,0]=4 14565 B16R1.608 CC(O)CCNC(=O)CCc1cccnc1 240690a_200000755665_100000198484 [0,1,0,0,0,1|2,0,0]=4 14566 B16R1.608 CC(O)CCNC(=O)CCc1cccnc1 527a_200000755665_100000198484 [0,1,0,0,0,1|2,0,0]=4 14567 B16R1.608 CC(O)CCNC(=O)CCc1ccncc1 240690a_200000755665_100011225043 [0,1,0,0,0,1|2,0,0]=4 14568 B16R1.608 CC(O)CCNC(=O)CCc1ccncc1 527a_200000755665_100011225043 [0,1,0,0,0,1|2,0,0]=4 14569 B16R1.608 CC(O)CCNC(=O)COc1ccccc1 240690a_200000755665_100000186222 [0,1,0,0,0,1|1,0,0]=3 14570 B16R1.608 CC(O)CCNC(=O)COc1ccccc1 527a_200000755665_100000186222 [0,1,0,0,0,1|1,0,0]=3 14571 B16R1.608 CC(O)CCNC(=O)COc1ccccn1 240690a_200000755665_100102699861 [0,1,0,0,0,1|2,0,0]=4 14572 B16R1.608 CC(O)CCNC(=O)COc1ccccn1 527a_200000755665_100102699861 [0,1,0,0,0,1|2,0,0]=4 14573 B16R1.608 CC(O)CCNC(=O)COc1cccnc1 240690a_200000755665_100015207166 [0,1,0,0,0,1|2,0,0]=4 14574 B16R1.608 CC(O)CCNC(=O)COc1cccnc1 527a_200000755665_100015207166 [0,1,0,0,0,1|2,0,0]=4 14575 B16R1.608 CC(O)CCNC(=O)CSc1ccccc1 240690a_200000755665_100000211596 [0,1,0,0,0,1|1,0,0]=3 14576 B16R1.608 CC(O)CCNC(=O)CSc1ccccc1 527a_200000755665_100000211596 [0,1,0,0,0,1|1,0,0]=3 14577 B16R1.608 CC(O)CCNC(=O)CSc1ccccn1 240690a_200000755665_100000156281 [0,1,0,0,0,1|2,0,0]=4 14578 B16R1.608 CC(O)CCNC(=O)CSc1ccccn1 527a_200000755665_100000156281 [0,1,0,0,0,1|2,0,0]=4 14579 B16R1.608 CC(O)CCNC(=O)CSc1ccncc1 240690a_200000755665_100000211328 [0,1,0,0,0,1|2,0,0]=4 14580 B16R1.608 CC(O)CCNC(=O)CSc1ccncc1 527a_200000755665_100000211328 [0,1,0,0,0,1|2,0,0]=4 14581 B16R1.608 CC(O)CCNC(=O)NCc1ccccc1 2708a_100015324214_200000755665 [0,1,0,0,0,1|1,0,0]=3 14582 B16R1.608 CC(O)CCNC(=O)NCc1ccccc1 273464a_200000755665_100015324214 [0,1,0,0,0,1|1,0,0]=3 14583 B16R1.608 CC(O)CCNC(=O)NCc1ccccc1 512a_100015324214_200000755665 [0,1,0,0,0,1|1,0,0]=3 14584 B16R1.608 CC(O)CCNC(=O)NCc1ccccc1 512a_200000755665_100015324214 [0,1,0,0,0,1|1,0,0]=3 14585 B16R1.608 CC(O)CCNC(=O)NCc1ccccn1 2708a_100000210449_200000755665 [0,1,0,0,0,1|2,0,0]=4 14586 B16R1.608 CC(O)CCNC(=O)NCc1ccccn1 273464a_200000755665_100000210449 [0,1,0,0,0,1|2,0,0]=4 14587 B16R1.608 CC(O)CCNC(=O)NCc1ccccn1 512a_200000755665_100000210449 [0,1,0,0,0,1|2,0,0]=4 14588 B16R1.608 CC(O)CCNC(=O)NCc1cccnc1 2708a_100000210453_200000755665 [0,1,0,0,0,1|2,0,0]=4 14589 B16R1.608 CC(O)CCNC(=O)NCc1cccnc1 273464a_200000755665_100000210453 [0,1,0,0,0,1|2,0,0]=4 14590 B16R1.608 CC(O)CCNC(=O)NCc1cccnc1 512a_100000210453_200000755665 [0,1,0,0,0,1|2,0,0]=4 14591 B16R1.608 CC(O)CCNC(=O)NCc1cccnc1 512a_200000755665_100000210453 [0,1,0,0,0,1|2,0,0]=4 14592 B16R1.608 CC(O)CCNC(=O)NCc1ccncc1 2708a_100000210450_200000755665 [0,1,0,0,0,1|2,0,0]=4 14593 B16R1.608 CC(O)CCNC(=O)NCc1ccncc1 273464a_200000755665_100000210450 [0,1,0,0,0,1|2,0,0]=4 14594 B16R1.608 CC(O)CCNC(=O)NCc1ccncc1 512a_200000755665_100000210450 [0,1,0,0,0,1|2,0,0]=4 14595 B16R1.608 CC(O)CCNC(=O)NNc1ccccc1 273464a_200000755665_100015195140 [0,1,0,0,0,1|2,0,0]=4 14596 B16R1.608 CC(O)CCNC(=O)NNc1ccccc1 512a_200000755665_100015195140 [0,1,0,0,0,1|2,0,0]=4 14597 B16R1.608 CC(O)CCOC(C)COc1ccccc1 34a_100000210911_100012276601 [0,1,0,0,0,1|1,0,1]=4 14598 B16R1.608 CC(O)CCOC(C)COc1ccccc1 7a_100000210911_100012276601 [0,1,0,0,0,1|1,0,1]=4 14599 B16R1.608 CC(O)CCO[C@@H](C)CCc1ccccc1 34a_100009815974_100012276601 [0,1,0,0,0,1|1,0,1]=4 14600 B16R1.608 CC(O)CCO[C@@H](C)CCc1ccccc1 7a_100009815974_100012276601 [0,1,0,0,0,1|1,0,1]=4 14601 B16R1.608 CC(O)CNCC(=O)CCc1ccccc1 2230a_100000210904_100012361361 [0,1,0,0,0,1|2,0,0]=4 14602 B16R1.608 CC(O)CNCC(=O)CCc1ccccc1 34a_100000210904_100012361361 [0,1,0,0,0,1|2,0,0]=4 14603 B16R1.608 CC(O)CNCC(=O)NCc1ccccc1 2230a_100000210904_100000183539 [0,1,0,0,0,1|2,0,0]=4 14604 B16R1.608 CC(O)CNCC(=O)NCc1ccccc1 2230a_100000739245_100011218427 [0,1,0,0,0,1|2,0,0]=4 14605 B16R1.608 CC(O)CNCC(=O)NCc1ccccc1 34a_100000210904_100000183539 [0,1,0,0,0,1|2,0,0]=4 14606 B16R1.608 CC(O)CNCC(=O)OCc1ccccc1 2230a_100000210904_100000753625 [0,1,0,0,0,1|2,0,0]=4 14607 B16R1.608 CC(O)CNCC(=O)OCc1ccccc1 34a_100000210904_100000753625 [0,1,0,0,0,1|2,0,0]=4 14608 B16R1.608 CC(O)CNNC(=O)CCc1ccccc1 22a_200000730056_100000185753 [0,1,0,0,0,1|2,0,0]=4 14609 B16R1.608 CC(O)CNNC(=O)COc1ccccc1 22a_200000730056_100000186222 [0,1,0,0,0,1|2,0,0]=4 14610 B16R1.608 CC(O)CNNC(=O)CSc1ccccc1 22a_200000730056_100000211596 [0,1,0,0,0,1|2,0,0]=4 14611 B16R1.608 CC(O)CNNC(=O)NCc1ccccc1 512a_100015324214_200000730056 [0,1,0,0,0,1|2,0,0]=4 14612 B16R1.608 CC(O)CNNC(=O)NCc1ccccc1 512a_200000730056_100015324214 [0,1,0,0,0,1|2,0,0]=4 14613 B16R1.608 CC(O)CSCC(=O)CCc1ccccc1 62a_100011218427_100012361361 [0,1,0,0,0,1|2,0,0]=4 14614 B16R1.608 CC(O)CSCC(=O)CCc1ccccc1 62a_100012361361_100011218427 [0,1,0,0,0,1|2,0,0]=4 14615 B16R1.608 CC(O)CSCC(=O)NCc1ccccc1 62a_100000183539_100011218427 [0,1,0,0,0,1|2,0,0]=4 14616 B16R1.608 CC(O)CSCC(=O)NCc1ccccc1 62a_100011218427_100000183539 [0,1,0,0,0,1|2,0,0]=4 14617 B16R1.608 CC(O)CSCC(=O)OCc1ccccc1 62a_100000753625_100011218427 [0,1,0,0,0,1|2,0,0]=4 14618 B16R1.608 CC(O)CSCC(=O)OCc1ccccc1 62a_100011218427_100000753625 [0,1,0,0,0,1|2,0,0]=4 14619 B16R1.608 CN(C)CCCC(=O)CCc1ccccc1 1458a_100000185753_100000695564 [0,1,0,0,0,1|2,0,0]=4 14620 B16R1.608 CN(C)CCCC(=O)COc1ccccc1 1458a_100000186222_100000695564 [0,1,0,0,0,1|2,0,0]=4 14621 B16R1.608 CN(C)CCCC(=O)CSc1ccccc1 1458a_100000211596_100000695564 [0,1,0,0,0,1|2,0,0]=4 14622 B16R1.608 CN(C)CCCC(=O)NCc1ccccc1 11a_100015324214_100000740757 [0,1,0,0,0,1|2,0,0]=4 14623 B16R1.608 CN(C)CCCC(=O)NCc1ccccc1 240690a_100015324214_100000740757 [0,1,0,0,0,1|2,0,0]=4 14624 B16R1.608 CN(C)CCCC(=O)OCc1ccccc1 2230a_100102631434_100009813218 [0,1,0,0,0,1|2,0,0]=4 14625 B16R1.608 CN(C)CCCC(=O)OCc1ccccc1 269982a_100102631434_100009813218 [0,1,0,0,0,1|2,0,0]=4 14626 B16R1.608 CN(C)CCNC(=O)CCc1ccccc1 240690a_100000210585_100000185753 [0,1,0,0,0,1|2,0,0]=4 14627 B16R1.608 CN(C)CCNC(=O)CCc1ccccc1 527a_100000210585_100000185753 [0,1,0,0,0,1|2,0,0]=4 14628 B16R1.608 CN(C)CCNC(=O)COc1ccccc1 240690a_100000210585_100000186222 [0,1,0,0,0,1|2,0,0]=4 14629 B16R1.608 CN(C)CCNC(=O)COc1ccccc1 527a_100000210585_100000186222 [0,1,0,0,0,1|2,0,0]=4 14630 B16R1.608 CN(C)CCNC(=O)CSc1ccccc1 240690a_100000210585_100000211596 [0,1,0,0,0,1|2,0,0]=4 14631 B16R1.608 CN(C)CCNC(=O)CSc1ccccc1 527a_100000210585_100000211596 [0,1,0,0,0,1|2,0,0]=4 14632 B16R1.608 CN(C)CCNC(=O)NCc1ccccc1 2708a_100015324214_100000210585 [0,1,0,0,0,1|2,0,0]=4 14633 B16R1.608 CN(C)CCNC(=O)NCc1ccccc1 273464a_100000210585_100015324214 [0,1,0,0,0,1|2,0,0]=4 14634 B16R1.608 CN(C)CCNC(=O)NCc1ccccc1 273464a_100015324214_100000210585 [0,1,0,0,0,1|2,0,0]=4 14635 B16R1.608 CN(C)CCNC(=O)NCc1ccccc1 512a_100015324214_100000210585 [0,1,0,0,0,1|2,0,0]=4 14636 B16R1.608 CN(C)CCNC(=O)OCc1ccccc1 2230a_100016987931_200000210301 [0,1,0,0,0,1|2,0,0]=4 14637 B16R1.608 CN(C)CCNC(=O)OCc1ccccc1 2230a_100102631434_100012357035 [0,1,0,0,0,1|2,0,0]=4 14638 B16R1.608 CN(C)CCNC(=O)OCc1ccccc1 269982a_100016987931_200000210301 [0,1,0,0,0,1|2,0,0]=4 14639 B16R1.608 CN(C)CCNC(=O)OCc1ccccc1 269982a_100102631434_100012357035 [0,1,0,0,0,1|2,0,0]=4 14640 B16R1.608 CN([13CH3])CCNC(=O)OCc1ccccc1 2230a_100016987931_200025704644 [0,1,0,0,0,1|2,0,0]=4 14641 B16R1.608 CN([13CH3])CCNC(=O)OCc1ccccc1 269982a_100016987931_200025704644 [0,1,0,0,0,1|2,0,0]=4 14642 B16R1.608 C[C@@H](Cl)COCC(=O)CCc1ccccc1 34a_100016084084_100012361361 [0,1,0,0,0,1|2,0,0]=4 14643 B16R1.608 C[C@@H](Cl)COCC(=O)NCc1ccccc1 34a_100016084084_100000183539 [0,1,0,0,0,1|2,0,0]=4 14644 B16R1.608 C[C@@H](Cl)COCC(=O)OCc1ccccc1 34a_100016084084_100000753625 [0,1,0,0,0,1|2,0,0]=4 14645 B16R1.608 C[C@@H](N)COCC(=O)CCc1ccccc1 34a_100000737577_100012361361 [0,1,0,0,0,1|2,0,0]=4 14646 B16R1.608 C[C@@H](N)COCC(=O)NCc1ccccc1 34a_100000737577_100000183539 [0,1,0,0,0,1|2,0,0]=4 14647 B16R1.608 C[C@@H](N)COCC(=O)OCc1ccccc1 34a_100000737577_100000753625 [0,1,0,0,0,1|2,0,0]=4 14648 B16R1.608 C[C@@H](O)CNCC(=O)NCc1ccccc1 2230a_100000739245_100009817552 [0,1,0,0,0,1|2,0,0]=4 14649 B16R1.608 C[C@@H](O)CSCC(=O)CCc1ccccc1 62a_100009817552_100012361361 [0,1,0,0,0,1|2,0,0]=4 14650 B16R1.608 C[C@@H](O)CSCC(=O)CCc1ccccc1 62a_100012361361_100009817552 [0,1,0,0,0,1|2,0,0]=4 14651 B16R1.608 C[C@@H](O)CSCC(=O)NCc1ccccc1 62a_100000183539_100009817552 [0,1,0,0,0,1|2,0,0]=4 14652 B16R1.608 C[C@@H](O)CSCC(=O)NCc1ccccc1 62a_100009817552_100000183539 [0,1,0,0,0,1|2,0,0]=4 14653 B16R1.608 C[C@@H](O)CSCC(=O)OCc1ccccc1 62a_100000753625_100009817552 [0,1,0,0,0,1|2,0,0]=4 14654 B16R1.608 C[C@@H](O)CSCC(=O)OCc1ccccc1 62a_100009817552_100000753625 [0,1,0,0,0,1|2,0,0]=4 14655 B16R1.608 [13CH3]C(=O)CCCC(=O)OCc1ccccc1 1458a_100010293158_200025704644 [0,1,0,0,0,1|1,0,1]=4 14656 B16R1.608 [13CH3]C(=O)CCNC(=O)OCc1ccccc1 1458a_100000236050_200025704644 [0,1,0,0,0,1|1,0,1]=4 14657 B16R1.688 C#CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100010269958 [0,1,0,0,0,1|1,0,1]=4 14658 B16R1.688 C#CCCCCC(=O)CCc1ccccc1 1458a_100000696528_100000765856 [0,1,0,0,0,1|1,0,1]=4 14659 B16R1.688 C#CCCCCC(=O)COc1ccccc1 1458a_100000186222_100010269958 [0,1,0,0,0,1|1,0,1]=4 14660 B16R1.688 C#CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100010269958 [0,1,0,0,0,1|1,0,1]=4 14661 B16R1.688 C#CCCCCC(=O)NCc1ccccc1 11a_100015324214_100000696528 [0,1,0,0,0,1|1,0,1]=4 14662 B16R1.688 C#CCCCCC(=O)NCc1ccccc1 1626a_100015324214_100000696528 [0,1,0,0,0,1|1,0,1]=4 14663 B16R1.688 C#CCCCCC(=O)NCc1ccccc1 240690a_100015324214_100000696528 [0,1,0,0,0,1|1,0,1]=4 14664 B16R1.688 C#CCCCCC(=O)NCc1ccccc1 527a_100015324214_100000696528 [0,1,0,0,0,1|1,0,1]=4 14665 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 11a_100000718082_100000185753 [0,1,0,0,0,1|1,0,1]=4 14666 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 1626a_100000718082_100000185753 [0,1,0,0,0,1|1,0,1]=4 14667 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 240690a_100000718082_100000185753 [0,1,0,0,0,1|1,0,1]=4 14668 B16R1.688 C#CCCCNC(=O)CCc1ccccc1 527a_100000718082_100000185753 [0,1,0,0,0,1|1,0,1]=4 14669 B16R1.688 C#CCCCNC(=O)COc1ccccc1 11a_100000718082_100000186222 [0,1,0,0,0,1|1,0,1]=4 14670 B16R1.688 C#CCCCNC(=O)COc1ccccc1 1626a_100000718082_100000186222 [0,1,0,0,0,1|1,0,1]=4 14671 B16R1.688 C#CCCCNC(=O)COc1ccccc1 240690a_100000718082_100000186222 [0,1,0,0,0,1|1,0,1]=4 14672 B16R1.688 C#CCCCNC(=O)COc1ccccc1 527a_100000718082_100000186222 [0,1,0,0,0,1|1,0,1]=4 14673 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 11a_100000718082_100000211596 [0,1,0,0,0,1|1,0,1]=4 14674 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 1626a_100000718082_100000211596 [0,1,0,0,0,1|1,0,1]=4 14675 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 240690a_100000718082_100000211596 [0,1,0,0,0,1|1,0,1]=4 14676 B16R1.688 C#CCCCNC(=O)CSc1ccccc1 527a_100000718082_100000211596 [0,1,0,0,0,1|1,0,1]=4 14677 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 2708a_100000718082_100015324214 [0,1,0,0,0,1|1,0,1]=4 14678 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000718082 [0,1,0,0,0,1|1,0,1]=4 14679 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 273464a_100000718082_100015324214 [0,1,0,0,0,1|1,0,1]=4 14680 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000718082 [0,1,0,0,0,1|1,0,1]=4 14681 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 512a_100000718082_100015324214 [0,1,0,0,0,1|1,0,1]=4 14682 B16R1.688 C#CCCCNC(=O)NCc1ccccc1 512a_100015324214_100000718082 [0,1,0,0,0,1|1,0,1]=4 14683 B16R1.688 C#CCCOCC(=O)CCc1ccccc1 34a_100011215631_100012361361 [0,1,0,0,0,1|0,0,2]=4 14684 B16R1.688 C#CCCOCC(=O)NCc1ccccc1 34a_100011215631_100000183539 [0,1,0,0,0,1|0,0,2]=4 14685 B16R1.688 C#CCCOCC(=O)OCc1ccccc1 34a_100011215631_100000753625 [0,1,0,0,0,1|0,0,2]=4 14686 B16R1.688 C/C=C/COCC(=O)CCc1ccccc1 34a_100016270725_100012361361 [0,1,0,0,0,1|0,0,2]=4 14687 B16R1.688 C/C=C/COCC(=O)NCc1ccccc1 34a_100016270725_100000183539 [0,1,0,0,0,1|0,0,2]=4 14688 B16R1.688 C/C=C/COCC(=O)OCc1ccccc1 34a_100016270725_100000753625 [0,1,0,0,0,1|0,0,2]=4 14689 B16R1.688 C=CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100011215482 [0,1,0,0,0,1|1,0,1]=4 14690 B16R1.688 C=CCCCCC(=O)CCc1ccccc1 1458a_100011215552_100000765856 [0,1,0,0,0,1|1,0,1]=4 14691 B16R1.688 C=CCCCCC(=O)COc1ccccc1 1458a_100000186222_100011215482 [0,1,0,0,0,1|1,0,1]=4 14692 B16R1.688 C=CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100011215482 [0,1,0,0,0,1|1,0,1]=4 14693 B16R1.688 C=CCCCCC(=O)NCc1ccccc1 11a_100015324214_100011215552 [0,1,0,0,0,1|1,0,1]=4 14694 B16R1.688 C=CCCCCC(=O)NCc1ccccc1 1626a_100015324214_100011215552 [0,1,0,0,0,1|1,0,1]=4 14695 B16R1.688 C=CCCCCC(=O)NCc1ccccc1 240690a_100015324214_100011215552 [0,1,0,0,0,1|1,0,1]=4 14696 B16R1.688 C=CCCCCC(=O)NCc1ccccc1 527a_100015324214_100011215552 [0,1,0,0,0,1|1,0,1]=4 14697 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 11a_100000700776_100000185753 [0,1,0,0,0,1|1,0,1]=4 14698 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 1626a_100000700776_100000185753 [0,1,0,0,0,1|1,0,1]=4 14699 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 240690a_100000700776_100000185753 [0,1,0,0,0,1|1,0,1]=4 14700 B16R1.688 C=CCCCNC(=O)CCc1ccccc1 527a_100000700776_100000185753 [0,1,0,0,0,1|1,0,1]=4 14701 B16R1.688 C=CCCCNC(=O)COc1ccccc1 11a_100000700776_100000186222 [0,1,0,0,0,1|1,0,1]=4 14702 B16R1.688 C=CCCCNC(=O)COc1ccccc1 1626a_100000700776_100000186222 [0,1,0,0,0,1|1,0,1]=4 14703 B16R1.688 C=CCCCNC(=O)COc1ccccc1 240690a_100000700776_100000186222 [0,1,0,0,0,1|1,0,1]=4 14704 B16R1.688 C=CCCCNC(=O)COc1ccccc1 527a_100000700776_100000186222 [0,1,0,0,0,1|1,0,1]=4 14705 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 11a_100000700776_100000211596 [0,1,0,0,0,1|1,0,1]=4 14706 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 1626a_100000700776_100000211596 [0,1,0,0,0,1|1,0,1]=4 14707 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 240690a_100000700776_100000211596 [0,1,0,0,0,1|1,0,1]=4 14708 B16R1.688 C=CCCCNC(=O)CSc1ccccc1 527a_100000700776_100000211596 [0,1,0,0,0,1|1,0,1]=4 14709 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 2708a_100000700776_100015324214 [0,1,0,0,0,1|1,0,1]=4 14710 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000700776 [0,1,0,0,0,1|1,0,1]=4 14711 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 273464a_100000700776_100015324214 [0,1,0,0,0,1|1,0,1]=4 14712 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000700776 [0,1,0,0,0,1|1,0,1]=4 14713 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 512a_100000700776_100015324214 [0,1,0,0,0,1|1,0,1]=4 14714 B16R1.688 C=CCCCNC(=O)NCc1ccccc1 512a_100015324214_100000700776 [0,1,0,0,0,1|1,0,1]=4 14715 B16R1.688 C=CCCOCC(=O)CCc1ccccc1 34a_100011205117_100012361361 [0,1,0,0,0,1|0,0,2]=4 14716 B16R1.688 C=CCCOCC(=O)NCc1ccccc1 34a_100011205117_100000183539 [0,1,0,0,0,1|0,0,2]=4 14717 B16R1.688 C=CCCOCC(=O)OCc1ccccc1 34a_100011205117_100000753625 [0,1,0,0,0,1|0,0,2]=4 14718 B16R1.688 CC#CCOCC(=O)CCc1ccccc1 34a_100000761923_100012361361 [0,1,0,0,0,1|0,0,2]=4 14719 B16R1.688 CC#CCOCC(=O)NCc1ccccc1 34a_100000761923_100000183539 [0,1,0,0,0,1|0,0,2]=4 14720 B16R1.688 CC#CCOCC(=O)OCc1ccccc1 34a_100000761923_100000753625 [0,1,0,0,0,1|0,0,2]=4 14721 B16R1.688 CC(COc1ccccc1)OCCCCF 34a_100000210911_100000729493 [0,1,0,0,0,1|1,0,1]=4 14722 B16R1.688 CC(COc1ccccc1)OCCCCF 7a_100000210911_100000729493 [0,1,0,0,0,1|1,0,1]=4 14723 B16R1.688 CC(COc1ccccc1)OCCCCO 34a_100000210911_100011216708 [0,1,0,0,0,1|1,0,1]=4 14724 B16R1.688 CC(COc1ccccc1)OCCCCO 7a_100000210911_100000210776 [0,1,0,0,0,1|1,0,1]=4 14725 B16R1.688 CC(COc1ccccc1)OCCCO[13CH3] 34a_200011103555_200025704644 [0,1,0,0,0,1|1,0,1]=4 14726 B16R1.688 CC(COc1ccccc1)OCCCO[13CH3] 7a_200011103555_200025704644 [0,1,0,0,0,1|1,0,1]=4 14727 B16R1.688 CC/C=C\CCC(=O)CCc1ccccc1 1458a_100000185753_100015370543 [0,1,0,0,0,1|1,0,1]=4 14728 B16R1.688 CC/C=C\CCC(=O)COc1ccccc1 1458a_100000186222_100015370543 [0,1,0,0,0,1|1,0,1]=4 14729 B16R1.688 CC/C=C\CCC(=O)CSc1ccccc1 1458a_100000211596_100015370543 [0,1,0,0,0,1|1,0,1]=4 14730 B16R1.688 CCC/C=C/CC(=O)CCc1ccccc1 1458a_200016266809_100000765856 [0,1,0,0,0,1|1,0,1]=4 14731 B16R1.688 CCC/C=C/CC(=O)NCc1ccccc1 11a_100015324214_200016266809 [0,1,0,0,0,1|1,0,1]=4 14732 B16R1.688 CCC/C=C/CC(=O)NCc1ccccc1 1626a_100015324214_200016266809 [0,1,0,0,0,1|1,0,1]=4 14733 B16R1.688 CCC/C=C/CC(=O)NCc1ccccc1 240690a_100015324214_200016266809 [0,1,0,0,0,1|1,0,1]=4 14734 B16R1.688 CCC/C=C/CC(=O)NCc1ccccc1 527a_100015324214_200016266809 [0,1,0,0,0,1|1,0,1]=4 14735 B16R1.688 CCCC=NNC(=O)CCc1ccccc1 4a_100000189782_100000185831 [0,1,0,0,0,1|1,0,1]=4 14736 B16R1.688 CCCC=NNC(=O)COc1ccccc1 4a_100000186219_100000185831 [0,1,0,0,0,1|1,0,1]=4 14737 B16R1.688 CCCCC=CC(=O)CCc1ccccc1 1458a_100016266645_100000765856 [0,1,0,0,0,1|1,0,0]=3 14738 B16R1.688 CCCCC=CC(=O)CCc1ccccn1 1458a_100016266645_100015183660 [0,1,0,0,0,1|2,0,0]=4 14739 B16R1.688 CCCCC=CC(=O)CCc1cccnc1 1458a_100016266645_200011713674 [0,1,0,0,0,1|2,0,0]=4 14740 B16R1.688 CCCCC=CC(=O)CCc1ccncc1 1458a_100016266645_100000723409 [0,1,0,0,0,1|2,0,0]=4 14741 B16R1.688 CCCCC=CC(=O)NCc1ccccc1 11a_100015324214_100016266645 [0,1,0,0,0,1|1,0,0]=3 14742 B16R1.688 CCCCC=CC(=O)NCc1ccccc1 1626a_100015324214_100016266645 [0,1,0,0,0,1|1,0,0]=3 14743 B16R1.688 CCCCC=CC(=O)NCc1ccccc1 240690a_100015324214_100016266645 [0,1,0,0,0,1|1,0,0]=3 14744 B16R1.688 CCCCC=CC(=O)NCc1ccccn1 11a_100000210449_100016266645 [0,1,0,0,0,1|2,0,0]=4 14745 B16R1.688 CCCCC=CC(=O)NCc1ccccn1 1626a_100000210449_100016266645 [0,1,0,0,0,1|2,0,0]=4 14746 B16R1.688 CCCCC=CC(=O)NCc1ccccn1 240690a_100000210449_100016266645 [0,1,0,0,0,1|2,0,0]=4 14747 B16R1.688 CCCCC=CC(=O)NCc1cccnc1 11a_100000210453_100016266645 [0,1,0,0,0,1|2,0,0]=4 14748 B16R1.688 CCCCC=CC(=O)NCc1cccnc1 240690a_100000210453_100016266645 [0,1,0,0,0,1|2,0,0]=4 14749 B16R1.688 CCCCC=CC(=O)NCc1ccncc1 11a_100000210450_100016266645 [0,1,0,0,0,1|2,0,0]=4 14750 B16R1.688 CCCCC=CC(=O)NCc1ccncc1 1626a_100000210450_100016266645 [0,1,0,0,0,1|2,0,0]=4 14751 B16R1.688 CCCCC=CC(=O)NCc1ccncc1 240690a_100000210450_100016266645 [0,1,0,0,0,1|2,0,0]=4 14752 B16R1.688 CCCCC=CC(=O)NNc1ccccc1 22a_100015195140_100016266645 [0,1,0,0,0,1|2,0,0]=4 14753 B16R1.688 CCCCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210757 [0,1,0,0,0,1|1,0,1]=4 14754 B16R1.688 CCCCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210757 [0,1,0,0,0,1|1,0,1]=4 14755 B16R1.688 CCCCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210757 [0,1,0,0,0,1|1,0,0]=3 14756 B16R1.688 CCCCCCC(=O)CCc1ccccc1 1458a_100102632555_100000765856 [0,1,0,0,0,1|1,0,0]=3 14757 B16R1.688 CCCCCCC(=O)CCc1ccccn1 1458a_100015195070_100000210757 [0,1,0,0,0,1|2,0,0]=4 14758 B16R1.688 CCCCCCC(=O)CCc1ccccn1 1458a_100102632555_100015183660 [0,1,0,0,0,1|2,0,0]=4 14759 B16R1.688 CCCCCCC(=O)CCc1cccnc1 1458a_100000198484_100000210757 [0,1,0,0,0,1|2,0,0]=4 14760 B16R1.688 CCCCCCC(=O)CCc1cccnc1 1458a_100102632555_200011713674 [0,1,0,0,0,1|2,0,0]=4 14761 B16R1.688 CCCCCCC(=O)CCc1ccncc1 1458a_100011225043_100000210757 [0,1,0,0,0,1|2,0,0]=4 14762 B16R1.688 CCCCCCC(=O)CCc1ccncc1 1458a_100102632555_100000723409 [0,1,0,0,0,1|2,0,0]=4 14763 B16R1.688 CCCCCCC(=O)COc1ccccc1 1458a_100000186222_100000210757 [0,1,0,0,0,1|1,0,0]=3 14764 B16R1.688 CCCCCCC(=O)COc1ccccn1 1458a_100102699861_100000210757 [0,1,0,0,0,1|2,0,0]=4 14765 B16R1.688 CCCCCCC(=O)COc1cccnc1 1458a_100015207166_100000210757 [0,1,0,0,0,1|2,0,0]=4 14766 B16R1.688 CCCCCCC(=O)CSc1ccccc1 1458a_100000211596_100000210757 [0,1,0,0,0,1|1,0,0]=3 14767 B16R1.688 CCCCCCC(=O)CSc1ccccn1 1458a_100000156281_100000210757 [0,1,0,0,0,1|2,0,0]=4 14768 B16R1.688 CCCCCCC(=O)CSc1ccncc1 1458a_100000211328_100000210757 [0,1,0,0,0,1|2,0,0]=4 14769 B16R1.688 CCCCCCC(=O)NCc1ccccc1 11a_100015324214_100102632555 [0,1,0,0,0,1|1,0,0]=3 14770 B16R1.688 CCCCCCC(=O)NCc1ccccc1 1626a_100015324214_100102632555 [0,1,0,0,0,1|1,0,0]=3 14771 B16R1.688 CCCCCCC(=O)NCc1ccccc1 240690a_100015324214_100102632555 [0,1,0,0,0,1|1,0,0]=3 14772 B16R1.688 CCCCCCC(=O)NCc1ccccc1 527a_100015324214_100102632555 [0,1,0,0,0,1|1,0,0]=3 14773 B16R1.688 CCCCCCC(=O)NCc1ccccn1 11a_100000210449_100102632555 [0,1,0,0,0,1|2,0,0]=4 14774 B16R1.688 CCCCCCC(=O)NCc1ccccn1 1626a_100000210449_100102632555 [0,1,0,0,0,1|2,0,0]=4 14775 B16R1.688 CCCCCCC(=O)NCc1ccccn1 240690a_100000210449_100102632555 [0,1,0,0,0,1|2,0,0]=4 14776 B16R1.688 CCCCCCC(=O)NCc1ccccn1 527a_100000210449_100102632555 [0,1,0,0,0,1|2,0,0]=4 14777 B16R1.688 CCCCCCC(=O)NCc1cccnc1 11a_100000210453_100102632555 [0,1,0,0,0,1|2,0,0]=4 14778 B16R1.688 CCCCCCC(=O)NCc1cccnc1 240690a_100000210453_100102632555 [0,1,0,0,0,1|2,0,0]=4 14779 B16R1.688 CCCCCCC(=O)NCc1cccnc1 527a_100000210453_100102632555 [0,1,0,0,0,1|2,0,0]=4 14780 B16R1.688 CCCCCCC(=O)NCc1ccncc1 11a_100000210450_100102632555 [0,1,0,0,0,1|2,0,0]=4 14781 B16R1.688 CCCCCCC(=O)NCc1ccncc1 1626a_100000210450_100102632555 [0,1,0,0,0,1|2,0,0]=4 14782 B16R1.688 CCCCCCC(=O)NCc1ccncc1 240690a_100000210450_100102632555 [0,1,0,0,0,1|2,0,0]=4 14783 B16R1.688 CCCCCCC(=O)NCc1ccncc1 527a_100000210450_100102632555 [0,1,0,0,0,1|2,0,0]=4 14784 B16R1.688 CCCCCCC(=O)NNc1ccccc1 22a_100015195140_100102632555 [0,1,0,0,0,1|2,0,0]=4 14785 B16R1.688 CCCCCNC(=O)C#Cc1ccccc1 240690a_100000209983_100000736102 [0,1,0,0,0,1|1,0,1]=4 14786 B16R1.688 CCCCCNC(=O)C=Cc1ccccc1 11a_100000209983_100000210462 [0,1,0,0,0,1|1,0,1]=4 14787 B16R1.688 CCCCCNC(=O)C=Cc1ccccc1 1626a_100000209983_100000210462 [0,1,0,0,0,1|1,0,1]=4 14788 B16R1.688 CCCCCNC(=O)CCc1ccccc1 11a_100000209983_100000185753 [0,1,0,0,0,1|1,0,0]=3 14789 B16R1.688 CCCCCNC(=O)CCc1ccccc1 1626a_100000209983_100000185753 [0,1,0,0,0,1|1,0,0]=3 14790 B16R1.688 CCCCCNC(=O)CCc1ccccc1 240690a_100000209983_100000185753 [0,1,0,0,0,1|1,0,0]=3 14791 B16R1.688 CCCCCNC(=O)CCc1ccccc1 527a_100000209983_100000185753 [0,1,0,0,0,1|1,0,0]=3 14792 B16R1.688 CCCCCNC(=O)CCc1ccccn1 11a_100000209983_100015195070 [0,1,0,0,0,1|2,0,0]=4 14793 B16R1.688 CCCCCNC(=O)CCc1ccccn1 240690a_100000209983_100015195070 [0,1,0,0,0,1|2,0,0]=4 14794 B16R1.688 CCCCCNC(=O)CCc1ccccn1 527a_100000209983_100015195070 [0,1,0,0,0,1|2,0,0]=4 14795 B16R1.688 CCCCCNC(=O)CCc1cccnc1 11a_100000209983_100000198484 [0,1,0,0,0,1|2,0,0]=4 14796 B16R1.688 CCCCCNC(=O)CCc1cccnc1 1626a_100000209983_100000198484 [0,1,0,0,0,1|2,0,0]=4 14797 B16R1.688 CCCCCNC(=O)CCc1cccnc1 240690a_100000209983_100000198484 [0,1,0,0,0,1|2,0,0]=4 14798 B16R1.688 CCCCCNC(=O)CCc1cccnc1 527a_100000209983_100000198484 [0,1,0,0,0,1|2,0,0]=4 14799 B16R1.688 CCCCCNC(=O)CCc1ccncc1 11a_100000209983_100011225043 [0,1,0,0,0,1|2,0,0]=4 14800 B16R1.688 CCCCCNC(=O)CCc1ccncc1 240690a_100000209983_100011225043 [0,1,0,0,0,1|2,0,0]=4 14801 B16R1.688 CCCCCNC(=O)CCc1ccncc1 527a_100000209983_100011225043 [0,1,0,0,0,1|2,0,0]=4 14802 B16R1.688 CCCCCNC(=O)CNc1ccccc1 34a_100000106764_100000230301 [0,1,0,0,0,1|1,0,0]=3 14803 B16R1.688 CCCCCNC(=O)COc1ccccc1 11a_100000209983_100000186222 [0,1,0,0,0,1|1,0,0]=3 14804 B16R1.688 CCCCCNC(=O)COc1ccccc1 1626a_100000209983_100000186222 [0,1,0,0,0,1|1,0,0]=3 14805 B16R1.688 CCCCCNC(=O)COc1ccccc1 240690a_100000209983_100000186222 [0,1,0,0,0,1|1,0,0]=3 14806 B16R1.688 CCCCCNC(=O)COc1ccccc1 34a_100000210340_100000230301 [0,1,0,0,0,1|1,0,0]=3 14807 B16R1.688 CCCCCNC(=O)COc1ccccc1 527a_100000209983_100000186222 [0,1,0,0,0,1|1,0,0]=3 14808 B16R1.688 CCCCCNC(=O)COc1ccccc1 7a_100000210340_100000230301 [0,1,0,0,0,1|1,0,0]=3 14809 B16R1.688 CCCCCNC(=O)COc1ccccn1 1626a_100000209983_100102699861 [0,1,0,0,0,1|2,0,0]=4 14810 B16R1.688 CCCCCNC(=O)COc1ccccn1 240690a_100000209983_100102699861 [0,1,0,0,0,1|2,0,0]=4 14811 B16R1.688 CCCCCNC(=O)COc1ccccn1 527a_100000209983_100102699861 [0,1,0,0,0,1|2,0,0]=4 14812 B16R1.688 CCCCCNC(=O)COc1cccnc1 11a_100000209983_100015207166 [0,1,0,0,0,1|2,0,0]=4 14813 B16R1.688 CCCCCNC(=O)COc1cccnc1 1626a_100000209983_100015207166 [0,1,0,0,0,1|2,0,0]=4 14814 B16R1.688 CCCCCNC(=O)COc1cccnc1 240690a_100000209983_100015207166 [0,1,0,0,0,1|2,0,0]=4 14815 B16R1.688 CCCCCNC(=O)COc1cccnc1 34a_100000210849_100000230301 [0,1,0,0,0,1|2,0,0]=4 14816 B16R1.688 CCCCCNC(=O)COc1cccnc1 527a_100000209983_100015207166 [0,1,0,0,0,1|2,0,0]=4 14817 B16R1.688 CCCCCNC(=O)COc1cccnc1 7a_100000210849_100000230301 [0,1,0,0,0,1|2,0,0]=4 14818 B16R1.688 CCCCCNC(=O)COc1ccncc1 34a_100000212176_100000230301 [0,1,0,0,0,1|2,0,0]=4 14819 B16R1.688 CCCCCNC(=O)CSc1ccccc1 11a_100000209983_100000211596 [0,1,0,0,0,1|1,0,0]=3 14820 B16R1.688 CCCCCNC(=O)CSc1ccccc1 1626a_100000209983_100000211596 [0,1,0,0,0,1|1,0,0]=3 14821 B16R1.688 CCCCCNC(=O)CSc1ccccc1 240690a_100000209983_100000211596 [0,1,0,0,0,1|1,0,0]=3 14822 B16R1.688 CCCCCNC(=O)CSc1ccccc1 527a_100000209983_100000211596 [0,1,0,0,0,1|1,0,0]=3 14823 B16R1.688 CCCCCNC(=O)CSc1ccccc1 62a_100000230301_100000041952 [0,1,0,0,0,1|1,0,0]=3 14824 B16R1.688 CCCCCNC(=O)CSc1ccccc1 62a_100000719477_100000230301 [0,1,0,0,0,1|1,0,0]=3 14825 B16R1.688 CCCCCNC(=O)CSc1ccccn1 11a_100000209983_100000156281 [0,1,0,0,0,1|2,0,0]=4 14826 B16R1.688 CCCCCNC(=O)CSc1ccccn1 240690a_100000209983_100000156281 [0,1,0,0,0,1|2,0,0]=4 14827 B16R1.688 CCCCCNC(=O)CSc1ccccn1 527a_100000209983_100000156281 [0,1,0,0,0,1|2,0,0]=4 14828 B16R1.688 CCCCCNC(=O)CSc1ccccn1 62a_100000230301_100011216584 [0,1,0,0,0,1|2,0,0]=4 14829 B16R1.688 CCCCCNC(=O)CSc1ccccn1 62a_100011216584_100000230301 [0,1,0,0,0,1|2,0,0]=4 14830 B16R1.688 CCCCCNC(=O)CSc1cccnc1 62a_100000210063_100000230301 [0,1,0,0,0,1|2,0,0]=4 14831 B16R1.688 CCCCCNC(=O)CSc1cccnc1 62a_100000230301_100000210063 [0,1,0,0,0,1|2,0,0]=4 14832 B16R1.688 CCCCCNC(=O)CSc1ccncc1 11a_100000209983_100000211328 [0,1,0,0,0,1|2,0,0]=4 14833 B16R1.688 CCCCCNC(=O)CSc1ccncc1 1626a_100000209983_100000211328 [0,1,0,0,0,1|2,0,0]=4 14834 B16R1.688 CCCCCNC(=O)CSc1ccncc1 240690a_100000209983_100000211328 [0,1,0,0,0,1|2,0,0]=4 14835 B16R1.688 CCCCCNC(=O)CSc1ccncc1 527a_100000209983_100000211328 [0,1,0,0,0,1|2,0,0]=4 14836 B16R1.688 CCCCCNC(=O)CSc1ccncc1 62a_100000230301_100000728582 [0,1,0,0,0,1|2,0,0]=4 14837 B16R1.688 CCCCCNC(=O)CSc1ccncc1 62a_100000728582_100000230301 [0,1,0,0,0,1|2,0,0]=4 14838 B16R1.688 CCCCCNC(=O)NCc1ccccc1 2708a_100000209983_100015324214 [0,1,0,0,0,1|1,0,0]=3 14839 B16R1.688 CCCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000209983 [0,1,0,0,0,1|1,0,0]=3 14840 B16R1.688 CCCCCNC(=O)NCc1ccccc1 273464a_100000209983_100015324214 [0,1,0,0,0,1|1,0,0]=3 14841 B16R1.688 CCCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000209983 [0,1,0,0,0,1|1,0,0]=3 14842 B16R1.688 CCCCCNC(=O)NCc1ccccc1 512a_100000209983_100015324214 [0,1,0,0,0,1|1,0,0]=3 14843 B16R1.688 CCCCCNC(=O)NCc1ccccc1 512a_100015324214_100000209983 [0,1,0,0,0,1|1,0,0]=3 14844 B16R1.688 CCCCCNC(=O)NCc1ccccn1 2708a_100000209983_100000210449 [0,1,0,0,0,1|2,0,0]=4 14845 B16R1.688 CCCCCNC(=O)NCc1ccccn1 2708a_100000210449_100000209983 [0,1,0,0,0,1|2,0,0]=4 14846 B16R1.688 CCCCCNC(=O)NCc1ccccn1 273464a_100000209983_100000210449 [0,1,0,0,0,1|2,0,0]=4 14847 B16R1.688 CCCCCNC(=O)NCc1ccccn1 273464a_100000210449_100000209983 [0,1,0,0,0,1|2,0,0]=4 14848 B16R1.688 CCCCCNC(=O)NCc1ccccn1 512a_100000209983_100000210449 [0,1,0,0,0,1|2,0,0]=4 14849 B16R1.688 CCCCCNC(=O)NCc1cccnc1 2708a_100000209983_100000210453 [0,1,0,0,0,1|2,0,0]=4 14850 B16R1.688 CCCCCNC(=O)NCc1cccnc1 2708a_100000210453_100000209983 [0,1,0,0,0,1|2,0,0]=4 14851 B16R1.688 CCCCCNC(=O)NCc1cccnc1 273464a_100000209983_100000210453 [0,1,0,0,0,1|2,0,0]=4 14852 B16R1.688 CCCCCNC(=O)NCc1cccnc1 273464a_100000210453_100000209983 [0,1,0,0,0,1|2,0,0]=4 14853 B16R1.688 CCCCCNC(=O)NCc1cccnc1 512a_100000209983_100000210453 [0,1,0,0,0,1|2,0,0]=4 14854 B16R1.688 CCCCCNC(=O)NCc1cccnc1 512a_100000210453_100000209983 [0,1,0,0,0,1|2,0,0]=4 14855 B16R1.688 CCCCCNC(=O)NCc1ccncc1 2708a_100000209983_100000210450 [0,1,0,0,0,1|2,0,0]=4 14856 B16R1.688 CCCCCNC(=O)NCc1ccncc1 2708a_100000210450_100000209983 [0,1,0,0,0,1|2,0,0]=4 14857 B16R1.688 CCCCCNC(=O)NCc1ccncc1 273464a_100000209983_100000210450 [0,1,0,0,0,1|2,0,0]=4 14858 B16R1.688 CCCCCNC(=O)NCc1ccncc1 273464a_100000210450_100000209983 [0,1,0,0,0,1|2,0,0]=4 14859 B16R1.688 CCCCCNC(=O)NCc1ccncc1 512a_100000209983_100000210450 [0,1,0,0,0,1|2,0,0]=4 14860 B16R1.688 CCCCCNC(=O)NNc1ccccc1 273464a_100000209983_100015195140 [0,1,0,0,0,1|2,0,0]=4 14861 B16R1.688 CCCCCNC(=O)NNc1ccccc1 512a_100000209983_100015195140 [0,1,0,0,0,1|2,0,0]=4 14862 B16R1.688 CCCCCOC(C)COc1ccccc1 34a_100000210911_100000718602 [0,1,0,0,0,1|1,0,1]=4 14863 B16R1.688 CCCCCOC(C)COc1ccccc1 7a_100000210911_100000210326 [0,1,0,0,0,1|1,0,1]=4 14864 B16R1.688 CCCCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000718602 [0,1,0,0,0,1|1,0,1]=4 14865 B16R1.688 CCCCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000210326 [0,1,0,0,0,1|1,0,1]=4 14866 B16R1.688 CCCCNCC(=O)CCc1ccccc1 2230a_100000102301_100012361361 [0,1,0,0,0,1|1,0,0]=3 14867 B16R1.688 CCCCNCC(=O)CCc1ccccc1 7a_106832991798_100012361361 [0,1,0,0,0,1|1,0,0]=3 14868 B16R1.688 CCCCNCC(=O)NCc1ccccc1 2230a_100000102301_100000183539 [0,1,0,0,0,1|1,0,0]=3 14869 B16R1.688 CCCCNCC(=O)NCc1ccccc1 2230a_100000739245_100000210211 [0,1,0,0,0,1|1,0,0]=3 14870 B16R1.688 CCCCNCC(=O)NCc1ccccc1 7a_106832991798_100000183539 [0,1,0,0,0,1|1,0,0]=3 14871 B16R1.688 CCCCNCC(=O)NCc1ccccn1 2230a_100000102301_100000684169 [0,1,0,0,0,1|2,0,0]=4 14872 B16R1.688 CCCCNCC(=O)NCc1ccccn1 7a_106832991798_100000684169 [0,1,0,0,0,1|2,0,0]=4 14873 B16R1.688 CCCCNCC(=O)NCc1cccnc1 2230a_100000102301_100000752408 [0,1,0,0,0,1|2,0,0]=4 14874 B16R1.688 CCCCNCC(=O)NCc1cccnc1 7a_106832991798_100000752408 [0,1,0,0,0,1|2,0,0]=4 14875 B16R1.688 CCCCNCC(=O)NCc1ccncc1 2230a_100000102301_100011243468 [0,1,0,0,0,1|2,0,0]=4 14876 B16R1.688 CCCCNCC(=O)NCc1ccncc1 7a_106832991798_100011243468 [0,1,0,0,0,1|2,0,0]=4 14877 B16R1.688 CCCCNCC(=O)OCc1ccccc1 2230a_100000102301_100000753625 [0,1,0,0,0,1|1,0,0]=3 14878 B16R1.688 CCCCNCC(=O)OCc1ccccc1 7a_106832991798_100000753625 [0,1,0,0,0,1|1,0,0]=3 14879 B16R1.688 CCCCNN=C(C)CCc1ccccc1 4a_100025702795_100000210092 [0,1,0,0,0,1|2,0,0]=4 14880 B16R1.688 CCCCNN=C(C)COc1ccccc1 4a_100025702795_100000150576 [0,1,0,0,0,1|2,0,0]=4 14881 B16R1.688 CCCCNN=C(C)CSc1ccccc1 4a_100025702795_100000150717 [0,1,0,0,0,1|2,0,0]=4 14882 B16R1.688 CCCCNNC(=O)C#Cc1ccccc1 22a_100025702795_100000736102 [0,1,0,0,0,1|1,0,1]=4 14883 B16R1.688 CCCCNNC(=O)C=Cc1ccccc1 22a_100025702795_100000210462 [0,1,0,0,0,1|1,0,1]=4 14884 B16R1.688 CCCCNNC(=O)CCc1ccccc1 22a_100025702795_100000185753 [0,1,0,0,0,1|1,0,0]=3 14885 B16R1.688 CCCCNNC(=O)CCc1ccccn1 22a_100025702795_100015195070 [0,1,0,0,0,1|2,0,0]=4 14886 B16R1.688 CCCCNNC(=O)CCc1cccnc1 22a_100025702795_100000198484 [0,1,0,0,0,1|2,0,0]=4 14887 B16R1.688 CCCCNNC(=O)CCc1ccncc1 22a_100025702795_100011225043 [0,1,0,0,0,1|2,0,0]=4 14888 B16R1.688 CCCCNNC(=O)COc1ccccc1 22a_100025702795_100000186222 [0,1,0,0,0,1|1,0,0]=3 14889 B16R1.688 CCCCNNC(=O)COc1ccccn1 22a_100025702795_100102699861 [0,1,0,0,0,1|2,0,0]=4 14890 B16R1.688 CCCCNNC(=O)COc1cccnc1 22a_100025702795_100015207166 [0,1,0,0,0,1|2,0,0]=4 14891 B16R1.688 CCCCNNC(=O)CSc1ccccc1 22a_100025702795_100000211596 [0,1,0,0,0,1|1,0,0]=3 14892 B16R1.688 CCCCNNC(=O)CSc1ccccn1 22a_100025702795_100000156281 [0,1,0,0,0,1|2,0,0]=4 14893 B16R1.688 CCCCNNC(=O)CSc1ccncc1 22a_100025702795_100000211328 [0,1,0,0,0,1|2,0,0]=4 14894 B16R1.688 CCCCNNC(=O)NCc1ccccc1 273464a_100015324214_100025702795 [0,1,0,0,0,1|1,0,0]=3 14895 B16R1.688 CCCCNNC(=O)NCc1ccccc1 512a_100015324214_100025702795 [0,1,0,0,0,1|1,0,0]=3 14896 B16R1.688 CCCCNNC(=O)NCc1ccccc1 512a_100025702795_100015324214 [0,1,0,0,0,1|1,0,0]=3 14897 B16R1.688 CCCCNNC(=O)NCc1ccccn1 273464a_100000210449_100025702795 [0,1,0,0,0,1|2,0,0]=4 14898 B16R1.688 CCCCNNC(=O)NCc1ccccn1 512a_100025702795_100000210449 [0,1,0,0,0,1|2,0,0]=4 14899 B16R1.688 CCCCNNC(=O)NCc1cccnc1 273464a_100000210453_100025702795 [0,1,0,0,0,1|2,0,0]=4 14900 B16R1.688 CCCCNNC(=O)NCc1cccnc1 512a_100000210453_100025702795 [0,1,0,0,0,1|2,0,0]=4 14901 B16R1.688 CCCCNNC(=O)NCc1cccnc1 512a_100025702795_100000210453 [0,1,0,0,0,1|2,0,0]=4 14902 B16R1.688 CCCCNNC(=O)NCc1ccncc1 273464a_100000210450_100025702795 [0,1,0,0,0,1|2,0,0]=4 14903 B16R1.688 CCCCNNC(=O)NCc1ccncc1 512a_100025702795_100000210450 [0,1,0,0,0,1|2,0,0]=4 14904 B16R1.688 CCCCNNC(=O)NNc1ccccc1 512a_100025702795_100015195140 [0,1,0,0,0,1|2,0,0]=4 14905 B16R1.688 CCCCOCC(=O)C#Cc1ccccc1 1458a_100000736102_100011995733 [0,1,0,0,0,1|0,0,1]=3 14906 B16R1.688 CCCCOCC(=O)C#Cc1ccccn1 1458a_102125277312_100011995733 [0,1,0,0,0,1|1,0,1]=4 14907 B16R1.688 CCCCOCC(=O)C=Cc1ccccc1 1458a_100000210462_100011995733 [0,1,0,0,0,1|0,0,1]=3 14908 B16R1.688 CCCCOCC(=O)C=Cc1ccccn1 1458a_100000740811_100011995733 [0,1,0,0,0,1|1,0,1]=4 14909 B16R1.688 CCCCOCC(=O)C=Cc1cccnc1 1458a_100000735890_100011995733 [0,1,0,0,0,1|1,0,1]=4 14910 B16R1.688 CCCCOCC(=O)C=Cc1ccncc1 1458a_100000682801_100011995733 [0,1,0,0,0,1|1,0,1]=4 14911 B16R1.688 CCCCOCC(=O)CCc1ccccc1 1458a_100000185753_100011995733 [0,1,0,0,0,1|0,0,0]=2 14912 B16R1.688 CCCCOCC(=O)CCc1ccccc1 1458a_100000757543_100000765856 [0,1,0,0,0,1|0,0,0]=2 14913 B16R1.688 CCCCOCC(=O)CCc1ccccc1 34a_100000210227_100012361361 [0,1,0,0,0,1|0,0,0]=2 14914 B16R1.688 CCCCOCC(=O)CCc1ccccc1 7a_100000210227_100012361361 [0,1,0,0,0,1|0,0,0]=2 14915 B16R1.688 CCCCOCC(=O)CCc1ccccn1 1458a_100000757543_100015183660 [0,1,0,0,0,1|1,0,0]=3 14916 B16R1.688 CCCCOCC(=O)CCc1ccccn1 1458a_100015195070_100011995733 [0,1,0,0,0,1|1,0,0]=3 14917 B16R1.688 CCCCOCC(=O)CCc1cccnc1 1458a_100000198484_100011995733 [0,1,0,0,0,1|1,0,0]=3 14918 B16R1.688 CCCCOCC(=O)CCc1cccnc1 1458a_100000757543_200011713674 [0,1,0,0,0,1|1,0,0]=3 14919 B16R1.688 CCCCOCC(=O)CCc1ccncc1 1458a_100000757543_100000723409 [0,1,0,0,0,1|1,0,0]=3 14920 B16R1.688 CCCCOCC(=O)CCc1ccncc1 1458a_100011225043_100011995733 [0,1,0,0,0,1|1,0,0]=3 14921 B16R1.688 CCCCOCC(=O)COc1ccccc1 1458a_100000186222_100011995733 [0,1,0,0,0,1|0,0,0]=2 14922 B16R1.688 CCCCOCC(=O)COc1ccccn1 1458a_100102699861_100011995733 [0,1,0,0,0,1|1,0,0]=3 14923 B16R1.688 CCCCOCC(=O)COc1cccnc1 1458a_100015207166_100011995733 [0,1,0,0,0,1|1,0,0]=3 14924 B16R1.688 CCCCOCC(=O)CSc1ccccc1 1458a_100000211596_100011995733 [0,1,0,0,0,1|0,0,0]=2 14925 B16R1.688 CCCCOCC(=O)CSc1ccccn1 1458a_100000156281_100011995733 [0,1,0,0,0,1|1,0,0]=3 14926 B16R1.688 CCCCOCC(=O)CSc1ccncc1 1458a_100000211328_100011995733 [0,1,0,0,0,1|1,0,0]=3 14927 B16R1.688 CCCCOCC(=O)NCc1ccccc1 11a_100015324214_100000757543 [0,1,0,0,0,1|0,0,0]=2 14928 B16R1.688 CCCCOCC(=O)NCc1ccccc1 1626a_100015324214_100000757543 [0,1,0,0,0,1|0,0,0]=2 14929 B16R1.688 CCCCOCC(=O)NCc1ccccc1 240690a_100015324214_100000757543 [0,1,0,0,0,1|0,0,0]=2 14930 B16R1.688 CCCCOCC(=O)NCc1ccccc1 34a_100000210227_100000183539 [0,1,0,0,0,1|0,0,0]=2 14931 B16R1.688 CCCCOCC(=O)NCc1ccccc1 527a_100015324214_100000757543 [0,1,0,0,0,1|0,0,0]=2 14932 B16R1.688 CCCCOCC(=O)NCc1ccccc1 7a_100000210227_100000183539 [0,1,0,0,0,1|0,0,0]=2 14933 B16R1.688 CCCCOCC(=O)NCc1ccccn1 11a_100000210449_100000757543 [0,1,0,0,0,1|1,0,0]=3 14934 B16R1.688 CCCCOCC(=O)NCc1ccccn1 1626a_100000210449_100000757543 [0,1,0,0,0,1|1,0,0]=3 14935 B16R1.688 CCCCOCC(=O)NCc1ccccn1 240690a_100000210449_100000757543 [0,1,0,0,0,1|1,0,0]=3 14936 B16R1.688 CCCCOCC(=O)NCc1ccccn1 34a_100000210227_100000684169 [0,1,0,0,0,1|1,0,0]=3 14937 B16R1.688 CCCCOCC(=O)NCc1ccccn1 527a_100000210449_100000757543 [0,1,0,0,0,1|1,0,0]=3 14938 B16R1.688 CCCCOCC(=O)NCc1ccccn1 7a_100000210227_100000684169 [0,1,0,0,0,1|1,0,0]=3 14939 B16R1.688 CCCCOCC(=O)NCc1cccnc1 11a_100000210453_100000757543 [0,1,0,0,0,1|1,0,0]=3 14940 B16R1.688 CCCCOCC(=O)NCc1cccnc1 240690a_100000210453_100000757543 [0,1,0,0,0,1|1,0,0]=3 14941 B16R1.688 CCCCOCC(=O)NCc1cccnc1 527a_100000210453_100000757543 [0,1,0,0,0,1|1,0,0]=3 14942 B16R1.688 CCCCOCC(=O)NCc1cccnc1 7a_100000210227_100000752408 [0,1,0,0,0,1|1,0,0]=3 14943 B16R1.688 CCCCOCC(=O)NCc1cccnn1 11a_100159270163_100000757543 [0,1,0,0,0,1|2,0,0]=4 14944 B16R1.688 CCCCOCC(=O)NCc1cccnn1 240690a_100159270163_100000757543 [0,1,0,0,0,1|2,0,0]=4 14945 B16R1.688 CCCCOCC(=O)NCc1cccnn1 527a_100159270163_100000757543 [0,1,0,0,0,1|2,0,0]=4 14946 B16R1.688 CCCCOCC(=O)NCc1ccncc1 11a_100000210450_100000757543 [0,1,0,0,0,1|1,0,0]=3 14947 B16R1.688 CCCCOCC(=O)NCc1ccncc1 1626a_100000210450_100000757543 [0,1,0,0,0,1|1,0,0]=3 14948 B16R1.688 CCCCOCC(=O)NCc1ccncc1 240690a_100000210450_100000757543 [0,1,0,0,0,1|1,0,0]=3 14949 B16R1.688 CCCCOCC(=O)NCc1ccncc1 527a_100000210450_100000757543 [0,1,0,0,0,1|1,0,0]=3 14950 B16R1.688 CCCCOCC(=O)NCc1ccncc1 7a_100000210227_100011243468 [0,1,0,0,0,1|1,0,0]=3 14951 B16R1.688 CCCCOCC(=O)NCc1ccncn1 11a_100000736019_100000757543 [0,1,0,0,0,1|2,0,0]=4 14952 B16R1.688 CCCCOCC(=O)NCc1ccncn1 240690a_100000736019_100000757543 [0,1,0,0,0,1|2,0,0]=4 14953 B16R1.688 CCCCOCC(=O)NCc1ccncn1 527a_100000736019_100000757543 [0,1,0,0,0,1|2,0,0]=4 14954 B16R1.688 CCCCOCC(=O)NCc1cnccn1 11a_100000737960_100000757543 [0,1,0,0,0,1|2,0,0]=4 14955 B16R1.688 CCCCOCC(=O)NCc1cnccn1 240690a_100000737960_100000757543 [0,1,0,0,0,1|2,0,0]=4 14956 B16R1.688 CCCCOCC(=O)NCc1cnccn1 527a_100000737960_100000757543 [0,1,0,0,0,1|2,0,0]=4 14957 B16R1.688 CCCCOCC(=O)NCc1cncnc1 11a_100011243677_100000757543 [0,1,0,0,0,1|2,0,0]=4 14958 B16R1.688 CCCCOCC(=O)NCc1cncnc1 240690a_100011243677_100000757543 [0,1,0,0,0,1|2,0,0]=4 14959 B16R1.688 CCCCOCC(=O)NCc1cncnc1 527a_100011243677_100000757543 [0,1,0,0,0,1|2,0,0]=4 14960 B16R1.688 CCCCOCC(=O)NCc1ncccn1 11a_100015189908_100000757543 [0,1,0,0,0,1|2,0,0]=4 14961 B16R1.688 CCCCOCC(=O)NCc1ncccn1 240690a_100015189908_100000757543 [0,1,0,0,0,1|2,0,0]=4 14962 B16R1.688 CCCCOCC(=O)NCc1ncccn1 527a_100015189908_100000757543 [0,1,0,0,0,1|2,0,0]=4 14963 B16R1.688 CCCCOCC(=O)NNc1ccccc1 22a_100015195140_100000757543 [0,1,0,0,0,1|1,0,0]=3 14964 B16R1.688 CCCCOCC(=O)NNc1ccccn1 22a_100000183288_100000757543 [0,1,0,0,0,1|2,0,0]=4 14965 B16R1.688 CCCCOCC(=O)NNc1cccnc1 22a_100000728903_100000757543 [0,1,0,0,0,1|2,0,0]=4 14966 B16R1.688 CCCCOCC(=O)NNc1ccncc1 22a_100000698918_100000757543 [0,1,0,0,0,1|2,0,0]=4 14967 B16R1.688 CCCCOCC(=O)OCc1ccccc1 34a_100000210227_100000753625 [0,1,0,0,0,1|0,0,0]=2 14968 B16R1.688 CCCCOCC(=O)OCc1ccccc1 7a_100000210227_100000753625 [0,1,0,0,0,1|0,0,0]=2 14969 B16R1.688 CCCCOCC(C)OCc1ccccc1 34a_100011217071_100015291786 [0,1,0,0,0,1|1,0,1]=4 14970 B16R1.688 CCCCOCC(C)OCc1ccccc1 7a_100011217071_100000211182 [0,1,0,0,0,1|1,0,1]=4 14971 B16R1.688 CCCCOCN(C)CCc1ccccc1 2230a_100000207497_100011995733 [0,1,0,0,0,1|2,0,0]=4 14972 B16R1.688 CCCCOCN(C)CCc1ccccc1 269982a_100000207497_100011995733 [0,1,0,0,0,1|2,0,0]=4 14973 B16R1.688 CCCCOC[C@@H](C)NCc1ccccc1 34a_100000762708_100000210210 [0,1,0,0,0,1|1,0,1]=4 14974 B16R1.688 CCCCSCC(=O)CCc1ccccc1 1458a_100000191162_100000765856 [0,1,0,0,0,1|0,1,0]=3 14975 B16R1.688 CCCCSCC(=O)CCc1ccccc1 62a_100000210211_100012361361 [0,1,0,0,0,1|0,1,0]=3 14976 B16R1.688 CCCCSCC(=O)CCc1ccccc1 62a_100012361361_100000210210 [0,1,0,0,0,1|0,1,0]=3 14977 B16R1.688 CCCCSCC(=O)CCc1ccccn1 1458a_100000191162_100015183660 [0,1,0,0,0,1|1,1,0]=4 14978 B16R1.688 CCCCSCC(=O)CCc1cccnc1 1458a_100000191162_200011713674 [0,1,0,0,0,1|1,1,0]=4 14979 B16R1.688 CCCCSCC(=O)CCc1ccncc1 1458a_100000191162_100000723409 [0,1,0,0,0,1|1,1,0]=4 14980 B16R1.688 CCCCSCC(=O)NCc1ccccc1 11a_100015324214_100000191162 [0,1,0,0,0,1|0,1,0]=3 14981 B16R1.688 CCCCSCC(=O)NCc1ccccc1 1626a_100015324214_100000191162 [0,1,0,0,0,1|0,1,0]=3 14982 B16R1.688 CCCCSCC(=O)NCc1ccccc1 240690a_100015324214_100000191162 [0,1,0,0,0,1|0,1,0]=3 14983 B16R1.688 CCCCSCC(=O)NCc1ccccc1 527a_100015324214_100000191162 [0,1,0,0,0,1|0,1,0]=3 14984 B16R1.688 CCCCSCC(=O)NCc1ccccc1 62a_100000183539_100000210210 [0,1,0,0,0,1|0,1,0]=3 14985 B16R1.688 CCCCSCC(=O)NCc1ccccc1 62a_100000210211_100000183539 [0,1,0,0,0,1|0,1,0]=3 14986 B16R1.688 CCCCSCC(=O)NCc1ccccn1 11a_100000210449_100000191162 [0,1,0,0,0,1|1,1,0]=4 14987 B16R1.688 CCCCSCC(=O)NCc1ccccn1 1626a_100000210449_100000191162 [0,1,0,0,0,1|1,1,0]=4 14988 B16R1.688 CCCCSCC(=O)NCc1ccccn1 240690a_100000210449_100000191162 [0,1,0,0,0,1|1,1,0]=4 14989 B16R1.688 CCCCSCC(=O)NCc1ccccn1 527a_100000210449_100000191162 [0,1,0,0,0,1|1,1,0]=4 14990 B16R1.688 CCCCSCC(=O)NCc1ccccn1 62a_100000210211_100000684169 [0,1,0,0,0,1|1,1,0]=4 14991 B16R1.688 CCCCSCC(=O)NCc1ccccn1 62a_100000684169_100000210210 [0,1,0,0,0,1|1,1,0]=4 14992 B16R1.688 CCCCSCC(=O)NCc1cccnc1 11a_100000210453_100000191162 [0,1,0,0,0,1|1,1,0]=4 14993 B16R1.688 CCCCSCC(=O)NCc1cccnc1 240690a_100000210453_100000191162 [0,1,0,0,0,1|1,1,0]=4 14994 B16R1.688 CCCCSCC(=O)NCc1cccnc1 527a_100000210453_100000191162 [0,1,0,0,0,1|1,1,0]=4 14995 B16R1.688 CCCCSCC(=O)NCc1cccnc1 62a_100000210211_100000752408 [0,1,0,0,0,1|1,1,0]=4 14996 B16R1.688 CCCCSCC(=O)NCc1cccnc1 62a_100000752408_100000210210 [0,1,0,0,0,1|1,1,0]=4 14997 B16R1.688 CCCCSCC(=O)NCc1ccncc1 11a_100000210450_100000191162 [0,1,0,0,0,1|1,1,0]=4 14998 B16R1.688 CCCCSCC(=O)NCc1ccncc1 1626a_100000210450_100000191162 [0,1,0,0,0,1|1,1,0]=4 14999 B16R1.688 CCCCSCC(=O)NCc1ccncc1 240690a_100000210450_100000191162 [0,1,0,0,0,1|1,1,0]=4 15000 B16R1.688 CCCCSCC(=O)NCc1ccncc1 527a_100000210450_100000191162 [0,1,0,0,0,1|1,1,0]=4 15001 B16R1.688 CCCCSCC(=O)NCc1ccncc1 62a_100000210211_100011243468 [0,1,0,0,0,1|1,1,0]=4 15002 B16R1.688 CCCCSCC(=O)NCc1ccncc1 62a_100011243468_100000210210 [0,1,0,0,0,1|1,1,0]=4 15003 B16R1.688 CCCCSCC(=O)NNc1ccccc1 22a_100015195140_100000191162 [0,1,0,0,0,1|1,1,0]=4 15004 B16R1.688 CCCCSCC(=O)OCc1ccccc1 62a_100000210211_100000753625 [0,1,0,0,0,1|0,1,0]=3 15005 B16R1.688 CCCCSCC(=O)OCc1ccccc1 62a_100000753625_100000210210 [0,1,0,0,0,1|0,1,0]=3 15006 B16R1.688 CCCNCCC(=O)NCc1ccccc1 2230a_100025741942_100000210303 [0,1,0,0,0,1|1,0,0]=3 15007 B16R1.688 CCCNCCC(=O)NCc1ccccc1 34a_100025741942_100000210303 [0,1,0,0,0,1|1,0,0]=3 15008 B16R1.688 CCCOCCC(=O)C#Cc1ccccc1 1458a_100000736102_100011215938 [0,1,0,0,0,1|1,0,1]=4 15009 B16R1.688 CCCOCCC(=O)C=Cc1ccccc1 1458a_100000210462_100011215938 [0,1,0,0,0,1|1,0,1]=4 15010 B16R1.688 CCCOCCC(=O)CCc1ccccc1 1458a_100000185753_100011215938 [0,1,0,0,0,1|1,0,0]=3 15011 B16R1.688 CCCOCCC(=O)CCc1ccccn1 1458a_100015195070_100011215938 [0,1,0,0,0,1|2,0,0]=4 15012 B16R1.688 CCCOCCC(=O)CCc1cccnc1 1458a_100000198484_100011215938 [0,1,0,0,0,1|2,0,0]=4 15013 B16R1.688 CCCOCCC(=O)CCc1ccncc1 1458a_100011225043_100011215938 [0,1,0,0,0,1|2,0,0]=4 15014 B16R1.688 CCCOCCC(=O)COc1ccccc1 1458a_100000186222_100011215938 [0,1,0,0,0,1|1,0,0]=3 15015 B16R1.688 CCCOCCC(=O)COc1ccccn1 1458a_100102699861_100011215938 [0,1,0,0,0,1|2,0,0]=4 15016 B16R1.688 CCCOCCC(=O)COc1cccnc1 1458a_100015207166_100011215938 [0,1,0,0,0,1|2,0,0]=4 15017 B16R1.688 CCCOCCC(=O)CSc1ccccc1 1458a_100000211596_100011215938 [0,1,0,0,0,1|1,0,0]=3 15018 B16R1.688 CCCOCCC(=O)CSc1ccccn1 1458a_100000156281_100011215938 [0,1,0,0,0,1|2,0,0]=4 15019 B16R1.688 CCCOCCC(=O)CSc1ccncc1 1458a_100000211328_100011215938 [0,1,0,0,0,1|2,0,0]=4 15020 B16R1.688 CCCOCCC(=O)OCc1ccccc1 7a_100009831632_100000210303 [0,1,0,0,0,1|1,0,0]=3 15021 B16R1.688 CCCSCCC(=O)OCc1ccccc1 62a_100000210303_100009813219 [0,1,0,0,0,1|1,0,0]=3 15022 B16R1.688 CCCSCCC(=O)OCc1ccccc1 62a_100009813219_100000210303 [0,1,0,0,0,1|1,0,0]=3 15023 B16R1.688 CCNCCCC(=O)OCc1ccccc1 2230a_100015525214_100009813218 [0,1,0,0,0,1|1,0,0]=3 15024 B16R1.688 CCNCCNC(=O)OCc1ccccc1 2230a_100015525214_100012357035 [0,1,0,0,0,1|1,0,0]=3 15025 B16R1.688 CCOCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100012232248 [0,1,0,0,0,1|1,0,1]=4 15026 B16R1.688 CCOCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100012232248 [0,1,0,0,0,1|1,0,1]=4 15027 B16R1.688 CCOCCCC(=O)CCc1ccccc1 1458a_100000185753_100012232248 [0,1,0,0,0,1|1,0,0]=3 15028 B16R1.688 CCOCCCC(=O)CCc1ccccn1 1458a_100015195070_100012232248 [0,1,0,0,0,1|2,0,0]=4 15029 B16R1.688 CCOCCCC(=O)CCc1cccnc1 1458a_100000198484_100012232248 [0,1,0,0,0,1|2,0,0]=4 15030 B16R1.688 CCOCCCC(=O)CCc1ccncc1 1458a_100011225043_100012232248 [0,1,0,0,0,1|2,0,0]=4 15031 B16R1.688 CCOCCCC(=O)COc1ccccc1 1458a_100000186222_100012232248 [0,1,0,0,0,1|1,0,0]=3 15032 B16R1.688 CCOCCCC(=O)COc1ccccn1 1458a_100102699861_100012232248 [0,1,0,0,0,1|2,0,0]=4 15033 B16R1.688 CCOCCCC(=O)COc1cccnc1 1458a_100015207166_100012232248 [0,1,0,0,0,1|2,0,0]=4 15034 B16R1.688 CCOCCCC(=O)CSc1ccccc1 1458a_100000211596_100012232248 [0,1,0,0,0,1|1,0,0]=3 15035 B16R1.688 CCOCCCC(=O)CSc1ccccn1 1458a_100000156281_100012232248 [0,1,0,0,0,1|2,0,0]=4 15036 B16R1.688 CCOCCCC(=O)CSc1ccncc1 1458a_100000211328_100012232248 [0,1,0,0,0,1|2,0,0]=4 15037 B16R1.688 CCOCCCC(=O)OCc1ccccc1 34a_100121572206_100009813218 [0,1,0,0,0,1|1,0,0]=3 15038 B16R1.688 CCOCCCC(=O)OCc1ccccc1 7a_100009831633_100000210202 [0,1,0,0,0,1|1,0,0]=3 15039 B16R1.688 CCOCCNC(=O)C#Cc1ccccc1 240690a_100011200944_100000736102 [0,1,0,0,0,1|1,0,1]=4 15040 B16R1.688 CCOCCNC(=O)C=Cc1ccccc1 11a_100011200944_100000210462 [0,1,0,0,0,1|1,0,1]=4 15041 B16R1.688 CCOCCNC(=O)C=Cc1ccccc1 1626a_102516460346_100000210462 [0,1,0,0,0,1|1,0,1]=4 15042 B16R1.688 CCOCCNC(=O)CCc1ccccc1 11a_100011200944_100000185753 [0,1,0,0,0,1|1,0,0]=3 15043 B16R1.688 CCOCCNC(=O)CCc1ccccc1 1626a_102516460346_100000185753 [0,1,0,0,0,1|1,0,0]=3 15044 B16R1.688 CCOCCNC(=O)CCc1ccccc1 240690a_100011200944_100000185753 [0,1,0,0,0,1|1,0,0]=3 15045 B16R1.688 CCOCCNC(=O)CCc1ccccc1 527a_100011200944_100000185753 [0,1,0,0,0,1|1,0,0]=3 15046 B16R1.688 CCOCCNC(=O)CCc1ccccn1 11a_100011200944_100015195070 [0,1,0,0,0,1|2,0,0]=4 15047 B16R1.688 CCOCCNC(=O)CCc1ccccn1 240690a_100011200944_100015195070 [0,1,0,0,0,1|2,0,0]=4 15048 B16R1.688 CCOCCNC(=O)CCc1ccccn1 527a_100011200944_100015195070 [0,1,0,0,0,1|2,0,0]=4 15049 B16R1.688 CCOCCNC(=O)CCc1cccnc1 11a_100011200944_100000198484 [0,1,0,0,0,1|2,0,0]=4 15050 B16R1.688 CCOCCNC(=O)CCc1cccnc1 1626a_102516460346_100000198484 [0,1,0,0,0,1|2,0,0]=4 15051 B16R1.688 CCOCCNC(=O)CCc1cccnc1 240690a_100011200944_100000198484 [0,1,0,0,0,1|2,0,0]=4 15052 B16R1.688 CCOCCNC(=O)CCc1cccnc1 527a_100011200944_100000198484 [0,1,0,0,0,1|2,0,0]=4 15053 B16R1.688 CCOCCNC(=O)CCc1ccncc1 11a_100011200944_100011225043 [0,1,0,0,0,1|2,0,0]=4 15054 B16R1.688 CCOCCNC(=O)CCc1ccncc1 240690a_100011200944_100011225043 [0,1,0,0,0,1|2,0,0]=4 15055 B16R1.688 CCOCCNC(=O)CCc1ccncc1 527a_100011200944_100011225043 [0,1,0,0,0,1|2,0,0]=4 15056 B16R1.688 CCOCCNC(=O)COc1ccccc1 11a_100011200944_100000186222 [0,1,0,0,0,1|1,0,0]=3 15057 B16R1.688 CCOCCNC(=O)COc1ccccc1 1626a_102516460346_100000186222 [0,1,0,0,0,1|1,0,0]=3 15058 B16R1.688 CCOCCNC(=O)COc1ccccc1 240690a_100011200944_100000186222 [0,1,0,0,0,1|1,0,0]=3 15059 B16R1.688 CCOCCNC(=O)COc1ccccc1 527a_100011200944_100000186222 [0,1,0,0,0,1|1,0,0]=3 15060 B16R1.688 CCOCCNC(=O)COc1ccccn1 1626a_102516460346_100102699861 [0,1,0,0,0,1|2,0,0]=4 15061 B16R1.688 CCOCCNC(=O)COc1ccccn1 240690a_100011200944_100102699861 [0,1,0,0,0,1|2,0,0]=4 15062 B16R1.688 CCOCCNC(=O)COc1ccccn1 527a_100011200944_100102699861 [0,1,0,0,0,1|2,0,0]=4 15063 B16R1.688 CCOCCNC(=O)COc1cccnc1 11a_100011200944_100015207166 [0,1,0,0,0,1|2,0,0]=4 15064 B16R1.688 CCOCCNC(=O)COc1cccnc1 1626a_102516460346_100015207166 [0,1,0,0,0,1|2,0,0]=4 15065 B16R1.688 CCOCCNC(=O)COc1cccnc1 240690a_100011200944_100015207166 [0,1,0,0,0,1|2,0,0]=4 15066 B16R1.688 CCOCCNC(=O)COc1cccnc1 527a_100011200944_100015207166 [0,1,0,0,0,1|2,0,0]=4 15067 B16R1.688 CCOCCNC(=O)CSc1ccccc1 11a_100011200944_100000211596 [0,1,0,0,0,1|1,0,0]=3 15068 B16R1.688 CCOCCNC(=O)CSc1ccccc1 1626a_102516460346_100000211596 [0,1,0,0,0,1|1,0,0]=3 15069 B16R1.688 CCOCCNC(=O)CSc1ccccc1 240690a_100011200944_100000211596 [0,1,0,0,0,1|1,0,0]=3 15070 B16R1.688 CCOCCNC(=O)CSc1ccccc1 527a_100011200944_100000211596 [0,1,0,0,0,1|1,0,0]=3 15071 B16R1.688 CCOCCNC(=O)CSc1ccccn1 11a_100011200944_100000156281 [0,1,0,0,0,1|2,0,0]=4 15072 B16R1.688 CCOCCNC(=O)CSc1ccccn1 240690a_100011200944_100000156281 [0,1,0,0,0,1|2,0,0]=4 15073 B16R1.688 CCOCCNC(=O)CSc1ccccn1 527a_100011200944_100000156281 [0,1,0,0,0,1|2,0,0]=4 15074 B16R1.688 CCOCCNC(=O)CSc1ccncc1 11a_100011200944_100000211328 [0,1,0,0,0,1|2,0,0]=4 15075 B16R1.688 CCOCCNC(=O)CSc1ccncc1 1626a_102516460346_100000211328 [0,1,0,0,0,1|2,0,0]=4 15076 B16R1.688 CCOCCNC(=O)CSc1ccncc1 240690a_100011200944_100000211328 [0,1,0,0,0,1|2,0,0]=4 15077 B16R1.688 CCOCCNC(=O)CSc1ccncc1 527a_100011200944_100000211328 [0,1,0,0,0,1|2,0,0]=4 15078 B16R1.688 CCOCCNC(=O)NCc1ccccc1 2708a_100011200944_100015324214 [0,1,0,0,0,1|1,0,0]=3 15079 B16R1.688 CCOCCNC(=O)NCc1ccccc1 2708a_100015324214_100011200944 [0,1,0,0,0,1|1,0,0]=3 15080 B16R1.688 CCOCCNC(=O)NCc1ccccc1 273464a_100015324214_102516460346 [0,1,0,0,0,1|1,0,0]=3 15081 B16R1.688 CCOCCNC(=O)NCc1ccccc1 273464a_102516460346_100015324214 [0,1,0,0,0,1|1,0,0]=3 15082 B16R1.688 CCOCCNC(=O)NCc1ccccc1 512a_100011200944_100015324214 [0,1,0,0,0,1|1,0,0]=3 15083 B16R1.688 CCOCCNC(=O)NCc1ccccc1 512a_100015324214_100011200944 [0,1,0,0,0,1|1,0,0]=3 15084 B16R1.688 CCOCCNC(=O)NCc1ccccn1 2708a_100000210449_100011200944 [0,1,0,0,0,1|2,0,0]=4 15085 B16R1.688 CCOCCNC(=O)NCc1ccccn1 2708a_100011200944_100000210449 [0,1,0,0,0,1|2,0,0]=4 15086 B16R1.688 CCOCCNC(=O)NCc1ccccn1 273464a_100000210449_102516460346 [0,1,0,0,0,1|2,0,0]=4 15087 B16R1.688 CCOCCNC(=O)NCc1ccccn1 273464a_102516460346_100000210449 [0,1,0,0,0,1|2,0,0]=4 15088 B16R1.688 CCOCCNC(=O)NCc1ccccn1 512a_100011200944_100000210449 [0,1,0,0,0,1|2,0,0]=4 15089 B16R1.688 CCOCCNC(=O)NCc1cccnc1 2708a_100000210453_100011200944 [0,1,0,0,0,1|2,0,0]=4 15090 B16R1.688 CCOCCNC(=O)NCc1cccnc1 2708a_100011200944_100000210453 [0,1,0,0,0,1|2,0,0]=4 15091 B16R1.688 CCOCCNC(=O)NCc1cccnc1 273464a_100000210453_102516460346 [0,1,0,0,0,1|2,0,0]=4 15092 B16R1.688 CCOCCNC(=O)NCc1cccnc1 273464a_102516460346_100000210453 [0,1,0,0,0,1|2,0,0]=4 15093 B16R1.688 CCOCCNC(=O)NCc1cccnc1 512a_100000210453_100011200944 [0,1,0,0,0,1|2,0,0]=4 15094 B16R1.688 CCOCCNC(=O)NCc1cccnc1 512a_100011200944_100000210453 [0,1,0,0,0,1|2,0,0]=4 15095 B16R1.688 CCOCCNC(=O)NCc1ccncc1 2708a_100000210450_100011200944 [0,1,0,0,0,1|2,0,0]=4 15096 B16R1.688 CCOCCNC(=O)NCc1ccncc1 2708a_100011200944_100000210450 [0,1,0,0,0,1|2,0,0]=4 15097 B16R1.688 CCOCCNC(=O)NCc1ccncc1 273464a_100000210450_102516460346 [0,1,0,0,0,1|2,0,0]=4 15098 B16R1.688 CCOCCNC(=O)NCc1ccncc1 273464a_102516460346_100000210450 [0,1,0,0,0,1|2,0,0]=4 15099 B16R1.688 CCOCCNC(=O)NCc1ccncc1 512a_100011200944_100000210450 [0,1,0,0,0,1|2,0,0]=4 15100 B16R1.688 CCOCCNC(=O)NNc1ccccc1 273464a_102516460346_100015195140 [0,1,0,0,0,1|2,0,0]=4 15101 B16R1.688 CCOCCNC(=O)NNc1ccccc1 512a_100011200944_100015195140 [0,1,0,0,0,1|2,0,0]=4 15102 B16R1.688 CCOCCNC(=O)OCc1ccccc1 34a_100000159002_100000210202 [0,1,0,0,0,1|1,0,0]=3 15103 B16R1.688 CCOCCNC(=O)OCc1ccccc1 7a_100000159002_100000210202 [0,1,0,0,0,1|1,0,0]=3 15104 B16R1.688 CCOCCOC(=O)CNc1ccccc1 34a_100000106764_200000101388 [0,1,0,0,0,1|0,0,0]=2 15105 B16R1.688 CCOCCOC(=O)COc1ccccc1 34a_100000210340_200000101388 [0,1,0,0,0,1|0,0,0]=2 15106 B16R1.688 CCOCCOC(=O)COc1ccccc1 7a_100000210340_200000101388 [0,1,0,0,0,1|0,0,0]=2 15107 B16R1.688 CCOCCOC(=O)COc1cccnc1 34a_100000210849_200000101388 [0,1,0,0,0,1|1,0,0]=3 15108 B16R1.688 CCOCCOC(=O)COc1cccnc1 7a_100000210849_200000101388 [0,1,0,0,0,1|1,0,0]=3 15109 B16R1.688 CCOCCOC(=O)COc1ccncc1 34a_100000212176_200000101388 [0,1,0,0,0,1|1,0,0]=3 15110 B16R1.688 CCOCCOC(=O)COc1ccnnc1 34a_100015204005_200000101388 [0,1,0,0,0,1|2,0,0]=4 15111 B16R1.688 CCOCCOC(=O)COc1cncnc1 7a_100000754086_200000101388 [0,1,0,0,0,1|2,0,0]=4 15112 B16R1.688 CCOCCOC(=O)CSc1ccccc1 62a_100000719477_200000101388 [0,1,0,0,0,1|0,0,0]=2 15113 B16R1.688 CCOCCOC(=O)CSc1ccccc1 62a_200000101388_100000041952 [0,1,0,0,0,1|0,0,0]=2 15114 B16R1.688 CCOCCOC(=O)CSc1ccccn1 62a_100011216584_200000101388 [0,1,0,0,0,1|1,0,0]=3 15115 B16R1.688 CCOCCOC(=O)CSc1ccccn1 62a_200000101388_100011216584 [0,1,0,0,0,1|1,0,0]=3 15116 B16R1.688 CCOCCOC(=O)CSc1cccnc1 62a_100000210063_200000101388 [0,1,0,0,0,1|1,0,0]=3 15117 B16R1.688 CCOCCOC(=O)CSc1cccnc1 62a_200000101388_100000210063 [0,1,0,0,0,1|1,0,0]=3 15118 B16R1.688 CCOCCOC(=O)CSc1cccnn1 62a_100016991348_200000101388 [0,1,0,0,0,1|2,0,0]=4 15119 B16R1.688 CCOCCOC(=O)CSc1cccnn1 62a_200000101388_100016991348 [0,1,0,0,0,1|2,0,0]=4 15120 B16R1.688 CCOCCOC(=O)CSc1ccncc1 62a_100000728582_200000101388 [0,1,0,0,0,1|1,0,0]=3 15121 B16R1.688 CCOCCOC(=O)CSc1ccncc1 62a_200000101388_100000728582 [0,1,0,0,0,1|1,0,0]=3 15122 B16R1.688 CCOCCOC(=O)CSc1ccncn1 62a_100000703185_200000101388 [0,1,0,0,0,1|2,0,0]=4 15123 B16R1.688 CCOCCOC(=O)CSc1ccncn1 62a_200000101388_100000703185 [0,1,0,0,0,1|2,0,0]=4 15124 B16R1.688 CCOCCOC(=O)CSc1ccnnc1 62a_100000732662_200000101388 [0,1,0,0,0,1|2,0,0]=4 15125 B16R1.688 CCOCCOC(=O)CSc1ccnnc1 62a_200000101388_100000732662 [0,1,0,0,0,1|2,0,0]=4 15126 B16R1.688 CCOCCOC(=O)CSc1cnccn1 62a_100000211759_200000101388 [0,1,0,0,0,1|2,0,0]=4 15127 B16R1.688 CCOCCOC(=O)CSc1cnccn1 62a_200000101388_100000211759 [0,1,0,0,0,1|2,0,0]=4 15128 B16R1.688 CCOCCOC(=O)CSc1cncnc1 62a_100011206942_200000101388 [0,1,0,0,0,1|2,0,0]=4 15129 B16R1.688 CCOCCOC(=O)CSc1cncnc1 62a_200000101388_100011206942 [0,1,0,0,0,1|2,0,0]=4 15130 B16R1.688 CCOCCOC(=O)CSc1ncccn1 62a_100000211032_200000101388 [0,1,0,0,0,1|2,0,0]=4 15131 B16R1.688 CCOCCOC(=O)CSc1ncccn1 62a_200000101388_100000211032 [0,1,0,0,0,1|2,0,0]=4 15132 B16R1.688 CCOCCOC(C)COc1ccccc1 34a_100000210911_100000210147 [0,1,0,0,0,1|1,0,1]=4 15133 B16R1.688 CCOCCOC(C)COc1ccccc1 7a_100000210911_100011215890 [0,1,0,0,0,1|1,0,1]=4 15134 B16R1.688 CCOCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000210147 [0,1,0,0,0,1|1,0,1]=4 15135 B16R1.688 CCOCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100011215890 [0,1,0,0,0,1|1,0,1]=4 15136 B16R1.688 CCOCSCC(=O)CCc1ccccc1 62a_100000739092_100012361361 [0,1,0,0,0,1|1,1,0]=4 15137 B16R1.688 CCOCSCC(=O)CCc1ccccc1 62a_100012361361_100000739092 [0,1,0,0,0,1|1,1,0]=4 15138 B16R1.688 CCOCSCC(=O)NCc1ccccc1 62a_100000183539_100000739092 [0,1,0,0,0,1|1,1,0]=4 15139 B16R1.688 CCOCSCC(=O)NCc1ccccc1 62a_100000739092_100000183539 [0,1,0,0,0,1|1,1,0]=4 15140 B16R1.688 CCOCSCC(=O)OCc1ccccc1 62a_100000739092_100000753625 [0,1,0,0,0,1|1,1,0]=4 15141 B16R1.688 CCOCSCC(=O)OCc1ccccc1 62a_100000753625_100000739092 [0,1,0,0,0,1|1,1,0]=4 15142 B16R1.688 CCSCCCC(=O)OCc1ccccc1 62a_100000210202_100009813218 [0,1,0,0,0,1|1,0,0]=3 15143 B16R1.688 CCSCCCC(=O)OCc1ccccc1 62a_100009813218_100000210202 [0,1,0,0,0,1|1,0,0]=3 15144 B16R1.688 CCSCCNC(=O)C#Cc1ccccc1 240690a_100000106463_100000736102 [0,1,0,0,0,1|1,0,1]=4 15145 B16R1.688 CCSCCNC(=O)C=Cc1ccccc1 11a_100000106463_100000210462 [0,1,0,0,0,1|1,0,1]=4 15146 B16R1.688 CCSCCNC(=O)C=Cc1ccccc1 1626a_100000106463_100000210462 [0,1,0,0,0,1|1,0,1]=4 15147 B16R1.688 CCSCCNC(=O)CCc1ccccc1 11a_100000106463_100000185753 [0,1,0,0,0,1|1,0,0]=3 15148 B16R1.688 CCSCCNC(=O)CCc1ccccc1 1626a_100000106463_100000185753 [0,1,0,0,0,1|1,0,0]=3 15149 B16R1.688 CCSCCNC(=O)CCc1ccccc1 240690a_100000106463_100000185753 [0,1,0,0,0,1|1,0,0]=3 15150 B16R1.688 CCSCCNC(=O)CCc1ccccc1 527a_100000106463_100000185753 [0,1,0,0,0,1|1,0,0]=3 15151 B16R1.688 CCSCCNC(=O)CCc1ccccn1 11a_100000106463_100015195070 [0,1,0,0,0,1|2,0,0]=4 15152 B16R1.688 CCSCCNC(=O)CCc1ccccn1 240690a_100000106463_100015195070 [0,1,0,0,0,1|2,0,0]=4 15153 B16R1.688 CCSCCNC(=O)CCc1ccccn1 527a_100000106463_100015195070 [0,1,0,0,0,1|2,0,0]=4 15154 B16R1.688 CCSCCNC(=O)CCc1cccnc1 11a_100000106463_100000198484 [0,1,0,0,0,1|2,0,0]=4 15155 B16R1.688 CCSCCNC(=O)CCc1cccnc1 1626a_100000106463_100000198484 [0,1,0,0,0,1|2,0,0]=4 15156 B16R1.688 CCSCCNC(=O)CCc1cccnc1 240690a_100000106463_100000198484 [0,1,0,0,0,1|2,0,0]=4 15157 B16R1.688 CCSCCNC(=O)CCc1cccnc1 527a_100000106463_100000198484 [0,1,0,0,0,1|2,0,0]=4 15158 B16R1.688 CCSCCNC(=O)CCc1ccncc1 11a_100000106463_100011225043 [0,1,0,0,0,1|2,0,0]=4 15159 B16R1.688 CCSCCNC(=O)CCc1ccncc1 240690a_100000106463_100011225043 [0,1,0,0,0,1|2,0,0]=4 15160 B16R1.688 CCSCCNC(=O)CCc1ccncc1 527a_100000106463_100011225043 [0,1,0,0,0,1|2,0,0]=4 15161 B16R1.688 CCSCCNC(=O)COc1ccccc1 11a_100000106463_100000186222 [0,1,0,0,0,1|1,0,0]=3 15162 B16R1.688 CCSCCNC(=O)COc1ccccc1 1626a_100000106463_100000186222 [0,1,0,0,0,1|1,0,0]=3 15163 B16R1.688 CCSCCNC(=O)COc1ccccc1 240690a_100000106463_100000186222 [0,1,0,0,0,1|1,0,0]=3 15164 B16R1.688 CCSCCNC(=O)COc1ccccc1 527a_100000106463_100000186222 [0,1,0,0,0,1|1,0,0]=3 15165 B16R1.688 CCSCCNC(=O)COc1ccccn1 1626a_100000106463_100102699861 [0,1,0,0,0,1|2,0,0]=4 15166 B16R1.688 CCSCCNC(=O)COc1ccccn1 240690a_100000106463_100102699861 [0,1,0,0,0,1|2,0,0]=4 15167 B16R1.688 CCSCCNC(=O)COc1ccccn1 527a_100000106463_100102699861 [0,1,0,0,0,1|2,0,0]=4 15168 B16R1.688 CCSCCNC(=O)COc1cccnc1 11a_100000106463_100015207166 [0,1,0,0,0,1|2,0,0]=4 15169 B16R1.688 CCSCCNC(=O)COc1cccnc1 1626a_100000106463_100015207166 [0,1,0,0,0,1|2,0,0]=4 15170 B16R1.688 CCSCCNC(=O)COc1cccnc1 240690a_100000106463_100015207166 [0,1,0,0,0,1|2,0,0]=4 15171 B16R1.688 CCSCCNC(=O)COc1cccnc1 527a_100000106463_100015207166 [0,1,0,0,0,1|2,0,0]=4 15172 B16R1.688 CCSCCNC(=O)CSc1ccccc1 11a_100000106463_100000211596 [0,1,0,0,0,1|1,0,0]=3 15173 B16R1.688 CCSCCNC(=O)CSc1ccccc1 1626a_100000106463_100000211596 [0,1,0,0,0,1|1,0,0]=3 15174 B16R1.688 CCSCCNC(=O)CSc1ccccc1 240690a_100000106463_100000211596 [0,1,0,0,0,1|1,0,0]=3 15175 B16R1.688 CCSCCNC(=O)CSc1ccccc1 527a_100000106463_100000211596 [0,1,0,0,0,1|1,0,0]=3 15176 B16R1.688 CCSCCNC(=O)CSc1ccccn1 11a_100000106463_100000156281 [0,1,0,0,0,1|2,0,0]=4 15177 B16R1.688 CCSCCNC(=O)CSc1ccccn1 240690a_100000106463_100000156281 [0,1,0,0,0,1|2,0,0]=4 15178 B16R1.688 CCSCCNC(=O)CSc1ccccn1 527a_100000106463_100000156281 [0,1,0,0,0,1|2,0,0]=4 15179 B16R1.688 CCSCCNC(=O)CSc1ccncc1 11a_100000106463_100000211328 [0,1,0,0,0,1|2,0,0]=4 15180 B16R1.688 CCSCCNC(=O)CSc1ccncc1 1626a_100000106463_100000211328 [0,1,0,0,0,1|2,0,0]=4 15181 B16R1.688 CCSCCNC(=O)CSc1ccncc1 240690a_100000106463_100000211328 [0,1,0,0,0,1|2,0,0]=4 15182 B16R1.688 CCSCCNC(=O)CSc1ccncc1 527a_100000106463_100000211328 [0,1,0,0,0,1|2,0,0]=4 15183 B16R1.688 CCSCCNC(=O)NCc1ccccc1 2708a_100000106463_100015324214 [0,1,0,0,0,1|1,0,0]=3 15184 B16R1.688 CCSCCNC(=O)NCc1ccccc1 2708a_100015324214_100000106463 [0,1,0,0,0,1|1,0,0]=3 15185 B16R1.688 CCSCCNC(=O)NCc1ccccc1 273464a_100000106463_100015324214 [0,1,0,0,0,1|1,0,0]=3 15186 B16R1.688 CCSCCNC(=O)NCc1ccccc1 273464a_100015324214_100000106463 [0,1,0,0,0,1|1,0,0]=3 15187 B16R1.688 CCSCCNC(=O)NCc1ccccc1 512a_100000106463_100015324214 [0,1,0,0,0,1|1,0,0]=3 15188 B16R1.688 CCSCCNC(=O)NCc1ccccc1 512a_100015324214_100000106463 [0,1,0,0,0,1|1,0,0]=3 15189 B16R1.688 CCSCCNC(=O)NCc1ccccn1 2708a_100000106463_100000210449 [0,1,0,0,0,1|2,0,0]=4 15190 B16R1.688 CCSCCNC(=O)NCc1ccccn1 2708a_100000210449_100000106463 [0,1,0,0,0,1|2,0,0]=4 15191 B16R1.688 CCSCCNC(=O)NCc1ccccn1 273464a_100000106463_100000210449 [0,1,0,0,0,1|2,0,0]=4 15192 B16R1.688 CCSCCNC(=O)NCc1ccccn1 273464a_100000210449_100000106463 [0,1,0,0,0,1|2,0,0]=4 15193 B16R1.688 CCSCCNC(=O)NCc1ccccn1 512a_100000106463_100000210449 [0,1,0,0,0,1|2,0,0]=4 15194 B16R1.688 CCSCCNC(=O)NCc1cccnc1 2708a_100000106463_100000210453 [0,1,0,0,0,1|2,0,0]=4 15195 B16R1.688 CCSCCNC(=O)NCc1cccnc1 2708a_100000210453_100000106463 [0,1,0,0,0,1|2,0,0]=4 15196 B16R1.688 CCSCCNC(=O)NCc1cccnc1 273464a_100000106463_100000210453 [0,1,0,0,0,1|2,0,0]=4 15197 B16R1.688 CCSCCNC(=O)NCc1cccnc1 273464a_100000210453_100000106463 [0,1,0,0,0,1|2,0,0]=4 15198 B16R1.688 CCSCCNC(=O)NCc1cccnc1 512a_100000106463_100000210453 [0,1,0,0,0,1|2,0,0]=4 15199 B16R1.688 CCSCCNC(=O)NCc1cccnc1 512a_100000210453_100000106463 [0,1,0,0,0,1|2,0,0]=4 15200 B16R1.688 CCSCCNC(=O)NCc1ccncc1 2708a_100000106463_100000210450 [0,1,0,0,0,1|2,0,0]=4 15201 B16R1.688 CCSCCNC(=O)NCc1ccncc1 2708a_100000210450_100000106463 [0,1,0,0,0,1|2,0,0]=4 15202 B16R1.688 CCSCCNC(=O)NCc1ccncc1 273464a_100000106463_100000210450 [0,1,0,0,0,1|2,0,0]=4 15203 B16R1.688 CCSCCNC(=O)NCc1ccncc1 273464a_100000210450_100000106463 [0,1,0,0,0,1|2,0,0]=4 15204 B16R1.688 CCSCCNC(=O)NCc1ccncc1 512a_100000106463_100000210450 [0,1,0,0,0,1|2,0,0]=4 15205 B16R1.688 CCSCCNC(=O)NNc1ccccc1 273464a_100000106463_100015195140 [0,1,0,0,0,1|2,0,0]=4 15206 B16R1.688 CCSCCNC(=O)NNc1ccccc1 512a_100000106463_100015195140 [0,1,0,0,0,1|2,0,0]=4 15207 B16R1.688 CCSCCNC(=O)OCc1ccccc1 62a_100000210202_100012357035 [0,1,0,0,0,1|1,0,0]=3 15208 B16R1.688 CCSCCNC(=O)OCc1ccccc1 62a_100012357035_100000210202 [0,1,0,0,0,1|1,0,0]=3 15209 B16R1.688 CCSCCOC(C)COc1ccccc1 34a_100000210911_100000757381 [0,1,0,0,0,1|1,0,1]=4 15210 B16R1.688 CCSCCOC(C)COc1ccccc1 7a_100000210911_100000757381 [0,1,0,0,0,1|1,0,1]=4 15211 B16R1.688 CCSCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000757381 [0,1,0,0,0,1|1,0,1]=4 15212 B16R1.688 CCSCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000757381 [0,1,0,0,0,1|1,0,1]=4 15213 B16R1.688 CNCCCNC(=O)OCc1ccccc1 2230a_106832991635_100012340047 [0,1,0,0,0,1|1,0,0]=3 15214 B16R1.688 CNCCCNC(=O)OCc1ccccc1 34a_100102657272_100012340047 [0,1,0,0,0,1|1,0,0]=3 15215 B16R1.688 CNCCCNC(=O)OCc1ccccc1 7a_106832991635_100012340047 [0,1,0,0,0,1|1,0,0]=3 15216 B16R1.688 COCCCCC(=O)C#Cc1ccccc1 1458a_100000736102_100000755781 [0,1,0,0,0,1|1,0,1]=4 15217 B16R1.688 COCCCCC(=O)C=Cc1ccccc1 1458a_100000210462_100000755781 [0,1,0,0,0,1|1,0,1]=4 15218 B16R1.688 COCCCCC(=O)CCc1ccccc1 1458a_100000185753_100000755781 [0,1,0,0,0,1|1,0,0]=3 15219 B16R1.688 COCCCCC(=O)CCc1ccccn1 1458a_100015195070_100000755781 [0,1,0,0,0,1|2,0,0]=4 15220 B16R1.688 COCCCCC(=O)CCc1cccnc1 1458a_100000198484_100000755781 [0,1,0,0,0,1|2,0,0]=4 15221 B16R1.688 COCCCCC(=O)CCc1ccncc1 1458a_100011225043_100000755781 [0,1,0,0,0,1|2,0,0]=4 15222 B16R1.688 COCCCCC(=O)COc1ccccc1 1458a_100000186222_100000755781 [0,1,0,0,0,1|1,0,0]=3 15223 B16R1.688 COCCCCC(=O)COc1ccccn1 1458a_100102699861_100000755781 [0,1,0,0,0,1|2,0,0]=4 15224 B16R1.688 COCCCCC(=O)COc1cccnc1 1458a_100015207166_100000755781 [0,1,0,0,0,1|2,0,0]=4 15225 B16R1.688 COCCCCC(=O)CSc1ccccc1 1458a_100000211596_100000755781 [0,1,0,0,0,1|1,0,0]=3 15226 B16R1.688 COCCCCC(=O)CSc1ccccn1 1458a_100000156281_100000755781 [0,1,0,0,0,1|2,0,0]=4 15227 B16R1.688 COCCCCC(=O)CSc1ccncc1 1458a_100000211328_100000755781 [0,1,0,0,0,1|2,0,0]=4 15228 B16R1.688 COCCCCC(=O)OCc1ccccc1 7a_200000059030_200000210301 [0,1,0,0,0,1|1,0,0]=3 15229 B16R1.688 COCCCNC(=O)C#Cc1ccccc1 240690a_100150723488_100000736102 [0,1,0,0,0,1|1,0,1]=4 15230 B16R1.688 COCCCNC(=O)C=Cc1ccccc1 1626a_100150723488_100000210462 [0,1,0,0,0,1|1,0,1]=4 15231 B16R1.688 COCCCNC(=O)CCc1ccccc1 1626a_100150723488_100000185753 [0,1,0,0,0,1|1,0,0]=3 15232 B16R1.688 COCCCNC(=O)CCc1ccccc1 240690a_100150723488_100000185753 [0,1,0,0,0,1|1,0,0]=3 15233 B16R1.688 COCCCNC(=O)CCc1ccccc1 527a_100150723488_100000185753 [0,1,0,0,0,1|1,0,0]=3 15234 B16R1.688 COCCCNC(=O)CCc1ccccn1 240690a_100150723488_100015195070 [0,1,0,0,0,1|2,0,0]=4 15235 B16R1.688 COCCCNC(=O)CCc1ccccn1 527a_100150723488_100015195070 [0,1,0,0,0,1|2,0,0]=4 15236 B16R1.688 COCCCNC(=O)CCc1cccnc1 1626a_100150723488_100000198484 [0,1,0,0,0,1|2,0,0]=4 15237 B16R1.688 COCCCNC(=O)CCc1cccnc1 240690a_100150723488_100000198484 [0,1,0,0,0,1|2,0,0]=4 15238 B16R1.688 COCCCNC(=O)CCc1cccnc1 527a_100150723488_100000198484 [0,1,0,0,0,1|2,0,0]=4 15239 B16R1.688 COCCCNC(=O)CCc1ccncc1 240690a_100150723488_100011225043 [0,1,0,0,0,1|2,0,0]=4 15240 B16R1.688 COCCCNC(=O)CCc1ccncc1 527a_100150723488_100011225043 [0,1,0,0,0,1|2,0,0]=4 15241 B16R1.688 COCCCNC(=O)CNc1ccccc1 34a_100000106764_100000183178 [0,1,0,0,0,1|1,0,0]=3 15242 B16R1.688 COCCCNC(=O)COc1ccccc1 1626a_100150723488_100000186222 [0,1,0,0,0,1|1,0,0]=3 15243 B16R1.688 COCCCNC(=O)COc1ccccc1 240690a_100150723488_100000186222 [0,1,0,0,0,1|1,0,0]=3 15244 B16R1.688 COCCCNC(=O)COc1ccccc1 34a_100000210340_100000183178 [0,1,0,0,0,1|1,0,0]=3 15245 B16R1.688 COCCCNC(=O)COc1ccccc1 527a_100150723488_100000186222 [0,1,0,0,0,1|1,0,0]=3 15246 B16R1.688 COCCCNC(=O)COc1ccccc1 7a_100000210340_100000183178 [0,1,0,0,0,1|1,0,0]=3 15247 B16R1.688 COCCCNC(=O)COc1ccccn1 1626a_100150723488_100102699861 [0,1,0,0,0,1|2,0,0]=4 15248 B16R1.688 COCCCNC(=O)COc1ccccn1 240690a_100150723488_100102699861 [0,1,0,0,0,1|2,0,0]=4 15249 B16R1.688 COCCCNC(=O)COc1ccccn1 527a_100150723488_100102699861 [0,1,0,0,0,1|2,0,0]=4 15250 B16R1.688 COCCCNC(=O)COc1cccnc1 1626a_100150723488_100015207166 [0,1,0,0,0,1|2,0,0]=4 15251 B16R1.688 COCCCNC(=O)COc1cccnc1 240690a_100150723488_100015207166 [0,1,0,0,0,1|2,0,0]=4 15252 B16R1.688 COCCCNC(=O)COc1cccnc1 34a_100000210849_100000183178 [0,1,0,0,0,1|2,0,0]=4 15253 B16R1.688 COCCCNC(=O)COc1cccnc1 527a_100150723488_100015207166 [0,1,0,0,0,1|2,0,0]=4 15254 B16R1.688 COCCCNC(=O)COc1cccnc1 7a_100000210849_100000183178 [0,1,0,0,0,1|2,0,0]=4 15255 B16R1.688 COCCCNC(=O)COc1ccncc1 34a_100000212176_100000183178 [0,1,0,0,0,1|2,0,0]=4 15256 B16R1.688 COCCCNC(=O)CSc1ccccc1 1626a_100150723488_100000211596 [0,1,0,0,0,1|1,0,0]=3 15257 B16R1.688 COCCCNC(=O)CSc1ccccc1 240690a_100150723488_100000211596 [0,1,0,0,0,1|1,0,0]=3 15258 B16R1.688 COCCCNC(=O)CSc1ccccc1 527a_100150723488_100000211596 [0,1,0,0,0,1|1,0,0]=3 15259 B16R1.688 COCCCNC(=O)CSc1ccccc1 62a_100000183178_100000041952 [0,1,0,0,0,1|1,0,0]=3 15260 B16R1.688 COCCCNC(=O)CSc1ccccn1 240690a_100150723488_100000156281 [0,1,0,0,0,1|2,0,0]=4 15261 B16R1.688 COCCCNC(=O)CSc1ccccn1 527a_100150723488_100000156281 [0,1,0,0,0,1|2,0,0]=4 15262 B16R1.688 COCCCNC(=O)CSc1ccccn1 62a_100000183178_100011216584 [0,1,0,0,0,1|2,0,0]=4 15263 B16R1.688 COCCCNC(=O)CSc1cccnc1 62a_100000183178_100000210063 [0,1,0,0,0,1|2,0,0]=4 15264 B16R1.688 COCCCNC(=O)CSc1ccncc1 1626a_100150723488_100000211328 [0,1,0,0,0,1|2,0,0]=4 15265 B16R1.688 COCCCNC(=O)CSc1ccncc1 240690a_100150723488_100000211328 [0,1,0,0,0,1|2,0,0]=4 15266 B16R1.688 COCCCNC(=O)CSc1ccncc1 527a_100150723488_100000211328 [0,1,0,0,0,1|2,0,0]=4 15267 B16R1.688 COCCCNC(=O)CSc1ccncc1 62a_100000183178_100000728582 [0,1,0,0,0,1|2,0,0]=4 15268 B16R1.688 COCCCNC(=O)NCc1ccccc1 2708a_100015324214_100150723488 [0,1,0,0,0,1|1,0,0]=3 15269 B16R1.688 COCCCNC(=O)NCc1ccccc1 2708a_100150723488_100015324214 [0,1,0,0,0,1|1,0,0]=3 15270 B16R1.688 COCCCNC(=O)NCc1ccccc1 273464a_100015324214_100150723488 [0,1,0,0,0,1|1,0,0]=3 15271 B16R1.688 COCCCNC(=O)NCc1ccccc1 273464a_100150723488_100015324214 [0,1,0,0,0,1|1,0,0]=3 15272 B16R1.688 COCCCNC(=O)NCc1ccccc1 512a_100015324214_100150723488 [0,1,0,0,0,1|1,0,0]=3 15273 B16R1.688 COCCCNC(=O)NCc1ccccn1 2708a_100000210449_100150723488 [0,1,0,0,0,1|2,0,0]=4 15274 B16R1.688 COCCCNC(=O)NCc1ccccn1 2708a_100150723488_100000210449 [0,1,0,0,0,1|2,0,0]=4 15275 B16R1.688 COCCCNC(=O)NCc1ccccn1 273464a_100000210449_100150723488 [0,1,0,0,0,1|2,0,0]=4 15276 B16R1.688 COCCCNC(=O)NCc1ccccn1 273464a_100150723488_100000210449 [0,1,0,0,0,1|2,0,0]=4 15277 B16R1.688 COCCCNC(=O)NCc1cccnc1 2708a_100000210453_100150723488 [0,1,0,0,0,1|2,0,0]=4 15278 B16R1.688 COCCCNC(=O)NCc1cccnc1 2708a_100150723488_100000210453 [0,1,0,0,0,1|2,0,0]=4 15279 B16R1.688 COCCCNC(=O)NCc1cccnc1 273464a_100000210453_100150723488 [0,1,0,0,0,1|2,0,0]=4 15280 B16R1.688 COCCCNC(=O)NCc1cccnc1 273464a_100150723488_100000210453 [0,1,0,0,0,1|2,0,0]=4 15281 B16R1.688 COCCCNC(=O)NCc1cccnc1 512a_100000210453_100150723488 [0,1,0,0,0,1|2,0,0]=4 15282 B16R1.688 COCCCNC(=O)NCc1ccncc1 2708a_100000210450_100150723488 [0,1,0,0,0,1|2,0,0]=4 15283 B16R1.688 COCCCNC(=O)NCc1ccncc1 2708a_100150723488_100000210450 [0,1,0,0,0,1|2,0,0]=4 15284 B16R1.688 COCCCNC(=O)NCc1ccncc1 273464a_100000210450_100150723488 [0,1,0,0,0,1|2,0,0]=4 15285 B16R1.688 COCCCNC(=O)NCc1ccncc1 273464a_100150723488_100000210450 [0,1,0,0,0,1|2,0,0]=4 15286 B16R1.688 COCCCNC(=O)NNc1ccccc1 273464a_100150723488_100015195140 [0,1,0,0,0,1|2,0,0]=4 15287 B16R1.688 COCCCNC(=O)OCc1ccccc1 34a_100011215709_200000210301 [0,1,0,0,0,1|1,0,0]=3 15288 B16R1.688 COCCCNC(=O)OCc1ccccc1 34a_100138415774_100012340047 [0,1,0,0,0,1|1,0,0]=3 15289 B16R1.688 COCCCNC(=O)OCc1ccccc1 7a_100011215709_200000210301 [0,1,0,0,0,1|1,0,0]=3 15290 B16R1.688 COCCCOC(C)COc1ccccc1 34a_100000210911_100000740836 [0,1,0,0,0,1|1,0,1]=4 15291 B16R1.688 COCCCOC(C)COc1ccccc1 34a_200011103555_200000210301 [0,1,0,0,0,1|1,0,1]=4 15292 B16R1.688 COCCCOC(C)COc1ccccc1 7a_100000210911_100000740836 [0,1,0,0,0,1|1,0,1]=4 15293 B16R1.688 COCCCOC(C)COc1ccccc1 7a_200011103555_200000210301 [0,1,0,0,0,1|1,0,1]=4 15294 B16R1.688 COCCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000740836 [0,1,0,0,0,1|1,0,1]=4 15295 B16R1.688 COCCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000740836 [0,1,0,0,0,1|1,0,1]=4 15296 B16R1.688 COCCNCC(=O)CCc1ccccc1 2230a_100000209980_100012361361 [0,1,0,0,0,1|2,0,0]=4 15297 B16R1.688 COCCNCC(=O)NCc1ccccc1 2230a_100000209980_100000183539 [0,1,0,0,0,1|2,0,0]=4 15298 B16R1.688 COCCNCC(=O)NCc1ccccc1 2230a_100000739245_100011201679 [0,1,0,0,0,1|2,0,0]=4 15299 B16R1.688 COCCNCC(=O)OCc1ccccc1 2230a_100000209980_100000753625 [0,1,0,0,0,1|2,0,0]=4 15300 B16R1.688 COCCNNC(=O)CCc1ccccc1 22a_100000741390_100000185753 [0,1,0,0,0,1|2,0,0]=4 15301 B16R1.688 COCCNNC(=O)COc1ccccc1 22a_100000741390_100000186222 [0,1,0,0,0,1|2,0,0]=4 15302 B16R1.688 COCCNNC(=O)CSc1ccccc1 22a_100000741390_100000211596 [0,1,0,0,0,1|2,0,0]=4 15303 B16R1.688 COCCNNC(=O)NCc1ccccc1 273464a_100015324214_100000741390 [0,1,0,0,0,1|2,0,0]=4 15304 B16R1.688 COCCOCC(=O)CCc1ccccc1 1458a_100000211095_100000765856 [0,1,0,0,0,1|1,0,0]=3 15305 B16R1.688 COCCOCC(=O)CCc1ccccc1 34a_100000210237_100012361361 [0,1,0,0,0,1|1,0,0]=3 15306 B16R1.688 COCCOCC(=O)CCc1ccccn1 1458a_100000211095_100015183660 [0,1,0,0,0,1|2,0,0]=4 15307 B16R1.688 COCCOCC(=O)CCc1cccnc1 1458a_100000211095_200011713674 [0,1,0,0,0,1|2,0,0]=4 15308 B16R1.688 COCCOCC(=O)CCc1ccncc1 1458a_100000211095_100000723409 [0,1,0,0,0,1|2,0,0]=4 15309 B16R1.688 COCCOCC(=O)NCc1ccccc1 11a_100015324214_100000211095 [0,1,0,0,0,1|1,0,0]=3 15310 B16R1.688 COCCOCC(=O)NCc1ccccc1 1626a_100015324214_100000211095 [0,1,0,0,0,1|1,0,0]=3 15311 B16R1.688 COCCOCC(=O)NCc1ccccc1 240690a_100015324214_100000211095 [0,1,0,0,0,1|1,0,0]=3 15312 B16R1.688 COCCOCC(=O)NCc1ccccc1 34a_100000210237_100000183539 [0,1,0,0,0,1|1,0,0]=3 15313 B16R1.688 COCCOCC(=O)NCc1ccccc1 527a_100015324214_100000211095 [0,1,0,0,0,1|1,0,0]=3 15314 B16R1.688 COCCOCC(=O)NCc1ccccn1 11a_100000210449_100000211095 [0,1,0,0,0,1|2,0,0]=4 15315 B16R1.688 COCCOCC(=O)NCc1ccccn1 1626a_100000210449_100000211095 [0,1,0,0,0,1|2,0,0]=4 15316 B16R1.688 COCCOCC(=O)NCc1ccccn1 240690a_100000210449_100000211095 [0,1,0,0,0,1|2,0,0]=4 15317 B16R1.688 COCCOCC(=O)NCc1ccccn1 34a_100000210237_100000684169 [0,1,0,0,0,1|2,0,0]=4 15318 B16R1.688 COCCOCC(=O)NCc1ccccn1 527a_100000210449_100000211095 [0,1,0,0,0,1|2,0,0]=4 15319 B16R1.688 COCCOCC(=O)NCc1cccnc1 11a_100000210453_100000211095 [0,1,0,0,0,1|2,0,0]=4 15320 B16R1.688 COCCOCC(=O)NCc1cccnc1 240690a_100000210453_100000211095 [0,1,0,0,0,1|2,0,0]=4 15321 B16R1.688 COCCOCC(=O)NCc1cccnc1 527a_100000210453_100000211095 [0,1,0,0,0,1|2,0,0]=4 15322 B16R1.688 COCCOCC(=O)NCc1ccncc1 11a_100000210450_100000211095 [0,1,0,0,0,1|2,0,0]=4 15323 B16R1.688 COCCOCC(=O)NCc1ccncc1 1626a_100000210450_100000211095 [0,1,0,0,0,1|2,0,0]=4 15324 B16R1.688 COCCOCC(=O)NCc1ccncc1 240690a_100000210450_100000211095 [0,1,0,0,0,1|2,0,0]=4 15325 B16R1.688 COCCOCC(=O)NCc1ccncc1 527a_100000210450_100000211095 [0,1,0,0,0,1|2,0,0]=4 15326 B16R1.688 COCCOCC(=O)NNc1ccccc1 22a_100015195140_100000211095 [0,1,0,0,0,1|2,0,0]=4 15327 B16R1.688 COCCOCC(=O)OCc1ccccc1 34a_100000210237_100000753625 [0,1,0,0,0,1|1,0,0]=3 15328 B16R1.688 COCCSCC(=O)CCc1ccccc1 62a_100000233755_100012361361 [0,1,0,0,0,1|1,1,0]=4 15329 B16R1.688 COCCSCC(=O)CCc1ccccc1 62a_100012361361_100000233755 [0,1,0,0,0,1|1,1,0]=4 15330 B16R1.688 COCCSCC(=O)NCc1ccccc1 62a_100000183539_100000233755 [0,1,0,0,0,1|1,1,0]=4 15331 B16R1.688 COCCSCC(=O)NCc1ccccc1 62a_100000233755_100000183539 [0,1,0,0,0,1|1,1,0]=4 15332 B16R1.688 COCCSCC(=O)OCc1ccccc1 62a_100000233755_100000753625 [0,1,0,0,0,1|1,1,0]=4 15333 B16R1.688 COCCSCC(=O)OCc1ccccc1 62a_100000753625_100000233755 [0,1,0,0,0,1|1,1,0]=4 15334 B16R1.688 COCNCCC(=O)NCc1ccccc1 2230a_100025741942_100000766300 [0,1,0,0,0,1|2,0,0]=4 15335 B16R1.688 COCSCCC(=O)OCc1ccccc1 62a_100000766300_100009813219 [0,1,0,0,0,1|2,0,0]=4 15336 B16R1.688 COCSCCC(=O)OCc1ccccc1 62a_100009813219_100000766300 [0,1,0,0,0,1|2,0,0]=4 15337 B16R1.688 CSCCCNC(=O)C#Cc1ccccc1 240690a_100000749238_100000736102 [0,1,0,0,0,1|1,0,1]=4 15338 B16R1.688 CSCCCNC(=O)C=Cc1ccccc1 11a_100000749238_100000210462 [0,1,0,0,0,1|1,0,1]=4 15339 B16R1.688 CSCCCNC(=O)C=Cc1ccccc1 1626a_100000749238_100000210462 [0,1,0,0,0,1|1,0,1]=4 15340 B16R1.688 CSCCCNC(=O)CCc1ccccc1 11a_100000749238_100000185753 [0,1,0,0,0,1|1,0,0]=3 15341 B16R1.688 CSCCCNC(=O)CCc1ccccc1 1626a_100000749238_100000185753 [0,1,0,0,0,1|1,0,0]=3 15342 B16R1.688 CSCCCNC(=O)CCc1ccccc1 240690a_100000749238_100000185753 [0,1,0,0,0,1|1,0,0]=3 15343 B16R1.688 CSCCCNC(=O)CCc1ccccc1 527a_100000749238_100000185753 [0,1,0,0,0,1|1,0,0]=3 15344 B16R1.688 CSCCCNC(=O)CCc1ccccn1 11a_100000749238_100015195070 [0,1,0,0,0,1|2,0,0]=4 15345 B16R1.688 CSCCCNC(=O)CCc1ccccn1 240690a_100000749238_100015195070 [0,1,0,0,0,1|2,0,0]=4 15346 B16R1.688 CSCCCNC(=O)CCc1ccccn1 527a_100000749238_100015195070 [0,1,0,0,0,1|2,0,0]=4 15347 B16R1.688 CSCCCNC(=O)CCc1cccnc1 11a_100000749238_100000198484 [0,1,0,0,0,1|2,0,0]=4 15348 B16R1.688 CSCCCNC(=O)CCc1cccnc1 1626a_100000749238_100000198484 [0,1,0,0,0,1|2,0,0]=4 15349 B16R1.688 CSCCCNC(=O)CCc1cccnc1 240690a_100000749238_100000198484 [0,1,0,0,0,1|2,0,0]=4 15350 B16R1.688 CSCCCNC(=O)CCc1cccnc1 527a_100000749238_100000198484 [0,1,0,0,0,1|2,0,0]=4 15351 B16R1.688 CSCCCNC(=O)CCc1ccncc1 11a_100000749238_100011225043 [0,1,0,0,0,1|2,0,0]=4 15352 B16R1.688 CSCCCNC(=O)CCc1ccncc1 240690a_100000749238_100011225043 [0,1,0,0,0,1|2,0,0]=4 15353 B16R1.688 CSCCCNC(=O)CCc1ccncc1 527a_100000749238_100011225043 [0,1,0,0,0,1|2,0,0]=4 15354 B16R1.688 CSCCCNC(=O)COc1ccccc1 11a_100000749238_100000186222 [0,1,0,0,0,1|1,0,0]=3 15355 B16R1.688 CSCCCNC(=O)COc1ccccc1 1626a_100000749238_100000186222 [0,1,0,0,0,1|1,0,0]=3 15356 B16R1.688 CSCCCNC(=O)COc1ccccc1 240690a_100000749238_100000186222 [0,1,0,0,0,1|1,0,0]=3 15357 B16R1.688 CSCCCNC(=O)COc1ccccc1 527a_100000749238_100000186222 [0,1,0,0,0,1|1,0,0]=3 15358 B16R1.688 CSCCCNC(=O)COc1ccccn1 1626a_100000749238_100102699861 [0,1,0,0,0,1|2,0,0]=4 15359 B16R1.688 CSCCCNC(=O)COc1ccccn1 240690a_100000749238_100102699861 [0,1,0,0,0,1|2,0,0]=4 15360 B16R1.688 CSCCCNC(=O)COc1ccccn1 527a_100000749238_100102699861 [0,1,0,0,0,1|2,0,0]=4 15361 B16R1.688 CSCCCNC(=O)COc1cccnc1 11a_100000749238_100015207166 [0,1,0,0,0,1|2,0,0]=4 15362 B16R1.688 CSCCCNC(=O)COc1cccnc1 1626a_100000749238_100015207166 [0,1,0,0,0,1|2,0,0]=4 15363 B16R1.688 CSCCCNC(=O)COc1cccnc1 240690a_100000749238_100015207166 [0,1,0,0,0,1|2,0,0]=4 15364 B16R1.688 CSCCCNC(=O)COc1cccnc1 527a_100000749238_100015207166 [0,1,0,0,0,1|2,0,0]=4 15365 B16R1.688 CSCCCNC(=O)CSc1ccccc1 11a_100000749238_100000211596 [0,1,0,0,0,1|1,0,0]=3 15366 B16R1.688 CSCCCNC(=O)CSc1ccccc1 1626a_100000749238_100000211596 [0,1,0,0,0,1|1,0,0]=3 15367 B16R1.688 CSCCCNC(=O)CSc1ccccc1 240690a_100000749238_100000211596 [0,1,0,0,0,1|1,0,0]=3 15368 B16R1.688 CSCCCNC(=O)CSc1ccccc1 527a_100000749238_100000211596 [0,1,0,0,0,1|1,0,0]=3 15369 B16R1.688 CSCCCNC(=O)CSc1ccccn1 11a_100000749238_100000156281 [0,1,0,0,0,1|2,0,0]=4 15370 B16R1.688 CSCCCNC(=O)CSc1ccccn1 240690a_100000749238_100000156281 [0,1,0,0,0,1|2,0,0]=4 15371 B16R1.688 CSCCCNC(=O)CSc1ccccn1 527a_100000749238_100000156281 [0,1,0,0,0,1|2,0,0]=4 15372 B16R1.688 CSCCCNC(=O)CSc1ccncc1 11a_100000749238_100000211328 [0,1,0,0,0,1|2,0,0]=4 15373 B16R1.688 CSCCCNC(=O)CSc1ccncc1 1626a_100000749238_100000211328 [0,1,0,0,0,1|2,0,0]=4 15374 B16R1.688 CSCCCNC(=O)CSc1ccncc1 240690a_100000749238_100000211328 [0,1,0,0,0,1|2,0,0]=4 15375 B16R1.688 CSCCCNC(=O)CSc1ccncc1 527a_100000749238_100000211328 [0,1,0,0,0,1|2,0,0]=4 15376 B16R1.688 CSCCCNC(=O)NCc1ccccc1 2708a_100000749238_100015324214 [0,1,0,0,0,1|1,0,0]=3 15377 B16R1.688 CSCCCNC(=O)NCc1ccccc1 2708a_100015324214_100000749238 [0,1,0,0,0,1|1,0,0]=3 15378 B16R1.688 CSCCCNC(=O)NCc1ccccc1 273464a_100000749238_100015324214 [0,1,0,0,0,1|1,0,0]=3 15379 B16R1.688 CSCCCNC(=O)NCc1ccccc1 273464a_100015324214_100000749238 [0,1,0,0,0,1|1,0,0]=3 15380 B16R1.688 CSCCCNC(=O)NCc1ccccc1 512a_100000749238_100015324214 [0,1,0,0,0,1|1,0,0]=3 15381 B16R1.688 CSCCCNC(=O)NCc1ccccc1 512a_100015324214_100000749238 [0,1,0,0,0,1|1,0,0]=3 15382 B16R1.688 CSCCCNC(=O)NCc1ccccn1 2708a_100000210449_100000749238 [0,1,0,0,0,1|2,0,0]=4 15383 B16R1.688 CSCCCNC(=O)NCc1ccccn1 2708a_100000749238_100000210449 [0,1,0,0,0,1|2,0,0]=4 15384 B16R1.688 CSCCCNC(=O)NCc1ccccn1 273464a_100000210449_100000749238 [0,1,0,0,0,1|2,0,0]=4 15385 B16R1.688 CSCCCNC(=O)NCc1ccccn1 273464a_100000749238_100000210449 [0,1,0,0,0,1|2,0,0]=4 15386 B16R1.688 CSCCCNC(=O)NCc1ccccn1 512a_100000749238_100000210449 [0,1,0,0,0,1|2,0,0]=4 15387 B16R1.688 CSCCCNC(=O)NCc1cccnc1 2708a_100000210453_100000749238 [0,1,0,0,0,1|2,0,0]=4 15388 B16R1.688 CSCCCNC(=O)NCc1cccnc1 2708a_100000749238_100000210453 [0,1,0,0,0,1|2,0,0]=4 15389 B16R1.688 CSCCCNC(=O)NCc1cccnc1 273464a_100000210453_100000749238 [0,1,0,0,0,1|2,0,0]=4 15390 B16R1.688 CSCCCNC(=O)NCc1cccnc1 273464a_100000749238_100000210453 [0,1,0,0,0,1|2,0,0]=4 15391 B16R1.688 CSCCCNC(=O)NCc1cccnc1 512a_100000210453_100000749238 [0,1,0,0,0,1|2,0,0]=4 15392 B16R1.688 CSCCCNC(=O)NCc1cccnc1 512a_100000749238_100000210453 [0,1,0,0,0,1|2,0,0]=4 15393 B16R1.688 CSCCCNC(=O)NCc1ccncc1 2708a_100000210450_100000749238 [0,1,0,0,0,1|2,0,0]=4 15394 B16R1.688 CSCCCNC(=O)NCc1ccncc1 2708a_100000749238_100000210450 [0,1,0,0,0,1|2,0,0]=4 15395 B16R1.688 CSCCCNC(=O)NCc1ccncc1 273464a_100000210450_100000749238 [0,1,0,0,0,1|2,0,0]=4 15396 B16R1.688 CSCCCNC(=O)NCc1ccncc1 273464a_100000749238_100000210450 [0,1,0,0,0,1|2,0,0]=4 15397 B16R1.688 CSCCCNC(=O)NCc1ccncc1 512a_100000749238_100000210450 [0,1,0,0,0,1|2,0,0]=4 15398 B16R1.688 CSCCCNC(=O)NNc1ccccc1 273464a_100000749238_100015195140 [0,1,0,0,0,1|2,0,0]=4 15399 B16R1.688 CSCCCNC(=O)NNc1ccccc1 512a_100000749238_100015195140 [0,1,0,0,0,1|2,0,0]=4 15400 B16R1.688 CSCCCNC(=O)OCc1ccccc1 62a_100012340047_200000210301 [0,1,0,0,0,1|1,0,0]=3 15401 B16R1.688 CSCCCNC(=O)OCc1ccccc1 62a_200000210301_100012340047 [0,1,0,0,0,1|1,0,0]=3 15402 B16R1.688 CSCCNCC(=O)CCc1ccccc1 2230a_100020590264_100012361361 [0,1,0,0,0,1|2,0,0]=4 15403 B16R1.688 CSCCNCC(=O)NCc1ccccc1 2230a_100000739245_100000751147 [0,1,0,0,0,1|2,0,0]=4 15404 B16R1.688 CSCCNCC(=O)NCc1ccccc1 2230a_100020590264_100000183539 [0,1,0,0,0,1|2,0,0]=4 15405 B16R1.688 CSCCNCC(=O)OCc1ccccc1 2230a_100020590264_100000753625 [0,1,0,0,0,1|2,0,0]=4 15406 B16R1.688 CSCCOCC(=O)CCc1ccccc1 34a_100000230434_100012361361 [0,1,0,0,0,1|1,0,0]=3 15407 B16R1.688 CSCCOCC(=O)CCc1ccccc1 7a_100000230434_100012361361 [0,1,0,0,0,1|1,0,0]=3 15408 B16R1.688 CSCCOCC(=O)NCc1ccccc1 34a_100000230434_100000183539 [0,1,0,0,0,1|1,0,0]=3 15409 B16R1.688 CSCCOCC(=O)NCc1ccccc1 7a_100000230434_100000183539 [0,1,0,0,0,1|1,0,0]=3 15410 B16R1.688 CSCCOCC(=O)NCc1ccccn1 34a_100000230434_100000684169 [0,1,0,0,0,1|2,0,0]=4 15411 B16R1.688 CSCCOCC(=O)NCc1ccccn1 7a_100000230434_100000684169 [0,1,0,0,0,1|2,0,0]=4 15412 B16R1.688 CSCCOCC(=O)NCc1cccnc1 7a_100000230434_100000752408 [0,1,0,0,0,1|2,0,0]=4 15413 B16R1.688 CSCCOCC(=O)NCc1ccncc1 7a_100000230434_100011243468 [0,1,0,0,0,1|2,0,0]=4 15414 B16R1.688 CSCCOCC(=O)OCc1ccccc1 34a_100000230434_100000753625 [0,1,0,0,0,1|1,0,0]=3 15415 B16R1.688 CSCCOCC(=O)OCc1ccccc1 7a_100000230434_100000753625 [0,1,0,0,0,1|1,0,0]=3 15416 B16R1.688 CSCCSCC(=O)CCc1ccccc1 62a_100000212216_100012361361 [0,1,0,0,0,1|1,1,0]=4 15417 B16R1.688 CSCCSCC(=O)CCc1ccccc1 62a_100012361361_100000751147 [0,1,0,0,0,1|1,1,0]=4 15418 B16R1.688 CSCCSCC(=O)NCc1ccccc1 62a_100000183539_100000751147 [0,1,0,0,0,1|1,1,0]=4 15419 B16R1.688 CSCCSCC(=O)NCc1ccccc1 62a_100000212216_100000183539 [0,1,0,0,0,1|1,1,0]=4 15420 B16R1.688 CSCCSCC(=O)OCc1ccccc1 62a_100000212216_100000753625 [0,1,0,0,0,1|1,1,0]=4 15421 B16R1.688 CSCCSCC(=O)OCc1ccccc1 62a_100000753625_100000751147 [0,1,0,0,0,1|1,1,0]=4 15422 B16R1.688 CSCNCCC(=O)NCc1ccccc1 2230a_100025741942_100011218213 [0,1,0,0,0,1|2,0,0]=4 15423 B16R1.688 CSCNCCC(=O)NCc1ccccc1 34a_100025741942_100011218213 [0,1,0,0,0,1|2,0,0]=4 15424 B16R1.688 CSCSCCC(=O)OCc1ccccc1 62a_100009813219_100011218213 [0,1,0,0,0,1|2,0,0]=4 15425 B16R1.688 CSCSCCC(=O)OCc1ccccc1 62a_100011218213_100009813219 [0,1,0,0,0,1|2,0,0]=4 15426 B16R1.688 C[C@@H](CCc1ccccc1)OCCCCF 34a_100009815974_100000729493 [0,1,0,0,0,1|1,0,1]=4 15427 B16R1.688 C[C@@H](CCc1ccccc1)OCCCCF 7a_100009815974_100000729493 [0,1,0,0,0,1|1,0,1]=4 15428 B16R1.688 C[C@@H](CCc1ccccc1)OCCCCO 34a_100009815974_100011216708 [0,1,0,0,0,1|1,0,1]=4 15429 B16R1.688 C[C@@H](CCc1ccccc1)OCCCCO 7a_100009815974_100000210776 [0,1,0,0,0,1|1,0,1]=4 15430 B16R1.688 N#CCCCCC(=O)CCc1ccccc1 1458a_100000185753_100000211819 [0,1,0,0,0,1|1,0,1]=4 15431 B16R1.688 N#CCCCCC(=O)COc1ccccc1 1458a_100000186222_100000211819 [0,1,0,0,0,1|1,0,1]=4 15432 B16R1.688 N#CCCCCC(=O)CSc1ccccc1 1458a_100000211596_100000211819 [0,1,0,0,0,1|1,0,1]=4 15433 B16R1.688 NCCCOCC(=O)CCc1ccccc1 34a_100000182051_100012361361 [0,1,0,0,0,1|1,0,0]=3 15434 B16R1.688 NCCCOCC(=O)NCc1ccccc1 34a_100000182051_100000183539 [0,1,0,0,0,1|1,0,0]=3 15435 B16R1.688 NCCCOCC(=O)NCc1ccccn1 34a_100000182051_100000684169 [0,1,0,0,0,1|2,0,0]=4 15436 B16R1.688 NCCCOCC(=O)OCc1ccccc1 34a_100000182051_100000753625 [0,1,0,0,0,1|1,0,0]=3 15437 B16R1.688 NOCCOCC(=O)CCc1ccccc1 34a_100000700252_100012361361 [0,1,0,0,0,1|2,0,0]=4 15438 B16R1.688 NOCCOCC(=O)NCc1ccccc1 34a_100000700252_100000183539 [0,1,0,0,0,1|2,0,0]=4 15439 B16R1.688 NOCCOCC(=O)OCc1ccccc1 34a_100000700252_100000753625 [0,1,0,0,0,1|2,0,0]=4 15440 B16R1.688 O=C(C#Cc1ccccc1)CCCCCF 1458a_100000736102_100000729378 [0,1,0,0,0,1|1,0,1]=4 15441 B16R1.688 O=C(C#Cc1ccccc1)CCCCCO 1458a_100000736102_100000746330 [0,1,0,0,0,1|1,0,1]=4 15442 B16R1.688 O=C(C#Cc1ccccc1)NCCCCO 240690a_100000750430_100000736102 [0,1,0,0,0,1|1,0,1]=4 15443 B16R1.688 O=C(C=Cc1ccccc1)CCCCCF 1458a_100000210462_100000729378 [0,1,0,0,0,1|1,0,1]=4 15444 B16R1.688 O=C(C=Cc1ccccc1)CCCCCO 1458a_100000210462_100000746330 [0,1,0,0,0,1|1,0,1]=4 15445 B16R1.688 O=C(CCCCCF)CCc1ccccc1 1458a_100000185753_100000729378 [0,1,0,0,0,1|1,0,0]=3 15446 B16R1.688 O=C(CCCCCF)CCc1ccccn1 1458a_100015195070_100000729378 [0,1,0,0,0,1|2,0,0]=4 15447 B16R1.688 O=C(CCCCCF)CCc1cccnc1 1458a_100000198484_100000729378 [0,1,0,0,0,1|2,0,0]=4 15448 B16R1.688 O=C(CCCCCF)CCc1ccncc1 1458a_100011225043_100000729378 [0,1,0,0,0,1|2,0,0]=4 15449 B16R1.688 O=C(CCCCCF)COc1ccccc1 1458a_100000186222_100000729378 [0,1,0,0,0,1|1,0,0]=3 15450 B16R1.688 O=C(CCCCCF)COc1ccccn1 1458a_100102699861_100000729378 [0,1,0,0,0,1|2,0,0]=4 15451 B16R1.688 O=C(CCCCCF)COc1cccnc1 1458a_100015207166_100000729378 [0,1,0,0,0,1|2,0,0]=4 15452 B16R1.688 O=C(CCCCCF)CSc1ccccc1 1458a_100000211596_100000729378 [0,1,0,0,0,1|1,0,0]=3 15453 B16R1.688 O=C(CCCCCF)CSc1ccccn1 1458a_100000156281_100000729378 [0,1,0,0,0,1|2,0,0]=4 15454 B16R1.688 O=C(CCCCCF)CSc1ccncc1 1458a_100000211328_100000729378 [0,1,0,0,0,1|2,0,0]=4 15455 B16R1.688 O=C(CCCCCO)CCc1ccccc1 1458a_100000185753_100000746330 [0,1,0,0,0,1|1,0,0]=3 15456 B16R1.688 O=C(CCCCCO)CCc1ccccc1 1458a_100102619762_100000765856 [0,1,0,0,0,1|1,0,0]=3 15457 B16R1.688 O=C(CCCCCO)CCc1ccccn1 1458a_100015195070_100000746330 [0,1,0,0,0,1|2,0,0]=4 15458 B16R1.688 O=C(CCCCCO)CCc1ccccn1 1458a_100102619762_100015183660 [0,1,0,0,0,1|2,0,0]=4 15459 B16R1.688 O=C(CCCCCO)CCc1cccnc1 1458a_100000198484_100000746330 [0,1,0,0,0,1|2,0,0]=4 15460 B16R1.688 O=C(CCCCCO)CCc1cccnc1 1458a_100102619762_200011713674 [0,1,0,0,0,1|2,0,0]=4 15461 B16R1.688 O=C(CCCCCO)CCc1ccncc1 1458a_100011225043_100000746330 [0,1,0,0,0,1|2,0,0]=4 15462 B16R1.688 O=C(CCCCCO)CCc1ccncc1 1458a_100102619762_100000723409 [0,1,0,0,0,1|2,0,0]=4 15463 B16R1.688 O=C(CCCCCO)COc1ccccc1 1458a_100000186222_100000746330 [0,1,0,0,0,1|1,0,0]=3 15464 B16R1.688 O=C(CCCCCO)COc1ccccn1 1458a_100102699861_100000746330 [0,1,0,0,0,1|2,0,0]=4 15465 B16R1.688 O=C(CCCCCO)COc1cccnc1 1458a_100015207166_100000746330 [0,1,0,0,0,1|2,0,0]=4 15466 B16R1.688 O=C(CCCCCO)CSc1ccccc1 1458a_100000211596_100000746330 [0,1,0,0,0,1|1,0,0]=3 15467 B16R1.688 O=C(CCCCCO)CSc1ccccn1 1458a_100000156281_100000746330 [0,1,0,0,0,1|2,0,0]=4 15468 B16R1.688 O=C(CCCCCO)CSc1ccncc1 1458a_100000211328_100000746330 [0,1,0,0,0,1|2,0,0]=4 15469 B16R1.688 O=C(CCCCCO)NCc1ccccc1 240690a_100015324214_100102619762 [0,1,0,0,0,1|1,0,0]=3 15470 B16R1.688 O=C(CCCCCO)NCc1ccccn1 240690a_100000210449_100102619762 [0,1,0,0,0,1|2,0,0]=4 15471 B16R1.688 O=C(CCCCCO)NCc1cccnc1 240690a_100000210453_100102619762 [0,1,0,0,0,1|2,0,0]=4 15472 B16R1.688 O=C(CCCCCO)NCc1ccncc1 240690a_100000210450_100102619762 [0,1,0,0,0,1|2,0,0]=4 15473 B16R1.688 O=C(CCCCCO)NNc1ccccc1 22a_100015195140_100102619762 [0,1,0,0,0,1|2,0,0]=4 15474 B16R1.688 O=C(CCCOCF)OCc1ccccc1 7a_100009831633_100015361967 [0,1,0,0,0,1|2,0,0]=4 15475 B16R1.688 O=C(CCCSCF)OCc1ccccc1 62a_100009813218_100015361967 [0,1,0,0,0,1|2,0,0]=4 15476 B16R1.688 O=C(CCCSCF)OCc1ccccc1 62a_100015361967_100009813218 [0,1,0,0,0,1|2,0,0]=4 15477 B16R1.688 O=C(CCNCCF)NCc1ccccc1 2230a_100025741942_100011217306 [0,1,0,0,0,1|2,0,0]=4 15478 B16R1.688 O=C(CCNCCF)NCc1ccccc1 34a_100025741942_100011217306 [0,1,0,0,0,1|2,0,0]=4 15479 B16R1.688 O=C(CCNCCO)NCc1ccccc1 2230a_100025741942_100000211926 [0,1,0,0,0,1|2,0,0]=4 15480 B16R1.688 O=C(CCNCCO)NCc1ccccc1 34a_100025741942_100000211926 [0,1,0,0,0,1|2,0,0]=4 15481 B16R1.688 O=C(CCNCCO)OCc1ccccc1 2230a_100016997473_100009813219 [0,1,0,0,0,1|2,0,0]=4 15482 B16R1.688 O=C(CCOCCF)OCc1ccccc1 7a_100009831632_100011217306 [0,1,0,0,0,1|2,0,0]=4 15483 B16R1.688 O=C(CCOCCO)CCc1ccccc1 1458a_100000185753_100011215305 [0,1,0,0,0,1|2,0,0]=4 15484 B16R1.688 O=C(CCOCCO)CCc1ccccc1 1458a_100011229844_100000765856 [0,1,0,0,0,1|2,0,0]=4 15485 B16R1.688 O=C(CCOCCO)COc1ccccc1 1458a_100000186222_100011215305 [0,1,0,0,0,1|2,0,0]=4 15486 B16R1.688 O=C(CCOCCO)CSc1ccccc1 1458a_100000211596_100011215305 [0,1,0,0,0,1|2,0,0]=4 15487 B16R1.688 O=C(CCOCCO)NCc1ccccc1 1626a_100015324214_100011229844 [0,1,0,0,0,1|2,0,0]=4 15488 B16R1.688 O=C(CCOCCO)NCc1ccccc1 240690a_100015324214_100011229844 [0,1,0,0,0,1|2,0,0]=4 15489 B16R1.688 O=C(CCOCCO)OCc1ccccc1 7a_100009831632_100000211926 [0,1,0,0,0,1|2,0,0]=4 15490 B16R1.688 O=C(CCSCCF)OCc1ccccc1 62a_100009813219_100011217306 [0,1,0,0,0,1|2,0,0]=4 15491 B16R1.688 O=C(CCSCCF)OCc1ccccc1 62a_100011217306_100009813219 [0,1,0,0,0,1|2,0,0]=4 15492 B16R1.688 O=C(CCSCCO)OCc1ccccc1 62a_100000211926_100009813219 [0,1,0,0,0,1|2,0,0]=4 15493 B16R1.688 O=C(CCSCCO)OCc1ccccc1 62a_100009813219_100000211926 [0,1,0,0,0,1|2,0,0]=4 15494 B16R1.688 O=C(CCc1ccccc1)CNCCCF 2230a_100015189416_100012361361 [0,1,0,0,0,1|2,0,0]=4 15495 B16R1.688 O=C(CCc1ccccc1)CNCCCF 34a_100015189416_100012361361 [0,1,0,0,0,1|2,0,0]=4 15496 B16R1.688 O=C(CCc1ccccc1)COCCCBr 34a_100011217188_100012361361 [0,1,0,0,0,1|1,0,0]=3 15497 B16R1.688 O=C(CCc1ccccc1)COCCCCl 34a_100000230001_100012361361 [0,1,0,0,0,1|1,0,0]=3 15498 B16R1.688 O=C(CCc1ccccc1)COCCCF 34a_100000759539_100012361361 [0,1,0,0,0,1|1,0,0]=3 15499 B16R1.688 O=C(CCc1ccccc1)CSCCCF 62a_100011934791_100012361361 [0,1,0,0,0,1|1,1,0]=4 15500 B16R1.688 O=C(CCc1ccccc1)CSCCCF 62a_100012361361_100011934791 [0,1,0,0,0,1|1,1,0]=4 15501 B16R1.688 O=C(CCc1ccccc1)CSCCCO 62a_100011215043_100012361361 [0,1,0,0,0,1|1,1,0]=4 15502 B16R1.688 O=C(CCc1ccccc1)CSCCCO 62a_100012361361_100011215043 [0,1,0,0,0,1|1,1,0]=4 15503 B16R1.688 O=C(CCc1ccccc1)NCCCCO 240690a_100000750430_100000185753 [0,1,0,0,0,1|1,0,0]=3 15504 B16R1.688 O=C(CCc1ccccc1)NCCCCO 527a_100000750430_100000185753 [0,1,0,0,0,1|1,0,0]=3 15505 B16R1.688 O=C(CCc1ccccn1)NCCCCO 240690a_100000750430_100015195070 [0,1,0,0,0,1|2,0,0]=4 15506 B16R1.688 O=C(CCc1ccccn1)NCCCCO 527a_100000750430_100015195070 [0,1,0,0,0,1|2,0,0]=4 15507 B16R1.688 O=C(CCc1cccnc1)NCCCCO 240690a_100000750430_100000198484 [0,1,0,0,0,1|2,0,0]=4 15508 B16R1.688 O=C(CCc1cccnc1)NCCCCO 527a_100000750430_100000198484 [0,1,0,0,0,1|2,0,0]=4 15509 B16R1.688 O=C(CCc1ccncc1)NCCCCO 240690a_100000750430_100011225043 [0,1,0,0,0,1|2,0,0]=4 15510 B16R1.688 O=C(CCc1ccncc1)NCCCCO 527a_100000750430_100011225043 [0,1,0,0,0,1|2,0,0]=4 15511 B16R1.688 O=C(CNCCCF)NCc1ccccc1 2230a_100000739245_100011934791 [0,1,0,0,0,1|2,0,0]=4 15512 B16R1.688 O=C(CNCCCF)NCc1ccccc1 2230a_100015189416_100000183539 [0,1,0,0,0,1|2,0,0]=4 15513 B16R1.688 O=C(CNCCCF)NCc1ccccc1 34a_100015189416_100000183539 [0,1,0,0,0,1|2,0,0]=4 15514 B16R1.688 O=C(CNCCCF)OCc1ccccc1 2230a_100015189416_100000753625 [0,1,0,0,0,1|2,0,0]=4 15515 B16R1.688 O=C(CNCCCF)OCc1ccccc1 34a_100015189416_100000753625 [0,1,0,0,0,1|2,0,0]=4 15516 B16R1.688 O=C(CNCCCO)NCc1ccccc1 2230a_100000739245_100000230001 [0,1,0,0,0,1|2,0,0]=4 15517 B16R1.688 O=C(COCCCBr)NCc1ccccc1 34a_100011217188_100000183539 [0,1,0,0,0,1|1,0,0]=3 15518 B16R1.688 O=C(COCCCBr)NCc1ccccn1 34a_100011217188_100000684169 [0,1,0,0,0,1|2,0,0]=4 15519 B16R1.688 O=C(COCCCBr)OCc1ccccc1 34a_100011217188_100000753625 [0,1,0,0,0,1|1,0,0]=3 15520 B16R1.688 O=C(COCCCCl)NCc1ccccc1 34a_100000230001_100000183539 [0,1,0,0,0,1|1,0,0]=3 15521 B16R1.688 O=C(COCCCCl)NCc1ccccn1 34a_100000230001_100000684169 [0,1,0,0,0,1|2,0,0]=4 15522 B16R1.688 O=C(COCCCCl)OCc1ccccc1 34a_100000230001_100000753625 [0,1,0,0,0,1|1,0,0]=3 15523 B16R1.688 O=C(COCCCF)NCc1ccccc1 34a_100000759539_100000183539 [0,1,0,0,0,1|1,0,0]=3 15524 B16R1.688 O=C(COCCCF)NCc1ccccn1 34a_100000759539_100000684169 [0,1,0,0,0,1|2,0,0]=4 15525 B16R1.688 O=C(COCCCF)OCc1ccccc1 34a_100000759539_100000753625 [0,1,0,0,0,1|1,0,0]=3 15526 B16R1.688 O=C(COc1ccccc1)NCCCCO 240690a_100000750430_100000186222 [0,1,0,0,0,1|1,0,0]=3 15527 B16R1.688 O=C(COc1ccccc1)NCCCCO 527a_100000750430_100000186222 [0,1,0,0,0,1|1,0,0]=3 15528 B16R1.688 O=C(COc1ccccn1)NCCCCO 240690a_100000750430_100102699861 [0,1,0,0,0,1|2,0,0]=4 15529 B16R1.688 O=C(COc1ccccn1)NCCCCO 527a_100000750430_100102699861 [0,1,0,0,0,1|2,0,0]=4 15530 B16R1.688 O=C(COc1cccnc1)NCCCCO 240690a_100000750430_100015207166 [0,1,0,0,0,1|2,0,0]=4 15531 B16R1.688 O=C(COc1cccnc1)NCCCCO 527a_100000750430_100015207166 [0,1,0,0,0,1|2,0,0]=4 15532 B16R1.688 O=C(CSCCCF)NCc1ccccc1 62a_100000183539_100011934791 [0,1,0,0,0,1|1,1,0]=4 15533 B16R1.688 O=C(CSCCCF)NCc1ccccc1 62a_100011934791_100000183539 [0,1,0,0,0,1|1,1,0]=4 15534 B16R1.688 O=C(CSCCCF)OCc1ccccc1 62a_100000753625_100011934791 [0,1,0,0,0,1|1,1,0]=4 15535 B16R1.688 O=C(CSCCCF)OCc1ccccc1 62a_100011934791_100000753625 [0,1,0,0,0,1|1,1,0]=4 15536 B16R1.688 O=C(CSCCCO)NCc1ccccc1 62a_100000183539_100011215043 [0,1,0,0,0,1|1,1,0]=4 15537 B16R1.688 O=C(CSCCCO)NCc1ccccc1 62a_100011215043_100000183539 [0,1,0,0,0,1|1,1,0]=4 15538 B16R1.688 O=C(CSCCCO)OCc1ccccc1 62a_100000753625_100011215043 [0,1,0,0,0,1|1,1,0]=4 15539 B16R1.688 O=C(CSCCCO)OCc1ccccc1 62a_100011215043_100000753625 [0,1,0,0,0,1|1,1,0]=4 15540 B16R1.688 O=C(CSc1ccccc1)NCCCCO 240690a_100000750430_100000211596 [0,1,0,0,0,1|1,0,0]=3 15541 B16R1.688 O=C(CSc1ccccc1)NCCCCO 527a_100000750430_100000211596 [0,1,0,0,0,1|1,0,0]=3 15542 B16R1.688 O=C(CSc1ccccn1)NCCCCO 240690a_100000750430_100000156281 [0,1,0,0,0,1|2,0,0]=4 15543 B16R1.688 O=C(CSc1ccccn1)NCCCCO 527a_100000750430_100000156281 [0,1,0,0,0,1|2,0,0]=4 15544 B16R1.688 O=C(CSc1ccncc1)NCCCCO 240690a_100000750430_100000211328 [0,1,0,0,0,1|2,0,0]=4 15545 B16R1.688 O=C(CSc1ccncc1)NCCCCO 527a_100000750430_100000211328 [0,1,0,0,0,1|2,0,0]=4 15546 B16R1.688 O=C(NCCCCO)NCc1ccccc1 2708a_100000750430_100015324214 [0,1,0,0,0,1|1,0,0]=3 15547 B16R1.688 O=C(NCCCCO)NCc1ccccc1 2708a_100015324214_100000750430 [0,1,0,0,0,1|1,0,0]=3 15548 B16R1.688 O=C(NCCCCO)NCc1ccccc1 273464a_100000750430_100015324214 [0,1,0,0,0,1|1,0,0]=3 15549 B16R1.688 O=C(NCCCCO)NCc1ccccc1 273464a_100015324214_100000750430 [0,1,0,0,0,1|1,0,0]=3 15550 B16R1.688 O=C(NCCCCO)NCc1ccccc1 512a_100000750430_100015324214 [0,1,0,0,0,1|1,0,0]=3 15551 B16R1.688 O=C(NCCCCO)NCc1ccccc1 512a_100015324214_100000750430 [0,1,0,0,0,1|1,0,0]=3 15552 B16R1.688 O=C(NCCCCO)NCc1ccccn1 2708a_100000210449_100000750430 [0,1,0,0,0,1|2,0,0]=4 15553 B16R1.688 O=C(NCCCCO)NCc1ccccn1 2708a_100000750430_100000210449 [0,1,0,0,0,1|2,0,0]=4 15554 B16R1.688 O=C(NCCCCO)NCc1ccccn1 273464a_100000210449_100000750430 [0,1,0,0,0,1|2,0,0]=4 15555 B16R1.688 O=C(NCCCCO)NCc1ccccn1 273464a_100000750430_100000210449 [0,1,0,0,0,1|2,0,0]=4 15556 B16R1.688 O=C(NCCCCO)NCc1ccccn1 512a_100000750430_100000210449 [0,1,0,0,0,1|2,0,0]=4 15557 B16R1.688 O=C(NCCCCO)NCc1cccnc1 2708a_100000210453_100000750430 [0,1,0,0,0,1|2,0,0]=4 15558 B16R1.688 O=C(NCCCCO)NCc1cccnc1 2708a_100000750430_100000210453 [0,1,0,0,0,1|2,0,0]=4 15559 B16R1.688 O=C(NCCCCO)NCc1cccnc1 273464a_100000210453_100000750430 [0,1,0,0,0,1|2,0,0]=4 15560 B16R1.688 O=C(NCCCCO)NCc1cccnc1 273464a_100000750430_100000210453 [0,1,0,0,0,1|2,0,0]=4 15561 B16R1.688 O=C(NCCCCO)NCc1cccnc1 512a_100000210453_100000750430 [0,1,0,0,0,1|2,0,0]=4 15562 B16R1.688 O=C(NCCCCO)NCc1cccnc1 512a_100000750430_100000210453 [0,1,0,0,0,1|2,0,0]=4 15563 B16R1.688 O=C(NCCCCO)NCc1ccncc1 2708a_100000210450_100000750430 [0,1,0,0,0,1|2,0,0]=4 15564 B16R1.688 O=C(NCCCCO)NCc1ccncc1 2708a_100000750430_100000210450 [0,1,0,0,0,1|2,0,0]=4 15565 B16R1.688 O=C(NCCCCO)NCc1ccncc1 273464a_100000210450_100000750430 [0,1,0,0,0,1|2,0,0]=4 15566 B16R1.688 O=C(NCCCCO)NCc1ccncc1 273464a_100000750430_100000210450 [0,1,0,0,0,1|2,0,0]=4 15567 B16R1.688 O=C(NCCCCO)NCc1ccncc1 512a_100000750430_100000210450 [0,1,0,0,0,1|2,0,0]=4 15568 B16R1.688 O=C(NCCCCO)NNc1ccccc1 273464a_100000750430_100015195140 [0,1,0,0,0,1|2,0,0]=4 15569 B16R1.688 O=C(NCCCCO)NNc1ccccc1 512a_100000750430_100015195140 [0,1,0,0,0,1|2,0,0]=4 15570 B16R1.688 O=C(NCCOCF)OCc1ccccc1 34a_100000159002_100015361967 [0,1,0,0,0,1|2,0,0]=4 15571 B16R1.688 O=C(NCCOCF)OCc1ccccc1 7a_100000159002_100015361967 [0,1,0,0,0,1|2,0,0]=4 15572 B16R1.688 O=C(NCCSCF)OCc1ccccc1 62a_100012357035_100015361967 [0,1,0,0,0,1|2,0,0]=4 15573 B16R1.688 O=C(NCCSCF)OCc1ccccc1 62a_100015361967_100012357035 [0,1,0,0,0,1|2,0,0]=4 15574 B16R1.688 [13CH3]OCCCCC(=O)OCc1ccccc1 7a_200000059030_200025704644 [0,1,0,0,0,1|1,0,0]=3 15575 B16R1.688 [13CH3]OCCCNC(=O)OCc1ccccc1 34a_100011215709_200025704644 [0,1,0,0,0,1|1,0,0]=3 15576 B16R1.688 [13CH3]OCCCNC(=O)OCc1ccccc1 7a_100011215709_200025704644 [0,1,0,0,0,1|1,0,0]=3 15577 B16R1.688 [13CH3]SCCCNC(=O)OCc1ccccc1 62a_100012340047_200025704644 [0,1,0,0,0,1|1,0,0]=3 15578 B16R1.688 [13CH3]SCCCNC(=O)OCc1ccccc1 62a_200025704644_100012340047 [0,1,0,0,0,1|1,0,0]=3 15579 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCC 11a_100000102301_100000066491 [0,1,0,0,0,1|1,0,0]=3 15580 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCC 1626a_100000102301_100000066491 [0,1,0,0,0,1|1,0,0]=3 15581 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCF 11a_100015189416_100000066491 [0,1,0,0,0,1|2,0,0]=4 15582 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCCF 1626a_100015189416_100000066491 [0,1,0,0,0,1|2,0,0]=4 15583 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCOC 1626a_100000209980_100000066491 [0,1,0,0,0,1|2,0,0]=4 15584 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCSC 11a_100020590264_100000066491 [0,1,0,0,0,1|2,0,0]=4 15585 B16R1.1216 C=C(Cc1ccccc1)C(=O)NCCSC 1626a_100020590264_100000066491 [0,1,0,0,0,1|2,0,0]=4 15586 B16R1.1216 C=C(Cc1ccccc1)C(=O)NNCCC 22a_100000740057_100000066491 [0,1,0,0,0,1|2,0,0]=4 15587 B16R1.1216 CC(Cc1ccccc1)C(=O)CCCCF 1458a_100000754839_100000729493 [0,1,0,0,0,1|2,0,0]=4 15588 B16R1.1216 CC(Cc1ccccc1)C(=O)CCCCO 1458a_100000695505_200011218536 [0,1,0,0,0,1|2,0,0]=4 15589 B16R1.1216 CC(Cc1ccccc1)C(=O)CCCCO 1458a_100000754839_100000210776 [0,1,0,0,0,1|2,0,0]=4 15590 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCF 11a_100015189416_100000754839 [0,1,0,0,0,1|2,0,0]=4 15591 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCF 1626a_100015189416_100000754839 [0,1,0,0,0,1|2,0,0]=4 15592 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCF 240690a_100015189416_100000754839 [0,1,0,0,0,1|2,0,0]=4 15593 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCF 527a_100015189416_100000754839 [0,1,0,0,0,1|2,0,0]=4 15594 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCO 240690a_100000182051_100000754839 [0,1,0,0,0,1|2,0,0]=4 15595 B16R1.1216 CC(Cc1ccccc1)C(=O)NCCCO 527a_100000182051_100000754839 [0,1,0,0,0,1|2,0,0]=4 15596 B16R1.1216 CC(Oc1ccccc1)C(=O)CCCCF 1458a_100000188414_100000729493 [0,1,0,0,0,1|2,0,0]=4 15597 B16R1.1216 CC(Oc1ccccc1)C(=O)CCCCO 1458a_100000188414_100000210776 [0,1,0,0,0,1|2,0,0]=4 15598 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCF 11a_100015189416_100000188414 [0,1,0,0,0,1|2,0,0]=4 15599 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCF 1626a_100015189416_100000188414 [0,1,0,0,0,1|2,0,0]=4 15600 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCF 240690a_100015189416_100000188414 [0,1,0,0,0,1|2,0,0]=4 15601 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCF 527a_100015189416_100000188414 [0,1,0,0,0,1|2,0,0]=4 15602 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCO 240690a_100000182051_100000188414 [0,1,0,0,0,1|2,0,0]=4 15603 B16R1.1216 CC(Oc1ccccc1)C(=O)NCCCO 527a_100000182051_100000188414 [0,1,0,0,0,1|2,0,0]=4 15604 B16R1.1216 CC(Sc1ccccc1)C(=O)CCCCF 1458a_100000199063_100000729493 [0,1,0,0,0,1|2,0,0]=4 15605 B16R1.1216 CC(Sc1ccccc1)C(=O)CCCCO 1458a_100000199063_100000210776 [0,1,0,0,0,1|2,0,0]=4 15606 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCF 11a_100015189416_100000199063 [0,1,0,0,0,1|2,0,0]=4 15607 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCF 1626a_100015189416_100000199063 [0,1,0,0,0,1|2,0,0]=4 15608 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCF 240690a_100015189416_100000199063 [0,1,0,0,0,1|2,0,0]=4 15609 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCF 527a_100015189416_100000199063 [0,1,0,0,0,1|2,0,0]=4 15610 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCO 240690a_100000182051_100000199063 [0,1,0,0,0,1|2,0,0]=4 15611 B16R1.1216 CC(Sc1ccccc1)C(=O)NCCCO 527a_100000182051_100000199063 [0,1,0,0,0,1|2,0,0]=4 15612 B16R1.1216 CCCC#CC(=O)C(C)Cc1ccccc1 1458a_200011218047_200011218536 [0,1,0,0,0,1|1,0,1]=4 15613 B16R1.1216 CCCC#CC(=O)N(C)Cc1ccccc1 240690a_100000186898_200011218047 [0,1,0,0,0,1|1,0,1]=4 15614 B16R1.1216 CCCC=CC(=O)C(C)Cc1ccccc1 1458a_100000212230_200011218536 [0,1,0,0,0,1|1,0,1]=4 15615 B16R1.1216 CCCC=CC(=O)N(C)Cc1ccccc1 11a_100000186898_100000212230 [0,1,0,0,0,1|1,0,1]=4 15616 B16R1.1216 CCCC=CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000212230 [0,1,0,0,0,1|1,0,1]=4 15617 B16R1.1216 CCCC=CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000212230 [0,1,0,0,0,1|1,0,1]=4 15618 B16R1.1216 CCCCCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210326 [0,1,0,0,0,1|1,0,1]=4 15619 B16R1.1216 CCCCCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210326 [0,1,0,0,0,1|1,0,1]=4 15620 B16R1.1216 CCCCCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210326 [0,1,0,0,0,1|1,0,1]=4 15621 B16R1.1216 CCCCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210326 [0,1,0,0,0,1|1,0,1]=4 15622 B16R1.1216 CCCCCC(=O)C(C)Cc1ccccc1 1458a_100000212188_200011218536 [0,1,0,0,0,1|1,0,0]=3 15623 B16R1.1216 CCCCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210326 [0,1,0,0,0,1|1,0,0]=3 15624 B16R1.1216 CCCCCC(=O)C(C)Cc1ccccn1 1458a_100012000792_100000210326 [0,1,0,0,0,1|2,0,0]=4 15625 B16R1.1216 CCCCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210326 [0,1,0,0,0,1|1,0,0]=3 15626 B16R1.1216 CCCCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210326 [0,1,0,0,0,1|1,0,0]=3 15627 B16R1.1216 CCCCCC(=O)C(C)Sc1ccccn1 1458a_100000156770_100000210326 [0,1,0,0,0,1|2,0,0]=4 15628 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000212188 [0,1,0,0,0,1|1,0,0]=3 15629 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000212188 [0,1,0,0,0,1|1,0,0]=3 15630 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000212188 [0,1,0,0,0,1|1,0,0]=3 15631 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000212188 [0,1,0,0,0,1|1,0,0]=3 15632 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccn1 11a_100000207498_100000212188 [0,1,0,0,0,1|2,0,0]=4 15633 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccn1 240690a_100000207498_100000212188 [0,1,0,0,0,1|2,0,0]=4 15634 B16R1.1216 CCCCCC(=O)N(C)Cc1ccccn1 527a_100000207498_100000212188 [0,1,0,0,0,1|2,0,0]=4 15635 B16R1.1216 CCCCCC(=O)N(C)Cc1cccnc1 11a_100000184577_100000212188 [0,1,0,0,0,1|2,0,0]=4 15636 B16R1.1216 CCCCCC(=O)N(C)Cc1cccnc1 240690a_100000184577_100000212188 [0,1,0,0,0,1|2,0,0]=4 15637 B16R1.1216 CCCCCC(=O)N(C)Cc1cccnc1 527a_100000184577_100000212188 [0,1,0,0,0,1|2,0,0]=4 15638 B16R1.1216 CCCCCC(=O)N(C)Cc1ccncc1 11a_100000187231_100000212188 [0,1,0,0,0,1|2,0,0]=4 15639 B16R1.1216 CCCCCC(=O)N(C)Cc1ccncc1 240690a_100000187231_100000212188 [0,1,0,0,0,1|2,0,0]=4 15640 B16R1.1216 CCCCCC(=O)N(C)Cc1ccncc1 527a_100000187231_100000212188 [0,1,0,0,0,1|2,0,0]=4 15641 B16R1.1216 CCCCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210326 [0,1,0,0,0,1|1,0,0]=3 15642 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/C 11a_100000102301_100016990649 [0,1,0,0,0,1|1,0,1]=4 15643 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/C 1626a_100000102301_100016990649 [0,1,0,0,0,1|1,0,1]=4 15644 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/C 527a_100000102301_100016990649 [0,1,0,0,0,1|1,0,1]=4 15645 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/Cl 11a_100000102301_200020598536 [0,1,0,0,0,1|1,0,1]=4 15646 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/Cl 1626a_100000102301_200020598536 [0,1,0,0,0,1|1,0,1]=4 15647 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100000102301_200020598536 [0,1,0,0,0,1|1,0,1]=4 15648 B16R1.1216 CCCCNC(=O)/C(=C/c1ccccc1)/Cl 527a_100000102301_200020598536 [0,1,0,0,0,1|1,0,1]=4 15649 B16R1.1216 CCCCNC(=O)/C(=C\c1ccccc1)/F 11a_100000102301_100020889036 [0,1,0,0,0,1|1,0,1]=4 15650 B16R1.1216 CCCCNC(=O)/C(=C\c1ccccc1)/F 527a_100000102301_100020889036 [0,1,0,0,0,1|1,0,1]=4 15651 B16R1.1216 CCCCNC(=O)C(=O)Nc1ccccc1 240690a_100000102301_100000738435 [0,1,0,0,0,1|1,0,1]=4 15652 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 11a_100000102301_100000754839 [0,1,0,0,0,1|1,0,0]=3 15653 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 1626a_100000102301_100000754839 [0,1,0,0,0,1|1,0,0]=3 15654 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 240690a_100000102301_100000754839 [0,1,0,0,0,1|1,0,0]=3 15655 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccc1 527a_100000102301_100000754839 [0,1,0,0,0,1|1,0,0]=3 15656 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccn1 1626a_100000102301_100012000792 [0,1,0,0,0,1|2,0,0]=4 15657 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccn1 240690a_100000102301_100012000792 [0,1,0,0,0,1|2,0,0]=4 15658 B16R1.1216 CCCCNC(=O)C(C)Cc1ccccn1 527a_100000102301_100012000792 [0,1,0,0,0,1|2,0,0]=4 15659 B16R1.1216 CCCCNC(=O)C(C)Nc1ccccc1 34a_100000106764_100000735917 [0,1,0,0,0,1|1,0,0]=3 15660 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 11a_100000102301_100000188414 [0,1,0,0,0,1|1,0,0]=3 15661 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 1626a_100000102301_100000188414 [0,1,0,0,0,1|1,0,0]=3 15662 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 240690a_100000102301_100000188414 [0,1,0,0,0,1|1,0,0]=3 15663 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000735917 [0,1,0,0,0,1|1,0,0]=3 15664 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 527a_100000102301_100000188414 [0,1,0,0,0,1|1,0,0]=3 15665 B16R1.1216 CCCCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000735917 [0,1,0,0,0,1|1,0,0]=3 15666 B16R1.1216 CCCCNC(=O)C(C)Oc1cccnc1 34a_100000210849_100000735917 [0,1,0,0,0,1|2,0,0]=4 15667 B16R1.1216 CCCCNC(=O)C(C)Oc1cccnc1 7a_100000210849_100000735917 [0,1,0,0,0,1|2,0,0]=4 15668 B16R1.1216 CCCCNC(=O)C(C)Oc1ccncc1 34a_100000212176_100000735917 [0,1,0,0,0,1|2,0,0]=4 15669 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 11a_100000102301_100000199063 [0,1,0,0,0,1|1,0,0]=3 15670 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 1626a_100000102301_100000199063 [0,1,0,0,0,1|1,0,0]=3 15671 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 240690a_100000102301_100000199063 [0,1,0,0,0,1|1,0,0]=3 15672 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 527a_100000102301_100000199063 [0,1,0,0,0,1|1,0,0]=3 15673 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000735917 [0,1,0,0,0,1|1,0,0]=3 15674 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccc1 62a_100000735917_100000041952 [0,1,0,0,0,1|1,0,0]=3 15675 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 11a_100000102301_100000156770 [0,1,0,0,0,1|2,0,0]=4 15676 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 1626a_100000102301_100000156770 [0,1,0,0,0,1|2,0,0]=4 15677 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 240690a_100000102301_100000156770 [0,1,0,0,0,1|2,0,0]=4 15678 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 527a_100000102301_100000156770 [0,1,0,0,0,1|2,0,0]=4 15679 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 62a_100000735917_100011216584 [0,1,0,0,0,1|2,0,0]=4 15680 B16R1.1216 CCCCNC(=O)C(C)Sc1ccccn1 62a_100011216584_100000735917 [0,1,0,0,0,1|2,0,0]=4 15681 B16R1.1216 CCCCNC(=O)C(C)Sc1cccnc1 62a_100000210063_100000735917 [0,1,0,0,0,1|2,0,0]=4 15682 B16R1.1216 CCCCNC(=O)C(C)Sc1cccnc1 62a_100000735917_100000210063 [0,1,0,0,0,1|2,0,0]=4 15683 B16R1.1216 CCCCNC(=O)C(C)Sc1ccncc1 62a_100000728582_100000735917 [0,1,0,0,0,1|2,0,0]=4 15684 B16R1.1216 CCCCNC(=O)C(C)Sc1ccncc1 62a_100000735917_100000728582 [0,1,0,0,0,1|2,0,0]=4 15685 B16R1.1216 CCCCNC(=O)N(C)Cc1ccccc1 2708a_100000102301_100000186898 [0,1,0,0,0,1|1,0,0]=3 15686 B16R1.1216 CCCCNC(=O)N(C)Cc1ccccc1 273464a_100000102301_100000186898 [0,1,0,0,0,1|1,0,0]=3 15687 B16R1.1216 CCCCNC(=O)N(C)Cc1ccccn1 2708a_100000102301_100000207498 [0,1,0,0,0,1|2,0,0]=4 15688 B16R1.1216 CCCCNC(=O)N(C)Cc1ccccn1 273464a_100000102301_100000207498 [0,1,0,0,0,1|2,0,0]=4 15689 B16R1.1216 CCCCNC(=O)N(C)Cc1cccnc1 2708a_100000102301_100000184577 [0,1,0,0,0,1|2,0,0]=4 15690 B16R1.1216 CCCCNC(=O)N(C)Cc1cccnc1 273464a_100000102301_100000184577 [0,1,0,0,0,1|2,0,0]=4 15691 B16R1.1216 CCCCNC(=O)N(C)Cc1ccncc1 2708a_100000102301_100000187231 [0,1,0,0,0,1|2,0,0]=4 15692 B16R1.1216 CCCCNC(=O)N(C)Cc1ccncc1 273464a_100000102301_100000187231 [0,1,0,0,0,1|2,0,0]=4 15693 B16R1.1216 CCCCNC(=O)[C@H](O)Cc1ccccc1 240690a_100000102301_100009816399 [0,1,0,0,0,1|1,0,0]=3 15694 B16R1.1216 CCCCOC(=O)C(C)Nc1ccccc1 34a_100000106764_100000759602 [0,1,0,0,0,1|0,0,0]=2 15695 B16R1.1216 CCCCOC(=O)C(C)Oc1ccccc1 34a_100000210340_100000759602 [0,1,0,0,0,1|0,0,0]=2 15696 B16R1.1216 CCCCOC(=O)C(C)Oc1ccccc1 7a_100000210340_100000759602 [0,1,0,0,0,1|0,0,0]=2 15697 B16R1.1216 CCCCOC(=O)C(C)Oc1cccnc1 34a_100000210849_100000759602 [0,1,0,0,0,1|1,0,0]=3 15698 B16R1.1216 CCCCOC(=O)C(C)Oc1cccnc1 7a_100000210849_100000759602 [0,1,0,0,0,1|1,0,0]=3 15699 B16R1.1216 CCCCOC(=O)C(C)Oc1ccncc1 34a_100000212176_100000759602 [0,1,0,0,0,1|1,0,0]=3 15700 B16R1.1216 CCCCOC(=O)C(C)Oc1ccnnc1 34a_100015204005_100000759602 [0,1,0,0,0,1|2,0,0]=4 15701 B16R1.1216 CCCCOC(=O)C(C)Oc1cncnc1 7a_100000754086_100000759602 [0,1,0,0,0,1|2,0,0]=4 15702 B16R1.1216 CCCCOC(=O)C(C)Sc1ccccc1 62a_100000719477_100000759602 [0,1,0,0,0,1|0,0,0]=2 15703 B16R1.1216 CCCCOC(=O)C(C)Sc1ccccc1 62a_100000759602_100000041952 [0,1,0,0,0,1|0,0,0]=2 15704 B16R1.1216 CCCCOC(=O)C(C)Sc1ccccn1 62a_100000759602_100011216584 [0,1,0,0,0,1|1,0,0]=3 15705 B16R1.1216 CCCCOC(=O)C(C)Sc1ccccn1 62a_100011216584_100000759602 [0,1,0,0,0,1|1,0,0]=3 15706 B16R1.1216 CCCCOC(=O)C(C)Sc1cccnc1 62a_100000210063_100000759602 [0,1,0,0,0,1|1,0,0]=3 15707 B16R1.1216 CCCCOC(=O)C(C)Sc1cccnc1 62a_100000759602_100000210063 [0,1,0,0,0,1|1,0,0]=3 15708 B16R1.1216 CCCCOC(=O)C(C)Sc1cccnn1 62a_100000759602_100016991348 [0,1,0,0,0,1|2,0,0]=4 15709 B16R1.1216 CCCCOC(=O)C(C)Sc1cccnn1 62a_100016991348_100000759602 [0,1,0,0,0,1|2,0,0]=4 15710 B16R1.1216 CCCCOC(=O)C(C)Sc1ccncc1 62a_100000728582_100000759602 [0,1,0,0,0,1|1,0,0]=3 15711 B16R1.1216 CCCCOC(=O)C(C)Sc1ccncc1 62a_100000759602_100000728582 [0,1,0,0,0,1|1,0,0]=3 15712 B16R1.1216 CCCCOC(=O)C(C)Sc1ccncn1 62a_100000703185_100000759602 [0,1,0,0,0,1|2,0,0]=4 15713 B16R1.1216 CCCCOC(=O)C(C)Sc1ccncn1 62a_100000759602_100000703185 [0,1,0,0,0,1|2,0,0]=4 15714 B16R1.1216 CCCCOC(=O)C(C)Sc1ccnnc1 62a_100000732662_100000759602 [0,1,0,0,0,1|2,0,0]=4 15715 B16R1.1216 CCCCOC(=O)C(C)Sc1ccnnc1 62a_100000759602_100000732662 [0,1,0,0,0,1|2,0,0]=4 15716 B16R1.1216 CCCCOC(=O)C(C)Sc1cnccn1 62a_100000211759_100000759602 [0,1,0,0,0,1|2,0,0]=4 15717 B16R1.1216 CCCCOC(=O)C(C)Sc1cnccn1 62a_100000759602_100000211759 [0,1,0,0,0,1|2,0,0]=4 15718 B16R1.1216 CCCCOC(=O)C(C)Sc1cncnc1 62a_100000759602_100011206942 [0,1,0,0,0,1|2,0,0]=4 15719 B16R1.1216 CCCCOC(=O)C(C)Sc1cncnc1 62a_100011206942_100000759602 [0,1,0,0,0,1|2,0,0]=4 15720 B16R1.1216 CCCCOC(=O)C(C)Sc1ncccn1 62a_100000211032_100000759602 [0,1,0,0,0,1|2,0,0]=4 15721 B16R1.1216 CCCCOC(=O)C(C)Sc1ncccn1 62a_100000759602_100000211032 [0,1,0,0,0,1|2,0,0]=4 15722 B16R1.1216 CCCNNC(=O)C(C)Cc1ccccc1 22a_100000740057_100000754839 [0,1,0,0,0,1|2,0,0]=4 15723 B16R1.1216 CCCNNC(=O)C(C)Oc1ccccc1 22a_100000740057_100000188414 [0,1,0,0,0,1|2,0,0]=4 15724 B16R1.1216 CCCNNC(=O)C(C)Sc1ccccc1 22a_100000740057_100000199063 [0,1,0,0,0,1|2,0,0]=4 15725 B16R1.1216 CCCNNC(=O)[C@H](O)Cc1ccccc1 22a_100000740057_100009816399 [0,1,0,0,0,1|2,0,0]=4 15726 B16R1.1216 CCCOCC(=O)C(C)Cc1ccccc1 1458a_100000745993_200011218536 [0,1,0,0,0,1|2,0,0]=4 15727 B16R1.1216 CCCOCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000745993 [0,1,0,0,0,1|2,0,0]=4 15728 B16R1.1216 CCCOCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000745993 [0,1,0,0,0,1|2,0,0]=4 15729 B16R1.1216 CCCOCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000745993 [0,1,0,0,0,1|2,0,0]=4 15730 B16R1.1216 CCCOCC(=O)N(C)Cc1ccccc1 34a_100000210258_100000182870 [0,1,0,0,0,1|2,0,0]=4 15731 B16R1.1216 CCCOCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000745993 [0,1,0,0,0,1|2,0,0]=4 15732 B16R1.1216 CCCSCC(=O)C(C)Cc1ccccc1 1458a_100000217233_200011218536 [0,1,0,0,0,1|2,0,0]=4 15733 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000217233 [0,1,0,0,0,1|2,0,0]=4 15734 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000217233 [0,1,0,0,0,1|2,0,0]=4 15735 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000217233 [0,1,0,0,0,1|2,0,0]=4 15736 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000217233 [0,1,0,0,0,1|2,0,0]=4 15737 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 62a_100000182870_100000210303 [0,1,0,0,0,1|2,0,0]=4 15738 B16R1.1216 CCCSCC(=O)N(C)Cc1ccccc1 62a_100000210303_100000182870 [0,1,0,0,0,1|2,0,0]=4 15739 B16R1.1216 CCNCCC(=O)N(C)Cc1ccccc1 2230a_100015525214_200011208496 [0,1,0,0,0,1|2,0,0]=4 15740 B16R1.1216 CCNCCC(=O)N(C)Cc1ccccc1 2230a_100025749762_100000210202 [0,1,0,0,0,1|2,0,0]=4 15741 B16R1.1216 CCOCCC(=O)C(C)Cc1ccccc1 1458a_100000749530_200011218536 [0,1,0,0,0,1|2,0,0]=4 15742 B16R1.1216 CCOCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100011215890 [0,1,0,0,0,1|2,0,0]=4 15743 B16R1.1216 CCOCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100011215890 [0,1,0,0,0,1|2,0,0]=4 15744 B16R1.1216 CCOCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100011215890 [0,1,0,0,0,1|2,0,0]=4 15745 B16R1.1216 CCOCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000749530 [0,1,0,0,0,1|2,0,0]=4 15746 B16R1.1216 CCOCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000749530 [0,1,0,0,0,1|2,0,0]=4 15747 B16R1.1216 CCOCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000749530 [0,1,0,0,0,1|2,0,0]=4 15748 B16R1.1216 CCOCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000749530 [0,1,0,0,0,1|2,0,0]=4 15749 B16R1.1216 CCOCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100011215890 [0,1,0,0,0,1|2,0,0]=4 15750 B16R1.1216 CCSCCC(=O)C(C)Cc1ccccc1 1458a_100000230768_200011218536 [0,1,0,0,0,1|2,0,0]=4 15751 B16R1.1216 CCSCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000757381 [0,1,0,0,0,1|2,0,0]=4 15752 B16R1.1216 CCSCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000757381 [0,1,0,0,0,1|2,0,0]=4 15753 B16R1.1216 CCSCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000757381 [0,1,0,0,0,1|2,0,0]=4 15754 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000230768 [0,1,0,0,0,1|2,0,0]=4 15755 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000230768 [0,1,0,0,0,1|2,0,0]=4 15756 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000230768 [0,1,0,0,0,1|2,0,0]=4 15757 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000230768 [0,1,0,0,0,1|2,0,0]=4 15758 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 62a_100000210202_200011208496 [0,1,0,0,0,1|2,0,0]=4 15759 B16R1.1216 CCSCCC(=O)N(C)Cc1ccccc1 62a_200011208496_100000210202 [0,1,0,0,0,1|2,0,0]=4 15760 B16R1.1216 CCSCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000757381 [0,1,0,0,0,1|2,0,0]=4 15761 B16R1.1216 CN(Cc1ccccc1)C(=O)CCCCO 1626a_100000186898_100000695505 [0,1,0,0,0,1|2,0,0]=4 15762 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCF 2708a_100015189416_100000186898 [0,1,0,0,0,1|2,0,0]=4 15763 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCF 273464a_100015189416_100000186898 [0,1,0,0,0,1|2,0,0]=4 15764 B16R1.1216 CN(Cc1ccccc1)C(=O)NCCCO 273464a_100000182051_100000186898 [0,1,0,0,0,1|2,0,0]=4 15765 B16R1.1216 COCCCC(=O)C(C)Cc1ccccc1 1458a_100000741012_200011218536 [0,1,0,0,0,1|2,0,0]=4 15766 B16R1.1216 COCCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000740836 [0,1,0,0,0,1|2,0,0]=4 15767 B16R1.1216 COCCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000740836 [0,1,0,0,0,1|2,0,0]=4 15768 B16R1.1216 COCCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000740836 [0,1,0,0,0,1|2,0,0]=4 15769 B16R1.1216 COCCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000741012 [0,1,0,0,0,1|2,0,0]=4 15770 B16R1.1216 COCCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000741012 [0,1,0,0,0,1|2,0,0]=4 15771 B16R1.1216 COCCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000741012 [0,1,0,0,0,1|2,0,0]=4 15772 B16R1.1216 COCCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000741012 [0,1,0,0,0,1|2,0,0]=4 15773 B16R1.1216 COCCCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000740836 [0,1,0,0,0,1|2,0,0]=4 15774 B16R1.1216 COCCNC(=O)C(C)Cc1ccccc1 1626a_100000209980_100000754839 [0,1,0,0,0,1|2,0,0]=4 15775 B16R1.1216 COCCNC(=O)C(C)Cc1ccccc1 240690a_100000209980_100000754839 [0,1,0,0,0,1|2,0,0]=4 15776 B16R1.1216 COCCNC(=O)C(C)Cc1ccccc1 527a_100000209980_100000754839 [0,1,0,0,0,1|2,0,0]=4 15777 B16R1.1216 COCCNC(=O)C(C)Oc1ccccc1 1626a_100000209980_100000188414 [0,1,0,0,0,1|2,0,0]=4 15778 B16R1.1216 COCCNC(=O)C(C)Oc1ccccc1 240690a_100000209980_100000188414 [0,1,0,0,0,1|2,0,0]=4 15779 B16R1.1216 COCCNC(=O)C(C)Oc1ccccc1 527a_100000209980_100000188414 [0,1,0,0,0,1|2,0,0]=4 15780 B16R1.1216 COCCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000230274 [0,1,0,0,0,1|2,0,0]=4 15781 B16R1.1216 COCCNC(=O)C(C)Sc1ccccc1 1626a_100000209980_100000199063 [0,1,0,0,0,1|2,0,0]=4 15782 B16R1.1216 COCCNC(=O)C(C)Sc1ccccc1 240690a_100000209980_100000199063 [0,1,0,0,0,1|2,0,0]=4 15783 B16R1.1216 COCCNC(=O)C(C)Sc1ccccc1 527a_100000209980_100000199063 [0,1,0,0,0,1|2,0,0]=4 15784 B16R1.1216 COCCNC(=O)C(C)Sc1ccccc1 62a_100000230274_100000041952 [0,1,0,0,0,1|2,0,0]=4 15785 B16R1.1216 COCCNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000230274 [0,1,0,0,0,1|2,0,0]=4 15786 B16R1.1216 COCCNC(=O)N(C)Cc1ccccc1 273464a_100000209980_100000186898 [0,1,0,0,0,1|2,0,0]=4 15787 B16R1.1216 COCCNC(=O)[C@H](O)Cc1ccccc1 240690a_100000209980_100009816399 [0,1,0,0,0,1|2,0,0]=4 15788 B16R1.1216 CSCCCC(=O)C(C)Cc1ccccc1 1458a_100000173376_200011218536 [0,1,0,0,0,1|2,0,0]=4 15789 B16R1.1216 CSCCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000173376 [0,1,0,0,0,1|2,0,0]=4 15790 B16R1.1216 CSCCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000173376 [0,1,0,0,0,1|2,0,0]=4 15791 B16R1.1216 CSCCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000173376 [0,1,0,0,0,1|2,0,0]=4 15792 B16R1.1216 CSCCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000173376 [0,1,0,0,0,1|2,0,0]=4 15793 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 11a_100020590264_100000754839 [0,1,0,0,0,1|2,0,0]=4 15794 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 1626a_100020590264_100000754839 [0,1,0,0,0,1|2,0,0]=4 15795 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 240690a_100020590264_100000754839 [0,1,0,0,0,1|2,0,0]=4 15796 B16R1.1216 CSCCNC(=O)C(C)Cc1ccccc1 527a_100020590264_100000754839 [0,1,0,0,0,1|2,0,0]=4 15797 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 11a_100020590264_100000188414 [0,1,0,0,0,1|2,0,0]=4 15798 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 1626a_100020590264_100000188414 [0,1,0,0,0,1|2,0,0]=4 15799 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 240690a_100020590264_100000188414 [0,1,0,0,0,1|2,0,0]=4 15800 B16R1.1216 CSCCNC(=O)C(C)Oc1ccccc1 527a_100020590264_100000188414 [0,1,0,0,0,1|2,0,0]=4 15801 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 11a_100020590264_100000199063 [0,1,0,0,0,1|2,0,0]=4 15802 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 1626a_100020590264_100000199063 [0,1,0,0,0,1|2,0,0]=4 15803 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 240690a_100020590264_100000199063 [0,1,0,0,0,1|2,0,0]=4 15804 B16R1.1216 CSCCNC(=O)C(C)Sc1ccccc1 527a_100020590264_100000199063 [0,1,0,0,0,1|2,0,0]=4 15805 B16R1.1216 CSCCNC(=O)N(C)Cc1ccccc1 2708a_100020590264_100000186898 [0,1,0,0,0,1|2,0,0]=4 15806 B16R1.1216 CSCCNC(=O)N(C)Cc1ccccc1 273464a_100020590264_100000186898 [0,1,0,0,0,1|2,0,0]=4 15807 B16R1.1216 CSCCNC(=O)[C@H](O)Cc1ccccc1 240690a_100020590264_100009816399 [0,1,0,0,0,1|2,0,0]=4 15808 B16R1.1216 O=C(CCCCF)[C@H](O)Cc1ccccc1 1458a_100009816399_100000729493 [0,1,0,0,0,1|2,0,0]=4 15809 B16R1.1216 O=C(CCCCO)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210776 [0,1,0,0,0,1|2,0,0]=4 15810 B16R1.1216 O=C(NCCCF)[C@H](O)Cc1ccccc1 240690a_100015189416_100009816399 [0,1,0,0,0,1|2,0,0]=4 15811 B16R1.1216 O=C(NCCCO)[C@H](O)Cc1ccccc1 240690a_100000182051_100009816399 [0,1,0,0,0,1|2,0,0]=4 15812 B16R1.1343 CC(CNC(=O)OCc1ccccc1)O[13CH3] 34a_200011240566_200025704644 [0,1,0,0,0,1|2,0,0]=4 15813 B16R1.1343 CC(CNC(=O)OCc1ccccc1)O[13CH3] 7a_200011240566_200025704644 [0,1,0,0,0,1|2,0,0]=4 15814 B16R1.1343 CC(CO)CNC(=O)CCc1ccccc1 240690a_100000744482_100000185753 [0,1,0,0,0,1|2,0,0]=4 15815 B16R1.1343 CC(CO)CNC(=O)CCc1ccccc1 527a_100000744482_100000185753 [0,1,0,0,0,1|2,0,0]=4 15816 B16R1.1343 CC(CO)CNC(=O)COc1ccccc1 240690a_100000744482_100000186222 [0,1,0,0,0,1|2,0,0]=4 15817 B16R1.1343 CC(CO)CNC(=O)COc1ccccc1 527a_100000744482_100000186222 [0,1,0,0,0,1|2,0,0]=4 15818 B16R1.1343 CC(CO)CNC(=O)CSc1ccccc1 240690a_100000744482_100000211596 [0,1,0,0,0,1|2,0,0]=4 15819 B16R1.1343 CC(CO)CNC(=O)CSc1ccccc1 527a_100000744482_100000211596 [0,1,0,0,0,1|2,0,0]=4 15820 B16R1.1343 CC(CO)CNC(=O)NCc1ccccc1 2708a_100015324214_100000744482 [0,1,0,0,0,1|2,0,0]=4 15821 B16R1.1343 CC(CO)CNC(=O)NCc1ccccc1 273464a_100000744482_100015324214 [0,1,0,0,0,1|2,0,0]=4 15822 B16R1.1343 CC(CO)CNC(=O)NCc1ccccc1 273464a_100015324214_100000744482 [0,1,0,0,0,1|2,0,0]=4 15823 B16R1.1343 CC(CO)CNC(=O)NCc1ccccc1 512a_100000744482_100015324214 [0,1,0,0,0,1|2,0,0]=4 15824 B16R1.1343 CC(CO)CNC(=O)NCc1ccccc1 512a_100015324214_100000744482 [0,1,0,0,0,1|2,0,0]=4 15825 B16R1.1343 CCC(=O)CCC(=O)NCc1ccccc1 1458a_100000185749_100000210202 [0,1,0,0,0,1|1,0,1]=4 15826 B16R1.1343 CCC(=O)CCC(=O)OCc1ccccc1 1458a_100000066287_100000210202 [0,1,0,0,0,1|1,0,1]=4 15827 B16R1.1343 CCC(=O)CCC(=O)OCc1ccccc1 1458a_100000210414_100009813219 [0,1,0,0,0,1|1,0,1]=4 15828 B16R1.1343 CCC(=O)CNC(=O)CCc1ccccc1 1458a_100000194590_100000210202 [0,1,0,0,0,1|1,0,1]=4 15829 B16R1.1343 CCC(=O)CNC(=O)COc1ccccc1 1458a_100000185185_100000210202 [0,1,0,0,0,1|1,0,1]=4 15830 B16R1.1343 CCC(=O)CNC(=O)OCc1ccccc1 1458a_100000744346_100000210202 [0,1,0,0,0,1|1,0,1]=4 15831 B16R1.1343 CCC(C)CCC(=O)CCc1ccccc1 1458a_100000701222_100000765856 [0,1,0,0,0,1|1,0,0]=3 15832 B16R1.1343 CCC(C)CCC(=O)CCc1ccccn1 1458a_100000701222_100015183660 [0,1,0,0,0,1|2,0,0]=4 15833 B16R1.1343 CCC(C)CCC(=O)CCc1cccnc1 1458a_100000701222_200011713674 [0,1,0,0,0,1|2,0,0]=4 15834 B16R1.1343 CCC(C)CCC(=O)CCc1ccncc1 1458a_100000701222_100000723409 [0,1,0,0,0,1|2,0,0]=4 15835 B16R1.1343 CCC(C)CCC(=O)NCc1ccccc1 11a_100015324214_100000701222 [0,1,0,0,0,1|1,0,0]=3 15836 B16R1.1343 CCC(C)CCC(=O)NCc1ccccc1 1626a_100015324214_100000701222 [0,1,0,0,0,1|1,0,0]=3 15837 B16R1.1343 CCC(C)CCC(=O)NCc1ccccc1 240690a_100015324214_100000701222 [0,1,0,0,0,1|1,0,0]=3 15838 B16R1.1343 CCC(C)CCC(=O)NCc1ccccc1 527a_100015324214_100000701222 [0,1,0,0,0,1|1,0,0]=3 15839 B16R1.1343 CCC(C)CCC(=O)NCc1ccccn1 11a_100000210449_100000701222 [0,1,0,0,0,1|2,0,0]=4 15840 B16R1.1343 CCC(C)CCC(=O)NCc1ccccn1 1626a_100000210449_100000701222 [0,1,0,0,0,1|2,0,0]=4 15841 B16R1.1343 CCC(C)CCC(=O)NCc1ccccn1 240690a_100000210449_100000701222 [0,1,0,0,0,1|2,0,0]=4 15842 B16R1.1343 CCC(C)CCC(=O)NCc1ccccn1 527a_100000210449_100000701222 [0,1,0,0,0,1|2,0,0]=4 15843 B16R1.1343 CCC(C)CCC(=O)NCc1cccnc1 11a_100000210453_100000701222 [0,1,0,0,0,1|2,0,0]=4 15844 B16R1.1343 CCC(C)CCC(=O)NCc1cccnc1 240690a_100000210453_100000701222 [0,1,0,0,0,1|2,0,0]=4 15845 B16R1.1343 CCC(C)CCC(=O)NCc1cccnc1 527a_100000210453_100000701222 [0,1,0,0,0,1|2,0,0]=4 15846 B16R1.1343 CCC(C)CCC(=O)NCc1ccncc1 11a_100000210450_100000701222 [0,1,0,0,0,1|2,0,0]=4 15847 B16R1.1343 CCC(C)CCC(=O)NCc1ccncc1 1626a_100000210450_100000701222 [0,1,0,0,0,1|2,0,0]=4 15848 B16R1.1343 CCC(C)CCC(=O)NCc1ccncc1 240690a_100000210450_100000701222 [0,1,0,0,0,1|2,0,0]=4 15849 B16R1.1343 CCC(C)CCC(=O)NCc1ccncc1 527a_100000210450_100000701222 [0,1,0,0,0,1|2,0,0]=4 15850 B16R1.1343 CCC(C)CCC(=O)NNc1ccccc1 22a_100015195140_100000701222 [0,1,0,0,0,1|2,0,0]=4 15851 B16R1.1343 CCC(C)CNC(=O)C#Cc1ccccc1 240690a_100020588543_100000736102 [0,1,0,0,0,1|1,0,1]=4 15852 B16R1.1343 CCC(C)CNC(=O)C=Cc1ccccc1 11a_100020588543_100000210462 [0,1,0,0,0,1|1,0,1]=4 15853 B16R1.1343 CCC(C)CNC(=O)C=Cc1ccccc1 1626a_100020588543_100000210462 [0,1,0,0,0,1|1,0,1]=4 15854 B16R1.1343 CCC(C)CNC(=O)CCc1ccccc1 11a_100020588543_100000185753 [0,1,0,0,0,1|1,0,0]=3 15855 B16R1.1343 CCC(C)CNC(=O)CCc1ccccc1 1626a_100020588543_100000185753 [0,1,0,0,0,1|1,0,0]=3 15856 B16R1.1343 CCC(C)CNC(=O)CCc1ccccc1 240690a_100020588543_100000185753 [0,1,0,0,0,1|1,0,0]=3 15857 B16R1.1343 CCC(C)CNC(=O)CCc1ccccc1 527a_100020588543_100000185753 [0,1,0,0,0,1|1,0,0]=3 15858 B16R1.1343 CCC(C)CNC(=O)CCc1ccccn1 11a_100020588543_100015195070 [0,1,0,0,0,1|2,0,0]=4 15859 B16R1.1343 CCC(C)CNC(=O)CCc1ccccn1 240690a_100020588543_100015195070 [0,1,0,0,0,1|2,0,0]=4 15860 B16R1.1343 CCC(C)CNC(=O)CCc1ccccn1 527a_100020588543_100015195070 [0,1,0,0,0,1|2,0,0]=4 15861 B16R1.1343 CCC(C)CNC(=O)CCc1cccnc1 11a_100020588543_100000198484 [0,1,0,0,0,1|2,0,0]=4 15862 B16R1.1343 CCC(C)CNC(=O)CCc1cccnc1 1626a_100020588543_100000198484 [0,1,0,0,0,1|2,0,0]=4 15863 B16R1.1343 CCC(C)CNC(=O)CCc1cccnc1 240690a_100020588543_100000198484 [0,1,0,0,0,1|2,0,0]=4 15864 B16R1.1343 CCC(C)CNC(=O)CCc1cccnc1 527a_100020588543_100000198484 [0,1,0,0,0,1|2,0,0]=4 15865 B16R1.1343 CCC(C)CNC(=O)CCc1ccncc1 11a_100020588543_100011225043 [0,1,0,0,0,1|2,0,0]=4 15866 B16R1.1343 CCC(C)CNC(=O)CCc1ccncc1 240690a_100020588543_100011225043 [0,1,0,0,0,1|2,0,0]=4 15867 B16R1.1343 CCC(C)CNC(=O)CCc1ccncc1 527a_100020588543_100011225043 [0,1,0,0,0,1|2,0,0]=4 15868 B16R1.1343 CCC(C)CNC(=O)COc1ccccc1 11a_100020588543_100000186222 [0,1,0,0,0,1|1,0,0]=3 15869 B16R1.1343 CCC(C)CNC(=O)COc1ccccc1 1626a_100020588543_100000186222 [0,1,0,0,0,1|1,0,0]=3 15870 B16R1.1343 CCC(C)CNC(=O)COc1ccccc1 240690a_100020588543_100000186222 [0,1,0,0,0,1|1,0,0]=3 15871 B16R1.1343 CCC(C)CNC(=O)COc1ccccc1 527a_100020588543_100000186222 [0,1,0,0,0,1|1,0,0]=3 15872 B16R1.1343 CCC(C)CNC(=O)COc1ccccn1 1626a_100020588543_100102699861 [0,1,0,0,0,1|2,0,0]=4 15873 B16R1.1343 CCC(C)CNC(=O)COc1ccccn1 240690a_100020588543_100102699861 [0,1,0,0,0,1|2,0,0]=4 15874 B16R1.1343 CCC(C)CNC(=O)COc1ccccn1 527a_100020588543_100102699861 [0,1,0,0,0,1|2,0,0]=4 15875 B16R1.1343 CCC(C)CNC(=O)COc1cccnc1 11a_100020588543_100015207166 [0,1,0,0,0,1|2,0,0]=4 15876 B16R1.1343 CCC(C)CNC(=O)COc1cccnc1 1626a_100020588543_100015207166 [0,1,0,0,0,1|2,0,0]=4 15877 B16R1.1343 CCC(C)CNC(=O)COc1cccnc1 240690a_100020588543_100015207166 [0,1,0,0,0,1|2,0,0]=4 15878 B16R1.1343 CCC(C)CNC(=O)COc1cccnc1 527a_100020588543_100015207166 [0,1,0,0,0,1|2,0,0]=4 15879 B16R1.1343 CCC(C)CNC(=O)CSc1ccccc1 11a_100020588543_100000211596 [0,1,0,0,0,1|1,0,0]=3 15880 B16R1.1343 CCC(C)CNC(=O)CSc1ccccc1 1626a_100020588543_100000211596 [0,1,0,0,0,1|1,0,0]=3 15881 B16R1.1343 CCC(C)CNC(=O)CSc1ccccc1 240690a_100020588543_100000211596 [0,1,0,0,0,1|1,0,0]=3 15882 B16R1.1343 CCC(C)CNC(=O)CSc1ccccc1 527a_100020588543_100000211596 [0,1,0,0,0,1|1,0,0]=3 15883 B16R1.1343 CCC(C)CNC(=O)CSc1ccccn1 11a_100020588543_100000156281 [0,1,0,0,0,1|2,0,0]=4 15884 B16R1.1343 CCC(C)CNC(=O)CSc1ccccn1 240690a_100020588543_100000156281 [0,1,0,0,0,1|2,0,0]=4 15885 B16R1.1343 CCC(C)CNC(=O)CSc1ccccn1 527a_100020588543_100000156281 [0,1,0,0,0,1|2,0,0]=4 15886 B16R1.1343 CCC(C)CNC(=O)CSc1ccncc1 11a_100020588543_100000211328 [0,1,0,0,0,1|2,0,0]=4 15887 B16R1.1343 CCC(C)CNC(=O)CSc1ccncc1 1626a_100020588543_100000211328 [0,1,0,0,0,1|2,0,0]=4 15888 B16R1.1343 CCC(C)CNC(=O)CSc1ccncc1 240690a_100020588543_100000211328 [0,1,0,0,0,1|2,0,0]=4 15889 B16R1.1343 CCC(C)CNC(=O)CSc1ccncc1 527a_100020588543_100000211328 [0,1,0,0,0,1|2,0,0]=4 15890 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 2708a_100015324214_100020588543 [0,1,0,0,0,1|1,0,0]=3 15891 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 2708a_100020588543_100015324214 [0,1,0,0,0,1|1,0,0]=3 15892 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 273464a_100015324214_100020588543 [0,1,0,0,0,1|1,0,0]=3 15893 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 273464a_100020588543_100015324214 [0,1,0,0,0,1|1,0,0]=3 15894 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 512a_100015324214_100020588543 [0,1,0,0,0,1|1,0,0]=3 15895 B16R1.1343 CCC(C)CNC(=O)NCc1ccccc1 512a_100020588543_100015324214 [0,1,0,0,0,1|1,0,0]=3 15896 B16R1.1343 CCC(C)CNC(=O)NCc1ccccn1 2708a_100000210449_100020588543 [0,1,0,0,0,1|2,0,0]=4 15897 B16R1.1343 CCC(C)CNC(=O)NCc1ccccn1 2708a_100020588543_100000210449 [0,1,0,0,0,1|2,0,0]=4 15898 B16R1.1343 CCC(C)CNC(=O)NCc1ccccn1 273464a_100000210449_100020588543 [0,1,0,0,0,1|2,0,0]=4 15899 B16R1.1343 CCC(C)CNC(=O)NCc1ccccn1 273464a_100020588543_100000210449 [0,1,0,0,0,1|2,0,0]=4 15900 B16R1.1343 CCC(C)CNC(=O)NCc1ccccn1 512a_100020588543_100000210449 [0,1,0,0,0,1|2,0,0]=4 15901 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 2708a_100000210453_100020588543 [0,1,0,0,0,1|2,0,0]=4 15902 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 2708a_100020588543_100000210453 [0,1,0,0,0,1|2,0,0]=4 15903 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 273464a_100000210453_100020588543 [0,1,0,0,0,1|2,0,0]=4 15904 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 273464a_100020588543_100000210453 [0,1,0,0,0,1|2,0,0]=4 15905 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 512a_100000210453_100020588543 [0,1,0,0,0,1|2,0,0]=4 15906 B16R1.1343 CCC(C)CNC(=O)NCc1cccnc1 512a_100020588543_100000210453 [0,1,0,0,0,1|2,0,0]=4 15907 B16R1.1343 CCC(C)CNC(=O)NCc1ccncc1 2708a_100000210450_100020588543 [0,1,0,0,0,1|2,0,0]=4 15908 B16R1.1343 CCC(C)CNC(=O)NCc1ccncc1 2708a_100020588543_100000210450 [0,1,0,0,0,1|2,0,0]=4 15909 B16R1.1343 CCC(C)CNC(=O)NCc1ccncc1 273464a_100000210450_100020588543 [0,1,0,0,0,1|2,0,0]=4 15910 B16R1.1343 CCC(C)CNC(=O)NCc1ccncc1 273464a_100020588543_100000210450 [0,1,0,0,0,1|2,0,0]=4 15911 B16R1.1343 CCC(C)CNC(=O)NCc1ccncc1 512a_100020588543_100000210450 [0,1,0,0,0,1|2,0,0]=4 15912 B16R1.1343 CCC(C)CNC(=O)NNc1ccccc1 273464a_100020588543_100015195140 [0,1,0,0,0,1|2,0,0]=4 15913 B16R1.1343 CCC(C)CNC(=O)NNc1ccccc1 512a_100020588543_100015195140 [0,1,0,0,0,1|2,0,0]=4 15914 B16R1.1343 CCC(C)COC(C)COc1ccccc1 34a_100000210911_100000748023 [0,1,0,0,0,1|1,0,1]=4 15915 B16R1.1343 CCC(C)COC(C)COc1ccccc1 7a_100000210911_100000748023 [0,1,0,0,0,1|1,0,1]=4 15916 B16R1.1343 CCC(C)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100000748023 [0,1,0,0,0,1|1,0,1]=4 15917 B16R1.1343 CCC(C)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000748023 [0,1,0,0,0,1|1,0,1]=4 15918 B16R1.1343 CCC(C)NCC(=O)CCc1ccccc1 2230a_100000209981_100012361361 [0,1,0,0,0,1|2,0,0]=4 15919 B16R1.1343 CCC(C)NCC(=O)NCc1ccccc1 2230a_100000209981_100000183539 [0,1,0,0,0,1|2,0,0]=4 15920 B16R1.1343 CCC(C)NCC(=O)NCc1ccccc1 2230a_100000739245_100000758301 [0,1,0,0,0,1|2,0,0]=4 15921 B16R1.1343 CCC(C)NCC(=O)OCc1ccccc1 2230a_100000209981_100000753625 [0,1,0,0,0,1|2,0,0]=4 15922 B16R1.1343 CCC(C)NNC(=O)CCc1ccccc1 22a_100000718999_100000185753 [0,1,0,0,0,1|2,0,0]=4 15923 B16R1.1343 CCC(C)NNC(=O)COc1ccccc1 22a_100000718999_100000186222 [0,1,0,0,0,1|2,0,0]=4 15924 B16R1.1343 CCC(C)NNC(=O)CSc1ccccc1 22a_100000718999_100000211596 [0,1,0,0,0,1|2,0,0]=4 15925 B16R1.1343 CCC(C)NNC(=O)NCc1ccccc1 273464a_100015324214_100000718999 [0,1,0,0,0,1|2,0,0]=4 15926 B16R1.1343 CCC(C)NNC(=O)NCc1ccccc1 512a_100000718999_100015324214 [0,1,0,0,0,1|2,0,0]=4 15927 B16R1.1343 CCC(C)NNC(=O)NCc1ccccc1 512a_100015324214_100000718999 [0,1,0,0,0,1|2,0,0]=4 15928 B16R1.1343 CCC(C)OCC(=O)CCc1ccccc1 7a_100000210228_100012361361 [0,1,0,0,0,1|2,0,0]=4 15929 B16R1.1343 CCC(C)OCC(=O)NCc1ccccc1 7a_100000210228_100000183539 [0,1,0,0,0,1|2,0,0]=4 15930 B16R1.1343 CCC(C)OCC(=O)OCc1ccccc1 7a_100000210228_100000753625 [0,1,0,0,0,1|2,0,0]=4 15931 B16R1.1343 CCC(C)SCC(=O)CCc1ccccc1 62a_100000758301_100012361361 [0,1,0,0,0,1|2,0,0]=4 15932 B16R1.1343 CCC(C)SCC(=O)CCc1ccccc1 62a_100012361361_100000758301 [0,1,0,0,0,1|2,0,0]=4 15933 B16R1.1343 CCC(C)SCC(=O)NCc1ccccc1 62a_100000183539_100000758301 [0,1,0,0,0,1|2,0,0]=4 15934 B16R1.1343 CCC(C)SCC(=O)NCc1ccccc1 62a_100000758301_100000183539 [0,1,0,0,0,1|2,0,0]=4 15935 B16R1.1343 CCC(C)SCC(=O)OCc1ccccc1 62a_100000753625_100000758301 [0,1,0,0,0,1|2,0,0]=4 15936 B16R1.1343 CCC(C)SCC(=O)OCc1ccccc1 62a_100000758301_100000753625 [0,1,0,0,0,1|2,0,0]=4 15937 B16R1.1343 CCC(O)CCC(=O)NCc1ccccc1 1626a_100015324214_203496584001 [0,1,0,0,0,1|1,0,0]=3 15938 B16R1.1343 CCC(O)CCC(=O)NCc1ccccc1 240690a_100015324214_203496584001 [0,1,0,0,0,1|1,0,0]=3 15939 B16R1.1343 CCC(O)CCC(=O)NCc1ccccn1 1626a_100000210449_203496584001 [0,1,0,0,0,1|2,0,0]=4 15940 B16R1.1343 CCC(O)CCC(=O)NCc1ccccn1 240690a_100000210449_203496584001 [0,1,0,0,0,1|2,0,0]=4 15941 B16R1.1343 CCC(O)CCC(=O)NCc1cccnc1 240690a_100000210453_203496584001 [0,1,0,0,0,1|2,0,0]=4 15942 B16R1.1343 CCC(O)CCC(=O)NCc1ccncc1 1626a_100000210450_203496584001 [0,1,0,0,0,1|2,0,0]=4 15943 B16R1.1343 CCC(O)CCC(=O)NCc1ccncc1 240690a_100000210450_203496584001 [0,1,0,0,0,1|2,0,0]=4 15944 B16R1.1343 CCC(O)CCC(=O)NNc1ccccc1 22a_100015195140_203496584001 [0,1,0,0,0,1|2,0,0]=4 15945 B16R1.1343 CCC(O)CNC(=O)C#Cc1ccccc1 240690a_100011218483_100000736102 [0,1,0,0,0,1|1,0,1]=4 15946 B16R1.1343 CCC(O)CNC(=O)C=Cc1ccccc1 11a_100011218483_100000210462 [0,1,0,0,0,1|1,0,1]=4 15947 B16R1.1343 CCC(O)CNC(=O)CCc1ccccc1 11a_100011218483_100000185753 [0,1,0,0,0,1|1,0,0]=3 15948 B16R1.1343 CCC(O)CNC(=O)CCc1ccccc1 240690a_100011218483_100000185753 [0,1,0,0,0,1|1,0,0]=3 15949 B16R1.1343 CCC(O)CNC(=O)CCc1ccccc1 527a_100011218483_100000185753 [0,1,0,0,0,1|1,0,0]=3 15950 B16R1.1343 CCC(O)CNC(=O)CCc1ccccn1 11a_100011218483_100015195070 [0,1,0,0,0,1|2,0,0]=4 15951 B16R1.1343 CCC(O)CNC(=O)CCc1ccccn1 240690a_100011218483_100015195070 [0,1,0,0,0,1|2,0,0]=4 15952 B16R1.1343 CCC(O)CNC(=O)CCc1ccccn1 527a_100011218483_100015195070 [0,1,0,0,0,1|2,0,0]=4 15953 B16R1.1343 CCC(O)CNC(=O)CCc1cccnc1 11a_100011218483_100000198484 [0,1,0,0,0,1|2,0,0]=4 15954 B16R1.1343 CCC(O)CNC(=O)CCc1cccnc1 240690a_100011218483_100000198484 [0,1,0,0,0,1|2,0,0]=4 15955 B16R1.1343 CCC(O)CNC(=O)CCc1cccnc1 527a_100011218483_100000198484 [0,1,0,0,0,1|2,0,0]=4 15956 B16R1.1343 CCC(O)CNC(=O)CCc1ccncc1 11a_100011218483_100011225043 [0,1,0,0,0,1|2,0,0]=4 15957 B16R1.1343 CCC(O)CNC(=O)CCc1ccncc1 240690a_100011218483_100011225043 [0,1,0,0,0,1|2,0,0]=4 15958 B16R1.1343 CCC(O)CNC(=O)CCc1ccncc1 527a_100011218483_100011225043 [0,1,0,0,0,1|2,0,0]=4 15959 B16R1.1343 CCC(O)CNC(=O)COc1ccccc1 11a_100011218483_100000186222 [0,1,0,0,0,1|1,0,0]=3 15960 B16R1.1343 CCC(O)CNC(=O)COc1ccccc1 240690a_100011218483_100000186222 [0,1,0,0,0,1|1,0,0]=3 15961 B16R1.1343 CCC(O)CNC(=O)COc1ccccc1 527a_100011218483_100000186222 [0,1,0,0,0,1|1,0,0]=3 15962 B16R1.1343 CCC(O)CNC(=O)COc1ccccn1 240690a_100011218483_100102699861 [0,1,0,0,0,1|2,0,0]=4 15963 B16R1.1343 CCC(O)CNC(=O)COc1ccccn1 527a_100011218483_100102699861 [0,1,0,0,0,1|2,0,0]=4 15964 B16R1.1343 CCC(O)CNC(=O)COc1cccnc1 11a_100011218483_100015207166 [0,1,0,0,0,1|2,0,0]=4 15965 B16R1.1343 CCC(O)CNC(=O)COc1cccnc1 240690a_100011218483_100015207166 [0,1,0,0,0,1|2,0,0]=4 15966 B16R1.1343 CCC(O)CNC(=O)COc1cccnc1 527a_100011218483_100015207166 [0,1,0,0,0,1|2,0,0]=4 15967 B16R1.1343 CCC(O)CNC(=O)CSc1ccccc1 11a_100011218483_100000211596 [0,1,0,0,0,1|1,0,0]=3 15968 B16R1.1343 CCC(O)CNC(=O)CSc1ccccc1 240690a_100011218483_100000211596 [0,1,0,0,0,1|1,0,0]=3 15969 B16R1.1343 CCC(O)CNC(=O)CSc1ccccc1 527a_100011218483_100000211596 [0,1,0,0,0,1|1,0,0]=3 15970 B16R1.1343 CCC(O)CNC(=O)CSc1ccccn1 11a_100011218483_100000156281 [0,1,0,0,0,1|2,0,0]=4 15971 B16R1.1343 CCC(O)CNC(=O)CSc1ccccn1 240690a_100011218483_100000156281 [0,1,0,0,0,1|2,0,0]=4 15972 B16R1.1343 CCC(O)CNC(=O)CSc1ccccn1 527a_100011218483_100000156281 [0,1,0,0,0,1|2,0,0]=4 15973 B16R1.1343 CCC(O)CNC(=O)CSc1ccncc1 11a_100011218483_100000211328 [0,1,0,0,0,1|2,0,0]=4 15974 B16R1.1343 CCC(O)CNC(=O)CSc1ccncc1 240690a_100011218483_100000211328 [0,1,0,0,0,1|2,0,0]=4 15975 B16R1.1343 CCC(O)CNC(=O)CSc1ccncc1 527a_100011218483_100000211328 [0,1,0,0,0,1|2,0,0]=4 15976 B16R1.1343 CCC(O)CNC(=O)NCc1ccccc1 2708a_100015324214_100011218483 [0,1,0,0,0,1|1,0,0]=3 15977 B16R1.1343 CCC(O)CNC(=O)NCc1ccccc1 273464a_100011218483_100015324214 [0,1,0,0,0,1|1,0,0]=3 15978 B16R1.1343 CCC(O)CNC(=O)NCc1ccccc1 273464a_100015324214_100011218483 [0,1,0,0,0,1|1,0,0]=3 15979 B16R1.1343 CCC(O)CNC(=O)NCc1ccccc1 512a_100011218483_100015324214 [0,1,0,0,0,1|1,0,0]=3 15980 B16R1.1343 CCC(O)CNC(=O)NCc1ccccn1 2708a_100000210449_100011218483 [0,1,0,0,0,1|2,0,0]=4 15981 B16R1.1343 CCC(O)CNC(=O)NCc1ccccn1 273464a_100000210449_100011218483 [0,1,0,0,0,1|2,0,0]=4 15982 B16R1.1343 CCC(O)CNC(=O)NCc1ccccn1 273464a_100011218483_100000210449 [0,1,0,0,0,1|2,0,0]=4 15983 B16R1.1343 CCC(O)CNC(=O)NCc1ccccn1 512a_100011218483_100000210449 [0,1,0,0,0,1|2,0,0]=4 15984 B16R1.1343 CCC(O)CNC(=O)NCc1cccnc1 2708a_100000210453_100011218483 [0,1,0,0,0,1|2,0,0]=4 15985 B16R1.1343 CCC(O)CNC(=O)NCc1cccnc1 273464a_100000210453_100011218483 [0,1,0,0,0,1|2,0,0]=4 15986 B16R1.1343 CCC(O)CNC(=O)NCc1cccnc1 273464a_100011218483_100000210453 [0,1,0,0,0,1|2,0,0]=4 15987 B16R1.1343 CCC(O)CNC(=O)NCc1cccnc1 512a_100011218483_100000210453 [0,1,0,0,0,1|2,0,0]=4 15988 B16R1.1343 CCC(O)CNC(=O)NCc1ccncc1 2708a_100000210450_100011218483 [0,1,0,0,0,1|2,0,0]=4 15989 B16R1.1343 CCC(O)CNC(=O)NCc1ccncc1 273464a_100000210450_100011218483 [0,1,0,0,0,1|2,0,0]=4 15990 B16R1.1343 CCC(O)CNC(=O)NCc1ccncc1 273464a_100011218483_100000210450 [0,1,0,0,0,1|2,0,0]=4 15991 B16R1.1343 CCC(O)CNC(=O)NCc1ccncc1 512a_100011218483_100000210450 [0,1,0,0,0,1|2,0,0]=4 15992 B16R1.1343 CCC(O)CNC(=O)NNc1ccccc1 273464a_100011218483_100015195140 [0,1,0,0,0,1|2,0,0]=4 15993 B16R1.1343 CCC(O)CNC(=O)NNc1ccccc1 512a_100011218483_100015195140 [0,1,0,0,0,1|2,0,0]=4 15994 B16R1.1343 CCC(O)COC(C)COc1ccccc1 34a_100000210911_100011218378 [0,1,0,0,0,1|1,0,1]=4 15995 B16R1.1343 CCC(O)COC(C)COc1ccccc1 7a_100000210911_100011218378 [0,1,0,0,0,1|1,0,1]=4 15996 B16R1.1343 CCC(O)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100011218378 [0,1,0,0,0,1|1,0,1]=4 15997 B16R1.1343 CCC(O)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100011218378 [0,1,0,0,0,1|1,0,1]=4 15998 B16R1.1343 CCN(C)CCC(=O)CCc1ccccc1 1458a_100000755305_100000765856 [0,1,0,0,0,1|2,0,0]=4 15999 B16R1.1343 CCN(C)CCC(=O)NCc1ccccc1 240690a_100015324214_100000755305 [0,1,0,0,0,1|2,0,0]=4 16000 B16R1.1343 CCN(C)CCC(=O)OCc1ccccc1 2230a_100000225621_100009813219 [0,1,0,0,0,1|2,0,0]=4 16001 B16R1.1343 CCN(C)CCC(=O)OCc1ccccc1 269982a_100000225621_100009813219 [0,1,0,0,0,1|2,0,0]=4 16002 B16R1.1343 CCS(=O)CCC(=O)CCc1ccccc1 1458a_100011387550_100000765856 [0,1,0,0,0,1|2,0,0]=4 16003 B16R1.1343 CCS(=O)CCC(=O)NCc1ccccc1 11a_100015324214_100011387550 [0,1,0,0,0,1|2,0,0]=4 16004 B16R1.1343 CCS(=O)CCC(=O)NCc1ccccc1 1626a_100015324214_100011387550 [0,1,0,0,0,1|2,0,0]=4 16005 B16R1.1343 CCS(=O)CCC(=O)NCc1ccccc1 240690a_100015324214_100011387550 [0,1,0,0,0,1|2,0,0]=4 16006 B16R1.1343 CCS(=O)CCC(=O)NCc1ccccc1 527a_100015324214_100011387550 [0,1,0,0,0,1|2,0,0]=4 16007 B16R1.1343 CC[C@H](C)COC(C)COc1ccccc1 34a_100000210911_100009816398 [0,1,0,0,0,1|1,0,1]=4 16008 B16R1.1343 CC[C@H](C)COC(C)COc1ccccc1 7a_100000210911_100009816398 [0,1,0,0,0,1|1,0,1]=4 16009 B16R1.1343 CC[C@H](C)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100009816398 [0,1,0,0,0,1|1,0,1]=4 16010 B16R1.1343 CC[C@H](C)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100009816398 [0,1,0,0,0,1|1,0,1]=4 16011 B16R1.1343 COC(C)CNC(=O)OCc1ccccc1 34a_200011240566_200000210301 [0,1,0,0,0,1|2,0,0]=4 16012 B16R1.1343 COC(C)CNC(=O)OCc1ccccc1 7a_200011240566_200000210301 [0,1,0,0,0,1|2,0,0]=4 16013 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 11a_100020591295_100000185753 [0,1,0,0,0,1|2,0,0]=4 16014 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 1626a_100020591295_100000185753 [0,1,0,0,0,1|2,0,0]=4 16015 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 240690a_100020591295_100000185753 [0,1,0,0,0,1|2,0,0]=4 16016 B16R1.1343 CO[C@H](C)CNC(=O)CCc1ccccc1 527a_100020591295_100000185753 [0,1,0,0,0,1|2,0,0]=4 16017 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 11a_100020591295_100000186222 [0,1,0,0,0,1|2,0,0]=4 16018 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 1626a_100020591295_100000186222 [0,1,0,0,0,1|2,0,0]=4 16019 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 240690a_100020591295_100000186222 [0,1,0,0,0,1|2,0,0]=4 16020 B16R1.1343 CO[C@H](C)CNC(=O)COc1ccccc1 527a_100020591295_100000186222 [0,1,0,0,0,1|2,0,0]=4 16021 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 11a_100020591295_100000211596 [0,1,0,0,0,1|2,0,0]=4 16022 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 1626a_100020591295_100000211596 [0,1,0,0,0,1|2,0,0]=4 16023 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 240690a_100020591295_100000211596 [0,1,0,0,0,1|2,0,0]=4 16024 B16R1.1343 CO[C@H](C)CNC(=O)CSc1ccccc1 527a_100020591295_100000211596 [0,1,0,0,0,1|2,0,0]=4 16025 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 2708a_100015324214_100020591295 [0,1,0,0,0,1|2,0,0]=4 16026 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 2708a_100020591295_100015324214 [0,1,0,0,0,1|2,0,0]=4 16027 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 273464a_100015324214_100020591295 [0,1,0,0,0,1|2,0,0]=4 16028 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 273464a_100020591295_100015324214 [0,1,0,0,0,1|2,0,0]=4 16029 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 512a_100015324214_100020591295 [0,1,0,0,0,1|2,0,0]=4 16030 B16R1.1343 CO[C@H](C)CNC(=O)NCc1ccccc1 512a_100020591295_100015324214 [0,1,0,0,0,1|2,0,0]=4 16031 B16R1.1343 O=C(CCc1ccccc1)NC[C@@H](F)CO 240690a_100015665980_100000185753 [0,1,0,0,0,1|2,0,0]=4 16032 B16R1.1343 O=C(CCc1ccccc1)NC[C@@H](F)CO 527a_100015665980_100000185753 [0,1,0,0,0,1|2,0,0]=4 16033 B16R1.1343 O=C(CCc1ccccc1)NC[C@H](O)CO 240690a_100020644852_100000185753 [0,1,0,0,0,1|2,0,0]=4 16034 B16R1.1343 O=C(CCc1ccccc1)NC[C@H](O)CO 527a_100020644852_100000185753 [0,1,0,0,0,1|2,0,0]=4 16035 B16R1.1343 O=C(CNc1ccccc1)NCC(O)CO 34a_100000106764_200012027429 [0,1,0,0,0,1|2,0,0]=4 16036 B16R1.1343 O=C(COc1ccccc1)NCC(O)CO 34a_100000210340_200012027429 [0,1,0,0,0,1|2,0,0]=4 16037 B16R1.1343 O=C(COc1ccccc1)NCC(O)CO 7a_100000210340_200012027429 [0,1,0,0,0,1|2,0,0]=4 16038 B16R1.1343 O=C(COc1ccccc1)NC[C@@H](F)CO 240690a_100015665980_100000186222 [0,1,0,0,0,1|2,0,0]=4 16039 B16R1.1343 O=C(COc1ccccc1)NC[C@@H](F)CO 527a_100015665980_100000186222 [0,1,0,0,0,1|2,0,0]=4 16040 B16R1.1343 O=C(COc1ccccc1)NC[C@H](O)CO 240690a_100020644852_100000186222 [0,1,0,0,0,1|2,0,0]=4 16041 B16R1.1343 O=C(COc1ccccc1)NC[C@H](O)CO 527a_100020644852_100000186222 [0,1,0,0,0,1|2,0,0]=4 16042 B16R1.1343 O=C(CSc1ccccc1)NCC(O)CO 62a_100000719477_200012027429 [0,1,0,0,0,1|2,0,0]=4 16043 B16R1.1343 O=C(CSc1ccccc1)NCC(O)CO 62a_200012027429_100000041952 [0,1,0,0,0,1|2,0,0]=4 16044 B16R1.1343 O=C(CSc1ccccc1)NC[C@@H](F)CO 240690a_100015665980_100000211596 [0,1,0,0,0,1|2,0,0]=4 16045 B16R1.1343 O=C(CSc1ccccc1)NC[C@@H](F)CO 527a_100015665980_100000211596 [0,1,0,0,0,1|2,0,0]=4 16046 B16R1.1343 O=C(CSc1ccccc1)NC[C@H](O)CO 240690a_100020644852_100000211596 [0,1,0,0,0,1|2,0,0]=4 16047 B16R1.1343 O=C(CSc1ccccc1)NC[C@H](O)CO 527a_100020644852_100000211596 [0,1,0,0,0,1|2,0,0]=4 16048 B16R1.1343 O=C(NCc1ccccc1)NC[C@@H](F)CO 2708a_100015324214_100015665980 [0,1,0,0,0,1|2,0,0]=4 16049 B16R1.1343 O=C(NCc1ccccc1)NC[C@@H](F)CO 273464a_100015324214_100015665980 [0,1,0,0,0,1|2,0,0]=4 16050 B16R1.1343 O=C(NCc1ccccc1)NC[C@@H](F)CO 273464a_100015665980_100015324214 [0,1,0,0,0,1|2,0,0]=4 16051 B16R1.1343 O=C(NCc1ccccc1)NC[C@@H](F)CO 512a_100015324214_100015665980 [0,1,0,0,0,1|2,0,0]=4 16052 B16R1.1343 O=C(NCc1ccccc1)NC[C@@H](F)CO 512a_100015665980_100015324214 [0,1,0,0,0,1|2,0,0]=4 16053 B16R1.1343 O=C(NCc1ccccc1)NC[C@H](O)CO 2708a_100015324214_100020644852 [0,1,0,0,0,1|2,0,0]=4 16054 B16R1.1343 O=C(NCc1ccccc1)NC[C@H](O)CO 273464a_100015324214_100020644852 [0,1,0,0,0,1|2,0,0]=4 16055 B16R1.1343 O=C(NCc1ccccc1)NC[C@H](O)CO 273464a_100020644852_100015324214 [0,1,0,0,0,1|2,0,0]=4 16056 B16R1.1516 CCC/C=C(\C)/C(=O)CCc1ccccc1 1458a_200020648666_100000765856 [0,1,0,0,0,1|1,0,1]=4 16057 B16R1.1516 CCC/C=C(\C)/C(=O)NCc1ccccc1 11a_100015324214_200020648666 [0,1,0,0,0,1|1,0,1]=4 16058 B16R1.1516 CCC/C=C(\C)/C(=O)NCc1ccccc1 1626a_100015324214_200020648666 [0,1,0,0,0,1|1,0,1]=4 16059 B16R1.1516 CCC/C=C(\C)/C(=O)NCc1ccccc1 240690a_100015324214_200020648666 [0,1,0,0,0,1|1,0,1]=4 16060 B16R1.1516 CCCCC(C)C(=O)C#Cc1ccccc1 1458a_100000736102_200011215066 [0,1,0,0,0,1|1,0,1]=4 16061 B16R1.1516 CCCCC(C)C(=O)C=Cc1ccccc1 1458a_100000210462_200011215066 [0,1,0,0,0,1|1,0,1]=4 16062 B16R1.1516 CCCCC(C)C(=O)CCc1ccccc1 1458a_100000185753_200011215066 [0,1,0,0,0,1|1,0,0]=3 16063 B16R1.1516 CCCCC(C)C(=O)CCc1ccccc1 1458a_100000725509_100000765856 [0,1,0,0,0,1|1,0,0]=3 16064 B16R1.1516 CCCCC(C)C(=O)CCc1ccccn1 1458a_100000725509_100015183660 [0,1,0,0,0,1|2,0,0]=4 16065 B16R1.1516 CCCCC(C)C(=O)CCc1ccccn1 1458a_100015195070_200011215066 [0,1,0,0,0,1|2,0,0]=4 16066 B16R1.1516 CCCCC(C)C(=O)CCc1cccnc1 1458a_100000198484_200011215066 [0,1,0,0,0,1|2,0,0]=4 16067 B16R1.1516 CCCCC(C)C(=O)CCc1cccnc1 1458a_100000725509_200011713674 [0,1,0,0,0,1|2,0,0]=4 16068 B16R1.1516 CCCCC(C)C(=O)CCc1ccncc1 1458a_100000725509_100000723409 [0,1,0,0,0,1|2,0,0]=4 16069 B16R1.1516 CCCCC(C)C(=O)CCc1ccncc1 1458a_100011225043_200011215066 [0,1,0,0,0,1|2,0,0]=4 16070 B16R1.1516 CCCCC(C)C(=O)COc1ccccc1 1458a_100000186222_200011215066 [0,1,0,0,0,1|1,0,0]=3 16071 B16R1.1516 CCCCC(C)C(=O)COc1ccccn1 1458a_100102699861_200011215066 [0,1,0,0,0,1|2,0,0]=4 16072 B16R1.1516 CCCCC(C)C(=O)COc1cccnc1 1458a_100015207166_200011215066 [0,1,0,0,0,1|2,0,0]=4 16073 B16R1.1516 CCCCC(C)C(=O)CSc1ccccc1 1458a_100000211596_200011215066 [0,1,0,0,0,1|1,0,0]=3 16074 B16R1.1516 CCCCC(C)C(=O)CSc1ccccn1 1458a_100000156281_200011215066 [0,1,0,0,0,1|2,0,0]=4 16075 B16R1.1516 CCCCC(C)C(=O)CSc1ccncc1 1458a_100000211328_200011215066 [0,1,0,0,0,1|2,0,0]=4 16076 B16R1.1516 CCCCC(C)C(=O)NCc1ccccc1 11a_100015324214_100000725509 [0,1,0,0,0,1|1,0,0]=3 16077 B16R1.1516 CCCCC(C)C(=O)NCc1ccccc1 1626a_100015324214_100000725509 [0,1,0,0,0,1|1,0,0]=3 16078 B16R1.1516 CCCCC(C)C(=O)NCc1ccccc1 240690a_100015324214_100000725509 [0,1,0,0,0,1|1,0,0]=3 16079 B16R1.1516 CCCCC(C)C(=O)NCc1ccccc1 527a_100015324214_100000725509 [0,1,0,0,0,1|1,0,0]=3 16080 B16R1.1516 CCCCC(C)C(=O)NCc1ccccn1 11a_100000210449_100000725509 [0,1,0,0,0,1|2,0,0]=4 16081 B16R1.1516 CCCCC(C)C(=O)NCc1ccccn1 1626a_100000210449_100000725509 [0,1,0,0,0,1|2,0,0]=4 16082 B16R1.1516 CCCCC(C)C(=O)NCc1ccccn1 240690a_100000210449_100000725509 [0,1,0,0,0,1|2,0,0]=4 16083 B16R1.1516 CCCCC(C)C(=O)NCc1ccccn1 527a_100000210449_100000725509 [0,1,0,0,0,1|2,0,0]=4 16084 B16R1.1516 CCCCC(C)C(=O)NCc1cccnc1 11a_100000210453_100000725509 [0,1,0,0,0,1|2,0,0]=4 16085 B16R1.1516 CCCCC(C)C(=O)NCc1cccnc1 240690a_100000210453_100000725509 [0,1,0,0,0,1|2,0,0]=4 16086 B16R1.1516 CCCCC(C)C(=O)NCc1cccnc1 527a_100000210453_100000725509 [0,1,0,0,0,1|2,0,0]=4 16087 B16R1.1516 CCCCC(C)C(=O)NCc1ccncc1 11a_100000210450_100000725509 [0,1,0,0,0,1|2,0,0]=4 16088 B16R1.1516 CCCCC(C)C(=O)NCc1ccncc1 1626a_100000210450_100000725509 [0,1,0,0,0,1|2,0,0]=4 16089 B16R1.1516 CCCCC(C)C(=O)NCc1ccncc1 240690a_100000210450_100000725509 [0,1,0,0,0,1|2,0,0]=4 16090 B16R1.1516 CCCCC(C)C(=O)NCc1ccncc1 527a_100000210450_100000725509 [0,1,0,0,0,1|2,0,0]=4 16091 B16R1.1516 CCCCC(C)C(=O)NNc1ccccc1 22a_100015195140_100000725509 [0,1,0,0,0,1|2,0,0]=4 16092 B16R1.1516 CCCCC(O)C(=O)CCc1ccccc1 1458a_100000720857_100000765856 [0,1,0,0,0,1|1,0,0]=3 16093 B16R1.1516 CCCCC(O)C(=O)CCc1ccccn1 1458a_100000720857_100015183660 [0,1,0,0,0,1|2,0,0]=4 16094 B16R1.1516 CCCCC(O)C(=O)CCc1cccnc1 1458a_100000720857_200011713674 [0,1,0,0,0,1|2,0,0]=4 16095 B16R1.1516 CCCCC(O)C(=O)CCc1ccncc1 1458a_100000720857_100000723409 [0,1,0,0,0,1|2,0,0]=4 16096 B16R1.1516 CCCCC(O)C(=O)NCc1ccccc1 240690a_100015324214_100000720857 [0,1,0,0,0,1|1,0,0]=3 16097 B16R1.1516 CCCCC(O)C(=O)NCc1ccccc1 527a_100015324214_100000720857 [0,1,0,0,0,1|1,0,0]=3 16098 B16R1.1516 CCCCC(O)C(=O)NCc1ccccn1 240690a_100000210449_100000720857 [0,1,0,0,0,1|2,0,0]=4 16099 B16R1.1516 CCCCC(O)C(=O)NCc1ccccn1 527a_100000210449_100000720857 [0,1,0,0,0,1|2,0,0]=4 16100 B16R1.1516 CCCCC(O)C(=O)NCc1cccnc1 240690a_100000210453_100000720857 [0,1,0,0,0,1|2,0,0]=4 16101 B16R1.1516 CCCCC(O)C(=O)NCc1cccnc1 527a_100000210453_100000720857 [0,1,0,0,0,1|2,0,0]=4 16102 B16R1.1516 CCCCC(O)C(=O)NCc1ccncc1 240690a_100000210450_100000720857 [0,1,0,0,0,1|2,0,0]=4 16103 B16R1.1516 CCCCC(O)C(=O)NCc1ccncc1 527a_100000210450_100000720857 [0,1,0,0,0,1|2,0,0]=4 16104 B16R1.1516 CCCCC(O)C(=O)NNc1ccccc1 22a_100015195140_100000720857 [0,1,0,0,0,1|2,0,0]=4 16105 B16R1.1516 CCCCN(C)C(=O)C#Cc1ccccc1 240690a_100000207549_100000736102 [0,1,0,0,0,1|1,0,1]=4 16106 B16R1.1516 CCCCN(C)C(=O)C=Cc1ccccc1 11a_100000207549_100000210462 [0,1,0,0,0,1|1,0,1]=4 16107 B16R1.1516 CCCCN(C)C(=O)C=Cc1ccccc1 1626a_100000207549_100000210462 [0,1,0,0,0,1|1,0,1]=4 16108 B16R1.1516 CCCCN(C)C(=O)CCc1ccccc1 11a_100000207549_100000185753 [0,1,0,0,0,1|1,0,0]=3 16109 B16R1.1516 CCCCN(C)C(=O)CCc1ccccc1 1626a_100000207549_100000185753 [0,1,0,0,0,1|1,0,0]=3 16110 B16R1.1516 CCCCN(C)C(=O)CCc1ccccc1 240690a_100000207549_100000185753 [0,1,0,0,0,1|1,0,0]=3 16111 B16R1.1516 CCCCN(C)C(=O)CCc1ccccc1 527a_100000207549_100000185753 [0,1,0,0,0,1|1,0,0]=3 16112 B16R1.1516 CCCCN(C)C(=O)CCc1ccccn1 11a_100000207549_100015195070 [0,1,0,0,0,1|2,0,0]=4 16113 B16R1.1516 CCCCN(C)C(=O)CCc1ccccn1 240690a_100000207549_100015195070 [0,1,0,0,0,1|2,0,0]=4 16114 B16R1.1516 CCCCN(C)C(=O)CCc1ccccn1 527a_100000207549_100015195070 [0,1,0,0,0,1|2,0,0]=4 16115 B16R1.1516 CCCCN(C)C(=O)CCc1cccnc1 11a_100000207549_100000198484 [0,1,0,0,0,1|2,0,0]=4 16116 B16R1.1516 CCCCN(C)C(=O)CCc1cccnc1 1626a_100000207549_100000198484 [0,1,0,0,0,1|2,0,0]=4 16117 B16R1.1516 CCCCN(C)C(=O)CCc1cccnc1 240690a_100000207549_100000198484 [0,1,0,0,0,1|2,0,0]=4 16118 B16R1.1516 CCCCN(C)C(=O)CCc1cccnc1 527a_100000207549_100000198484 [0,1,0,0,0,1|2,0,0]=4 16119 B16R1.1516 CCCCN(C)C(=O)CCc1ccncc1 11a_100000207549_100011225043 [0,1,0,0,0,1|2,0,0]=4 16120 B16R1.1516 CCCCN(C)C(=O)CCc1ccncc1 240690a_100000207549_100011225043 [0,1,0,0,0,1|2,0,0]=4 16121 B16R1.1516 CCCCN(C)C(=O)CCc1ccncc1 527a_100000207549_100011225043 [0,1,0,0,0,1|2,0,0]=4 16122 B16R1.1516 CCCCN(C)C(=O)CNc1ccccc1 34a_100000106764_100000230175 [0,1,0,0,0,1|1,0,0]=3 16123 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 11a_100000207549_100000186222 [0,1,0,0,0,1|1,0,0]=3 16124 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 1626a_100000207549_100000186222 [0,1,0,0,0,1|1,0,0]=3 16125 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 240690a_100000207549_100000186222 [0,1,0,0,0,1|1,0,0]=3 16126 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 34a_100000210340_100000230175 [0,1,0,0,0,1|1,0,0]=3 16127 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 527a_100000207549_100000186222 [0,1,0,0,0,1|1,0,0]=3 16128 B16R1.1516 CCCCN(C)C(=O)COc1ccccc1 7a_100000210340_100000230175 [0,1,0,0,0,1|1,0,0]=3 16129 B16R1.1516 CCCCN(C)C(=O)COc1ccccn1 1626a_100000207549_100102699861 [0,1,0,0,0,1|2,0,0]=4 16130 B16R1.1516 CCCCN(C)C(=O)COc1ccccn1 240690a_100000207549_100102699861 [0,1,0,0,0,1|2,0,0]=4 16131 B16R1.1516 CCCCN(C)C(=O)COc1ccccn1 527a_100000207549_100102699861 [0,1,0,0,0,1|2,0,0]=4 16132 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 11a_100000207549_100015207166 [0,1,0,0,0,1|2,0,0]=4 16133 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 1626a_100000207549_100015207166 [0,1,0,0,0,1|2,0,0]=4 16134 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 240690a_100000207549_100015207166 [0,1,0,0,0,1|2,0,0]=4 16135 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 34a_100000210849_100000230175 [0,1,0,0,0,1|2,0,0]=4 16136 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 527a_100000207549_100015207166 [0,1,0,0,0,1|2,0,0]=4 16137 B16R1.1516 CCCCN(C)C(=O)COc1cccnc1 7a_100000210849_100000230175 [0,1,0,0,0,1|2,0,0]=4 16138 B16R1.1516 CCCCN(C)C(=O)COc1ccncc1 34a_100000212176_100000230175 [0,1,0,0,0,1|2,0,0]=4 16139 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 11a_100000207549_100000211596 [0,1,0,0,0,1|1,0,0]=3 16140 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 1626a_100000207549_100000211596 [0,1,0,0,0,1|1,0,0]=3 16141 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 240690a_100000207549_100000211596 [0,1,0,0,0,1|1,0,0]=3 16142 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 527a_100000207549_100000211596 [0,1,0,0,0,1|1,0,0]=3 16143 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 62a_100000230175_100000041952 [0,1,0,0,0,1|1,0,0]=3 16144 B16R1.1516 CCCCN(C)C(=O)CSc1ccccc1 62a_100000719477_100000230175 [0,1,0,0,0,1|1,0,0]=3 16145 B16R1.1516 CCCCN(C)C(=O)CSc1ccccn1 11a_100000207549_100000156281 [0,1,0,0,0,1|2,0,0]=4 16146 B16R1.1516 CCCCN(C)C(=O)CSc1ccccn1 240690a_100000207549_100000156281 [0,1,0,0,0,1|2,0,0]=4 16147 B16R1.1516 CCCCN(C)C(=O)CSc1ccccn1 527a_100000207549_100000156281 [0,1,0,0,0,1|2,0,0]=4 16148 B16R1.1516 CCCCN(C)C(=O)CSc1ccccn1 62a_100000230175_100011216584 [0,1,0,0,0,1|2,0,0]=4 16149 B16R1.1516 CCCCN(C)C(=O)CSc1ccccn1 62a_100011216584_100000230175 [0,1,0,0,0,1|2,0,0]=4 16150 B16R1.1516 CCCCN(C)C(=O)CSc1cccnc1 62a_100000210063_100000230175 [0,1,0,0,0,1|2,0,0]=4 16151 B16R1.1516 CCCCN(C)C(=O)CSc1cccnc1 62a_100000230175_100000210063 [0,1,0,0,0,1|2,0,0]=4 16152 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 11a_100000207549_100000211328 [0,1,0,0,0,1|2,0,0]=4 16153 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 1626a_100000207549_100000211328 [0,1,0,0,0,1|2,0,0]=4 16154 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 240690a_100000207549_100000211328 [0,1,0,0,0,1|2,0,0]=4 16155 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 527a_100000207549_100000211328 [0,1,0,0,0,1|2,0,0]=4 16156 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 62a_100000230175_100000728582 [0,1,0,0,0,1|2,0,0]=4 16157 B16R1.1516 CCCCN(C)C(=O)CSc1ccncc1 62a_100000728582_100000230175 [0,1,0,0,0,1|2,0,0]=4 16158 B16R1.1516 CCCCN(C)C(=O)NCc1ccccc1 2708a_100015324214_100000207549 [0,1,0,0,0,1|1,0,0]=3 16159 B16R1.1516 CCCCN(C)C(=O)NCc1ccccc1 273464a_100015324214_100000207549 [0,1,0,0,0,1|1,0,0]=3 16160 B16R1.1516 CCCCN(C)C(=O)NCc1ccccn1 2708a_100000210449_100000207549 [0,1,0,0,0,1|2,0,0]=4 16161 B16R1.1516 CCCCN(C)C(=O)NCc1ccccn1 273464a_100000210449_100000207549 [0,1,0,0,0,1|2,0,0]=4 16162 B16R1.1516 CCCCN(C)C(=O)NCc1cccnc1 2708a_100000210453_100000207549 [0,1,0,0,0,1|2,0,0]=4 16163 B16R1.1516 CCCCN(C)C(=O)NCc1cccnc1 273464a_100000210453_100000207549 [0,1,0,0,0,1|2,0,0]=4 16164 B16R1.1516 CCCCN(C)C(=O)NCc1ccncc1 2708a_100000210450_100000207549 [0,1,0,0,0,1|2,0,0]=4 16165 B16R1.1516 CCCCN(C)C(=O)NCc1ccncc1 273464a_100000210450_100000207549 [0,1,0,0,0,1|2,0,0]=4 16166 B16R1.1516 CCCNC(=O)C(=O)CCc1ccccc1 1458a_200011297150_100000765856 [0,1,0,0,0,1|2,0,0]=4 16167 B16R1.1516 CCCNC(=O)C(=O)NCc1ccccc1 1626a_100015324214_200011297150 [0,1,0,0,0,1|2,0,0]=4 16168 B16R1.1516 CCCNC(=O)C(=O)NCc1ccccc1 240690a_100015324214_200011297150 [0,1,0,0,0,1|2,0,0]=4 16169 B16R1.1516 CCCNC(=O)C(=O)NCc1ccccc1 527a_100015324214_200011297150 [0,1,0,0,0,1|2,0,0]=4 16170 B16R1.1516 CCCNC(C)C(=O)NCc1ccccc1 2230a_100000744559_100000210303 [0,1,0,0,0,1|2,0,0]=4 16171 B16R1.1516 CCCNC(C)C(=O)NCc1ccccc1 34a_100000744559_100000210303 [0,1,0,0,0,1|2,0,0]=4 16172 B16R1.1516 CCCOC(C)C(=O)NCc1ccccc1 34a_100000210258_200011934207 [0,1,0,0,0,1|2,0,0]=4 16173 B16R1.1516 CCCOC(F)C(=O)OCc1ccccc1 34a_100000210258_100000036447 [0,1,0,0,0,1|2,0,0]=4 16174 B16R1.1516 CCCO[C@@H](C)C(=O)OCc1ccccc1 7a_100016105899_100000210303 [0,1,0,0,0,1|2,0,0]=4 16175 B16R1.1516 CCCSC(C)C(=O)NCc1ccccc1 62a_100000183842_100000210303 [0,1,0,0,0,1|2,0,0]=4 16176 B16R1.1516 CCCSC(C)C(=O)NCc1ccccc1 62a_100000210303_100000183842 [0,1,0,0,0,1|2,0,0]=4 16177 B16R1.1516 CCCSC(F)C(=O)OCc1ccccc1 62a_100000036447_100000210303 [0,1,0,0,0,1|2,0,0]=4 16178 B16R1.1516 CCCSC(F)C(=O)OCc1ccccc1 62a_100000210303_100000036447 [0,1,0,0,0,1|2,0,0]=4 16179 B16R1.1516 CN(CCCO)C(=O)CCc1ccccc1 240690a_100000213112_100000185753 [0,1,0,0,0,1|2,0,0]=4 16180 B16R1.1516 CN(CCCO)C(=O)CCc1ccccc1 527a_100000213112_100000185753 [0,1,0,0,0,1|2,0,0]=4 16181 B16R1.1516 CN(CCCO)C(=O)COc1ccccc1 240690a_100000213112_100000186222 [0,1,0,0,0,1|2,0,0]=4 16182 B16R1.1516 CN(CCCO)C(=O)COc1ccccc1 527a_100000213112_100000186222 [0,1,0,0,0,1|2,0,0]=4 16183 B16R1.1516 CN(CCCO)C(=O)CSc1ccccc1 240690a_100000213112_100000211596 [0,1,0,0,0,1|2,0,0]=4 16184 B16R1.1516 CN(CCCO)C(=O)CSc1ccccc1 527a_100000213112_100000211596 [0,1,0,0,0,1|2,0,0]=4 16185 B16R1.1516 CN(CCCO)C(=O)NCc1ccccc1 2708a_100015324214_100000213112 [0,1,0,0,0,1|2,0,0]=4 16186 B16R1.1516 CN(CCCO)C(=O)NCc1ccccc1 273464a_100015324214_100000213112 [0,1,0,0,0,1|2,0,0]=4 16187 B16R1.1516 CN(CCO[13CH3])C(=O)OCc1ccccc1 7a_100011204018_200025704644 [0,1,0,0,0,1|2,0,0]=4 16188 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 11a_100000743101_100000185753 [0,1,0,0,0,1|2,0,0]=4 16189 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 1626a_100000743101_100000185753 [0,1,0,0,0,1|2,0,0]=4 16190 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 240690a_100000743101_100000185753 [0,1,0,0,0,1|2,0,0]=4 16191 B16R1.1516 COCCN(C)C(=O)CCc1ccccc1 527a_100000743101_100000185753 [0,1,0,0,0,1|2,0,0]=4 16192 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 11a_100000743101_100000186222 [0,1,0,0,0,1|2,0,0]=4 16193 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 1626a_100000743101_100000186222 [0,1,0,0,0,1|2,0,0]=4 16194 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 240690a_100000743101_100000186222 [0,1,0,0,0,1|2,0,0]=4 16195 B16R1.1516 COCCN(C)C(=O)COc1ccccc1 527a_100000743101_100000186222 [0,1,0,0,0,1|2,0,0]=4 16196 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 11a_100000743101_100000211596 [0,1,0,0,0,1|2,0,0]=4 16197 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 1626a_100000743101_100000211596 [0,1,0,0,0,1|2,0,0]=4 16198 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 240690a_100000743101_100000211596 [0,1,0,0,0,1|2,0,0]=4 16199 B16R1.1516 COCCN(C)C(=O)CSc1ccccc1 527a_100000743101_100000211596 [0,1,0,0,0,1|2,0,0]=4 16200 B16R1.1516 COCCN(C)C(=O)NCc1ccccc1 2708a_100015324214_100000743101 [0,1,0,0,0,1|2,0,0]=4 16201 B16R1.1516 COCCN(C)C(=O)NCc1ccccc1 273464a_100015324214_100000743101 [0,1,0,0,0,1|2,0,0]=4 16202 B16R1.1516 COCCN(C)C(=O)OCc1ccccc1 7a_100011204018_200000210301 [0,1,0,0,0,1|2,0,0]=4 16203 B16R1.1516 CSCCC(O)C(=O)CCc1ccccc1 1458a_100000685904_100000765856 [0,1,0,0,0,1|2,0,0]=4 16204 B16R1.1516 CSCCC(O)C(=O)NCc1ccccc1 240690a_100015324214_100000685904 [0,1,0,0,0,1|2,0,0]=4 16205 B16R1.1516 CSCCN(C)C(=O)CCc1ccccc1 11a_100000686725_100000185753 [0,1,0,0,0,1|2,0,0]=4 16206 B16R1.1516 CSCCN(C)C(=O)CCc1ccccc1 1626a_100000686725_100000185753 [0,1,0,0,0,1|2,0,0]=4 16207 B16R1.1516 CSCCN(C)C(=O)CCc1ccccc1 240690a_100000686725_100000185753 [0,1,0,0,0,1|2,0,0]=4 16208 B16R1.1516 CSCCN(C)C(=O)CCc1ccccc1 527a_100000686725_100000185753 [0,1,0,0,0,1|2,0,0]=4 16209 B16R1.1516 CSCCN(C)C(=O)COc1ccccc1 11a_100000686725_100000186222 [0,1,0,0,0,1|2,0,0]=4 16210 B16R1.1516 CSCCN(C)C(=O)COc1ccccc1 1626a_100000686725_100000186222 [0,1,0,0,0,1|2,0,0]=4 16211 B16R1.1516 CSCCN(C)C(=O)COc1ccccc1 240690a_100000686725_100000186222 [0,1,0,0,0,1|2,0,0]=4 16212 B16R1.1516 CSCCN(C)C(=O)COc1ccccc1 527a_100000686725_100000186222 [0,1,0,0,0,1|2,0,0]=4 16213 B16R1.1516 CSCCN(C)C(=O)CSc1ccccc1 11a_100000686725_100000211596 [0,1,0,0,0,1|2,0,0]=4 16214 B16R1.1516 CSCCN(C)C(=O)CSc1ccccc1 1626a_100000686725_100000211596 [0,1,0,0,0,1|2,0,0]=4 16215 B16R1.1516 CSCCN(C)C(=O)CSc1ccccc1 240690a_100000686725_100000211596 [0,1,0,0,0,1|2,0,0]=4 16216 B16R1.1516 CSCCN(C)C(=O)CSc1ccccc1 527a_100000686725_100000211596 [0,1,0,0,0,1|2,0,0]=4 16217 B16R1.1516 CSCCN(C)C(=O)NCc1ccccc1 2708a_100015324214_100000686725 [0,1,0,0,0,1|2,0,0]=4 16218 B16R1.1516 CSCCN(C)C(=O)NCc1ccccc1 273464a_100015324214_100000686725 [0,1,0,0,0,1|2,0,0]=4 16219 B16R1.1570 C=C(CCC)CC(=O)CCc1ccccc1 1458a_100000138376_100000765856 [0,1,0,0,0,1|1,0,1]=4 16220 B16R1.1570 C=C(CCC)CC(=O)NCc1ccccc1 11a_100015324214_100000138376 [0,1,0,0,0,1|1,0,1]=4 16221 B16R1.1570 C=C(CCC)CC(=O)NCc1ccccc1 240690a_100015324214_100000138376 [0,1,0,0,0,1|1,0,1]=4 16222 B16R1.1570 C=C(CCC)CC(=O)NCc1ccccc1 527a_100015324214_100000138376 [0,1,0,0,0,1|1,0,1]=4 16223 B16R1.1570 CC(OC(=O)OCc1ccccc1)SCF 62a_100015361967_200015597219 [0,1,0,0,0,1|2,0,0]=4 16224 B16R1.1570 CC(OC(=O)OCc1ccccc1)SCF 62a_200015597219_100015361967 [0,1,0,0,0,1|2,0,0]=4 16225 B16R1.1570 CCCC(=CC(=O)CCc1ccccc1)C 1458a_100020676950_100000765856 [0,1,0,0,0,1|1,0,1]=4 16226 B16R1.1570 CCCC(=CC(=O)NCc1ccccc1)C 11a_100015324214_100020676950 [0,1,0,0,0,1|1,0,1]=4 16227 B16R1.1570 CCCC(=CC(=O)NCc1ccccc1)C 1626a_100015324214_100020676950 [0,1,0,0,0,1|1,0,1]=4 16228 B16R1.1570 CCCC(=CC(=O)NCc1ccccc1)C 240690a_100015324214_100020676950 [0,1,0,0,0,1|1,0,1]=4 16229 B16R1.1570 CCCC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000747444 [0,1,0,0,0,1|1,0,1]=4 16230 B16R1.1570 CCCC(=O)CC(=O)CCc1ccccc1 1458a_100000211992_100012361361 [0,1,0,0,0,1|1,0,1]=4 16231 B16R1.1570 CCCC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000747444 [0,1,0,0,0,1|1,0,1]=4 16232 B16R1.1570 CCCC(=O)CC(=O)CSc1ccccc1 1458a_100000211596_100000747444 [0,1,0,0,0,1|1,0,1]=4 16233 B16R1.1570 CCCC(=O)CC(=O)NCc1ccccc1 1458a_100000211992_100000183539 [0,1,0,0,0,1|1,0,1]=4 16234 B16R1.1570 CCCC(=O)CC(=O)OCc1ccccc1 1458a_100000037839_100000210303 [0,1,0,0,0,1|1,0,1]=4 16235 B16R1.1570 CCCC(=O)CC(=O)OCc1ccccc1 1458a_100000211992_100000753625 [0,1,0,0,0,1|1,0,1]=4 16236 B16R1.1570 CCCC(C)CC(=O)C#Cc1ccccc1 1458a_100000736102_100011216630 [0,1,0,0,0,1|1,0,1]=4 16237 B16R1.1570 CCCC(C)CC(=O)C=Cc1ccccc1 1458a_100000210462_100011216630 [0,1,0,0,0,1|1,0,1]=4 16238 B16R1.1570 CCCC(C)CC(=O)CCc1ccccc1 1458a_100000185753_100011216630 [0,1,0,0,0,1|1,0,0]=3 16239 B16R1.1570 CCCC(C)CC(=O)CCc1ccccc1 1458a_100000748435_100000765856 [0,1,0,0,0,1|1,0,0]=3 16240 B16R1.1570 CCCC(C)CC(=O)CCc1ccccn1 1458a_100000748435_100015183660 [0,1,0,0,0,1|2,0,0]=4 16241 B16R1.1570 CCCC(C)CC(=O)CCc1ccccn1 1458a_100015195070_100011216630 [0,1,0,0,0,1|2,0,0]=4 16242 B16R1.1570 CCCC(C)CC(=O)CCc1cccnc1 1458a_100000198484_100011216630 [0,1,0,0,0,1|2,0,0]=4 16243 B16R1.1570 CCCC(C)CC(=O)CCc1cccnc1 1458a_100000748435_200011713674 [0,1,0,0,0,1|2,0,0]=4 16244 B16R1.1570 CCCC(C)CC(=O)CCc1ccncc1 1458a_100000748435_100000723409 [0,1,0,0,0,1|2,0,0]=4 16245 B16R1.1570 CCCC(C)CC(=O)CCc1ccncc1 1458a_100011225043_100011216630 [0,1,0,0,0,1|2,0,0]=4 16246 B16R1.1570 CCCC(C)CC(=O)COc1ccccc1 1458a_100000186222_100011216630 [0,1,0,0,0,1|1,0,0]=3 16247 B16R1.1570 CCCC(C)CC(=O)COc1ccccn1 1458a_100102699861_100011216630 [0,1,0,0,0,1|2,0,0]=4 16248 B16R1.1570 CCCC(C)CC(=O)COc1cccnc1 1458a_100015207166_100011216630 [0,1,0,0,0,1|2,0,0]=4 16249 B16R1.1570 CCCC(C)CC(=O)CSc1ccccc1 1458a_100000211596_100011216630 [0,1,0,0,0,1|1,0,0]=3 16250 B16R1.1570 CCCC(C)CC(=O)CSc1ccccn1 1458a_100000156281_100011216630 [0,1,0,0,0,1|2,0,0]=4 16251 B16R1.1570 CCCC(C)CC(=O)CSc1ccncc1 1458a_100000211328_100011216630 [0,1,0,0,0,1|2,0,0]=4 16252 B16R1.1570 CCCC(C)CC(=O)NCc1ccccc1 11a_100015324214_100000748435 [0,1,0,0,0,1|1,0,0]=3 16253 B16R1.1570 CCCC(C)CC(=O)NCc1ccccc1 1626a_100015324214_100000748435 [0,1,0,0,0,1|1,0,0]=3 16254 B16R1.1570 CCCC(C)CC(=O)NCc1ccccc1 240690a_100015324214_100000748435 [0,1,0,0,0,1|1,0,0]=3 16255 B16R1.1570 CCCC(C)CC(=O)NCc1ccccc1 527a_100015324214_100000748435 [0,1,0,0,0,1|1,0,0]=3 16256 B16R1.1570 CCCC(C)CC(=O)NCc1ccccn1 11a_100000210449_100000748435 [0,1,0,0,0,1|2,0,0]=4 16257 B16R1.1570 CCCC(C)CC(=O)NCc1ccccn1 1626a_100000210449_100000748435 [0,1,0,0,0,1|2,0,0]=4 16258 B16R1.1570 CCCC(C)CC(=O)NCc1ccccn1 240690a_100000210449_100000748435 [0,1,0,0,0,1|2,0,0]=4 16259 B16R1.1570 CCCC(C)CC(=O)NCc1ccccn1 527a_100000210449_100000748435 [0,1,0,0,0,1|2,0,0]=4 16260 B16R1.1570 CCCC(C)CC(=O)NCc1cccnc1 11a_100000210453_100000748435 [0,1,0,0,0,1|2,0,0]=4 16261 B16R1.1570 CCCC(C)CC(=O)NCc1cccnc1 240690a_100000210453_100000748435 [0,1,0,0,0,1|2,0,0]=4 16262 B16R1.1570 CCCC(C)CC(=O)NCc1cccnc1 527a_100000210453_100000748435 [0,1,0,0,0,1|2,0,0]=4 16263 B16R1.1570 CCCC(C)CC(=O)NCc1ccncc1 11a_100000210450_100000748435 [0,1,0,0,0,1|2,0,0]=4 16264 B16R1.1570 CCCC(C)CC(=O)NCc1ccncc1 1626a_100000210450_100000748435 [0,1,0,0,0,1|2,0,0]=4 16265 B16R1.1570 CCCC(C)CC(=O)NCc1ccncc1 240690a_100000210450_100000748435 [0,1,0,0,0,1|2,0,0]=4 16266 B16R1.1570 CCCC(C)CC(=O)NCc1ccncc1 527a_100000210450_100000748435 [0,1,0,0,0,1|2,0,0]=4 16267 B16R1.1570 CCCC(C)CC(=O)NNc1ccccc1 22a_100015195140_100000748435 [0,1,0,0,0,1|2,0,0]=4 16268 B16R1.1570 CCCC(C)NC(=O)C#Cc1ccccc1 240690a_100000741246_100000736102 [0,1,0,0,0,1|1,0,1]=4 16269 B16R1.1570 CCCC(C)NC(=O)C=Cc1ccccc1 11a_100000741246_100000210462 [0,1,0,0,0,1|1,0,1]=4 16270 B16R1.1570 CCCC(C)NC(=O)C=Cc1ccccc1 1626a_100000741246_100000210462 [0,1,0,0,0,1|1,0,1]=4 16271 B16R1.1570 CCCC(C)NC(=O)CCc1ccccc1 11a_100000741246_100000185753 [0,1,0,0,0,1|1,0,0]=3 16272 B16R1.1570 CCCC(C)NC(=O)CCc1ccccc1 1626a_100000741246_100000185753 [0,1,0,0,0,1|1,0,0]=3 16273 B16R1.1570 CCCC(C)NC(=O)CCc1ccccc1 240690a_100000741246_100000185753 [0,1,0,0,0,1|1,0,0]=3 16274 B16R1.1570 CCCC(C)NC(=O)CCc1ccccc1 527a_100000741246_100000185753 [0,1,0,0,0,1|1,0,0]=3 16275 B16R1.1570 CCCC(C)NC(=O)CCc1ccccn1 11a_100000741246_100015195070 [0,1,0,0,0,1|2,0,0]=4 16276 B16R1.1570 CCCC(C)NC(=O)CCc1ccccn1 240690a_100000741246_100015195070 [0,1,0,0,0,1|2,0,0]=4 16277 B16R1.1570 CCCC(C)NC(=O)CCc1ccccn1 527a_100000741246_100015195070 [0,1,0,0,0,1|2,0,0]=4 16278 B16R1.1570 CCCC(C)NC(=O)CCc1cccnc1 11a_100000741246_100000198484 [0,1,0,0,0,1|2,0,0]=4 16279 B16R1.1570 CCCC(C)NC(=O)CCc1cccnc1 1626a_100000741246_100000198484 [0,1,0,0,0,1|2,0,0]=4 16280 B16R1.1570 CCCC(C)NC(=O)CCc1cccnc1 240690a_100000741246_100000198484 [0,1,0,0,0,1|2,0,0]=4 16281 B16R1.1570 CCCC(C)NC(=O)CCc1cccnc1 527a_100000741246_100000198484 [0,1,0,0,0,1|2,0,0]=4 16282 B16R1.1570 CCCC(C)NC(=O)CCc1ccncc1 11a_100000741246_100011225043 [0,1,0,0,0,1|2,0,0]=4 16283 B16R1.1570 CCCC(C)NC(=O)CCc1ccncc1 240690a_100000741246_100011225043 [0,1,0,0,0,1|2,0,0]=4 16284 B16R1.1570 CCCC(C)NC(=O)CCc1ccncc1 527a_100000741246_100011225043 [0,1,0,0,0,1|2,0,0]=4 16285 B16R1.1570 CCCC(C)NC(=O)COc1ccccc1 11a_100000741246_100000186222 [0,1,0,0,0,1|1,0,0]=3 16286 B16R1.1570 CCCC(C)NC(=O)COc1ccccc1 1626a_100000741246_100000186222 [0,1,0,0,0,1|1,0,0]=3 16287 B16R1.1570 CCCC(C)NC(=O)COc1ccccc1 240690a_100000741246_100000186222 [0,1,0,0,0,1|1,0,0]=3 16288 B16R1.1570 CCCC(C)NC(=O)COc1ccccc1 527a_100000741246_100000186222 [0,1,0,0,0,1|1,0,0]=3 16289 B16R1.1570 CCCC(C)NC(=O)COc1ccccn1 1626a_100000741246_100102699861 [0,1,0,0,0,1|2,0,0]=4 16290 B16R1.1570 CCCC(C)NC(=O)COc1ccccn1 240690a_100000741246_100102699861 [0,1,0,0,0,1|2,0,0]=4 16291 B16R1.1570 CCCC(C)NC(=O)COc1ccccn1 527a_100000741246_100102699861 [0,1,0,0,0,1|2,0,0]=4 16292 B16R1.1570 CCCC(C)NC(=O)COc1cccnc1 11a_100000741246_100015207166 [0,1,0,0,0,1|2,0,0]=4 16293 B16R1.1570 CCCC(C)NC(=O)COc1cccnc1 1626a_100000741246_100015207166 [0,1,0,0,0,1|2,0,0]=4 16294 B16R1.1570 CCCC(C)NC(=O)COc1cccnc1 240690a_100000741246_100015207166 [0,1,0,0,0,1|2,0,0]=4 16295 B16R1.1570 CCCC(C)NC(=O)COc1cccnc1 527a_100000741246_100015207166 [0,1,0,0,0,1|2,0,0]=4 16296 B16R1.1570 CCCC(C)NC(=O)CSc1ccccc1 11a_100000741246_100000211596 [0,1,0,0,0,1|1,0,0]=3 16297 B16R1.1570 CCCC(C)NC(=O)CSc1ccccc1 1626a_100000741246_100000211596 [0,1,0,0,0,1|1,0,0]=3 16298 B16R1.1570 CCCC(C)NC(=O)CSc1ccccc1 240690a_100000741246_100000211596 [0,1,0,0,0,1|1,0,0]=3 16299 B16R1.1570 CCCC(C)NC(=O)CSc1ccccc1 527a_100000741246_100000211596 [0,1,0,0,0,1|1,0,0]=3 16300 B16R1.1570 CCCC(C)NC(=O)CSc1ccccn1 11a_100000741246_100000156281 [0,1,0,0,0,1|2,0,0]=4 16301 B16R1.1570 CCCC(C)NC(=O)CSc1ccccn1 240690a_100000741246_100000156281 [0,1,0,0,0,1|2,0,0]=4 16302 B16R1.1570 CCCC(C)NC(=O)CSc1ccccn1 527a_100000741246_100000156281 [0,1,0,0,0,1|2,0,0]=4 16303 B16R1.1570 CCCC(C)NC(=O)CSc1ccncc1 11a_100000741246_100000211328 [0,1,0,0,0,1|2,0,0]=4 16304 B16R1.1570 CCCC(C)NC(=O)CSc1ccncc1 1626a_100000741246_100000211328 [0,1,0,0,0,1|2,0,0]=4 16305 B16R1.1570 CCCC(C)NC(=O)CSc1ccncc1 240690a_100000741246_100000211328 [0,1,0,0,0,1|2,0,0]=4 16306 B16R1.1570 CCCC(C)NC(=O)CSc1ccncc1 527a_100000741246_100000211328 [0,1,0,0,0,1|2,0,0]=4 16307 B16R1.1570 CCCC(C)NC(=O)NCc1ccccc1 2708a_100000741246_100015324214 [0,1,0,0,0,1|1,0,0]=3 16308 B16R1.1570 CCCC(C)NC(=O)NCc1ccccc1 2708a_100015324214_100000741246 [0,1,0,0,0,1|1,0,0]=3 16309 B16R1.1570 CCCC(C)NC(=O)NCc1ccccc1 273464a_100000741246_100015324214 [0,1,0,0,0,1|1,0,0]=3 16310 B16R1.1570 CCCC(C)NC(=O)NCc1ccccc1 512a_100000741246_100015324214 [0,1,0,0,0,1|1,0,0]=3 16311 B16R1.1570 CCCC(C)NC(=O)NCc1ccccc1 512a_100015324214_100000741246 [0,1,0,0,0,1|1,0,0]=3 16312 B16R1.1570 CCCC(C)NC(=O)NCc1ccccn1 2708a_100000210449_100000741246 [0,1,0,0,0,1|2,0,0]=4 16313 B16R1.1570 CCCC(C)NC(=O)NCc1ccccn1 2708a_100000741246_100000210449 [0,1,0,0,0,1|2,0,0]=4 16314 B16R1.1570 CCCC(C)NC(=O)NCc1ccccn1 273464a_100000741246_100000210449 [0,1,0,0,0,1|2,0,0]=4 16315 B16R1.1570 CCCC(C)NC(=O)NCc1ccccn1 512a_100000741246_100000210449 [0,1,0,0,0,1|2,0,0]=4 16316 B16R1.1570 CCCC(C)NC(=O)NCc1cccnc1 2708a_100000210453_100000741246 [0,1,0,0,0,1|2,0,0]=4 16317 B16R1.1570 CCCC(C)NC(=O)NCc1cccnc1 2708a_100000741246_100000210453 [0,1,0,0,0,1|2,0,0]=4 16318 B16R1.1570 CCCC(C)NC(=O)NCc1cccnc1 273464a_100000741246_100000210453 [0,1,0,0,0,1|2,0,0]=4 16319 B16R1.1570 CCCC(C)NC(=O)NCc1cccnc1 512a_100000210453_100000741246 [0,1,0,0,0,1|2,0,0]=4 16320 B16R1.1570 CCCC(C)NC(=O)NCc1cccnc1 512a_100000741246_100000210453 [0,1,0,0,0,1|2,0,0]=4 16321 B16R1.1570 CCCC(C)NC(=O)NCc1ccncc1 2708a_100000210450_100000741246 [0,1,0,0,0,1|2,0,0]=4 16322 B16R1.1570 CCCC(C)NC(=O)NCc1ccncc1 2708a_100000741246_100000210450 [0,1,0,0,0,1|2,0,0]=4 16323 B16R1.1570 CCCC(C)NC(=O)NCc1ccncc1 273464a_100000741246_100000210450 [0,1,0,0,0,1|2,0,0]=4 16324 B16R1.1570 CCCC(C)NC(=O)NCc1ccncc1 512a_100000741246_100000210450 [0,1,0,0,0,1|2,0,0]=4 16325 B16R1.1570 CCCC(C)NC(=O)NNc1ccccc1 273464a_100000741246_100015195140 [0,1,0,0,0,1|2,0,0]=4 16326 B16R1.1570 CCCC(C)NC(=O)NNc1ccccc1 512a_100000741246_100015195140 [0,1,0,0,0,1|2,0,0]=4 16327 B16R1.1570 CCCC(C)OC(C)COc1ccccc1 34a_100000210911_100000766640 [0,1,0,0,0,1|1,0,1]=4 16328 B16R1.1570 CCCC(C)OC(C)COc1ccccc1 7a_100000210911_100000766640 [0,1,0,0,0,1|1,0,1]=4 16329 B16R1.1570 CCCC(C)O[C@@H](C)CCc1ccccc1 34a_100009815974_100000766640 [0,1,0,0,0,1|1,0,1]=4 16330 B16R1.1570 CCCC(C)O[C@@H](C)CCc1ccccc1 7a_100009815974_100000766640 [0,1,0,0,0,1|1,0,1]=4 16331 B16R1.1570 CCCN(C)CC(=O)CCc1ccccc1 2230a_100000747261_100012361361 [0,1,0,0,0,1|2,0,0]=4 16332 B16R1.1570 CCCN(C)CC(=O)CCc1ccccc1 269982a_100000747261_100012361361 [0,1,0,0,0,1|2,0,0]=4 16333 B16R1.1570 CCCN(C)CC(=O)NCc1ccccc1 2230a_100000747261_100000183539 [0,1,0,0,0,1|2,0,0]=4 16334 B16R1.1570 CCCN(C)CC(=O)NCc1ccccc1 2230a_100015205873_100000210303 [0,1,0,0,0,1|2,0,0]=4 16335 B16R1.1570 CCCN(C)CC(=O)NCc1ccccc1 269982a_100000747261_100000183539 [0,1,0,0,0,1|2,0,0]=4 16336 B16R1.1570 CCCN(C)CC(=O)NCc1ccccc1 269982a_100015205873_100000210303 [0,1,0,0,0,1|2,0,0]=4 16337 B16R1.1570 CCCN(C)CC(=O)OCc1ccccc1 2230a_100000747261_100000753625 [0,1,0,0,0,1|2,0,0]=4 16338 B16R1.1570 CCCN(C)CC(=O)OCc1ccccc1 2230a_100020626385_100000210303 [0,1,0,0,0,1|2,0,0]=4 16339 B16R1.1570 CCCN(C)CC(=O)OCc1ccccc1 269982a_100000747261_100000753625 [0,1,0,0,0,1|2,0,0]=4 16340 B16R1.1570 CCCN(C)CC(=O)OCc1ccccc1 269982a_100020626385_100000210303 [0,1,0,0,0,1|2,0,0]=4 16341 B16R1.1570 CCCS(=O)CC(=O)CCc1ccccc1 1458a_100011387404_100000765856 [0,1,0,0,0,1|2,0,0]=4 16342 B16R1.1570 CCCS(=O)CC(=O)NCc1ccccc1 11a_100015324214_100011387404 [0,1,0,0,0,1|2,0,0]=4 16343 B16R1.1570 CCCS(=O)CC(=O)NCc1ccccc1 1626a_100015324214_100011387404 [0,1,0,0,0,1|2,0,0]=4 16344 B16R1.1570 CCCS(=O)CC(=O)NCc1ccccc1 240690a_100015324214_100011387404 [0,1,0,0,0,1|2,0,0]=4 16345 B16R1.1570 CCCS(=O)CC(=O)NCc1ccccc1 527a_100015324214_100011387404 [0,1,0,0,0,1|2,0,0]=4 16346 B16R1.1570 CCSC(C)CC(=O)CCc1ccccc1 1458a_200011311441_100000765856 [0,1,0,0,0,1|2,0,0]=4 16347 B16R1.1570 CCSC(C)CC(=O)NCc1ccccc1 11a_100015324214_200011311441 [0,1,0,0,0,1|2,0,0]=4 16348 B16R1.1570 CCSC(C)CC(=O)NCc1ccccc1 1626a_100015324214_200011311441 [0,1,0,0,0,1|2,0,0]=4 16349 B16R1.1570 CCSC(C)CC(=O)NCc1ccccc1 240690a_100015324214_200011311441 [0,1,0,0,0,1|2,0,0]=4 16350 B16R1.1570 CCSC(C)CC(=O)NCc1ccccc1 527a_100015324214_200011311441 [0,1,0,0,0,1|2,0,0]=4 16351 B16R1.1570 CCSC(C)OC(=O)OCc1ccccc1 62a_100000210202_200015597219 [0,1,0,0,0,1|1,0,0]=3 16352 B16R1.1570 CCSC(C)OC(=O)OCc1ccccc1 62a_200015597219_100000210202 [0,1,0,0,0,1|1,0,0]=3 16353 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 11a_100000764878_100000185753 [0,1,0,0,0,1|2,0,0]=4 16354 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 1626a_100000764878_100000185753 [0,1,0,0,0,1|2,0,0]=4 16355 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 240690a_100000764878_100000185753 [0,1,0,0,0,1|2,0,0]=4 16356 B16R1.1570 COC[C@@H](C)NC(=O)CCc1ccccc1 527a_100000764878_100000185753 [0,1,0,0,0,1|2,0,0]=4 16357 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 11a_100000764878_100000186222 [0,1,0,0,0,1|2,0,0]=4 16358 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 1626a_100000764878_100000186222 [0,1,0,0,0,1|2,0,0]=4 16359 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 240690a_100000764878_100000186222 [0,1,0,0,0,1|2,0,0]=4 16360 B16R1.1570 COC[C@@H](C)NC(=O)COc1ccccc1 527a_100000764878_100000186222 [0,1,0,0,0,1|2,0,0]=4 16361 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 11a_100000764878_100000211596 [0,1,0,0,0,1|2,0,0]=4 16362 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 1626a_100000764878_100000211596 [0,1,0,0,0,1|2,0,0]=4 16363 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 240690a_100000764878_100000211596 [0,1,0,0,0,1|2,0,0]=4 16364 B16R1.1570 COC[C@@H](C)NC(=O)CSc1ccccc1 527a_100000764878_100000211596 [0,1,0,0,0,1|2,0,0]=4 16365 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 2708a_100000764878_100015324214 [0,1,0,0,0,1|2,0,0]=4 16366 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 2708a_100015324214_100000764878 [0,1,0,0,0,1|2,0,0]=4 16367 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 273464a_100000764878_100015324214 [0,1,0,0,0,1|2,0,0]=4 16368 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 273464a_100015324214_100000764878 [0,1,0,0,0,1|2,0,0]=4 16369 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 512a_100000764878_100015324214 [0,1,0,0,0,1|2,0,0]=4 16370 B16R1.1570 COC[C@@H](C)NC(=O)NCc1ccccc1 512a_100015324214_100000764878 [0,1,0,0,0,1|2,0,0]=4 16371 B16R1.1570 COC[C@H](C)NC(=O)OCc1ccccc1 7a_100011830355_200000210301 [0,1,0,0,0,1|2,0,0]=4 16372 B16R1.1570 C[C@@H](CO[13CH3])NC(=O)OCc1ccccc1 7a_100011830355_200025704644 [0,1,0,0,0,1|2,0,0]=4 16373 B16R1.1570 C[C@H](CCO)NC(=O)CCc1ccccc1 240690a_100000706166_100000185753 [0,1,0,0,0,1|2,0,0]=4 16374 B16R1.1570 C[C@H](CCO)NC(=O)CCc1ccccc1 527a_100000706166_100000185753 [0,1,0,0,0,1|2,0,0]=4 16375 B16R1.1570 C[C@H](CCO)NC(=O)COc1ccccc1 240690a_100000706166_100000186222 [0,1,0,0,0,1|2,0,0]=4 16376 B16R1.1570 C[C@H](CCO)NC(=O)COc1ccccc1 527a_100000706166_100000186222 [0,1,0,0,0,1|2,0,0]=4 16377 B16R1.1570 C[C@H](CCO)NC(=O)CSc1ccccc1 240690a_100000706166_100000211596 [0,1,0,0,0,1|2,0,0]=4 16378 B16R1.1570 C[C@H](CCO)NC(=O)CSc1ccccc1 527a_100000706166_100000211596 [0,1,0,0,0,1|2,0,0]=4 16379 B16R1.1570 C[C@H](CCO)NC(=O)NCc1ccccc1 2708a_100015324214_100000706166 [0,1,0,0,0,1|2,0,0]=4 16380 B16R1.1570 C[C@H](CCO)NC(=O)NCc1ccccc1 273464a_100000706166_100015324214 [0,1,0,0,0,1|2,0,0]=4 16381 B16R1.1570 C[C@H](CCO)NC(=O)NCc1ccccc1 512a_100000706166_100015324214 [0,1,0,0,0,1|2,0,0]=4 16382 B16R1.1570 C[C@H](CCO)NC(=O)NCc1ccccc1 512a_100015324214_100000706166 [0,1,0,0,0,1|2,0,0]=4 16383 B16R1.1696 CCCC#CC(=O)CCc1ccccc1Br 1458a_200011218047_100012161201 [0,1,0,0,0,1|1,0,1]=4 16384 B16R1.1696 CCCC#CC(=O)CCc1ccccc1C 1458a_200011218047_100011713688 [0,1,0,0,0,1|1,0,1]=4 16385 B16R1.1696 CCCC#CC(=O)CCc1ccccc1Cl 1458a_200011218047_100011713703 [0,1,0,0,0,1|1,0,1]=4 16386 B16R1.1696 CCCC#CC(=O)CCc1ccccc1F 1458a_200011218047_100000720011 [0,1,0,0,0,1|1,0,1]=4 16387 B16R1.1696 CCCC#CC(=O)CCc1ccccc1O 1458a_200011218047_100000722297 [0,1,0,0,0,1|1,0,1]=4 16388 B16R1.1696 CCCC#CC(=O)NCc1ccccc1Br 240690a_100000689332_200011218047 [0,1,0,0,0,1|1,0,1]=4 16389 B16R1.1696 CCCC#CC(=O)NCc1ccccc1C 240690a_100000174972_200011218047 [0,1,0,0,0,1|1,0,1]=4 16390 B16R1.1696 CCCC#CC(=O)NCc1ccccc1Cl 240690a_100000174879_200011218047 [0,1,0,0,0,1|1,0,1]=4 16391 B16R1.1696 CCCC#CC(=O)NCc1ccccc1F 240690a_100000174869_200011218047 [0,1,0,0,0,1|1,0,1]=4 16392 B16R1.1696 CCCC#CC(=O)NCc1ccccc1I 240690a_100015347259_200011218047 [0,1,0,0,0,1|1,0,1]=4 16393 B16R1.1696 CCCC#CC(=O)NCc1ccccc1O 240690a_100000185550_200011218047 [0,1,0,0,0,1|1,0,1]=4 16394 B16R1.1696 CCCC=CC(=O)CCc1ccccc1Br 1458a_100000212230_100012161201 [0,1,0,0,0,1|1,0,1]=4 16395 B16R1.1696 CCCC=CC(=O)CCc1ccccc1C 1458a_100000212230_100011713688 [0,1,0,0,0,1|1,0,1]=4 16396 B16R1.1696 CCCC=CC(=O)CCc1ccccc1Cl 1458a_100000212230_100011713703 [0,1,0,0,0,1|1,0,1]=4 16397 B16R1.1696 CCCC=CC(=O)CCc1ccccc1F 1458a_100000212230_100000720011 [0,1,0,0,0,1|1,0,1]=4 16398 B16R1.1696 CCCC=CC(=O)CCc1ccccc1O 1458a_100000212230_100000722297 [0,1,0,0,0,1|1,0,1]=4 16399 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Br 11a_100000689332_100000212230 [0,1,0,0,0,1|1,0,1]=4 16400 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Br 1626a_100000689332_100000212230 [0,1,0,0,0,1|1,0,1]=4 16401 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Br 240690a_100000689332_100000212230 [0,1,0,0,0,1|1,0,1]=4 16402 B16R1.1696 CCCC=CC(=O)NCc1ccccc1C 11a_100000174972_100000212230 [0,1,0,0,0,1|1,0,1]=4 16403 B16R1.1696 CCCC=CC(=O)NCc1ccccc1C 1626a_100000174972_100000212230 [0,1,0,0,0,1|1,0,1]=4 16404 B16R1.1696 CCCC=CC(=O)NCc1ccccc1C 240690a_100000174972_100000212230 [0,1,0,0,0,1|1,0,1]=4 16405 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Cl 11a_100000174879_100000212230 [0,1,0,0,0,1|1,0,1]=4 16406 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Cl 1626a_100000174879_100000212230 [0,1,0,0,0,1|1,0,1]=4 16407 B16R1.1696 CCCC=CC(=O)NCc1ccccc1Cl 240690a_100000174879_100000212230 [0,1,0,0,0,1|1,0,1]=4 16408 B16R1.1696 CCCC=CC(=O)NCc1ccccc1F 11a_100000174869_100000212230 [0,1,0,0,0,1|1,0,1]=4 16409 B16R1.1696 CCCC=CC(=O)NCc1ccccc1F 1626a_100000174869_100000212230 [0,1,0,0,0,1|1,0,1]=4 16410 B16R1.1696 CCCC=CC(=O)NCc1ccccc1F 240690a_100000174869_100000212230 [0,1,0,0,0,1|1,0,1]=4 16411 B16R1.1696 CCCC=CC(=O)NCc1ccccc1I 11a_100015347259_100000212230 [0,1,0,0,0,1|1,0,1]=4 16412 B16R1.1696 CCCC=CC(=O)NCc1ccccc1I 1626a_100015347259_100000212230 [0,1,0,0,0,1|1,0,1]=4 16413 B16R1.1696 CCCC=CC(=O)NCc1ccccc1I 240690a_100015347259_100000212230 [0,1,0,0,0,1|1,0,1]=4 16414 B16R1.1696 CCCC=CC(=O)NCc1ccccc1O 240690a_100000185550_100000212230 [0,1,0,0,0,1|1,0,1]=4 16415 B16R1.1696 CCCCCC(=O)C#Cc1ccccc1F 1458a_100011892747_100000210326 [0,1,0,0,0,1|1,0,1]=4 16416 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1Br 1458a_100000719032_100000210326 [0,1,0,0,0,1|1,0,1]=4 16417 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1Cl 1458a_100000720304_100000210326 [0,1,0,0,0,1|1,0,1]=4 16418 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1F 1458a_100016256065_100000210326 [0,1,0,0,0,1|1,0,1]=4 16419 B16R1.1696 CCCCCC(=O)C=Cc1ccccc1O 1458a_100016263591_100000210326 [0,1,0,0,0,1|1,0,1]=4 16420 B16R1.1696 CCCCCC(=O)CCc1ccccc1Br 1458a_100000212188_100012161201 [0,1,0,0,0,1|1,0,0]=3 16421 B16R1.1696 CCCCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000210326 [0,1,0,0,0,1|1,0,0]=3 16422 B16R1.1696 CCCCCC(=O)CCc1ccccc1C 1458a_100000212188_100011713688 [0,1,0,0,0,1|1,0,0]=3 16423 B16R1.1696 CCCCCC(=O)CCc1ccccc1C 1458a_100000748742_100000210326 [0,1,0,0,0,1|1,0,0]=3 16424 B16R1.1696 CCCCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000210326 [0,1,0,0,0,1|1,0,0]=3 16425 B16R1.1696 CCCCCC(=O)CCc1ccccc1Cl 1458a_100000212188_100011713703 [0,1,0,0,0,1|1,0,0]=3 16426 B16R1.1696 CCCCCC(=O)CCc1ccccc1F 1458a_100000189703_100000210326 [0,1,0,0,0,1|1,0,0]=3 16427 B16R1.1696 CCCCCC(=O)CCc1ccccc1F 1458a_100000212188_100000720011 [0,1,0,0,0,1|1,0,0]=3 16428 B16R1.1696 CCCCCC(=O)CCc1ccccc1I 1458a_100000037306_100000210326 [0,1,0,0,0,1|1,0,0]=3 16429 B16R1.1696 CCCCCC(=O)CCc1ccccc1O 1458a_100000181328_100000210326 [0,1,0,0,0,1|1,0,0]=3 16430 B16R1.1696 CCCCCC(=O)CCc1ccccc1O 1458a_100000212188_100000722297 [0,1,0,0,0,1|1,0,0]=3 16431 B16R1.1696 CCCCCC(=O)CCn1ccccc1=O 1458a_100000738505_100000210326 [0,1,0,0,0,1|2,0,0]=4 16432 B16R1.1696 CCCCCC(=O)CNc1ccccc1Br 34a_100000210017_200012276598 [0,1,0,0,0,1|1,0,0]=3 16433 B16R1.1696 CCCCCC(=O)CNc1ccccc1C 34a_100015192222_200012276598 [0,1,0,0,0,1|1,0,0]=3 16434 B16R1.1696 CCCCCC(=O)CNc1ccccc1Cl 34a_100000185783_200012276598 [0,1,0,0,0,1|1,0,0]=3 16435 B16R1.1696 CCCCCC(=O)CNc1ccccc1F 34a_100000210422_200012276598 [0,1,0,0,0,1|1,0,0]=3 16436 B16R1.1696 CCCCCC(=O)CNc1ccccc1I 34a_100000210053_200012276598 [0,1,0,0,0,1|1,0,0]=3 16437 B16R1.1696 CCCCCC(=O)CNc1ccccc1O 34a_100000185747_200012276598 [0,1,0,0,0,1|1,0,0]=3 16438 B16R1.1696 CCCCCC(=O)COc1cccc[n+]1[O-] 7a_100000211761_200012276598 [0,1,0,0,0,1|2,0,0]=4 16439 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 1458a_100000216496_100000210326 [0,1,0,0,0,1|1,0,0]=3 16440 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 34a_100000181306_200012276598 [0,1,0,0,0,1|1,0,0]=3 16441 B16R1.1696 CCCCCC(=O)COc1ccccc1Br 7a_100000181306_200012276598 [0,1,0,0,0,1|1,0,0]=3 16442 B16R1.1696 CCCCCC(=O)COc1ccccc1C 1458a_100000182418_100000210326 [0,1,0,0,0,1|1,0,0]=3 16443 B16R1.1696 CCCCCC(=O)COc1ccccc1C 34a_100000210338_200012276598 [0,1,0,0,0,1|1,0,0]=3 16444 B16R1.1696 CCCCCC(=O)COc1ccccc1C 7a_100000210338_200012276598 [0,1,0,0,0,1|1,0,0]=3 16445 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000210326 [0,1,0,0,0,1|1,0,0]=3 16446 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 34a_100000210172_200012276598 [0,1,0,0,0,1|1,0,0]=3 16447 B16R1.1696 CCCCCC(=O)COc1ccccc1Cl 7a_100000210172_200012276598 [0,1,0,0,0,1|1,0,0]=3 16448 B16R1.1696 CCCCCC(=O)COc1ccccc1F 1458a_100000182486_100000210326 [0,1,0,0,0,1|1,0,0]=3 16449 B16R1.1696 CCCCCC(=O)COc1ccccc1F 34a_100000210171_200012276598 [0,1,0,0,0,1|1,0,0]=3 16450 B16R1.1696 CCCCCC(=O)COc1ccccc1F 7a_100000210171_200012276598 [0,1,0,0,0,1|1,0,0]=3 16451 B16R1.1696 CCCCCC(=O)COc1ccccc1I 34a_100000739446_200012276598 [0,1,0,0,0,1|1,0,0]=3 16452 B16R1.1696 CCCCCC(=O)COc1ccccc1I 7a_100000739446_200012276598 [0,1,0,0,0,1|1,0,0]=3 16453 B16R1.1696 CCCCCC(=O)COc1ccccc1N 34a_100000185747_200012276598 [0,1,0,0,0,1|1,0,0]=3 16454 B16R1.1696 CCCCCC(=O)COc1ccccc1N 7a_100000185747_200012276598 [0,1,0,0,0,1|1,0,0]=3 16455 B16R1.1696 CCCCCC(=O)COc1ccccc1O 1458a_100000183020_100000210326 [0,1,0,0,0,1|1,0,0]=3 16456 B16R1.1696 CCCCCC(=O)COc1cccnc1Br 34a_100000744436_200012276598 [0,1,0,0,0,1|2,0,0]=4 16457 B16R1.1696 CCCCCC(=O)COc1cccnc1Br 7a_100000744436_200012276598 [0,1,0,0,0,1|2,0,0]=4 16458 B16R1.1696 CCCCCC(=O)COc1cccnc1C 34a_100000745507_200012276598 [0,1,0,0,0,1|2,0,0]=4 16459 B16R1.1696 CCCCCC(=O)COc1cccnc1C 7a_100000745507_200012276598 [0,1,0,0,0,1|2,0,0]=4 16460 B16R1.1696 CCCCCC(=O)COc1cccnc1Cl 34a_100000757616_200012276598 [0,1,0,0,0,1|2,0,0]=4 16461 B16R1.1696 CCCCCC(=O)COc1cccnc1Cl 7a_100000757616_200012276598 [0,1,0,0,0,1|2,0,0]=4 16462 B16R1.1696 CCCCCC(=O)COc1cccnc1F 34a_100000061740_200012276598 [0,1,0,0,0,1|2,0,0]=4 16463 B16R1.1696 CCCCCC(=O)COc1cccnc1F 7a_100000061740_200012276598 [0,1,0,0,0,1|2,0,0]=4 16464 B16R1.1696 CCCCCC(=O)COc1cccnc1I 34a_100000034122_200012276598 [0,1,0,0,0,1|2,0,0]=4 16465 B16R1.1696 CCCCCC(=O)COc1cccnc1I 7a_100000034122_200012276598 [0,1,0,0,0,1|2,0,0]=4 16466 B16R1.1696 CCCCCC(=O)COc1cccnc1N 34a_100000211975_200012276598 [0,1,0,0,0,1|2,0,0]=4 16467 B16R1.1696 CCCCCC(=O)COc1cccnc1N 7a_100000211975_200012276598 [0,1,0,0,0,1|2,0,0]=4 16468 B16R1.1696 CCCCCC(=O)COc1cccoc1=O 34a_100000077404_200012276598 [0,1,0,0,0,1|2,0,0]=4 16469 B16R1.1696 CCCCCC(=O)COc1cccoc1=O 7a_100000077404_200012276598 [0,1,0,0,0,1|2,0,0]=4 16470 B16R1.1696 CCCCCC(=O)COc1ccncc1Br 34a_100011996408_200012276598 [0,1,0,0,0,1|2,0,0]=4 16471 B16R1.1696 CCCCCC(=O)COc1ccncc1C 34a_100000694293_200012276598 [0,1,0,0,0,1|2,0,0]=4 16472 B16R1.1696 CCCCCC(=O)COc1ccncc1Cl 34a_100011997054_200012276598 [0,1,0,0,0,1|2,0,0]=4 16473 B16R1.1696 CCCCCC(=O)COc1ccncc1F 34a_200000081243_200012276598 [0,1,0,0,0,1|2,0,0]=4 16474 B16R1.1696 CCCCCC(=O)COc1cnccc1C 34a_100011997053_200012276598 [0,1,0,0,0,1|2,0,0]=4 16475 B16R1.1696 CCCCCC(=O)COc1cnccc1C 7a_100011997053_200012276598 [0,1,0,0,0,1|2,0,0]=4 16476 B16R1.1696 CCCCCC(=O)COc1cnccc1Cl 34a_100011996695_200012276598 [0,1,0,0,0,1|2,0,0]=4 16477 B16R1.1696 CCCCCC(=O)COc1cnccc1I 34a_100000050107_200012276598 [0,1,0,0,0,1|2,0,0]=4 16478 B16R1.1696 CCCCCC(=O)COc1cnccc1N 34a_100000753702_200012276598 [0,1,0,0,0,1|2,0,0]=4 16479 B16R1.1696 CCCCCC(=O)COc1coccc1=O 34a_100000060831_200012276598 [0,1,0,0,0,1|2,0,0]=4 16480 B16R1.1696 CCCCCC(=O)COc1ncccc1Cl 34a_100011290957_200012276598 [0,1,0,0,0,1|2,0,0]=4 16481 B16R1.1696 CCCCCC(=O)COc1ncccc1F 34a_100011219419_200012276598 [0,1,0,0,0,1|2,0,0]=4 16482 B16R1.1696 CCCCCC(=O)COc1ncccc1N 34a_100000746358_200012276598 [0,1,0,0,0,1|2,0,0]=4 16483 B16R1.1696 CCCCCC(=O)CSc1c[nH]ccc1=O 62a_100009998708_200012276598 [0,1,0,0,0,1|2,0,0]=4 16484 B16R1.1696 CCCCCC(=O)CSc1c[nH]ccc1=O 62a_200012276598_100009998708 [0,1,0,0,0,1|2,0,0]=4 16485 B16R1.1696 CCCCCC(=O)CSc1c[nH]ccc1=S 62a_200012276598_200012280681 [0,1,0,0,0,1|2,0,0]=4 16486 B16R1.1696 CCCCCC(=O)CSc1c[nH]ccc1=S 62a_200012280681_200012276598 [0,1,0,0,0,1|2,0,0]=4 16487 B16R1.1696 CCCCCC(=O)CSc1cccc[n+]1C 62a_200012276598_100000212160 [0,1,0,0,0,1|2,0,0]=4 16488 B16R1.1696 CCCCCC(=O)CSc1cccc[n+]1[O-] 62a_200012276598_200000042595 [0,1,0,0,0,1|2,0,0]=4 16489 B16R1.1696 CCCCCC(=O)CSc1ccccc1Br 62a_100000695589_200012276598 [0,1,0,0,0,1|1,0,0]=3 16490 B16R1.1696 CCCCCC(=O)CSc1ccccc1Br 62a_200012276598_100000695589 [0,1,0,0,0,1|1,0,0]=3 16491 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 1458a_100000183026_100000210326 [0,1,0,0,0,1|1,0,0]=3 16492 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 62a_100000210755_200012276598 [0,1,0,0,0,1|1,0,0]=3 16493 B16R1.1696 CCCCCC(=O)CSc1ccccc1C 62a_200012276598_100000210755 [0,1,0,0,0,1|1,0,0]=3 16494 B16R1.1696 CCCCCC(=O)CSc1ccccc1Cl 62a_100000764095_200012276598 [0,1,0,0,0,1|1,0,0]=3 16495 B16R1.1696 CCCCCC(=O)CSc1ccccc1Cl 62a_200012276598_100000764095 [0,1,0,0,0,1|1,0,0]=3 16496 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 1458a_100000179528_100000210326 [0,1,0,0,0,1|1,0,0]=3 16497 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 62a_100011215700_200012276598 [0,1,0,0,0,1|1,0,0]=3 16498 B16R1.1696 CCCCCC(=O)CSc1ccccc1F 62a_200012276598_100011215700 [0,1,0,0,0,1|1,0,0]=3 16499 B16R1.1696 CCCCCC(=O)CSc1ccccc1N 62a_100000210017_200012276598 [0,1,0,0,0,1|1,0,0]=3 16500 B16R1.1696 CCCCCC(=O)CSc1ccccc1N 62a_200012276598_100000210017 [0,1,0,0,0,1|1,0,0]=3 16501 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 1458a_100000695322_100000210326 [0,1,0,0,0,1|1,0,0]=3 16502 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 62a_100000739446_200012276598 [0,1,0,0,0,1|1,0,0]=3 16503 B16R1.1696 CCCCCC(=O)CSc1ccccc1O 62a_200012276598_100000739446 [0,1,0,0,0,1|1,0,0]=3 16504 B16R1.1696 CCCCCC(=O)CSc1cccnc1Br 62a_100010202626_200012276598 [0,1,0,0,0,1|2,0,0]=4 16505 B16R1.1696 CCCCCC(=O)CSc1cccnc1Br 62a_200012276598_100010202626 [0,1,0,0,0,1|2,0,0]=4 16506 B16R1.1696 CCCCCC(=O)CSc1cccnc1C 62a_100000751574_200012276598 [0,1,0,0,0,1|2,0,0]=4 16507 B16R1.1696 CCCCCC(=O)CSc1cccnc1C 62a_200012276598_100000751574 [0,1,0,0,0,1|2,0,0]=4 16508 B16R1.1696 CCCCCC(=O)CSc1cccnc1Cl 62a_100000036424_200012276598 [0,1,0,0,0,1|2,0,0]=4 16509 B16R1.1696 CCCCCC(=O)CSc1cccnc1Cl 62a_200012276598_100000036424 [0,1,0,0,0,1|2,0,0]=4 16510 B16R1.1696 CCCCCC(=O)CSc1cccnc1F 62a_100009816115_200012276598 [0,1,0,0,0,1|2,0,0]=4 16511 B16R1.1696 CCCCCC(=O)CSc1cccnc1F 62a_200012276598_100009816115 [0,1,0,0,0,1|2,0,0]=4 16512 B16R1.1696 CCCCCC(=O)CSc1cccnc1N 62a_100000045569_200012276598 [0,1,0,0,0,1|2,0,0]=4 16513 B16R1.1696 CCCCCC(=O)CSc1cccnc1N 62a_200012276598_100000045569 [0,1,0,0,0,1|2,0,0]=4 16514 B16R1.1696 CCCCCC(=O)CSc1cccnc1O 62a_100000760158_200012276598 [0,1,0,0,0,1|2,0,0]=4 16515 B16R1.1696 CCCCCC(=O)CSc1cccnc1O 62a_200012276598_100000760158 [0,1,0,0,0,1|2,0,0]=4 16516 B16R1.1696 CCCCCC(=O)CSc1ccncc1Br 62a_100000726257_200012276598 [0,1,0,0,0,1|2,0,0]=4 16517 B16R1.1696 CCCCCC(=O)CSc1ccncc1Br 62a_200012276598_100000726257 [0,1,0,0,0,1|2,0,0]=4 16518 B16R1.1696 CCCCCC(=O)CSc1ccncc1C 62a_100000765111_200012276598 [0,1,0,0,0,1|2,0,0]=4 16519 B16R1.1696 CCCCCC(=O)CSc1ccncc1C 62a_200012276598_100000765111 [0,1,0,0,0,1|2,0,0]=4 16520 B16R1.1696 CCCCCC(=O)CSc1ccncc1Cl 62a_100000708259_200012276598 [0,1,0,0,0,1|2,0,0]=4 16521 B16R1.1696 CCCCCC(=O)CSc1ccncc1Cl 62a_200012276598_100000708259 [0,1,0,0,0,1|2,0,0]=4 16522 B16R1.1696 CCCCCC(=O)CSc1ccncc1F 62a_100000047030_200012276598 [0,1,0,0,0,1|2,0,0]=4 16523 B16R1.1696 CCCCCC(=O)CSc1ccncc1F 62a_200012276598_100000047030 [0,1,0,0,0,1|2,0,0]=4 16524 B16R1.1696 CCCCCC(=O)CSc1ccncc1N 62a_100000756074_200012276598 [0,1,0,0,0,1|2,0,0]=4 16525 B16R1.1696 CCCCCC(=O)CSc1ccncc1N 62a_200012276598_100000756074 [0,1,0,0,0,1|2,0,0]=4 16526 B16R1.1696 CCCCCC(=O)CSc1ccncc1O 62a_100009817591_200012276598 [0,1,0,0,0,1|2,0,0]=4 16527 B16R1.1696 CCCCCC(=O)CSc1ccncc1O 62a_200012276598_100009817591 [0,1,0,0,0,1|2,0,0]=4 16528 B16R1.1696 CCCCCC(=O)CSc1cnccc1Br 62a_100010138639_200012276598 [0,1,0,0,0,1|2,0,0]=4 16529 B16R1.1696 CCCCCC(=O)CSc1cnccc1Br 62a_200012276598_100010138639 [0,1,0,0,0,1|2,0,0]=4 16530 B16R1.1696 CCCCCC(=O)CSc1cnccc1C 62a_100000761580_200012276598 [0,1,0,0,0,1|2,0,0]=4 16531 B16R1.1696 CCCCCC(=O)CSc1cnccc1C 62a_200012276598_100000761580 [0,1,0,0,0,1|2,0,0]=4 16532 B16R1.1696 CCCCCC(=O)CSc1cnccc1Cl 62a_100009995489_200012276598 [0,1,0,0,0,1|2,0,0]=4 16533 B16R1.1696 CCCCCC(=O)CSc1cnccc1Cl 62a_200012276598_100009995489 [0,1,0,0,0,1|2,0,0]=4 16534 B16R1.1696 CCCCCC(=O)CSc1cnccc1F 62a_100009820683_200012276598 [0,1,0,0,0,1|2,0,0]=4 16535 B16R1.1696 CCCCCC(=O)CSc1cnccc1F 62a_200012276598_100009820683 [0,1,0,0,0,1|2,0,0]=4 16536 B16R1.1696 CCCCCC(=O)CSc1cnccc1N 62a_100000047001_200012276598 [0,1,0,0,0,1|2,0,0]=4 16537 B16R1.1696 CCCCCC(=O)CSc1cnccc1N 62a_200012276598_100000047001 [0,1,0,0,0,1|2,0,0]=4 16538 B16R1.1696 CCCCCC(=O)CSc1ncccc1Br 62a_100000696092_200012276598 [0,1,0,0,0,1|2,0,0]=4 16539 B16R1.1696 CCCCCC(=O)CSc1ncccc1Br 62a_200012276598_100000696092 [0,1,0,0,0,1|2,0,0]=4 16540 B16R1.1696 CCCCCC(=O)CSc1ncccc1C 62a_100000751373_200012276598 [0,1,0,0,0,1|2,0,0]=4 16541 B16R1.1696 CCCCCC(=O)CSc1ncccc1C 62a_200012276598_100000751373 [0,1,0,0,0,1|2,0,0]=4 16542 B16R1.1696 CCCCCC(=O)CSc1ncccc1Cl 62a_100011356963_200012276598 [0,1,0,0,0,1|2,0,0]=4 16543 B16R1.1696 CCCCCC(=O)CSc1ncccc1Cl 62a_200012276598_100011356963 [0,1,0,0,0,1|2,0,0]=4 16544 B16R1.1696 CCCCCC(=O)CSc1ncccc1F 62a_100000685392_200012276598 [0,1,0,0,0,1|2,0,0]=4 16545 B16R1.1696 CCCCCC(=O)CSc1ncccc1F 62a_200012276598_100000685392 [0,1,0,0,0,1|2,0,0]=4 16546 B16R1.1696 CCCCCC(=O)CSc1ncccc1N 62a_100000688686_200012276598 [0,1,0,0,0,1|2,0,0]=4 16547 B16R1.1696 CCCCCC(=O)CSc1ncccc1N 62a_200012276598_100000688686 [0,1,0,0,0,1|2,0,0]=4 16548 B16R1.1696 CCCCCC(=O)CSc1ncccc1O 62a_100000034122_200012276598 [0,1,0,0,0,1|2,0,0]=4 16549 B16R1.1696 CCCCCC(=O)CSc1ncccc1O 62a_200012276598_100000034122 [0,1,0,0,0,1|2,0,0]=4 16550 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 11a_100000689332_100000212188 [0,1,0,0,0,1|1,0,0]=3 16551 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000212188 [0,1,0,0,0,1|1,0,0]=3 16552 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000212188 [0,1,0,0,0,1|1,0,0]=3 16553 B16R1.1696 CCCCCC(=O)NCc1ccccc1Br 527a_100000689332_100000212188 [0,1,0,0,0,1|1,0,0]=3 16554 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 11a_100000174972_100000212188 [0,1,0,0,0,1|1,0,0]=3 16555 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 1626a_100000174972_100000212188 [0,1,0,0,0,1|1,0,0]=3 16556 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 240690a_100000174972_100000212188 [0,1,0,0,0,1|1,0,0]=3 16557 B16R1.1696 CCCCCC(=O)NCc1ccccc1C 527a_100000174972_100000212188 [0,1,0,0,0,1|1,0,0]=3 16558 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000212188 [0,1,0,0,0,1|1,0,0]=3 16559 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000212188 [0,1,0,0,0,1|1,0,0]=3 16560 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000212188 [0,1,0,0,0,1|1,0,0]=3 16561 B16R1.1696 CCCCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000212188 [0,1,0,0,0,1|1,0,0]=3 16562 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 11a_100000174869_100000212188 [0,1,0,0,0,1|1,0,0]=3 16563 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 1626a_100000174869_100000212188 [0,1,0,0,0,1|1,0,0]=3 16564 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 240690a_100000174869_100000212188 [0,1,0,0,0,1|1,0,0]=3 16565 B16R1.1696 CCCCCC(=O)NCc1ccccc1F 527a_100000174869_100000212188 [0,1,0,0,0,1|1,0,0]=3 16566 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 11a_100015347259_100000212188 [0,1,0,0,0,1|1,0,0]=3 16567 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 1626a_100015347259_100000212188 [0,1,0,0,0,1|1,0,0]=3 16568 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 240690a_100015347259_100000212188 [0,1,0,0,0,1|1,0,0]=3 16569 B16R1.1696 CCCCCC(=O)NCc1ccccc1I 527a_100015347259_100000212188 [0,1,0,0,0,1|1,0,0]=3 16570 B16R1.1696 CCCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000212188 [0,1,0,0,0,1|1,0,0]=3 16571 B16R1.1696 CCCCCC(=O)NCc1ccccc1O 527a_100000185550_100000212188 [0,1,0,0,0,1|1,0,0]=3 16572 B16R1.1696 CCCCCC(=O)NCc1cccnc1Br 11a_100009818023_100000212188 [0,1,0,0,0,1|2,0,0]=4 16573 B16R1.1696 CCCCCC(=O)NCc1cccnc1Br 240690a_100009818023_100000212188 [0,1,0,0,0,1|2,0,0]=4 16574 B16R1.1696 CCCCCC(=O)NCc1cccnc1Br 527a_100009818023_100000212188 [0,1,0,0,0,1|2,0,0]=4 16575 B16R1.1696 CCCCCC(=O)NCc1cccnc1Cl 11a_100015189234_100000212188 [0,1,0,0,0,1|2,0,0]=4 16576 B16R1.1696 CCCCCC(=O)NCc1cccnc1Cl 1626a_100015189234_100000212188 [0,1,0,0,0,1|2,0,0]=4 16577 B16R1.1696 CCCCCC(=O)NCc1cccnc1Cl 240690a_100015189234_100000212188 [0,1,0,0,0,1|2,0,0]=4 16578 B16R1.1696 CCCCCC(=O)NCc1cccnc1Cl 527a_100015189234_100000212188 [0,1,0,0,0,1|2,0,0]=4 16579 B16R1.1696 CCCCCC(=O)NCc1cccnc1F 11a_100000724633_100000212188 [0,1,0,0,0,1|2,0,0]=4 16580 B16R1.1696 CCCCCC(=O)NCc1cccnc1F 1626a_100000724633_100000212188 [0,1,0,0,0,1|2,0,0]=4 16581 B16R1.1696 CCCCCC(=O)NCc1cccnc1F 240690a_100000724633_100000212188 [0,1,0,0,0,1|2,0,0]=4 16582 B16R1.1696 CCCCCC(=O)NCc1cccnc1F 527a_100000724633_100000212188 [0,1,0,0,0,1|2,0,0]=4 16583 B16R1.1696 CCCCCC(=O)NCc1ccncc1Br 11a_100020640021_100000212188 [0,1,0,0,0,1|2,0,0]=4 16584 B16R1.1696 CCCCCC(=O)NCc1ccncc1Br 240690a_100020640021_100000212188 [0,1,0,0,0,1|2,0,0]=4 16585 B16R1.1696 CCCCCC(=O)NCc1ccncc1Br 527a_100020640021_100000212188 [0,1,0,0,0,1|2,0,0]=4 16586 B16R1.1696 CCCCCC(=O)NCc1ccncc1C 11a_100000708811_100000212188 [0,1,0,0,0,1|2,0,0]=4 16587 B16R1.1696 CCCCCC(=O)NCc1ccncc1C 1626a_100000708811_100000212188 [0,1,0,0,0,1|2,0,0]=4 16588 B16R1.1696 CCCCCC(=O)NCc1ccncc1C 240690a_100000708811_100000212188 [0,1,0,0,0,1|2,0,0]=4 16589 B16R1.1696 CCCCCC(=O)NCc1ccncc1C 527a_100000708811_100000212188 [0,1,0,0,0,1|2,0,0]=4 16590 B16R1.1696 CCCCCC(=O)NCc1ccncc1F 11a_100011935246_100000212188 [0,1,0,0,0,1|2,0,0]=4 16591 B16R1.1696 CCCCCC(=O)NCc1ccncc1F 1626a_100011935246_100000212188 [0,1,0,0,0,1|2,0,0]=4 16592 B16R1.1696 CCCCCC(=O)NCc1ccncc1F 240690a_100011935246_100000212188 [0,1,0,0,0,1|2,0,0]=4 16593 B16R1.1696 CCCCCC(=O)NCc1ccncc1F 527a_100011935246_100000212188 [0,1,0,0,0,1|2,0,0]=4 16594 B16R1.1696 CCCCCC(=O)NCc1cnccc1C 11a_100011997553_100000212188 [0,1,0,0,0,1|2,0,0]=4 16595 B16R1.1696 CCCCCC(=O)NCc1cnccc1C 240690a_100011997553_100000212188 [0,1,0,0,0,1|2,0,0]=4 16596 B16R1.1696 CCCCCC(=O)NCc1cnccc1C 527a_100011997553_100000212188 [0,1,0,0,0,1|2,0,0]=4 16597 B16R1.1696 CCCCCC(=O)NCc1ncccc1Br 11a_100020591323_100000212188 [0,1,0,0,0,1|2,0,0]=4 16598 B16R1.1696 CCCCCC(=O)NCc1ncccc1Br 240690a_100020591323_100000212188 [0,1,0,0,0,1|2,0,0]=4 16599 B16R1.1696 CCCCCC(=O)NCc1ncccc1Br 527a_100020591323_100000212188 [0,1,0,0,0,1|2,0,0]=4 16600 B16R1.1696 CCCCCC(=O)NCc1ncccc1C 11a_100011223789_100000212188 [0,1,0,0,0,1|2,0,0]=4 16601 B16R1.1696 CCCCCC(=O)NCc1ncccc1C 1626a_100011223789_100000212188 [0,1,0,0,0,1|2,0,0]=4 16602 B16R1.1696 CCCCCC(=O)NCc1ncccc1C 240690a_100011223789_100000212188 [0,1,0,0,0,1|2,0,0]=4 16603 B16R1.1696 CCCCCC(=O)NCc1ncccc1C 527a_100011223789_100000212188 [0,1,0,0,0,1|2,0,0]=4 16604 B16R1.1696 CCCCCC(=O)NCc1ncccc1Cl 11a_100015189233_100000212188 [0,1,0,0,0,1|2,0,0]=4 16605 B16R1.1696 CCCCCC(=O)NCc1ncccc1Cl 1626a_100015189233_100000212188 [0,1,0,0,0,1|2,0,0]=4 16606 B16R1.1696 CCCCCC(=O)NCc1ncccc1Cl 240690a_100015189233_100000212188 [0,1,0,0,0,1|2,0,0]=4 16607 B16R1.1696 CCCCCC(=O)NCc1ncccc1Cl 527a_100015189233_100000212188 [0,1,0,0,0,1|2,0,0]=4 16608 B16R1.1696 CCCCCC(=O)NCc1ncccc1F 11a_100000690088_100000212188 [0,1,0,0,0,1|2,0,0]=4 16609 B16R1.1696 CCCCCC(=O)NCc1ncccc1F 1626a_100000690088_100000212188 [0,1,0,0,0,1|2,0,0]=4 16610 B16R1.1696 CCCCCC(=O)NCc1ncccc1F 240690a_100000690088_100000212188 [0,1,0,0,0,1|2,0,0]=4 16611 B16R1.1696 CCCCCC(=O)NCc1ncccc1F 527a_100000690088_100000212188 [0,1,0,0,0,1|2,0,0]=4 16612 B16R1.1696 CCCCCC(=O)NNc1ccccc1Br 22a_100000241748_100000212188 [0,1,0,0,0,1|2,0,0]=4 16613 B16R1.1696 CCCCCC(=O)NNc1ccccc1C 22a_100000184220_100000212188 [0,1,0,0,0,1|2,0,0]=4 16614 B16R1.1696 CCCCCC(=O)NNc1ccccc1Cl 22a_100000683529_100000212188 [0,1,0,0,0,1|2,0,0]=4 16615 B16R1.1696 CCCCCC(=O)NNc1ccccc1F 22a_100000239246_100000212188 [0,1,0,0,0,1|2,0,0]=4 16616 B16R1.1696 CCCCCC(=O)NNc1ccccc1I 22a_100011218156_100000212188 [0,1,0,0,0,1|2,0,0]=4 16617 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 11a_100000102301_100000719032 [0,1,0,0,0,1|1,0,1]=4 16618 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 1626a_100000102301_100000719032 [0,1,0,0,0,1|1,0,1]=4 16619 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Br 240690a_100000102301_100000719032 [0,1,0,0,0,1|1,0,1]=4 16620 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1C 1626a_100000102301_100016266485 [0,1,0,0,0,1|1,0,1]=4 16621 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 11a_100000102301_100000720304 [0,1,0,0,0,1|1,0,1]=4 16622 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 1626a_100000102301_100000720304 [0,1,0,0,0,1|1,0,1]=4 16623 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1Cl 240690a_100000102301_100000720304 [0,1,0,0,0,1|1,0,1]=4 16624 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 11a_100000102301_100016256065 [0,1,0,0,0,1|1,0,1]=4 16625 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 1626a_100000102301_100016256065 [0,1,0,0,0,1|1,0,1]=4 16626 B16R1.1696 CCCCNC(=O)C=Cc1ccccc1F 240690a_100000102301_100016256065 [0,1,0,0,0,1|1,0,1]=4 16627 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 11a_100000102301_100000740810 [0,1,0,0,0,1|1,0,0]=3 16628 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 1626a_100000102301_100000740810 [0,1,0,0,0,1|1,0,0]=3 16629 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 240690a_100000102301_100000740810 [0,1,0,0,0,1|1,0,0]=3 16630 B16R1.1696 CCCCNC(=O)CCc1ccccc1Br 527a_100000102301_100000740810 [0,1,0,0,0,1|1,0,0]=3 16631 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 11a_100000102301_100000748742 [0,1,0,0,0,1|1,0,0]=3 16632 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 1626a_100000102301_100000748742 [0,1,0,0,0,1|1,0,0]=3 16633 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 240690a_100000102301_100000748742 [0,1,0,0,0,1|1,0,0]=3 16634 B16R1.1696 CCCCNC(=O)CCc1ccccc1C 527a_100000102301_100000748742 [0,1,0,0,0,1|1,0,0]=3 16635 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 11a_100000102301_100000184300 [0,1,0,0,0,1|1,0,0]=3 16636 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 1626a_100000102301_100000184300 [0,1,0,0,0,1|1,0,0]=3 16637 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 240690a_100000102301_100000184300 [0,1,0,0,0,1|1,0,0]=3 16638 B16R1.1696 CCCCNC(=O)CCc1ccccc1Cl 527a_100000102301_100000184300 [0,1,0,0,0,1|1,0,0]=3 16639 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 11a_100000102301_100000189703 [0,1,0,0,0,1|1,0,0]=3 16640 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 1626a_100000102301_100000189703 [0,1,0,0,0,1|1,0,0]=3 16641 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 240690a_100000102301_100000189703 [0,1,0,0,0,1|1,0,0]=3 16642 B16R1.1696 CCCCNC(=O)CCc1ccccc1F 527a_100000102301_100000189703 [0,1,0,0,0,1|1,0,0]=3 16643 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 11a_100000102301_100000037306 [0,1,0,0,0,1|1,0,0]=3 16644 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 1626a_100000102301_100000037306 [0,1,0,0,0,1|1,0,0]=3 16645 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 240690a_100000102301_100000037306 [0,1,0,0,0,1|1,0,0]=3 16646 B16R1.1696 CCCCNC(=O)CCc1ccccc1I 527a_100000102301_100000037306 [0,1,0,0,0,1|1,0,0]=3 16647 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 11a_100000102301_100000181328 [0,1,0,0,0,1|1,0,0]=3 16648 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 240690a_100000102301_100000181328 [0,1,0,0,0,1|1,0,0]=3 16649 B16R1.1696 CCCCNC(=O)CCc1ccccc1O 527a_100000102301_100000181328 [0,1,0,0,0,1|1,0,0]=3 16650 B16R1.1696 CCCCNC(=O)CCn1ccccc1=O 11a_100000102301_100000738505 [0,1,0,0,0,1|2,0,0]=4 16651 B16R1.1696 CCCCNC(=O)CCn1ccccc1=O 1626a_100000102301_100000738505 [0,1,0,0,0,1|2,0,0]=4 16652 B16R1.1696 CCCCNC(=O)CCn1ccccc1=O 240690a_100000102301_100000738505 [0,1,0,0,0,1|2,0,0]=4 16653 B16R1.1696 CCCCNC(=O)CCn1ccccc1=O 527a_100000102301_100000738505 [0,1,0,0,0,1|2,0,0]=4 16654 B16R1.1696 CCCCNC(=O)CNc1ccccc1Br 34a_100000210017_100000182744 [0,1,0,0,0,1|1,0,0]=3 16655 B16R1.1696 CCCCNC(=O)CNc1ccccc1C 34a_100015192222_100000182744 [0,1,0,0,0,1|1,0,0]=3 16656 B16R1.1696 CCCCNC(=O)CNc1ccccc1Cl 34a_100000185783_100000182744 [0,1,0,0,0,1|1,0,0]=3 16657 B16R1.1696 CCCCNC(=O)CNc1ccccc1F 34a_100000210422_100000182744 [0,1,0,0,0,1|1,0,0]=3 16658 B16R1.1696 CCCCNC(=O)CNc1ccccc1I 34a_100000210053_100000182744 [0,1,0,0,0,1|1,0,0]=3 16659 B16R1.1696 CCCCNC(=O)CNc1ccccc1O 34a_100000185747_100000182744 [0,1,0,0,0,1|1,0,0]=3 16660 B16R1.1696 CCCCNC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000182744 [0,1,0,0,0,1|2,0,0]=4 16661 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 11a_100000102301_100000216496 [0,1,0,0,0,1|1,0,0]=3 16662 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 1626a_100000102301_100000216496 [0,1,0,0,0,1|1,0,0]=3 16663 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 240690a_100000102301_100000216496 [0,1,0,0,0,1|1,0,0]=3 16664 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 34a_100000181306_100000182744 [0,1,0,0,0,1|1,0,0]=3 16665 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 527a_100000102301_100000216496 [0,1,0,0,0,1|1,0,0]=3 16666 B16R1.1696 CCCCNC(=O)COc1ccccc1Br 7a_100000181306_100000182744 [0,1,0,0,0,1|1,0,0]=3 16667 B16R1.1696 CCCCNC(=O)COc1ccccc1C 11a_100000102301_100000182418 [0,1,0,0,0,1|1,0,0]=3 16668 B16R1.1696 CCCCNC(=O)COc1ccccc1C 1626a_100000102301_100000182418 [0,1,0,0,0,1|1,0,0]=3 16669 B16R1.1696 CCCCNC(=O)COc1ccccc1C 240690a_100000102301_100000182418 [0,1,0,0,0,1|1,0,0]=3 16670 B16R1.1696 CCCCNC(=O)COc1ccccc1C 34a_100000210338_100000182744 [0,1,0,0,0,1|1,0,0]=3 16671 B16R1.1696 CCCCNC(=O)COc1ccccc1C 527a_100000102301_100000182418 [0,1,0,0,0,1|1,0,0]=3 16672 B16R1.1696 CCCCNC(=O)COc1ccccc1C 7a_100000210338_100000182744 [0,1,0,0,0,1|1,0,0]=3 16673 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 11a_100000102301_100000185159 [0,1,0,0,0,1|1,0,0]=3 16674 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 1626a_100000102301_100000185159 [0,1,0,0,0,1|1,0,0]=3 16675 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 240690a_100000102301_100000185159 [0,1,0,0,0,1|1,0,0]=3 16676 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 34a_100000210172_100000182744 [0,1,0,0,0,1|1,0,0]=3 16677 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 527a_100000102301_100000185159 [0,1,0,0,0,1|1,0,0]=3 16678 B16R1.1696 CCCCNC(=O)COc1ccccc1Cl 7a_100000210172_100000182744 [0,1,0,0,0,1|1,0,0]=3 16679 B16R1.1696 CCCCNC(=O)COc1ccccc1F 11a_100000102301_100000182486 [0,1,0,0,0,1|1,0,0]=3 16680 B16R1.1696 CCCCNC(=O)COc1ccccc1F 1626a_100000102301_100000182486 [0,1,0,0,0,1|1,0,0]=3 16681 B16R1.1696 CCCCNC(=O)COc1ccccc1F 240690a_100000102301_100000182486 [0,1,0,0,0,1|1,0,0]=3 16682 B16R1.1696 CCCCNC(=O)COc1ccccc1F 34a_100000210171_100000182744 [0,1,0,0,0,1|1,0,0]=3 16683 B16R1.1696 CCCCNC(=O)COc1ccccc1F 527a_100000102301_100000182486 [0,1,0,0,0,1|1,0,0]=3 16684 B16R1.1696 CCCCNC(=O)COc1ccccc1F 7a_100000210171_100000182744 [0,1,0,0,0,1|1,0,0]=3 16685 B16R1.1696 CCCCNC(=O)COc1ccccc1I 34a_100000739446_100000182744 [0,1,0,0,0,1|1,0,0]=3 16686 B16R1.1696 CCCCNC(=O)COc1ccccc1I 7a_100000739446_100000182744 [0,1,0,0,0,1|1,0,0]=3 16687 B16R1.1696 CCCCNC(=O)COc1ccccc1N 34a_100000185747_100000182744 [0,1,0,0,0,1|1,0,0]=3 16688 B16R1.1696 CCCCNC(=O)COc1ccccc1N 7a_100000185747_100000182744 [0,1,0,0,0,1|1,0,0]=3 16689 B16R1.1696 CCCCNC(=O)COc1ccccc1O 240690a_100000102301_100000183020 [0,1,0,0,0,1|1,0,0]=3 16690 B16R1.1696 CCCCNC(=O)COc1ccccc1O 527a_100000102301_100000183020 [0,1,0,0,0,1|1,0,0]=3 16691 B16R1.1696 CCCCNC(=O)COc1cccnc1Br 34a_100000744436_100000182744 [0,1,0,0,0,1|2,0,0]=4 16692 B16R1.1696 CCCCNC(=O)COc1cccnc1Br 7a_100000744436_100000182744 [0,1,0,0,0,1|2,0,0]=4 16693 B16R1.1696 CCCCNC(=O)COc1cccnc1C 34a_100000745507_100000182744 [0,1,0,0,0,1|2,0,0]=4 16694 B16R1.1696 CCCCNC(=O)COc1cccnc1C 7a_100000745507_100000182744 [0,1,0,0,0,1|2,0,0]=4 16695 B16R1.1696 CCCCNC(=O)COc1cccnc1Cl 34a_100000757616_100000182744 [0,1,0,0,0,1|2,0,0]=4 16696 B16R1.1696 CCCCNC(=O)COc1cccnc1Cl 7a_100000757616_100000182744 [0,1,0,0,0,1|2,0,0]=4 16697 B16R1.1696 CCCCNC(=O)COc1cccnc1F 34a_100000061740_100000182744 [0,1,0,0,0,1|2,0,0]=4 16698 B16R1.1696 CCCCNC(=O)COc1cccnc1F 7a_100000061740_100000182744 [0,1,0,0,0,1|2,0,0]=4 16699 B16R1.1696 CCCCNC(=O)COc1cccnc1I 34a_100000034122_100000182744 [0,1,0,0,0,1|2,0,0]=4 16700 B16R1.1696 CCCCNC(=O)COc1cccnc1I 7a_100000034122_100000182744 [0,1,0,0,0,1|2,0,0]=4 16701 B16R1.1696 CCCCNC(=O)COc1cccnc1N 34a_100000211975_100000182744 [0,1,0,0,0,1|2,0,0]=4 16702 B16R1.1696 CCCCNC(=O)COc1cccnc1N 7a_100000211975_100000182744 [0,1,0,0,0,1|2,0,0]=4 16703 B16R1.1696 CCCCNC(=O)COc1cccoc1=O 34a_100000077404_100000182744 [0,1,0,0,0,1|2,0,0]=4 16704 B16R1.1696 CCCCNC(=O)COc1cccoc1=O 7a_100000077404_100000182744 [0,1,0,0,0,1|2,0,0]=4 16705 B16R1.1696 CCCCNC(=O)COc1ccncc1Br 34a_100011996408_100000182744 [0,1,0,0,0,1|2,0,0]=4 16706 B16R1.1696 CCCCNC(=O)COc1ccncc1C 34a_100000694293_100000182744 [0,1,0,0,0,1|2,0,0]=4 16707 B16R1.1696 CCCCNC(=O)COc1ccncc1Cl 34a_100011997054_100000182744 [0,1,0,0,0,1|2,0,0]=4 16708 B16R1.1696 CCCCNC(=O)COc1ccncc1F 34a_200000081243_100000182744 [0,1,0,0,0,1|2,0,0]=4 16709 B16R1.1696 CCCCNC(=O)COc1cnccc1C 34a_100011997053_100000182744 [0,1,0,0,0,1|2,0,0]=4 16710 B16R1.1696 CCCCNC(=O)COc1cnccc1C 7a_100011997053_100000182744 [0,1,0,0,0,1|2,0,0]=4 16711 B16R1.1696 CCCCNC(=O)COc1cnccc1Cl 34a_100011996695_100000182744 [0,1,0,0,0,1|2,0,0]=4 16712 B16R1.1696 CCCCNC(=O)COc1cnccc1I 34a_100000050107_100000182744 [0,1,0,0,0,1|2,0,0]=4 16713 B16R1.1696 CCCCNC(=O)COc1cnccc1N 34a_100000753702_100000182744 [0,1,0,0,0,1|2,0,0]=4 16714 B16R1.1696 CCCCNC(=O)COc1coccc1=O 34a_100000060831_100000182744 [0,1,0,0,0,1|2,0,0]=4 16715 B16R1.1696 CCCCNC(=O)COc1ncccc1Cl 34a_100011290957_100000182744 [0,1,0,0,0,1|2,0,0]=4 16716 B16R1.1696 CCCCNC(=O)COc1ncccc1F 34a_100011219419_100000182744 [0,1,0,0,0,1|2,0,0]=4 16717 B16R1.1696 CCCCNC(=O)COc1ncccc1N 34a_100000746358_100000182744 [0,1,0,0,0,1|2,0,0]=4 16718 B16R1.1696 CCCCNC(=O)CSc1c[nH]ccc1=O 62a_100000182744_100009998708 [0,1,0,0,0,1|2,0,0]=4 16719 B16R1.1696 CCCCNC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000182744 [0,1,0,0,0,1|2,0,0]=4 16720 B16R1.1696 CCCCNC(=O)CSc1c[nH]ccc1=S 62a_100000182744_200012280681 [0,1,0,0,0,1|2,0,0]=4 16721 B16R1.1696 CCCCNC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000182744 [0,1,0,0,0,1|2,0,0]=4 16722 B16R1.1696 CCCCNC(=O)CSc1cccc[n+]1C 62a_100000182744_100000212160 [0,1,0,0,0,1|2,0,0]=4 16723 B16R1.1696 CCCCNC(=O)CSc1cccc[n+]1[O-] 62a_100000182744_200000042595 [0,1,0,0,0,1|2,0,0]=4 16724 B16R1.1696 CCCCNC(=O)CSc1ccccc1Br 62a_100000182744_100000695589 [0,1,0,0,0,1|1,0,0]=3 16725 B16R1.1696 CCCCNC(=O)CSc1ccccc1Br 62a_100000695589_100000182744 [0,1,0,0,0,1|1,0,0]=3 16726 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 11a_100000102301_100000183026 [0,1,0,0,0,1|1,0,0]=3 16727 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 1626a_100000102301_100000183026 [0,1,0,0,0,1|1,0,0]=3 16728 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 240690a_100000102301_100000183026 [0,1,0,0,0,1|1,0,0]=3 16729 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 527a_100000102301_100000183026 [0,1,0,0,0,1|1,0,0]=3 16730 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 62a_100000182744_100000210755 [0,1,0,0,0,1|1,0,0]=3 16731 B16R1.1696 CCCCNC(=O)CSc1ccccc1C 62a_100000210755_100000182744 [0,1,0,0,0,1|1,0,0]=3 16732 B16R1.1696 CCCCNC(=O)CSc1ccccc1Cl 62a_100000182744_100000764095 [0,1,0,0,0,1|1,0,0]=3 16733 B16R1.1696 CCCCNC(=O)CSc1ccccc1Cl 62a_100000764095_100000182744 [0,1,0,0,0,1|1,0,0]=3 16734 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 11a_100000102301_100000179528 [0,1,0,0,0,1|1,0,0]=3 16735 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 1626a_100000102301_100000179528 [0,1,0,0,0,1|1,0,0]=3 16736 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 240690a_100000102301_100000179528 [0,1,0,0,0,1|1,0,0]=3 16737 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 62a_100000182744_100011215700 [0,1,0,0,0,1|1,0,0]=3 16738 B16R1.1696 CCCCNC(=O)CSc1ccccc1F 62a_100011215700_100000182744 [0,1,0,0,0,1|1,0,0]=3 16739 B16R1.1696 CCCCNC(=O)CSc1ccccc1N 62a_100000182744_100000210017 [0,1,0,0,0,1|1,0,0]=3 16740 B16R1.1696 CCCCNC(=O)CSc1ccccc1N 62a_100000210017_100000182744 [0,1,0,0,0,1|1,0,0]=3 16741 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 240690a_100000102301_100000695322 [0,1,0,0,0,1|1,0,0]=3 16742 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 527a_100000102301_100000695322 [0,1,0,0,0,1|1,0,0]=3 16743 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 62a_100000182744_100000739446 [0,1,0,0,0,1|1,0,0]=3 16744 B16R1.1696 CCCCNC(=O)CSc1ccccc1O 62a_100000739446_100000182744 [0,1,0,0,0,1|1,0,0]=3 16745 B16R1.1696 CCCCNC(=O)CSc1cccnc1Br 62a_100000182744_100010202626 [0,1,0,0,0,1|2,0,0]=4 16746 B16R1.1696 CCCCNC(=O)CSc1cccnc1Br 62a_100010202626_100000182744 [0,1,0,0,0,1|2,0,0]=4 16747 B16R1.1696 CCCCNC(=O)CSc1cccnc1C 62a_100000182744_100000751574 [0,1,0,0,0,1|2,0,0]=4 16748 B16R1.1696 CCCCNC(=O)CSc1cccnc1C 62a_100000751574_100000182744 [0,1,0,0,0,1|2,0,0]=4 16749 B16R1.1696 CCCCNC(=O)CSc1cccnc1Cl 62a_100000036424_100000182744 [0,1,0,0,0,1|2,0,0]=4 16750 B16R1.1696 CCCCNC(=O)CSc1cccnc1Cl 62a_100000182744_100000036424 [0,1,0,0,0,1|2,0,0]=4 16751 B16R1.1696 CCCCNC(=O)CSc1cccnc1F 62a_100000182744_100009816115 [0,1,0,0,0,1|2,0,0]=4 16752 B16R1.1696 CCCCNC(=O)CSc1cccnc1F 62a_100009816115_100000182744 [0,1,0,0,0,1|2,0,0]=4 16753 B16R1.1696 CCCCNC(=O)CSc1cccnc1N 62a_100000045569_100000182744 [0,1,0,0,0,1|2,0,0]=4 16754 B16R1.1696 CCCCNC(=O)CSc1cccnc1N 62a_100000182744_100000045569 [0,1,0,0,0,1|2,0,0]=4 16755 B16R1.1696 CCCCNC(=O)CSc1cccnc1O 62a_100000182744_100000760158 [0,1,0,0,0,1|2,0,0]=4 16756 B16R1.1696 CCCCNC(=O)CSc1cccnc1O 62a_100000760158_100000182744 [0,1,0,0,0,1|2,0,0]=4 16757 B16R1.1696 CCCCNC(=O)CSc1ccncc1Br 62a_100000182744_100000726257 [0,1,0,0,0,1|2,0,0]=4 16758 B16R1.1696 CCCCNC(=O)CSc1ccncc1Br 62a_100000726257_100000182744 [0,1,0,0,0,1|2,0,0]=4 16759 B16R1.1696 CCCCNC(=O)CSc1ccncc1C 62a_100000182744_100000765111 [0,1,0,0,0,1|2,0,0]=4 16760 B16R1.1696 CCCCNC(=O)CSc1ccncc1C 62a_100000765111_100000182744 [0,1,0,0,0,1|2,0,0]=4 16761 B16R1.1696 CCCCNC(=O)CSc1ccncc1Cl 62a_100000182744_100000708259 [0,1,0,0,0,1|2,0,0]=4 16762 B16R1.1696 CCCCNC(=O)CSc1ccncc1Cl 62a_100000708259_100000182744 [0,1,0,0,0,1|2,0,0]=4 16763 B16R1.1696 CCCCNC(=O)CSc1ccncc1F 62a_100000047030_100000182744 [0,1,0,0,0,1|2,0,0]=4 16764 B16R1.1696 CCCCNC(=O)CSc1ccncc1F 62a_100000182744_100000047030 [0,1,0,0,0,1|2,0,0]=4 16765 B16R1.1696 CCCCNC(=O)CSc1ccncc1N 62a_100000182744_100000756074 [0,1,0,0,0,1|2,0,0]=4 16766 B16R1.1696 CCCCNC(=O)CSc1ccncc1N 62a_100000756074_100000182744 [0,1,0,0,0,1|2,0,0]=4 16767 B16R1.1696 CCCCNC(=O)CSc1ccncc1O 62a_100000182744_100009817591 [0,1,0,0,0,1|2,0,0]=4 16768 B16R1.1696 CCCCNC(=O)CSc1ccncc1O 62a_100009817591_100000182744 [0,1,0,0,0,1|2,0,0]=4 16769 B16R1.1696 CCCCNC(=O)CSc1cnccc1Br 62a_100000182744_100010138639 [0,1,0,0,0,1|2,0,0]=4 16770 B16R1.1696 CCCCNC(=O)CSc1cnccc1Br 62a_100010138639_100000182744 [0,1,0,0,0,1|2,0,0]=4 16771 B16R1.1696 CCCCNC(=O)CSc1cnccc1C 62a_100000182744_100000761580 [0,1,0,0,0,1|2,0,0]=4 16772 B16R1.1696 CCCCNC(=O)CSc1cnccc1C 62a_100000761580_100000182744 [0,1,0,0,0,1|2,0,0]=4 16773 B16R1.1696 CCCCNC(=O)CSc1cnccc1Cl 62a_100000182744_100009995489 [0,1,0,0,0,1|2,0,0]=4 16774 B16R1.1696 CCCCNC(=O)CSc1cnccc1Cl 62a_100009995489_100000182744 [0,1,0,0,0,1|2,0,0]=4 16775 B16R1.1696 CCCCNC(=O)CSc1cnccc1F 62a_100000182744_100009820683 [0,1,0,0,0,1|2,0,0]=4 16776 B16R1.1696 CCCCNC(=O)CSc1cnccc1F 62a_100009820683_100000182744 [0,1,0,0,0,1|2,0,0]=4 16777 B16R1.1696 CCCCNC(=O)CSc1cnccc1N 62a_100000047001_100000182744 [0,1,0,0,0,1|2,0,0]=4 16778 B16R1.1696 CCCCNC(=O)CSc1cnccc1N 62a_100000182744_100000047001 [0,1,0,0,0,1|2,0,0]=4 16779 B16R1.1696 CCCCNC(=O)CSc1ncccc1Br 62a_100000182744_100000696092 [0,1,0,0,0,1|2,0,0]=4 16780 B16R1.1696 CCCCNC(=O)CSc1ncccc1Br 62a_100000696092_100000182744 [0,1,0,0,0,1|2,0,0]=4 16781 B16R1.1696 CCCCNC(=O)CSc1ncccc1C 62a_100000182744_100000751373 [0,1,0,0,0,1|2,0,0]=4 16782 B16R1.1696 CCCCNC(=O)CSc1ncccc1C 62a_100000751373_100000182744 [0,1,0,0,0,1|2,0,0]=4 16783 B16R1.1696 CCCCNC(=O)CSc1ncccc1Cl 62a_100000182744_100011356963 [0,1,0,0,0,1|2,0,0]=4 16784 B16R1.1696 CCCCNC(=O)CSc1ncccc1Cl 62a_100011356963_100000182744 [0,1,0,0,0,1|2,0,0]=4 16785 B16R1.1696 CCCCNC(=O)CSc1ncccc1F 62a_100000182744_100000685392 [0,1,0,0,0,1|2,0,0]=4 16786 B16R1.1696 CCCCNC(=O)CSc1ncccc1F 62a_100000685392_100000182744 [0,1,0,0,0,1|2,0,0]=4 16787 B16R1.1696 CCCCNC(=O)CSc1ncccc1N 62a_100000182744_100000688686 [0,1,0,0,0,1|2,0,0]=4 16788 B16R1.1696 CCCCNC(=O)CSc1ncccc1N 62a_100000688686_100000182744 [0,1,0,0,0,1|2,0,0]=4 16789 B16R1.1696 CCCCNC(=O)CSc1ncccc1O 62a_100000034122_100000182744 [0,1,0,0,0,1|2,0,0]=4 16790 B16R1.1696 CCCCNC(=O)CSc1ncccc1O 62a_100000182744_100000034122 [0,1,0,0,0,1|2,0,0]=4 16791 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 2708a_100000102301_100000689332 [0,1,0,0,0,1|1,0,0]=3 16792 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 2708a_100000689332_100000102301 [0,1,0,0,0,1|1,0,0]=3 16793 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 273464a_100000102301_100000689332 [0,1,0,0,0,1|1,0,0]=3 16794 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 273464a_100000689332_100000102301 [0,1,0,0,0,1|1,0,0]=3 16795 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 512a_100000102301_100000689332 [0,1,0,0,0,1|1,0,0]=3 16796 B16R1.1696 CCCCNC(=O)NCc1ccccc1Br 512a_100000689332_100000102301 [0,1,0,0,0,1|1,0,0]=3 16797 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 2708a_100000102301_100000174972 [0,1,0,0,0,1|1,0,0]=3 16798 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 2708a_100000174972_100000102301 [0,1,0,0,0,1|1,0,0]=3 16799 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 273464a_100000102301_100000174972 [0,1,0,0,0,1|1,0,0]=3 16800 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 273464a_100000174972_100000102301 [0,1,0,0,0,1|1,0,0]=3 16801 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 512a_100000102301_100000174972 [0,1,0,0,0,1|1,0,0]=3 16802 B16R1.1696 CCCCNC(=O)NCc1ccccc1C 512a_100000174972_100000102301 [0,1,0,0,0,1|1,0,0]=3 16803 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 2708a_100000102301_100000174879 [0,1,0,0,0,1|1,0,0]=3 16804 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100000102301 [0,1,0,0,0,1|1,0,0]=3 16805 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 273464a_100000102301_100000174879 [0,1,0,0,0,1|1,0,0]=3 16806 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100000102301 [0,1,0,0,0,1|1,0,0]=3 16807 B16R1.1696 CCCCNC(=O)NCc1ccccc1Cl 512a_100000102301_100000174879 [0,1,0,0,0,1|1,0,0]=3 16808 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 2708a_100000102301_100000174869 [0,1,0,0,0,1|1,0,0]=3 16809 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 2708a_100000174869_100000102301 [0,1,0,0,0,1|1,0,0]=3 16810 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 273464a_100000102301_100000174869 [0,1,0,0,0,1|1,0,0]=3 16811 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 273464a_100000174869_100000102301 [0,1,0,0,0,1|1,0,0]=3 16812 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 512a_100000102301_100000174869 [0,1,0,0,0,1|1,0,0]=3 16813 B16R1.1696 CCCCNC(=O)NCc1ccccc1F 512a_100000174869_100000102301 [0,1,0,0,0,1|1,0,0]=3 16814 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 2708a_100000102301_100015347259 [0,1,0,0,0,1|1,0,0]=3 16815 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 2708a_100015347259_100000102301 [0,1,0,0,0,1|1,0,0]=3 16816 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 273464a_100000102301_100015347259 [0,1,0,0,0,1|1,0,0]=3 16817 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 273464a_100015347259_100000102301 [0,1,0,0,0,1|1,0,0]=3 16818 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 512a_100000102301_100015347259 [0,1,0,0,0,1|1,0,0]=3 16819 B16R1.1696 CCCCNC(=O)NCc1ccccc1I 512a_100015347259_100000102301 [0,1,0,0,0,1|1,0,0]=3 16820 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 2708a_100000102301_100000185550 [0,1,0,0,0,1|1,0,0]=3 16821 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 2708a_100000185550_100000102301 [0,1,0,0,0,1|1,0,0]=3 16822 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 273464a_100000102301_100000185550 [0,1,0,0,0,1|1,0,0]=3 16823 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 273464a_100000185550_100000102301 [0,1,0,0,0,1|1,0,0]=3 16824 B16R1.1696 CCCCNC(=O)NCc1ccccc1O 512a_100000185550_100000102301 [0,1,0,0,0,1|1,0,0]=3 16825 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 2708a_100000102301_100009818023 [0,1,0,0,0,1|2,0,0]=4 16826 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 2708a_100009818023_100000102301 [0,1,0,0,0,1|2,0,0]=4 16827 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 273464a_100000102301_100009818023 [0,1,0,0,0,1|2,0,0]=4 16828 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 273464a_100009818023_100000102301 [0,1,0,0,0,1|2,0,0]=4 16829 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 512a_100000102301_100009818023 [0,1,0,0,0,1|2,0,0]=4 16830 B16R1.1696 CCCCNC(=O)NCc1cccnc1Br 512a_100009818023_100000102301 [0,1,0,0,0,1|2,0,0]=4 16831 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 2708a_100000102301_100015189234 [0,1,0,0,0,1|2,0,0]=4 16832 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 2708a_100015189234_100000102301 [0,1,0,0,0,1|2,0,0]=4 16833 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 273464a_100000102301_100015189234 [0,1,0,0,0,1|2,0,0]=4 16834 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 273464a_100015189234_100000102301 [0,1,0,0,0,1|2,0,0]=4 16835 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 512a_100000102301_100015189234 [0,1,0,0,0,1|2,0,0]=4 16836 B16R1.1696 CCCCNC(=O)NCc1cccnc1Cl 512a_100015189234_100000102301 [0,1,0,0,0,1|2,0,0]=4 16837 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 2708a_100000102301_100000724633 [0,1,0,0,0,1|2,0,0]=4 16838 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 2708a_100000724633_100000102301 [0,1,0,0,0,1|2,0,0]=4 16839 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 273464a_100000102301_100000724633 [0,1,0,0,0,1|2,0,0]=4 16840 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 273464a_100000724633_100000102301 [0,1,0,0,0,1|2,0,0]=4 16841 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 512a_100000102301_100000724633 [0,1,0,0,0,1|2,0,0]=4 16842 B16R1.1696 CCCCNC(=O)NCc1cccnc1F 512a_100000724633_100000102301 [0,1,0,0,0,1|2,0,0]=4 16843 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 2708a_100000102301_100020640021 [0,1,0,0,0,1|2,0,0]=4 16844 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 2708a_100020640021_100000102301 [0,1,0,0,0,1|2,0,0]=4 16845 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 273464a_100000102301_100020640021 [0,1,0,0,0,1|2,0,0]=4 16846 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 273464a_100020640021_100000102301 [0,1,0,0,0,1|2,0,0]=4 16847 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 512a_100000102301_100020640021 [0,1,0,0,0,1|2,0,0]=4 16848 B16R1.1696 CCCCNC(=O)NCc1ccncc1Br 512a_100020640021_100000102301 [0,1,0,0,0,1|2,0,0]=4 16849 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 2708a_100000102301_100000708811 [0,1,0,0,0,1|2,0,0]=4 16850 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 2708a_100000708811_100000102301 [0,1,0,0,0,1|2,0,0]=4 16851 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 273464a_100000102301_100000708811 [0,1,0,0,0,1|2,0,0]=4 16852 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 273464a_100000708811_100000102301 [0,1,0,0,0,1|2,0,0]=4 16853 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 512a_100000102301_100000708811 [0,1,0,0,0,1|2,0,0]=4 16854 B16R1.1696 CCCCNC(=O)NCc1ccncc1C 512a_100000708811_100000102301 [0,1,0,0,0,1|2,0,0]=4 16855 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 2708a_100000102301_100011935246 [0,1,0,0,0,1|2,0,0]=4 16856 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 2708a_100011935246_100000102301 [0,1,0,0,0,1|2,0,0]=4 16857 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 273464a_100000102301_100011935246 [0,1,0,0,0,1|2,0,0]=4 16858 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 273464a_100011935246_100000102301 [0,1,0,0,0,1|2,0,0]=4 16859 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 512a_100000102301_100011935246 [0,1,0,0,0,1|2,0,0]=4 16860 B16R1.1696 CCCCNC(=O)NCc1ccncc1F 512a_100011935246_100000102301 [0,1,0,0,0,1|2,0,0]=4 16861 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 2708a_100000102301_100011997553 [0,1,0,0,0,1|2,0,0]=4 16862 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 2708a_100011997553_100000102301 [0,1,0,0,0,1|2,0,0]=4 16863 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 273464a_100000102301_100011997553 [0,1,0,0,0,1|2,0,0]=4 16864 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 273464a_100011997553_100000102301 [0,1,0,0,0,1|2,0,0]=4 16865 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 512a_100000102301_100011997553 [0,1,0,0,0,1|2,0,0]=4 16866 B16R1.1696 CCCCNC(=O)NCc1cnccc1C 512a_100011997553_100000102301 [0,1,0,0,0,1|2,0,0]=4 16867 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 2708a_100000102301_100020591323 [0,1,0,0,0,1|2,0,0]=4 16868 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 2708a_100020591323_100000102301 [0,1,0,0,0,1|2,0,0]=4 16869 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 273464a_100000102301_100020591323 [0,1,0,0,0,1|2,0,0]=4 16870 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 273464a_100020591323_100000102301 [0,1,0,0,0,1|2,0,0]=4 16871 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 512a_100000102301_100020591323 [0,1,0,0,0,1|2,0,0]=4 16872 B16R1.1696 CCCCNC(=O)NCc1ncccc1Br 512a_100020591323_100000102301 [0,1,0,0,0,1|2,0,0]=4 16873 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 2708a_100000102301_100011223789 [0,1,0,0,0,1|2,0,0]=4 16874 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 2708a_100011223789_100000102301 [0,1,0,0,0,1|2,0,0]=4 16875 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 273464a_100000102301_100011223789 [0,1,0,0,0,1|2,0,0]=4 16876 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 273464a_100011223789_100000102301 [0,1,0,0,0,1|2,0,0]=4 16877 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 512a_100000102301_100011223789 [0,1,0,0,0,1|2,0,0]=4 16878 B16R1.1696 CCCCNC(=O)NCc1ncccc1C 512a_100011223789_100000102301 [0,1,0,0,0,1|2,0,0]=4 16879 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 2708a_100000102301_100015189233 [0,1,0,0,0,1|2,0,0]=4 16880 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 2708a_100015189233_100000102301 [0,1,0,0,0,1|2,0,0]=4 16881 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 273464a_100000102301_100015189233 [0,1,0,0,0,1|2,0,0]=4 16882 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 273464a_100015189233_100000102301 [0,1,0,0,0,1|2,0,0]=4 16883 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 512a_100000102301_100015189233 [0,1,0,0,0,1|2,0,0]=4 16884 B16R1.1696 CCCCNC(=O)NCc1ncccc1Cl 512a_100015189233_100000102301 [0,1,0,0,0,1|2,0,0]=4 16885 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 2708a_100000102301_100000690088 [0,1,0,0,0,1|2,0,0]=4 16886 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 2708a_100000690088_100000102301 [0,1,0,0,0,1|2,0,0]=4 16887 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 273464a_100000102301_100000690088 [0,1,0,0,0,1|2,0,0]=4 16888 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 273464a_100000690088_100000102301 [0,1,0,0,0,1|2,0,0]=4 16889 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 512a_100000102301_100000690088 [0,1,0,0,0,1|2,0,0]=4 16890 B16R1.1696 CCCCNC(=O)NCc1ncccc1F 512a_100000690088_100000102301 [0,1,0,0,0,1|2,0,0]=4 16891 B16R1.1696 CCCCNC(=O)NNc1ccccc1Br 273464a_100000102301_100000241748 [0,1,0,0,0,1|2,0,0]=4 16892 B16R1.1696 CCCCNC(=O)NNc1ccccc1Br 512a_100000102301_100000241748 [0,1,0,0,0,1|2,0,0]=4 16893 B16R1.1696 CCCCNC(=O)NNc1ccccc1C 273464a_100000102301_100000184220 [0,1,0,0,0,1|2,0,0]=4 16894 B16R1.1696 CCCCNC(=O)NNc1ccccc1C 512a_100000102301_100000184220 [0,1,0,0,0,1|2,0,0]=4 16895 B16R1.1696 CCCCNC(=O)NNc1ccccc1Cl 273464a_100000102301_100000683529 [0,1,0,0,0,1|2,0,0]=4 16896 B16R1.1696 CCCCNC(=O)NNc1ccccc1Cl 512a_100000102301_100000683529 [0,1,0,0,0,1|2,0,0]=4 16897 B16R1.1696 CCCCNC(=O)NNc1ccccc1F 273464a_100000102301_100000239246 [0,1,0,0,0,1|2,0,0]=4 16898 B16R1.1696 CCCCNC(=O)NNc1ccccc1F 512a_100000102301_100000239246 [0,1,0,0,0,1|2,0,0]=4 16899 B16R1.1696 CCCCNC(=O)NNc1ccccc1I 273464a_100000102301_100011218156 [0,1,0,0,0,1|2,0,0]=4 16900 B16R1.1696 CCCCNC(=O)NNc1ccccc1I 512a_100000102301_100011218156 [0,1,0,0,0,1|2,0,0]=4 16901 B16R1.1696 CCCCOC(=O)CNc1ccccc1Br 34a_100000210017_100000211628 [0,1,0,0,0,1|0,0,0]=2 16902 B16R1.1696 CCCCOC(=O)CNc1ccccc1C 34a_100015192222_100000211628 [0,1,0,0,0,1|0,0,0]=2 16903 B16R1.1696 CCCCOC(=O)CNc1ccccc1Cl 34a_100000185783_100000211628 [0,1,0,0,0,1|0,0,0]=2 16904 B16R1.1696 CCCCOC(=O)CNc1ccccc1F 34a_100000210422_100000211628 [0,1,0,0,0,1|0,0,0]=2 16905 B16R1.1696 CCCCOC(=O)CNc1ccccc1I 34a_100000210053_100000211628 [0,1,0,0,0,1|0,0,0]=2 16906 B16R1.1696 CCCCOC(=O)CNc1ccccc1O 34a_100000185747_100000211628 [0,1,0,0,0,1|0,0,0]=2 16907 B16R1.1696 CCCCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_100000211628 [0,1,0,0,0,1|1,0,0]=3 16908 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 34a_100000181306_100000211628 [0,1,0,0,0,1|0,0,0]=2 16909 B16R1.1696 CCCCOC(=O)COc1ccccc1Br 7a_100000181306_100000211628 [0,1,0,0,0,1|0,0,0]=2 16910 B16R1.1696 CCCCOC(=O)COc1ccccc1C 34a_100000210338_100000211628 [0,1,0,0,0,1|0,0,0]=2 16911 B16R1.1696 CCCCOC(=O)COc1ccccc1C 7a_100000210338_100000211628 [0,1,0,0,0,1|0,0,0]=2 16912 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 34a_100000210172_100000211628 [0,1,0,0,0,1|0,0,0]=2 16913 B16R1.1696 CCCCOC(=O)COc1ccccc1Cl 7a_100000210172_100000211628 [0,1,0,0,0,1|0,0,0]=2 16914 B16R1.1696 CCCCOC(=O)COc1ccccc1F 34a_100000210171_100000211628 [0,1,0,0,0,1|0,0,0]=2 16915 B16R1.1696 CCCCOC(=O)COc1ccccc1F 7a_100000210171_100000211628 [0,1,0,0,0,1|0,0,0]=2 16916 B16R1.1696 CCCCOC(=O)COc1ccccc1I 34a_100000739446_100000211628 [0,1,0,0,0,1|0,0,0]=2 16917 B16R1.1696 CCCCOC(=O)COc1ccccc1I 7a_100000739446_100000211628 [0,1,0,0,0,1|0,0,0]=2 16918 B16R1.1696 CCCCOC(=O)COc1ccccc1N 34a_100000185747_100000211628 [0,1,0,0,0,1|0,0,0]=2 16919 B16R1.1696 CCCCOC(=O)COc1ccccc1N 7a_100000185747_100000211628 [0,1,0,0,0,1|0,0,0]=2 16920 B16R1.1696 CCCCOC(=O)COc1cccnc1Br 34a_100000744436_100000211628 [0,1,0,0,0,1|1,0,0]=3 16921 B16R1.1696 CCCCOC(=O)COc1cccnc1Br 7a_100000744436_100000211628 [0,1,0,0,0,1|1,0,0]=3 16922 B16R1.1696 CCCCOC(=O)COc1cccnc1C 34a_100000745507_100000211628 [0,1,0,0,0,1|1,0,0]=3 16923 B16R1.1696 CCCCOC(=O)COc1cccnc1C 7a_100000745507_100000211628 [0,1,0,0,0,1|1,0,0]=3 16924 B16R1.1696 CCCCOC(=O)COc1cccnc1Cl 34a_100000757616_100000211628 [0,1,0,0,0,1|1,0,0]=3 16925 B16R1.1696 CCCCOC(=O)COc1cccnc1Cl 7a_100000757616_100000211628 [0,1,0,0,0,1|1,0,0]=3 16926 B16R1.1696 CCCCOC(=O)COc1cccnc1F 34a_100000061740_100000211628 [0,1,0,0,0,1|1,0,0]=3 16927 B16R1.1696 CCCCOC(=O)COc1cccnc1F 7a_100000061740_100000211628 [0,1,0,0,0,1|1,0,0]=3 16928 B16R1.1696 CCCCOC(=O)COc1cccnc1I 34a_100000034122_100000211628 [0,1,0,0,0,1|1,0,0]=3 16929 B16R1.1696 CCCCOC(=O)COc1cccnc1I 7a_100000034122_100000211628 [0,1,0,0,0,1|1,0,0]=3 16930 B16R1.1696 CCCCOC(=O)COc1cccnc1N 34a_100000211975_100000211628 [0,1,0,0,0,1|1,0,0]=3 16931 B16R1.1696 CCCCOC(=O)COc1cccnc1N 7a_100000211975_100000211628 [0,1,0,0,0,1|1,0,0]=3 16932 B16R1.1696 CCCCOC(=O)COc1cccoc1=O 34a_100000077404_100000211628 [0,1,0,0,0,1|1,0,0]=3 16933 B16R1.1696 CCCCOC(=O)COc1cccoc1=O 7a_100000077404_100000211628 [0,1,0,0,0,1|1,0,0]=3 16934 B16R1.1696 CCCCOC(=O)COc1ccncc1Br 34a_100011996408_100000211628 [0,1,0,0,0,1|1,0,0]=3 16935 B16R1.1696 CCCCOC(=O)COc1ccncc1C 34a_100000694293_100000211628 [0,1,0,0,0,1|1,0,0]=3 16936 B16R1.1696 CCCCOC(=O)COc1ccncc1Cl 34a_100011997054_100000211628 [0,1,0,0,0,1|1,0,0]=3 16937 B16R1.1696 CCCCOC(=O)COc1ccncc1F 34a_200000081243_100000211628 [0,1,0,0,0,1|1,0,0]=3 16938 B16R1.1696 CCCCOC(=O)COc1cnccc1C 34a_100011997053_100000211628 [0,1,0,0,0,1|1,0,0]=3 16939 B16R1.1696 CCCCOC(=O)COc1cnccc1C 7a_100011997053_100000211628 [0,1,0,0,0,1|1,0,0]=3 16940 B16R1.1696 CCCCOC(=O)COc1cnccc1Cl 34a_100011996695_100000211628 [0,1,0,0,0,1|1,0,0]=3 16941 B16R1.1696 CCCCOC(=O)COc1cnccc1I 34a_100000050107_100000211628 [0,1,0,0,0,1|1,0,0]=3 16942 B16R1.1696 CCCCOC(=O)COc1cnccc1N 34a_100000753702_100000211628 [0,1,0,0,0,1|1,0,0]=3 16943 B16R1.1696 CCCCOC(=O)COc1cncnc1N 7a_100000112926_100000211628 [0,1,0,0,0,1|2,0,0]=4 16944 B16R1.1696 CCCCOC(=O)COc1coccc1=O 34a_100000060831_100000211628 [0,1,0,0,0,1|1,0,0]=3 16945 B16R1.1696 CCCCOC(=O)COc1ncccc1Cl 34a_100011290957_100000211628 [0,1,0,0,0,1|1,0,0]=3 16946 B16R1.1696 CCCCOC(=O)COc1ncccc1F 34a_100011219419_100000211628 [0,1,0,0,0,1|1,0,0]=3 16947 B16R1.1696 CCCCOC(=O)COc1ncccc1N 34a_100000746358_100000211628 [0,1,0,0,0,1|1,0,0]=3 16948 B16R1.1696 CCCCOC(=O)COc1nccnc1C 34a_100000766352_100000211628 [0,1,0,0,0,1|2,0,0]=4 16949 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=O 62a_100000211628_100009998708 [0,1,0,0,0,1|1,0,0]=3 16950 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=O 62a_100009998708_100000211628 [0,1,0,0,0,1|1,0,0]=3 16951 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=S 62a_100000211628_200012280681 [0,1,0,0,0,1|1,0,0]=3 16952 B16R1.1696 CCCCOC(=O)CSc1c[nH]ccc1=S 62a_200012280681_100000211628 [0,1,0,0,0,1|1,0,0]=3 16953 B16R1.1696 CCCCOC(=O)CSc1cccc[n+]1C 62a_100000211628_100000212160 [0,1,0,0,0,1|1,0,0]=3 16954 B16R1.1696 CCCCOC(=O)CSc1cccc[n+]1[O-] 62a_100000211628_200000042595 [0,1,0,0,0,1|1,0,0]=3 16955 B16R1.1696 CCCCOC(=O)CSc1ccccc1Br 62a_100000211628_100000695589 [0,1,0,0,0,1|0,0,0]=2 16956 B16R1.1696 CCCCOC(=O)CSc1ccccc1Br 62a_100000695589_100000211628 [0,1,0,0,0,1|0,0,0]=2 16957 B16R1.1696 CCCCOC(=O)CSc1ccccc1C 62a_100000210755_100000211628 [0,1,0,0,0,1|0,0,0]=2 16958 B16R1.1696 CCCCOC(=O)CSc1ccccc1C 62a_100000211628_100000210755 [0,1,0,0,0,1|0,0,0]=2 16959 B16R1.1696 CCCCOC(=O)CSc1ccccc1Cl 62a_100000211628_100000764095 [0,1,0,0,0,1|0,0,0]=2 16960 B16R1.1696 CCCCOC(=O)CSc1ccccc1Cl 62a_100000764095_100000211628 [0,1,0,0,0,1|0,0,0]=2 16961 B16R1.1696 CCCCOC(=O)CSc1ccccc1F 62a_100000211628_100011215700 [0,1,0,0,0,1|0,0,0]=2 16962 B16R1.1696 CCCCOC(=O)CSc1ccccc1F 62a_100011215700_100000211628 [0,1,0,0,0,1|0,0,0]=2 16963 B16R1.1696 CCCCOC(=O)CSc1ccccc1N 62a_100000210017_100000211628 [0,1,0,0,0,1|0,0,0]=2 16964 B16R1.1696 CCCCOC(=O)CSc1ccccc1N 62a_100000211628_100000210017 [0,1,0,0,0,1|0,0,0]=2 16965 B16R1.1696 CCCCOC(=O)CSc1ccccc1O 62a_100000211628_100000739446 [0,1,0,0,0,1|0,0,0]=2 16966 B16R1.1696 CCCCOC(=O)CSc1ccccc1O 62a_100000739446_100000211628 [0,1,0,0,0,1|0,0,0]=2 16967 B16R1.1696 CCCCOC(=O)CSc1cccnc1Br 62a_100000211628_100010202626 [0,1,0,0,0,1|1,0,0]=3 16968 B16R1.1696 CCCCOC(=O)CSc1cccnc1Br 62a_100010202626_100000211628 [0,1,0,0,0,1|1,0,0]=3 16969 B16R1.1696 CCCCOC(=O)CSc1cccnc1C 62a_100000211628_100000751574 [0,1,0,0,0,1|1,0,0]=3 16970 B16R1.1696 CCCCOC(=O)CSc1cccnc1C 62a_100000751574_100000211628 [0,1,0,0,0,1|1,0,0]=3 16971 B16R1.1696 CCCCOC(=O)CSc1cccnc1Cl 62a_100000036424_100000211628 [0,1,0,0,0,1|1,0,0]=3 16972 B16R1.1696 CCCCOC(=O)CSc1cccnc1Cl 62a_100000211628_100000036424 [0,1,0,0,0,1|1,0,0]=3 16973 B16R1.1696 CCCCOC(=O)CSc1cccnc1F 62a_100000211628_100009816115 [0,1,0,0,0,1|1,0,0]=3 16974 B16R1.1696 CCCCOC(=O)CSc1cccnc1F 62a_100009816115_100000211628 [0,1,0,0,0,1|1,0,0]=3 16975 B16R1.1696 CCCCOC(=O)CSc1cccnc1N 62a_100000045569_100000211628 [0,1,0,0,0,1|1,0,0]=3 16976 B16R1.1696 CCCCOC(=O)CSc1cccnc1N 62a_100000211628_100000045569 [0,1,0,0,0,1|1,0,0]=3 16977 B16R1.1696 CCCCOC(=O)CSc1cccnc1O 62a_100000211628_100000760158 [0,1,0,0,0,1|1,0,0]=3 16978 B16R1.1696 CCCCOC(=O)CSc1cccnc1O 62a_100000760158_100000211628 [0,1,0,0,0,1|1,0,0]=3 16979 B16R1.1696 CCCCOC(=O)CSc1ccn[nH]c1=O 62a_100000211628_100000087129 [0,1,0,0,0,1|2,0,0]=4 16980 B16R1.1696 CCCCOC(=O)CSc1ccncc1Br 62a_100000211628_100000726257 [0,1,0,0,0,1|1,0,0]=3 16981 B16R1.1696 CCCCOC(=O)CSc1ccncc1Br 62a_100000726257_100000211628 [0,1,0,0,0,1|1,0,0]=3 16982 B16R1.1696 CCCCOC(=O)CSc1ccncc1C 62a_100000211628_100000765111 [0,1,0,0,0,1|1,0,0]=3 16983 B16R1.1696 CCCCOC(=O)CSc1ccncc1C 62a_100000765111_100000211628 [0,1,0,0,0,1|1,0,0]=3 16984 B16R1.1696 CCCCOC(=O)CSc1ccncc1Cl 62a_100000211628_100000708259 [0,1,0,0,0,1|1,0,0]=3 16985 B16R1.1696 CCCCOC(=O)CSc1ccncc1Cl 62a_100000708259_100000211628 [0,1,0,0,0,1|1,0,0]=3 16986 B16R1.1696 CCCCOC(=O)CSc1ccncc1F 62a_100000047030_100000211628 [0,1,0,0,0,1|1,0,0]=3 16987 B16R1.1696 CCCCOC(=O)CSc1ccncc1F 62a_100000211628_100000047030 [0,1,0,0,0,1|1,0,0]=3 16988 B16R1.1696 CCCCOC(=O)CSc1ccncc1N 62a_100000211628_100000756074 [0,1,0,0,0,1|1,0,0]=3 16989 B16R1.1696 CCCCOC(=O)CSc1ccncc1N 62a_100000756074_100000211628 [0,1,0,0,0,1|1,0,0]=3 16990 B16R1.1696 CCCCOC(=O)CSc1ccncc1O 62a_100000211628_100009817591 [0,1,0,0,0,1|1,0,0]=3 16991 B16R1.1696 CCCCOC(=O)CSc1ccncc1O 62a_100009817591_100000211628 [0,1,0,0,0,1|1,0,0]=3 16992 B16R1.1696 CCCCOC(=O)CSc1cnccc1Br 62a_100000211628_100010138639 [0,1,0,0,0,1|1,0,0]=3 16993 B16R1.1696 CCCCOC(=O)CSc1cnccc1Br 62a_100010138639_100000211628 [0,1,0,0,0,1|1,0,0]=3 16994 B16R1.1696 CCCCOC(=O)CSc1cnccc1C 62a_100000211628_100000761580 [0,1,0,0,0,1|1,0,0]=3 16995 B16R1.1696 CCCCOC(=O)CSc1cnccc1C 62a_100000761580_100000211628 [0,1,0,0,0,1|1,0,0]=3 16996 B16R1.1696 CCCCOC(=O)CSc1cnccc1Cl 62a_100000211628_100009995489 [0,1,0,0,0,1|1,0,0]=3 16997 B16R1.1696 CCCCOC(=O)CSc1cnccc1Cl 62a_100009995489_100000211628 [0,1,0,0,0,1|1,0,0]=3 16998 B16R1.1696 CCCCOC(=O)CSc1cnccc1F 62a_100000211628_100009820683 [0,1,0,0,0,1|1,0,0]=3 16999 B16R1.1696 CCCCOC(=O)CSc1cnccc1F 62a_100009820683_100000211628 [0,1,0,0,0,1|1,0,0]=3 17000 B16R1.1696 CCCCOC(=O)CSc1cnccc1N 62a_100000047001_100000211628 [0,1,0,0,0,1|1,0,0]=3 17001 B16R1.1696 CCCCOC(=O)CSc1cnccc1N 62a_100000211628_100000047001 [0,1,0,0,0,1|1,0,0]=3 17002 B16R1.1696 CCCCOC(=O)CSc1cncnc1Br 62a_100000211628_200012461658 [0,1,0,0,0,1|2,0,0]=4 17003 B16R1.1696 CCCCOC(=O)CSc1cncnc1Br 62a_200012461658_100000211628 [0,1,0,0,0,1|2,0,0]=4 17004 B16R1.1696 CCCCOC(=O)CSc1cncnc1C 62a_100000211628_100009819671 [0,1,0,0,0,1|2,0,0]=4 17005 B16R1.1696 CCCCOC(=O)CSc1cncnc1C 62a_100009819671_100000211628 [0,1,0,0,0,1|2,0,0]=4 17006 B16R1.1696 CCCCOC(=O)CSc1cncnc1Cl 62a_100000211628_100000758962 [0,1,0,0,0,1|2,0,0]=4 17007 B16R1.1696 CCCCOC(=O)CSc1cncnc1Cl 62a_100000758962_100000211628 [0,1,0,0,0,1|2,0,0]=4 17008 B16R1.1696 CCCCOC(=O)CSc1cncnc1N 62a_100000211628_100011996079 [0,1,0,0,0,1|2,0,0]=4 17009 B16R1.1696 CCCCOC(=O)CSc1cncnc1N 62a_100011996079_100000211628 [0,1,0,0,0,1|2,0,0]=4 17010 B16R1.1696 CCCCOC(=O)CSc1cncnc1O 62a_100000211628_100000751107 [0,1,0,0,0,1|2,0,0]=4 17011 B16R1.1696 CCCCOC(=O)CSc1cncnc1O 62a_100000751107_100000211628 [0,1,0,0,0,1|2,0,0]=4 17012 B16R1.1696 CCCCOC(=O)CSc1cnncc1N 62a_100000211628_100009829405 [0,1,0,0,0,1|2,0,0]=4 17013 B16R1.1696 CCCCOC(=O)CSc1cnncc1N 62a_100009829405_100000211628 [0,1,0,0,0,1|2,0,0]=4 17014 B16R1.1696 CCCCOC(=O)CSc1ncc[nH]c1=O 62a_100000211628_100000763361 [0,1,0,0,0,1|2,0,0]=4 17015 B16R1.1696 CCCCOC(=O)CSc1ncccc1Br 62a_100000211628_100000696092 [0,1,0,0,0,1|1,0,0]=3 17016 B16R1.1696 CCCCOC(=O)CSc1ncccc1Br 62a_100000696092_100000211628 [0,1,0,0,0,1|1,0,0]=3 17017 B16R1.1696 CCCCOC(=O)CSc1ncccc1C 62a_100000211628_100000751373 [0,1,0,0,0,1|1,0,0]=3 17018 B16R1.1696 CCCCOC(=O)CSc1ncccc1C 62a_100000751373_100000211628 [0,1,0,0,0,1|1,0,0]=3 17019 B16R1.1696 CCCCOC(=O)CSc1ncccc1Cl 62a_100000211628_100011356963 [0,1,0,0,0,1|1,0,0]=3 17020 B16R1.1696 CCCCOC(=O)CSc1ncccc1Cl 62a_100011356963_100000211628 [0,1,0,0,0,1|1,0,0]=3 17021 B16R1.1696 CCCCOC(=O)CSc1ncccc1F 62a_100000211628_100000685392 [0,1,0,0,0,1|1,0,0]=3 17022 B16R1.1696 CCCCOC(=O)CSc1ncccc1F 62a_100000685392_100000211628 [0,1,0,0,0,1|1,0,0]=3 17023 B16R1.1696 CCCCOC(=O)CSc1ncccc1N 62a_100000211628_100000688686 [0,1,0,0,0,1|1,0,0]=3 17024 B16R1.1696 CCCCOC(=O)CSc1ncccc1N 62a_100000688686_100000211628 [0,1,0,0,0,1|1,0,0]=3 17025 B16R1.1696 CCCCOC(=O)CSc1ncccc1O 62a_100000034122_100000211628 [0,1,0,0,0,1|1,0,0]=3 17026 B16R1.1696 CCCCOC(=O)CSc1ncccc1O 62a_100000211628_100000034122 [0,1,0,0,0,1|1,0,0]=3 17027 B16R1.1696 CCCCOC(=O)CSc1nccnc1C 62a_100000211628_100011999405 [0,1,0,0,0,1|2,0,0]=4 17028 B16R1.1696 CCCCOC(=O)CSc1nccnc1C 62a_100011999405_100000211628 [0,1,0,0,0,1|2,0,0]=4 17029 B16R1.1696 CCCCOC(=O)CSc1nccnc1Cl 62a_100000211628_100010886584 [0,1,0,0,0,1|2,0,0]=4 17030 B16R1.1696 CCCCOC(=O)CSc1nccnc1Cl 62a_100010886584_100000211628 [0,1,0,0,0,1|2,0,0]=4 17031 B16R1.1696 CCCCOC(=O)CSc1nccnc1F 62a_100000211628_200010125657 [0,1,0,0,0,1|2,0,0]=4 17032 B16R1.1696 CCCCOC(=O)CSc1nccnc1F 62a_200010125657_100000211628 [0,1,0,0,0,1|2,0,0]=4 17033 B16R1.1696 CCCCOC(=O)CSc1nccnc1N 62a_100000211628_100000747729 [0,1,0,0,0,1|2,0,0]=4 17034 B16R1.1696 CCCCOC(=O)CSc1nccnc1N 62a_100000747729_100000211628 [0,1,0,0,0,1|2,0,0]=4 17035 B16R1.1696 CCCCOC(=O)CSc1ncncc1C 62a_100000211628_100011998708 [0,1,0,0,0,1|2,0,0]=4 17036 B16R1.1696 CCCCOC(=O)CSc1ncncc1C 62a_100011998708_100000211628 [0,1,0,0,0,1|2,0,0]=4 17037 B16R1.1696 CCCCOC(=O)CSc1ncncc1F 62a_100000069762_100000211628 [0,1,0,0,0,1|2,0,0]=4 17038 B16R1.1696 CCCCOC(=O)CSc1ncncc1F 62a_100000211628_100000069762 [0,1,0,0,0,1|2,0,0]=4 17039 B16R1.1696 CCCCOC(=O)CSc1ncncc1N 62a_100000211628_100000709731 [0,1,0,0,0,1|2,0,0]=4 17040 B16R1.1696 CCCCOC(=O)CSc1ncncc1N 62a_100000709731_100000211628 [0,1,0,0,0,1|2,0,0]=4 17041 B16R1.1696 CCCCOC(=O)CSc1nnccc1C 62a_100000211628_100000089043 [0,1,0,0,0,1|2,0,0]=4 17042 B16R1.1696 CCCCOC(C)COc1ccccc1C 34a_200011217337_100000210210 [0,1,0,0,0,1|1,0,1]=4 17043 B16R1.1696 CCCCOC(C)COc1ccccc1C 7a_200011217337_100000210211 [0,1,0,0,0,1|1,0,1]=4 17044 B16R1.1696 CCCNNC(=O)CCc1ccccc1Br 22a_100000740057_100000740810 [0,1,0,0,0,1|2,0,0]=4 17045 B16R1.1696 CCCNNC(=O)CCc1ccccc1C 22a_100000740057_100000748742 [0,1,0,0,0,1|2,0,0]=4 17046 B16R1.1696 CCCNNC(=O)CCc1ccccc1Cl 22a_100000740057_100000184300 [0,1,0,0,0,1|2,0,0]=4 17047 B16R1.1696 CCCNNC(=O)CCc1ccccc1F 22a_100000740057_100000189703 [0,1,0,0,0,1|2,0,0]=4 17048 B16R1.1696 CCCNNC(=O)CCc1ccccc1I 22a_100000740057_100000037306 [0,1,0,0,0,1|2,0,0]=4 17049 B16R1.1696 CCCNNC(=O)CCc1ccccc1O 22a_100000740057_100000181328 [0,1,0,0,0,1|2,0,0]=4 17050 B16R1.1696 CCCNNC(=O)COc1ccccc1Br 22a_100000740057_100000216496 [0,1,0,0,0,1|2,0,0]=4 17051 B16R1.1696 CCCNNC(=O)COc1ccccc1C 22a_100000740057_100000182418 [0,1,0,0,0,1|2,0,0]=4 17052 B16R1.1696 CCCNNC(=O)COc1ccccc1Cl 22a_100000740057_100000185159 [0,1,0,0,0,1|2,0,0]=4 17053 B16R1.1696 CCCNNC(=O)COc1ccccc1F 22a_100000740057_100000182486 [0,1,0,0,0,1|2,0,0]=4 17054 B16R1.1696 CCCNNC(=O)COc1ccccc1O 22a_100000740057_100000183020 [0,1,0,0,0,1|2,0,0]=4 17055 B16R1.1696 CCCNNC(=O)CSc1ccccc1C 22a_100000740057_100000183026 [0,1,0,0,0,1|2,0,0]=4 17056 B16R1.1696 CCCNNC(=O)CSc1ccccc1F 22a_100000740057_100000179528 [0,1,0,0,0,1|2,0,0]=4 17057 B16R1.1696 CCCNNC(=O)CSc1ccccc1O 22a_100000740057_100000695322 [0,1,0,0,0,1|2,0,0]=4 17058 B16R1.1696 CCCNNC(=O)NCc1ccccc1Br 273464a_100000689332_100000740057 [0,1,0,0,0,1|2,0,0]=4 17059 B16R1.1696 CCCNNC(=O)NCc1ccccc1Br 512a_100000689332_100000740057 [0,1,0,0,0,1|2,0,0]=4 17060 B16R1.1696 CCCNNC(=O)NCc1ccccc1Br 512a_100000740057_100000689332 [0,1,0,0,0,1|2,0,0]=4 17061 B16R1.1696 CCCNNC(=O)NCc1ccccc1C 273464a_100000174972_100000740057 [0,1,0,0,0,1|2,0,0]=4 17062 B16R1.1696 CCCNNC(=O)NCc1ccccc1C 512a_100000174972_100000740057 [0,1,0,0,0,1|2,0,0]=4 17063 B16R1.1696 CCCNNC(=O)NCc1ccccc1C 512a_100000740057_100000174972 [0,1,0,0,0,1|2,0,0]=4 17064 B16R1.1696 CCCNNC(=O)NCc1ccccc1Cl 273464a_100000174879_100000740057 [0,1,0,0,0,1|2,0,0]=4 17065 B16R1.1696 CCCNNC(=O)NCc1ccccc1Cl 512a_100000740057_100000174879 [0,1,0,0,0,1|2,0,0]=4 17066 B16R1.1696 CCCNNC(=O)NCc1ccccc1F 273464a_100000174869_100000740057 [0,1,0,0,0,1|2,0,0]=4 17067 B16R1.1696 CCCNNC(=O)NCc1ccccc1F 512a_100000174869_100000740057 [0,1,0,0,0,1|2,0,0]=4 17068 B16R1.1696 CCCNNC(=O)NCc1ccccc1F 512a_100000740057_100000174869 [0,1,0,0,0,1|2,0,0]=4 17069 B16R1.1696 CCCNNC(=O)NCc1ccccc1I 273464a_100015347259_100000740057 [0,1,0,0,0,1|2,0,0]=4 17070 B16R1.1696 CCCNNC(=O)NCc1ccccc1I 512a_100000740057_100015347259 [0,1,0,0,0,1|2,0,0]=4 17071 B16R1.1696 CCCNNC(=O)NCc1ccccc1I 512a_100015347259_100000740057 [0,1,0,0,0,1|2,0,0]=4 17072 B16R1.1696 CCCNNC(=O)NCc1ccccc1O 273464a_100000185550_100000740057 [0,1,0,0,0,1|2,0,0]=4 17073 B16R1.1696 CCCNNC(=O)NCc1ccccc1O 512a_100000185550_100000740057 [0,1,0,0,0,1|2,0,0]=4 17074 B16R1.1696 CCCOCC(=O)CCc1ccccc1Br 1458a_100000745993_100012161201 [0,1,0,0,0,1|2,0,0]=4 17075 B16R1.1696 CCCOCC(=O)CCc1ccccc1C 1458a_100000745993_100011713688 [0,1,0,0,0,1|2,0,0]=4 17076 B16R1.1696 CCCOCC(=O)CCc1ccccc1Cl 1458a_100000745993_100011713703 [0,1,0,0,0,1|2,0,0]=4 17077 B16R1.1696 CCCOCC(=O)CCc1ccccc1F 1458a_100000745993_100000720011 [0,1,0,0,0,1|2,0,0]=4 17078 B16R1.1696 CCCOCC(=O)CCc1ccccc1O 1458a_100000745993_100000722297 [0,1,0,0,0,1|2,0,0]=4 17079 B16R1.1696 CCCOCC(=O)NCc1ccccc1Br 11a_100000689332_100000745993 [0,1,0,0,0,1|2,0,0]=4 17080 B16R1.1696 CCCOCC(=O)NCc1ccccc1Br 1626a_100000689332_100000745993 [0,1,0,0,0,1|2,0,0]=4 17081 B16R1.1696 CCCOCC(=O)NCc1ccccc1Br 240690a_100000689332_100000745993 [0,1,0,0,0,1|2,0,0]=4 17082 B16R1.1696 CCCOCC(=O)NCc1ccccc1Br 527a_100000689332_100000745993 [0,1,0,0,0,1|2,0,0]=4 17083 B16R1.1696 CCCOCC(=O)NCc1ccccc1C 11a_100000174972_100000745993 [0,1,0,0,0,1|2,0,0]=4 17084 B16R1.1696 CCCOCC(=O)NCc1ccccc1C 1626a_100000174972_100000745993 [0,1,0,0,0,1|2,0,0]=4 17085 B16R1.1696 CCCOCC(=O)NCc1ccccc1C 240690a_100000174972_100000745993 [0,1,0,0,0,1|2,0,0]=4 17086 B16R1.1696 CCCOCC(=O)NCc1ccccc1C 34a_100000210258_100000230231 [0,1,0,0,0,1|2,0,0]=4 17087 B16R1.1696 CCCOCC(=O)NCc1ccccc1C 527a_100000174972_100000745993 [0,1,0,0,0,1|2,0,0]=4 17088 B16R1.1696 CCCOCC(=O)NCc1ccccc1Cl 11a_100000174879_100000745993 [0,1,0,0,0,1|2,0,0]=4 17089 B16R1.1696 CCCOCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000745993 [0,1,0,0,0,1|2,0,0]=4 17090 B16R1.1696 CCCOCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000745993 [0,1,0,0,0,1|2,0,0]=4 17091 B16R1.1696 CCCOCC(=O)NCc1ccccc1Cl 527a_100000174879_100000745993 [0,1,0,0,0,1|2,0,0]=4 17092 B16R1.1696 CCCOCC(=O)NCc1ccccc1F 11a_100000174869_100000745993 [0,1,0,0,0,1|2,0,0]=4 17093 B16R1.1696 CCCOCC(=O)NCc1ccccc1F 1626a_100000174869_100000745993 [0,1,0,0,0,1|2,0,0]=4 17094 B16R1.1696 CCCOCC(=O)NCc1ccccc1F 240690a_100000174869_100000745993 [0,1,0,0,0,1|2,0,0]=4 17095 B16R1.1696 CCCOCC(=O)NCc1ccccc1F 34a_100000210258_100000190583 [0,1,0,0,0,1|2,0,0]=4 17096 B16R1.1696 CCCOCC(=O)NCc1ccccc1F 527a_100000174869_100000745993 [0,1,0,0,0,1|2,0,0]=4 17097 B16R1.1696 CCCOCC(=O)NCc1ccccc1I 11a_100015347259_100000745993 [0,1,0,0,0,1|2,0,0]=4 17098 B16R1.1696 CCCOCC(=O)NCc1ccccc1I 1626a_100015347259_100000745993 [0,1,0,0,0,1|2,0,0]=4 17099 B16R1.1696 CCCOCC(=O)NCc1ccccc1I 240690a_100015347259_100000745993 [0,1,0,0,0,1|2,0,0]=4 17100 B16R1.1696 CCCOCC(=O)NCc1ccccc1I 527a_100015347259_100000745993 [0,1,0,0,0,1|2,0,0]=4 17101 B16R1.1696 CCCOCC(=O)NCc1ccccc1O 240690a_100000185550_100000745993 [0,1,0,0,0,1|2,0,0]=4 17102 B16R1.1696 CCCOCC(=O)NCc1ccccc1O 527a_100000185550_100000745993 [0,1,0,0,0,1|2,0,0]=4 17103 B16R1.1696 CCCSCC(=O)CCc1ccccc1Br 1458a_100000217233_100012161201 [0,1,0,0,0,1|2,0,0]=4 17104 B16R1.1696 CCCSCC(=O)CCc1ccccc1C 1458a_100000217233_100011713688 [0,1,0,0,0,1|2,0,0]=4 17105 B16R1.1696 CCCSCC(=O)CCc1ccccc1Cl 1458a_100000217233_100011713703 [0,1,0,0,0,1|2,0,0]=4 17106 B16R1.1696 CCCSCC(=O)CCc1ccccc1F 1458a_100000217233_100000720011 [0,1,0,0,0,1|2,0,0]=4 17107 B16R1.1696 CCCSCC(=O)CCc1ccccc1O 1458a_100000217233_100000722297 [0,1,0,0,0,1|2,0,0]=4 17108 B16R1.1696 CCCSCC(=O)NCc1ccccc1Br 11a_100000689332_100000217233 [0,1,0,0,0,1|2,0,0]=4 17109 B16R1.1696 CCCSCC(=O)NCc1ccccc1Br 1626a_100000689332_100000217233 [0,1,0,0,0,1|2,0,0]=4 17110 B16R1.1696 CCCSCC(=O)NCc1ccccc1Br 240690a_100000689332_100000217233 [0,1,0,0,0,1|2,0,0]=4 17111 B16R1.1696 CCCSCC(=O)NCc1ccccc1Br 527a_100000689332_100000217233 [0,1,0,0,0,1|2,0,0]=4 17112 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 11a_100000174972_100000217233 [0,1,0,0,0,1|2,0,0]=4 17113 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 1626a_100000174972_100000217233 [0,1,0,0,0,1|2,0,0]=4 17114 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 240690a_100000174972_100000217233 [0,1,0,0,0,1|2,0,0]=4 17115 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 527a_100000174972_100000217233 [0,1,0,0,0,1|2,0,0]=4 17116 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 62a_100000210303_100000230231 [0,1,0,0,0,1|2,0,0]=4 17117 B16R1.1696 CCCSCC(=O)NCc1ccccc1C 62a_100000230231_100000210303 [0,1,0,0,0,1|2,0,0]=4 17118 B16R1.1696 CCCSCC(=O)NCc1ccccc1Cl 11a_100000174879_100000217233 [0,1,0,0,0,1|2,0,0]=4 17119 B16R1.1696 CCCSCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000217233 [0,1,0,0,0,1|2,0,0]=4 17120 B16R1.1696 CCCSCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000217233 [0,1,0,0,0,1|2,0,0]=4 17121 B16R1.1696 CCCSCC(=O)NCc1ccccc1Cl 527a_100000174879_100000217233 [0,1,0,0,0,1|2,0,0]=4 17122 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 11a_100000174869_100000217233 [0,1,0,0,0,1|2,0,0]=4 17123 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 1626a_100000174869_100000217233 [0,1,0,0,0,1|2,0,0]=4 17124 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 240690a_100000174869_100000217233 [0,1,0,0,0,1|2,0,0]=4 17125 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 527a_100000174869_100000217233 [0,1,0,0,0,1|2,0,0]=4 17126 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 62a_100000190583_100000210303 [0,1,0,0,0,1|2,0,0]=4 17127 B16R1.1696 CCCSCC(=O)NCc1ccccc1F 62a_100000210303_100000190583 [0,1,0,0,0,1|2,0,0]=4 17128 B16R1.1696 CCCSCC(=O)NCc1ccccc1I 11a_100015347259_100000217233 [0,1,0,0,0,1|2,0,0]=4 17129 B16R1.1696 CCCSCC(=O)NCc1ccccc1I 1626a_100015347259_100000217233 [0,1,0,0,0,1|2,0,0]=4 17130 B16R1.1696 CCCSCC(=O)NCc1ccccc1I 240690a_100015347259_100000217233 [0,1,0,0,0,1|2,0,0]=4 17131 B16R1.1696 CCCSCC(=O)NCc1ccccc1I 527a_100015347259_100000217233 [0,1,0,0,0,1|2,0,0]=4 17132 B16R1.1696 CCCSCC(=O)NCc1ccccc1O 240690a_100000185550_100000217233 [0,1,0,0,0,1|2,0,0]=4 17133 B16R1.1696 CCCSCC(=O)NCc1ccccc1O 527a_100000185550_100000217233 [0,1,0,0,0,1|2,0,0]=4 17134 B16R1.1696 CCNCCC(=O)NCc1ccccc1Cl 2230a_100015525214_100000242069 [0,1,0,0,0,1|2,0,0]=4 17135 B16R1.1696 CCNCCC(=O)NCc1ccccc1F 2230a_100015525214_200011194869 [0,1,0,0,0,1|2,0,0]=4 17136 B16R1.1696 CCOCCC(=O)CCc1ccccc1Br 1458a_100000740810_100011215890 [0,1,0,0,0,1|2,0,0]=4 17137 B16R1.1696 CCOCCC(=O)CCc1ccccc1Br 1458a_100000749530_100012161201 [0,1,0,0,0,1|2,0,0]=4 17138 B16R1.1696 CCOCCC(=O)CCc1ccccc1C 1458a_100000748742_100011215890 [0,1,0,0,0,1|2,0,0]=4 17139 B16R1.1696 CCOCCC(=O)CCc1ccccc1C 1458a_100000749530_100011713688 [0,1,0,0,0,1|2,0,0]=4 17140 B16R1.1696 CCOCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100011215890 [0,1,0,0,0,1|2,0,0]=4 17141 B16R1.1696 CCOCCC(=O)CCc1ccccc1Cl 1458a_100000749530_100011713703 [0,1,0,0,0,1|2,0,0]=4 17142 B16R1.1696 CCOCCC(=O)CCc1ccccc1F 1458a_100000189703_100011215890 [0,1,0,0,0,1|2,0,0]=4 17143 B16R1.1696 CCOCCC(=O)CCc1ccccc1F 1458a_100000749530_100000720011 [0,1,0,0,0,1|2,0,0]=4 17144 B16R1.1696 CCOCCC(=O)CCc1ccccc1I 1458a_100000037306_100011215890 [0,1,0,0,0,1|2,0,0]=4 17145 B16R1.1696 CCOCCC(=O)CCc1ccccc1O 1458a_100000181328_100011215890 [0,1,0,0,0,1|2,0,0]=4 17146 B16R1.1696 CCOCCC(=O)CCc1ccccc1O 1458a_100000749530_100000722297 [0,1,0,0,0,1|2,0,0]=4 17147 B16R1.1696 CCOCCC(=O)COc1ccccc1Br 1458a_100000216496_100011215890 [0,1,0,0,0,1|2,0,0]=4 17148 B16R1.1696 CCOCCC(=O)COc1ccccc1C 1458a_100000182418_100011215890 [0,1,0,0,0,1|2,0,0]=4 17149 B16R1.1696 CCOCCC(=O)COc1ccccc1Cl 1458a_100000185159_100011215890 [0,1,0,0,0,1|2,0,0]=4 17150 B16R1.1696 CCOCCC(=O)COc1ccccc1F 1458a_100000182486_100011215890 [0,1,0,0,0,1|2,0,0]=4 17151 B16R1.1696 CCOCCC(=O)COc1ccccc1O 1458a_100000183020_100011215890 [0,1,0,0,0,1|2,0,0]=4 17152 B16R1.1696 CCOCCC(=O)CSc1ccccc1C 1458a_100000183026_100011215890 [0,1,0,0,0,1|2,0,0]=4 17153 B16R1.1696 CCOCCC(=O)CSc1ccccc1F 1458a_100000179528_100011215890 [0,1,0,0,0,1|2,0,0]=4 17154 B16R1.1696 CCOCCC(=O)CSc1ccccc1O 1458a_100000695322_100011215890 [0,1,0,0,0,1|2,0,0]=4 17155 B16R1.1696 CCOCCC(=O)NCc1ccccc1Br 11a_100000689332_100000749530 [0,1,0,0,0,1|2,0,0]=4 17156 B16R1.1696 CCOCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000749530 [0,1,0,0,0,1|2,0,0]=4 17157 B16R1.1696 CCOCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000749530 [0,1,0,0,0,1|2,0,0]=4 17158 B16R1.1696 CCOCCC(=O)NCc1ccccc1Br 527a_100000689332_100000749530 [0,1,0,0,0,1|2,0,0]=4 17159 B16R1.1696 CCOCCC(=O)NCc1ccccc1C 11a_100000174972_100000749530 [0,1,0,0,0,1|2,0,0]=4 17160 B16R1.1696 CCOCCC(=O)NCc1ccccc1C 1626a_100000174972_100000749530 [0,1,0,0,0,1|2,0,0]=4 17161 B16R1.1696 CCOCCC(=O)NCc1ccccc1C 240690a_100000174972_100000749530 [0,1,0,0,0,1|2,0,0]=4 17162 B16R1.1696 CCOCCC(=O)NCc1ccccc1C 527a_100000174972_100000749530 [0,1,0,0,0,1|2,0,0]=4 17163 B16R1.1696 CCOCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000749530 [0,1,0,0,0,1|2,0,0]=4 17164 B16R1.1696 CCOCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000749530 [0,1,0,0,0,1|2,0,0]=4 17165 B16R1.1696 CCOCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000749530 [0,1,0,0,0,1|2,0,0]=4 17166 B16R1.1696 CCOCCC(=O)NCc1ccccc1Cl 34a_100121572206_100000242069 [0,1,0,0,0,1|2,0,0]=4 17167 B16R1.1696 CCOCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000749530 [0,1,0,0,0,1|2,0,0]=4 17168 B16R1.1696 CCOCCC(=O)NCc1ccccc1F 11a_100000174869_100000749530 [0,1,0,0,0,1|2,0,0]=4 17169 B16R1.1696 CCOCCC(=O)NCc1ccccc1F 1626a_100000174869_100000749530 [0,1,0,0,0,1|2,0,0]=4 17170 B16R1.1696 CCOCCC(=O)NCc1ccccc1F 240690a_100000174869_100000749530 [0,1,0,0,0,1|2,0,0]=4 17171 B16R1.1696 CCOCCC(=O)NCc1ccccc1F 34a_100121572206_200011194869 [0,1,0,0,0,1|2,0,0]=4 17172 B16R1.1696 CCOCCC(=O)NCc1ccccc1F 527a_100000174869_100000749530 [0,1,0,0,0,1|2,0,0]=4 17173 B16R1.1696 CCOCCC(=O)NCc1ccccc1I 11a_100015347259_100000749530 [0,1,0,0,0,1|2,0,0]=4 17174 B16R1.1696 CCOCCC(=O)NCc1ccccc1I 1626a_100015347259_100000749530 [0,1,0,0,0,1|2,0,0]=4 17175 B16R1.1696 CCOCCC(=O)NCc1ccccc1I 240690a_100015347259_100000749530 [0,1,0,0,0,1|2,0,0]=4 17176 B16R1.1696 CCOCCC(=O)NCc1ccccc1I 527a_100015347259_100000749530 [0,1,0,0,0,1|2,0,0]=4 17177 B16R1.1696 CCOCCC(=O)NCc1ccccc1O 240690a_100000185550_100000749530 [0,1,0,0,0,1|2,0,0]=4 17178 B16R1.1696 CCOCCC(=O)NCc1ccccc1O 527a_100000185550_100000749530 [0,1,0,0,0,1|2,0,0]=4 17179 B16R1.1696 CCSCCC(=O)CCc1ccccc1Br 1458a_100000230768_100012161201 [0,1,0,0,0,1|2,0,0]=4 17180 B16R1.1696 CCSCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000757381 [0,1,0,0,0,1|2,0,0]=4 17181 B16R1.1696 CCSCCC(=O)CCc1ccccc1C 1458a_100000230768_100011713688 [0,1,0,0,0,1|2,0,0]=4 17182 B16R1.1696 CCSCCC(=O)CCc1ccccc1C 1458a_100000748742_100000757381 [0,1,0,0,0,1|2,0,0]=4 17183 B16R1.1696 CCSCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000757381 [0,1,0,0,0,1|2,0,0]=4 17184 B16R1.1696 CCSCCC(=O)CCc1ccccc1Cl 1458a_100000230768_100011713703 [0,1,0,0,0,1|2,0,0]=4 17185 B16R1.1696 CCSCCC(=O)CCc1ccccc1F 1458a_100000189703_100000757381 [0,1,0,0,0,1|2,0,0]=4 17186 B16R1.1696 CCSCCC(=O)CCc1ccccc1F 1458a_100000230768_100000720011 [0,1,0,0,0,1|2,0,0]=4 17187 B16R1.1696 CCSCCC(=O)CCc1ccccc1I 1458a_100000037306_100000757381 [0,1,0,0,0,1|2,0,0]=4 17188 B16R1.1696 CCSCCC(=O)CCc1ccccc1O 1458a_100000181328_100000757381 [0,1,0,0,0,1|2,0,0]=4 17189 B16R1.1696 CCSCCC(=O)CCc1ccccc1O 1458a_100000230768_100000722297 [0,1,0,0,0,1|2,0,0]=4 17190 B16R1.1696 CCSCCC(=O)COc1ccccc1Br 1458a_100000216496_100000757381 [0,1,0,0,0,1|2,0,0]=4 17191 B16R1.1696 CCSCCC(=O)COc1ccccc1C 1458a_100000182418_100000757381 [0,1,0,0,0,1|2,0,0]=4 17192 B16R1.1696 CCSCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000757381 [0,1,0,0,0,1|2,0,0]=4 17193 B16R1.1696 CCSCCC(=O)COc1ccccc1F 1458a_100000182486_100000757381 [0,1,0,0,0,1|2,0,0]=4 17194 B16R1.1696 CCSCCC(=O)COc1ccccc1O 1458a_100000183020_100000757381 [0,1,0,0,0,1|2,0,0]=4 17195 B16R1.1696 CCSCCC(=O)CSc1ccccc1C 1458a_100000183026_100000757381 [0,1,0,0,0,1|2,0,0]=4 17196 B16R1.1696 CCSCCC(=O)CSc1ccccc1F 1458a_100000179528_100000757381 [0,1,0,0,0,1|2,0,0]=4 17197 B16R1.1696 CCSCCC(=O)CSc1ccccc1O 1458a_100000695322_100000757381 [0,1,0,0,0,1|2,0,0]=4 17198 B16R1.1696 CCSCCC(=O)NCc1ccccc1Br 11a_100000689332_100000230768 [0,1,0,0,0,1|2,0,0]=4 17199 B16R1.1696 CCSCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000230768 [0,1,0,0,0,1|2,0,0]=4 17200 B16R1.1696 CCSCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000230768 [0,1,0,0,0,1|2,0,0]=4 17201 B16R1.1696 CCSCCC(=O)NCc1ccccc1Br 527a_100000689332_100000230768 [0,1,0,0,0,1|2,0,0]=4 17202 B16R1.1696 CCSCCC(=O)NCc1ccccc1C 11a_100000174972_100000230768 [0,1,0,0,0,1|2,0,0]=4 17203 B16R1.1696 CCSCCC(=O)NCc1ccccc1C 1626a_100000174972_100000230768 [0,1,0,0,0,1|2,0,0]=4 17204 B16R1.1696 CCSCCC(=O)NCc1ccccc1C 240690a_100000174972_100000230768 [0,1,0,0,0,1|2,0,0]=4 17205 B16R1.1696 CCSCCC(=O)NCc1ccccc1C 527a_100000174972_100000230768 [0,1,0,0,0,1|2,0,0]=4 17206 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000230768 [0,1,0,0,0,1|2,0,0]=4 17207 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000230768 [0,1,0,0,0,1|2,0,0]=4 17208 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000230768 [0,1,0,0,0,1|2,0,0]=4 17209 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000230768 [0,1,0,0,0,1|2,0,0]=4 17210 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 62a_100000210202_100000242069 [0,1,0,0,0,1|2,0,0]=4 17211 B16R1.1696 CCSCCC(=O)NCc1ccccc1Cl 62a_100000242069_100000210202 [0,1,0,0,0,1|2,0,0]=4 17212 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 11a_100000174869_100000230768 [0,1,0,0,0,1|2,0,0]=4 17213 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 1626a_100000174869_100000230768 [0,1,0,0,0,1|2,0,0]=4 17214 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 240690a_100000174869_100000230768 [0,1,0,0,0,1|2,0,0]=4 17215 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 527a_100000174869_100000230768 [0,1,0,0,0,1|2,0,0]=4 17216 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 62a_100000210202_200011194869 [0,1,0,0,0,1|2,0,0]=4 17217 B16R1.1696 CCSCCC(=O)NCc1ccccc1F 62a_200011194869_100000210202 [0,1,0,0,0,1|2,0,0]=4 17218 B16R1.1696 CCSCCC(=O)NCc1ccccc1I 11a_100015347259_100000230768 [0,1,0,0,0,1|2,0,0]=4 17219 B16R1.1696 CCSCCC(=O)NCc1ccccc1I 1626a_100015347259_100000230768 [0,1,0,0,0,1|2,0,0]=4 17220 B16R1.1696 CCSCCC(=O)NCc1ccccc1I 240690a_100015347259_100000230768 [0,1,0,0,0,1|2,0,0]=4 17221 B16R1.1696 CCSCCC(=O)NCc1ccccc1I 527a_100015347259_100000230768 [0,1,0,0,0,1|2,0,0]=4 17222 B16R1.1696 CCSCCC(=O)NCc1ccccc1O 240690a_100000185550_100000230768 [0,1,0,0,0,1|2,0,0]=4 17223 B16R1.1696 CCSCCC(=O)NCc1ccccc1O 527a_100000185550_100000230768 [0,1,0,0,0,1|2,0,0]=4 17224 B16R1.1696 COCCCC(=O)CCc1ccccc1Br 1458a_100000740810_100000740836 [0,1,0,0,0,1|2,0,0]=4 17225 B16R1.1696 COCCCC(=O)CCc1ccccc1Br 1458a_100000741012_100012161201 [0,1,0,0,0,1|2,0,0]=4 17226 B16R1.1696 COCCCC(=O)CCc1ccccc1C 1458a_100000741012_100011713688 [0,1,0,0,0,1|2,0,0]=4 17227 B16R1.1696 COCCCC(=O)CCc1ccccc1C 1458a_100000748742_100000740836 [0,1,0,0,0,1|2,0,0]=4 17228 B16R1.1696 COCCCC(=O)CCc1ccccc1Cl 1458a_100000184300_100000740836 [0,1,0,0,0,1|2,0,0]=4 17229 B16R1.1696 COCCCC(=O)CCc1ccccc1Cl 1458a_100000741012_100011713703 [0,1,0,0,0,1|2,0,0]=4 17230 B16R1.1696 COCCCC(=O)CCc1ccccc1F 1458a_100000189703_100000740836 [0,1,0,0,0,1|2,0,0]=4 17231 B16R1.1696 COCCCC(=O)CCc1ccccc1F 1458a_100000741012_100000720011 [0,1,0,0,0,1|2,0,0]=4 17232 B16R1.1696 COCCCC(=O)CCc1ccccc1I 1458a_100000037306_100000740836 [0,1,0,0,0,1|2,0,0]=4 17233 B16R1.1696 COCCCC(=O)CCc1ccccc1O 1458a_100000181328_100000740836 [0,1,0,0,0,1|2,0,0]=4 17234 B16R1.1696 COCCCC(=O)CCc1ccccc1O 1458a_100000741012_100000722297 [0,1,0,0,0,1|2,0,0]=4 17235 B16R1.1696 COCCCC(=O)COc1ccccc1Br 1458a_100000216496_100000740836 [0,1,0,0,0,1|2,0,0]=4 17236 B16R1.1696 COCCCC(=O)COc1ccccc1C 1458a_100000182418_100000740836 [0,1,0,0,0,1|2,0,0]=4 17237 B16R1.1696 COCCCC(=O)COc1ccccc1Cl 1458a_100000185159_100000740836 [0,1,0,0,0,1|2,0,0]=4 17238 B16R1.1696 COCCCC(=O)COc1ccccc1F 1458a_100000182486_100000740836 [0,1,0,0,0,1|2,0,0]=4 17239 B16R1.1696 COCCCC(=O)COc1ccccc1O 1458a_100000183020_100000740836 [0,1,0,0,0,1|2,0,0]=4 17240 B16R1.1696 COCCCC(=O)CSc1ccccc1C 1458a_100000183026_100000740836 [0,1,0,0,0,1|2,0,0]=4 17241 B16R1.1696 COCCCC(=O)CSc1ccccc1F 1458a_100000179528_100000740836 [0,1,0,0,0,1|2,0,0]=4 17242 B16R1.1696 COCCCC(=O)CSc1ccccc1O 1458a_100000695322_100000740836 [0,1,0,0,0,1|2,0,0]=4 17243 B16R1.1696 COCCCC(=O)NCc1ccccc1Br 11a_100000689332_100000741012 [0,1,0,0,0,1|2,0,0]=4 17244 B16R1.1696 COCCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000741012 [0,1,0,0,0,1|2,0,0]=4 17245 B16R1.1696 COCCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000741012 [0,1,0,0,0,1|2,0,0]=4 17246 B16R1.1696 COCCCC(=O)NCc1ccccc1Br 527a_100000689332_100000741012 [0,1,0,0,0,1|2,0,0]=4 17247 B16R1.1696 COCCCC(=O)NCc1ccccc1C 11a_100000174972_100000741012 [0,1,0,0,0,1|2,0,0]=4 17248 B16R1.1696 COCCCC(=O)NCc1ccccc1C 1626a_100000174972_100000741012 [0,1,0,0,0,1|2,0,0]=4 17249 B16R1.1696 COCCCC(=O)NCc1ccccc1C 240690a_100000174972_100000741012 [0,1,0,0,0,1|2,0,0]=4 17250 B16R1.1696 COCCCC(=O)NCc1ccccc1C 527a_100000174972_100000741012 [0,1,0,0,0,1|2,0,0]=4 17251 B16R1.1696 COCCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000741012 [0,1,0,0,0,1|2,0,0]=4 17252 B16R1.1696 COCCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000741012 [0,1,0,0,0,1|2,0,0]=4 17253 B16R1.1696 COCCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000741012 [0,1,0,0,0,1|2,0,0]=4 17254 B16R1.1696 COCCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000741012 [0,1,0,0,0,1|2,0,0]=4 17255 B16R1.1696 COCCCC(=O)NCc1ccccc1F 11a_100000174869_100000741012 [0,1,0,0,0,1|2,0,0]=4 17256 B16R1.1696 COCCCC(=O)NCc1ccccc1F 1626a_100000174869_100000741012 [0,1,0,0,0,1|2,0,0]=4 17257 B16R1.1696 COCCCC(=O)NCc1ccccc1F 240690a_100000174869_100000741012 [0,1,0,0,0,1|2,0,0]=4 17258 B16R1.1696 COCCCC(=O)NCc1ccccc1F 527a_100000174869_100000741012 [0,1,0,0,0,1|2,0,0]=4 17259 B16R1.1696 COCCCC(=O)NCc1ccccc1I 11a_100015347259_100000741012 [0,1,0,0,0,1|2,0,0]=4 17260 B16R1.1696 COCCCC(=O)NCc1ccccc1I 1626a_100015347259_100000741012 [0,1,0,0,0,1|2,0,0]=4 17261 B16R1.1696 COCCCC(=O)NCc1ccccc1I 240690a_100015347259_100000741012 [0,1,0,0,0,1|2,0,0]=4 17262 B16R1.1696 COCCCC(=O)NCc1ccccc1I 527a_100015347259_100000741012 [0,1,0,0,0,1|2,0,0]=4 17263 B16R1.1696 COCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000741012 [0,1,0,0,0,1|2,0,0]=4 17264 B16R1.1696 COCCCC(=O)NCc1ccccc1O 527a_100000185550_100000741012 [0,1,0,0,0,1|2,0,0]=4 17265 B16R1.1696 COCCNC(=O)CCc1ccccc1Br 1626a_100000209980_100000740810 [0,1,0,0,0,1|2,0,0]=4 17266 B16R1.1696 COCCNC(=O)CCc1ccccc1Br 240690a_100000209980_100000740810 [0,1,0,0,0,1|2,0,0]=4 17267 B16R1.1696 COCCNC(=O)CCc1ccccc1Br 527a_100000209980_100000740810 [0,1,0,0,0,1|2,0,0]=4 17268 B16R1.1696 COCCNC(=O)CCc1ccccc1C 1626a_100000209980_100000748742 [0,1,0,0,0,1|2,0,0]=4 17269 B16R1.1696 COCCNC(=O)CCc1ccccc1C 240690a_100000209980_100000748742 [0,1,0,0,0,1|2,0,0]=4 17270 B16R1.1696 COCCNC(=O)CCc1ccccc1C 527a_100000209980_100000748742 [0,1,0,0,0,1|2,0,0]=4 17271 B16R1.1696 COCCNC(=O)CCc1ccccc1Cl 1626a_100000209980_100000184300 [0,1,0,0,0,1|2,0,0]=4 17272 B16R1.1696 COCCNC(=O)CCc1ccccc1Cl 240690a_100000209980_100000184300 [0,1,0,0,0,1|2,0,0]=4 17273 B16R1.1696 COCCNC(=O)CCc1ccccc1Cl 527a_100000209980_100000184300 [0,1,0,0,0,1|2,0,0]=4 17274 B16R1.1696 COCCNC(=O)CCc1ccccc1F 1626a_100000209980_100000189703 [0,1,0,0,0,1|2,0,0]=4 17275 B16R1.1696 COCCNC(=O)CCc1ccccc1F 240690a_100000209980_100000189703 [0,1,0,0,0,1|2,0,0]=4 17276 B16R1.1696 COCCNC(=O)CCc1ccccc1F 527a_100000209980_100000189703 [0,1,0,0,0,1|2,0,0]=4 17277 B16R1.1696 COCCNC(=O)CCc1ccccc1I 1626a_100000209980_100000037306 [0,1,0,0,0,1|2,0,0]=4 17278 B16R1.1696 COCCNC(=O)CCc1ccccc1I 240690a_100000209980_100000037306 [0,1,0,0,0,1|2,0,0]=4 17279 B16R1.1696 COCCNC(=O)CCc1ccccc1I 527a_100000209980_100000037306 [0,1,0,0,0,1|2,0,0]=4 17280 B16R1.1696 COCCNC(=O)CCc1ccccc1O 240690a_100000209980_100000181328 [0,1,0,0,0,1|2,0,0]=4 17281 B16R1.1696 COCCNC(=O)CCc1ccccc1O 527a_100000209980_100000181328 [0,1,0,0,0,1|2,0,0]=4 17282 B16R1.1696 COCCNC(=O)CNc1ccccc1Br 34a_100000210017_100000183275 [0,1,0,0,0,1|2,0,0]=4 17283 B16R1.1696 COCCNC(=O)CNc1ccccc1C 34a_100015192222_100000183275 [0,1,0,0,0,1|2,0,0]=4 17284 B16R1.1696 COCCNC(=O)CNc1ccccc1Cl 34a_100000185783_100000183275 [0,1,0,0,0,1|2,0,0]=4 17285 B16R1.1696 COCCNC(=O)CNc1ccccc1F 34a_100000210422_100000183275 [0,1,0,0,0,1|2,0,0]=4 17286 B16R1.1696 COCCNC(=O)CNc1ccccc1I 34a_100000210053_100000183275 [0,1,0,0,0,1|2,0,0]=4 17287 B16R1.1696 COCCNC(=O)CNc1ccccc1O 34a_100000185747_100000183275 [0,1,0,0,0,1|2,0,0]=4 17288 B16R1.1696 COCCNC(=O)COc1ccccc1Br 1626a_100000209980_100000216496 [0,1,0,0,0,1|2,0,0]=4 17289 B16R1.1696 COCCNC(=O)COc1ccccc1Br 240690a_100000209980_100000216496 [0,1,0,0,0,1|2,0,0]=4 17290 B16R1.1696 COCCNC(=O)COc1ccccc1Br 34a_100000181306_100000183275 [0,1,0,0,0,1|2,0,0]=4 17291 B16R1.1696 COCCNC(=O)COc1ccccc1Br 527a_100000209980_100000216496 [0,1,0,0,0,1|2,0,0]=4 17292 B16R1.1696 COCCNC(=O)COc1ccccc1Br 7a_100000181306_100000183275 [0,1,0,0,0,1|2,0,0]=4 17293 B16R1.1696 COCCNC(=O)COc1ccccc1C 1626a_100000209980_100000182418 [0,1,0,0,0,1|2,0,0]=4 17294 B16R1.1696 COCCNC(=O)COc1ccccc1C 240690a_100000209980_100000182418 [0,1,0,0,0,1|2,0,0]=4 17295 B16R1.1696 COCCNC(=O)COc1ccccc1C 34a_100000210338_100000183275 [0,1,0,0,0,1|2,0,0]=4 17296 B16R1.1696 COCCNC(=O)COc1ccccc1C 527a_100000209980_100000182418 [0,1,0,0,0,1|2,0,0]=4 17297 B16R1.1696 COCCNC(=O)COc1ccccc1C 7a_100000210338_100000183275 [0,1,0,0,0,1|2,0,0]=4 17298 B16R1.1696 COCCNC(=O)COc1ccccc1Cl 1626a_100000209980_100000185159 [0,1,0,0,0,1|2,0,0]=4 17299 B16R1.1696 COCCNC(=O)COc1ccccc1Cl 240690a_100000209980_100000185159 [0,1,0,0,0,1|2,0,0]=4 17300 B16R1.1696 COCCNC(=O)COc1ccccc1Cl 34a_100000210172_100000183275 [0,1,0,0,0,1|2,0,0]=4 17301 B16R1.1696 COCCNC(=O)COc1ccccc1Cl 527a_100000209980_100000185159 [0,1,0,0,0,1|2,0,0]=4 17302 B16R1.1696 COCCNC(=O)COc1ccccc1Cl 7a_100000210172_100000183275 [0,1,0,0,0,1|2,0,0]=4 17303 B16R1.1696 COCCNC(=O)COc1ccccc1F 1626a_100000209980_100000182486 [0,1,0,0,0,1|2,0,0]=4 17304 B16R1.1696 COCCNC(=O)COc1ccccc1F 240690a_100000209980_100000182486 [0,1,0,0,0,1|2,0,0]=4 17305 B16R1.1696 COCCNC(=O)COc1ccccc1F 34a_100000210171_100000183275 [0,1,0,0,0,1|2,0,0]=4 17306 B16R1.1696 COCCNC(=O)COc1ccccc1F 527a_100000209980_100000182486 [0,1,0,0,0,1|2,0,0]=4 17307 B16R1.1696 COCCNC(=O)COc1ccccc1F 7a_100000210171_100000183275 [0,1,0,0,0,1|2,0,0]=4 17308 B16R1.1696 COCCNC(=O)COc1ccccc1I 34a_100000739446_100000183275 [0,1,0,0,0,1|2,0,0]=4 17309 B16R1.1696 COCCNC(=O)COc1ccccc1I 7a_100000739446_100000183275 [0,1,0,0,0,1|2,0,0]=4 17310 B16R1.1696 COCCNC(=O)COc1ccccc1N 34a_100000185747_100000183275 [0,1,0,0,0,1|2,0,0]=4 17311 B16R1.1696 COCCNC(=O)COc1ccccc1N 7a_100000185747_100000183275 [0,1,0,0,0,1|2,0,0]=4 17312 B16R1.1696 COCCNC(=O)COc1ccccc1O 240690a_100000209980_100000183020 [0,1,0,0,0,1|2,0,0]=4 17313 B16R1.1696 COCCNC(=O)COc1ccccc1O 527a_100000209980_100000183020 [0,1,0,0,0,1|2,0,0]=4 17314 B16R1.1696 COCCNC(=O)CSc1ccccc1Br 62a_100000183275_100000695589 [0,1,0,0,0,1|2,0,0]=4 17315 B16R1.1696 COCCNC(=O)CSc1ccccc1Br 62a_100000695589_100000183275 [0,1,0,0,0,1|2,0,0]=4 17316 B16R1.1696 COCCNC(=O)CSc1ccccc1C 1626a_100000209980_100000183026 [0,1,0,0,0,1|2,0,0]=4 17317 B16R1.1696 COCCNC(=O)CSc1ccccc1C 240690a_100000209980_100000183026 [0,1,0,0,0,1|2,0,0]=4 17318 B16R1.1696 COCCNC(=O)CSc1ccccc1C 527a_100000209980_100000183026 [0,1,0,0,0,1|2,0,0]=4 17319 B16R1.1696 COCCNC(=O)CSc1ccccc1C 62a_100000183275_100000210755 [0,1,0,0,0,1|2,0,0]=4 17320 B16R1.1696 COCCNC(=O)CSc1ccccc1C 62a_100000210755_100000183275 [0,1,0,0,0,1|2,0,0]=4 17321 B16R1.1696 COCCNC(=O)CSc1ccccc1Cl 62a_100000183275_100000764095 [0,1,0,0,0,1|2,0,0]=4 17322 B16R1.1696 COCCNC(=O)CSc1ccccc1Cl 62a_100000764095_100000183275 [0,1,0,0,0,1|2,0,0]=4 17323 B16R1.1696 COCCNC(=O)CSc1ccccc1F 1626a_100000209980_100000179528 [0,1,0,0,0,1|2,0,0]=4 17324 B16R1.1696 COCCNC(=O)CSc1ccccc1F 240690a_100000209980_100000179528 [0,1,0,0,0,1|2,0,0]=4 17325 B16R1.1696 COCCNC(=O)CSc1ccccc1F 62a_100000183275_100011215700 [0,1,0,0,0,1|2,0,0]=4 17326 B16R1.1696 COCCNC(=O)CSc1ccccc1F 62a_100011215700_100000183275 [0,1,0,0,0,1|2,0,0]=4 17327 B16R1.1696 COCCNC(=O)CSc1ccccc1N 62a_100000183275_100000210017 [0,1,0,0,0,1|2,0,0]=4 17328 B16R1.1696 COCCNC(=O)CSc1ccccc1N 62a_100000210017_100000183275 [0,1,0,0,0,1|2,0,0]=4 17329 B16R1.1696 COCCNC(=O)CSc1ccccc1O 240690a_100000209980_100000695322 [0,1,0,0,0,1|2,0,0]=4 17330 B16R1.1696 COCCNC(=O)CSc1ccccc1O 527a_100000209980_100000695322 [0,1,0,0,0,1|2,0,0]=4 17331 B16R1.1696 COCCNC(=O)CSc1ccccc1O 62a_100000183275_100000739446 [0,1,0,0,0,1|2,0,0]=4 17332 B16R1.1696 COCCNC(=O)CSc1ccccc1O 62a_100000739446_100000183275 [0,1,0,0,0,1|2,0,0]=4 17333 B16R1.1696 COCCNC(=O)NCc1ccccc1Br 2708a_100000689332_100000209980 [0,1,0,0,0,1|2,0,0]=4 17334 B16R1.1696 COCCNC(=O)NCc1ccccc1Br 273464a_100000209980_100000689332 [0,1,0,0,0,1|2,0,0]=4 17335 B16R1.1696 COCCNC(=O)NCc1ccccc1Br 273464a_100000689332_100000209980 [0,1,0,0,0,1|2,0,0]=4 17336 B16R1.1696 COCCNC(=O)NCc1ccccc1C 2708a_100000174972_100000209980 [0,1,0,0,0,1|2,0,0]=4 17337 B16R1.1696 COCCNC(=O)NCc1ccccc1C 273464a_100000174972_100000209980 [0,1,0,0,0,1|2,0,0]=4 17338 B16R1.1696 COCCNC(=O)NCc1ccccc1C 273464a_100000209980_100000174972 [0,1,0,0,0,1|2,0,0]=4 17339 B16R1.1696 COCCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100000209980 [0,1,0,0,0,1|2,0,0]=4 17340 B16R1.1696 COCCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100000209980 [0,1,0,0,0,1|2,0,0]=4 17341 B16R1.1696 COCCNC(=O)NCc1ccccc1Cl 273464a_100000209980_100000174879 [0,1,0,0,0,1|2,0,0]=4 17342 B16R1.1696 COCCNC(=O)NCc1ccccc1F 2708a_100000174869_100000209980 [0,1,0,0,0,1|2,0,0]=4 17343 B16R1.1696 COCCNC(=O)NCc1ccccc1F 273464a_100000174869_100000209980 [0,1,0,0,0,1|2,0,0]=4 17344 B16R1.1696 COCCNC(=O)NCc1ccccc1F 273464a_100000209980_100000174869 [0,1,0,0,0,1|2,0,0]=4 17345 B16R1.1696 COCCNC(=O)NCc1ccccc1I 2708a_100015347259_100000209980 [0,1,0,0,0,1|2,0,0]=4 17346 B16R1.1696 COCCNC(=O)NCc1ccccc1I 273464a_100000209980_100015347259 [0,1,0,0,0,1|2,0,0]=4 17347 B16R1.1696 COCCNC(=O)NCc1ccccc1I 273464a_100015347259_100000209980 [0,1,0,0,0,1|2,0,0]=4 17348 B16R1.1696 COCCNC(=O)NCc1ccccc1O 2708a_100000185550_100000209980 [0,1,0,0,0,1|2,0,0]=4 17349 B16R1.1696 COCCNC(=O)NCc1ccccc1O 273464a_100000185550_100000209980 [0,1,0,0,0,1|2,0,0]=4 17350 B16R1.1696 COCCNC(=O)NCc1ccccc1O 273464a_100000209980_100000185550 [0,1,0,0,0,1|2,0,0]=4 17351 B16R1.1696 COCCOC(=O)CNc1ccccc1Br 34a_100000210017_200000040189 [0,1,0,0,0,1|1,0,0]=3 17352 B16R1.1696 COCCOC(=O)CNc1ccccc1C 34a_100015192222_200000040189 [0,1,0,0,0,1|1,0,0]=3 17353 B16R1.1696 COCCOC(=O)CNc1ccccc1Cl 34a_100000185783_200000040189 [0,1,0,0,0,1|1,0,0]=3 17354 B16R1.1696 COCCOC(=O)CNc1ccccc1F 34a_100000210422_200000040189 [0,1,0,0,0,1|1,0,0]=3 17355 B16R1.1696 COCCOC(=O)CNc1ccccc1I 34a_100000210053_200000040189 [0,1,0,0,0,1|1,0,0]=3 17356 B16R1.1696 COCCOC(=O)CNc1ccccc1O 34a_100000185747_200000040189 [0,1,0,0,0,1|1,0,0]=3 17357 B16R1.1696 COCCOC(=O)COc1cccc[n+]1[O-] 7a_100000211761_200000040189 [0,1,0,0,0,1|2,0,0]=4 17358 B16R1.1696 COCCOC(=O)COc1ccccc1Br 34a_100000181306_200000040189 [0,1,0,0,0,1|1,0,0]=3 17359 B16R1.1696 COCCOC(=O)COc1ccccc1Br 7a_100000181306_200000040189 [0,1,0,0,0,1|1,0,0]=3 17360 B16R1.1696 COCCOC(=O)COc1ccccc1C 34a_100000210338_200000040189 [0,1,0,0,0,1|1,0,0]=3 17361 B16R1.1696 COCCOC(=O)COc1ccccc1C 7a_100000210338_200000040189 [0,1,0,0,0,1|1,0,0]=3 17362 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 34a_100000210172_200000040189 [0,1,0,0,0,1|1,0,0]=3 17363 B16R1.1696 COCCOC(=O)COc1ccccc1Cl 7a_100000210172_200000040189 [0,1,0,0,0,1|1,0,0]=3 17364 B16R1.1696 COCCOC(=O)COc1ccccc1F 34a_100000210171_200000040189 [0,1,0,0,0,1|1,0,0]=3 17365 B16R1.1696 COCCOC(=O)COc1ccccc1F 7a_100000210171_200000040189 [0,1,0,0,0,1|1,0,0]=3 17366 B16R1.1696 COCCOC(=O)COc1ccccc1I 34a_100000739446_200000040189 [0,1,0,0,0,1|1,0,0]=3 17367 B16R1.1696 COCCOC(=O)COc1ccccc1I 7a_100000739446_200000040189 [0,1,0,0,0,1|1,0,0]=3 17368 B16R1.1696 COCCOC(=O)COc1ccccc1N 34a_100000185747_200000040189 [0,1,0,0,0,1|1,0,0]=3 17369 B16R1.1696 COCCOC(=O)COc1ccccc1N 7a_100000185747_200000040189 [0,1,0,0,0,1|1,0,0]=3 17370 B16R1.1696 COCCOC(=O)COc1cccnc1Br 34a_100000744436_200000040189 [0,1,0,0,0,1|2,0,0]=4 17371 B16R1.1696 COCCOC(=O)COc1cccnc1Br 7a_100000744436_200000040189 [0,1,0,0,0,1|2,0,0]=4 17372 B16R1.1696 COCCOC(=O)COc1cccnc1C 34a_100000745507_200000040189 [0,1,0,0,0,1|2,0,0]=4 17373 B16R1.1696 COCCOC(=O)COc1cccnc1C 7a_100000745507_200000040189 [0,1,0,0,0,1|2,0,0]=4 17374 B16R1.1696 COCCOC(=O)COc1cccnc1Cl 34a_100000757616_200000040189 [0,1,0,0,0,1|2,0,0]=4 17375 B16R1.1696 COCCOC(=O)COc1cccnc1Cl 7a_100000757616_200000040189 [0,1,0,0,0,1|2,0,0]=4 17376 B16R1.1696 COCCOC(=O)COc1cccnc1F 34a_100000061740_200000040189 [0,1,0,0,0,1|2,0,0]=4 17377 B16R1.1696 COCCOC(=O)COc1cccnc1F 7a_100000061740_200000040189 [0,1,0,0,0,1|2,0,0]=4 17378 B16R1.1696 COCCOC(=O)COc1cccnc1I 34a_100000034122_200000040189 [0,1,0,0,0,1|2,0,0]=4 17379 B16R1.1696 COCCOC(=O)COc1cccnc1I 7a_100000034122_200000040189 [0,1,0,0,0,1|2,0,0]=4 17380 B16R1.1696 COCCOC(=O)COc1cccnc1N 34a_100000211975_200000040189 [0,1,0,0,0,1|2,0,0]=4 17381 B16R1.1696 COCCOC(=O)COc1cccnc1N 7a_100000211975_200000040189 [0,1,0,0,0,1|2,0,0]=4 17382 B16R1.1696 COCCOC(=O)COc1cccoc1=O 34a_100000077404_200000040189 [0,1,0,0,0,1|2,0,0]=4 17383 B16R1.1696 COCCOC(=O)COc1cccoc1=O 7a_100000077404_200000040189 [0,1,0,0,0,1|2,0,0]=4 17384 B16R1.1696 COCCOC(=O)COc1ccncc1Br 34a_100011996408_200000040189 [0,1,0,0,0,1|2,0,0]=4 17385 B16R1.1696 COCCOC(=O)COc1ccncc1C 34a_100000694293_200000040189 [0,1,0,0,0,1|2,0,0]=4 17386 B16R1.1696 COCCOC(=O)COc1ccncc1Cl 34a_100011997054_200000040189 [0,1,0,0,0,1|2,0,0]=4 17387 B16R1.1696 COCCOC(=O)COc1ccncc1F 34a_200000081243_200000040189 [0,1,0,0,0,1|2,0,0]=4 17388 B16R1.1696 COCCOC(=O)COc1cnccc1C 34a_100011997053_200000040189 [0,1,0,0,0,1|2,0,0]=4 17389 B16R1.1696 COCCOC(=O)COc1cnccc1C 7a_100011997053_200000040189 [0,1,0,0,0,1|2,0,0]=4 17390 B16R1.1696 COCCOC(=O)COc1cnccc1Cl 34a_100011996695_200000040189 [0,1,0,0,0,1|2,0,0]=4 17391 B16R1.1696 COCCOC(=O)COc1cnccc1I 34a_100000050107_200000040189 [0,1,0,0,0,1|2,0,0]=4 17392 B16R1.1696 COCCOC(=O)COc1cnccc1N 34a_100000753702_200000040189 [0,1,0,0,0,1|2,0,0]=4 17393 B16R1.1696 COCCOC(=O)COc1coccc1=O 34a_100000060831_200000040189 [0,1,0,0,0,1|2,0,0]=4 17394 B16R1.1696 COCCOC(=O)COc1ncccc1Cl 34a_100011290957_200000040189 [0,1,0,0,0,1|2,0,0]=4 17395 B16R1.1696 COCCOC(=O)COc1ncccc1F 34a_100011219419_200000040189 [0,1,0,0,0,1|2,0,0]=4 17396 B16R1.1696 COCCOC(=O)COc1ncccc1N 34a_100000746358_200000040189 [0,1,0,0,0,1|2,0,0]=4 17397 B16R1.1696 COCCOC(=O)CSc1c[nH]ccc1=O 62a_100009998708_200000040189 [0,1,0,0,0,1|2,0,0]=4 17398 B16R1.1696 COCCOC(=O)CSc1c[nH]ccc1=O 62a_200000040189_100009998708 [0,1,0,0,0,1|2,0,0]=4 17399 B16R1.1696 COCCOC(=O)CSc1c[nH]ccc1=S 62a_200000040189_200012280681 [0,1,0,0,0,1|2,0,0]=4 17400 B16R1.1696 COCCOC(=O)CSc1c[nH]ccc1=S 62a_200012280681_200000040189 [0,1,0,0,0,1|2,0,0]=4 17401 B16R1.1696 COCCOC(=O)CSc1cccc[n+]1C 62a_200000040189_100000212160 [0,1,0,0,0,1|2,0,0]=4 17402 B16R1.1696 COCCOC(=O)CSc1cccc[n+]1[O-] 62a_200000040189_200000042595 [0,1,0,0,0,1|2,0,0]=4 17403 B16R1.1696 COCCOC(=O)CSc1ccccc1Br 62a_100000695589_200000040189 [0,1,0,0,0,1|1,0,0]=3 17404 B16R1.1696 COCCOC(=O)CSc1ccccc1Br 62a_200000040189_100000695589 [0,1,0,0,0,1|1,0,0]=3 17405 B16R1.1696 COCCOC(=O)CSc1ccccc1C 62a_100000210755_200000040189 [0,1,0,0,0,1|1,0,0]=3 17406 B16R1.1696 COCCOC(=O)CSc1ccccc1C 62a_200000040189_100000210755 [0,1,0,0,0,1|1,0,0]=3 17407 B16R1.1696 COCCOC(=O)CSc1ccccc1Cl 62a_100000764095_200000040189 [0,1,0,0,0,1|1,0,0]=3 17408 B16R1.1696 COCCOC(=O)CSc1ccccc1Cl 62a_200000040189_100000764095 [0,1,0,0,0,1|1,0,0]=3 17409 B16R1.1696 COCCOC(=O)CSc1ccccc1F 62a_100011215700_200000040189 [0,1,0,0,0,1|1,0,0]=3 17410 B16R1.1696 COCCOC(=O)CSc1ccccc1F 62a_200000040189_100011215700 [0,1,0,0,0,1|1,0,0]=3 17411 B16R1.1696 COCCOC(=O)CSc1ccccc1N 62a_100000210017_200000040189 [0,1,0,0,0,1|1,0,0]=3 17412 B16R1.1696 COCCOC(=O)CSc1ccccc1N 62a_200000040189_100000210017 [0,1,0,0,0,1|1,0,0]=3 17413 B16R1.1696 COCCOC(=O)CSc1ccccc1O 62a_100000739446_200000040189 [0,1,0,0,0,1|1,0,0]=3 17414 B16R1.1696 COCCOC(=O)CSc1ccccc1O 62a_200000040189_100000739446 [0,1,0,0,0,1|1,0,0]=3 17415 B16R1.1696 COCCOC(=O)CSc1cccnc1Br 62a_100010202626_200000040189 [0,1,0,0,0,1|2,0,0]=4 17416 B16R1.1696 COCCOC(=O)CSc1cccnc1Br 62a_200000040189_100010202626 [0,1,0,0,0,1|2,0,0]=4 17417 B16R1.1696 COCCOC(=O)CSc1cccnc1C 62a_100000751574_200000040189 [0,1,0,0,0,1|2,0,0]=4 17418 B16R1.1696 COCCOC(=O)CSc1cccnc1C 62a_200000040189_100000751574 [0,1,0,0,0,1|2,0,0]=4 17419 B16R1.1696 COCCOC(=O)CSc1cccnc1Cl 62a_100000036424_200000040189 [0,1,0,0,0,1|2,0,0]=4 17420 B16R1.1696 COCCOC(=O)CSc1cccnc1Cl 62a_200000040189_100000036424 [0,1,0,0,0,1|2,0,0]=4 17421 B16R1.1696 COCCOC(=O)CSc1cccnc1F 62a_100009816115_200000040189 [0,1,0,0,0,1|2,0,0]=4 17422 B16R1.1696 COCCOC(=O)CSc1cccnc1F 62a_200000040189_100009816115 [0,1,0,0,0,1|2,0,0]=4 17423 B16R1.1696 COCCOC(=O)CSc1cccnc1N 62a_100000045569_200000040189 [0,1,0,0,0,1|2,0,0]=4 17424 B16R1.1696 COCCOC(=O)CSc1cccnc1N 62a_200000040189_100000045569 [0,1,0,0,0,1|2,0,0]=4 17425 B16R1.1696 COCCOC(=O)CSc1cccnc1O 62a_100000760158_200000040189 [0,1,0,0,0,1|2,0,0]=4 17426 B16R1.1696 COCCOC(=O)CSc1cccnc1O 62a_200000040189_100000760158 [0,1,0,0,0,1|2,0,0]=4 17427 B16R1.1696 COCCOC(=O)CSc1ccncc1Br 62a_100000726257_200000040189 [0,1,0,0,0,1|2,0,0]=4 17428 B16R1.1696 COCCOC(=O)CSc1ccncc1Br 62a_200000040189_100000726257 [0,1,0,0,0,1|2,0,0]=4 17429 B16R1.1696 COCCOC(=O)CSc1ccncc1C 62a_100000765111_200000040189 [0,1,0,0,0,1|2,0,0]=4 17430 B16R1.1696 COCCOC(=O)CSc1ccncc1C 62a_200000040189_100000765111 [0,1,0,0,0,1|2,0,0]=4 17431 B16R1.1696 COCCOC(=O)CSc1ccncc1Cl 62a_100000708259_200000040189 [0,1,0,0,0,1|2,0,0]=4 17432 B16R1.1696 COCCOC(=O)CSc1ccncc1Cl 62a_200000040189_100000708259 [0,1,0,0,0,1|2,0,0]=4 17433 B16R1.1696 COCCOC(=O)CSc1ccncc1F 62a_100000047030_200000040189 [0,1,0,0,0,1|2,0,0]=4 17434 B16R1.1696 COCCOC(=O)CSc1ccncc1F 62a_200000040189_100000047030 [0,1,0,0,0,1|2,0,0]=4 17435 B16R1.1696 COCCOC(=O)CSc1ccncc1N 62a_100000756074_200000040189 [0,1,0,0,0,1|2,0,0]=4 17436 B16R1.1696 COCCOC(=O)CSc1ccncc1N 62a_200000040189_100000756074 [0,1,0,0,0,1|2,0,0]=4 17437 B16R1.1696 COCCOC(=O)CSc1ccncc1O 62a_100009817591_200000040189 [0,1,0,0,0,1|2,0,0]=4 17438 B16R1.1696 COCCOC(=O)CSc1ccncc1O 62a_200000040189_100009817591 [0,1,0,0,0,1|2,0,0]=4 17439 B16R1.1696 COCCOC(=O)CSc1cnccc1Br 62a_100010138639_200000040189 [0,1,0,0,0,1|2,0,0]=4 17440 B16R1.1696 COCCOC(=O)CSc1cnccc1Br 62a_200000040189_100010138639 [0,1,0,0,0,1|2,0,0]=4 17441 B16R1.1696 COCCOC(=O)CSc1cnccc1C 62a_100000761580_200000040189 [0,1,0,0,0,1|2,0,0]=4 17442 B16R1.1696 COCCOC(=O)CSc1cnccc1C 62a_200000040189_100000761580 [0,1,0,0,0,1|2,0,0]=4 17443 B16R1.1696 COCCOC(=O)CSc1cnccc1Cl 62a_100009995489_200000040189 [0,1,0,0,0,1|2,0,0]=4 17444 B16R1.1696 COCCOC(=O)CSc1cnccc1Cl 62a_200000040189_100009995489 [0,1,0,0,0,1|2,0,0]=4 17445 B16R1.1696 COCCOC(=O)CSc1cnccc1F 62a_100009820683_200000040189 [0,1,0,0,0,1|2,0,0]=4 17446 B16R1.1696 COCCOC(=O)CSc1cnccc1F 62a_200000040189_100009820683 [0,1,0,0,0,1|2,0,0]=4 17447 B16R1.1696 COCCOC(=O)CSc1cnccc1N 62a_100000047001_200000040189 [0,1,0,0,0,1|2,0,0]=4 17448 B16R1.1696 COCCOC(=O)CSc1cnccc1N 62a_200000040189_100000047001 [0,1,0,0,0,1|2,0,0]=4 17449 B16R1.1696 COCCOC(=O)CSc1ncccc1Br 62a_100000696092_200000040189 [0,1,0,0,0,1|2,0,0]=4 17450 B16R1.1696 COCCOC(=O)CSc1ncccc1Br 62a_200000040189_100000696092 [0,1,0,0,0,1|2,0,0]=4 17451 B16R1.1696 COCCOC(=O)CSc1ncccc1C 62a_100000751373_200000040189 [0,1,0,0,0,1|2,0,0]=4 17452 B16R1.1696 COCCOC(=O)CSc1ncccc1C 62a_200000040189_100000751373 [0,1,0,0,0,1|2,0,0]=4 17453 B16R1.1696 COCCOC(=O)CSc1ncccc1Cl 62a_100011356963_200000040189 [0,1,0,0,0,1|2,0,0]=4 17454 B16R1.1696 COCCOC(=O)CSc1ncccc1Cl 62a_200000040189_100011356963 [0,1,0,0,0,1|2,0,0]=4 17455 B16R1.1696 COCCOC(=O)CSc1ncccc1F 62a_100000685392_200000040189 [0,1,0,0,0,1|2,0,0]=4 17456 B16R1.1696 COCCOC(=O)CSc1ncccc1F 62a_200000040189_100000685392 [0,1,0,0,0,1|2,0,0]=4 17457 B16R1.1696 COCCOC(=O)CSc1ncccc1N 62a_100000688686_200000040189 [0,1,0,0,0,1|2,0,0]=4 17458 B16R1.1696 COCCOC(=O)CSc1ncccc1N 62a_200000040189_100000688686 [0,1,0,0,0,1|2,0,0]=4 17459 B16R1.1696 COCCOC(=O)CSc1ncccc1O 62a_100000034122_200000040189 [0,1,0,0,0,1|2,0,0]=4 17460 B16R1.1696 COCCOC(=O)CSc1ncccc1O 62a_200000040189_100000034122 [0,1,0,0,0,1|2,0,0]=4 17461 B16R1.1696 CSCCCC(=O)CCc1ccccc1Br 1458a_100000173376_100012161201 [0,1,0,0,0,1|2,0,0]=4 17462 B16R1.1696 CSCCCC(=O)CCc1ccccc1C 1458a_100000173376_100011713688 [0,1,0,0,0,1|2,0,0]=4 17463 B16R1.1696 CSCCCC(=O)CCc1ccccc1Cl 1458a_100000173376_100011713703 [0,1,0,0,0,1|2,0,0]=4 17464 B16R1.1696 CSCCCC(=O)CCc1ccccc1F 1458a_100000173376_100000720011 [0,1,0,0,0,1|2,0,0]=4 17465 B16R1.1696 CSCCCC(=O)CCc1ccccc1O 1458a_100000173376_100000722297 [0,1,0,0,0,1|2,0,0]=4 17466 B16R1.1696 CSCCCC(=O)NCc1ccccc1Br 11a_100000689332_100000173376 [0,1,0,0,0,1|2,0,0]=4 17467 B16R1.1696 CSCCCC(=O)NCc1ccccc1Br 1626a_100000689332_100000173376 [0,1,0,0,0,1|2,0,0]=4 17468 B16R1.1696 CSCCCC(=O)NCc1ccccc1Br 240690a_100000689332_100000173376 [0,1,0,0,0,1|2,0,0]=4 17469 B16R1.1696 CSCCCC(=O)NCc1ccccc1Br 527a_100000689332_100000173376 [0,1,0,0,0,1|2,0,0]=4 17470 B16R1.1696 CSCCCC(=O)NCc1ccccc1C 11a_100000174972_100000173376 [0,1,0,0,0,1|2,0,0]=4 17471 B16R1.1696 CSCCCC(=O)NCc1ccccc1C 1626a_100000174972_100000173376 [0,1,0,0,0,1|2,0,0]=4 17472 B16R1.1696 CSCCCC(=O)NCc1ccccc1C 240690a_100000174972_100000173376 [0,1,0,0,0,1|2,0,0]=4 17473 B16R1.1696 CSCCCC(=O)NCc1ccccc1C 527a_100000174972_100000173376 [0,1,0,0,0,1|2,0,0]=4 17474 B16R1.1696 CSCCCC(=O)NCc1ccccc1Cl 11a_100000174879_100000173376 [0,1,0,0,0,1|2,0,0]=4 17475 B16R1.1696 CSCCCC(=O)NCc1ccccc1Cl 1626a_100000174879_100000173376 [0,1,0,0,0,1|2,0,0]=4 17476 B16R1.1696 CSCCCC(=O)NCc1ccccc1Cl 240690a_100000174879_100000173376 [0,1,0,0,0,1|2,0,0]=4 17477 B16R1.1696 CSCCCC(=O)NCc1ccccc1Cl 527a_100000174879_100000173376 [0,1,0,0,0,1|2,0,0]=4 17478 B16R1.1696 CSCCCC(=O)NCc1ccccc1F 11a_100000174869_100000173376 [0,1,0,0,0,1|2,0,0]=4 17479 B16R1.1696 CSCCCC(=O)NCc1ccccc1F 1626a_100000174869_100000173376 [0,1,0,0,0,1|2,0,0]=4 17480 B16R1.1696 CSCCCC(=O)NCc1ccccc1F 240690a_100000174869_100000173376 [0,1,0,0,0,1|2,0,0]=4 17481 B16R1.1696 CSCCCC(=O)NCc1ccccc1F 527a_100000174869_100000173376 [0,1,0,0,0,1|2,0,0]=4 17482 B16R1.1696 CSCCCC(=O)NCc1ccccc1I 11a_100015347259_100000173376 [0,1,0,0,0,1|2,0,0]=4 17483 B16R1.1696 CSCCCC(=O)NCc1ccccc1I 1626a_100015347259_100000173376 [0,1,0,0,0,1|2,0,0]=4 17484 B16R1.1696 CSCCCC(=O)NCc1ccccc1I 240690a_100015347259_100000173376 [0,1,0,0,0,1|2,0,0]=4 17485 B16R1.1696 CSCCCC(=O)NCc1ccccc1I 527a_100015347259_100000173376 [0,1,0,0,0,1|2,0,0]=4 17486 B16R1.1696 CSCCCC(=O)NCc1ccccc1O 240690a_100000185550_100000173376 [0,1,0,0,0,1|2,0,0]=4 17487 B16R1.1696 CSCCCC(=O)NCc1ccccc1O 527a_100000185550_100000173376 [0,1,0,0,0,1|2,0,0]=4 17488 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br 11a_100020590264_100000740810 [0,1,0,0,0,1|2,0,0]=4 17489 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br 1626a_100020590264_100000740810 [0,1,0,0,0,1|2,0,0]=4 17490 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br 240690a_100020590264_100000740810 [0,1,0,0,0,1|2,0,0]=4 17491 B16R1.1696 CSCCNC(=O)CCc1ccccc1Br 527a_100020590264_100000740810 [0,1,0,0,0,1|2,0,0]=4 17492 B16R1.1696 CSCCNC(=O)CCc1ccccc1C 11a_100020590264_100000748742 [0,1,0,0,0,1|2,0,0]=4 17493 B16R1.1696 CSCCNC(=O)CCc1ccccc1C 1626a_100020590264_100000748742 [0,1,0,0,0,1|2,0,0]=4 17494 B16R1.1696 CSCCNC(=O)CCc1ccccc1C 240690a_100020590264_100000748742 [0,1,0,0,0,1|2,0,0]=4 17495 B16R1.1696 CSCCNC(=O)CCc1ccccc1C 527a_100020590264_100000748742 [0,1,0,0,0,1|2,0,0]=4 17496 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl 11a_100020590264_100000184300 [0,1,0,0,0,1|2,0,0]=4 17497 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl 1626a_100020590264_100000184300 [0,1,0,0,0,1|2,0,0]=4 17498 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl 240690a_100020590264_100000184300 [0,1,0,0,0,1|2,0,0]=4 17499 B16R1.1696 CSCCNC(=O)CCc1ccccc1Cl 527a_100020590264_100000184300 [0,1,0,0,0,1|2,0,0]=4 17500 B16R1.1696 CSCCNC(=O)CCc1ccccc1F 11a_100020590264_100000189703 [0,1,0,0,0,1|2,0,0]=4 17501 B16R1.1696 CSCCNC(=O)CCc1ccccc1F 1626a_100020590264_100000189703 [0,1,0,0,0,1|2,0,0]=4 17502 B16R1.1696 CSCCNC(=O)CCc1ccccc1F 240690a_100020590264_100000189703 [0,1,0,0,0,1|2,0,0]=4 17503 B16R1.1696 CSCCNC(=O)CCc1ccccc1F 527a_100020590264_100000189703 [0,1,0,0,0,1|2,0,0]=4 17504 B16R1.1696 CSCCNC(=O)CCc1ccccc1I 11a_100020590264_100000037306 [0,1,0,0,0,1|2,0,0]=4 17505 B16R1.1696 CSCCNC(=O)CCc1ccccc1I 1626a_100020590264_100000037306 [0,1,0,0,0,1|2,0,0]=4 17506 B16R1.1696 CSCCNC(=O)CCc1ccccc1I 240690a_100020590264_100000037306 [0,1,0,0,0,1|2,0,0]=4 17507 B16R1.1696 CSCCNC(=O)CCc1ccccc1I 527a_100020590264_100000037306 [0,1,0,0,0,1|2,0,0]=4 17508 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 11a_100020590264_100000181328 [0,1,0,0,0,1|2,0,0]=4 17509 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 240690a_100020590264_100000181328 [0,1,0,0,0,1|2,0,0]=4 17510 B16R1.1696 CSCCNC(=O)CCc1ccccc1O 527a_100020590264_100000181328 [0,1,0,0,0,1|2,0,0]=4 17511 B16R1.1696 CSCCNC(=O)COc1ccccc1Br 11a_100020590264_100000216496 [0,1,0,0,0,1|2,0,0]=4 17512 B16R1.1696 CSCCNC(=O)COc1ccccc1Br 1626a_100020590264_100000216496 [0,1,0,0,0,1|2,0,0]=4 17513 B16R1.1696 CSCCNC(=O)COc1ccccc1Br 240690a_100020590264_100000216496 [0,1,0,0,0,1|2,0,0]=4 17514 B16R1.1696 CSCCNC(=O)COc1ccccc1Br 527a_100020590264_100000216496 [0,1,0,0,0,1|2,0,0]=4 17515 B16R1.1696 CSCCNC(=O)COc1ccccc1C 11a_100020590264_100000182418 [0,1,0,0,0,1|2,0,0]=4 17516 B16R1.1696 CSCCNC(=O)COc1ccccc1C 1626a_100020590264_100000182418 [0,1,0,0,0,1|2,0,0]=4 17517 B16R1.1696 CSCCNC(=O)COc1ccccc1C 240690a_100020590264_100000182418 [0,1,0,0,0,1|2,0,0]=4 17518 B16R1.1696 CSCCNC(=O)COc1ccccc1C 527a_100020590264_100000182418 [0,1,0,0,0,1|2,0,0]=4 17519 B16R1.1696 CSCCNC(=O)COc1ccccc1Cl 11a_100020590264_100000185159 [0,1,0,0,0,1|2,0,0]=4 17520 B16R1.1696 CSCCNC(=O)COc1ccccc1Cl 1626a_100020590264_100000185159 [0,1,0,0,0,1|2,0,0]=4 17521 B16R1.1696 CSCCNC(=O)COc1ccccc1Cl 240690a_100020590264_100000185159 [0,1,0,0,0,1|2,0,0]=4 17522 B16R1.1696 CSCCNC(=O)COc1ccccc1Cl 527a_100020590264_100000185159 [0,1,0,0,0,1|2,0,0]=4 17523 B16R1.1696 CSCCNC(=O)COc1ccccc1F 11a_100020590264_100000182486 [0,1,0,0,0,1|2,0,0]=4 17524 B16R1.1696 CSCCNC(=O)COc1ccccc1F 1626a_100020590264_100000182486 [0,1,0,0,0,1|2,0,0]=4 17525 B16R1.1696 CSCCNC(=O)COc1ccccc1F 240690a_100020590264_100000182486 [0,1,0,0,0,1|2,0,0]=4 17526 B16R1.1696 CSCCNC(=O)COc1ccccc1F 527a_100020590264_100000182486 [0,1,0,0,0,1|2,0,0]=4 17527 B16R1.1696 CSCCNC(=O)COc1ccccc1O 240690a_100020590264_100000183020 [0,1,0,0,0,1|2,0,0]=4 17528 B16R1.1696 CSCCNC(=O)COc1ccccc1O 527a_100020590264_100000183020 [0,1,0,0,0,1|2,0,0]=4 17529 B16R1.1696 CSCCNC(=O)CSc1ccccc1C 11a_100020590264_100000183026 [0,1,0,0,0,1|2,0,0]=4 17530 B16R1.1696 CSCCNC(=O)CSc1ccccc1C 1626a_100020590264_100000183026 [0,1,0,0,0,1|2,0,0]=4 17531 B16R1.1696 CSCCNC(=O)CSc1ccccc1C 240690a_100020590264_100000183026 [0,1,0,0,0,1|2,0,0]=4 17532 B16R1.1696 CSCCNC(=O)CSc1ccccc1C 527a_100020590264_100000183026 [0,1,0,0,0,1|2,0,0]=4 17533 B16R1.1696 CSCCNC(=O)CSc1ccccc1F 11a_100020590264_100000179528 [0,1,0,0,0,1|2,0,0]=4 17534 B16R1.1696 CSCCNC(=O)CSc1ccccc1F 1626a_100020590264_100000179528 [0,1,0,0,0,1|2,0,0]=4 17535 B16R1.1696 CSCCNC(=O)CSc1ccccc1F 240690a_100020590264_100000179528 [0,1,0,0,0,1|2,0,0]=4 17536 B16R1.1696 CSCCNC(=O)CSc1ccccc1O 240690a_100020590264_100000695322 [0,1,0,0,0,1|2,0,0]=4 17537 B16R1.1696 CSCCNC(=O)CSc1ccccc1O 527a_100020590264_100000695322 [0,1,0,0,0,1|2,0,0]=4 17538 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 2708a_100000689332_100020590264 [0,1,0,0,0,1|2,0,0]=4 17539 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 2708a_100020590264_100000689332 [0,1,0,0,0,1|2,0,0]=4 17540 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 273464a_100000689332_100020590264 [0,1,0,0,0,1|2,0,0]=4 17541 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 273464a_100020590264_100000689332 [0,1,0,0,0,1|2,0,0]=4 17542 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 512a_100000689332_100020590264 [0,1,0,0,0,1|2,0,0]=4 17543 B16R1.1696 CSCCNC(=O)NCc1ccccc1Br 512a_100020590264_100000689332 [0,1,0,0,0,1|2,0,0]=4 17544 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 2708a_100000174972_100020590264 [0,1,0,0,0,1|2,0,0]=4 17545 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 2708a_100020590264_100000174972 [0,1,0,0,0,1|2,0,0]=4 17546 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 273464a_100000174972_100020590264 [0,1,0,0,0,1|2,0,0]=4 17547 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 273464a_100020590264_100000174972 [0,1,0,0,0,1|2,0,0]=4 17548 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 512a_100000174972_100020590264 [0,1,0,0,0,1|2,0,0]=4 17549 B16R1.1696 CSCCNC(=O)NCc1ccccc1C 512a_100020590264_100000174972 [0,1,0,0,0,1|2,0,0]=4 17550 B16R1.1696 CSCCNC(=O)NCc1ccccc1Cl 2708a_100000174879_100020590264 [0,1,0,0,0,1|2,0,0]=4 17551 B16R1.1696 CSCCNC(=O)NCc1ccccc1Cl 2708a_100020590264_100000174879 [0,1,0,0,0,1|2,0,0]=4 17552 B16R1.1696 CSCCNC(=O)NCc1ccccc1Cl 273464a_100000174879_100020590264 [0,1,0,0,0,1|2,0,0]=4 17553 B16R1.1696 CSCCNC(=O)NCc1ccccc1Cl 273464a_100020590264_100000174879 [0,1,0,0,0,1|2,0,0]=4 17554 B16R1.1696 CSCCNC(=O)NCc1ccccc1Cl 512a_100020590264_100000174879 [0,1,0,0,0,1|2,0,0]=4 17555 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 2708a_100000174869_100020590264 [0,1,0,0,0,1|2,0,0]=4 17556 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 2708a_100020590264_100000174869 [0,1,0,0,0,1|2,0,0]=4 17557 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 273464a_100000174869_100020590264 [0,1,0,0,0,1|2,0,0]=4 17558 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 273464a_100020590264_100000174869 [0,1,0,0,0,1|2,0,0]=4 17559 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 512a_100000174869_100020590264 [0,1,0,0,0,1|2,0,0]=4 17560 B16R1.1696 CSCCNC(=O)NCc1ccccc1F 512a_100020590264_100000174869 [0,1,0,0,0,1|2,0,0]=4 17561 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 2708a_100015347259_100020590264 [0,1,0,0,0,1|2,0,0]=4 17562 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 2708a_100020590264_100015347259 [0,1,0,0,0,1|2,0,0]=4 17563 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 273464a_100015347259_100020590264 [0,1,0,0,0,1|2,0,0]=4 17564 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 273464a_100020590264_100015347259 [0,1,0,0,0,1|2,0,0]=4 17565 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 512a_100015347259_100020590264 [0,1,0,0,0,1|2,0,0]=4 17566 B16R1.1696 CSCCNC(=O)NCc1ccccc1I 512a_100020590264_100015347259 [0,1,0,0,0,1|2,0,0]=4 17567 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 2708a_100000185550_100020590264 [0,1,0,0,0,1|2,0,0]=4 17568 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 2708a_100020590264_100000185550 [0,1,0,0,0,1|2,0,0]=4 17569 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 273464a_100000185550_100020590264 [0,1,0,0,0,1|2,0,0]=4 17570 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 273464a_100020590264_100000185550 [0,1,0,0,0,1|2,0,0]=4 17571 B16R1.1696 CSCCNC(=O)NCc1ccccc1O 512a_100000185550_100020590264 [0,1,0,0,0,1|2,0,0]=4 17572 B16R1.1696 Cc1ccccc1CCC(=O)CCCCF 1458a_100000748742_100000729493 [0,1,0,0,0,1|2,0,0]=4 17573 B16R1.1696 Cc1ccccc1CCC(=O)CCCCO 1458a_100000695505_100011713688 [0,1,0,0,0,1|2,0,0]=4 17574 B16R1.1696 Cc1ccccc1CCC(=O)CCCCO 1458a_100000748742_100000210776 [0,1,0,0,0,1|2,0,0]=4 17575 B16R1.1696 Cc1ccccc1CCC(=O)NCCCF 11a_100015189416_100000748742 [0,1,0,0,0,1|2,0,0]=4 17576 B16R1.1696 Cc1ccccc1CCC(=O)NCCCF 1626a_100015189416_100000748742 [0,1,0,0,0,1|2,0,0]=4 17577 B16R1.1696 Cc1ccccc1CCC(=O)NCCCF 240690a_100015189416_100000748742 [0,1,0,0,0,1|2,0,0]=4 17578 B16R1.1696 Cc1ccccc1CCC(=O)NCCCF 527a_100015189416_100000748742 [0,1,0,0,0,1|2,0,0]=4 17579 B16R1.1696 Cc1ccccc1CCC(=O)NCCCO 240690a_100000182051_100000748742 [0,1,0,0,0,1|2,0,0]=4 17580 B16R1.1696 Cc1ccccc1CCC(=O)NCCCO 527a_100000182051_100000748742 [0,1,0,0,0,1|2,0,0]=4 17581 B16R1.1696 Cc1ccccc1CNC(=O)CCCCO 1626a_100000174972_100000695505 [0,1,0,0,0,1|2,0,0]=4 17582 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 2708a_100000174972_100015189416 [0,1,0,0,0,1|2,0,0]=4 17583 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 2708a_100015189416_100000174972 [0,1,0,0,0,1|2,0,0]=4 17584 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 273464a_100000174972_100015189416 [0,1,0,0,0,1|2,0,0]=4 17585 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 273464a_100015189416_100000174972 [0,1,0,0,0,1|2,0,0]=4 17586 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 512a_100000174972_100015189416 [0,1,0,0,0,1|2,0,0]=4 17587 B16R1.1696 Cc1ccccc1CNC(=O)NCCCF 512a_100015189416_100000174972 [0,1,0,0,0,1|2,0,0]=4 17588 B16R1.1696 Cc1ccccc1CNC(=O)NCCCO 2708a_100000174972_100000182051 [0,1,0,0,0,1|2,0,0]=4 17589 B16R1.1696 Cc1ccccc1CNC(=O)NCCCO 273464a_100000174972_100000182051 [0,1,0,0,0,1|2,0,0]=4 17590 B16R1.1696 Cc1ccccc1CNC(=O)NCCCO 273464a_100000182051_100000174972 [0,1,0,0,0,1|2,0,0]=4 17591 B16R1.1696 Cc1ccccc1CNC(=O)NCCCO 512a_100000174972_100000182051 [0,1,0,0,0,1|2,0,0]=4 17592 B16R1.1696 Cc1ccccc1OCC(=O)CCCCF 1458a_100000182418_100000729493 [0,1,0,0,0,1|2,0,0]=4 17593 B16R1.1696 Cc1ccccc1OCC(=O)CCCCO 1458a_100000182418_100000210776 [0,1,0,0,0,1|2,0,0]=4 17594 B16R1.1696 Cc1ccccc1OCC(=O)NCCCF 11a_100015189416_100000182418 [0,1,0,0,0,1|2,0,0]=4 17595 B16R1.1696 Cc1ccccc1OCC(=O)NCCCF 1626a_100015189416_100000182418 [0,1,0,0,0,1|2,0,0]=4 17596 B16R1.1696 Cc1ccccc1OCC(=O)NCCCF 240690a_100015189416_100000182418 [0,1,0,0,0,1|2,0,0]=4 17597 B16R1.1696 Cc1ccccc1OCC(=O)NCCCF 527a_100015189416_100000182418 [0,1,0,0,0,1|2,0,0]=4 17598 B16R1.1696 Cc1ccccc1OCC(=O)NCCCO 240690a_100000182051_100000182418 [0,1,0,0,0,1|2,0,0]=4 17599 B16R1.1696 Cc1ccccc1OCC(=O)NCCCO 527a_100000182051_100000182418 [0,1,0,0,0,1|2,0,0]=4 17600 B16R1.1696 Cc1ccccc1SCC(=O)CCCCF 1458a_100000183026_100000729493 [0,1,0,0,0,1|2,0,0]=4 17601 B16R1.1696 Cc1ccccc1SCC(=O)CCCCO 1458a_100000183026_100000210776 [0,1,0,0,0,1|2,0,0]=4 17602 B16R1.1696 Cc1ccccc1SCC(=O)NCCCF 11a_100015189416_100000183026 [0,1,0,0,0,1|2,0,0]=4 17603 B16R1.1696 Cc1ccccc1SCC(=O)NCCCF 1626a_100015189416_100000183026 [0,1,0,0,0,1|2,0,0]=4 17604 B16R1.1696 Cc1ccccc1SCC(=O)NCCCF 240690a_100015189416_100000183026 [0,1,0,0,0,1|2,0,0]=4 17605 B16R1.1696 Cc1ccccc1SCC(=O)NCCCF 527a_100015189416_100000183026 [0,1,0,0,0,1|2,0,0]=4 17606 B16R1.1696 Cc1ccccc1SCC(=O)NCCCO 240690a_100000182051_100000183026 [0,1,0,0,0,1|2,0,0]=4 17607 B16R1.1696 Cc1ccccc1SCC(=O)NCCCO 527a_100000182051_100000183026 [0,1,0,0,0,1|2,0,0]=4 17608 B16R1.1696 O=C(CCCCF)CCc1ccccc1Br 1458a_100000740810_100000729493 [0,1,0,0,0,1|2,0,0]=4 17609 B16R1.1696 O=C(CCCCF)CCc1ccccc1Cl 1458a_100000184300_100000729493 [0,1,0,0,0,1|2,0,0]=4 17610 B16R1.1696 O=C(CCCCF)CCc1ccccc1F 1458a_100000189703_100000729493 [0,1,0,0,0,1|2,0,0]=4 17611 B16R1.1696 O=C(CCCCF)CCc1ccccc1I 1458a_100000037306_100000729493 [0,1,0,0,0,1|2,0,0]=4 17612 B16R1.1696 O=C(CCCCF)CCc1ccccc1O 1458a_100000181328_100000729493 [0,1,0,0,0,1|2,0,0]=4 17613 B16R1.1696 O=C(CCCCF)COc1ccccc1Br 1458a_100000216496_100000729493 [0,1,0,0,0,1|2,0,0]=4 17614 B16R1.1696 O=C(CCCCF)COc1ccccc1Cl 1458a_100000185159_100000729493 [0,1,0,0,0,1|2,0,0]=4 17615 B16R1.1696 O=C(CCCCF)COc1ccccc1F 1458a_100000182486_100000729493 [0,1,0,0,0,1|2,0,0]=4 17616 B16R1.1696 O=C(CCCCF)COc1ccccc1O 1458a_100000183020_100000729493 [0,1,0,0,0,1|2,0,0]=4 17617 B16R1.1696 O=C(CCCCF)CSc1ccccc1F 1458a_100000179528_100000729493 [0,1,0,0,0,1|2,0,0]=4 17618 B16R1.1696 O=C(CCCCF)CSc1ccccc1O 1458a_100000695322_100000729493 [0,1,0,0,0,1|2,0,0]=4 17619 B16R1.1696 O=C(CCCCO)CCc1ccccc1Br 1458a_100000695505_100012161201 [0,1,0,0,0,1|2,0,0]=4 17620 B16R1.1696 O=C(CCCCO)CCc1ccccc1Br 1458a_100000740810_100000210776 [0,1,0,0,0,1|2,0,0]=4 17621 B16R1.1696 O=C(CCCCO)CCc1ccccc1Cl 1458a_100000184300_100000210776 [0,1,0,0,0,1|2,0,0]=4 17622 B16R1.1696 O=C(CCCCO)CCc1ccccc1Cl 1458a_100000695505_100011713703 [0,1,0,0,0,1|2,0,0]=4 17623 B16R1.1696 O=C(CCCCO)CCc1ccccc1F 1458a_100000189703_100000210776 [0,1,0,0,0,1|2,0,0]=4 17624 B16R1.1696 O=C(CCCCO)CCc1ccccc1F 1458a_100000695505_100000720011 [0,1,0,0,0,1|2,0,0]=4 17625 B16R1.1696 O=C(CCCCO)CCc1ccccc1I 1458a_100000037306_100000210776 [0,1,0,0,0,1|2,0,0]=4 17626 B16R1.1696 O=C(CCCCO)CCc1ccccc1O 1458a_100000181328_100000210776 [0,1,0,0,0,1|2,0,0]=4 17627 B16R1.1696 O=C(CCCCO)CCc1ccccc1O 1458a_100000695505_100000722297 [0,1,0,0,0,1|2,0,0]=4 17628 B16R1.1696 O=C(CCCCO)COc1ccccc1Br 1458a_100000216496_100000210776 [0,1,0,0,0,1|2,0,0]=4 17629 B16R1.1696 O=C(CCCCO)COc1ccccc1Cl 1458a_100000185159_100000210776 [0,1,0,0,0,1|2,0,0]=4 17630 B16R1.1696 O=C(CCCCO)COc1ccccc1F 1458a_100000182486_100000210776 [0,1,0,0,0,1|2,0,0]=4 17631 B16R1.1696 O=C(CCCCO)COc1ccccc1O 1458a_100000183020_100000210776 [0,1,0,0,0,1|2,0,0]=4 17632 B16R1.1696 O=C(CCCCO)CSc1ccccc1F 1458a_100000179528_100000210776 [0,1,0,0,0,1|2,0,0]=4 17633 B16R1.1696 O=C(CCCCO)CSc1ccccc1O 1458a_100000695322_100000210776 [0,1,0,0,0,1|2,0,0]=4 17634 B16R1.1696 O=C(CCCCO)NCc1ccccc1Br 1626a_100000689332_100000695505 [0,1,0,0,0,1|2,0,0]=4 17635 B16R1.1696 O=C(CCCCO)NCc1ccccc1Cl 1626a_100000174879_100000695505 [0,1,0,0,0,1|2,0,0]=4 17636 B16R1.1696 O=C(CCCCO)NCc1ccccc1F 1626a_100000174869_100000695505 [0,1,0,0,0,1|2,0,0]=4 17637 B16R1.1696 O=C(CCCCO)NCc1ccccc1I 1626a_100015347259_100000695505 [0,1,0,0,0,1|2,0,0]=4 17638 B16R1.1696 O=C(CCc1ccccc1Br)NCCCF 11a_100015189416_100000740810 [0,1,0,0,0,1|2,0,0]=4 17639 B16R1.1696 O=C(CCc1ccccc1Br)NCCCF 1626a_100015189416_100000740810 [0,1,0,0,0,1|2,0,0]=4 17640 B16R1.1696 O=C(CCc1ccccc1Br)NCCCF 240690a_100015189416_100000740810 [0,1,0,0,0,1|2,0,0]=4 17641 B16R1.1696 O=C(CCc1ccccc1Br)NCCCF 527a_100015189416_100000740810 [0,1,0,0,0,1|2,0,0]=4 17642 B16R1.1696 O=C(CCc1ccccc1Br)NCCCO 240690a_100000182051_100000740810 [0,1,0,0,0,1|2,0,0]=4 17643 B16R1.1696 O=C(CCc1ccccc1Br)NCCCO 527a_100000182051_100000740810 [0,1,0,0,0,1|2,0,0]=4 17644 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCF 11a_100015189416_100000184300 [0,1,0,0,0,1|2,0,0]=4 17645 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCF 1626a_100015189416_100000184300 [0,1,0,0,0,1|2,0,0]=4 17646 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCF 240690a_100015189416_100000184300 [0,1,0,0,0,1|2,0,0]=4 17647 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCF 527a_100015189416_100000184300 [0,1,0,0,0,1|2,0,0]=4 17648 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCO 240690a_100000182051_100000184300 [0,1,0,0,0,1|2,0,0]=4 17649 B16R1.1696 O=C(CCc1ccccc1Cl)NCCCO 527a_100000182051_100000184300 [0,1,0,0,0,1|2,0,0]=4 17650 B16R1.1696 O=C(CCc1ccccc1F)NCCCF 11a_100015189416_100000189703 [0,1,0,0,0,1|2,0,0]=4 17651 B16R1.1696 O=C(CCc1ccccc1F)NCCCF 1626a_100015189416_100000189703 [0,1,0,0,0,1|2,0,0]=4 17652 B16R1.1696 O=C(CCc1ccccc1F)NCCCF 240690a_100015189416_100000189703 [0,1,0,0,0,1|2,0,0]=4 17653 B16R1.1696 O=C(CCc1ccccc1F)NCCCF 527a_100015189416_100000189703 [0,1,0,0,0,1|2,0,0]=4 17654 B16R1.1696 O=C(CCc1ccccc1F)NCCCO 240690a_100000182051_100000189703 [0,1,0,0,0,1|2,0,0]=4 17655 B16R1.1696 O=C(CCc1ccccc1F)NCCCO 527a_100000182051_100000189703 [0,1,0,0,0,1|2,0,0]=4 17656 B16R1.1696 O=C(CCc1ccccc1I)NCCCF 11a_100015189416_100000037306 [0,1,0,0,0,1|2,0,0]=4 17657 B16R1.1696 O=C(CCc1ccccc1I)NCCCF 1626a_100015189416_100000037306 [0,1,0,0,0,1|2,0,0]=4 17658 B16R1.1696 O=C(CCc1ccccc1I)NCCCF 240690a_100015189416_100000037306 [0,1,0,0,0,1|2,0,0]=4 17659 B16R1.1696 O=C(CCc1ccccc1I)NCCCF 527a_100015189416_100000037306 [0,1,0,0,0,1|2,0,0]=4 17660 B16R1.1696 O=C(CCc1ccccc1I)NCCCO 240690a_100000182051_100000037306 [0,1,0,0,0,1|2,0,0]=4 17661 B16R1.1696 O=C(CCc1ccccc1I)NCCCO 527a_100000182051_100000037306 [0,1,0,0,0,1|2,0,0]=4 17662 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 11a_100015189416_100000181328 [0,1,0,0,0,1|2,0,0]=4 17663 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 240690a_100015189416_100000181328 [0,1,0,0,0,1|2,0,0]=4 17664 B16R1.1696 O=C(CCc1ccccc1O)NCCCF 527a_100015189416_100000181328 [0,1,0,0,0,1|2,0,0]=4 17665 B16R1.1696 O=C(CCc1ccccc1O)NCCCO 240690a_100000182051_100000181328 [0,1,0,0,0,1|2,0,0]=4 17666 B16R1.1696 O=C(CCc1ccccc1O)NCCCO 527a_100000182051_100000181328 [0,1,0,0,0,1|2,0,0]=4 17667 B16R1.1696 O=C(COc1ccccc1Br)NCCCF 11a_100015189416_100000216496 [0,1,0,0,0,1|2,0,0]=4 17668 B16R1.1696 O=C(COc1ccccc1Br)NCCCF 1626a_100015189416_100000216496 [0,1,0,0,0,1|2,0,0]=4 17669 B16R1.1696 O=C(COc1ccccc1Br)NCCCF 240690a_100015189416_100000216496 [0,1,0,0,0,1|2,0,0]=4 17670 B16R1.1696 O=C(COc1ccccc1Br)NCCCF 527a_100015189416_100000216496 [0,1,0,0,0,1|2,0,0]=4 17671 B16R1.1696 O=C(COc1ccccc1Br)NCCCO 240690a_100000182051_100000216496 [0,1,0,0,0,1|2,0,0]=4 17672 B16R1.1696 O=C(COc1ccccc1Br)NCCCO 527a_100000182051_100000216496 [0,1,0,0,0,1|2,0,0]=4 17673 B16R1.1696 O=C(COc1ccccc1Cl)NCCCF 11a_100015189416_100000185159 [0,1,0,0,0,1|2,0,0]=4 17674 B16R1.1696 O=C(COc1ccccc1Cl)NCCCF 1626a_100015189416_100000185159 [0,1,0,0,0,1|2,0,0]=4 17675 B16R1.1696 O=C(COc1ccccc1Cl)NCCCF 240690a_100015189416_100000185159 [0,1,0,0,0,1|2,0,0]=4 17676 B16R1.1696 O=C(COc1ccccc1Cl)NCCCF 527a_100015189416_100000185159 [0,1,0,0,0,1|2,0,0]=4 17677 B16R1.1696 O=C(COc1ccccc1Cl)NCCCO 240690a_100000182051_100000185159 [0,1,0,0,0,1|2,0,0]=4 17678 B16R1.1696 O=C(COc1ccccc1Cl)NCCCO 527a_100000182051_100000185159 [0,1,0,0,0,1|2,0,0]=4 17679 B16R1.1696 O=C(COc1ccccc1F)NCCCF 11a_100015189416_100000182486 [0,1,0,0,0,1|2,0,0]=4 17680 B16R1.1696 O=C(COc1ccccc1F)NCCCF 1626a_100015189416_100000182486 [0,1,0,0,0,1|2,0,0]=4 17681 B16R1.1696 O=C(COc1ccccc1F)NCCCF 240690a_100015189416_100000182486 [0,1,0,0,0,1|2,0,0]=4 17682 B16R1.1696 O=C(COc1ccccc1F)NCCCF 527a_100015189416_100000182486 [0,1,0,0,0,1|2,0,0]=4 17683 B16R1.1696 O=C(COc1ccccc1F)NCCCO 240690a_100000182051_100000182486 [0,1,0,0,0,1|2,0,0]=4 17684 B16R1.1696 O=C(COc1ccccc1F)NCCCO 527a_100000182051_100000182486 [0,1,0,0,0,1|2,0,0]=4 17685 B16R1.1696 O=C(COc1ccccc1O)NCCCF 240690a_100015189416_100000183020 [0,1,0,0,0,1|2,0,0]=4 17686 B16R1.1696 O=C(COc1ccccc1O)NCCCF 527a_100015189416_100000183020 [0,1,0,0,0,1|2,0,0]=4 17687 B16R1.1696 O=C(COc1ccccc1O)NCCCO 240690a_100000182051_100000183020 [0,1,0,0,0,1|2,0,0]=4 17688 B16R1.1696 O=C(COc1ccccc1O)NCCCO 527a_100000182051_100000183020 [0,1,0,0,0,1|2,0,0]=4 17689 B16R1.1696 O=C(CSc1ccccc1F)NCCCF 11a_100015189416_100000179528 [0,1,0,0,0,1|2,0,0]=4 17690 B16R1.1696 O=C(CSc1ccccc1F)NCCCF 1626a_100015189416_100000179528 [0,1,0,0,0,1|2,0,0]=4 17691 B16R1.1696 O=C(CSc1ccccc1F)NCCCF 240690a_100015189416_100000179528 [0,1,0,0,0,1|2,0,0]=4 17692 B16R1.1696 O=C(CSc1ccccc1F)NCCCO 240690a_100000182051_100000179528 [0,1,0,0,0,1|2,0,0]=4 17693 B16R1.1696 O=C(CSc1ccccc1O)NCCCF 240690a_100015189416_100000695322 [0,1,0,0,0,1|2,0,0]=4 17694 B16R1.1696 O=C(CSc1ccccc1O)NCCCF 527a_100015189416_100000695322 [0,1,0,0,0,1|2,0,0]=4 17695 B16R1.1696 O=C(CSc1ccccc1O)NCCCO 240690a_100000182051_100000695322 [0,1,0,0,0,1|2,0,0]=4 17696 B16R1.1696 O=C(CSc1ccccc1O)NCCCO 527a_100000182051_100000695322 [0,1,0,0,0,1|2,0,0]=4 17697 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 2708a_100000689332_100015189416 [0,1,0,0,0,1|2,0,0]=4 17698 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 2708a_100015189416_100000689332 [0,1,0,0,0,1|2,0,0]=4 17699 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 273464a_100000689332_100015189416 [0,1,0,0,0,1|2,0,0]=4 17700 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 273464a_100015189416_100000689332 [0,1,0,0,0,1|2,0,0]=4 17701 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 512a_100000689332_100015189416 [0,1,0,0,0,1|2,0,0]=4 17702 B16R1.1696 O=C(NCCCF)NCc1ccccc1Br 512a_100015189416_100000689332 [0,1,0,0,0,1|2,0,0]=4 17703 B16R1.1696 O=C(NCCCF)NCc1ccccc1Cl 2708a_100000174879_100015189416 [0,1,0,0,0,1|2,0,0]=4 17704 B16R1.1696 O=C(NCCCF)NCc1ccccc1Cl 2708a_100015189416_100000174879 [0,1,0,0,0,1|2,0,0]=4 17705 B16R1.1696 O=C(NCCCF)NCc1ccccc1Cl 273464a_100000174879_100015189416 [0,1,0,0,0,1|2,0,0]=4 17706 B16R1.1696 O=C(NCCCF)NCc1ccccc1Cl 273464a_100015189416_100000174879 [0,1,0,0,0,1|2,0,0]=4 17707 B16R1.1696 O=C(NCCCF)NCc1ccccc1Cl 512a_100015189416_100000174879 [0,1,0,0,0,1|2,0,0]=4 17708 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 2708a_100000174869_100015189416 [0,1,0,0,0,1|2,0,0]=4 17709 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 2708a_100015189416_100000174869 [0,1,0,0,0,1|2,0,0]=4 17710 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 273464a_100000174869_100015189416 [0,1,0,0,0,1|2,0,0]=4 17711 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 273464a_100015189416_100000174869 [0,1,0,0,0,1|2,0,0]=4 17712 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 512a_100000174869_100015189416 [0,1,0,0,0,1|2,0,0]=4 17713 B16R1.1696 O=C(NCCCF)NCc1ccccc1F 512a_100015189416_100000174869 [0,1,0,0,0,1|2,0,0]=4 17714 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 2708a_100015189416_100015347259 [0,1,0,0,0,1|2,0,0]=4 17715 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 2708a_100015347259_100015189416 [0,1,0,0,0,1|2,0,0]=4 17716 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 273464a_100015189416_100015347259 [0,1,0,0,0,1|2,0,0]=4 17717 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 273464a_100015347259_100015189416 [0,1,0,0,0,1|2,0,0]=4 17718 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 512a_100015189416_100015347259 [0,1,0,0,0,1|2,0,0]=4 17719 B16R1.1696 O=C(NCCCF)NCc1ccccc1I 512a_100015347259_100015189416 [0,1,0,0,0,1|2,0,0]=4 17720 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 2708a_100000185550_100015189416 [0,1,0,0,0,1|2,0,0]=4 17721 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 2708a_100015189416_100000185550 [0,1,0,0,0,1|2,0,0]=4 17722 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 273464a_100000185550_100015189416 [0,1,0,0,0,1|2,0,0]=4 17723 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 273464a_100015189416_100000185550 [0,1,0,0,0,1|2,0,0]=4 17724 B16R1.1696 O=C(NCCCF)NCc1ccccc1O 512a_100000185550_100015189416 [0,1,0,0,0,1|2,0,0]=4 17725 B16R1.1696 O=C(NCCCO)NCc1ccccc1Br 2708a_100000689332_100000182051 [0,1,0,0,0,1|2,0,0]=4 17726 B16R1.1696 O=C(NCCCO)NCc1ccccc1Br 273464a_100000182051_100000689332 [0,1,0,0,0,1|2,0,0]=4 17727 B16R1.1696 O=C(NCCCO)NCc1ccccc1Br 273464a_100000689332_100000182051 [0,1,0,0,0,1|2,0,0]=4 17728 B16R1.1696 O=C(NCCCO)NCc1ccccc1Br 512a_100000689332_100000182051 [0,1,0,0,0,1|2,0,0]=4 17729 B16R1.1696 O=C(NCCCO)NCc1ccccc1Cl 2708a_100000174879_100000182051 [0,1,0,0,0,1|2,0,0]=4 17730 B16R1.1696 O=C(NCCCO)NCc1ccccc1Cl 273464a_100000174879_100000182051 [0,1,0,0,0,1|2,0,0]=4 17731 B16R1.1696 O=C(NCCCO)NCc1ccccc1Cl 273464a_100000182051_100000174879 [0,1,0,0,0,1|2,0,0]=4 17732 B16R1.1696 O=C(NCCCO)NCc1ccccc1F 2708a_100000174869_100000182051 [0,1,0,0,0,1|2,0,0]=4 17733 B16R1.1696 O=C(NCCCO)NCc1ccccc1F 273464a_100000174869_100000182051 [0,1,0,0,0,1|2,0,0]=4 17734 B16R1.1696 O=C(NCCCO)NCc1ccccc1F 273464a_100000182051_100000174869 [0,1,0,0,0,1|2,0,0]=4 17735 B16R1.1696 O=C(NCCCO)NCc1ccccc1F 512a_100000174869_100000182051 [0,1,0,0,0,1|2,0,0]=4 17736 B16R1.1696 O=C(NCCCO)NCc1ccccc1I 2708a_100015347259_100000182051 [0,1,0,0,0,1|2,0,0]=4 17737 B16R1.1696 O=C(NCCCO)NCc1ccccc1I 273464a_100000182051_100015347259 [0,1,0,0,0,1|2,0,0]=4 17738 B16R1.1696 O=C(NCCCO)NCc1ccccc1I 273464a_100015347259_100000182051 [0,1,0,0,0,1|2,0,0]=4 17739 B16R1.1696 O=C(NCCCO)NCc1ccccc1I 512a_100015347259_100000182051 [0,1,0,0,0,1|2,0,0]=4 17740 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 2708a_100000185550_100000182051 [0,1,0,0,0,1|2,0,0]=4 17741 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 273464a_100000182051_100000185550 [0,1,0,0,0,1|2,0,0]=4 17742 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 273464a_100000185550_100000182051 [0,1,0,0,0,1|2,0,0]=4 17743 B16R1.1696 O=C(NCCCO)NCc1ccccc1O 512a_100000185550_100000182051 [0,1,0,0,0,1|2,0,0]=4 17744 B16R1.1758 CCCCOC(CN)COc1ccccc1 34a_100000738913_100000210210 [0,1,0,0,0,1|1,0,1]=4 17745 B16R1.20527 CCCCCS(=O)(=O)NCc1ccccc1 270084a_100015324214_100000753860 [0,1,0,0,0,1|2,0,0]=4 17746 B16R1.20527 CCCCCS(=O)(=O)NCc1ccccc1 274078a_100015324214_100000753860 [0,1,0,0,0,1|2,0,0]=4 17747 B16R1.20527 CCCCNS(=O)(=O)CCc1ccccc1 270084a_100000102301_100000738789 [0,1,0,0,0,1|2,0,0]=4 17748 B16R1.20527 CCCCNS(=O)(=O)CCc1ccccc1 274078a_100000102301_100000738789 [0,1,0,0,0,1|2,0,0]=4 17749 B16R1.20527 CCCCOC(C)(C)CCc1ccccc1 7a_100000750528_100000210211 [0,1,0,0,0,1|1,0,1]=4 17750 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100010269958 [0,2,0,0,0,0|1,0,1]=4 17751 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000696528_100000189115 [0,2,0,0,0,0|1,0,1]=4 17752 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100010269958 [0,2,0,0,0,0|1,0,1]=4 17753 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000696528_100000210814 [0,2,0,0,0,0|1,0,1]=4 17754 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100010269958 [0,2,0,0,0,0|1,0,1]=4 17755 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000696528_100000694040 [0,2,0,0,0,0|1,0,1]=4 17756 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100010269958 [0,2,0,0,0,0|1,0,1]=4 17757 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000696528_100000198546 [0,2,0,0,0,0|1,0,1]=4 17758 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100010269958 [0,2,0,0,0,0|1,0,1]=4 17759 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000696528_100000189116 [0,2,0,0,0,0|1,0,1]=4 17760 B16R1.54 C#CCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100010269958 [0,2,0,0,0,0|1,0,1]=4 17761 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Br 11a_100000718082_100000198978 [0,2,0,0,0,0|1,0,1]=4 17762 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000718082_100000198978 [0,2,0,0,0,0|1,0,1]=4 17763 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Br 527a_100000718082_100000198978 [0,2,0,0,0,0|1,0,1]=4 17764 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)C 11a_100000718082_100000212244 [0,2,0,0,0,0|1,0,1]=4 17765 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)C 240690a_100000718082_100000212244 [0,2,0,0,0,0|1,0,1]=4 17766 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)C 527a_100000718082_100000212244 [0,2,0,0,0,0|1,0,1]=4 17767 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000718082_100000211027 [0,2,0,0,0,0|1,0,1]=4 17768 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000718082_100000211027 [0,2,0,0,0,0|1,0,1]=4 17769 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000718082_100000211027 [0,2,0,0,0,0|1,0,1]=4 17770 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F 11a_100000718082_100000210951 [0,2,0,0,0,0|1,0,1]=4 17771 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F 1626a_100000718082_100000210951 [0,2,0,0,0,0|1,0,1]=4 17772 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F 240690a_100000718082_100000210951 [0,2,0,0,0,0|1,0,1]=4 17773 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)F 527a_100000718082_100000210951 [0,2,0,0,0,0|1,0,1]=4 17774 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)I 11a_100000718082_100000688869 [0,2,0,0,0,0|1,0,1]=4 17775 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)I 1626a_100000718082_100000688869 [0,2,0,0,0,0|1,0,1]=4 17776 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)I 240690a_100000718082_100000688869 [0,2,0,0,0,0|1,0,1]=4 17777 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)I 527a_100000718082_100000688869 [0,2,0,0,0,0|1,0,1]=4 17778 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)O 1626a_100000718082_100000198540 [0,2,0,0,0,0|1,0,1]=4 17779 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)O 240690a_100000718082_100000198540 [0,2,0,0,0,0|1,0,1]=4 17780 B16R1.54 C#CCCCNC(=O)Cc1ccc(cc1)O 527a_100000718082_100000198540 [0,2,0,0,0,0|1,0,1]=4 17781 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215482 [0,2,0,0,0,0|1,0,1]=4 17782 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100011215552_100000189115 [0,2,0,0,0,0|1,0,1]=4 17783 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011215482 [0,2,0,0,0,0|1,0,1]=4 17784 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)C 1458a_100011215552_100000210814 [0,2,0,0,0,0|1,0,1]=4 17785 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215482 [0,2,0,0,0,0|1,0,1]=4 17786 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100011215552_100000694040 [0,2,0,0,0,0|1,0,1]=4 17787 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215482 [0,2,0,0,0,0|1,0,1]=4 17788 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)F 1458a_100011215552_100000198546 [0,2,0,0,0,0|1,0,1]=4 17789 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215482 [0,2,0,0,0,0|1,0,1]=4 17790 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)I 1458a_100011215552_100000189116 [0,2,0,0,0,0|1,0,1]=4 17791 B16R1.54 C=CCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215482 [0,2,0,0,0,0|1,0,1]=4 17792 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Br 11a_100000700776_100000198978 [0,2,0,0,0,0|1,0,1]=4 17793 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000700776_100000198978 [0,2,0,0,0,0|1,0,1]=4 17794 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Br 527a_100000700776_100000198978 [0,2,0,0,0,0|1,0,1]=4 17795 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)C 11a_100000700776_100000212244 [0,2,0,0,0,0|1,0,1]=4 17796 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)C 240690a_100000700776_100000212244 [0,2,0,0,0,0|1,0,1]=4 17797 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)C 527a_100000700776_100000212244 [0,2,0,0,0,0|1,0,1]=4 17798 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000700776_100000211027 [0,2,0,0,0,0|1,0,1]=4 17799 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000700776_100000211027 [0,2,0,0,0,0|1,0,1]=4 17800 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000700776_100000211027 [0,2,0,0,0,0|1,0,1]=4 17801 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)F 11a_100000700776_100000210951 [0,2,0,0,0,0|1,0,1]=4 17802 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)F 1626a_100000700776_100000210951 [0,2,0,0,0,0|1,0,1]=4 17803 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)F 240690a_100000700776_100000210951 [0,2,0,0,0,0|1,0,1]=4 17804 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)F 527a_100000700776_100000210951 [0,2,0,0,0,0|1,0,1]=4 17805 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)I 11a_100000700776_100000688869 [0,2,0,0,0,0|1,0,1]=4 17806 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)I 1626a_100000700776_100000688869 [0,2,0,0,0,0|1,0,1]=4 17807 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)I 240690a_100000700776_100000688869 [0,2,0,0,0,0|1,0,1]=4 17808 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)I 527a_100000700776_100000688869 [0,2,0,0,0,0|1,0,1]=4 17809 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)O 1626a_100000700776_100000198540 [0,2,0,0,0,0|1,0,1]=4 17810 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)O 240690a_100000700776_100000198540 [0,2,0,0,0,0|1,0,1]=4 17811 B16R1.54 C=CCCCNC(=O)Cc1ccc(cc1)O 527a_100000700776_100000198540 [0,2,0,0,0,0|1,0,1]=4 17812 B16R1.54 CC(Cc1ccc(cc1)F)OCCCCF 34a_100011351027_100000729493 [0,2,0,0,0,0|1,0,1]=4 17813 B16R1.54 CC(Cc1ccc(cc1)F)OCCCCF 7a_100011351027_100000729493 [0,2,0,0,0,0|1,0,1]=4 17814 B16R1.54 CC(Cc1ccc(cc1)F)OCCCCO 34a_100011351027_100011216708 [0,2,0,0,0,0|1,0,1]=4 17815 B16R1.54 CC(Cc1ccc(cc1)F)OCCCCO 7a_100011351027_100000210776 [0,2,0,0,0,0|1,0,1]=4 17816 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100015370543 [0,2,0,0,0,0|1,0,1]=4 17817 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100015370543 [0,2,0,0,0,0|1,0,1]=4 17818 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100015370543 [0,2,0,0,0,0|1,0,1]=4 17819 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100015370543 [0,2,0,0,0,0|1,0,1]=4 17820 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100015370543 [0,2,0,0,0,0|1,0,1]=4 17821 B16R1.54 CC/C=C\CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100015370543 [0,2,0,0,0,0|1,0,1]=4 17822 B16R1.54 CCC/C=C/CC(=O)Cc1ccc(cc1)Br 1458a_200016266809_100000189115 [0,2,0,0,0,0|1,0,1]=4 17823 B16R1.54 CCC/C=C/CC(=O)Cc1ccc(cc1)C 1458a_200016266809_100000210814 [0,2,0,0,0,0|1,0,1]=4 17824 B16R1.54 CCC/C=C/CC(=O)Cc1ccc(cc1)Cl 1458a_200016266809_100000694040 [0,2,0,0,0,0|1,0,1]=4 17825 B16R1.54 CCC/C=C/CC(=O)Cc1ccc(cc1)F 1458a_200016266809_100000198546 [0,2,0,0,0,0|1,0,1]=4 17826 B16R1.54 CCC/C=C/CC(=O)Cc1ccc(cc1)I 1458a_200016266809_100000189116 [0,2,0,0,0,0|1,0,1]=4 17827 B16R1.54 CCCC=NNC(=O)Cc1ccc(cc1)C 4a_100000189221_100000185831 [0,2,0,0,0,0|1,0,1]=4 17828 B16R1.54 CCCC=NNC(=O)Cc1ccc(cc1)Cl 4a_100000181177_100000185831 [0,2,0,0,0,0|1,0,1]=4 17829 B16R1.54 CCCC=NNC(=O)Cc1ccc(cc1)F 4a_100000181394_100000185831 [0,2,0,0,0,0|1,0,1]=4 17830 B16R1.54 CCCCC=CC(=O)Cc1ccc(cc1)Br 1458a_100016266645_100000189115 [0,2,0,0,0,0|1,0,0]=3 17831 B16R1.54 CCCCC=CC(=O)Cc1ccc(cc1)C 1458a_100016266645_100000210814 [0,2,0,0,0,0|1,0,0]=3 17832 B16R1.54 CCCCC=CC(=O)Cc1ccc(cc1)Cl 1458a_100016266645_100000694040 [0,2,0,0,0,0|1,0,0]=3 17833 B16R1.54 CCCCC=CC(=O)Cc1ccc(cc1)F 1458a_100016266645_100000198546 [0,2,0,0,0,0|1,0,0]=3 17834 B16R1.54 CCCCC=CC(=O)Cc1ccc(cc1)I 1458a_100016266645_100000189116 [0,2,0,0,0,0|1,0,0]=3 17835 B16R1.54 CCCCC=CC(=O)Cc1ccc(cn1)Br 1458a_100016266645_100000702658 [0,2,0,0,0,0|2,0,0]=4 17836 B16R1.54 CCCCC=CC(=O)Cc1ccc(cn1)C 1458a_100016266645_100000691093 [0,2,0,0,0,0|2,0,0]=4 17837 B16R1.54 CCCCC=CC(=O)Cc1ccc(cn1)Cl 1458a_100016266645_100012066911 [0,2,0,0,0,0|2,0,0]=4 17838 B16R1.54 CCCCC=CC(=O)Cc1ccc(cn1)F 1458a_100016266645_100000703193 [0,2,0,0,0,0|2,0,0]=4 17839 B16R1.54 CCCCC=CC(=O)Cc1ccc(nc1)Br 1458a_100016266645_100009831999 [0,2,0,0,0,0|2,0,0]=4 17840 B16R1.54 CCCCC=CC(=O)Cc1ccc(nc1)C 1458a_100016266645_100016987292 [0,2,0,0,0,0|2,0,0]=4 17841 B16R1.54 CCCCC=CC(=O)Cc1ccc(nc1)Cl 1458a_100016266645_100000735431 [0,2,0,0,0,0|2,0,0]=4 17842 B16R1.54 CCCCC=CC(=O)Cc1ccc(nc1)F 1458a_100016266645_100009820150 [0,2,0,0,0,0|2,0,0]=4 17843 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100016266645 [0,2,0,0,0,0|2,0,0]=4 17844 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100016266645 [0,2,0,0,0,0|2,0,0]=4 17845 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100016266645 [0,2,0,0,0,0|2,0,0]=4 17846 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)C 11a_100000124888_100016266645 [0,2,0,0,0,0|2,0,0]=4 17847 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100016266645 [0,2,0,0,0,0|2,0,0]=4 17848 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100016266645 [0,2,0,0,0,0|2,0,0]=4 17849 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100016266645 [0,2,0,0,0,0|2,0,0]=4 17850 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100016266645 [0,2,0,0,0,0|2,0,0]=4 17851 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100016266645 [0,2,0,0,0,0|2,0,0]=4 17852 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)F 11a_100000185862_100016266645 [0,2,0,0,0,0|2,0,0]=4 17853 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100016266645 [0,2,0,0,0,0|2,0,0]=4 17854 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100016266645 [0,2,0,0,0,0|2,0,0]=4 17855 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)I 11a_100000185761_100016266645 [0,2,0,0,0,0|2,0,0]=4 17856 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100016266645 [0,2,0,0,0,0|2,0,0]=4 17857 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100016266645 [0,2,0,0,0,0|2,0,0]=4 17858 B16R1.54 CCCCC=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100016266645 [0,2,0,0,0,0|2,0,0]=4 17859 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210757 [0,2,0,0,0,0|1,0,0]=3 17860 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)Br 1458a_100102632555_100000189115 [0,2,0,0,0,0|1,0,0]=3 17861 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210757 [0,2,0,0,0,0|1,0,0]=3 17862 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)C 1458a_100102632555_100000210814 [0,2,0,0,0,0|1,0,0]=3 17863 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210757 [0,2,0,0,0,0|1,0,0]=3 17864 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100102632555_100000694040 [0,2,0,0,0,0|1,0,0]=3 17865 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210757 [0,2,0,0,0,0|1,0,0]=3 17866 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)F 1458a_100102632555_100000198546 [0,2,0,0,0,0|1,0,0]=3 17867 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210757 [0,2,0,0,0,0|1,0,0]=3 17868 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)I 1458a_100102632555_100000189116 [0,2,0,0,0,0|1,0,0]=3 17869 B16R1.54 CCCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210757 [0,2,0,0,0,0|1,0,0]=3 17870 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210757 [0,2,0,0,0,0|2,0,0]=4 17871 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)Br 1458a_100102632555_100000702658 [0,2,0,0,0,0|2,0,0]=4 17872 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210757 [0,2,0,0,0,0|2,0,0]=4 17873 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)C 1458a_100102632555_100000691093 [0,2,0,0,0,0|2,0,0]=4 17874 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210757 [0,2,0,0,0,0|2,0,0]=4 17875 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100102632555_100012066911 [0,2,0,0,0,0|2,0,0]=4 17876 B16R1.54 CCCCCCC(=O)Cc1ccc(cn1)F 1458a_100102632555_100000703193 [0,2,0,0,0,0|2,0,0]=4 17877 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210757 [0,2,0,0,0,0|2,0,0]=4 17878 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)Br 1458a_100102632555_100009831999 [0,2,0,0,0,0|2,0,0]=4 17879 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210757 [0,2,0,0,0,0|2,0,0]=4 17880 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)C 1458a_100102632555_100016987292 [0,2,0,0,0,0|2,0,0]=4 17881 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210757 [0,2,0,0,0,0|2,0,0]=4 17882 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100102632555_100000735431 [0,2,0,0,0,0|2,0,0]=4 17883 B16R1.54 CCCCCCC(=O)Cc1ccc(nc1)F 1458a_100102632555_100009820150 [0,2,0,0,0,0|2,0,0]=4 17884 B16R1.54 CCCCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210757 [0,2,0,0,0,0|2,0,0]=4 17885 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100102632555 [0,2,0,0,0,0|2,0,0]=4 17886 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100102632555 [0,2,0,0,0,0|2,0,0]=4 17887 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100102632555 [0,2,0,0,0,0|2,0,0]=4 17888 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100102632555 [0,2,0,0,0,0|2,0,0]=4 17889 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100102632555 [0,2,0,0,0,0|2,0,0]=4 17890 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100102632555 [0,2,0,0,0,0|2,0,0]=4 17891 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100102632555 [0,2,0,0,0,0|2,0,0]=4 17892 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100102632555 [0,2,0,0,0,0|2,0,0]=4 17893 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100102632555 [0,2,0,0,0,0|2,0,0]=4 17894 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100102632555 [0,2,0,0,0,0|2,0,0]=4 17895 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100102632555 [0,2,0,0,0,0|2,0,0]=4 17896 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100102632555 [0,2,0,0,0,0|2,0,0]=4 17897 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100102632555 [0,2,0,0,0,0|2,0,0]=4 17898 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100102632555 [0,2,0,0,0,0|2,0,0]=4 17899 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100102632555 [0,2,0,0,0,0|2,0,0]=4 17900 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100102632555 [0,2,0,0,0,0|2,0,0]=4 17901 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100102632555 [0,2,0,0,0,0|2,0,0]=4 17902 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100102632555 [0,2,0,0,0,0|2,0,0]=4 17903 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100102632555 [0,2,0,0,0,0|2,0,0]=4 17904 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100102632555 [0,2,0,0,0,0|2,0,0]=4 17905 B16R1.54 CCCCCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100102632555 [0,2,0,0,0,0|2,0,0]=4 17906 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Br 11a_100000209983_100000198978 [0,2,0,0,0,0|1,0,0]=3 17907 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000209983_100000198978 [0,2,0,0,0,0|1,0,0]=3 17908 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Br 527a_100000209983_100000198978 [0,2,0,0,0,0|1,0,0]=3 17909 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)C 11a_100000209983_100000212244 [0,2,0,0,0,0|1,0,0]=3 17910 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)C 240690a_100000209983_100000212244 [0,2,0,0,0,0|1,0,0]=3 17911 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)C 527a_100000209983_100000212244 [0,2,0,0,0,0|1,0,0]=3 17912 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000209983_100000211027 [0,2,0,0,0,0|1,0,0]=3 17913 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000209983_100000211027 [0,2,0,0,0,0|1,0,0]=3 17914 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000209983_100000211027 [0,2,0,0,0,0|1,0,0]=3 17915 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F 11a_100000209983_100000210951 [0,2,0,0,0,0|1,0,0]=3 17916 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F 1626a_100000209983_100000210951 [0,2,0,0,0,0|1,0,0]=3 17917 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F 240690a_100000209983_100000210951 [0,2,0,0,0,0|1,0,0]=3 17918 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)F 527a_100000209983_100000210951 [0,2,0,0,0,0|1,0,0]=3 17919 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)I 11a_100000209983_100000688869 [0,2,0,0,0,0|1,0,0]=3 17920 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)I 1626a_100000209983_100000688869 [0,2,0,0,0,0|1,0,0]=3 17921 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)I 240690a_100000209983_100000688869 [0,2,0,0,0,0|1,0,0]=3 17922 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)I 527a_100000209983_100000688869 [0,2,0,0,0,0|1,0,0]=3 17923 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)O 1626a_100000209983_100000198540 [0,2,0,0,0,0|1,0,0]=3 17924 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)O 240690a_100000209983_100000198540 [0,2,0,0,0,0|1,0,0]=3 17925 B16R1.54 CCCCCNC(=O)Cc1ccc(cc1)O 527a_100000209983_100000198540 [0,2,0,0,0,0|1,0,0]=3 17926 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Br 11a_100000209983_100020629044 [0,2,0,0,0,0|2,0,0]=4 17927 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Br 240690a_100000209983_100020629044 [0,2,0,0,0,0|2,0,0]=4 17928 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)C 11a_100000209983_100025705728 [0,2,0,0,0,0|2,0,0]=4 17929 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)C 1626a_100000209983_100025705728 [0,2,0,0,0,0|2,0,0]=4 17930 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)C 240690a_100000209983_100025705728 [0,2,0,0,0,0|2,0,0]=4 17931 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl 11a_100000209983_100000728320 [0,2,0,0,0,0|2,0,0]=4 17932 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000209983_100000728320 [0,2,0,0,0,0|2,0,0]=4 17933 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000209983_100000728320 [0,2,0,0,0,0|2,0,0]=4 17934 B16R1.54 CCCCCNC(=O)Cc1ccc(cn1)Cl 527a_100000209983_100000728320 [0,2,0,0,0,0|2,0,0]=4 17935 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Br 11a_100000209983_100010067268 [0,2,0,0,0,0|2,0,0]=4 17936 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Br 240690a_100000209983_100010067268 [0,2,0,0,0,0|2,0,0]=4 17937 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Br 527a_100000209983_100010067268 [0,2,0,0,0,0|2,0,0]=4 17938 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C 11a_100000209983_100000740413 [0,2,0,0,0,0|2,0,0]=4 17939 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C 1626a_100000209983_100000740413 [0,2,0,0,0,0|2,0,0]=4 17940 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C 240690a_100000209983_100000740413 [0,2,0,0,0,0|2,0,0]=4 17941 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)C 527a_100000209983_100000740413 [0,2,0,0,0,0|2,0,0]=4 17942 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Cl 11a_100000209983_100000061944 [0,2,0,0,0,0|2,0,0]=4 17943 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000209983_100000061944 [0,2,0,0,0,0|2,0,0]=4 17944 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000209983_100000061944 [0,2,0,0,0,0|2,0,0]=4 17945 B16R1.54 CCCCCNC(=O)Cc1ccc(nc1)Cl 527a_100000209983_100000061944 [0,2,0,0,0,0|2,0,0]=4 17946 B16R1.54 CCCCCNC(=O)Cn1ccc(=O)cc1 11a_100000209983_200000238563 [0,2,0,0,0,0|2,0,0]=4 17947 B16R1.54 CCCCCNC(=O)Cn1ccc(=O)cc1 1626a_100000209983_200000238563 [0,2,0,0,0,0|2,0,0]=4 17948 B16R1.54 CCCCCNC(=O)Cn1ccc(=O)cc1 240690a_100000209983_200000238563 [0,2,0,0,0,0|2,0,0]=4 17949 B16R1.54 CCCCCNC(=O)Cn1ccc(=O)cc1 527a_100000209983_200000238563 [0,2,0,0,0,0|2,0,0]=4 17950 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000209983 [0,2,0,0,0,0|2,0,0]=4 17951 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000209983 [0,2,0,0,0,0|2,0,0]=4 17952 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000209983 [0,2,0,0,0,0|2,0,0]=4 17953 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000209983 [0,2,0,0,0,0|2,0,0]=4 17954 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000209983 [0,2,0,0,0,0|2,0,0]=4 17955 B16R1.54 CCCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000209983 [0,2,0,0,0,0|2,0,0]=4 17956 B16R1.54 CCCCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000718602 [0,2,0,0,0,0|1,0,1]=4 17957 B16R1.54 CCCCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000210326 [0,2,0,0,0,0|1,0,1]=4 17958 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)Br 2230a_100000102301_100000183692 [0,2,0,0,0,0|2,0,0]=4 17959 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)Br 2230a_100000741985_100000210211 [0,2,0,0,0,0|2,0,0]=4 17960 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)Br 7a_106832991798_100000183692 [0,2,0,0,0,0|2,0,0]=4 17961 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)C 2230a_100000102301_100000182914 [0,2,0,0,0,0|2,0,0]=4 17962 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)C 7a_106832991798_100000182914 [0,2,0,0,0,0|2,0,0]=4 17963 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)Cl 2230a_100000102301_100000182960 [0,2,0,0,0,0|2,0,0]=4 17964 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)Cl 7a_106832991798_100000182960 [0,2,0,0,0,0|2,0,0]=4 17965 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)F 2230a_100000102301_100000181725 [0,2,0,0,0,0|2,0,0]=4 17966 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)F 2230a_100025683178_100000210211 [0,2,0,0,0,0|2,0,0]=4 17967 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)F 34a_100025683178_100000210210 [0,2,0,0,0,0|2,0,0]=4 17968 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)F 7a_106832991798_100000181725 [0,2,0,0,0,0|2,0,0]=4 17969 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)I 2230a_100000102301_100000183000 [0,2,0,0,0,0|2,0,0]=4 17970 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)I 7a_106832991798_100000183000 [0,2,0,0,0,0|2,0,0]=4 17971 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)O 2230a_100000102301_100000233757 [0,2,0,0,0,0|2,0,0]=4 17972 B16R1.54 CCCCNCC(=O)Nc1ccc(cc1)O 7a_106832991798_100000233757 [0,2,0,0,0,0|2,0,0]=4 17973 B16R1.54 CCCCNCC(=O)Oc1ccc(cc1)Br 2230a_100000102301_200010760497 [0,2,0,0,0,0|2,0,0]=4 17974 B16R1.54 CCCCNCC(=O)Oc1ccc(cc1)Br 7a_106832991798_200010760497 [0,2,0,0,0,0|2,0,0]=4 17975 B16R1.54 CCCCNN=C(C)Cc1ccc(cc1)C 4a_100025702795_100000751045 [0,2,0,0,0,0|2,0,0]=4 17976 B16R1.54 CCCCNN=C(C)Cc1ccc(cc1)Cl 4a_100025702795_100000747806 [0,2,0,0,0,0|2,0,0]=4 17977 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)Br 22a_100025702795_100000198978 [0,2,0,0,0,0|1,0,0]=3 17978 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)C 22a_100025702795_100000212244 [0,2,0,0,0,0|1,0,0]=3 17979 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)Cl 22a_100025702795_100000211027 [0,2,0,0,0,0|1,0,0]=3 17980 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)F 22a_100025702795_100000210951 [0,2,0,0,0,0|1,0,0]=3 17981 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)I 22a_100025702795_100000688869 [0,2,0,0,0,0|1,0,0]=3 17982 B16R1.54 CCCCNNC(=O)Cc1ccc(cc1)O 22a_100025702795_100000198540 [0,2,0,0,0,0|1,0,0]=3 17983 B16R1.54 CCCCNNC(=O)Cc1ccc(cn1)Br 22a_100025702795_100020629044 [0,2,0,0,0,0|2,0,0]=4 17984 B16R1.54 CCCCNNC(=O)Cc1ccc(cn1)C 22a_100025702795_100025705728 [0,2,0,0,0,0|2,0,0]=4 17985 B16R1.54 CCCCNNC(=O)Cc1ccc(cn1)Cl 22a_100025702795_100000728320 [0,2,0,0,0,0|2,0,0]=4 17986 B16R1.54 CCCCNNC(=O)Cc1ccc(nc1)Br 22a_100025702795_100010067268 [0,2,0,0,0,0|2,0,0]=4 17987 B16R1.54 CCCCNNC(=O)Cc1ccc(nc1)C 22a_100025702795_100000740413 [0,2,0,0,0,0|2,0,0]=4 17988 B16R1.54 CCCCNNC(=O)Cc1ccc(nc1)Cl 22a_100025702795_100000061944 [0,2,0,0,0,0|2,0,0]=4 17989 B16R1.54 CCCCNNC(=O)Cn1ccc(=O)cc1 22a_100025702795_200000238563 [0,2,0,0,0,0|2,0,0]=4 17990 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011995733 [0,2,0,0,0,0|0,0,0]=2 17991 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)Br 1458a_100000757543_100000189115 [0,2,0,0,0,0|0,0,0]=2 17992 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011995733 [0,2,0,0,0,0|0,0,0]=2 17993 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)C 1458a_100000757543_100000210814 [0,2,0,0,0,0|0,0,0]=2 17994 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011995733 [0,2,0,0,0,0|0,0,0]=2 17995 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000757543_100000694040 [0,2,0,0,0,0|0,0,0]=2 17996 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011995733 [0,2,0,0,0,0|0,0,0]=2 17997 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)F 1458a_100000757543_100000198546 [0,2,0,0,0,0|0,0,0]=2 17998 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011995733 [0,2,0,0,0,0|0,0,0]=2 17999 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)I 1458a_100000757543_100000189116 [0,2,0,0,0,0|0,0,0]=2 18000 B16R1.54 CCCCOCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011995733 [0,2,0,0,0,0|0,0,0]=2 18001 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)Br 1458a_100000757543_100000702658 [0,2,0,0,0,0|1,0,0]=3 18002 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100011995733 [0,2,0,0,0,0|1,0,0]=3 18003 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)C 1458a_100000757543_100000691093 [0,2,0,0,0,0|1,0,0]=3 18004 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100011995733 [0,2,0,0,0,0|1,0,0]=3 18005 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100011995733 [0,2,0,0,0,0|1,0,0]=3 18006 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)Cl 1458a_100000757543_100012066911 [0,2,0,0,0,0|1,0,0]=3 18007 B16R1.54 CCCCOCC(=O)Cc1ccc(cn1)F 1458a_100000757543_100000703193 [0,2,0,0,0,0|1,0,0]=3 18008 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)Br 1458a_100000757543_100009831999 [0,2,0,0,0,0|1,0,0]=3 18009 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100011995733 [0,2,0,0,0,0|1,0,0]=3 18010 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100011995733 [0,2,0,0,0,0|1,0,0]=3 18011 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)C 1458a_100000757543_100016987292 [0,2,0,0,0,0|1,0,0]=3 18012 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100011995733 [0,2,0,0,0,0|1,0,0]=3 18013 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)Cl 1458a_100000757543_100000735431 [0,2,0,0,0,0|1,0,0]=3 18014 B16R1.54 CCCCOCC(=O)Cc1ccc(nc1)F 1458a_100000757543_100009820150 [0,2,0,0,0,0|1,0,0]=3 18015 B16R1.54 CCCCOCC(=O)Cc1ccc(nn1)Cl 1458a_100000757543_100016992710 [0,2,0,0,0,0|2,0,0]=4 18016 B16R1.54 CCCCOCC(=O)Cc1cnc(cn1)C 1458a_100000757543_100000752025 [0,2,0,0,0,0|2,0,0]=4 18017 B16R1.54 CCCCOCC(=O)Cc1ncc(cn1)Br 1458a_100000757543_100010064664 [0,2,0,0,0,0|2,0,0]=4 18018 B16R1.54 CCCCOCC(=O)Cc1ncc(cn1)C 1458a_100000757543_100000685645 [0,2,0,0,0,0|2,0,0]=4 18019 B16R1.54 CCCCOCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100011995733 [0,2,0,0,0,0|1,0,0]=3 18020 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000757543 [0,2,0,0,0,0|1,0,0]=3 18021 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000757543 [0,2,0,0,0,0|1,0,0]=3 18022 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000757543 [0,2,0,0,0,0|1,0,0]=3 18023 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 34a_100000210227_100000183692 [0,2,0,0,0,0|1,0,0]=3 18024 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000757543 [0,2,0,0,0,0|1,0,0]=3 18025 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Br 7a_100000210227_100000183692 [0,2,0,0,0,0|1,0,0]=3 18026 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000757543 [0,2,0,0,0,0|1,0,0]=3 18027 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000757543 [0,2,0,0,0,0|1,0,0]=3 18028 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000757543 [0,2,0,0,0,0|1,0,0]=3 18029 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 34a_100000210227_100000182914 [0,2,0,0,0,0|1,0,0]=3 18030 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000757543 [0,2,0,0,0,0|1,0,0]=3 18031 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)C 7a_100000210227_100000182914 [0,2,0,0,0,0|1,0,0]=3 18032 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000757543 [0,2,0,0,0,0|1,0,0]=3 18033 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000757543 [0,2,0,0,0,0|1,0,0]=3 18034 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000757543 [0,2,0,0,0,0|1,0,0]=3 18035 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210227_100000182960 [0,2,0,0,0,0|1,0,0]=3 18036 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000757543 [0,2,0,0,0,0|1,0,0]=3 18037 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)Cl 7a_100000210227_100000182960 [0,2,0,0,0,0|1,0,0]=3 18038 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000757543 [0,2,0,0,0,0|1,0,0]=3 18039 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000757543 [0,2,0,0,0,0|1,0,0]=3 18040 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000757543 [0,2,0,0,0,0|1,0,0]=3 18041 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 34a_100000210227_100000181725 [0,2,0,0,0,0|1,0,0]=3 18042 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000757543 [0,2,0,0,0,0|1,0,0]=3 18043 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)F 7a_100000210227_100000181725 [0,2,0,0,0,0|1,0,0]=3 18044 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000757543 [0,2,0,0,0,0|1,0,0]=3 18045 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000757543 [0,2,0,0,0,0|1,0,0]=3 18046 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000757543 [0,2,0,0,0,0|1,0,0]=3 18047 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 34a_100000210227_100000183000 [0,2,0,0,0,0|1,0,0]=3 18048 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000757543 [0,2,0,0,0,0|1,0,0]=3 18049 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)I 7a_100000210227_100000183000 [0,2,0,0,0,0|1,0,0]=3 18050 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000210210 [0,2,0,0,0,0|1,0,0]=3 18051 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000757543 [0,2,0,0,0,0|1,0,0]=3 18052 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)O 34a_100000210227_100000233757 [0,2,0,0,0,0|1,0,0]=3 18053 B16R1.54 CCCCOCC(=O)Nc1ccc(cc1)O 7a_100000210227_100000233757 [0,2,0,0,0,0|1,0,0]=3 18054 B16R1.54 CCCCOCC(=O)Nc1ccc(cn1)Br 7a_100000210227_100000239667 [0,2,0,0,0,0|2,0,0]=4 18055 B16R1.54 CCCCOCC(=O)Nc1ccc(cn1)C 7a_100000210227_100020671718 [0,2,0,0,0,0|2,0,0]=4 18056 B16R1.54 CCCCOCC(=O)Nc1ccc(cn1)Cl 7a_100000210227_100000183295 [0,2,0,0,0,0|2,0,0]=4 18057 B16R1.54 CCCCOCC(=O)Nc1ccc(nc1)Cl 34a_100000210227_100020591235 [0,2,0,0,0,0|2,0,0]=4 18058 B16R1.54 CCCCOCC(=O)Nc1ccc(nc1)Cl 7a_100000210227_100020591235 [0,2,0,0,0,0|2,0,0]=4 18059 B16R1.54 CCCCOCC(=O)Oc1ccc(cc1)Br 34a_100000210227_200010760497 [0,2,0,0,0,0|1,0,0]=3 18060 B16R1.54 CCCCOCC(=O)Oc1ccc(cc1)Br 7a_100000210227_200010760497 [0,2,0,0,0,0|1,0,0]=3 18061 B16R1.54 CCCCOCC(N)Cc1ccc(cc1)Cl 34a_100025702442_100000210210 [0,2,0,0,0,0|1,0,1]=4 18062 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)Br 2230a_100000180866_100011995733 [0,2,0,0,0,0|2,0,0]=4 18063 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100011995733 [0,2,0,0,0,0|2,0,0]=4 18064 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)C 2230a_100000744650_100011995733 [0,2,0,0,0,0|2,0,0]=4 18065 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)C 269982a_100000744650_100011995733 [0,2,0,0,0,0|2,0,0]=4 18066 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)C 34a_100000744650_100011995733 [0,2,0,0,0,0|2,0,0]=4 18067 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)Cl 2230a_100000184517_100011995733 [0,2,0,0,0,0|2,0,0]=4 18068 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100011995733 [0,2,0,0,0,0|2,0,0]=4 18069 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)Cl 34a_100000184517_100011995733 [0,2,0,0,0,0|2,0,0]=4 18070 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)F 2230a_100000184576_100011995733 [0,2,0,0,0,0|2,0,0]=4 18071 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)F 269982a_100000184576_100011995733 [0,2,0,0,0,0|2,0,0]=4 18072 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)F 34a_100000184576_100011995733 [0,2,0,0,0,0|2,0,0]=4 18073 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)O 2230a_100000207500_100011995733 [0,2,0,0,0,0|2,0,0]=4 18074 B16R1.54 CCCCOCN(C)Cc1ccc(cc1)O 269982a_100000207500_100011995733 [0,2,0,0,0,0|2,0,0]=4 18075 B16R1.54 CCCCSCC(=O)Cc1ccc(cc1)Br 1458a_100000191162_100000189115 [0,2,0,0,0,0|0,1,0]=3 18076 B16R1.54 CCCCSCC(=O)Cc1ccc(cc1)C 1458a_100000191162_100000210814 [0,2,0,0,0,0|0,1,0]=3 18077 B16R1.54 CCCCSCC(=O)Cc1ccc(cc1)Cl 1458a_100000191162_100000694040 [0,2,0,0,0,0|0,1,0]=3 18078 B16R1.54 CCCCSCC(=O)Cc1ccc(cc1)F 1458a_100000191162_100000198546 [0,2,0,0,0,0|0,1,0]=3 18079 B16R1.54 CCCCSCC(=O)Cc1ccc(cc1)I 1458a_100000191162_100000189116 [0,2,0,0,0,0|0,1,0]=3 18080 B16R1.54 CCCCSCC(=O)Cc1ccc(cn1)Br 1458a_100000191162_100000702658 [0,2,0,0,0,0|1,1,0]=4 18081 B16R1.54 CCCCSCC(=O)Cc1ccc(cn1)C 1458a_100000191162_100000691093 [0,2,0,0,0,0|1,1,0]=4 18082 B16R1.54 CCCCSCC(=O)Cc1ccc(cn1)Cl 1458a_100000191162_100012066911 [0,2,0,0,0,0|1,1,0]=4 18083 B16R1.54 CCCCSCC(=O)Cc1ccc(cn1)F 1458a_100000191162_100000703193 [0,2,0,0,0,0|1,1,0]=4 18084 B16R1.54 CCCCSCC(=O)Cc1ccc(nc1)Br 1458a_100000191162_100009831999 [0,2,0,0,0,0|1,1,0]=4 18085 B16R1.54 CCCCSCC(=O)Cc1ccc(nc1)C 1458a_100000191162_100016987292 [0,2,0,0,0,0|1,1,0]=4 18086 B16R1.54 CCCCSCC(=O)Cc1ccc(nc1)Cl 1458a_100000191162_100000735431 [0,2,0,0,0,0|1,1,0]=4 18087 B16R1.54 CCCCSCC(=O)Cc1ccc(nc1)F 1458a_100000191162_100009820150 [0,2,0,0,0,0|1,1,0]=4 18088 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000191162 [0,2,0,0,0,0|1,1,0]=4 18089 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000191162 [0,2,0,0,0,0|1,1,0]=4 18090 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000191162 [0,2,0,0,0,0|1,1,0]=4 18091 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000191162 [0,2,0,0,0,0|1,1,0]=4 18092 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 62a_100000183692_100000210210 [0,2,0,0,0,0|1,1,0]=4 18093 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Br 62a_100000210211_100000183692 [0,2,0,0,0,0|1,1,0]=4 18094 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000191162 [0,2,0,0,0,0|1,1,0]=4 18095 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000191162 [0,2,0,0,0,0|1,1,0]=4 18096 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000191162 [0,2,0,0,0,0|1,1,0]=4 18097 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000191162 [0,2,0,0,0,0|1,1,0]=4 18098 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)C 62a_100000210211_100000182914 [0,2,0,0,0,0|1,1,0]=4 18099 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000191162 [0,2,0,0,0,0|1,1,0]=4 18100 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000191162 [0,2,0,0,0,0|1,1,0]=4 18101 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000191162 [0,2,0,0,0,0|1,1,0]=4 18102 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000191162 [0,2,0,0,0,0|1,1,0]=4 18103 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 62a_100000210211_100000182960 [0,2,0,0,0,0|1,1,0]=4 18104 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)Cl 62a_200011202288_100000210210 [0,2,0,0,0,0|1,1,0]=4 18105 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000191162 [0,2,0,0,0,0|1,1,0]=4 18106 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000191162 [0,2,0,0,0,0|1,1,0]=4 18107 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000191162 [0,2,0,0,0,0|1,1,0]=4 18108 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000191162 [0,2,0,0,0,0|1,1,0]=4 18109 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 62a_100000210211_100000181725 [0,2,0,0,0,0|1,1,0]=4 18110 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)F 62a_200000243717_100000210210 [0,2,0,0,0,0|1,1,0]=4 18111 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000191162 [0,2,0,0,0,0|1,1,0]=4 18112 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000191162 [0,2,0,0,0,0|1,1,0]=4 18113 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000191162 [0,2,0,0,0,0|1,1,0]=4 18114 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000191162 [0,2,0,0,0,0|1,1,0]=4 18115 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 62a_100000183000_100000210210 [0,2,0,0,0,0|1,1,0]=4 18116 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)I 62a_100000210211_100000183000 [0,2,0,0,0,0|1,1,0]=4 18117 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000191162 [0,2,0,0,0,0|1,1,0]=4 18118 B16R1.54 CCCCSCC(=O)Nc1ccc(cc1)O 62a_100000210211_100000233757 [0,2,0,0,0,0|1,1,0]=4 18119 B16R1.54 CCCCSCC(=O)Oc1ccc(cc1)Br 62a_100000210211_200010760497 [0,2,0,0,0,0|1,1,0]=4 18120 B16R1.54 CCCCSCC(=O)Oc1ccc(cc1)Br 62a_200010760497_100000210210 [0,2,0,0,0,0|1,1,0]=4 18121 B16R1.54 CCCNCCC(=O)Nc1ccc(cc1)Br 2230a_100000743120_100000210303 [0,2,0,0,0,0|2,0,0]=4 18122 B16R1.54 CCCNCCC(=O)Nc1ccc(cc1)Br 34a_100000743120_100000210303 [0,2,0,0,0,0|2,0,0]=4 18123 B16R1.54 CCCNCCC(=O)Nc1ccc(cc1)C 34a_100015187665_100000210303 [0,2,0,0,0,0|2,0,0]=4 18124 B16R1.54 CCCNCCC(=O)Nc1ccc(cc1)F 2230a_100015184513_100000210303 [0,2,0,0,0,0|2,0,0]=4 18125 B16R1.54 CCCNCCC(=O)Nc1ccc(cc1)F 34a_100015184513_100000210303 [0,2,0,0,0,0|2,0,0]=4 18126 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215938 [0,2,0,0,0,0|1,0,0]=3 18127 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011215938 [0,2,0,0,0,0|1,0,0]=3 18128 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215938 [0,2,0,0,0,0|1,0,0]=3 18129 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215938 [0,2,0,0,0,0|1,0,0]=3 18130 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215938 [0,2,0,0,0,0|1,0,0]=3 18131 B16R1.54 CCCOCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215938 [0,2,0,0,0,0|1,0,0]=3 18132 B16R1.54 CCCOCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100011215938 [0,2,0,0,0,0|2,0,0]=4 18133 B16R1.54 CCCOCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100011215938 [0,2,0,0,0,0|2,0,0]=4 18134 B16R1.54 CCCOCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100011215938 [0,2,0,0,0,0|2,0,0]=4 18135 B16R1.54 CCCOCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100011215938 [0,2,0,0,0,0|2,0,0]=4 18136 B16R1.54 CCCOCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100011215938 [0,2,0,0,0,0|2,0,0]=4 18137 B16R1.54 CCCOCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100011215938 [0,2,0,0,0,0|2,0,0]=4 18138 B16R1.54 CCCOCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100011215938 [0,2,0,0,0,0|2,0,0]=4 18139 B16R1.54 CCCOCCC(=O)Nc1ccc(cc1)Br 34a_100000210258_100000740023 [0,2,0,0,0,0|2,0,0]=4 18140 B16R1.54 CCCOCCC(=O)Nc1ccc(cc1)C 34a_100000210258_200000187088 [0,2,0,0,0,0|2,0,0]=4 18141 B16R1.54 CCCOCCC(=O)Nc1ccc(cc1)C 34a_200009859269_100000210303 [0,2,0,0,0,0|2,0,0]=4 18142 B16R1.54 CCCOCCC(=O)Nc1ccc(cc1)C 7a_200009859269_100000210303 [0,2,0,0,0,0|2,0,0]=4 18143 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)Br 62a_100000210303_100000740023 [0,2,0,0,0,0|2,0,0]=4 18144 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)Br 62a_100011219129_100000210303 [0,2,0,0,0,0|2,0,0]=4 18145 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)C 62a_100000210303_200000187088 [0,2,0,0,0,0|2,0,0]=4 18146 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)Cl 62a_100000210303_100000188356 [0,2,0,0,0,0|2,0,0]=4 18147 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)F 62a_100000210303_100000736363 [0,2,0,0,0,0|2,0,0]=4 18148 B16R1.54 CCCSCCC(=O)Nc1ccc(cc1)O 62a_100000210303_100011302330 [0,2,0,0,0,0|2,0,0]=4 18149 B16R1.54 CCNCCCC(=O)Nc1ccc(cc1)C 2230a_100015525214_200011194843 [0,2,0,0,0,0|2,0,0]=4 18150 B16R1.54 CCNCCNC(=O)Nc1ccc(cc1)F 2230a_100015525214_100000163319 [0,2,0,0,0,0|2,0,0]=4 18151 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100012232248 [0,2,0,0,0,0|1,0,0]=3 18152 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100012232248 [0,2,0,0,0,0|1,0,0]=3 18153 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100012232248 [0,2,0,0,0,0|1,0,0]=3 18154 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100012232248 [0,2,0,0,0,0|1,0,0]=3 18155 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100012232248 [0,2,0,0,0,0|1,0,0]=3 18156 B16R1.54 CCOCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100012232248 [0,2,0,0,0,0|1,0,0]=3 18157 B16R1.54 CCOCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100012232248 [0,2,0,0,0,0|2,0,0]=4 18158 B16R1.54 CCOCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100012232248 [0,2,0,0,0,0|2,0,0]=4 18159 B16R1.54 CCOCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100012232248 [0,2,0,0,0,0|2,0,0]=4 18160 B16R1.54 CCOCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100012232248 [0,2,0,0,0,0|2,0,0]=4 18161 B16R1.54 CCOCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100012232248 [0,2,0,0,0,0|2,0,0]=4 18162 B16R1.54 CCOCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100012232248 [0,2,0,0,0,0|2,0,0]=4 18163 B16R1.54 CCOCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100012232248 [0,2,0,0,0,0|2,0,0]=4 18164 B16R1.54 CCOCCCC(=O)Nc1ccc(cc1)Br 34a_100121572206_100000190511 [0,2,0,0,0,0|2,0,0]=4 18165 B16R1.54 CCOCCCC(=O)Nc1ccc(cc1)C 34a_100121572206_200011194843 [0,2,0,0,0,0|2,0,0]=4 18166 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Br 11a_100011200944_100000198978 [0,2,0,0,0,0|1,0,0]=3 18167 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Br 240690a_100011200944_100000198978 [0,2,0,0,0,0|1,0,0]=3 18168 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Br 527a_100011200944_100000198978 [0,2,0,0,0,0|1,0,0]=3 18169 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)C 11a_100011200944_100000212244 [0,2,0,0,0,0|1,0,0]=3 18170 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)C 240690a_100011200944_100000212244 [0,2,0,0,0,0|1,0,0]=3 18171 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)C 527a_100011200944_100000212244 [0,2,0,0,0,0|1,0,0]=3 18172 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Cl 11a_100011200944_100000211027 [0,2,0,0,0,0|1,0,0]=3 18173 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Cl 240690a_100011200944_100000211027 [0,2,0,0,0,0|1,0,0]=3 18174 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)Cl 527a_100011200944_100000211027 [0,2,0,0,0,0|1,0,0]=3 18175 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)F 11a_100011200944_100000210951 [0,2,0,0,0,0|1,0,0]=3 18176 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)F 1626a_102516460346_100000210951 [0,2,0,0,0,0|1,0,0]=3 18177 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)F 240690a_100011200944_100000210951 [0,2,0,0,0,0|1,0,0]=3 18178 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)F 527a_100011200944_100000210951 [0,2,0,0,0,0|1,0,0]=3 18179 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)I 11a_100011200944_100000688869 [0,2,0,0,0,0|1,0,0]=3 18180 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)I 1626a_102516460346_100000688869 [0,2,0,0,0,0|1,0,0]=3 18181 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)I 240690a_100011200944_100000688869 [0,2,0,0,0,0|1,0,0]=3 18182 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)I 527a_100011200944_100000688869 [0,2,0,0,0,0|1,0,0]=3 18183 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)O 1626a_102516460346_100000198540 [0,2,0,0,0,0|1,0,0]=3 18184 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)O 240690a_100011200944_100000198540 [0,2,0,0,0,0|1,0,0]=3 18185 B16R1.54 CCOCCNC(=O)Cc1ccc(cc1)O 527a_100011200944_100000198540 [0,2,0,0,0,0|1,0,0]=3 18186 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Br 11a_100011200944_100020629044 [0,2,0,0,0,0|2,0,0]=4 18187 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Br 240690a_100011200944_100020629044 [0,2,0,0,0,0|2,0,0]=4 18188 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)C 11a_100011200944_100025705728 [0,2,0,0,0,0|2,0,0]=4 18189 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)C 1626a_102516460346_100025705728 [0,2,0,0,0,0|2,0,0]=4 18190 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)C 240690a_100011200944_100025705728 [0,2,0,0,0,0|2,0,0]=4 18191 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Cl 11a_100011200944_100000728320 [0,2,0,0,0,0|2,0,0]=4 18192 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Cl 1626a_102516460346_100000728320 [0,2,0,0,0,0|2,0,0]=4 18193 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Cl 240690a_100011200944_100000728320 [0,2,0,0,0,0|2,0,0]=4 18194 B16R1.54 CCOCCNC(=O)Cc1ccc(cn1)Cl 527a_100011200944_100000728320 [0,2,0,0,0,0|2,0,0]=4 18195 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Br 11a_100011200944_100010067268 [0,2,0,0,0,0|2,0,0]=4 18196 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Br 240690a_100011200944_100010067268 [0,2,0,0,0,0|2,0,0]=4 18197 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Br 527a_100011200944_100010067268 [0,2,0,0,0,0|2,0,0]=4 18198 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)C 11a_100011200944_100000740413 [0,2,0,0,0,0|2,0,0]=4 18199 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)C 1626a_102516460346_100000740413 [0,2,0,0,0,0|2,0,0]=4 18200 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)C 240690a_100011200944_100000740413 [0,2,0,0,0,0|2,0,0]=4 18201 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)C 527a_100011200944_100000740413 [0,2,0,0,0,0|2,0,0]=4 18202 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Cl 11a_100011200944_100000061944 [0,2,0,0,0,0|2,0,0]=4 18203 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Cl 1626a_102516460346_100000061944 [0,2,0,0,0,0|2,0,0]=4 18204 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Cl 240690a_100011200944_100000061944 [0,2,0,0,0,0|2,0,0]=4 18205 B16R1.54 CCOCCNC(=O)Cc1ccc(nc1)Cl 527a_100011200944_100000061944 [0,2,0,0,0,0|2,0,0]=4 18206 B16R1.54 CCOCCNC(=O)Cn1ccc(=O)cc1 11a_100011200944_200000238563 [0,2,0,0,0,0|2,0,0]=4 18207 B16R1.54 CCOCCNC(=O)Cn1ccc(=O)cc1 1626a_102516460346_200000238563 [0,2,0,0,0,0|2,0,0]=4 18208 B16R1.54 CCOCCNC(=O)Cn1ccc(=O)cc1 240690a_100011200944_200000238563 [0,2,0,0,0,0|2,0,0]=4 18209 B16R1.54 CCOCCNC(=O)Cn1ccc(=O)cc1 527a_100011200944_200000238563 [0,2,0,0,0,0|2,0,0]=4 18210 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100011200944 [0,2,0,0,0,0|2,0,0]=4 18211 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100011200944 [0,2,0,0,0,0|2,0,0]=4 18212 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100011200944 [0,2,0,0,0,0|2,0,0]=4 18213 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100011200944 [0,2,0,0,0,0|2,0,0]=4 18214 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100011200944 [0,2,0,0,0,0|2,0,0]=4 18215 B16R1.54 CCOCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100011200944 [0,2,0,0,0,0|2,0,0]=4 18216 B16R1.54 CCOCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000210147 [0,2,0,0,0,0|1,0,1]=4 18217 B16R1.54 CCOCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100011215890 [0,2,0,0,0,0|1,0,1]=4 18218 B16R1.54 CCSCCCC(=O)Nc1ccc(cc1)Br 62a_100000210202_100000190511 [0,2,0,0,0,0|2,0,0]=4 18219 B16R1.54 CCSCCCC(=O)Nc1ccc(cc1)C 62a_100000210202_200011194843 [0,2,0,0,0,0|2,0,0]=4 18220 B16R1.54 CCSCCCC(=O)Oc1ccc(cc1)F 62a_100000210202_100000010882 [0,2,0,0,0,0|2,0,0]=4 18221 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Br 11a_100000106463_100000198978 [0,2,0,0,0,0|1,0,0]=3 18222 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Br 240690a_100000106463_100000198978 [0,2,0,0,0,0|1,0,0]=3 18223 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Br 527a_100000106463_100000198978 [0,2,0,0,0,0|1,0,0]=3 18224 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)C 11a_100000106463_100000212244 [0,2,0,0,0,0|1,0,0]=3 18225 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)C 240690a_100000106463_100000212244 [0,2,0,0,0,0|1,0,0]=3 18226 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)C 527a_100000106463_100000212244 [0,2,0,0,0,0|1,0,0]=3 18227 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Cl 11a_100000106463_100000211027 [0,2,0,0,0,0|1,0,0]=3 18228 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000106463_100000211027 [0,2,0,0,0,0|1,0,0]=3 18229 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)Cl 527a_100000106463_100000211027 [0,2,0,0,0,0|1,0,0]=3 18230 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F 11a_100000106463_100000210951 [0,2,0,0,0,0|1,0,0]=3 18231 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F 1626a_100000106463_100000210951 [0,2,0,0,0,0|1,0,0]=3 18232 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F 240690a_100000106463_100000210951 [0,2,0,0,0,0|1,0,0]=3 18233 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)F 527a_100000106463_100000210951 [0,2,0,0,0,0|1,0,0]=3 18234 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)I 11a_100000106463_100000688869 [0,2,0,0,0,0|1,0,0]=3 18235 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)I 1626a_100000106463_100000688869 [0,2,0,0,0,0|1,0,0]=3 18236 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)I 240690a_100000106463_100000688869 [0,2,0,0,0,0|1,0,0]=3 18237 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)I 527a_100000106463_100000688869 [0,2,0,0,0,0|1,0,0]=3 18238 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)O 1626a_100000106463_100000198540 [0,2,0,0,0,0|1,0,0]=3 18239 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)O 240690a_100000106463_100000198540 [0,2,0,0,0,0|1,0,0]=3 18240 B16R1.54 CCSCCNC(=O)Cc1ccc(cc1)O 527a_100000106463_100000198540 [0,2,0,0,0,0|1,0,0]=3 18241 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Br 11a_100000106463_100020629044 [0,2,0,0,0,0|2,0,0]=4 18242 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Br 240690a_100000106463_100020629044 [0,2,0,0,0,0|2,0,0]=4 18243 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)C 11a_100000106463_100025705728 [0,2,0,0,0,0|2,0,0]=4 18244 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)C 1626a_100000106463_100025705728 [0,2,0,0,0,0|2,0,0]=4 18245 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)C 240690a_100000106463_100025705728 [0,2,0,0,0,0|2,0,0]=4 18246 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl 11a_100000106463_100000728320 [0,2,0,0,0,0|2,0,0]=4 18247 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000106463_100000728320 [0,2,0,0,0,0|2,0,0]=4 18248 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000106463_100000728320 [0,2,0,0,0,0|2,0,0]=4 18249 B16R1.54 CCSCCNC(=O)Cc1ccc(cn1)Cl 527a_100000106463_100000728320 [0,2,0,0,0,0|2,0,0]=4 18250 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Br 11a_100000106463_100010067268 [0,2,0,0,0,0|2,0,0]=4 18251 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Br 240690a_100000106463_100010067268 [0,2,0,0,0,0|2,0,0]=4 18252 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Br 527a_100000106463_100010067268 [0,2,0,0,0,0|2,0,0]=4 18253 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C 11a_100000106463_100000740413 [0,2,0,0,0,0|2,0,0]=4 18254 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C 1626a_100000106463_100000740413 [0,2,0,0,0,0|2,0,0]=4 18255 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C 240690a_100000106463_100000740413 [0,2,0,0,0,0|2,0,0]=4 18256 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)C 527a_100000106463_100000740413 [0,2,0,0,0,0|2,0,0]=4 18257 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Cl 11a_100000106463_100000061944 [0,2,0,0,0,0|2,0,0]=4 18258 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000106463_100000061944 [0,2,0,0,0,0|2,0,0]=4 18259 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000106463_100000061944 [0,2,0,0,0,0|2,0,0]=4 18260 B16R1.54 CCSCCNC(=O)Cc1ccc(nc1)Cl 527a_100000106463_100000061944 [0,2,0,0,0,0|2,0,0]=4 18261 B16R1.54 CCSCCNC(=O)Cn1ccc(=O)cc1 11a_100000106463_200000238563 [0,2,0,0,0,0|2,0,0]=4 18262 B16R1.54 CCSCCNC(=O)Cn1ccc(=O)cc1 1626a_100000106463_200000238563 [0,2,0,0,0,0|2,0,0]=4 18263 B16R1.54 CCSCCNC(=O)Cn1ccc(=O)cc1 240690a_100000106463_200000238563 [0,2,0,0,0,0|2,0,0]=4 18264 B16R1.54 CCSCCNC(=O)Cn1ccc(=O)cc1 527a_100000106463_200000238563 [0,2,0,0,0,0|2,0,0]=4 18265 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000106463 [0,2,0,0,0,0|2,0,0]=4 18266 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000106463 [0,2,0,0,0,0|2,0,0]=4 18267 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000106463 [0,2,0,0,0,0|2,0,0]=4 18268 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000106463 [0,2,0,0,0,0|2,0,0]=4 18269 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)F 62a_100000210202_100000163319 [0,2,0,0,0,0|2,0,0]=4 18270 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000106463 [0,2,0,0,0,0|2,0,0]=4 18271 B16R1.54 CCSCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000106463 [0,2,0,0,0,0|2,0,0]=4 18272 B16R1.54 CCSCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000757381 [0,2,0,0,0,0|1,0,1]=4 18273 B16R1.54 CCSCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000757381 [0,2,0,0,0,0|1,0,1]=4 18274 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000755781 [0,2,0,0,0,0|1,0,0]=3 18275 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000755781 [0,2,0,0,0,0|1,0,0]=3 18276 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000755781 [0,2,0,0,0,0|1,0,0]=3 18277 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000755781 [0,2,0,0,0,0|1,0,0]=3 18278 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000755781 [0,2,0,0,0,0|1,0,0]=3 18279 B16R1.54 COCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000755781 [0,2,0,0,0,0|1,0,0]=3 18280 B16R1.54 COCCCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000755781 [0,2,0,0,0,0|2,0,0]=4 18281 B16R1.54 COCCCCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000755781 [0,2,0,0,0,0|2,0,0]=4 18282 B16R1.54 COCCCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000755781 [0,2,0,0,0,0|2,0,0]=4 18283 B16R1.54 COCCCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000755781 [0,2,0,0,0,0|2,0,0]=4 18284 B16R1.54 COCCCCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000755781 [0,2,0,0,0,0|2,0,0]=4 18285 B16R1.54 COCCCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000755781 [0,2,0,0,0,0|2,0,0]=4 18286 B16R1.54 COCCCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000755781 [0,2,0,0,0,0|2,0,0]=4 18287 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Br 240690a_100150723488_100000198978 [0,2,0,0,0,0|1,0,0]=3 18288 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Br 527a_100150723488_100000198978 [0,2,0,0,0,0|1,0,0]=3 18289 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)C 240690a_100150723488_100000212244 [0,2,0,0,0,0|1,0,0]=3 18290 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)C 527a_100150723488_100000212244 [0,2,0,0,0,0|1,0,0]=3 18291 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100150723488_100000211027 [0,2,0,0,0,0|1,0,0]=3 18292 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)Cl 527a_100150723488_100000211027 [0,2,0,0,0,0|1,0,0]=3 18293 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)F 1626a_100150723488_100000210951 [0,2,0,0,0,0|1,0,0]=3 18294 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)F 240690a_100150723488_100000210951 [0,2,0,0,0,0|1,0,0]=3 18295 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)F 527a_100150723488_100000210951 [0,2,0,0,0,0|1,0,0]=3 18296 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)I 1626a_100150723488_100000688869 [0,2,0,0,0,0|1,0,0]=3 18297 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)I 240690a_100150723488_100000688869 [0,2,0,0,0,0|1,0,0]=3 18298 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)I 527a_100150723488_100000688869 [0,2,0,0,0,0|1,0,0]=3 18299 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)O 1626a_100150723488_100000198540 [0,2,0,0,0,0|1,0,0]=3 18300 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)O 240690a_100150723488_100000198540 [0,2,0,0,0,0|1,0,0]=3 18301 B16R1.54 COCCCNC(=O)Cc1ccc(cc1)O 527a_100150723488_100000198540 [0,2,0,0,0,0|1,0,0]=3 18302 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Br 240690a_100150723488_100020629044 [0,2,0,0,0,0|2,0,0]=4 18303 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)C 1626a_100150723488_100025705728 [0,2,0,0,0,0|2,0,0]=4 18304 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)C 240690a_100150723488_100025705728 [0,2,0,0,0,0|2,0,0]=4 18305 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Cl 1626a_100150723488_100000728320 [0,2,0,0,0,0|2,0,0]=4 18306 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Cl 240690a_100150723488_100000728320 [0,2,0,0,0,0|2,0,0]=4 18307 B16R1.54 COCCCNC(=O)Cc1ccc(cn1)Cl 527a_100150723488_100000728320 [0,2,0,0,0,0|2,0,0]=4 18308 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Br 240690a_100150723488_100010067268 [0,2,0,0,0,0|2,0,0]=4 18309 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Br 527a_100150723488_100010067268 [0,2,0,0,0,0|2,0,0]=4 18310 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)C 1626a_100150723488_100000740413 [0,2,0,0,0,0|2,0,0]=4 18311 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)C 240690a_100150723488_100000740413 [0,2,0,0,0,0|2,0,0]=4 18312 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)C 527a_100150723488_100000740413 [0,2,0,0,0,0|2,0,0]=4 18313 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Cl 1626a_100150723488_100000061944 [0,2,0,0,0,0|2,0,0]=4 18314 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Cl 240690a_100150723488_100000061944 [0,2,0,0,0,0|2,0,0]=4 18315 B16R1.54 COCCCNC(=O)Cc1ccc(nc1)Cl 527a_100150723488_100000061944 [0,2,0,0,0,0|2,0,0]=4 18316 B16R1.54 COCCCNC(=O)Cn1ccc(=O)cc1 1626a_100150723488_200000238563 [0,2,0,0,0,0|2,0,0]=4 18317 B16R1.54 COCCCNC(=O)Cn1ccc(=O)cc1 240690a_100150723488_200000238563 [0,2,0,0,0,0|2,0,0]=4 18318 B16R1.54 COCCCNC(=O)Cn1ccc(=O)cc1 527a_100150723488_200000238563 [0,2,0,0,0,0|2,0,0]=4 18319 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100150723488 [0,2,0,0,0,0|2,0,0]=4 18320 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100150723488 [0,2,0,0,0,0|2,0,0]=4 18321 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100150723488 [0,2,0,0,0,0|2,0,0]=4 18322 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100150723488 [0,2,0,0,0,0|2,0,0]=4 18323 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100150723488 [0,2,0,0,0,0|2,0,0]=4 18324 B16R1.54 COCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100150723488 [0,2,0,0,0,0|2,0,0]=4 18325 B16R1.54 COCCCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000740836 [0,2,0,0,0,0|1,0,1]=4 18326 B16R1.54 COCCCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000740836 [0,2,0,0,0,0|1,0,1]=4 18327 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)Br 22a_100000741390_100000198978 [0,2,0,0,0,0|2,0,0]=4 18328 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)C 22a_100000741390_100000212244 [0,2,0,0,0,0|2,0,0]=4 18329 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)Cl 22a_100000741390_100000211027 [0,2,0,0,0,0|2,0,0]=4 18330 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)F 22a_100000741390_100000210951 [0,2,0,0,0,0|2,0,0]=4 18331 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)I 22a_100000741390_100000688869 [0,2,0,0,0,0|2,0,0]=4 18332 B16R1.54 COCCNNC(=O)Cc1ccc(cc1)O 22a_100000741390_100000198540 [0,2,0,0,0,0|2,0,0]=4 18333 B16R1.54 COCCOCC(=O)Cc1ccc(cc1)Br 1458a_100000211095_100000189115 [0,2,0,0,0,0|1,0,0]=3 18334 B16R1.54 COCCOCC(=O)Cc1ccc(cc1)C 1458a_100000211095_100000210814 [0,2,0,0,0,0|1,0,0]=3 18335 B16R1.54 COCCOCC(=O)Cc1ccc(cc1)Cl 1458a_100000211095_100000694040 [0,2,0,0,0,0|1,0,0]=3 18336 B16R1.54 COCCOCC(=O)Cc1ccc(cc1)F 1458a_100000211095_100000198546 [0,2,0,0,0,0|1,0,0]=3 18337 B16R1.54 COCCOCC(=O)Cc1ccc(cc1)I 1458a_100000211095_100000189116 [0,2,0,0,0,0|1,0,0]=3 18338 B16R1.54 COCCOCC(=O)Cc1ccc(cn1)Br 1458a_100000211095_100000702658 [0,2,0,0,0,0|2,0,0]=4 18339 B16R1.54 COCCOCC(=O)Cc1ccc(cn1)C 1458a_100000211095_100000691093 [0,2,0,0,0,0|2,0,0]=4 18340 B16R1.54 COCCOCC(=O)Cc1ccc(cn1)Cl 1458a_100000211095_100012066911 [0,2,0,0,0,0|2,0,0]=4 18341 B16R1.54 COCCOCC(=O)Cc1ccc(cn1)F 1458a_100000211095_100000703193 [0,2,0,0,0,0|2,0,0]=4 18342 B16R1.54 COCCOCC(=O)Cc1ccc(nc1)Br 1458a_100000211095_100009831999 [0,2,0,0,0,0|2,0,0]=4 18343 B16R1.54 COCCOCC(=O)Cc1ccc(nc1)C 1458a_100000211095_100016987292 [0,2,0,0,0,0|2,0,0]=4 18344 B16R1.54 COCCOCC(=O)Cc1ccc(nc1)Cl 1458a_100000211095_100000735431 [0,2,0,0,0,0|2,0,0]=4 18345 B16R1.54 COCCOCC(=O)Cc1ccc(nc1)F 1458a_100000211095_100009820150 [0,2,0,0,0,0|2,0,0]=4 18346 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000211095 [0,2,0,0,0,0|2,0,0]=4 18347 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000211095 [0,2,0,0,0,0|2,0,0]=4 18348 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000211095 [0,2,0,0,0,0|2,0,0]=4 18349 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Br 34a_100000210237_100000183692 [0,2,0,0,0,0|2,0,0]=4 18350 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000211095 [0,2,0,0,0,0|2,0,0]=4 18351 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211095 [0,2,0,0,0,0|2,0,0]=4 18352 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211095 [0,2,0,0,0,0|2,0,0]=4 18353 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211095 [0,2,0,0,0,0|2,0,0]=4 18354 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)C 34a_100000210237_100000182914 [0,2,0,0,0,0|2,0,0]=4 18355 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211095 [0,2,0,0,0,0|2,0,0]=4 18356 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000211095 [0,2,0,0,0,0|2,0,0]=4 18357 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000211095 [0,2,0,0,0,0|2,0,0]=4 18358 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000211095 [0,2,0,0,0,0|2,0,0]=4 18359 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000210237_100000182960 [0,2,0,0,0,0|2,0,0]=4 18360 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000211095 [0,2,0,0,0,0|2,0,0]=4 18361 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000211095 [0,2,0,0,0,0|2,0,0]=4 18362 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000211095 [0,2,0,0,0,0|2,0,0]=4 18363 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000211095 [0,2,0,0,0,0|2,0,0]=4 18364 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)F 34a_100000210237_100000181725 [0,2,0,0,0,0|2,0,0]=4 18365 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000211095 [0,2,0,0,0,0|2,0,0]=4 18366 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000211095 [0,2,0,0,0,0|2,0,0]=4 18367 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000211095 [0,2,0,0,0,0|2,0,0]=4 18368 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000211095 [0,2,0,0,0,0|2,0,0]=4 18369 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I 34a_100000210237_100000183000 [0,2,0,0,0,0|2,0,0]=4 18370 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000211095 [0,2,0,0,0,0|2,0,0]=4 18371 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100011201679 [0,2,0,0,0,0|2,0,0]=4 18372 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000211095 [0,2,0,0,0,0|2,0,0]=4 18373 B16R1.54 COCCOCC(=O)Nc1ccc(cc1)O 34a_100000210237_100000233757 [0,2,0,0,0,0|2,0,0]=4 18374 B16R1.54 COCCOCC(=O)Oc1ccc(cc1)Br 34a_100000210237_200010760497 [0,2,0,0,0,0|2,0,0]=4 18375 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Br 11a_100000749238_100000198978 [0,2,0,0,0,0|1,0,0]=3 18376 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Br 240690a_100000749238_100000198978 [0,2,0,0,0,0|1,0,0]=3 18377 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Br 527a_100000749238_100000198978 [0,2,0,0,0,0|1,0,0]=3 18378 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)C 11a_100000749238_100000212244 [0,2,0,0,0,0|1,0,0]=3 18379 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)C 240690a_100000749238_100000212244 [0,2,0,0,0,0|1,0,0]=3 18380 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)C 527a_100000749238_100000212244 [0,2,0,0,0,0|1,0,0]=3 18381 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Cl 11a_100000749238_100000211027 [0,2,0,0,0,0|1,0,0]=3 18382 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Cl 240690a_100000749238_100000211027 [0,2,0,0,0,0|1,0,0]=3 18383 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)Cl 527a_100000749238_100000211027 [0,2,0,0,0,0|1,0,0]=3 18384 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F 11a_100000749238_100000210951 [0,2,0,0,0,0|1,0,0]=3 18385 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F 1626a_100000749238_100000210951 [0,2,0,0,0,0|1,0,0]=3 18386 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F 240690a_100000749238_100000210951 [0,2,0,0,0,0|1,0,0]=3 18387 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)F 527a_100000749238_100000210951 [0,2,0,0,0,0|1,0,0]=3 18388 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)I 11a_100000749238_100000688869 [0,2,0,0,0,0|1,0,0]=3 18389 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)I 1626a_100000749238_100000688869 [0,2,0,0,0,0|1,0,0]=3 18390 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)I 240690a_100000749238_100000688869 [0,2,0,0,0,0|1,0,0]=3 18391 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)I 527a_100000749238_100000688869 [0,2,0,0,0,0|1,0,0]=3 18392 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)O 1626a_100000749238_100000198540 [0,2,0,0,0,0|1,0,0]=3 18393 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)O 240690a_100000749238_100000198540 [0,2,0,0,0,0|1,0,0]=3 18394 B16R1.54 CSCCCNC(=O)Cc1ccc(cc1)O 527a_100000749238_100000198540 [0,2,0,0,0,0|1,0,0]=3 18395 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Br 11a_100000749238_100020629044 [0,2,0,0,0,0|2,0,0]=4 18396 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Br 240690a_100000749238_100020629044 [0,2,0,0,0,0|2,0,0]=4 18397 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)C 11a_100000749238_100025705728 [0,2,0,0,0,0|2,0,0]=4 18398 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)C 1626a_100000749238_100025705728 [0,2,0,0,0,0|2,0,0]=4 18399 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)C 240690a_100000749238_100025705728 [0,2,0,0,0,0|2,0,0]=4 18400 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl 11a_100000749238_100000728320 [0,2,0,0,0,0|2,0,0]=4 18401 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl 1626a_100000749238_100000728320 [0,2,0,0,0,0|2,0,0]=4 18402 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl 240690a_100000749238_100000728320 [0,2,0,0,0,0|2,0,0]=4 18403 B16R1.54 CSCCCNC(=O)Cc1ccc(cn1)Cl 527a_100000749238_100000728320 [0,2,0,0,0,0|2,0,0]=4 18404 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Br 11a_100000749238_100010067268 [0,2,0,0,0,0|2,0,0]=4 18405 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Br 240690a_100000749238_100010067268 [0,2,0,0,0,0|2,0,0]=4 18406 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Br 527a_100000749238_100010067268 [0,2,0,0,0,0|2,0,0]=4 18407 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C 11a_100000749238_100000740413 [0,2,0,0,0,0|2,0,0]=4 18408 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C 1626a_100000749238_100000740413 [0,2,0,0,0,0|2,0,0]=4 18409 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C 240690a_100000749238_100000740413 [0,2,0,0,0,0|2,0,0]=4 18410 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)C 527a_100000749238_100000740413 [0,2,0,0,0,0|2,0,0]=4 18411 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Cl 11a_100000749238_100000061944 [0,2,0,0,0,0|2,0,0]=4 18412 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Cl 1626a_100000749238_100000061944 [0,2,0,0,0,0|2,0,0]=4 18413 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Cl 240690a_100000749238_100000061944 [0,2,0,0,0,0|2,0,0]=4 18414 B16R1.54 CSCCCNC(=O)Cc1ccc(nc1)Cl 527a_100000749238_100000061944 [0,2,0,0,0,0|2,0,0]=4 18415 B16R1.54 CSCCCNC(=O)Cn1ccc(=O)cc1 11a_100000749238_200000238563 [0,2,0,0,0,0|2,0,0]=4 18416 B16R1.54 CSCCCNC(=O)Cn1ccc(=O)cc1 1626a_100000749238_200000238563 [0,2,0,0,0,0|2,0,0]=4 18417 B16R1.54 CSCCCNC(=O)Cn1ccc(=O)cc1 240690a_100000749238_200000238563 [0,2,0,0,0,0|2,0,0]=4 18418 B16R1.54 CSCCCNC(=O)Cn1ccc(=O)cc1 527a_100000749238_200000238563 [0,2,0,0,0,0|2,0,0]=4 18419 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000749238 [0,2,0,0,0,0|2,0,0]=4 18420 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000749238 [0,2,0,0,0,0|2,0,0]=4 18421 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000749238 [0,2,0,0,0,0|2,0,0]=4 18422 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000749238 [0,2,0,0,0,0|2,0,0]=4 18423 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000749238 [0,2,0,0,0,0|2,0,0]=4 18424 B16R1.54 CSCCCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000749238 [0,2,0,0,0,0|2,0,0]=4 18425 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)Br 34a_100000230434_100000183692 [0,2,0,0,0,0|2,0,0]=4 18426 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)Br 7a_100000230434_100000183692 [0,2,0,0,0,0|2,0,0]=4 18427 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)C 34a_100000230434_100000182914 [0,2,0,0,0,0|2,0,0]=4 18428 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)C 7a_100000230434_100000182914 [0,2,0,0,0,0|2,0,0]=4 18429 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000230434_100000182960 [0,2,0,0,0,0|2,0,0]=4 18430 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)Cl 7a_100000230434_100000182960 [0,2,0,0,0,0|2,0,0]=4 18431 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)F 34a_100000230434_100000181725 [0,2,0,0,0,0|2,0,0]=4 18432 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)F 7a_100000230434_100000181725 [0,2,0,0,0,0|2,0,0]=4 18433 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)I 34a_100000230434_100000183000 [0,2,0,0,0,0|2,0,0]=4 18434 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)I 7a_100000230434_100000183000 [0,2,0,0,0,0|2,0,0]=4 18435 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)N 34a_100011269904_100000212216 [0,2,0,0,0,0|2,0,0]=4 18436 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)O 34a_100000230434_100000233757 [0,2,0,0,0,0|2,0,0]=4 18437 B16R1.54 CSCCOCC(=O)Nc1ccc(cc1)O 7a_100000230434_100000233757 [0,2,0,0,0,0|2,0,0]=4 18438 B16R1.54 CSCCOCC(=O)Oc1ccc(cc1)Br 34a_100000230434_200010760497 [0,2,0,0,0,0|2,0,0]=4 18439 B16R1.54 CSCCOCC(=O)Oc1ccc(cc1)Br 7a_100000230434_200010760497 [0,2,0,0,0,0|2,0,0]=4 18440 B16R1.54 Cc1ccc(cc1)CC(=O)CCCCC#N 1458a_100000212244_100000211819 [0,2,0,0,0,0|1,0,1]=4 18441 B16R1.54 Cc1ccc(cc1)CC(=O)CCCCCF 1458a_100000212244_100000729378 [0,2,0,0,0,0|1,0,0]=3 18442 B16R1.54 Cc1ccc(cc1)CC(=O)CCCCCO 1458a_100000212244_100000746330 [0,2,0,0,0,0|1,0,0]=3 18443 B16R1.54 Cc1ccc(cc1)CC(=O)CCCCCO 1458a_100102619762_100000210814 [0,2,0,0,0,0|1,0,0]=3 18444 B16R1.54 Cc1ccc(cc1)CC(=O)CCOCCO 1458a_100000212244_100011215305 [0,2,0,0,0,0|2,0,0]=4 18445 B16R1.54 Cc1ccc(cc1)CC(=O)CCOCCO 1458a_100011229844_100000210814 [0,2,0,0,0,0|2,0,0]=4 18446 B16R1.54 Cc1ccc(cc1)CC(=O)NCCCCO 240690a_100000750430_100000212244 [0,2,0,0,0,0|1,0,0]=3 18447 B16R1.54 Cc1ccc(cc1)CC(=O)NCCCCO 527a_100000750430_100000212244 [0,2,0,0,0,0|1,0,0]=3 18448 B16R1.54 Cc1ccc(cc1)NC(=O)CCCCCO 22a_100000124888_100102619762 [0,2,0,0,0,0|2,0,0]=4 18449 B16R1.54 Cc1ccc(cc1)NC(=O)COCCCBr 34a_100011217188_100000182914 [0,2,0,0,0,0|2,0,0]=4 18450 B16R1.54 Cc1ccc(cc1)NC(=O)COCCCCl 34a_100000230001_100000182914 [0,2,0,0,0,0|2,0,0]=4 18451 B16R1.54 Cc1ccc(cc1)NC(=O)COCCCF 34a_100000759539_100000182914 [0,2,0,0,0,0|2,0,0]=4 18452 B16R1.54 Cc1ccc(cc1)NC(=O)COCCCN 34a_100000182051_100000182914 [0,2,0,0,0,0|2,0,0]=4 18453 B16R1.54 Cc1ccc(cc1)NC(=O)NCCCCO 2430a_100000124888_100000750430 [0,2,0,0,0,0|2,0,0]=4 18454 B16R1.54 Cc1ccc(cn1)CC(=O)CCCCCF 1458a_100000740413_100000729378 [0,2,0,0,0,0|2,0,0]=4 18455 B16R1.54 Cc1ccc(cn1)CC(=O)CCCCCO 1458a_100000740413_100000746330 [0,2,0,0,0,0|2,0,0]=4 18456 B16R1.54 Cc1ccc(cn1)CC(=O)CCCCCO 1458a_100102619762_100016987292 [0,2,0,0,0,0|2,0,0]=4 18457 B16R1.54 Cc1ccc(cn1)CC(=O)NCCCCO 240690a_100000750430_100000740413 [0,2,0,0,0,0|2,0,0]=4 18458 B16R1.54 Cc1ccc(cn1)CC(=O)NCCCCO 527a_100000750430_100000740413 [0,2,0,0,0,0|2,0,0]=4 18459 B16R1.54 Cc1ccc(nc1)CC(=O)CCCCCF 1458a_100025705728_100000729378 [0,2,0,0,0,0|2,0,0]=4 18460 B16R1.54 Cc1ccc(nc1)CC(=O)CCCCCO 1458a_100025705728_100000746330 [0,2,0,0,0,0|2,0,0]=4 18461 B16R1.54 Cc1ccc(nc1)CC(=O)CCCCCO 1458a_100102619762_100000691093 [0,2,0,0,0,0|2,0,0]=4 18462 B16R1.54 Cc1ccc(nc1)CC(=O)NCCCCO 240690a_100000750430_100025705728 [0,2,0,0,0,0|2,0,0]=4 18463 B16R1.54 N#CCCCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000211819 [0,2,0,0,0,0|1,0,1]=4 18464 B16R1.54 N#CCCCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000211819 [0,2,0,0,0,0|1,0,1]=4 18465 B16R1.54 N#CCCCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000211819 [0,2,0,0,0,0|1,0,1]=4 18466 B16R1.54 N#CCCCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000211819 [0,2,0,0,0,0|1,0,1]=4 18467 B16R1.54 N#CCCCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000211819 [0,2,0,0,0,0|1,0,1]=4 18468 B16R1.54 NCCCOCC(=O)Nc1ccc(cc1)Br 34a_100000182051_100000183692 [0,2,0,0,0,0|2,0,0]=4 18469 B16R1.54 NCCCOCC(=O)Nc1ccc(cc1)Cl 34a_100000182051_100000182960 [0,2,0,0,0,0|2,0,0]=4 18470 B16R1.54 NCCCOCC(=O)Nc1ccc(cc1)F 34a_100000182051_100000181725 [0,2,0,0,0,0|2,0,0]=4 18471 B16R1.54 NCCCOCC(=O)Nc1ccc(cc1)I 34a_100000182051_100000183000 [0,2,0,0,0,0|2,0,0]=4 18472 B16R1.54 NCCCOCC(=O)Nc1ccc(cc1)O 34a_100000182051_100000233757 [0,2,0,0,0,0|2,0,0]=4 18473 B16R1.54 NCCCOCC(=O)Oc1ccc(cc1)Br 34a_100000182051_200010760497 [0,2,0,0,0,0|2,0,0]=4 18474 B16R1.54 Nc1ccc(cc1)NC(=O)COCCCF 34a_100011269904_100011934791 [0,2,0,0,0,0|2,0,0]=4 18475 B16R1.54 Nc1ccc(cc1)NC(=O)COCCCO 34a_100011269904_100000230001 [0,2,0,0,0,0|2,0,0]=4 18476 B16R1.54 O=C(CCCCCF)Cc1ccc(cc1)Br 1458a_100000198978_100000729378 [0,2,0,0,0,0|1,0,0]=3 18477 B16R1.54 O=C(CCCCCF)Cc1ccc(cc1)Cl 1458a_100000211027_100000729378 [0,2,0,0,0,0|1,0,0]=3 18478 B16R1.54 O=C(CCCCCF)Cc1ccc(cc1)F 1458a_100000210951_100000729378 [0,2,0,0,0,0|1,0,0]=3 18479 B16R1.54 O=C(CCCCCF)Cc1ccc(cc1)I 1458a_100000688869_100000729378 [0,2,0,0,0,0|1,0,0]=3 18480 B16R1.54 O=C(CCCCCF)Cc1ccc(cc1)O 1458a_100000198540_100000729378 [0,2,0,0,0,0|1,0,0]=3 18481 B16R1.54 O=C(CCCCCF)Cc1ccc(cn1)Br 1458a_100020629044_100000729378 [0,2,0,0,0,0|2,0,0]=4 18482 B16R1.54 O=C(CCCCCF)Cc1ccc(cn1)Cl 1458a_100000728320_100000729378 [0,2,0,0,0,0|2,0,0]=4 18483 B16R1.54 O=C(CCCCCF)Cc1ccc(nc1)Br 1458a_100010067268_100000729378 [0,2,0,0,0,0|2,0,0]=4 18484 B16R1.54 O=C(CCCCCF)Cc1ccc(nc1)Cl 1458a_100000061944_100000729378 [0,2,0,0,0,0|2,0,0]=4 18485 B16R1.54 O=C(CCCCCF)Cn1ccc(=O)cc1 1458a_200000238563_100000729378 [0,2,0,0,0,0|2,0,0]=4 18486 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)Br 1458a_100000198978_100000746330 [0,2,0,0,0,0|1,0,0]=3 18487 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)Br 1458a_100102619762_100000189115 [0,2,0,0,0,0|1,0,0]=3 18488 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100000746330 [0,2,0,0,0,0|1,0,0]=3 18489 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)Cl 1458a_100102619762_100000694040 [0,2,0,0,0,0|1,0,0]=3 18490 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)F 1458a_100000210951_100000746330 [0,2,0,0,0,0|1,0,0]=3 18491 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)F 1458a_100102619762_100000198546 [0,2,0,0,0,0|1,0,0]=3 18492 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)I 1458a_100000688869_100000746330 [0,2,0,0,0,0|1,0,0]=3 18493 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)I 1458a_100102619762_100000189116 [0,2,0,0,0,0|1,0,0]=3 18494 B16R1.54 O=C(CCCCCO)Cc1ccc(cc1)O 1458a_100000198540_100000746330 [0,2,0,0,0,0|1,0,0]=3 18495 B16R1.54 O=C(CCCCCO)Cc1ccc(cn1)Br 1458a_100020629044_100000746330 [0,2,0,0,0,0|2,0,0]=4 18496 B16R1.54 O=C(CCCCCO)Cc1ccc(cn1)Br 1458a_100102619762_100000702658 [0,2,0,0,0,0|2,0,0]=4 18497 B16R1.54 O=C(CCCCCO)Cc1ccc(cn1)Cl 1458a_100000728320_100000746330 [0,2,0,0,0,0|2,0,0]=4 18498 B16R1.54 O=C(CCCCCO)Cc1ccc(cn1)Cl 1458a_100102619762_100012066911 [0,2,0,0,0,0|2,0,0]=4 18499 B16R1.54 O=C(CCCCCO)Cc1ccc(cn1)F 1458a_100102619762_100000703193 [0,2,0,0,0,0|2,0,0]=4 18500 B16R1.54 O=C(CCCCCO)Cc1ccc(nc1)Br 1458a_100010067268_100000746330 [0,2,0,0,0,0|2,0,0]=4 18501 B16R1.54 O=C(CCCCCO)Cc1ccc(nc1)Br 1458a_100102619762_100009831999 [0,2,0,0,0,0|2,0,0]=4 18502 B16R1.54 O=C(CCCCCO)Cc1ccc(nc1)Cl 1458a_100000061944_100000746330 [0,2,0,0,0,0|2,0,0]=4 18503 B16R1.54 O=C(CCCCCO)Cc1ccc(nc1)Cl 1458a_100102619762_100000735431 [0,2,0,0,0,0|2,0,0]=4 18504 B16R1.54 O=C(CCCCCO)Cc1ccc(nc1)F 1458a_100102619762_100009820150 [0,2,0,0,0,0|2,0,0]=4 18505 B16R1.54 O=C(CCCCCO)Cn1ccc(=O)cc1 1458a_200000238563_100000746330 [0,2,0,0,0,0|2,0,0]=4 18506 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)Br 22a_100000210018_100102619762 [0,2,0,0,0,0|2,0,0]=4 18507 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)Cl 22a_100000210052_100102619762 [0,2,0,0,0,0|2,0,0]=4 18508 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)F 22a_100000185862_100102619762 [0,2,0,0,0,0|2,0,0]=4 18509 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)I 22a_100000185761_100102619762 [0,2,0,0,0,0|2,0,0]=4 18510 B16R1.54 O=C(CCCCCO)Nc1ccc(cc1)O 22a_100000185829_100102619762 [0,2,0,0,0,0|2,0,0]=4 18511 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)Br 1458a_100000198978_100011215305 [0,2,0,0,0,0|2,0,0]=4 18512 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)Br 1458a_100011229844_100000189115 [0,2,0,0,0,0|2,0,0]=4 18513 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)Cl 1458a_100000211027_100011215305 [0,2,0,0,0,0|2,0,0]=4 18514 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)Cl 1458a_100011229844_100000694040 [0,2,0,0,0,0|2,0,0]=4 18515 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)F 1458a_100000210951_100011215305 [0,2,0,0,0,0|2,0,0]=4 18516 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)F 1458a_100011229844_100000198546 [0,2,0,0,0,0|2,0,0]=4 18517 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)I 1458a_100000688869_100011215305 [0,2,0,0,0,0|2,0,0]=4 18518 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)I 1458a_100011229844_100000189116 [0,2,0,0,0,0|2,0,0]=4 18519 B16R1.54 O=C(CCOCCO)Cc1ccc(cc1)O 1458a_100000198540_100011215305 [0,2,0,0,0,0|2,0,0]=4 18520 B16R1.54 O=C(COCCCBr)Nc1ccc(cc1)Br 34a_100011217188_100000183692 [0,2,0,0,0,0|2,0,0]=4 18521 B16R1.54 O=C(COCCCBr)Nc1ccc(cc1)Cl 34a_100011217188_100000182960 [0,2,0,0,0,0|2,0,0]=4 18522 B16R1.54 O=C(COCCCBr)Nc1ccc(cc1)F 34a_100011217188_100000181725 [0,2,0,0,0,0|2,0,0]=4 18523 B16R1.54 O=C(COCCCBr)Nc1ccc(cc1)I 34a_100011217188_100000183000 [0,2,0,0,0,0|2,0,0]=4 18524 B16R1.54 O=C(COCCCBr)Nc1ccc(cc1)O 34a_100011217188_100000233757 [0,2,0,0,0,0|2,0,0]=4 18525 B16R1.54 O=C(COCCCBr)Oc1ccc(cc1)Br 34a_100011217188_200010760497 [0,2,0,0,0,0|2,0,0]=4 18526 B16R1.54 O=C(COCCCCl)Nc1ccc(cc1)Br 34a_100000230001_100000183692 [0,2,0,0,0,0|2,0,0]=4 18527 B16R1.54 O=C(COCCCCl)Nc1ccc(cc1)Cl 34a_100000230001_100000182960 [0,2,0,0,0,0|2,0,0]=4 18528 B16R1.54 O=C(COCCCCl)Nc1ccc(cc1)F 34a_100000230001_100000181725 [0,2,0,0,0,0|2,0,0]=4 18529 B16R1.54 O=C(COCCCCl)Nc1ccc(cc1)I 34a_100000230001_100000183000 [0,2,0,0,0,0|2,0,0]=4 18530 B16R1.54 O=C(COCCCCl)Nc1ccc(cc1)O 34a_100000230001_100000233757 [0,2,0,0,0,0|2,0,0]=4 18531 B16R1.54 O=C(COCCCCl)Oc1ccc(cc1)Br 34a_100000230001_200010760497 [0,2,0,0,0,0|2,0,0]=4 18532 B16R1.54 O=C(COCCCF)Nc1ccc(cc1)Br 34a_100000759539_100000183692 [0,2,0,0,0,0|2,0,0]=4 18533 B16R1.54 O=C(COCCCF)Nc1ccc(cc1)Cl 34a_100000759539_100000182960 [0,2,0,0,0,0|2,0,0]=4 18534 B16R1.54 O=C(COCCCF)Nc1ccc(cc1)F 34a_100000759539_100000181725 [0,2,0,0,0,0|2,0,0]=4 18535 B16R1.54 O=C(COCCCF)Nc1ccc(cc1)I 34a_100000759539_100000183000 [0,2,0,0,0,0|2,0,0]=4 18536 B16R1.54 O=C(COCCCF)Nc1ccc(cc1)O 34a_100000759539_100000233757 [0,2,0,0,0,0|2,0,0]=4 18537 B16R1.54 O=C(COCCCF)Oc1ccc(cc1)Br 34a_100000759539_200010760497 [0,2,0,0,0,0|2,0,0]=4 18538 B16R1.54 O=C(Cc1ccc(cc1)Br)NCCCCO 240690a_100000750430_100000198978 [0,2,0,0,0,0|1,0,0]=3 18539 B16R1.54 O=C(Cc1ccc(cc1)Br)NCCCCO 527a_100000750430_100000198978 [0,2,0,0,0,0|1,0,0]=3 18540 B16R1.54 O=C(Cc1ccc(cc1)Cl)NCCCCO 240690a_100000750430_100000211027 [0,2,0,0,0,0|1,0,0]=3 18541 B16R1.54 O=C(Cc1ccc(cc1)Cl)NCCCCO 527a_100000750430_100000211027 [0,2,0,0,0,0|1,0,0]=3 18542 B16R1.54 O=C(Cc1ccc(cc1)F)NCCCCO 240690a_100000750430_100000210951 [0,2,0,0,0,0|1,0,0]=3 18543 B16R1.54 O=C(Cc1ccc(cc1)F)NCCCCO 527a_100000750430_100000210951 [0,2,0,0,0,0|1,0,0]=3 18544 B16R1.54 O=C(Cc1ccc(cc1)I)NCCCCO 240690a_100000750430_100000688869 [0,2,0,0,0,0|1,0,0]=3 18545 B16R1.54 O=C(Cc1ccc(cc1)I)NCCCCO 527a_100000750430_100000688869 [0,2,0,0,0,0|1,0,0]=3 18546 B16R1.54 O=C(Cc1ccc(cc1)O)NCCCCO 240690a_100000750430_100000198540 [0,2,0,0,0,0|1,0,0]=3 18547 B16R1.54 O=C(Cc1ccc(cc1)O)NCCCCO 527a_100000750430_100000198540 [0,2,0,0,0,0|1,0,0]=3 18548 B16R1.54 O=C(Cc1ccc(cn1)Br)NCCCCO 240690a_100000750430_100020629044 [0,2,0,0,0,0|2,0,0]=4 18549 B16R1.54 O=C(Cc1ccc(cn1)Cl)NCCCCO 240690a_100000750430_100000728320 [0,2,0,0,0,0|2,0,0]=4 18550 B16R1.54 O=C(Cc1ccc(cn1)Cl)NCCCCO 527a_100000750430_100000728320 [0,2,0,0,0,0|2,0,0]=4 18551 B16R1.54 O=C(Cc1ccc(nc1)Br)NCCCCO 240690a_100000750430_100010067268 [0,2,0,0,0,0|2,0,0]=4 18552 B16R1.54 O=C(Cc1ccc(nc1)Br)NCCCCO 527a_100000750430_100010067268 [0,2,0,0,0,0|2,0,0]=4 18553 B16R1.54 O=C(Cc1ccc(nc1)Cl)NCCCCO 240690a_100000750430_100000061944 [0,2,0,0,0,0|2,0,0]=4 18554 B16R1.54 O=C(Cc1ccc(nc1)Cl)NCCCCO 527a_100000750430_100000061944 [0,2,0,0,0,0|2,0,0]=4 18555 B16R1.54 O=C(Cn1ccc(=O)cc1)NCCCCO 240690a_100000750430_200000238563 [0,2,0,0,0,0|2,0,0]=4 18556 B16R1.54 O=C(Cn1ccc(=O)cc1)NCCCCO 527a_100000750430_200000238563 [0,2,0,0,0,0|2,0,0]=4 18557 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)Br 2430a_100000210018_100000750430 [0,2,0,0,0,0|2,0,0]=4 18558 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)Cl 2430a_100000210052_100000750430 [0,2,0,0,0,0|2,0,0]=4 18559 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)F 2430a_100000185862_100000750430 [0,2,0,0,0,0|2,0,0]=4 18560 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)I 2430a_100000185761_100000750430 [0,2,0,0,0,0|2,0,0]=4 18561 B16R1.54 O=C(NCCCCO)Nc1ccc(cc1)O 2430a_100000185829_100000750430 [0,2,0,0,0,0|2,0,0]=4 18562 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000696528_100000211773 [0,2,0,0,0,0|1,0,1]=4 18563 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100010269958 [0,2,0,0,0,0|1,0,1]=4 18564 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)C 1458a_100000696528_100000211840 [0,2,0,0,0,0|1,0,1]=4 18565 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100010269958 [0,2,0,0,0,0|1,0,1]=4 18566 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000696528_100000181238 [0,2,0,0,0,0|1,0,1]=4 18567 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100010269958 [0,2,0,0,0,0|1,0,1]=4 18568 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100010269958 [0,2,0,0,0,0|1,0,1]=4 18569 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)F 1458a_100000696528_100000230114 [0,2,0,0,0,0|1,0,1]=4 18570 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100010269958 [0,2,0,0,0,0|1,0,1]=4 18571 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)I 1458a_100000696528_100011218688 [0,2,0,0,0,0|1,0,1]=4 18572 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)O 1458a_100000696528_100011660834 [0,2,0,0,0,0|1,0,1]=4 18573 B16R1.55 C#CCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100010269958 [0,2,0,0,0,0|1,0,1]=4 18574 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Br 11a_100000718082_100000747190 [0,2,0,0,0,0|1,0,1]=4 18575 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Br 240690a_100000718082_100000747190 [0,2,0,0,0,0|1,0,1]=4 18576 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Br 527a_100000718082_100000747190 [0,2,0,0,0,0|1,0,1]=4 18577 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C 11a_100000718082_100011206899 [0,2,0,0,0,0|1,0,1]=4 18578 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C 1626a_100000718082_100011206899 [0,2,0,0,0,0|1,0,1]=4 18579 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C 240690a_100000718082_100011206899 [0,2,0,0,0,0|1,0,1]=4 18580 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)C 527a_100000718082_100011206899 [0,2,0,0,0,0|1,0,1]=4 18581 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl 11a_100000718082_100000749307 [0,2,0,0,0,0|1,0,1]=4 18582 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000718082_100000749307 [0,2,0,0,0,0|1,0,1]=4 18583 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000718082_100000749307 [0,2,0,0,0,0|1,0,1]=4 18584 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)Cl 527a_100000718082_100000749307 [0,2,0,0,0,0|1,0,1]=4 18585 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F 11a_100000718082_100000211661 [0,2,0,0,0,0|1,0,1]=4 18586 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F 1626a_100000718082_100000211661 [0,2,0,0,0,0|1,0,1]=4 18587 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F 240690a_100000718082_100000211661 [0,2,0,0,0,0|1,0,1]=4 18588 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)F 527a_100000718082_100000211661 [0,2,0,0,0,0|1,0,1]=4 18589 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)I 11a_100000718082_100000238430 [0,2,0,0,0,0|1,0,1]=4 18590 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)I 1626a_100000718082_100000238430 [0,2,0,0,0,0|1,0,1]=4 18591 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)I 240690a_100000718082_100000238430 [0,2,0,0,0,0|1,0,1]=4 18592 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)I 527a_100000718082_100000238430 [0,2,0,0,0,0|1,0,1]=4 18593 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)O 240690a_100000718082_100000745134 [0,2,0,0,0,0|1,0,1]=4 18594 B16R1.55 C#CCCCNC(=O)Cc1cccc(c1)O 527a_100000718082_100000745134 [0,2,0,0,0,0|1,0,1]=4 18595 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215482 [0,2,0,0,0,0|1,0,1]=4 18596 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)Br 1458a_100011215552_100000211773 [0,2,0,0,0,0|1,0,1]=4 18597 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011215482 [0,2,0,0,0,0|1,0,1]=4 18598 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)C 1458a_100011215552_100000211840 [0,2,0,0,0,0|1,0,1]=4 18599 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215482 [0,2,0,0,0,0|1,0,1]=4 18600 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100011215552_100000181238 [0,2,0,0,0,0|1,0,1]=4 18601 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215482 [0,2,0,0,0,0|1,0,1]=4 18602 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)F 1458a_100011215552_100000230114 [0,2,0,0,0,0|1,0,1]=4 18603 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215482 [0,2,0,0,0,0|1,0,1]=4 18604 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)I 1458a_100011215552_100011218688 [0,2,0,0,0,0|1,0,1]=4 18605 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215482 [0,2,0,0,0,0|1,0,1]=4 18606 B16R1.55 C=CCCCCC(=O)Cc1cccc(c1)O 1458a_100011215552_100011660834 [0,2,0,0,0,0|1,0,1]=4 18607 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Br 11a_100000700776_100000747190 [0,2,0,0,0,0|1,0,1]=4 18608 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Br 240690a_100000700776_100000747190 [0,2,0,0,0,0|1,0,1]=4 18609 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Br 527a_100000700776_100000747190 [0,2,0,0,0,0|1,0,1]=4 18610 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)C 11a_100000700776_100011206899 [0,2,0,0,0,0|1,0,1]=4 18611 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)C 1626a_100000700776_100011206899 [0,2,0,0,0,0|1,0,1]=4 18612 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)C 240690a_100000700776_100011206899 [0,2,0,0,0,0|1,0,1]=4 18613 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)C 527a_100000700776_100011206899 [0,2,0,0,0,0|1,0,1]=4 18614 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Cl 11a_100000700776_100000749307 [0,2,0,0,0,0|1,0,1]=4 18615 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000700776_100000749307 [0,2,0,0,0,0|1,0,1]=4 18616 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000700776_100000749307 [0,2,0,0,0,0|1,0,1]=4 18617 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)Cl 527a_100000700776_100000749307 [0,2,0,0,0,0|1,0,1]=4 18618 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)F 11a_100000700776_100000211661 [0,2,0,0,0,0|1,0,1]=4 18619 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)F 1626a_100000700776_100000211661 [0,2,0,0,0,0|1,0,1]=4 18620 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)F 240690a_100000700776_100000211661 [0,2,0,0,0,0|1,0,1]=4 18621 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)F 527a_100000700776_100000211661 [0,2,0,0,0,0|1,0,1]=4 18622 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)I 11a_100000700776_100000238430 [0,2,0,0,0,0|1,0,1]=4 18623 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)I 1626a_100000700776_100000238430 [0,2,0,0,0,0|1,0,1]=4 18624 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)I 240690a_100000700776_100000238430 [0,2,0,0,0,0|1,0,1]=4 18625 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)I 527a_100000700776_100000238430 [0,2,0,0,0,0|1,0,1]=4 18626 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)O 240690a_100000700776_100000745134 [0,2,0,0,0,0|1,0,1]=4 18627 B16R1.55 C=CCCCNC(=O)Cc1cccc(c1)O 527a_100000700776_100000745134 [0,2,0,0,0,0|1,0,1]=4 18628 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100015370543 [0,2,0,0,0,0|1,0,1]=4 18629 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100015370543 [0,2,0,0,0,0|1,0,1]=4 18630 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100015370543 [0,2,0,0,0,0|1,0,1]=4 18631 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100015370543 [0,2,0,0,0,0|1,0,1]=4 18632 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100015370543 [0,2,0,0,0,0|1,0,1]=4 18633 B16R1.55 CC/C=C\CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100015370543 [0,2,0,0,0,0|1,0,1]=4 18634 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)Br 1458a_200016266809_100000211773 [0,2,0,0,0,0|1,0,1]=4 18635 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)C 1458a_200016266809_100000211840 [0,2,0,0,0,0|1,0,1]=4 18636 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)Cl 1458a_200016266809_100000181238 [0,2,0,0,0,0|1,0,1]=4 18637 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)F 1458a_200016266809_100000230114 [0,2,0,0,0,0|1,0,1]=4 18638 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)I 1458a_200016266809_100011218688 [0,2,0,0,0,0|1,0,1]=4 18639 B16R1.55 CCC/C=C/CC(=O)Cc1cccc(c1)O 1458a_200016266809_100011660834 [0,2,0,0,0,0|1,0,1]=4 18640 B16R1.55 CCCC=NNC(=O)Cc1cccc(c1)C 4a_100011661631_100000185831 [0,2,0,0,0,0|1,0,1]=4 18641 B16R1.55 CCCC=NNC(=O)Cc1cccc(c1)Cl 4a_100011203430_100000185831 [0,2,0,0,0,0|1,0,1]=4 18642 B16R1.55 CCCC=NNC(=O)Cc1cccc(c1)F 4a_100000189928_100000185831 [0,2,0,0,0,0|1,0,1]=4 18643 B16R1.55 CCCCC=CC(=O)Cc1cc(ccn1)Br 1458a_100016266645_100010173614 [0,2,0,0,0,0|2,0,0]=4 18644 B16R1.55 CCCCC=CC(=O)Cc1cc(ccn1)C 1458a_100016266645_100000718516 [0,2,0,0,0,0|2,0,0]=4 18645 B16R1.55 CCCCC=CC(=O)Cc1cc(ccn1)Cl 1458a_100016266645_100016988179 [0,2,0,0,0,0|2,0,0]=4 18646 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)Br 1458a_100016266645_100000211773 [0,2,0,0,0,0|1,0,0]=3 18647 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)C 1458a_100016266645_100000211840 [0,2,0,0,0,0|1,0,0]=3 18648 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)Cl 1458a_100016266645_100000181238 [0,2,0,0,0,0|1,0,0]=3 18649 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)F 1458a_100016266645_100000230114 [0,2,0,0,0,0|1,0,0]=3 18650 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)I 1458a_100016266645_100011218688 [0,2,0,0,0,0|1,0,0]=3 18651 B16R1.55 CCCCC=CC(=O)Cc1cccc(c1)O 1458a_100016266645_100011660834 [0,2,0,0,0,0|1,0,0]=3 18652 B16R1.55 CCCCC=CC(=O)Cc1cccc(n1)Br 1458a_100016266645_100009889011 [0,2,0,0,0,0|2,0,0]=4 18653 B16R1.55 CCCCC=CC(=O)Cc1cccc(n1)C 1458a_100016266645_100000757606 [0,2,0,0,0,0|2,0,0]=4 18654 B16R1.55 CCCCC=CC(=O)Cc1cccc(n1)Cl 1458a_100016266645_100000086093 [0,2,0,0,0,0|2,0,0]=4 18655 B16R1.55 CCCCC=CC(=O)Cc1cccc(n1)F 1458a_100016266645_100009819644 [0,2,0,0,0,0|2,0,0]=4 18656 B16R1.55 CCCCC=CC(=O)Cc1ccnc(c1)Br 1458a_100016266645_100010243470 [0,2,0,0,0,0|2,0,0]=4 18657 B16R1.55 CCCCC=CC(=O)Cc1ccnc(c1)C 1458a_100016266645_200020672517 [0,2,0,0,0,0|2,0,0]=4 18658 B16R1.55 CCCCC=CC(=O)Cc1ccnc(c1)Cl 1458a_100016266645_100000764220 [0,2,0,0,0,0|2,0,0]=4 18659 B16R1.55 CCCCC=CC(=O)Cc1cncc(c1)Br 1458a_100016266645_100011740620 [0,2,0,0,0,0|2,0,0]=4 18660 B16R1.55 CCCCC=CC(=O)Cc1cncc(c1)C 1458a_100016266645_100000716715 [0,2,0,0,0,0|2,0,0]=4 18661 B16R1.55 CCCCC=CC(=O)Cc1cncc(c1)Cl 1458a_100016266645_100016992070 [0,2,0,0,0,0|2,0,0]=4 18662 B16R1.55 CCCCC=CC(=O)Cc1cncc(c1)F 1458a_100016266645_100000725299 [0,2,0,0,0,0|2,0,0]=4 18663 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100016266645 [0,2,0,0,0,0|2,0,0]=4 18664 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100016266645 [0,2,0,0,0,0|2,0,0]=4 18665 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100016266645 [0,2,0,0,0,0|2,0,0]=4 18666 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)C 11a_100000188690_100016266645 [0,2,0,0,0,0|2,0,0]=4 18667 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100016266645 [0,2,0,0,0,0|2,0,0]=4 18668 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100016266645 [0,2,0,0,0,0|2,0,0]=4 18669 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100016266645 [0,2,0,0,0,0|2,0,0]=4 18670 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100016266645 [0,2,0,0,0,0|2,0,0]=4 18671 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100016266645 [0,2,0,0,0,0|2,0,0]=4 18672 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)F 11a_100000210047_100016266645 [0,2,0,0,0,0|2,0,0]=4 18673 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100016266645 [0,2,0,0,0,0|2,0,0]=4 18674 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100016266645 [0,2,0,0,0,0|2,0,0]=4 18675 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)I 11a_100000211102_100016266645 [0,2,0,0,0,0|2,0,0]=4 18676 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100016266645 [0,2,0,0,0,0|2,0,0]=4 18677 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100016266645 [0,2,0,0,0,0|2,0,0]=4 18678 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100016266645 [0,2,0,0,0,0|2,0,0]=4 18679 B16R1.55 CCCCC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100016266645 [0,2,0,0,0,0|2,0,0]=4 18680 B16R1.55 CCCCCCC(=O)Cc1cc(ccn1)Br 1458a_100102632555_100010173614 [0,2,0,0,0,0|2,0,0]=4 18681 B16R1.55 CCCCCCC(=O)Cc1cc(ccn1)C 1458a_100102632555_100000718516 [0,2,0,0,0,0|2,0,0]=4 18682 B16R1.55 CCCCCCC(=O)Cc1cc(ccn1)Cl 1458a_100102632555_100016988179 [0,2,0,0,0,0|2,0,0]=4 18683 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210757 [0,2,0,0,0,0|1,0,0]=3 18684 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)Br 1458a_100102632555_100000211773 [0,2,0,0,0,0|1,0,0]=3 18685 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210757 [0,2,0,0,0,0|1,0,0]=3 18686 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)C 1458a_100102632555_100000211840 [0,2,0,0,0,0|1,0,0]=3 18687 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210757 [0,2,0,0,0,0|1,0,0]=3 18688 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)Cl 1458a_100102632555_100000181238 [0,2,0,0,0,0|1,0,0]=3 18689 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210757 [0,2,0,0,0,0|1,0,0]=3 18690 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)F 1458a_100102632555_100000230114 [0,2,0,0,0,0|1,0,0]=3 18691 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210757 [0,2,0,0,0,0|1,0,0]=3 18692 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)I 1458a_100102632555_100011218688 [0,2,0,0,0,0|1,0,0]=3 18693 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210757 [0,2,0,0,0,0|1,0,0]=3 18694 B16R1.55 CCCCCCC(=O)Cc1cccc(c1)O 1458a_100102632555_100011660834 [0,2,0,0,0,0|1,0,0]=3 18695 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210757 [0,2,0,0,0,0|2,0,0]=4 18696 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)Br 1458a_100102632555_100009889011 [0,2,0,0,0,0|2,0,0]=4 18697 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210757 [0,2,0,0,0,0|2,0,0]=4 18698 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)C 1458a_100102632555_100000757606 [0,2,0,0,0,0|2,0,0]=4 18699 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210757 [0,2,0,0,0,0|2,0,0]=4 18700 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)Cl 1458a_100102632555_100000086093 [0,2,0,0,0,0|2,0,0]=4 18701 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210757 [0,2,0,0,0,0|2,0,0]=4 18702 B16R1.55 CCCCCCC(=O)Cc1cccc(n1)F 1458a_100102632555_100009819644 [0,2,0,0,0,0|2,0,0]=4 18703 B16R1.55 CCCCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210757 [0,2,0,0,0,0|2,0,0]=4 18704 B16R1.55 CCCCCCC(=O)Cc1ccnc(c1)Br 1458a_100102632555_100010243470 [0,2,0,0,0,0|2,0,0]=4 18705 B16R1.55 CCCCCCC(=O)Cc1ccnc(c1)C 1458a_100102632555_200020672517 [0,2,0,0,0,0|2,0,0]=4 18706 B16R1.55 CCCCCCC(=O)Cc1ccnc(c1)Cl 1458a_100102632555_100000764220 [0,2,0,0,0,0|2,0,0]=4 18707 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210757 [0,2,0,0,0,0|2,0,0]=4 18708 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)Br 1458a_100102632555_100011740620 [0,2,0,0,0,0|2,0,0]=4 18709 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)C 1458a_100102632555_100000716715 [0,2,0,0,0,0|2,0,0]=4 18710 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)Cl 1458a_100102632555_100016992070 [0,2,0,0,0,0|2,0,0]=4 18711 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210757 [0,2,0,0,0,0|2,0,0]=4 18712 B16R1.55 CCCCCCC(=O)Cc1cncc(c1)F 1458a_100102632555_100000725299 [0,2,0,0,0,0|2,0,0]=4 18713 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100102632555 [0,2,0,0,0,0|2,0,0]=4 18714 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100102632555 [0,2,0,0,0,0|2,0,0]=4 18715 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100102632555 [0,2,0,0,0,0|2,0,0]=4 18716 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100102632555 [0,2,0,0,0,0|2,0,0]=4 18717 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)C 11a_100000188690_100102632555 [0,2,0,0,0,0|2,0,0]=4 18718 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100102632555 [0,2,0,0,0,0|2,0,0]=4 18719 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)C 22a_100000188690_100102632555 [0,2,0,0,0,0|2,0,0]=4 18720 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)C 527a_100000188690_100102632555 [0,2,0,0,0,0|2,0,0]=4 18721 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100102632555 [0,2,0,0,0,0|2,0,0]=4 18722 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100102632555 [0,2,0,0,0,0|2,0,0]=4 18723 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100102632555 [0,2,0,0,0,0|2,0,0]=4 18724 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)F 11a_100000210047_100102632555 [0,2,0,0,0,0|2,0,0]=4 18725 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100102632555 [0,2,0,0,0,0|2,0,0]=4 18726 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)F 22a_100000210047_100102632555 [0,2,0,0,0,0|2,0,0]=4 18727 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)F 527a_100000210047_100102632555 [0,2,0,0,0,0|2,0,0]=4 18728 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)I 11a_100000211102_100102632555 [0,2,0,0,0,0|2,0,0]=4 18729 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100102632555 [0,2,0,0,0,0|2,0,0]=4 18730 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)I 22a_100000211102_100102632555 [0,2,0,0,0,0|2,0,0]=4 18731 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)I 527a_100000211102_100102632555 [0,2,0,0,0,0|2,0,0]=4 18732 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100102632555 [0,2,0,0,0,0|2,0,0]=4 18733 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)O 22a_100000210217_100102632555 [0,2,0,0,0,0|2,0,0]=4 18734 B16R1.55 CCCCCCC(=O)Nc1cccc(c1)O 527a_100000210217_100102632555 [0,2,0,0,0,0|2,0,0]=4 18735 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Br 11a_100000209983_100000747190 [0,2,0,0,0,0|1,0,0]=3 18736 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Br 240690a_100000209983_100000747190 [0,2,0,0,0,0|1,0,0]=3 18737 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Br 527a_100000209983_100000747190 [0,2,0,0,0,0|1,0,0]=3 18738 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C 11a_100000209983_100011206899 [0,2,0,0,0,0|1,0,0]=3 18739 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C 1626a_100000209983_100011206899 [0,2,0,0,0,0|1,0,0]=3 18740 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C 240690a_100000209983_100011206899 [0,2,0,0,0,0|1,0,0]=3 18741 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)C 527a_100000209983_100011206899 [0,2,0,0,0,0|1,0,0]=3 18742 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl 11a_100000209983_100000749307 [0,2,0,0,0,0|1,0,0]=3 18743 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000209983_100000749307 [0,2,0,0,0,0|1,0,0]=3 18744 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000209983_100000749307 [0,2,0,0,0,0|1,0,0]=3 18745 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)Cl 527a_100000209983_100000749307 [0,2,0,0,0,0|1,0,0]=3 18746 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F 11a_100000209983_100000211661 [0,2,0,0,0,0|1,0,0]=3 18747 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F 1626a_100000209983_100000211661 [0,2,0,0,0,0|1,0,0]=3 18748 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F 240690a_100000209983_100000211661 [0,2,0,0,0,0|1,0,0]=3 18749 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)F 527a_100000209983_100000211661 [0,2,0,0,0,0|1,0,0]=3 18750 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)I 11a_100000209983_100000238430 [0,2,0,0,0,0|1,0,0]=3 18751 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)I 1626a_100000209983_100000238430 [0,2,0,0,0,0|1,0,0]=3 18752 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)I 240690a_100000209983_100000238430 [0,2,0,0,0,0|1,0,0]=3 18753 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)I 527a_100000209983_100000238430 [0,2,0,0,0,0|1,0,0]=3 18754 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)O 240690a_100000209983_100000745134 [0,2,0,0,0,0|1,0,0]=3 18755 B16R1.55 CCCCCNC(=O)Cc1cccc(c1)O 527a_100000209983_100000745134 [0,2,0,0,0,0|1,0,0]=3 18756 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Br 11a_100000209983_100010201708 [0,2,0,0,0,0|2,0,0]=4 18757 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Br 240690a_100000209983_100010201708 [0,2,0,0,0,0|2,0,0]=4 18758 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Br 527a_100000209983_100010201708 [0,2,0,0,0,0|2,0,0]=4 18759 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C 11a_100000209983_100012001110 [0,2,0,0,0,0|2,0,0]=4 18760 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C 1626a_100000209983_100012001110 [0,2,0,0,0,0|2,0,0]=4 18761 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C 240690a_100000209983_100012001110 [0,2,0,0,0,0|2,0,0]=4 18762 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)C 527a_100000209983_100012001110 [0,2,0,0,0,0|2,0,0]=4 18763 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Cl 11a_100000209983_100000090259 [0,2,0,0,0,0|2,0,0]=4 18764 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Cl 1626a_100000209983_100000090259 [0,2,0,0,0,0|2,0,0]=4 18765 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)Cl 240690a_100000209983_100000090259 [0,2,0,0,0,0|2,0,0]=4 18766 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)F 11a_100000209983_100000096803 [0,2,0,0,0,0|2,0,0]=4 18767 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)F 1626a_100000209983_100000096803 [0,2,0,0,0,0|2,0,0]=4 18768 B16R1.55 CCCCCNC(=O)Cc1cccc(n1)F 240690a_100000209983_100000096803 [0,2,0,0,0,0|2,0,0]=4 18769 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Br 11a_100000209983_100010126891 [0,2,0,0,0,0|2,0,0]=4 18770 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Br 240690a_100000209983_100010126891 [0,2,0,0,0,0|2,0,0]=4 18771 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Br 527a_100000209983_100010126891 [0,2,0,0,0,0|2,0,0]=4 18772 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Cl 11a_100000209983_100000085289 [0,2,0,0,0,0|2,0,0]=4 18773 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Cl 1626a_100000209983_100000085289 [0,2,0,0,0,0|2,0,0]=4 18774 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Cl 240690a_100000209983_100000085289 [0,2,0,0,0,0|2,0,0]=4 18775 B16R1.55 CCCCCNC(=O)Cc1ccnc(c1)Cl 527a_100000209983_100000085289 [0,2,0,0,0,0|2,0,0]=4 18776 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)Br 11a_100000209983_100000239331 [0,2,0,0,0,0|2,0,0]=4 18777 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)Br 240690a_100000209983_100000239331 [0,2,0,0,0,0|2,0,0]=4 18778 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)Br 527a_100000209983_100000239331 [0,2,0,0,0,0|2,0,0]=4 18779 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)F 11a_100000209983_100011667516 [0,2,0,0,0,0|2,0,0]=4 18780 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)F 240690a_100000209983_100011667516 [0,2,0,0,0,0|2,0,0]=4 18781 B16R1.55 CCCCCNC(=O)Cc1cncc(c1)F 527a_100000209983_100011667516 [0,2,0,0,0,0|2,0,0]=4 18782 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000209983 [0,2,0,0,0,0|2,0,0]=4 18783 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000209983 [0,2,0,0,0,0|2,0,0]=4 18784 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000209983 [0,2,0,0,0,0|2,0,0]=4 18785 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100000209983 [0,2,0,0,0,0|2,0,0]=4 18786 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000209983 [0,2,0,0,0,0|2,0,0]=4 18787 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000209983 [0,2,0,0,0,0|2,0,0]=4 18788 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000209983 [0,2,0,0,0,0|2,0,0]=4 18789 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000209983 [0,2,0,0,0,0|2,0,0]=4 18790 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000209983 [0,2,0,0,0,0|2,0,0]=4 18791 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000209983 [0,2,0,0,0,0|2,0,0]=4 18792 B16R1.55 CCCCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000209983 [0,2,0,0,0,0|2,0,0]=4 18793 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)Br 2230a_100000102301_100000183509 [0,2,0,0,0,0|2,0,0]=4 18794 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)Br 7a_106832991798_100000183509 [0,2,0,0,0,0|2,0,0]=4 18795 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)C 2230a_100000102301_100000182861 [0,2,0,0,0,0|2,0,0]=4 18796 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)C 7a_106832991798_100000182861 [0,2,0,0,0,0|2,0,0]=4 18797 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)Cl 2230a_100000102301_100000182995 [0,2,0,0,0,0|2,0,0]=4 18798 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_100000210211 [0,2,0,0,0,0|2,0,0]=4 18799 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)Cl 7a_106832991798_100000182995 [0,2,0,0,0,0|2,0,0]=4 18800 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)F 2230a_100000102301_100000183335 [0,2,0,0,0,0|2,0,0]=4 18801 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)F 2230a_100000168492_100000210211 [0,2,0,0,0,0|2,0,0]=4 18802 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)F 34a_100000168492_100000210210 [0,2,0,0,0,0|2,0,0]=4 18803 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)F 7a_106832991798_100000183335 [0,2,0,0,0,0|2,0,0]=4 18804 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)O 2230a_100000102301_100011236192 [0,2,0,0,0,0|2,0,0]=4 18805 B16R1.55 CCCCNCC(=O)Nc1cccc(c1)O 7a_106832991798_100011236192 [0,2,0,0,0,0|2,0,0]=4 18806 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)Br 22a_100025702795_100000747190 [0,2,0,0,0,0|1,0,0]=3 18807 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)C 22a_100025702795_100011206899 [0,2,0,0,0,0|1,0,0]=3 18808 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)Cl 22a_100025702795_100000749307 [0,2,0,0,0,0|1,0,0]=3 18809 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)F 22a_100025702795_100000211661 [0,2,0,0,0,0|1,0,0]=3 18810 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)I 22a_100025702795_100000238430 [0,2,0,0,0,0|1,0,0]=3 18811 B16R1.55 CCCCNNC(=O)Cc1cccc(c1)O 22a_100025702795_100000745134 [0,2,0,0,0,0|1,0,0]=3 18812 B16R1.55 CCCCNNC(=O)Cc1cccc(n1)Br 22a_100025702795_100010201708 [0,2,0,0,0,0|2,0,0]=4 18813 B16R1.55 CCCCNNC(=O)Cc1cccc(n1)C 22a_100025702795_100012001110 [0,2,0,0,0,0|2,0,0]=4 18814 B16R1.55 CCCCNNC(=O)Cc1cccc(n1)Cl 22a_100025702795_100000090259 [0,2,0,0,0,0|2,0,0]=4 18815 B16R1.55 CCCCNNC(=O)Cc1ccnc(c1)Br 22a_100025702795_100010126891 [0,2,0,0,0,0|2,0,0]=4 18816 B16R1.55 CCCCNNC(=O)Cc1ccnc(c1)Cl 22a_100025702795_100000085289 [0,2,0,0,0,0|2,0,0]=4 18817 B16R1.55 CCCCNNC(=O)Cc1cncc(c1)Br 22a_100025702795_100000239331 [0,2,0,0,0,0|2,0,0]=4 18818 B16R1.55 CCCCNNC(=O)Cc1cncc(c1)F 22a_100025702795_100011667516 [0,2,0,0,0,0|2,0,0]=4 18819 B16R1.55 CCCCNNC(=O)Nc1cccc(c1)Br 512a_100000210019_100025702795 [0,2,0,0,0,0|2,0,0]=4 18820 B16R1.55 CCCCNNC(=O)Nc1cccc(c1)C 512a_100000188690_100025702795 [0,2,0,0,0,0|2,0,0]=4 18821 B16R1.55 CCCCNNC(=O)Nc1cccc(c1)F 512a_100000210047_100025702795 [0,2,0,0,0,0|2,0,0]=4 18822 B16R1.55 CCCCNNC(=O)Nc1cccc(c1)I 512a_100000211102_100025702795 [0,2,0,0,0,0|2,0,0]=4 18823 B16R1.55 CCCCNNC(=O)Nc1cccc(c1)O 512a_100000210217_100025702795 [0,2,0,0,0,0|2,0,0]=4 18824 B16R1.55 CCCCOCC(=O)Cc1cc(ccn1)Br 1458a_100000757543_100010173614 [0,2,0,0,0,0|1,0,0]=3 18825 B16R1.55 CCCCOCC(=O)Cc1cc(ccn1)C 1458a_100000757543_100000718516 [0,2,0,0,0,0|1,0,0]=3 18826 B16R1.55 CCCCOCC(=O)Cc1cc(ccn1)Cl 1458a_100000757543_100016988179 [0,2,0,0,0,0|1,0,0]=3 18827 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011995733 [0,2,0,0,0,0|0,0,0]=2 18828 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)Br 1458a_100000757543_100000211773 [0,2,0,0,0,0|0,0,0]=2 18829 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)C 1458a_100000757543_100000211840 [0,2,0,0,0,0|0,0,0]=2 18830 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011995733 [0,2,0,0,0,0|0,0,0]=2 18831 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011995733 [0,2,0,0,0,0|0,0,0]=2 18832 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)Cl 1458a_100000757543_100000181238 [0,2,0,0,0,0|0,0,0]=2 18833 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011995733 [0,2,0,0,0,0|0,0,0]=2 18834 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)F 1458a_100000757543_100000230114 [0,2,0,0,0,0|0,0,0]=2 18835 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011995733 [0,2,0,0,0,0|0,0,0]=2 18836 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)I 1458a_100000757543_100011218688 [0,2,0,0,0,0|0,0,0]=2 18837 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011995733 [0,2,0,0,0,0|0,0,0]=2 18838 B16R1.55 CCCCOCC(=O)Cc1cccc(c1)O 1458a_100000757543_100011660834 [0,2,0,0,0,0|0,0,0]=2 18839 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)Br 1458a_100000757543_100009889011 [0,2,0,0,0,0|1,0,0]=3 18840 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100011995733 [0,2,0,0,0,0|1,0,0]=3 18841 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)C 1458a_100000757543_100000757606 [0,2,0,0,0,0|1,0,0]=3 18842 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)C 1458a_100012001110_100011995733 [0,2,0,0,0,0|1,0,0]=3 18843 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100011995733 [0,2,0,0,0,0|1,0,0]=3 18844 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)Cl 1458a_100000757543_100000086093 [0,2,0,0,0,0|1,0,0]=3 18845 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)F 1458a_100000096803_100011995733 [0,2,0,0,0,0|1,0,0]=3 18846 B16R1.55 CCCCOCC(=O)Cc1cccc(n1)F 1458a_100000757543_100009819644 [0,2,0,0,0,0|1,0,0]=3 18847 B16R1.55 CCCCOCC(=O)Cc1ccnc(c1)Br 1458a_100000757543_100010243470 [0,2,0,0,0,0|1,0,0]=3 18848 B16R1.55 CCCCOCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100011995733 [0,2,0,0,0,0|1,0,0]=3 18849 B16R1.55 CCCCOCC(=O)Cc1ccnc(c1)C 1458a_100000757543_200020672517 [0,2,0,0,0,0|1,0,0]=3 18850 B16R1.55 CCCCOCC(=O)Cc1ccnc(c1)Cl 1458a_100000757543_100000764220 [0,2,0,0,0,0|1,0,0]=3 18851 B16R1.55 CCCCOCC(=O)Cc1ccnc(n1)Cl 1458a_100000757543_100000099655 [0,2,0,0,0,0|2,0,0]=4 18852 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100011995733 [0,2,0,0,0,0|1,0,0]=3 18853 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)Br 1458a_100000757543_100011740620 [0,2,0,0,0,0|1,0,0]=3 18854 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)C 1458a_100000757543_100000716715 [0,2,0,0,0,0|1,0,0]=3 18855 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)Cl 1458a_100000757543_100016992070 [0,2,0,0,0,0|1,0,0]=3 18856 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)F 1458a_100000757543_100000725299 [0,2,0,0,0,0|1,0,0]=3 18857 B16R1.55 CCCCOCC(=O)Cc1cncc(c1)F 1458a_100011667516_100011995733 [0,2,0,0,0,0|1,0,0]=3 18858 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000757543 [0,2,0,0,0,0|1,0,0]=3 18859 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000757543 [0,2,0,0,0,0|1,0,0]=3 18860 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000757543 [0,2,0,0,0,0|1,0,0]=3 18861 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 34a_100000210227_100000183509 [0,2,0,0,0,0|1,0,0]=3 18862 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000757543 [0,2,0,0,0,0|1,0,0]=3 18863 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Br 7a_100000210227_100000183509 [0,2,0,0,0,0|1,0,0]=3 18864 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 11a_100000188690_100000757543 [0,2,0,0,0,0|1,0,0]=3 18865 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000757543 [0,2,0,0,0,0|1,0,0]=3 18866 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 22a_100000188690_100000757543 [0,2,0,0,0,0|1,0,0]=3 18867 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 34a_100000210227_100000182861 [0,2,0,0,0,0|1,0,0]=3 18868 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100000210210 [0,2,0,0,0,0|1,0,0]=3 18869 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 527a_100000188690_100000757543 [0,2,0,0,0,0|1,0,0]=3 18870 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)C 7a_100000210227_100000182861 [0,2,0,0,0,0|1,0,0]=3 18871 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000757543 [0,2,0,0,0,0|1,0,0]=3 18872 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000757543 [0,2,0,0,0,0|1,0,0]=3 18873 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000757543 [0,2,0,0,0,0|1,0,0]=3 18874 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Cl 34a_100000210227_100000182995 [0,2,0,0,0,0|1,0,0]=3 18875 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)Cl 7a_100000210227_100000182995 [0,2,0,0,0,0|1,0,0]=3 18876 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 11a_100000210047_100000757543 [0,2,0,0,0,0|1,0,0]=3 18877 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000757543 [0,2,0,0,0,0|1,0,0]=3 18878 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 22a_100000210047_100000757543 [0,2,0,0,0,0|1,0,0]=3 18879 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 34a_100000210227_100000183335 [0,2,0,0,0,0|1,0,0]=3 18880 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 527a_100000210047_100000757543 [0,2,0,0,0,0|1,0,0]=3 18881 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)F 7a_100000210227_100000183335 [0,2,0,0,0,0|1,0,0]=3 18882 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)I 11a_100000211102_100000757543 [0,2,0,0,0,0|1,0,0]=3 18883 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000757543 [0,2,0,0,0,0|1,0,0]=3 18884 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)I 22a_100000211102_100000757543 [0,2,0,0,0,0|1,0,0]=3 18885 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)I 527a_100000211102_100000757543 [0,2,0,0,0,0|1,0,0]=3 18886 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000757543 [0,2,0,0,0,0|1,0,0]=3 18887 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)O 22a_100000210217_100000757543 [0,2,0,0,0,0|1,0,0]=3 18888 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)O 34a_100000210227_100011236192 [0,2,0,0,0,0|1,0,0]=3 18889 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)O 527a_100000210217_100000757543 [0,2,0,0,0,0|1,0,0]=3 18890 B16R1.55 CCCCOCC(=O)Nc1cccc(c1)O 7a_100000210227_100011236192 [0,2,0,0,0,0|1,0,0]=3 18891 B16R1.55 CCCCOCC(=O)Nc1cccc(n1)C 34a_100000210227_103633700106 [0,2,0,0,0,0|2,0,0]=4 18892 B16R1.55 CCCCOCC(N)Cc1cccc(c1)Br 34a_114802770106_100000210210 [0,2,0,0,0,0|1,0,1]=4 18893 B16R1.55 CCCCOCC(N)Cc1cccc(c1)C 34a_100000716799_100000210210 [0,2,0,0,0,0|1,0,1]=4 18894 B16R1.55 CCCCOCC(N)Cc1cccc(c1)F 34a_200012000099_100000210210 [0,2,0,0,0,0|1,0,1]=4 18895 B16R1.55 CCCCOCN(C)Cc1cccc(c1)Br 2230a_100000187585_100011995733 [0,2,0,0,0,0|2,0,0]=4 18896 B16R1.55 CCCCOCN(C)Cc1cccc(c1)Br 269982a_100000187585_100011995733 [0,2,0,0,0,0|2,0,0]=4 18897 B16R1.55 CCCCOCN(C)Cc1cccc(c1)C 2230a_102495364743_100011995733 [0,2,0,0,0,0|2,0,0]=4 18898 B16R1.55 CCCCOCN(C)Cc1cccc(c1)C 269982a_102495364743_100011995733 [0,2,0,0,0,0|2,0,0]=4 18899 B16R1.55 CCCCOCN(C)Cc1cccc(c1)C 34a_102495364743_100011995733 [0,2,0,0,0,0|2,0,0]=4 18900 B16R1.55 CCCCOCN(C)Cc1cccc(c1)Cl 2230a_100020629429_100011995733 [0,2,0,0,0,0|2,0,0]=4 18901 B16R1.55 CCCCOCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100011995733 [0,2,0,0,0,0|2,0,0]=4 18902 B16R1.55 CCCCOCN(C)Cc1cccc(c1)F 2230a_100000184398_100011995733 [0,2,0,0,0,0|2,0,0]=4 18903 B16R1.55 CCCCOCN(C)Cc1cccc(c1)F 269982a_100000184398_100011995733 [0,2,0,0,0,0|2,0,0]=4 18904 B16R1.55 CCCCOCN(C)Cc1cccc(c1)F 34a_100000184398_100011995733 [0,2,0,0,0,0|2,0,0]=4 18905 B16R1.55 CCCCOCN(C)Cc1cccc(c1)O 2230a_100000207540_100011995733 [0,2,0,0,0,0|2,0,0]=4 18906 B16R1.55 CCCCOCN(C)Cc1cccc(c1)O 269982a_100000207540_100011995733 [0,2,0,0,0,0|2,0,0]=4 18907 B16R1.55 CCCCSCC(=O)Cc1cc(ccn1)Br 1458a_100000191162_100010173614 [0,2,0,0,0,0|1,1,0]=4 18908 B16R1.55 CCCCSCC(=O)Cc1cc(ccn1)C 1458a_100000191162_100000718516 [0,2,0,0,0,0|1,1,0]=4 18909 B16R1.55 CCCCSCC(=O)Cc1cc(ccn1)Cl 1458a_100000191162_100016988179 [0,2,0,0,0,0|1,1,0]=4 18910 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)Br 1458a_100000191162_100000211773 [0,2,0,0,0,0|0,1,0]=3 18911 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)C 1458a_100000191162_100000211840 [0,2,0,0,0,0|0,1,0]=3 18912 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)Cl 1458a_100000191162_100000181238 [0,2,0,0,0,0|0,1,0]=3 18913 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)F 1458a_100000191162_100000230114 [0,2,0,0,0,0|0,1,0]=3 18914 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)I 1458a_100000191162_100011218688 [0,2,0,0,0,0|0,1,0]=3 18915 B16R1.55 CCCCSCC(=O)Cc1cccc(c1)O 1458a_100000191162_100011660834 [0,2,0,0,0,0|0,1,0]=3 18916 B16R1.55 CCCCSCC(=O)Cc1cccc(n1)Br 1458a_100000191162_100009889011 [0,2,0,0,0,0|1,1,0]=4 18917 B16R1.55 CCCCSCC(=O)Cc1cccc(n1)C 1458a_100000191162_100000757606 [0,2,0,0,0,0|1,1,0]=4 18918 B16R1.55 CCCCSCC(=O)Cc1cccc(n1)Cl 1458a_100000191162_100000086093 [0,2,0,0,0,0|1,1,0]=4 18919 B16R1.55 CCCCSCC(=O)Cc1cccc(n1)F 1458a_100000191162_100009819644 [0,2,0,0,0,0|1,1,0]=4 18920 B16R1.55 CCCCSCC(=O)Cc1ccnc(c1)Br 1458a_100000191162_100010243470 [0,2,0,0,0,0|1,1,0]=4 18921 B16R1.55 CCCCSCC(=O)Cc1ccnc(c1)C 1458a_100000191162_200020672517 [0,2,0,0,0,0|1,1,0]=4 18922 B16R1.55 CCCCSCC(=O)Cc1ccnc(c1)Cl 1458a_100000191162_100000764220 [0,2,0,0,0,0|1,1,0]=4 18923 B16R1.55 CCCCSCC(=O)Cc1cncc(c1)Br 1458a_100000191162_100011740620 [0,2,0,0,0,0|1,1,0]=4 18924 B16R1.55 CCCCSCC(=O)Cc1cncc(c1)C 1458a_100000191162_100000716715 [0,2,0,0,0,0|1,1,0]=4 18925 B16R1.55 CCCCSCC(=O)Cc1cncc(c1)Cl 1458a_100000191162_100016992070 [0,2,0,0,0,0|1,1,0]=4 18926 B16R1.55 CCCCSCC(=O)Cc1cncc(c1)F 1458a_100000191162_100000725299 [0,2,0,0,0,0|1,1,0]=4 18927 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000191162 [0,2,0,0,0,0|1,1,0]=4 18928 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000191162 [0,2,0,0,0,0|1,1,0]=4 18929 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000191162 [0,2,0,0,0,0|1,1,0]=4 18930 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000191162 [0,2,0,0,0,0|1,1,0]=4 18931 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 62a_100000183509_100000210210 [0,2,0,0,0,0|1,1,0]=4 18932 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Br 62a_100000210211_100000183509 [0,2,0,0,0,0|1,1,0]=4 18933 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000191162 [0,2,0,0,0,0|1,1,0]=4 18934 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000191162 [0,2,0,0,0,0|1,1,0]=4 18935 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000191162 [0,2,0,0,0,0|1,1,0]=4 18936 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000191162 [0,2,0,0,0,0|1,1,0]=4 18937 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 62a_100000210211_100000182861 [0,2,0,0,0,0|1,1,0]=4 18938 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)C 62a_100000243722_100000210210 [0,2,0,0,0,0|1,1,0]=4 18939 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000191162 [0,2,0,0,0,0|1,1,0]=4 18940 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000191162 [0,2,0,0,0,0|1,1,0]=4 18941 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000191162 [0,2,0,0,0,0|1,1,0]=4 18942 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)Cl 62a_100000210211_100000182995 [0,2,0,0,0,0|1,1,0]=4 18943 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000191162 [0,2,0,0,0,0|1,1,0]=4 18944 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000191162 [0,2,0,0,0,0|1,1,0]=4 18945 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000191162 [0,2,0,0,0,0|1,1,0]=4 18946 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000191162 [0,2,0,0,0,0|1,1,0]=4 18947 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 62a_100000183335_100000210210 [0,2,0,0,0,0|1,1,0]=4 18948 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)F 62a_100000210211_100000183335 [0,2,0,0,0,0|1,1,0]=4 18949 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000191162 [0,2,0,0,0,0|1,1,0]=4 18950 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000191162 [0,2,0,0,0,0|1,1,0]=4 18951 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000191162 [0,2,0,0,0,0|1,1,0]=4 18952 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000191162 [0,2,0,0,0,0|1,1,0]=4 18953 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000191162 [0,2,0,0,0,0|1,1,0]=4 18954 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000191162 [0,2,0,0,0,0|1,1,0]=4 18955 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000191162 [0,2,0,0,0,0|1,1,0]=4 18956 B16R1.55 CCCCSCC(=O)Nc1cccc(c1)O 62a_100000210211_100011236192 [0,2,0,0,0,0|1,1,0]=4 18957 B16R1.55 CCCNCCC(=O)Nc1cccc(c1)C 2230a_200015186421_100000210303 [0,2,0,0,0,0|2,0,0]=4 18958 B16R1.55 CCCNCCC(=O)Nc1cccc(c1)C 34a_200015186421_100000210303 [0,2,0,0,0,0|2,0,0]=4 18959 B16R1.55 CCCNCCC(=O)Nc1cccc(c1)F 2230a_100015185233_100000210303 [0,2,0,0,0,0|2,0,0]=4 18960 B16R1.55 CCCNCCC(=O)Nc1cccc(c1)F 34a_100015185233_100000210303 [0,2,0,0,0,0|2,0,0]=4 18961 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215938 [0,2,0,0,0,0|1,0,0]=3 18962 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011215938 [0,2,0,0,0,0|1,0,0]=3 18963 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215938 [0,2,0,0,0,0|1,0,0]=3 18964 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215938 [0,2,0,0,0,0|1,0,0]=3 18965 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215938 [0,2,0,0,0,0|1,0,0]=3 18966 B16R1.55 CCCOCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215938 [0,2,0,0,0,0|1,0,0]=3 18967 B16R1.55 CCCOCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100011215938 [0,2,0,0,0,0|2,0,0]=4 18968 B16R1.55 CCCOCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100011215938 [0,2,0,0,0,0|2,0,0]=4 18969 B16R1.55 CCCOCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100011215938 [0,2,0,0,0,0|2,0,0]=4 18970 B16R1.55 CCCOCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100011215938 [0,2,0,0,0,0|2,0,0]=4 18971 B16R1.55 CCCOCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100011215938 [0,2,0,0,0,0|2,0,0]=4 18972 B16R1.55 CCCOCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100011215938 [0,2,0,0,0,0|2,0,0]=4 18973 B16R1.55 CCCOCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100011215938 [0,2,0,0,0,0|2,0,0]=4 18974 B16R1.55 CCCOCCC(=O)Nc1cccc(c1)C 34a_100000210258_100011194834 [0,2,0,0,0,0|2,0,0]=4 18975 B16R1.55 CCCOCCC(=O)Nc1cccc(c1)Cl 34a_100000210258_100000242061 [0,2,0,0,0,0|2,0,0]=4 18976 B16R1.55 CCCOCCC(=O)Nc1cccc(c1)F 34a_100000210258_100000242062 [0,2,0,0,0,0|2,0,0]=4 18977 B16R1.55 CCCOCCC(=O)Nc1cccc(c1)O 34a_100000210258_200011436826 [0,2,0,0,0,0|2,0,0]=4 18978 B16R1.55 CCCSCCC(=O)Nc1cccc(c1)C 62a_100000210303_100011194834 [0,2,0,0,0,0|2,0,0]=4 18979 B16R1.55 CCCSCCC(=O)Nc1cccc(c1)Cl 62a_100000210303_100000242061 [0,2,0,0,0,0|2,0,0]=4 18980 B16R1.55 CCCSCCC(=O)Nc1cccc(c1)F 62a_100000210303_100000242062 [0,2,0,0,0,0|2,0,0]=4 18981 B16R1.55 CCCSCCC(=O)Nc1cccc(c1)O 62a_100000210303_200011436826 [0,2,0,0,0,0|2,0,0]=4 18982 B16R1.55 CCNCCCC(=O)Nc1cccc(c1)C 2230a_100015525214_100000184976 [0,2,0,0,0,0|2,0,0]=4 18983 B16R1.55 CCNCCCC(=O)Nc1cccc(c1)Cl 2230a_114873766722_100000210202 [0,2,0,0,0,0|2,0,0]=4 18984 B16R1.55 CCNCCCC(=O)Nc1cccc(c1)Cl 34a_114873766722_100000210202 [0,2,0,0,0,0|2,0,0]=4 18985 B16R1.55 CCNCCNC(=O)Cc1cccc(c1)F 2230a_106430523477_100000210202 [0,2,0,0,0,0|1,0,0]=3 18986 B16R1.55 CCNCCNC(=O)Cc1cccc(c1)F 34a_106430523477_100000210202 [0,2,0,0,0,0|1,0,0]=3 18987 B16R1.55 CCNCCNC(=O)Nc1cccc(c1)F 2230a_100015525214_100000163364 [0,2,0,0,0,0|2,0,0]=4 18988 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100012232248 [0,2,0,0,0,0|1,0,0]=3 18989 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100012232248 [0,2,0,0,0,0|1,0,0]=3 18990 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100012232248 [0,2,0,0,0,0|1,0,0]=3 18991 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100012232248 [0,2,0,0,0,0|1,0,0]=3 18992 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100012232248 [0,2,0,0,0,0|1,0,0]=3 18993 B16R1.55 CCOCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100012232248 [0,2,0,0,0,0|1,0,0]=3 18994 B16R1.55 CCOCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100012232248 [0,2,0,0,0,0|2,0,0]=4 18995 B16R1.55 CCOCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100012232248 [0,2,0,0,0,0|2,0,0]=4 18996 B16R1.55 CCOCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100012232248 [0,2,0,0,0,0|2,0,0]=4 18997 B16R1.55 CCOCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100012232248 [0,2,0,0,0,0|2,0,0]=4 18998 B16R1.55 CCOCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100012232248 [0,2,0,0,0,0|2,0,0]=4 18999 B16R1.55 CCOCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100012232248 [0,2,0,0,0,0|2,0,0]=4 19000 B16R1.55 CCOCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100012232248 [0,2,0,0,0,0|2,0,0]=4 19001 B16R1.55 CCOCCCC(=O)Nc1cccc(c1)C 34a_100121572206_100000184976 [0,2,0,0,0,0|2,0,0]=4 19002 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Br 11a_100011200944_100000747190 [0,2,0,0,0,0|1,0,0]=3 19003 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Br 240690a_100011200944_100000747190 [0,2,0,0,0,0|1,0,0]=3 19004 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Br 527a_100011200944_100000747190 [0,2,0,0,0,0|1,0,0]=3 19005 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)C 11a_100011200944_100011206899 [0,2,0,0,0,0|1,0,0]=3 19006 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)C 1626a_102516460346_100011206899 [0,2,0,0,0,0|1,0,0]=3 19007 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)C 240690a_100011200944_100011206899 [0,2,0,0,0,0|1,0,0]=3 19008 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)C 527a_100011200944_100011206899 [0,2,0,0,0,0|1,0,0]=3 19009 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Cl 11a_100011200944_100000749307 [0,2,0,0,0,0|1,0,0]=3 19010 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Cl 1626a_102516460346_100000749307 [0,2,0,0,0,0|1,0,0]=3 19011 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Cl 240690a_100011200944_100000749307 [0,2,0,0,0,0|1,0,0]=3 19012 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)Cl 527a_100011200944_100000749307 [0,2,0,0,0,0|1,0,0]=3 19013 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)F 11a_100011200944_100000211661 [0,2,0,0,0,0|1,0,0]=3 19014 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)F 1626a_102516460346_100000211661 [0,2,0,0,0,0|1,0,0]=3 19015 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)F 240690a_100011200944_100000211661 [0,2,0,0,0,0|1,0,0]=3 19016 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)F 527a_100011200944_100000211661 [0,2,0,0,0,0|1,0,0]=3 19017 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)I 11a_100011200944_100000238430 [0,2,0,0,0,0|1,0,0]=3 19018 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)I 1626a_102516460346_100000238430 [0,2,0,0,0,0|1,0,0]=3 19019 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)I 240690a_100011200944_100000238430 [0,2,0,0,0,0|1,0,0]=3 19020 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)I 527a_100011200944_100000238430 [0,2,0,0,0,0|1,0,0]=3 19021 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)O 240690a_100011200944_100000745134 [0,2,0,0,0,0|1,0,0]=3 19022 B16R1.55 CCOCCNC(=O)Cc1cccc(c1)O 527a_100011200944_100000745134 [0,2,0,0,0,0|1,0,0]=3 19023 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Br 11a_100011200944_100010201708 [0,2,0,0,0,0|2,0,0]=4 19024 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Br 240690a_100011200944_100010201708 [0,2,0,0,0,0|2,0,0]=4 19025 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Br 527a_100011200944_100010201708 [0,2,0,0,0,0|2,0,0]=4 19026 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)C 11a_100011200944_100012001110 [0,2,0,0,0,0|2,0,0]=4 19027 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)C 1626a_102516460346_100012001110 [0,2,0,0,0,0|2,0,0]=4 19028 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)C 240690a_100011200944_100012001110 [0,2,0,0,0,0|2,0,0]=4 19029 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)C 527a_100011200944_100012001110 [0,2,0,0,0,0|2,0,0]=4 19030 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Cl 11a_100011200944_100000090259 [0,2,0,0,0,0|2,0,0]=4 19031 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Cl 1626a_102516460346_100000090259 [0,2,0,0,0,0|2,0,0]=4 19032 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)Cl 240690a_100011200944_100000090259 [0,2,0,0,0,0|2,0,0]=4 19033 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)F 11a_100011200944_100000096803 [0,2,0,0,0,0|2,0,0]=4 19034 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)F 1626a_102516460346_100000096803 [0,2,0,0,0,0|2,0,0]=4 19035 B16R1.55 CCOCCNC(=O)Cc1cccc(n1)F 240690a_100011200944_100000096803 [0,2,0,0,0,0|2,0,0]=4 19036 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Br 11a_100011200944_100010126891 [0,2,0,0,0,0|2,0,0]=4 19037 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Br 240690a_100011200944_100010126891 [0,2,0,0,0,0|2,0,0]=4 19038 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Br 527a_100011200944_100010126891 [0,2,0,0,0,0|2,0,0]=4 19039 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Cl 11a_100011200944_100000085289 [0,2,0,0,0,0|2,0,0]=4 19040 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Cl 1626a_102516460346_100000085289 [0,2,0,0,0,0|2,0,0]=4 19041 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Cl 240690a_100011200944_100000085289 [0,2,0,0,0,0|2,0,0]=4 19042 B16R1.55 CCOCCNC(=O)Cc1ccnc(c1)Cl 527a_100011200944_100000085289 [0,2,0,0,0,0|2,0,0]=4 19043 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)Br 11a_100011200944_100000239331 [0,2,0,0,0,0|2,0,0]=4 19044 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)Br 240690a_100011200944_100000239331 [0,2,0,0,0,0|2,0,0]=4 19045 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)Br 527a_100011200944_100000239331 [0,2,0,0,0,0|2,0,0]=4 19046 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)F 11a_100011200944_100011667516 [0,2,0,0,0,0|2,0,0]=4 19047 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)F 240690a_100011200944_100011667516 [0,2,0,0,0,0|2,0,0]=4 19048 B16R1.55 CCOCCNC(=O)Cc1cncc(c1)F 527a_100011200944_100011667516 [0,2,0,0,0,0|2,0,0]=4 19049 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100011200944 [0,2,0,0,0,0|2,0,0]=4 19050 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100011200944 [0,2,0,0,0,0|2,0,0]=4 19051 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100011200944 [0,2,0,0,0,0|2,0,0]=4 19052 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100011200944 [0,2,0,0,0,0|2,0,0]=4 19053 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100011200944 [0,2,0,0,0,0|2,0,0]=4 19054 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100011200944 [0,2,0,0,0,0|2,0,0]=4 19055 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100011200944 [0,2,0,0,0,0|2,0,0]=4 19056 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100011200944 [0,2,0,0,0,0|2,0,0]=4 19057 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100011200944 [0,2,0,0,0,0|2,0,0]=4 19058 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100011200944 [0,2,0,0,0,0|2,0,0]=4 19059 B16R1.55 CCOCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100011200944 [0,2,0,0,0,0|2,0,0]=4 19060 B16R1.55 CCOCCOC(=O)Nc1cccc(c1)Br 34a_100121572206_100015757870 [0,2,0,0,0,0|1,0,0]=3 19061 B16R1.55 CCSCCCC(=O)Nc1cccc(c1)C 62a_100000210202_100000184976 [0,2,0,0,0,0|2,0,0]=4 19062 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Br 11a_100000106463_100000747190 [0,2,0,0,0,0|1,0,0]=3 19063 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Br 240690a_100000106463_100000747190 [0,2,0,0,0,0|1,0,0]=3 19064 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Br 527a_100000106463_100000747190 [0,2,0,0,0,0|1,0,0]=3 19065 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C 11a_100000106463_100011206899 [0,2,0,0,0,0|1,0,0]=3 19066 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C 1626a_100000106463_100011206899 [0,2,0,0,0,0|1,0,0]=3 19067 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C 240690a_100000106463_100011206899 [0,2,0,0,0,0|1,0,0]=3 19068 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)C 527a_100000106463_100011206899 [0,2,0,0,0,0|1,0,0]=3 19069 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl 11a_100000106463_100000749307 [0,2,0,0,0,0|1,0,0]=3 19070 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl 1626a_100000106463_100000749307 [0,2,0,0,0,0|1,0,0]=3 19071 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl 240690a_100000106463_100000749307 [0,2,0,0,0,0|1,0,0]=3 19072 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)Cl 527a_100000106463_100000749307 [0,2,0,0,0,0|1,0,0]=3 19073 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F 11a_100000106463_100000211661 [0,2,0,0,0,0|1,0,0]=3 19074 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F 1626a_100000106463_100000211661 [0,2,0,0,0,0|1,0,0]=3 19075 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F 240690a_100000106463_100000211661 [0,2,0,0,0,0|1,0,0]=3 19076 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)F 527a_100000106463_100000211661 [0,2,0,0,0,0|1,0,0]=3 19077 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)I 11a_100000106463_100000238430 [0,2,0,0,0,0|1,0,0]=3 19078 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)I 1626a_100000106463_100000238430 [0,2,0,0,0,0|1,0,0]=3 19079 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)I 240690a_100000106463_100000238430 [0,2,0,0,0,0|1,0,0]=3 19080 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)I 527a_100000106463_100000238430 [0,2,0,0,0,0|1,0,0]=3 19081 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)O 240690a_100000106463_100000745134 [0,2,0,0,0,0|1,0,0]=3 19082 B16R1.55 CCSCCNC(=O)Cc1cccc(c1)O 527a_100000106463_100000745134 [0,2,0,0,0,0|1,0,0]=3 19083 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Br 11a_100000106463_100010201708 [0,2,0,0,0,0|2,0,0]=4 19084 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Br 240690a_100000106463_100010201708 [0,2,0,0,0,0|2,0,0]=4 19085 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Br 527a_100000106463_100010201708 [0,2,0,0,0,0|2,0,0]=4 19086 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C 11a_100000106463_100012001110 [0,2,0,0,0,0|2,0,0]=4 19087 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C 1626a_100000106463_100012001110 [0,2,0,0,0,0|2,0,0]=4 19088 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C 240690a_100000106463_100012001110 [0,2,0,0,0,0|2,0,0]=4 19089 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)C 527a_100000106463_100012001110 [0,2,0,0,0,0|2,0,0]=4 19090 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Cl 11a_100000106463_100000090259 [0,2,0,0,0,0|2,0,0]=4 19091 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Cl 1626a_100000106463_100000090259 [0,2,0,0,0,0|2,0,0]=4 19092 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)Cl 240690a_100000106463_100000090259 [0,2,0,0,0,0|2,0,0]=4 19093 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)F 11a_100000106463_100000096803 [0,2,0,0,0,0|2,0,0]=4 19094 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)F 1626a_100000106463_100000096803 [0,2,0,0,0,0|2,0,0]=4 19095 B16R1.55 CCSCCNC(=O)Cc1cccc(n1)F 240690a_100000106463_100000096803 [0,2,0,0,0,0|2,0,0]=4 19096 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Br 11a_100000106463_100010126891 [0,2,0,0,0,0|2,0,0]=4 19097 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Br 240690a_100000106463_100010126891 [0,2,0,0,0,0|2,0,0]=4 19098 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Br 527a_100000106463_100010126891 [0,2,0,0,0,0|2,0,0]=4 19099 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Cl 11a_100000106463_100000085289 [0,2,0,0,0,0|2,0,0]=4 19100 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Cl 1626a_100000106463_100000085289 [0,2,0,0,0,0|2,0,0]=4 19101 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Cl 240690a_100000106463_100000085289 [0,2,0,0,0,0|2,0,0]=4 19102 B16R1.55 CCSCCNC(=O)Cc1ccnc(c1)Cl 527a_100000106463_100000085289 [0,2,0,0,0,0|2,0,0]=4 19103 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)Br 11a_100000106463_100000239331 [0,2,0,0,0,0|2,0,0]=4 19104 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)Br 240690a_100000106463_100000239331 [0,2,0,0,0,0|2,0,0]=4 19105 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)Br 527a_100000106463_100000239331 [0,2,0,0,0,0|2,0,0]=4 19106 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)F 11a_100000106463_100011667516 [0,2,0,0,0,0|2,0,0]=4 19107 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)F 240690a_100000106463_100011667516 [0,2,0,0,0,0|2,0,0]=4 19108 B16R1.55 CCSCCNC(=O)Cc1cncc(c1)F 527a_100000106463_100011667516 [0,2,0,0,0,0|2,0,0]=4 19109 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000106463 [0,2,0,0,0,0|2,0,0]=4 19110 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000106463 [0,2,0,0,0,0|2,0,0]=4 19111 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000106463 [0,2,0,0,0,0|2,0,0]=4 19112 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100000106463 [0,2,0,0,0,0|2,0,0]=4 19113 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000106463 [0,2,0,0,0,0|2,0,0]=4 19114 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000106463 [0,2,0,0,0,0|2,0,0]=4 19115 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000106463 [0,2,0,0,0,0|2,0,0]=4 19116 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)F 62a_100000210202_100000163364 [0,2,0,0,0,0|2,0,0]=4 19117 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000106463 [0,2,0,0,0,0|2,0,0]=4 19118 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000106463 [0,2,0,0,0,0|2,0,0]=4 19119 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000106463 [0,2,0,0,0,0|2,0,0]=4 19120 B16R1.55 CCSCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000106463 [0,2,0,0,0,0|2,0,0]=4 19121 B16R1.55 CCSCCOC(=O)Nc1cccc(c1)Br 62a_100000210202_100015757870 [0,2,0,0,0,0|1,0,0]=3 19122 B16R1.55 COCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000755781 [0,2,0,0,0,0|1,0,0]=3 19123 B16R1.55 COCCCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000755781 [0,2,0,0,0,0|1,0,0]=3 19124 B16R1.55 COCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000755781 [0,2,0,0,0,0|1,0,0]=3 19125 B16R1.55 COCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000755781 [0,2,0,0,0,0|1,0,0]=3 19126 B16R1.55 COCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000755781 [0,2,0,0,0,0|1,0,0]=3 19127 B16R1.55 COCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000755781 [0,2,0,0,0,0|1,0,0]=3 19128 B16R1.55 COCCCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000755781 [0,2,0,0,0,0|2,0,0]=4 19129 B16R1.55 COCCCCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000755781 [0,2,0,0,0,0|2,0,0]=4 19130 B16R1.55 COCCCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000755781 [0,2,0,0,0,0|2,0,0]=4 19131 B16R1.55 COCCCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000755781 [0,2,0,0,0,0|2,0,0]=4 19132 B16R1.55 COCCCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000755781 [0,2,0,0,0,0|2,0,0]=4 19133 B16R1.55 COCCCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000755781 [0,2,0,0,0,0|2,0,0]=4 19134 B16R1.55 COCCCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000755781 [0,2,0,0,0,0|2,0,0]=4 19135 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Br 240690a_100150723488_100000747190 [0,2,0,0,0,0|1,0,0]=3 19136 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Br 527a_100150723488_100000747190 [0,2,0,0,0,0|1,0,0]=3 19137 B16R1.55 COCCCNC(=O)Cc1cccc(c1)C 1626a_100150723488_100011206899 [0,2,0,0,0,0|1,0,0]=3 19138 B16R1.55 COCCCNC(=O)Cc1cccc(c1)C 240690a_100150723488_100011206899 [0,2,0,0,0,0|1,0,0]=3 19139 B16R1.55 COCCCNC(=O)Cc1cccc(c1)C 527a_100150723488_100011206899 [0,2,0,0,0,0|1,0,0]=3 19140 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Cl 1626a_100150723488_100000749307 [0,2,0,0,0,0|1,0,0]=3 19141 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Cl 240690a_100150723488_100000749307 [0,2,0,0,0,0|1,0,0]=3 19142 B16R1.55 COCCCNC(=O)Cc1cccc(c1)Cl 527a_100150723488_100000749307 [0,2,0,0,0,0|1,0,0]=3 19143 B16R1.55 COCCCNC(=O)Cc1cccc(c1)F 1626a_100150723488_100000211661 [0,2,0,0,0,0|1,0,0]=3 19144 B16R1.55 COCCCNC(=O)Cc1cccc(c1)F 240690a_100150723488_100000211661 [0,2,0,0,0,0|1,0,0]=3 19145 B16R1.55 COCCCNC(=O)Cc1cccc(c1)F 527a_100150723488_100000211661 [0,2,0,0,0,0|1,0,0]=3 19146 B16R1.55 COCCCNC(=O)Cc1cccc(c1)I 1626a_100150723488_100000238430 [0,2,0,0,0,0|1,0,0]=3 19147 B16R1.55 COCCCNC(=O)Cc1cccc(c1)I 240690a_100150723488_100000238430 [0,2,0,0,0,0|1,0,0]=3 19148 B16R1.55 COCCCNC(=O)Cc1cccc(c1)I 527a_100150723488_100000238430 [0,2,0,0,0,0|1,0,0]=3 19149 B16R1.55 COCCCNC(=O)Cc1cccc(c1)O 240690a_100150723488_100000745134 [0,2,0,0,0,0|1,0,0]=3 19150 B16R1.55 COCCCNC(=O)Cc1cccc(c1)O 527a_100150723488_100000745134 [0,2,0,0,0,0|1,0,0]=3 19151 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Br 240690a_100150723488_100010201708 [0,2,0,0,0,0|2,0,0]=4 19152 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Br 527a_100150723488_100010201708 [0,2,0,0,0,0|2,0,0]=4 19153 B16R1.55 COCCCNC(=O)Cc1cccc(n1)C 1626a_100150723488_100012001110 [0,2,0,0,0,0|2,0,0]=4 19154 B16R1.55 COCCCNC(=O)Cc1cccc(n1)C 240690a_100150723488_100012001110 [0,2,0,0,0,0|2,0,0]=4 19155 B16R1.55 COCCCNC(=O)Cc1cccc(n1)C 527a_100150723488_100012001110 [0,2,0,0,0,0|2,0,0]=4 19156 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Cl 1626a_100150723488_100000090259 [0,2,0,0,0,0|2,0,0]=4 19157 B16R1.55 COCCCNC(=O)Cc1cccc(n1)Cl 240690a_100150723488_100000090259 [0,2,0,0,0,0|2,0,0]=4 19158 B16R1.55 COCCCNC(=O)Cc1cccc(n1)F 1626a_100150723488_100000096803 [0,2,0,0,0,0|2,0,0]=4 19159 B16R1.55 COCCCNC(=O)Cc1cccc(n1)F 240690a_100150723488_100000096803 [0,2,0,0,0,0|2,0,0]=4 19160 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Br 240690a_100150723488_100010126891 [0,2,0,0,0,0|2,0,0]=4 19161 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Br 527a_100150723488_100010126891 [0,2,0,0,0,0|2,0,0]=4 19162 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Cl 1626a_100150723488_100000085289 [0,2,0,0,0,0|2,0,0]=4 19163 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Cl 240690a_100150723488_100000085289 [0,2,0,0,0,0|2,0,0]=4 19164 B16R1.55 COCCCNC(=O)Cc1ccnc(c1)Cl 527a_100150723488_100000085289 [0,2,0,0,0,0|2,0,0]=4 19165 B16R1.55 COCCCNC(=O)Cc1cncc(c1)Br 240690a_100150723488_100000239331 [0,2,0,0,0,0|2,0,0]=4 19166 B16R1.55 COCCCNC(=O)Cc1cncc(c1)Br 527a_100150723488_100000239331 [0,2,0,0,0,0|2,0,0]=4 19167 B16R1.55 COCCCNC(=O)Cc1cncc(c1)F 240690a_100150723488_100011667516 [0,2,0,0,0,0|2,0,0]=4 19168 B16R1.55 COCCCNC(=O)Cc1cncc(c1)F 527a_100150723488_100011667516 [0,2,0,0,0,0|2,0,0]=4 19169 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100150723488 [0,2,0,0,0,0|2,0,0]=4 19170 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100150723488 [0,2,0,0,0,0|2,0,0]=4 19171 B16R1.55 COCCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100150723488 [0,2,0,0,0,0|2,0,0]=4 19172 B16R1.55 COCCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100150723488 [0,2,0,0,0,0|2,0,0]=4 19173 B16R1.55 COCCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100150723488 [0,2,0,0,0,0|2,0,0]=4 19174 B16R1.55 COCCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100150723488 [0,2,0,0,0,0|2,0,0]=4 19175 B16R1.55 COCCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100150723488 [0,2,0,0,0,0|2,0,0]=4 19176 B16R1.55 COCCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100150723488 [0,2,0,0,0,0|2,0,0]=4 19177 B16R1.55 COCCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100150723488 [0,2,0,0,0,0|2,0,0]=4 19178 B16R1.55 COCCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100150723488 [0,2,0,0,0,0|2,0,0]=4 19179 B16R1.55 COCCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100150723488 [0,2,0,0,0,0|2,0,0]=4 19180 B16R1.55 COCCNNC(=O)Cc1cccc(c1)Br 22a_100000741390_100000747190 [0,2,0,0,0,0|2,0,0]=4 19181 B16R1.55 COCCNNC(=O)Cc1cccc(c1)C 22a_100000741390_100011206899 [0,2,0,0,0,0|2,0,0]=4 19182 B16R1.55 COCCNNC(=O)Cc1cccc(c1)Cl 22a_100000741390_100000749307 [0,2,0,0,0,0|2,0,0]=4 19183 B16R1.55 COCCNNC(=O)Cc1cccc(c1)F 22a_100000741390_100000211661 [0,2,0,0,0,0|2,0,0]=4 19184 B16R1.55 COCCNNC(=O)Cc1cccc(c1)I 22a_100000741390_100000238430 [0,2,0,0,0,0|2,0,0]=4 19185 B16R1.55 COCCNNC(=O)Cc1cccc(c1)O 22a_100000741390_100000745134 [0,2,0,0,0,0|2,0,0]=4 19186 B16R1.55 COCCOCC(=O)Cc1cc(ccn1)Br 1458a_100000211095_100010173614 [0,2,0,0,0,0|2,0,0]=4 19187 B16R1.55 COCCOCC(=O)Cc1cc(ccn1)C 1458a_100000211095_100000718516 [0,2,0,0,0,0|2,0,0]=4 19188 B16R1.55 COCCOCC(=O)Cc1cc(ccn1)Cl 1458a_100000211095_100016988179 [0,2,0,0,0,0|2,0,0]=4 19189 B16R1.55 COCCOCC(=O)Cc1cccc(c1)Br 1458a_100000211095_100000211773 [0,2,0,0,0,0|1,0,0]=3 19190 B16R1.55 COCCOCC(=O)Cc1cccc(c1)C 1458a_100000211095_100000211840 [0,2,0,0,0,0|1,0,0]=3 19191 B16R1.55 COCCOCC(=O)Cc1cccc(c1)Cl 1458a_100000211095_100000181238 [0,2,0,0,0,0|1,0,0]=3 19192 B16R1.55 COCCOCC(=O)Cc1cccc(c1)F 1458a_100000211095_100000230114 [0,2,0,0,0,0|1,0,0]=3 19193 B16R1.55 COCCOCC(=O)Cc1cccc(c1)I 1458a_100000211095_100011218688 [0,2,0,0,0,0|1,0,0]=3 19194 B16R1.55 COCCOCC(=O)Cc1cccc(c1)O 1458a_100000211095_100011660834 [0,2,0,0,0,0|1,0,0]=3 19195 B16R1.55 COCCOCC(=O)Cc1cccc(n1)Br 1458a_100000211095_100009889011 [0,2,0,0,0,0|2,0,0]=4 19196 B16R1.55 COCCOCC(=O)Cc1cccc(n1)C 1458a_100000211095_100000757606 [0,2,0,0,0,0|2,0,0]=4 19197 B16R1.55 COCCOCC(=O)Cc1cccc(n1)Cl 1458a_100000211095_100000086093 [0,2,0,0,0,0|2,0,0]=4 19198 B16R1.55 COCCOCC(=O)Cc1cccc(n1)F 1458a_100000211095_100009819644 [0,2,0,0,0,0|2,0,0]=4 19199 B16R1.55 COCCOCC(=O)Cc1ccnc(c1)Br 1458a_100000211095_100010243470 [0,2,0,0,0,0|2,0,0]=4 19200 B16R1.55 COCCOCC(=O)Cc1ccnc(c1)C 1458a_100000211095_200020672517 [0,2,0,0,0,0|2,0,0]=4 19201 B16R1.55 COCCOCC(=O)Cc1ccnc(c1)Cl 1458a_100000211095_100000764220 [0,2,0,0,0,0|2,0,0]=4 19202 B16R1.55 COCCOCC(=O)Cc1cncc(c1)Br 1458a_100000211095_100011740620 [0,2,0,0,0,0|2,0,0]=4 19203 B16R1.55 COCCOCC(=O)Cc1cncc(c1)C 1458a_100000211095_100000716715 [0,2,0,0,0,0|2,0,0]=4 19204 B16R1.55 COCCOCC(=O)Cc1cncc(c1)Cl 1458a_100000211095_100016992070 [0,2,0,0,0,0|2,0,0]=4 19205 B16R1.55 COCCOCC(=O)Cc1cncc(c1)F 1458a_100000211095_100000725299 [0,2,0,0,0,0|2,0,0]=4 19206 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000211095 [0,2,0,0,0,0|2,0,0]=4 19207 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000211095 [0,2,0,0,0,0|2,0,0]=4 19208 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000211095 [0,2,0,0,0,0|2,0,0]=4 19209 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Br 34a_100000210237_100000183509 [0,2,0,0,0,0|2,0,0]=4 19210 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000211095 [0,2,0,0,0,0|2,0,0]=4 19211 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 11a_100000188690_100000211095 [0,2,0,0,0,0|2,0,0]=4 19212 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000211095 [0,2,0,0,0,0|2,0,0]=4 19213 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 22a_100000188690_100000211095 [0,2,0,0,0,0|2,0,0]=4 19214 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 34a_100000210237_100000182861 [0,2,0,0,0,0|2,0,0]=4 19215 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100011201679 [0,2,0,0,0,0|2,0,0]=4 19216 B16R1.55 COCCOCC(=O)Nc1cccc(c1)C 527a_100000188690_100000211095 [0,2,0,0,0,0|2,0,0]=4 19217 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000211095 [0,2,0,0,0,0|2,0,0]=4 19218 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000211095 [0,2,0,0,0,0|2,0,0]=4 19219 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000211095 [0,2,0,0,0,0|2,0,0]=4 19220 B16R1.55 COCCOCC(=O)Nc1cccc(c1)Cl 34a_100000210237_100000182995 [0,2,0,0,0,0|2,0,0]=4 19221 B16R1.55 COCCOCC(=O)Nc1cccc(c1)F 11a_100000210047_100000211095 [0,2,0,0,0,0|2,0,0]=4 19222 B16R1.55 COCCOCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000211095 [0,2,0,0,0,0|2,0,0]=4 19223 B16R1.55 COCCOCC(=O)Nc1cccc(c1)F 22a_100000210047_100000211095 [0,2,0,0,0,0|2,0,0]=4 19224 B16R1.55 COCCOCC(=O)Nc1cccc(c1)F 34a_100000210237_100000183335 [0,2,0,0,0,0|2,0,0]=4 19225 B16R1.55 COCCOCC(=O)Nc1cccc(c1)F 527a_100000210047_100000211095 [0,2,0,0,0,0|2,0,0]=4 19226 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I 11a_100000211102_100000211095 [0,2,0,0,0,0|2,0,0]=4 19227 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000211095 [0,2,0,0,0,0|2,0,0]=4 19228 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I 22a_100000211102_100000211095 [0,2,0,0,0,0|2,0,0]=4 19229 B16R1.55 COCCOCC(=O)Nc1cccc(c1)I 527a_100000211102_100000211095 [0,2,0,0,0,0|2,0,0]=4 19230 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000211095 [0,2,0,0,0,0|2,0,0]=4 19231 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O 22a_100000210217_100000211095 [0,2,0,0,0,0|2,0,0]=4 19232 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O 34a_100000210237_100011236192 [0,2,0,0,0,0|2,0,0]=4 19233 B16R1.55 COCCOCC(=O)Nc1cccc(c1)O 527a_100000210217_100000211095 [0,2,0,0,0,0|2,0,0]=4 19234 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Br 11a_100000749238_100000747190 [0,2,0,0,0,0|1,0,0]=3 19235 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Br 240690a_100000749238_100000747190 [0,2,0,0,0,0|1,0,0]=3 19236 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Br 527a_100000749238_100000747190 [0,2,0,0,0,0|1,0,0]=3 19237 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C 11a_100000749238_100011206899 [0,2,0,0,0,0|1,0,0]=3 19238 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C 1626a_100000749238_100011206899 [0,2,0,0,0,0|1,0,0]=3 19239 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C 240690a_100000749238_100011206899 [0,2,0,0,0,0|1,0,0]=3 19240 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)C 527a_100000749238_100011206899 [0,2,0,0,0,0|1,0,0]=3 19241 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl 11a_100000749238_100000749307 [0,2,0,0,0,0|1,0,0]=3 19242 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl 1626a_100000749238_100000749307 [0,2,0,0,0,0|1,0,0]=3 19243 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl 240690a_100000749238_100000749307 [0,2,0,0,0,0|1,0,0]=3 19244 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)Cl 527a_100000749238_100000749307 [0,2,0,0,0,0|1,0,0]=3 19245 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F 11a_100000749238_100000211661 [0,2,0,0,0,0|1,0,0]=3 19246 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F 1626a_100000749238_100000211661 [0,2,0,0,0,0|1,0,0]=3 19247 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F 240690a_100000749238_100000211661 [0,2,0,0,0,0|1,0,0]=3 19248 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)F 527a_100000749238_100000211661 [0,2,0,0,0,0|1,0,0]=3 19249 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)I 11a_100000749238_100000238430 [0,2,0,0,0,0|1,0,0]=3 19250 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)I 1626a_100000749238_100000238430 [0,2,0,0,0,0|1,0,0]=3 19251 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)I 240690a_100000749238_100000238430 [0,2,0,0,0,0|1,0,0]=3 19252 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)I 527a_100000749238_100000238430 [0,2,0,0,0,0|1,0,0]=3 19253 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)O 240690a_100000749238_100000745134 [0,2,0,0,0,0|1,0,0]=3 19254 B16R1.55 CSCCCNC(=O)Cc1cccc(c1)O 527a_100000749238_100000745134 [0,2,0,0,0,0|1,0,0]=3 19255 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Br 11a_100000749238_100010201708 [0,2,0,0,0,0|2,0,0]=4 19256 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Br 240690a_100000749238_100010201708 [0,2,0,0,0,0|2,0,0]=4 19257 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Br 527a_100000749238_100010201708 [0,2,0,0,0,0|2,0,0]=4 19258 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C 11a_100000749238_100012001110 [0,2,0,0,0,0|2,0,0]=4 19259 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C 1626a_100000749238_100012001110 [0,2,0,0,0,0|2,0,0]=4 19260 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C 240690a_100000749238_100012001110 [0,2,0,0,0,0|2,0,0]=4 19261 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)C 527a_100000749238_100012001110 [0,2,0,0,0,0|2,0,0]=4 19262 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Cl 11a_100000749238_100000090259 [0,2,0,0,0,0|2,0,0]=4 19263 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Cl 1626a_100000749238_100000090259 [0,2,0,0,0,0|2,0,0]=4 19264 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)Cl 240690a_100000749238_100000090259 [0,2,0,0,0,0|2,0,0]=4 19265 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)F 11a_100000749238_100000096803 [0,2,0,0,0,0|2,0,0]=4 19266 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)F 1626a_100000749238_100000096803 [0,2,0,0,0,0|2,0,0]=4 19267 B16R1.55 CSCCCNC(=O)Cc1cccc(n1)F 240690a_100000749238_100000096803 [0,2,0,0,0,0|2,0,0]=4 19268 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Br 11a_100000749238_100010126891 [0,2,0,0,0,0|2,0,0]=4 19269 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Br 240690a_100000749238_100010126891 [0,2,0,0,0,0|2,0,0]=4 19270 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Br 527a_100000749238_100010126891 [0,2,0,0,0,0|2,0,0]=4 19271 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Cl 11a_100000749238_100000085289 [0,2,0,0,0,0|2,0,0]=4 19272 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Cl 1626a_100000749238_100000085289 [0,2,0,0,0,0|2,0,0]=4 19273 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Cl 240690a_100000749238_100000085289 [0,2,0,0,0,0|2,0,0]=4 19274 B16R1.55 CSCCCNC(=O)Cc1ccnc(c1)Cl 527a_100000749238_100000085289 [0,2,0,0,0,0|2,0,0]=4 19275 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)Br 11a_100000749238_100000239331 [0,2,0,0,0,0|2,0,0]=4 19276 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)Br 240690a_100000749238_100000239331 [0,2,0,0,0,0|2,0,0]=4 19277 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)Br 527a_100000749238_100000239331 [0,2,0,0,0,0|2,0,0]=4 19278 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)F 11a_100000749238_100011667516 [0,2,0,0,0,0|2,0,0]=4 19279 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)F 240690a_100000749238_100011667516 [0,2,0,0,0,0|2,0,0]=4 19280 B16R1.55 CSCCCNC(=O)Cc1cncc(c1)F 527a_100000749238_100011667516 [0,2,0,0,0,0|2,0,0]=4 19281 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000749238 [0,2,0,0,0,0|2,0,0]=4 19282 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000749238 [0,2,0,0,0,0|2,0,0]=4 19283 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100000749238 [0,2,0,0,0,0|2,0,0]=4 19284 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)C 512a_100000188690_100000749238 [0,2,0,0,0,0|2,0,0]=4 19285 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000749238 [0,2,0,0,0,0|2,0,0]=4 19286 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000749238 [0,2,0,0,0,0|2,0,0]=4 19287 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000749238 [0,2,0,0,0,0|2,0,0]=4 19288 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000749238 [0,2,0,0,0,0|2,0,0]=4 19289 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000749238 [0,2,0,0,0,0|2,0,0]=4 19290 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000749238 [0,2,0,0,0,0|2,0,0]=4 19291 B16R1.55 CSCCCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000749238 [0,2,0,0,0,0|2,0,0]=4 19292 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)Br 34a_100000230434_100000183509 [0,2,0,0,0,0|2,0,0]=4 19293 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)Br 7a_100000230434_100000183509 [0,2,0,0,0,0|2,0,0]=4 19294 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)C 34a_100000230434_100000182861 [0,2,0,0,0,0|2,0,0]=4 19295 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)C 34a_100000749660_100000212216 [0,2,0,0,0,0|2,0,0]=4 19296 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)C 7a_100000230434_100000182861 [0,2,0,0,0,0|2,0,0]=4 19297 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)Cl 34a_100000230434_100000182995 [0,2,0,0,0,0|2,0,0]=4 19298 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)Cl 7a_100000230434_100000182995 [0,2,0,0,0,0|2,0,0]=4 19299 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)F 34a_100000230434_100000183335 [0,2,0,0,0,0|2,0,0]=4 19300 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)F 7a_100000230434_100000183335 [0,2,0,0,0,0|2,0,0]=4 19301 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)O 34a_100000230434_100011236192 [0,2,0,0,0,0|2,0,0]=4 19302 B16R1.55 CSCCOCC(=O)Nc1cccc(c1)O 7a_100000230434_100011236192 [0,2,0,0,0,0|2,0,0]=4 19303 B16R1.55 Cc1cc(ccn1)CC(=O)CCCCCO 1458a_100102619762_200020672517 [0,2,0,0,0,0|2,0,0]=4 19304 B16R1.55 Cc1cccc(c1)CC(=O)CCCCC#N 1458a_100011206899_100000211819 [0,2,0,0,0,0|1,0,1]=4 19305 B16R1.55 Cc1cccc(c1)CC(=O)CCCCCF 1458a_100011206899_100000729378 [0,2,0,0,0,0|1,0,0]=3 19306 B16R1.55 Cc1cccc(c1)CC(=O)CCCCCO 1458a_100011206899_100000746330 [0,2,0,0,0,0|1,0,0]=3 19307 B16R1.55 Cc1cccc(c1)CC(=O)CCCCCO 1458a_100102619762_100000211840 [0,2,0,0,0,0|1,0,0]=3 19308 B16R1.55 Cc1cccc(c1)CC(=O)CCOCCO 1458a_100011206899_100011215305 [0,2,0,0,0,0|2,0,0]=4 19309 B16R1.55 Cc1cccc(c1)CC(=O)CCOCCO 1458a_100011229844_100000211840 [0,2,0,0,0,0|2,0,0]=4 19310 B16R1.55 Cc1cccc(c1)CC(=O)NCCCCO 240690a_100000750430_100011206899 [0,2,0,0,0,0|1,0,0]=3 19311 B16R1.55 Cc1cccc(c1)CC(=O)NCCCCO 527a_100000750430_100011206899 [0,2,0,0,0,0|1,0,0]=3 19312 B16R1.55 Cc1cccc(c1)NC(=O)CCCCCO 22a_100000188690_100102619762 [0,2,0,0,0,0|2,0,0]=4 19313 B16R1.55 Cc1cccc(c1)NC(=O)COCCCBr 34a_100011217188_100000182861 [0,2,0,0,0,0|2,0,0]=4 19314 B16R1.55 Cc1cccc(c1)NC(=O)COCCCCl 34a_100000230001_100000182861 [0,2,0,0,0,0|2,0,0]=4 19315 B16R1.55 Cc1cccc(c1)NC(=O)COCCCF 34a_100000749660_100011934791 [0,2,0,0,0,0|2,0,0]=4 19316 B16R1.55 Cc1cccc(c1)NC(=O)COCCCF 34a_100000759539_100000182861 [0,2,0,0,0,0|2,0,0]=4 19317 B16R1.55 Cc1cccc(c1)NC(=O)COCCCN 34a_100000182051_100000182861 [0,2,0,0,0,0|2,0,0]=4 19318 B16R1.55 Cc1cccc(c1)NC(=O)COCCCO 34a_100000749660_100000230001 [0,2,0,0,0,0|2,0,0]=4 19319 B16R1.55 Cc1cccc(c1)NC(=O)NCCCCO 2430a_100000188690_100000750430 [0,2,0,0,0,0|2,0,0]=4 19320 B16R1.55 Cc1cccc(c1)NC(=O)NCCCCO 512a_100000188690_100000750430 [0,2,0,0,0,0|2,0,0]=4 19321 B16R1.55 Cc1cccc(n1)CC(=O)CCCCCF 1458a_100012001110_100000729378 [0,2,0,0,0,0|2,0,0]=4 19322 B16R1.55 Cc1cccc(n1)CC(=O)CCCCCO 1458a_100012001110_100000746330 [0,2,0,0,0,0|2,0,0]=4 19323 B16R1.55 Cc1cccc(n1)CC(=O)CCCCCO 1458a_100102619762_100000757606 [0,2,0,0,0,0|2,0,0]=4 19324 B16R1.55 Cc1cccc(n1)CC(=O)NCCCCO 240690a_100000750430_100012001110 [0,2,0,0,0,0|2,0,0]=4 19325 B16R1.55 Cc1cccc(n1)CC(=O)NCCCCO 527a_100000750430_100012001110 [0,2,0,0,0,0|2,0,0]=4 19326 B16R1.55 Cc1ccnc(c1)CC(=O)CCCCCO 1458a_100102619762_100000718516 [0,2,0,0,0,0|2,0,0]=4 19327 B16R1.55 Cc1cncc(c1)CC(=O)CCCCCO 1458a_100102619762_100000716715 [0,2,0,0,0,0|2,0,0]=4 19328 B16R1.55 N#CCCCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000211819 [0,2,0,0,0,0|1,0,1]=4 19329 B16R1.55 N#CCCCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000211819 [0,2,0,0,0,0|1,0,1]=4 19330 B16R1.55 N#CCCCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000211819 [0,2,0,0,0,0|1,0,1]=4 19331 B16R1.55 N#CCCCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000211819 [0,2,0,0,0,0|1,0,1]=4 19332 B16R1.55 N#CCCCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000211819 [0,2,0,0,0,0|1,0,1]=4 19333 B16R1.55 NCCCOCC(=O)Nc1cccc(c1)Br 34a_100000182051_100000183509 [0,2,0,0,0,0|2,0,0]=4 19334 B16R1.55 NCCCOCC(=O)Nc1cccc(c1)Cl 34a_100000182051_100000182995 [0,2,0,0,0,0|2,0,0]=4 19335 B16R1.55 NCCCOCC(=O)Nc1cccc(c1)F 34a_100000182051_100000183335 [0,2,0,0,0,0|2,0,0]=4 19336 B16R1.55 NCCCOCC(=O)Nc1cccc(c1)O 34a_100000182051_100011236192 [0,2,0,0,0,0|2,0,0]=4 19337 B16R1.55 O=C(CCCCCF)Cc1cccc(c1)Br 1458a_100000747190_100000729378 [0,2,0,0,0,0|1,0,0]=3 19338 B16R1.55 O=C(CCCCCF)Cc1cccc(c1)Cl 1458a_100000749307_100000729378 [0,2,0,0,0,0|1,0,0]=3 19339 B16R1.55 O=C(CCCCCF)Cc1cccc(c1)F 1458a_100000211661_100000729378 [0,2,0,0,0,0|1,0,0]=3 19340 B16R1.55 O=C(CCCCCF)Cc1cccc(c1)I 1458a_100000238430_100000729378 [0,2,0,0,0,0|1,0,0]=3 19341 B16R1.55 O=C(CCCCCF)Cc1cccc(c1)O 1458a_100000745134_100000729378 [0,2,0,0,0,0|1,0,0]=3 19342 B16R1.55 O=C(CCCCCF)Cc1cccc(n1)Br 1458a_100010201708_100000729378 [0,2,0,0,0,0|2,0,0]=4 19343 B16R1.55 O=C(CCCCCF)Cc1cccc(n1)Cl 1458a_100000090259_100000729378 [0,2,0,0,0,0|2,0,0]=4 19344 B16R1.55 O=C(CCCCCF)Cc1cccc(n1)F 1458a_100000096803_100000729378 [0,2,0,0,0,0|2,0,0]=4 19345 B16R1.55 O=C(CCCCCF)Cc1ccnc(c1)Br 1458a_100010126891_100000729378 [0,2,0,0,0,0|2,0,0]=4 19346 B16R1.55 O=C(CCCCCF)Cc1cncc(c1)Br 1458a_100000239331_100000729378 [0,2,0,0,0,0|2,0,0]=4 19347 B16R1.55 O=C(CCCCCF)Cc1cncc(c1)F 1458a_100011667516_100000729378 [0,2,0,0,0,0|2,0,0]=4 19348 B16R1.55 O=C(CCCCCO)Cc1cc(ccn1)Br 1458a_100102619762_100010173614 [0,2,0,0,0,0|2,0,0]=4 19349 B16R1.55 O=C(CCCCCO)Cc1cc(ccn1)Cl 1458a_100102619762_100016988179 [0,2,0,0,0,0|2,0,0]=4 19350 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)Br 1458a_100000747190_100000746330 [0,2,0,0,0,0|1,0,0]=3 19351 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)Br 1458a_100102619762_100000211773 [0,2,0,0,0,0|1,0,0]=3 19352 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)Cl 1458a_100000749307_100000746330 [0,2,0,0,0,0|1,0,0]=3 19353 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)Cl 1458a_100102619762_100000181238 [0,2,0,0,0,0|1,0,0]=3 19354 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)F 1458a_100000211661_100000746330 [0,2,0,0,0,0|1,0,0]=3 19355 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)F 1458a_100102619762_100000230114 [0,2,0,0,0,0|1,0,0]=3 19356 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)I 1458a_100000238430_100000746330 [0,2,0,0,0,0|1,0,0]=3 19357 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)I 1458a_100102619762_100011218688 [0,2,0,0,0,0|1,0,0]=3 19358 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)O 1458a_100000745134_100000746330 [0,2,0,0,0,0|1,0,0]=3 19359 B16R1.55 O=C(CCCCCO)Cc1cccc(c1)O 1458a_100102619762_100011660834 [0,2,0,0,0,0|1,0,0]=3 19360 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)Br 1458a_100010201708_100000746330 [0,2,0,0,0,0|2,0,0]=4 19361 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)Br 1458a_100102619762_100009889011 [0,2,0,0,0,0|2,0,0]=4 19362 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)Cl 1458a_100000090259_100000746330 [0,2,0,0,0,0|2,0,0]=4 19363 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)Cl 1458a_100102619762_100000086093 [0,2,0,0,0,0|2,0,0]=4 19364 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)F 1458a_100000096803_100000746330 [0,2,0,0,0,0|2,0,0]=4 19365 B16R1.55 O=C(CCCCCO)Cc1cccc(n1)F 1458a_100102619762_100009819644 [0,2,0,0,0,0|2,0,0]=4 19366 B16R1.55 O=C(CCCCCO)Cc1ccnc(c1)Br 1458a_100010126891_100000746330 [0,2,0,0,0,0|2,0,0]=4 19367 B16R1.55 O=C(CCCCCO)Cc1ccnc(c1)Br 1458a_100102619762_100010243470 [0,2,0,0,0,0|2,0,0]=4 19368 B16R1.55 O=C(CCCCCO)Cc1ccnc(c1)Cl 1458a_100102619762_100000764220 [0,2,0,0,0,0|2,0,0]=4 19369 B16R1.55 O=C(CCCCCO)Cc1cncc(c1)Br 1458a_100000239331_100000746330 [0,2,0,0,0,0|2,0,0]=4 19370 B16R1.55 O=C(CCCCCO)Cc1cncc(c1)Br 1458a_100102619762_100011740620 [0,2,0,0,0,0|2,0,0]=4 19371 B16R1.55 O=C(CCCCCO)Cc1cncc(c1)Cl 1458a_100102619762_100016992070 [0,2,0,0,0,0|2,0,0]=4 19372 B16R1.55 O=C(CCCCCO)Cc1cncc(c1)F 1458a_100011667516_100000746330 [0,2,0,0,0,0|2,0,0]=4 19373 B16R1.55 O=C(CCCCCO)Cc1cncc(c1)F 1458a_100102619762_100000725299 [0,2,0,0,0,0|2,0,0]=4 19374 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)Br 22a_100000210019_100102619762 [0,2,0,0,0,0|2,0,0]=4 19375 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)Cl 22a_100000185859_100102619762 [0,2,0,0,0,0|2,0,0]=4 19376 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)F 22a_100000210047_100102619762 [0,2,0,0,0,0|2,0,0]=4 19377 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)I 22a_100000211102_100102619762 [0,2,0,0,0,0|2,0,0]=4 19378 B16R1.55 O=C(CCCCCO)Nc1cccc(c1)O 22a_100000210217_100102619762 [0,2,0,0,0,0|2,0,0]=4 19379 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)Br 1458a_100000747190_100011215305 [0,2,0,0,0,0|2,0,0]=4 19380 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)Br 1458a_100011229844_100000211773 [0,2,0,0,0,0|2,0,0]=4 19381 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)Cl 1458a_100000749307_100011215305 [0,2,0,0,0,0|2,0,0]=4 19382 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)Cl 1458a_100011229844_100000181238 [0,2,0,0,0,0|2,0,0]=4 19383 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)F 1458a_100000211661_100011215305 [0,2,0,0,0,0|2,0,0]=4 19384 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)F 1458a_100011229844_100000230114 [0,2,0,0,0,0|2,0,0]=4 19385 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)I 1458a_100000238430_100011215305 [0,2,0,0,0,0|2,0,0]=4 19386 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)I 1458a_100011229844_100011218688 [0,2,0,0,0,0|2,0,0]=4 19387 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)O 1458a_100000745134_100011215305 [0,2,0,0,0,0|2,0,0]=4 19388 B16R1.55 O=C(CCOCCO)Cc1cccc(c1)O 1458a_100011229844_100011660834 [0,2,0,0,0,0|2,0,0]=4 19389 B16R1.55 O=C(COCCCBr)Nc1cccc(c1)Br 34a_100011217188_100000183509 [0,2,0,0,0,0|2,0,0]=4 19390 B16R1.55 O=C(COCCCBr)Nc1cccc(c1)Cl 34a_100011217188_100000182995 [0,2,0,0,0,0|2,0,0]=4 19391 B16R1.55 O=C(COCCCBr)Nc1cccc(c1)F 34a_100011217188_100000183335 [0,2,0,0,0,0|2,0,0]=4 19392 B16R1.55 O=C(COCCCBr)Nc1cccc(c1)O 34a_100011217188_100011236192 [0,2,0,0,0,0|2,0,0]=4 19393 B16R1.55 O=C(COCCCCl)Nc1cccc(c1)Br 34a_100000230001_100000183509 [0,2,0,0,0,0|2,0,0]=4 19394 B16R1.55 O=C(COCCCCl)Nc1cccc(c1)Cl 34a_100000230001_100000182995 [0,2,0,0,0,0|2,0,0]=4 19395 B16R1.55 O=C(COCCCCl)Nc1cccc(c1)F 34a_100000230001_100000183335 [0,2,0,0,0,0|2,0,0]=4 19396 B16R1.55 O=C(COCCCCl)Nc1cccc(c1)O 34a_100000230001_100011236192 [0,2,0,0,0,0|2,0,0]=4 19397 B16R1.55 O=C(COCCCF)Nc1cccc(c1)Br 34a_100000759539_100000183509 [0,2,0,0,0,0|2,0,0]=4 19398 B16R1.55 O=C(COCCCF)Nc1cccc(c1)Cl 34a_100000759539_100000182995 [0,2,0,0,0,0|2,0,0]=4 19399 B16R1.55 O=C(COCCCF)Nc1cccc(c1)F 34a_100000759539_100000183335 [0,2,0,0,0,0|2,0,0]=4 19400 B16R1.55 O=C(COCCCF)Nc1cccc(c1)O 34a_100000759539_100011236192 [0,2,0,0,0,0|2,0,0]=4 19401 B16R1.55 O=C(Cc1cccc(c1)Br)NCCCCO 240690a_100000750430_100000747190 [0,2,0,0,0,0|1,0,0]=3 19402 B16R1.55 O=C(Cc1cccc(c1)Br)NCCCCO 527a_100000750430_100000747190 [0,2,0,0,0,0|1,0,0]=3 19403 B16R1.55 O=C(Cc1cccc(c1)Cl)NCCCCO 240690a_100000750430_100000749307 [0,2,0,0,0,0|1,0,0]=3 19404 B16R1.55 O=C(Cc1cccc(c1)Cl)NCCCCO 527a_100000750430_100000749307 [0,2,0,0,0,0|1,0,0]=3 19405 B16R1.55 O=C(Cc1cccc(c1)F)NCCCCO 240690a_100000750430_100000211661 [0,2,0,0,0,0|1,0,0]=3 19406 B16R1.55 O=C(Cc1cccc(c1)F)NCCCCO 527a_100000750430_100000211661 [0,2,0,0,0,0|1,0,0]=3 19407 B16R1.55 O=C(Cc1cccc(c1)F)NCCNCF 34a_106430523477_100015361967 [0,2,0,0,0,0|2,0,0]=4 19408 B16R1.55 O=C(Cc1cccc(c1)I)NCCCCO 240690a_100000750430_100000238430 [0,2,0,0,0,0|1,0,0]=3 19409 B16R1.55 O=C(Cc1cccc(c1)I)NCCCCO 527a_100000750430_100000238430 [0,2,0,0,0,0|1,0,0]=3 19410 B16R1.55 O=C(Cc1cccc(c1)O)NCCCCO 240690a_100000750430_100000745134 [0,2,0,0,0,0|1,0,0]=3 19411 B16R1.55 O=C(Cc1cccc(c1)O)NCCCCO 527a_100000750430_100000745134 [0,2,0,0,0,0|1,0,0]=3 19412 B16R1.55 O=C(Cc1cccc(n1)Br)NCCCCO 240690a_100000750430_100010201708 [0,2,0,0,0,0|2,0,0]=4 19413 B16R1.55 O=C(Cc1cccc(n1)Br)NCCCCO 527a_100000750430_100010201708 [0,2,0,0,0,0|2,0,0]=4 19414 B16R1.55 O=C(Cc1cccc(n1)Cl)NCCCCO 240690a_100000750430_100000090259 [0,2,0,0,0,0|2,0,0]=4 19415 B16R1.55 O=C(Cc1cccc(n1)F)NCCCCO 240690a_100000750430_100000096803 [0,2,0,0,0,0|2,0,0]=4 19416 B16R1.55 O=C(Cc1ccnc(c1)Br)NCCCCO 240690a_100000750430_100010126891 [0,2,0,0,0,0|2,0,0]=4 19417 B16R1.55 O=C(Cc1ccnc(c1)Br)NCCCCO 527a_100000750430_100010126891 [0,2,0,0,0,0|2,0,0]=4 19418 B16R1.55 O=C(Cc1ccnc(c1)Cl)NCCCCO 240690a_100000750430_100000085289 [0,2,0,0,0,0|2,0,0]=4 19419 B16R1.55 O=C(Cc1ccnc(c1)Cl)NCCCCO 527a_100000750430_100000085289 [0,2,0,0,0,0|2,0,0]=4 19420 B16R1.55 O=C(Cc1cncc(c1)Br)NCCCCO 240690a_100000750430_100000239331 [0,2,0,0,0,0|2,0,0]=4 19421 B16R1.55 O=C(Cc1cncc(c1)Br)NCCCCO 527a_100000750430_100000239331 [0,2,0,0,0,0|2,0,0]=4 19422 B16R1.55 O=C(Cc1cncc(c1)F)NCCCCO 240690a_100000750430_100011667516 [0,2,0,0,0,0|2,0,0]=4 19423 B16R1.55 O=C(Cc1cncc(c1)F)NCCCCO 527a_100000750430_100011667516 [0,2,0,0,0,0|2,0,0]=4 19424 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Br 2430a_100000210019_100000750430 [0,2,0,0,0,0|2,0,0]=4 19425 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Br 512a_100000210019_100000750430 [0,2,0,0,0,0|2,0,0]=4 19426 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)Cl 2430a_100000185859_100000750430 [0,2,0,0,0,0|2,0,0]=4 19427 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)F 2430a_100000210047_100000750430 [0,2,0,0,0,0|2,0,0]=4 19428 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)F 512a_100000210047_100000750430 [0,2,0,0,0,0|2,0,0]=4 19429 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)I 2430a_100000211102_100000750430 [0,2,0,0,0,0|2,0,0]=4 19430 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)I 512a_100000211102_100000750430 [0,2,0,0,0,0|2,0,0]=4 19431 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)O 2430a_100000210217_100000750430 [0,2,0,0,0,0|2,0,0]=4 19432 B16R1.55 O=C(NCCCCO)Nc1cccc(c1)O 512a_100000210217_100000750430 [0,2,0,0,0,0|2,0,0]=4 19433 B16R1.55 O=C(Nc1cccc(c1)Br)OCCSCF 62a_100015361967_100015757870 [0,2,0,0,0,0|2,0,0]=4 19434 B16R1.610 C/C(=C\c1ccccc1)/COCCC(C)C 34a_200025717232_100000210312 [0,2,0,0,0,0|1,0,1]=4 19435 B16R1.610 C/C(=C\c1ccccc1)/COCCC(C)C 7a_200025717232_100000210626 [0,2,0,0,0,0|1,0,1]=4 19436 B16R1.610 C/C(=C\c1ccccc1)/COCCC(C)O 34a_200025717232_100012276601 [0,2,0,0,0,0|1,0,1]=4 19437 B16R1.610 C/C(=C\c1ccccc1)/COCCC(C)O 7a_200025717232_100012276601 [0,2,0,0,0,0|1,0,1]=4 19438 B16R1.610 C=C(C)CCOCC(=O)Nc1ccccc1 34a_100000246334_100000730704 [0,2,0,0,0,0|1,0,1]=4 19439 B16R1.610 C=C(C)CCOCC(=O)Nc1ccccc1 34a_100000764851_100000182850 [0,2,0,0,0,0|1,0,1]=4 19440 B16R1.610 C=C(C)CCOCC(=O)Oc1ccccc1 34a_100000764851_100009813826 [0,2,0,0,0,0|1,0,1]=4 19441 B16R1.610 C=C(C)CCSCC(=O)Cc1ccccc1 62a_100000233483_100000730704 [0,2,0,0,0,0|0,1,1]=4 19442 B16R1.610 C=C(C)CCSCC(=O)Cc1ccccc1 62a_100000730704_100000233483 [0,2,0,0,0,0|0,1,1]=4 19443 B16R1.610 CC(=O)CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000735457 [0,2,0,0,0,0|2,0,0]=4 19444 B16R1.610 CC(=O)CCCCC(=O)Cc1ccccn1 1458a_100000233486_100000735457 [0,2,0,0,0,0|2,0,0]=4 19445 B16R1.610 CC(=O)CCCCC(=O)Cc1cccnc1 1458a_100000737805_100000735457 [0,2,0,0,0,0|2,0,0]=4 19446 B16R1.610 CC(=O)CCCOC(C)Cc1ccccc1 34a_100000748627_100000685027 [0,2,0,0,0,0|1,0,1]=4 19447 B16R1.610 CC(=O)CCCOC(C)Cc1ccccc1 34a_100000759063_200011218536 [0,2,0,0,0,0|1,0,1]=4 19448 B16R1.610 CC(=O)CCCOC(C)Cc1ccccc1 7a_100000748627_100011215641 [0,2,0,0,0,0|1,0,1]=4 19449 B16R1.610 CC(=O)CCCOC(C)Cc1ccccc1 7a_100000759063_200011218536 [0,2,0,0,0,0|1,0,1]=4 19450 B16R1.610 CC(=O)CCOCC(=O)Cc1ccccc1 7a_100000759926_100000233483 [0,2,0,0,0,0|0,0,1]=3 19451 B16R1.610 CC(=O)CCOCC(=O)Nc1ccccc1 34a_100000759926_100000182850 [0,2,0,0,0,0|1,0,1]=4 19452 B16R1.610 CC(=O)CCOCC(=O)Nc1ccccc1 7a_100000759926_100000182850 [0,2,0,0,0,0|1,0,1]=4 19453 B16R1.610 CC(=O)CCOCC(=O)Oc1ccccc1 34a_100000759926_100009813826 [0,2,0,0,0,0|1,0,1]=4 19454 B16R1.610 CC(=O)CCOCC(=O)Oc1ccccc1 7a_100000759926_100009813826 [0,2,0,0,0,0|1,0,1]=4 19455 B16R1.610 CC(=O)CCSCC(=O)Cc1ccccc1 62a_100000053229_100000233483 [0,2,0,0,0,0|0,1,1]=4 19456 B16R1.610 CC(=O)CCSCC(=O)Cc1ccccc1 62a_100000233483_100000053229 [0,2,0,0,0,0|0,1,1]=4 19457 B16R1.610 CC(=O)NCCCC(=O)Cc1ccccc1 1458a_100000194741_100015291786 [0,2,0,0,0,0|1,0,1]=4 19458 B16R1.610 CC(Br)CCOCC(=O)Nc1ccccc1 34a_100009893172_100000182850 [0,2,0,0,0,0|1,0,0]=3 19459 B16R1.610 CC(Br)CCOCC(=O)Oc1ccccc1 34a_100009893172_100009813826 [0,2,0,0,0,0|1,0,0]=3 19460 B16R1.610 CC(Br)CCOC[C@@H](O)Cc1ccccc1 34a_100009893172_100000729385 [0,2,0,0,0,0|0,0,2]=4 19461 B16R1.610 CC(Br)COCCC(=O)Nc1ccccc1 34a_100012180447_100000242058 [0,2,0,0,0,0|2,0,0]=4 19462 B16R1.610 CC(C)CC=NNC(=O)Cc1ccccc1 4a_100000182964_100000185833 [0,2,0,0,0,0|1,0,1]=4 19463 B16R1.610 CC(C)CCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011216152 [0,2,0,0,0,0|2,0,0]=4 19464 B16R1.610 CC(C)CCCCC(=O)Cc1ccccc1 1458a_100011933920_100015291786 [0,2,0,0,0,0|1,0,0]=3 19465 B16R1.610 CC(C)CCCCC(=O)Cc1ccccn1 1458a_100000233486_100011216152 [0,2,0,0,0,0|2,0,0]=4 19466 B16R1.610 CC(C)CCCCC(=O)Cc1ccccn1 1458a_100011933920_100000721315 [0,2,0,0,0,0|2,0,0]=4 19467 B16R1.610 CC(C)CCCCC(=O)Cc1cccnc1 1458a_100000737805_100011216152 [0,2,0,0,0,0|2,0,0]=4 19468 B16R1.610 CC(C)CCCCC(=O)Cc1cccnc1 1458a_100011933920_100000733263 [0,2,0,0,0,0|2,0,0]=4 19469 B16R1.610 CC(C)CCCCC(=O)Cc1ccncc1 1458a_100011933920_100000705612 [0,2,0,0,0,0|2,0,0]=4 19470 B16R1.610 CC(C)CCCCC(=O)Nc1ccccc1 11a_100000106764_100011933920 [0,2,0,0,0,0|2,0,0]=4 19471 B16R1.610 CC(C)CCCCC(=O)Nc1ccccc1 1626a_100000106764_100011933920 [0,2,0,0,0,0|2,0,0]=4 19472 B16R1.610 CC(C)CCCCC(=O)Nc1ccccc1 22a_100000106764_100011933920 [0,2,0,0,0,0|2,0,0]=4 19473 B16R1.610 CC(C)CCCCC(=O)Nc1ccccc1 527a_100000106764_100011933920 [0,2,0,0,0,0|2,0,0]=4 19474 B16R1.610 CC(C)CCCNC(=O)C[n+]1ccccc1 11a_200000737386_200000086051 [0,2,0,0,0,0|2,0,0]=4 19475 B16R1.610 CC(C)CCCNC(=O)C[n+]1ccccc1 240690a_200000737386_200000086051 [0,2,0,0,0,0|2,0,0]=4 19476 B16R1.610 CC(C)CCCNC(=O)C[n+]1ccccc1 527a_200000737386_200000086051 [0,2,0,0,0,0|2,0,0]=4 19477 B16R1.610 CC(C)CCCNC(=O)Cc1ccccn1 11a_200000737386_100000233486 [0,2,0,0,0,0|2,0,0]=4 19478 B16R1.610 CC(C)CCCNC(=O)Cc1cccnc1 11a_200000737386_100000737805 [0,2,0,0,0,0|2,0,0]=4 19479 B16R1.610 CC(C)CCCNC(=O)Cc1cccnc1 240690a_200000737386_100000737805 [0,2,0,0,0,0|2,0,0]=4 19480 B16R1.610 CC(C)CCCNC(=O)Cc1cccnc1 527a_200000737386_100000737805 [0,2,0,0,0,0|2,0,0]=4 19481 B16R1.610 CC(C)CCCNC(=O)Cc1ccncc1 11a_200000737386_100011201483 [0,2,0,0,0,0|2,0,0]=4 19482 B16R1.610 CC(C)CCCNC(=O)Cc1ccncc1 240690a_200000737386_100011201483 [0,2,0,0,0,0|2,0,0]=4 19483 B16R1.610 CC(C)CCCNC(=O)Nc1ccccc1 2430a_100000106764_200000737386 [0,2,0,0,0,0|2,0,0]=4 19484 B16R1.610 CC(C)CCCOC(C)Cc1ccccc1 34a_100000210774_200011218536 [0,2,0,0,0,0|1,0,1]=4 19485 B16R1.610 CC(C)CCCOC(C)Cc1ccccc1 34a_100000748627_100011214892 [0,2,0,0,0,0|1,0,1]=4 19486 B16R1.610 CC(C)CCCOC(C)Cc1ccccc1 7a_100000210774_200011218536 [0,2,0,0,0,0|1,0,1]=4 19487 B16R1.610 CC(C)CCCOC(C)Cc1ccccc1 7a_100000748627_100011214892 [0,2,0,0,0,0|1,0,1]=4 19488 B16R1.610 CC(C)CCOCC(=O)Cc1ccccc1 7a_100000210254_100000233483 [0,2,0,0,0,0|0,0,0]=2 19489 B16R1.610 CC(C)CCOCC(=O)Nc1ccccc1 34a_100000210254_100000182850 [0,2,0,0,0,0|1,0,0]=3 19490 B16R1.610 CC(C)CCOCC(=O)Nc1ccccc1 34a_100000246334_100000210312 [0,2,0,0,0,0|1,0,0]=3 19491 B16R1.610 CC(C)CCOCC(=O)Nc1ccccc1 7a_100000210254_100000182850 [0,2,0,0,0,0|1,0,0]=3 19492 B16R1.610 CC(C)CCOCC(=O)Nc1ccccn1 7a_100000210254_100020662008 [0,2,0,0,0,0|2,0,0]=4 19493 B16R1.610 CC(C)CCOCC(=O)Nc1ccncc1 7a_100000210254_100000754145 [0,2,0,0,0,0|2,0,0]=4 19494 B16R1.610 CC(C)CCOCC(=O)Oc1ccccc1 34a_100000210254_100009813826 [0,2,0,0,0,0|1,0,0]=3 19495 B16R1.610 CC(C)CCOCC(=O)Oc1ccccc1 7a_100000210254_100009813826 [0,2,0,0,0,0|1,0,0]=3 19496 B16R1.610 CC(C)CCOCC(C)Cc1ccccc1 34a_100012125295_100000210312 [0,2,0,0,0,0|1,0,1]=4 19497 B16R1.610 CC(C)CCOCC(C)Cc1ccccc1 7a_100012125295_100000210626 [0,2,0,0,0,0|1,0,1]=4 19498 B16R1.610 CC(C)CCOCC(N)Cc1ccccc1 34a_100000739027_100000210312 [0,2,0,0,0,0|1,0,1]=4 19499 B16R1.610 CC(C)CCOC[C@@H](O)Cc1ccccc1 34a_100000210254_100000729385 [0,2,0,0,0,0|0,0,2]=4 19500 B16R1.610 CC(C)CCOC[C@@H](O)Cc1ccccc1 7a_100000210254_100000729385 [0,2,0,0,0,0|0,0,2]=4 19501 B16R1.610 CC(C)CCSCC(=O)Cc1ccccc1 62a_100000210312_100000233483 [0,2,0,0,0,0|0,1,0]=3 19502 B16R1.610 CC(C)CCSCC(=O)Cc1ccccc1 62a_100000233483_100000210312 [0,2,0,0,0,0|0,1,0]=3 19503 B16R1.610 CC(C)CCSCC(=O)Nc1ccccc1 62a_100000210312_100000182850 [0,2,0,0,0,0|1,1,0]=4 19504 B16R1.610 CC(C)CCSCC(=O)Nc1ccccc1 62a_100012148978_100000210312 [0,2,0,0,0,0|1,1,0]=4 19505 B16R1.610 CC(C)CCSCC(=O)Oc1ccccc1 62a_100000210312_100009813826 [0,2,0,0,0,0|1,1,0]=4 19506 B16R1.610 CC(C)CCSCC(=O)Oc1ccccc1 62a_100009813826_100000210312 [0,2,0,0,0,0|1,1,0]=4 19507 B16R1.610 CC(C)CNCCC(=O)Nc1ccccc1 2230a_100000210953_100000242058 [0,2,0,0,0,0|2,0,0]=4 19508 B16R1.610 CC(C)CNCCC(=O)Nc1ccccc1 34a_100000210953_100000242058 [0,2,0,0,0,0|2,0,0]=4 19509 B16R1.610 CC(C)CNCCC(=O)Oc1ccccc1 2230a_100000210953_200000035796 [0,2,0,0,0,0|2,0,0]=4 19510 B16R1.610 CC(C)COCCC(=O)Nc1ccccc1 34a_100000210257_100000242058 [0,2,0,0,0,0|2,0,0]=4 19511 B16R1.610 CC(C)CSCCC(=O)Nc1ccccc1 62a_100000210624_100000242058 [0,2,0,0,0,0|2,0,0]=4 19512 B16R1.610 CC(C)CSCCC(=O)Oc1ccccc1 62a_100000210624_200000035796 [0,2,0,0,0,0|2,0,0]=4 19513 B16R1.610 CC(C)NCCCC(=O)Nc1ccccc1 2230a_100138425928_100011194425 [0,2,0,0,0,0|2,0,0]=4 19514 B16R1.610 CC(C)NCCCC(=O)Nc1ccccc1 34a_100000750157_100000210206 [0,2,0,0,0,0|2,0,0]=4 19515 B16R1.610 CC(C)NCCCC(=O)Nc1ccccc1 34a_100138425928_100011194425 [0,2,0,0,0,0|2,0,0]=4 19516 B16R1.610 CC(C)NCCOC(C)Cc1ccccc1 34a_100000224655_200011218536 [0,2,0,0,0,0|1,0,1]=4 19517 B16R1.610 CC(C)OCCCC(=O)Nc1ccccc1 34a_100000212225_100011194425 [0,2,0,0,0,0|2,0,0]=4 19518 B16R1.610 CC(C)OCCNC(=O)C[n+]1ccccc1 11a_100000701111_200000086051 [0,2,0,0,0,0|2,0,0]=4 19519 B16R1.610 CC(C)OCCNC(=O)C[n+]1ccccc1 240690a_100000701111_200000086051 [0,2,0,0,0,0|2,0,0]=4 19520 B16R1.610 CC(C)OCCNC(=O)C[n+]1ccccc1 527a_100000701111_200000086051 [0,2,0,0,0,0|2,0,0]=4 19521 B16R1.610 CC(C)OCCNC(=O)Cc1ccccn1 11a_100000701111_100000233486 [0,2,0,0,0,0|2,0,0]=4 19522 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 11a_100000701111_100000737805 [0,2,0,0,0,0|2,0,0]=4 19523 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 240690a_100000701111_100000737805 [0,2,0,0,0,0|2,0,0]=4 19524 B16R1.610 CC(C)OCCNC(=O)Cc1cccnc1 527a_100000701111_100000737805 [0,2,0,0,0,0|2,0,0]=4 19525 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 11a_100000701111_100011201483 [0,2,0,0,0,0|2,0,0]=4 19526 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 240690a_100000701111_100011201483 [0,2,0,0,0,0|2,0,0]=4 19527 B16R1.610 CC(C)OCCNC(=O)Nc1ccccc1 2430a_100000106764_100000701111 [0,2,0,0,0,0|2,0,0]=4 19528 B16R1.610 CC(C)OCCOC(C)Cc1ccccc1 34a_100000211219_200011218536 [0,2,0,0,0,0|1,0,1]=4 19529 B16R1.610 CC(C)OCCOC(C)Cc1ccccc1 34a_100000748627_100000211751 [0,2,0,0,0,0|1,0,1]=4 19530 B16R1.610 CC(C)OCCOC(C)Cc1ccccc1 7a_100000211219_200011218536 [0,2,0,0,0,0|1,0,1]=4 19531 B16R1.610 CC(C)OCCOC(C)Cc1ccccc1 7a_100000748627_100000211751 [0,2,0,0,0,0|1,0,1]=4 19532 B16R1.610 CC(C)OCOCC(=O)Nc1ccccc1 34a_100000246334_100000709892 [0,2,0,0,0,0|2,0,0]=4 19533 B16R1.610 CC(C)OCSCC(=O)Cc1ccccc1 62a_100000233483_100000709892 [0,2,0,0,0,0|1,1,0]=4 19534 B16R1.610 CC(C)OCSCC(=O)Cc1ccccc1 62a_100000709892_100000233483 [0,2,0,0,0,0|1,1,0]=4 19535 B16R1.610 CC(C)SCCCC(=O)Nc1ccccc1 62a_100000210206_100011194425 [0,2,0,0,0,0|2,0,0]=4 19536 B16R1.610 CC(C)SCCNC(=O)C[n+]1ccccc1 11a_100000731138_200000086051 [0,2,0,0,0,0|2,0,0]=4 19537 B16R1.610 CC(C)SCCNC(=O)C[n+]1ccccc1 240690a_100000731138_200000086051 [0,2,0,0,0,0|2,0,0]=4 19538 B16R1.610 CC(C)SCCNC(=O)C[n+]1ccccc1 527a_100000731138_200000086051 [0,2,0,0,0,0|2,0,0]=4 19539 B16R1.610 CC(C)SCCNC(=O)Cc1ccccn1 11a_100000731138_100000233486 [0,2,0,0,0,0|2,0,0]=4 19540 B16R1.610 CC(C)SCCNC(=O)Cc1cccnc1 11a_100000731138_100000737805 [0,2,0,0,0,0|2,0,0]=4 19541 B16R1.610 CC(C)SCCNC(=O)Cc1cccnc1 240690a_100000731138_100000737805 [0,2,0,0,0,0|2,0,0]=4 19542 B16R1.610 CC(C)SCCNC(=O)Cc1cccnc1 527a_100000731138_100000737805 [0,2,0,0,0,0|2,0,0]=4 19543 B16R1.610 CC(C)SCCNC(=O)Cc1ccncc1 11a_100000731138_100011201483 [0,2,0,0,0,0|2,0,0]=4 19544 B16R1.610 CC(C)SCCNC(=O)Cc1ccncc1 240690a_100000731138_100011201483 [0,2,0,0,0,0|2,0,0]=4 19545 B16R1.610 CC(C)SCCNC(=O)Nc1ccccc1 2430a_100000106764_100000731138 [0,2,0,0,0,0|2,0,0]=4 19546 B16R1.610 CC(Cc1ccccc1)OCCCN(C)C 7a_100000748627_100000757444 [0,2,0,0,0,0|1,0,1]=4 19547 B16R1.610 CC(Cc1ccccc1)OCCSC(C)C 34a_100000748627_100000730970 [0,2,0,0,0,0|1,0,1]=4 19548 B16R1.610 CC(Cc1ccccc1)OCCSC(C)C 34a_200011212901_200011218536 [0,2,0,0,0,0|1,0,1]=4 19549 B16R1.610 CC(Cc1ccccc1)OCCSC(C)C 7a_100000748627_100000730970 [0,2,0,0,0,0|1,0,1]=4 19550 B16R1.610 CC(Cc1ccccc1)OCCSC(C)C 7a_200011212901_200011218536 [0,2,0,0,0,0|1,0,1]=4 19551 B16R1.610 CC(F)COCCC(=O)Nc1ccccc1 34a_100015925927_100000242058 [0,2,0,0,0,0|2,0,0]=4 19552 B16R1.610 CC(O)CCCOC(C)Cc1ccccc1 34a_100000748627_200000718107 [0,2,0,0,0,0|1,0,1]=4 19553 B16R1.610 CC(O)CCCOC(C)Cc1ccccc1 7a_100000748627_200000718107 [0,2,0,0,0,0|1,0,1]=4 19554 B16R1.610 CC(O)CCNCC(=O)Cc1ccccc1 2230a_200000755665_100000233483 [0,2,0,0,0,0|1,0,0]=3 19555 B16R1.610 CC(O)CCNCC(=O)Nc1ccccc1 2230a_200000755665_100000182850 [0,2,0,0,0,0|2,0,0]=4 19556 B16R1.610 CC(O)CCNCC(=O)Oc1ccccc1 2230a_200000755665_100009813826 [0,2,0,0,0,0|2,0,0]=4 19557 B16R1.610 CC(O)CCOCC(=O)Nc1ccccc1 34a_100000246334_100012276601 [0,2,0,0,0,0|1,0,0]=3 19558 B16R1.610 CC(O)CCOCC(C)Cc1ccccc1 34a_100012125295_100012276601 [0,2,0,0,0,0|1,0,1]=4 19559 B16R1.610 CC(O)CCOCC(C)Cc1ccccc1 7a_100012125295_100012276601 [0,2,0,0,0,0|1,0,1]=4 19560 B16R1.610 CC(O)CCOCC(N)Cc1ccccc1 34a_100000739027_100012276601 [0,2,0,0,0,0|1,0,1]=4 19561 B16R1.610 CC(O)CCSCC(=O)Cc1ccccc1 62a_100000233483_100012276601 [0,2,0,0,0,0|0,1,0]=3 19562 B16R1.610 CC(O)CCSCC(=O)Cc1ccccc1 62a_100012276601_100000233483 [0,2,0,0,0,0|0,1,0]=3 19563 B16R1.610 CC(O)CCSCC(=O)Nc1ccccc1 62a_100012148978_100012276601 [0,2,0,0,0,0|1,1,0]=4 19564 B16R1.610 CC(O)CCSCC(=O)Nc1ccccc1 62a_100012276601_100000182850 [0,2,0,0,0,0|1,1,0]=4 19565 B16R1.610 CC(O)CCSCC(=O)Oc1ccccc1 62a_100009813826_100012276601 [0,2,0,0,0,0|1,1,0]=4 19566 B16R1.610 CC(O)CCSCC(=O)Oc1ccccc1 62a_100012276601_100009813826 [0,2,0,0,0,0|1,1,0]=4 19567 B16R1.610 CC(O)CNCCC(=O)Nc1ccccc1 2230a_100000210904_100000242058 [0,2,0,0,0,0|2,0,0]=4 19568 B16R1.610 CC(O)CNCCC(=O)Nc1ccccc1 34a_100000210904_100000242058 [0,2,0,0,0,0|2,0,0]=4 19569 B16R1.610 CC(O)CNCCC(=O)Oc1ccccc1 2230a_100000210904_200000035796 [0,2,0,0,0,0|2,0,0]=4 19570 B16R1.610 CC(O)CSCCC(=O)Nc1ccccc1 62a_100011218427_100000242058 [0,2,0,0,0,0|2,0,0]=4 19571 B16R1.610 CC(O)CSCCC(=O)Oc1ccccc1 62a_100011218427_200000035796 [0,2,0,0,0,0|2,0,0]=4 19572 B16R1.610 CN(C)CCCCC(=O)Nc1ccccc1 11a_100000106764_100000751710 [0,2,0,0,0,0|2,0,0]=4 19573 B16R1.610 CN(C)CCCCC(=O)Nc1ccccc1 22a_100000106764_100000751710 [0,2,0,0,0,0|2,0,0]=4 19574 B16R1.610 CN(C)CCCCC(=O)Nc1ccccc1 527a_100000106764_100000751710 [0,2,0,0,0,0|2,0,0]=4 19575 B16R1.610 CN(C)CCCNC(=O)C[n+]1ccccc1 240690a_102531767803_200000086051 [0,2,0,0,0,0|2,0,0]=4 19576 B16R1.610 CN(C)CCCNC(=O)C[n+]1ccccc1 527a_102531767803_200000086051 [0,2,0,0,0,0|2,0,0]=4 19577 B16R1.610 CN(C)CCCNC(=O)Cc1cccnc1 240690a_102531767803_100000737805 [0,2,0,0,0,0|2,0,0]=4 19578 B16R1.610 CN(C)CCCNC(=O)Cc1cccnc1 527a_102531767803_100000737805 [0,2,0,0,0,0|2,0,0]=4 19579 B16R1.610 CN(C)CCCNC(=O)Cc1ccncc1 240690a_102531767803_100011201483 [0,2,0,0,0,0|2,0,0]=4 19580 B16R1.610 CN(C)CCSCC(=O)Cc1ccccc1 62a_100000233483_100000755713 [0,2,0,0,0,0|1,1,0]=4 19581 B16R1.610 CS(=O)CCCNC(=O)C[n+]1ccccc1 11a_200000753449_200000086051 [0,2,0,0,0,0|2,0,0]=4 19582 B16R1.610 CS(=O)CCCNC(=O)C[n+]1ccccc1 240690a_200000753449_200000086051 [0,2,0,0,0,0|2,0,0]=4 19583 B16R1.610 CS(=O)CCCNC(=O)C[n+]1ccccc1 527a_200000753449_200000086051 [0,2,0,0,0,0|2,0,0]=4 19584 B16R1.610 CS(=O)CCCNC(=O)Cc1ccccn1 11a_200000753449_100000233486 [0,2,0,0,0,0|2,0,0]=4 19585 B16R1.610 CS(=O)CCCNC(=O)Cc1cccnc1 11a_200000753449_100000737805 [0,2,0,0,0,0|2,0,0]=4 19586 B16R1.610 CS(=O)CCCNC(=O)Cc1cccnc1 240690a_200000753449_100000737805 [0,2,0,0,0,0|2,0,0]=4 19587 B16R1.610 CS(=O)CCCNC(=O)Cc1cccnc1 527a_200000753449_100000737805 [0,2,0,0,0,0|2,0,0]=4 19588 B16R1.610 CS(=O)CCCNC(=O)Cc1ccncc1 11a_200000753449_100011201483 [0,2,0,0,0,0|2,0,0]=4 19589 B16R1.610 CS(=O)CCCNC(=O)Cc1ccncc1 240690a_200000753449_100011201483 [0,2,0,0,0,0|2,0,0]=4 19590 B16R1.610 CS(=O)CCCNC(=O)Nc1ccccc1 2430a_100000106764_200000753449 [0,2,0,0,0,0|2,0,0]=4 19591 B16R1.610 C[C@@H](Cl)COCCC(=O)Nc1ccccc1 34a_100016084084_100000242058 [0,2,0,0,0,0|2,0,0]=4 19592 B16R1.610 C[C@@H](N)CCOCC(=O)Nc1ccccc1 34a_100000706166_100000182850 [0,2,0,0,0,0|1,0,0]=3 19593 B16R1.610 C[C@@H](N)CCOCC(=O)Oc1ccccc1 34a_100000706166_100009813826 [0,2,0,0,0,0|1,0,0]=3 19594 B16R1.610 C[C@@H](N)CCOC[C@@H](O)Cc1ccccc1 34a_100000706166_100000729385 [0,2,0,0,0,0|0,0,2]=4 19595 B16R1.610 C[C@@H](N)COCCC(=O)Nc1ccccc1 34a_100000737577_100000242058 [0,2,0,0,0,0|2,0,0]=4 19596 B16R1.610 C[C@@H](O)CSCCC(=O)Nc1ccccc1 62a_100009817552_100000242058 [0,2,0,0,0,0|2,0,0]=4 19597 B16R1.610 C[C@@H](O)CSCCC(=O)Oc1ccccc1 62a_100009817552_200000035796 [0,2,0,0,0,0|2,0,0]=4 19598 B16R1.610 NC(=O)CCOCC(=O)Cc1ccccc1 7a_100000757172_100000233483 [0,2,0,0,0,0|1,0,1]=4 19599 B16R1.610 O=C(COCCC(F)F)Nc1ccccc1 34a_100103093639_100000182850 [0,2,0,0,0,0|2,0,0]=4 19600 B16R1.610 O=C(COCCC(F)F)Oc1ccccc1 34a_100103093639_100009813826 [0,2,0,0,0,0|2,0,0]=4 19601 B16R1.693 C#CCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100012094781 [0,2,0,0,0,0|2,0,0]=4 19602 B16R1.693 C#CCCCCCC(=O)Cc1ccccc1 1458a_100000694772_100015291786 [0,2,0,0,0,0|1,0,0]=3 19603 B16R1.693 C#CCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100012094781 [0,2,0,0,0,0|2,0,0]=4 19604 B16R1.693 C#CCCCCCC(=O)Cc1ccccn1 1458a_100000694772_100000721315 [0,2,0,0,0,0|2,0,0]=4 19605 B16R1.693 C#CCCCCCC(=O)Cc1cccnc1 1458a_100000694772_100000733263 [0,2,0,0,0,0|2,0,0]=4 19606 B16R1.693 C#CCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100012094781 [0,2,0,0,0,0|2,0,0]=4 19607 B16R1.693 C#CCCCCCC(=O)Cc1ccncc1 1458a_100000694772_100000705612 [0,2,0,0,0,0|2,0,0]=4 19608 B16R1.693 C#CCCCCCC(=O)Nc1ccccc1 11a_100000106764_100000694772 [0,2,0,0,0,0|2,0,0]=4 19609 B16R1.693 C#CCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000694772 [0,2,0,0,0,0|2,0,0]=4 19610 B16R1.693 C#CCCCCCC(=O)Nc1ccccc1 22a_100000106764_100000694772 [0,2,0,0,0,0|2,0,0]=4 19611 B16R1.693 C#CCCCCCC(=O)Nc1ccccc1 527a_100000106764_100000694772 [0,2,0,0,0,0|2,0,0]=4 19612 B16R1.693 C#CCCCCNC(=O)C[n+]1ccccc1 11a_100000706060_200000086051 [0,2,0,0,0,0|2,0,0]=4 19613 B16R1.693 C#CCCCCNC(=O)C[n+]1ccccc1 240690a_100000706060_200000086051 [0,2,0,0,0,0|2,0,0]=4 19614 B16R1.693 C#CCCCCNC(=O)C[n+]1ccccc1 527a_100000706060_200000086051 [0,2,0,0,0,0|2,0,0]=4 19615 B16R1.693 C#CCCCCNC(=O)Cc1ccccn1 11a_100000706060_100000233486 [0,2,0,0,0,0|2,0,0]=4 19616 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 11a_100000706060_100000737805 [0,2,0,0,0,0|2,0,0]=4 19617 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 240690a_100000706060_100000737805 [0,2,0,0,0,0|2,0,0]=4 19618 B16R1.693 C#CCCCCNC(=O)Cc1cccnc1 527a_100000706060_100000737805 [0,2,0,0,0,0|2,0,0]=4 19619 B16R1.693 C#CCCCCNC(=O)Cc1ccncc1 11a_100000706060_100011201483 [0,2,0,0,0,0|2,0,0]=4 19620 B16R1.693 C#CCCCCNC(=O)Cc1ccncc1 240690a_100000706060_100011201483 [0,2,0,0,0,0|2,0,0]=4 19621 B16R1.693 C#CCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000706060 [0,2,0,0,0,0|2,0,0]=4 19622 B16R1.693 C#CCCCCOC(C)Cc1ccccc1 34a_100000748627_100010269958 [0,2,0,0,0,0|1,0,1]=4 19623 B16R1.693 C#CCCCCOC(C)Cc1ccccc1 34a_100000766709_200011218536 [0,2,0,0,0,0|1,0,1]=4 19624 B16R1.693 C#CCCCCOC(C)Cc1ccccc1 7a_100000748627_100010269958 [0,2,0,0,0,0|1,0,1]=4 19625 B16R1.693 C#CCCCCOC(C)Cc1ccccc1 7a_100000766709_200011218536 [0,2,0,0,0,0|1,0,1]=4 19626 B16R1.693 C#CCCCOCC(=O)Cc1ccccc1 7a_100000215630_100000233483 [0,2,0,0,0,0|0,0,1]=3 19627 B16R1.693 C#CCCCOCC(=O)Nc1ccccc1 34a_100000215630_100000182850 [0,2,0,0,0,0|1,0,1]=4 19628 B16R1.693 C#CCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000695029 [0,2,0,0,0,0|1,0,1]=4 19629 B16R1.693 C#CCCCOCC(=O)Nc1ccccc1 7a_100000215630_100000182850 [0,2,0,0,0,0|1,0,1]=4 19630 B16R1.693 C#CCCCOCC(=O)Oc1ccccc1 34a_100000215630_100009813826 [0,2,0,0,0,0|1,0,1]=4 19631 B16R1.693 C#CCCCOCC(=O)Oc1ccccc1 7a_100000215630_100009813826 [0,2,0,0,0,0|1,0,1]=4 19632 B16R1.693 C#CCCCSCC(=O)Cc1ccccc1 62a_100000233483_100011215417 [0,2,0,0,0,0|0,1,1]=4 19633 B16R1.693 C#CCCCSCC(=O)Cc1ccccc1 62a_100011215417_100000233483 [0,2,0,0,0,0|0,1,1]=4 19634 B16R1.693 C/C(=C\c1ccccc1)/COCCCCF 34a_200025717232_100000729493 [0,2,0,0,0,0|1,0,1]=4 19635 B16R1.693 C/C(=C\c1ccccc1)/COCCCCF 7a_200025717232_100000729493 [0,2,0,0,0,0|1,0,1]=4 19636 B16R1.693 C/C(=C\c1ccccc1)/COCCCCO 34a_200025717232_100011216708 [0,2,0,0,0,0|1,0,1]=4 19637 B16R1.693 C/C(=C\c1ccccc1)/COCCCCO 7a_200025717232_100000210776 [0,2,0,0,0,0|1,0,1]=4 19638 B16R1.693 C/C=C/CCOCC(=O)Nc1ccccc1 34a_100016278192_100000182850 [0,2,0,0,0,0|1,0,1]=4 19639 B16R1.693 C/C=C/CCOCC(=O)Oc1ccccc1 34a_100016278192_100009813826 [0,2,0,0,0,0|1,0,1]=4 19640 B16R1.693 C=CCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000700193 [0,2,0,0,0,0|2,0,0]=4 19641 B16R1.693 C=CCCCCCC(=O)Cc1ccccc1 1458a_100011934241_100015291786 [0,2,0,0,0,0|1,0,0]=3 19642 B16R1.693 C=CCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000700193 [0,2,0,0,0,0|2,0,0]=4 19643 B16R1.693 C=CCCCCCC(=O)Cc1ccccn1 1458a_100011934241_100000721315 [0,2,0,0,0,0|2,0,0]=4 19644 B16R1.693 C=CCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000700193 [0,2,0,0,0,0|2,0,0]=4 19645 B16R1.693 C=CCCCCCC(=O)Cc1cccnc1 1458a_100011934241_100000733263 [0,2,0,0,0,0|2,0,0]=4 19646 B16R1.693 C=CCCCCCC(=O)Cc1ccncc1 1458a_100011934241_100000705612 [0,2,0,0,0,0|2,0,0]=4 19647 B16R1.693 C=CCCCCCC(=O)Nc1ccccc1 11a_100000106764_100011934241 [0,2,0,0,0,0|2,0,0]=4 19648 B16R1.693 C=CCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100011934241 [0,2,0,0,0,0|2,0,0]=4 19649 B16R1.693 C=CCCCCCC(=O)Nc1ccccc1 22a_100000106764_100011934241 [0,2,0,0,0,0|2,0,0]=4 19650 B16R1.693 C=CCCCCCC(=O)Nc1ccccc1 527a_100000106764_100011934241 [0,2,0,0,0,0|2,0,0]=4 19651 B16R1.693 C=CCCCCNC(=O)C[n+]1ccccc1 11a_100000703577_200000086051 [0,2,0,0,0,0|2,0,0]=4 19652 B16R1.693 C=CCCCCNC(=O)C[n+]1ccccc1 240690a_100000703577_200000086051 [0,2,0,0,0,0|2,0,0]=4 19653 B16R1.693 C=CCCCCNC(=O)C[n+]1ccccc1 527a_100000703577_200000086051 [0,2,0,0,0,0|2,0,0]=4 19654 B16R1.693 C=CCCCCNC(=O)Cc1ccccn1 11a_100000703577_100000233486 [0,2,0,0,0,0|2,0,0]=4 19655 B16R1.693 C=CCCCCNC(=O)Cc1cccnc1 11a_100000703577_100000737805 [0,2,0,0,0,0|2,0,0]=4 19656 B16R1.693 C=CCCCCNC(=O)Cc1cccnc1 240690a_100000703577_100000737805 [0,2,0,0,0,0|2,0,0]=4 19657 B16R1.693 C=CCCCCNC(=O)Cc1cccnc1 527a_100000703577_100000737805 [0,2,0,0,0,0|2,0,0]=4 19658 B16R1.693 C=CCCCCNC(=O)Cc1ccncc1 11a_100000703577_100011201483 [0,2,0,0,0,0|2,0,0]=4 19659 B16R1.693 C=CCCCCNC(=O)Cc1ccncc1 240690a_100000703577_100011201483 [0,2,0,0,0,0|2,0,0]=4 19660 B16R1.693 C=CCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000703577 [0,2,0,0,0,0|2,0,0]=4 19661 B16R1.693 C=CCCCCOC(C)Cc1ccccc1 34a_100000748627_100011215482 [0,2,0,0,0,0|1,0,1]=4 19662 B16R1.693 C=CCCCCOC(C)Cc1ccccc1 34a_100000766645_200011218536 [0,2,0,0,0,0|1,0,1]=4 19663 B16R1.693 C=CCCCCOC(C)Cc1ccccc1 7a_100000748627_100011215482 [0,2,0,0,0,0|1,0,1]=4 19664 B16R1.693 C=CCCCCOC(C)Cc1ccccc1 7a_100000766645_200011218536 [0,2,0,0,0,0|1,0,1]=4 19665 B16R1.693 C=CCCCNCC(=O)Cc1ccccc1 2230a_100000700776_100000233483 [0,2,0,0,0,0|1,0,1]=4 19666 B16R1.693 C=CCCCOCC(=O)Cc1ccccc1 7a_100000758997_100000233483 [0,2,0,0,0,0|0,0,1]=3 19667 B16R1.693 C=CCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000757094 [0,2,0,0,0,0|1,0,1]=4 19668 B16R1.693 C=CCCCOCC(=O)Nc1ccccc1 34a_100000758997_100000182850 [0,2,0,0,0,0|1,0,1]=4 19669 B16R1.693 C=CCCCOCC(=O)Nc1ccccc1 7a_100000758997_100000182850 [0,2,0,0,0,0|1,0,1]=4 19670 B16R1.693 C=CCCCOCC(=O)Oc1ccccc1 34a_100000758997_100009813826 [0,2,0,0,0,0|1,0,1]=4 19671 B16R1.693 C=CCCCOCC(=O)Oc1ccccc1 7a_100000758997_100009813826 [0,2,0,0,0,0|1,0,1]=4 19672 B16R1.693 C=CCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000757094 [0,2,0,0,0,0|0,1,1]=4 19673 B16R1.693 C=CCCCSCC(=O)Cc1ccccc1 62a_100011713584_100000233483 [0,2,0,0,0,0|0,1,1]=4 19674 B16R1.693 CC#CCCOCC(=O)Nc1ccccc1 34a_100000750427_100000182850 [0,2,0,0,0,0|1,0,1]=4 19675 B16R1.693 CC#CCCOCC(=O)Oc1ccccc1 34a_100000750427_100009813826 [0,2,0,0,0,0|1,0,1]=4 19676 B16R1.693 CC(COCCCCF)Cc1ccccc1 34a_100012125295_100000729493 [0,2,0,0,0,0|1,0,1]=4 19677 B16R1.693 CC(COCCCCF)Cc1ccccc1 7a_100012125295_100000729493 [0,2,0,0,0,0|1,0,1]=4 19678 B16R1.693 CC(COCCCCO)Cc1ccccc1 34a_100012125295_100011216708 [0,2,0,0,0,0|1,0,1]=4 19679 B16R1.693 CC(COCCCCO)Cc1ccccc1 7a_100012125295_100000210776 [0,2,0,0,0,0|1,0,1]=4 19680 B16R1.693 CC(Cc1ccccc1)OCCCCC#N 7a_100000748627_100000211819 [0,2,0,0,0,0|1,0,1]=4 19681 B16R1.693 CC(Cc1ccccc1)OCCCCC=O 7a_100000748627_100000139335 [0,2,0,0,0,0|1,0,1]=4 19682 B16R1.693 CC(Cc1ccccc1)OCCCCCBr 34a_100000746331_200011218536 [0,2,0,0,0,0|1,0,1]=4 19683 B16R1.693 CC(Cc1ccccc1)OCCCCCBr 7a_100000746331_200011218536 [0,2,0,0,0,0|1,0,1]=4 19684 B16R1.693 CC(Cc1ccccc1)OCCCCCCl 34a_100000746330_200011218536 [0,2,0,0,0,0|1,0,1]=4 19685 B16R1.693 CC(Cc1ccccc1)OCCCCCCl 7a_100000746330_200011218536 [0,2,0,0,0,0|1,0,1]=4 19686 B16R1.693 CC(Cc1ccccc1)OCCCCCF 34a_100000748627_100000729378 [0,2,0,0,0,0|1,0,1]=4 19687 B16R1.693 CC(Cc1ccccc1)OCCCCCF 7a_100000748627_100000729378 [0,2,0,0,0,0|1,0,1]=4 19688 B16R1.693 CC(Cc1ccccc1)OCCCCCI 34a_200012148887_200011218536 [0,2,0,0,0,0|1,0,1]=4 19689 B16R1.693 CC(Cc1ccccc1)OCCCCCI 7a_200012148887_200011218536 [0,2,0,0,0,0|1,0,1]=4 19690 B16R1.693 CC(Cc1ccccc1)OCCCCCN 34a_100000762737_200011218536 [0,2,0,0,0,0|1,0,1]=4 19691 B16R1.693 CC(Cc1ccccc1)OCCCCCO 34a_100000748627_100000746330 [0,2,0,0,0,0|1,0,1]=4 19692 B16R1.693 CC(Cc1ccccc1)OCCCCCO 7a_100000748627_100000746330 [0,2,0,0,0,0|1,0,1]=4 19693 B16R1.693 CC(Cc1ccccc1)OCCOCCBr 34a_100000692535_200011218536 [0,2,0,0,0,0|1,0,1]=4 19694 B16R1.693 CC(Cc1ccccc1)OCCOCCBr 7a_100000692535_200011218536 [0,2,0,0,0,0|1,0,1]=4 19695 B16R1.693 CC(Cc1ccccc1)OCCOCCCl 34a_100011215305_200011218536 [0,2,0,0,0,0|1,0,1]=4 19696 B16R1.693 CC(Cc1ccccc1)OCCOCCCl 7a_100011215305_200011218536 [0,2,0,0,0,0|1,0,1]=4 19697 B16R1.693 CC(Cc1ccccc1)OCCOCCF 34a_200015357709_200011218536 [0,2,0,0,0,0|1,0,1]=4 19698 B16R1.693 CC(Cc1ccccc1)OCCOCCF 7a_200015357709_200011218536 [0,2,0,0,0,0|1,0,1]=4 19699 B16R1.693 CC(Cc1ccccc1)OCCOCCI 34a_100012149058_200011218536 [0,2,0,0,0,0|1,0,1]=4 19700 B16R1.693 CC(Cc1ccccc1)OCCOCCI 7a_100012149058_200011218536 [0,2,0,0,0,0|1,0,1]=4 19701 B16R1.693 CC(Cc1ccccc1)OCCOCCN 34a_100000211614_200011218536 [0,2,0,0,0,0|1,0,1]=4 19702 B16R1.693 CC(Cc1ccccc1)OCCOCCO 34a_100000748627_100000692535 [0,2,0,0,0,0|1,0,1]=4 19703 B16R1.693 CC(Cc1ccccc1)OCCOCCO 7a_100000748627_100011215305 [0,2,0,0,0,0|1,0,1]=4 19704 B16R1.693 CC/C=C\CCOC(C)Cc1ccccc1 34a_100000748627_100015370543 [0,2,0,0,0,0|1,0,1]=4 19705 B16R1.693 CC/C=C\CCOC(C)Cc1ccccc1 34a_100016288707_200011218536 [0,2,0,0,0,0|1,0,1]=4 19706 B16R1.693 CC/C=C\CCOC(C)Cc1ccccc1 7a_100000748627_100015370543 [0,2,0,0,0,0|1,0,1]=4 19707 B16R1.693 CC/C=C\CCOC(C)Cc1ccccc1 7a_100016288707_200011218536 [0,2,0,0,0,0|1,0,1]=4 19708 B16R1.693 CC/C=C\COCC(=O)Nc1ccccc1 34a_100000246334_100103147603 [0,2,0,0,0,0|1,0,1]=4 19709 B16R1.693 CC/C=C\COCC(=O)Nc1ccccc1 34a_100016268518_100000182850 [0,2,0,0,0,0|1,0,1]=4 19710 B16R1.693 CC/C=C\COCC(=O)Oc1ccccc1 34a_100016268518_100009813826 [0,2,0,0,0,0|1,0,1]=4 19711 B16R1.693 CC/C=C\CSCC(=O)Cc1ccccc1 62a_100000233483_100103147603 [0,2,0,0,0,0|0,1,1]=4 19712 B16R1.693 CC/C=C\CSCC(=O)Cc1ccccc1 62a_100103147603_100000233483 [0,2,0,0,0,0|0,1,1]=4 19713 B16R1.693 CC=CCCCOC(C)Cc1ccccc1 34a_100020645299_200011218536 [0,2,0,0,0,0|1,0,1]=4 19714 B16R1.693 CCC#CCCOC(C)Cc1ccccc1 34a_100000036655_200011218536 [0,2,0,0,0,0|1,0,1]=4 19715 B16R1.693 CCC#CCCOC(C)Cc1ccccc1 7a_100000036655_200011218536 [0,2,0,0,0,0|1,0,1]=4 19716 B16R1.693 CCC#CCOCC(=O)Nc1ccccc1 34a_100000032950_100000182850 [0,2,0,0,0,0|1,0,1]=4 19717 B16R1.693 CCC#CCOCC(=O)Nc1ccccc1 34a_100000246334_100009813939 [0,2,0,0,0,0|1,0,1]=4 19718 B16R1.693 CCC#CCOCC(=O)Oc1ccccc1 34a_100000032950_100009813826 [0,2,0,0,0,0|1,0,1]=4 19719 B16R1.693 CCC#CCSCC(=O)Cc1ccccc1 62a_100000233483_100009813939 [0,2,0,0,0,0|0,1,1]=4 19720 B16R1.693 CCC#CCSCC(=O)Cc1ccccc1 62a_100009813939_100000233483 [0,2,0,0,0,0|0,1,1]=4 19721 B16R1.693 CCC/C=C/C=CC(=O)Cc1ccccc1 1458a_200016258893_100015291786 [0,2,0,0,0,0|1,0,1]=4 19722 B16R1.693 CCC/C=C/COC(C)Cc1ccccc1 34a_100016278788_200011218536 [0,2,0,0,0,0|1,0,1]=4 19723 B16R1.693 CCC/C=C/COC(C)Cc1ccccc1 7a_100016278788_200011218536 [0,2,0,0,0,0|1,0,1]=4 19724 B16R1.693 CCCC#CCOC(C)Cc1ccccc1 34a_100000034806_200011218536 [0,2,0,0,0,0|1,0,1]=4 19725 B16R1.693 CCCC#CCOC(C)Cc1ccccc1 7a_100000034806_200011218536 [0,2,0,0,0,0|1,0,1]=4 19726 B16R1.693 CCCC/C=C/CC(=O)Cc1ccccc1 1458a_200016282684_100015291786 [0,2,0,0,0,0|1,0,0]=3 19727 B16R1.693 CCCC/C=C/CC(=O)Cc1ccccn1 1458a_200016282684_100000721315 [0,2,0,0,0,0|2,0,0]=4 19728 B16R1.693 CCCC/C=C/CC(=O)Cc1cccnc1 1458a_200016282684_100000733263 [0,2,0,0,0,0|2,0,0]=4 19729 B16R1.693 CCCC/C=C/CC(=O)Cc1ccncc1 1458a_200016282684_100000705612 [0,2,0,0,0,0|2,0,0]=4 19730 B16R1.693 CCCC/C=C/CC(=O)Nc1ccccc1 11a_100000106764_200016282684 [0,2,0,0,0,0|2,0,0]=4 19731 B16R1.693 CCCC/C=C/CC(=O)Nc1ccccc1 1626a_100000106764_200016282684 [0,2,0,0,0,0|2,0,0]=4 19732 B16R1.693 CCCC/C=C/CC(=O)Nc1ccccc1 22a_100000106764_200016282684 [0,2,0,0,0,0|2,0,0]=4 19733 B16R1.693 CCCC/C=C/CC(=O)Nc1ccccc1 527a_100000106764_200016282684 [0,2,0,0,0,0|2,0,0]=4 19734 B16R1.693 CCCCC=NNC(=O)C[n+]1ccccc1 4a_100000199085_100000210104 [0,2,0,0,0,0|2,0,0]=4 19735 B16R1.693 CCCCC=NNC(=O)Cc1ccccc1 4a_100000182964_100000210104 [0,2,0,0,0,0|1,0,0]=3 19736 B16R1.693 CCCCC=NNC(=O)Cc1ccccn1 4a_200000059813_100000210104 [0,2,0,0,0,0|2,0,0]=4 19737 B16R1.693 CCCCC=NNC(=O)Cc1ccncc1 4a_100000766356_100000210104 [0,2,0,0,0,0|2,0,0]=4 19738 B16R1.693 CCCCCC#CC(=O)Cc1ccccc1 1458a_100011215388_100015291786 [0,2,0,0,0,0|1,0,0]=3 19739 B16R1.693 CCCCCC#CC(=O)Cc1ccccn1 1458a_100011215388_100000721315 [0,2,0,0,0,0|2,0,0]=4 19740 B16R1.693 CCCCCC#CC(=O)Cc1cccnc1 1458a_100011215388_100000733263 [0,2,0,0,0,0|2,0,0]=4 19741 B16R1.693 CCCCCC#CC(=O)Cc1ccncc1 1458a_100011215388_100000705612 [0,2,0,0,0,0|2,0,0]=4 19742 B16R1.693 CCCCCC#CC(=O)Nc1ccccc1 22a_100000106764_100011215388 [0,2,0,0,0,0|2,0,0]=4 19743 B16R1.693 CCCCCC=CC(=O)Cc1ccccc1 1458a_100016263427_100015291786 [0,2,0,0,0,0|1,0,0]=3 19744 B16R1.693 CCCCCC=CC(=O)Cc1ccccn1 1458a_100016263427_100000721315 [0,2,0,0,0,0|2,0,0]=4 19745 B16R1.693 CCCCCC=CC(=O)Cc1cccnc1 1458a_100016263427_100000733263 [0,2,0,0,0,0|2,0,0]=4 19746 B16R1.693 CCCCCC=CC(=O)Cc1ccncc1 1458a_100016263427_100000705612 [0,2,0,0,0,0|2,0,0]=4 19747 B16R1.693 CCCCCC=CC(=O)Nc1ccccc1 11a_100000106764_100016263427 [0,2,0,0,0,0|2,0,0]=4 19748 B16R1.693 CCCCCC=CC(=O)Nc1ccccc1 1626a_100000106764_100016263427 [0,2,0,0,0,0|2,0,0]=4 19749 B16R1.693 CCCCCC=CC(=O)Nc1ccccc1 22a_100000106764_100016263427 [0,2,0,0,0,0|2,0,0]=4 19750 B16R1.693 CCCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210614 [0,2,0,0,0,0|2,0,0]=4 19751 B16R1.693 CCCCCCCC(=O)Cc1ccccc1 1458a_100000211969_100015291786 [0,2,0,0,0,0|1,0,0]=3 19752 B16R1.693 CCCCCCCC(=O)Cc1ccccn1 1458a_100000211969_100000721315 [0,2,0,0,0,0|2,0,0]=4 19753 B16R1.693 CCCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210614 [0,2,0,0,0,0|2,0,0]=4 19754 B16R1.693 CCCCCCCC(=O)Cc1cccnc1 1458a_100000211969_100000733263 [0,2,0,0,0,0|2,0,0]=4 19755 B16R1.693 CCCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100000210614 [0,2,0,0,0,0|2,0,0]=4 19756 B16R1.693 CCCCCCCC(=O)Cc1ccncc1 1458a_100000211969_100000705612 [0,2,0,0,0,0|2,0,0]=4 19757 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 11a_100000106764_100000211969 [0,2,0,0,0,0|2,0,0]=4 19758 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100000211969 [0,2,0,0,0,0|2,0,0]=4 19759 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 22a_100000106764_100000211969 [0,2,0,0,0,0|2,0,0]=4 19760 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 527a_100000106764_100000211969 [0,2,0,0,0,0|2,0,0]=4 19761 B16R1.693 CCCCCCNC(=O)C[n+]1ccccc1 11a_100000210581_200000086051 [0,2,0,0,0,0|2,0,0]=4 19762 B16R1.693 CCCCCCNC(=O)C[n+]1ccccc1 240690a_100000210581_200000086051 [0,2,0,0,0,0|2,0,0]=4 19763 B16R1.693 CCCCCCNC(=O)C[n+]1ccccc1 527a_100000210581_200000086051 [0,2,0,0,0,0|2,0,0]=4 19764 B16R1.693 CCCCCCNC(=O)Cc1ccccn1 11a_100000210581_100000233486 [0,2,0,0,0,0|2,0,0]=4 19765 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 11a_100000210581_100000737805 [0,2,0,0,0,0|2,0,0]=4 19766 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 240690a_100000210581_100000737805 [0,2,0,0,0,0|2,0,0]=4 19767 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 527a_100000210581_100000737805 [0,2,0,0,0,0|2,0,0]=4 19768 B16R1.693 CCCCCCNC(=O)Cc1ccncc1 11a_100000210581_100011201483 [0,2,0,0,0,0|2,0,0]=4 19769 B16R1.693 CCCCCCNC(=O)Cc1ccncc1 240690a_100000210581_100011201483 [0,2,0,0,0,0|2,0,0]=4 19770 B16R1.693 CCCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000210581 [0,2,0,0,0,0|2,0,0]=4 19771 B16R1.693 CCCCCCOC(C)Cc1ccccc1 34a_100000210259_200011218536 [0,2,0,0,0,0|1,0,1]=4 19772 B16R1.693 CCCCCCOC(C)Cc1ccccc1 34a_100000748627_100000210314 [0,2,0,0,0,0|1,0,1]=4 19773 B16R1.693 CCCCCCOC(C)Cc1ccccc1 7a_100000210259_200011218536 [0,2,0,0,0,0|1,0,1]=4 19774 B16R1.693 CCCCCCOC(C)Cc1ccccc1 7a_100000748627_100000210314 [0,2,0,0,0,0|1,0,1]=4 19775 B16R1.693 CCCCCNCC(=O)Cc1ccccc1 2230a_100000209983_100000233483 [0,2,0,0,0,0|1,0,0]=3 19776 B16R1.693 CCCCCNCC(=O)Nc1ccccc1 2230a_100000209983_100000182850 [0,2,0,0,0,0|2,0,0]=4 19777 B16R1.693 CCCCCNCC(=O)Oc1ccccc1 2230a_100000209983_100009813826 [0,2,0,0,0,0|2,0,0]=4 19778 B16R1.693 CCCCCNNC(=O)C[n+]1ccccc1 22a_100000694160_200000086051 [0,2,0,0,0,0|2,0,0]=4 19779 B16R1.693 CCCCCNNC(=O)Cc1ccccn1 22a_100000694160_100000233486 [0,2,0,0,0,0|2,0,0]=4 19780 B16R1.693 CCCCCNNC(=O)Cc1cccnc1 22a_100000694160_100000737805 [0,2,0,0,0,0|2,0,0]=4 19781 B16R1.693 CCCCCNNC(=O)Cc1ccncc1 22a_100000694160_100011201483 [0,2,0,0,0,0|2,0,0]=4 19782 B16R1.693 CCCCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000718602 [0,2,0,0,0,0|1,0,1]=4 19783 B16R1.693 CCCCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000210326 [0,2,0,0,0,0|1,0,1]=4 19784 B16R1.693 CCCCCOCC(=O)Cc1ccccc1 7a_100000210253_100000233483 [0,2,0,0,0,0|0,0,0]=2 19785 B16R1.693 CCCCCOCC(=O)Nc1ccccc1 34a_100000210253_100000182850 [0,2,0,0,0,0|1,0,0]=3 19786 B16R1.693 CCCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000718602 [0,2,0,0,0,0|1,0,0]=3 19787 B16R1.693 CCCCCOCC(=O)Nc1ccccc1 7a_100000210253_100000182850 [0,2,0,0,0,0|1,0,0]=3 19788 B16R1.693 CCCCCOCC(=O)Nc1ccccn1 7a_100000210253_100020662008 [0,2,0,0,0,0|2,0,0]=4 19789 B16R1.693 CCCCCOCC(=O)Nc1ccncc1 7a_100000210253_100000754145 [0,2,0,0,0,0|2,0,0]=4 19790 B16R1.693 CCCCCOCC(=O)Oc1ccccc1 34a_100000210253_100009813826 [0,2,0,0,0,0|1,0,0]=3 19791 B16R1.693 CCCCCOCC(=O)Oc1ccccc1 7a_100000210253_100009813826 [0,2,0,0,0,0|1,0,0]=3 19792 B16R1.693 CCCCCOCC(C)Cc1ccccc1 34a_100012125295_100000718602 [0,2,0,0,0,0|1,0,1]=4 19793 B16R1.693 CCCCCOCC(C)Cc1ccccc1 7a_100012125295_100000210326 [0,2,0,0,0,0|1,0,1]=4 19794 B16R1.693 CCCCCOCC(N)Cc1ccccc1 34a_100000739027_100000718602 [0,2,0,0,0,0|1,0,1]=4 19795 B16R1.693 CCCCCOC[C@@H](O)Cc1ccccc1 34a_100000210253_100000729385 [0,2,0,0,0,0|0,0,2]=4 19796 B16R1.693 CCCCCOC[C@@H](O)Cc1ccccc1 7a_100000210253_100000729385 [0,2,0,0,0,0|0,0,2]=4 19797 B16R1.693 CCCCCSCC(=O)Cc1ccccc1 62a_100000210326_100000233483 [0,2,0,0,0,0|0,1,0]=3 19798 B16R1.693 CCCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000210326 [0,2,0,0,0,0|0,1,0]=3 19799 B16R1.693 CCCCCSCC(=O)Nc1ccccc1 62a_100000210326_100000182850 [0,2,0,0,0,0|1,1,0]=4 19800 B16R1.693 CCCCCSCC(=O)Nc1ccccc1 62a_100012148978_100000210326 [0,2,0,0,0,0|1,1,0]=4 19801 B16R1.693 CCCCCSCC(=O)Oc1ccccc1 62a_100000210326_100009813826 [0,2,0,0,0,0|1,1,0]=4 19802 B16R1.693 CCCCCSCC(=O)Oc1ccccc1 62a_100009813826_100000210326 [0,2,0,0,0,0|1,1,0]=4 19803 B16R1.693 CCCCNCCC(=O)Nc1ccccc1 2230a_100000102301_100000242058 [0,2,0,0,0,0|2,0,0]=4 19804 B16R1.693 CCCCNCCC(=O)Nc1ccccc1 7a_106832991798_100000242058 [0,2,0,0,0,0|2,0,0]=4 19805 B16R1.693 CCCCNCCC(=O)Oc1ccccc1 2230a_100000102301_200000035796 [0,2,0,0,0,0|2,0,0]=4 19806 B16R1.693 CCCCNCCC(=O)Oc1ccccc1 7a_106832991798_200000035796 [0,2,0,0,0,0|2,0,0]=4 19807 B16R1.693 CCCCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000743108 [0,2,0,0,0,0|1,0,0]=3 19808 B16R1.693 CCCCOCCC(=O)Cc1ccccn1 1458a_100000233486_100000743108 [0,2,0,0,0,0|1,0,0]=3 19809 B16R1.693 CCCCOCCC(=O)Cc1cccnc1 1458a_100000737805_100000743108 [0,2,0,0,0,0|1,0,0]=3 19810 B16R1.693 CCCCOCCC(=O)Cc1cncnc1 1458a_100000721575_100000743108 [0,2,0,0,0,0|2,0,0]=4 19811 B16R1.693 CCCCOCCC(=O)Nc1ccccc1 34a_100000210227_100000242058 [0,2,0,0,0,0|1,0,0]=3 19812 B16R1.693 CCCCOCCC(=O)Nc1ccccc1 7a_100000210227_100000242058 [0,2,0,0,0,0|1,0,0]=3 19813 B16R1.693 CCCCOCCC(=O)Nc1cccnc1 7a_100000210227_200015187043 [0,2,0,0,0,0|2,0,0]=4 19814 B16R1.693 CCCCOCCC(=O)Oc1ccccc1 7a_100000210227_200000035796 [0,2,0,0,0,0|1,0,0]=3 19815 B16R1.693 CCCCOCCN(C)Cc1ccccc1 2230a_100000186898_100000743108 [0,2,0,0,0,0|2,0,0]=4 19816 B16R1.693 CCCCOCCN(C)Cc1ccccc1 269982a_100000186898_100000743108 [0,2,0,0,0,0|2,0,0]=4 19817 B16R1.693 CCCCOCCN(C)Cc1ccccc1 34a_100000210227_100015196923 [0,2,0,0,0,0|2,0,0]=4 19818 B16R1.693 CCCCOCCN(C)Cc1ccccc1 7a_100000210227_100015196923 [0,2,0,0,0,0|2,0,0]=4 19819 B16R1.693 CCCCOCOC(C)Cc1ccccc1 34a_100000748627_100011995733 [0,2,0,0,0,0|1,0,1]=4 19820 B16R1.693 CCCCOCSC(C)Cc1ccccc1 62a_100011995733_200011218536 [0,2,0,0,0,0|1,0,1]=4 19821 B16R1.693 CCCCOCSC(C)Cc1ccccc1 62a_200011218536_100011995733 [0,2,0,0,0,0|1,0,1]=4 19822 B16R1.693 CCCCSCCC(=O)Nc1ccccc1 62a_100000210211_100000242058 [0,2,0,0,0,0|1,1,0]=4 19823 B16R1.693 CCCCSCCC(=O)Oc1ccccc1 62a_100000210211_200000035796 [0,2,0,0,0,0|1,1,0]=4 19824 B16R1.693 CCCNCCCC(=O)Nc1ccccc1 34a_100000750157_100000210303 [0,2,0,0,0,0|2,0,0]=4 19825 B16R1.693 CCCOCCCC(=O)Nc1ccccc1 34a_100000210258_100011194425 [0,2,0,0,0,0|2,0,0]=4 19826 B16R1.693 CCCOCCNC(=O)C[n+]1ccccc1 240690a_100161115042_200000086051 [0,2,0,0,0,0|2,0,0]=4 19827 B16R1.693 CCCOCCNC(=O)C[n+]1ccccc1 527a_100161115042_200000086051 [0,2,0,0,0,0|2,0,0]=4 19828 B16R1.693 CCCOCCNC(=O)Cc1cccnc1 240690a_100161115042_100000737805 [0,2,0,0,0,0|2,0,0]=4 19829 B16R1.693 CCCOCCNC(=O)Cc1cccnc1 527a_100161115042_100000737805 [0,2,0,0,0,0|2,0,0]=4 19830 B16R1.693 CCCOCCNC(=O)Cc1ccncc1 240690a_100161115042_100011201483 [0,2,0,0,0,0|2,0,0]=4 19831 B16R1.693 CCCOCCNC(=O)Nc1ccccc1 2430a_100000106764_100161115042 [0,2,0,0,0,0|2,0,0]=4 19832 B16R1.693 CCCOCCOC(C)Cc1ccccc1 34a_100000748627_100011215938 [0,2,0,0,0,0|1,0,1]=4 19833 B16R1.693 CCCOCCOC(C)Cc1ccccc1 34a_100000752267_200011218536 [0,2,0,0,0,0|1,0,1]=4 19834 B16R1.693 CCCOCCOC(C)Cc1ccccc1 7a_100000748627_100011215938 [0,2,0,0,0,0|1,0,1]=4 19835 B16R1.693 CCCOCCOC(C)Cc1ccccc1 7a_100000752267_200011218536 [0,2,0,0,0,0|1,0,1]=4 19836 B16R1.693 CCCSCCCC(=O)Nc1ccccc1 62a_100000210303_100011194425 [0,2,0,0,0,0|2,0,0]=4 19837 B16R1.693 CCCSCCNC(=O)C[n+]1ccccc1 11a_100020603323_200000086051 [0,2,0,0,0,0|2,0,0]=4 19838 B16R1.693 CCCSCCNC(=O)C[n+]1ccccc1 240690a_100020603323_200000086051 [0,2,0,0,0,0|2,0,0]=4 19839 B16R1.693 CCCSCCNC(=O)C[n+]1ccccc1 527a_100020603323_200000086051 [0,2,0,0,0,0|2,0,0]=4 19840 B16R1.693 CCCSCCNC(=O)Cc1ccccn1 11a_100020603323_100000233486 [0,2,0,0,0,0|2,0,0]=4 19841 B16R1.693 CCCSCCNC(=O)Cc1cccnc1 11a_100020603323_100000737805 [0,2,0,0,0,0|2,0,0]=4 19842 B16R1.693 CCCSCCNC(=O)Cc1cccnc1 240690a_100020603323_100000737805 [0,2,0,0,0,0|2,0,0]=4 19843 B16R1.693 CCCSCCNC(=O)Cc1cccnc1 527a_100020603323_100000737805 [0,2,0,0,0,0|2,0,0]=4 19844 B16R1.693 CCCSCCNC(=O)Cc1ccncc1 11a_100020603323_100011201483 [0,2,0,0,0,0|2,0,0]=4 19845 B16R1.693 CCCSCCNC(=O)Cc1ccncc1 240690a_100020603323_100011201483 [0,2,0,0,0,0|2,0,0]=4 19846 B16R1.693 CCCSCCNC(=O)Nc1ccccc1 2430a_100000106764_100020603323 [0,2,0,0,0,0|2,0,0]=4 19847 B16R1.693 CCCSCCOC(C)Cc1ccccc1 34a_200000230433_200011218536 [0,2,0,0,0,0|1,0,1]=4 19848 B16R1.693 CCCSCCOC(C)Cc1ccccc1 7a_200000230433_200011218536 [0,2,0,0,0,0|1,0,1]=4 19849 B16R1.693 CCOCCCNC(=O)C[n+]1ccccc1 11a_100000210961_200000086051 [0,2,0,0,0,0|2,0,0]=4 19850 B16R1.693 CCOCCCNC(=O)C[n+]1ccccc1 240690a_100000210961_200000086051 [0,2,0,0,0,0|2,0,0]=4 19851 B16R1.693 CCOCCCNC(=O)C[n+]1ccccc1 527a_100000210961_200000086051 [0,2,0,0,0,0|2,0,0]=4 19852 B16R1.693 CCOCCCNC(=O)Cc1ccccn1 11a_100000210961_100000233486 [0,2,0,0,0,0|2,0,0]=4 19853 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 11a_100000210961_100000737805 [0,2,0,0,0,0|2,0,0]=4 19854 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 240690a_100000210961_100000737805 [0,2,0,0,0,0|2,0,0]=4 19855 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 527a_100000210961_100000737805 [0,2,0,0,0,0|2,0,0]=4 19856 B16R1.693 CCOCCCNC(=O)Cc1ccncc1 11a_100000210961_100011201483 [0,2,0,0,0,0|2,0,0]=4 19857 B16R1.693 CCOCCCNC(=O)Cc1ccncc1 240690a_100000210961_100011201483 [0,2,0,0,0,0|2,0,0]=4 19858 B16R1.693 CCOCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000210961 [0,2,0,0,0,0|2,0,0]=4 19859 B16R1.693 CCOCCCOC(C)Cc1ccccc1 34a_100000748627_100012232248 [0,2,0,0,0,0|1,0,1]=4 19860 B16R1.693 CCOCCCOC(C)Cc1ccccc1 34a_100000757476_200011218536 [0,2,0,0,0,0|1,0,1]=4 19861 B16R1.693 CCOCCCOC(C)Cc1ccccc1 7a_100000748627_100012232248 [0,2,0,0,0,0|1,0,1]=4 19862 B16R1.693 CCOCCCOC(C)Cc1ccccc1 7a_100000757476_200011218536 [0,2,0,0,0,0|1,0,1]=4 19863 B16R1.693 CCOCCNCC(=O)Cc1ccccc1 2230a_102516460346_100000233483 [0,2,0,0,0,0|1,0,0]=3 19864 B16R1.693 CCOCCNCC(=O)Nc1ccccc1 2230a_102516460346_100000182850 [0,2,0,0,0,0|2,0,0]=4 19865 B16R1.693 CCOCCNCC(=O)Nc1ccccc1 34a_102516460346_100000182850 [0,2,0,0,0,0|2,0,0]=4 19866 B16R1.693 CCOCCNCC(=O)Oc1ccccc1 2230a_102516460346_100009813826 [0,2,0,0,0,0|2,0,0]=4 19867 B16R1.693 CCOCCNCC(=O)Oc1ccccc1 34a_102516460346_100009813826 [0,2,0,0,0,0|2,0,0]=4 19868 B16R1.693 CCOCCNNC(=O)C[n+]1ccccc1 22a_100000732670_200000086051 [0,2,0,0,0,0|2,0,0]=4 19869 B16R1.693 CCOCCNNC(=O)Cc1ccccn1 22a_100000732670_100000233486 [0,2,0,0,0,0|2,0,0]=4 19870 B16R1.693 CCOCCNNC(=O)Cc1cccnc1 22a_100000732670_100000737805 [0,2,0,0,0,0|2,0,0]=4 19871 B16R1.693 CCOCCNNC(=O)Cc1ccncc1 22a_100000732670_100011201483 [0,2,0,0,0,0|2,0,0]=4 19872 B16R1.693 CCOCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000210147 [0,2,0,0,0,0|1,0,1]=4 19873 B16R1.693 CCOCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100011215890 [0,2,0,0,0,0|1,0,1]=4 19874 B16R1.693 CCOCCOCC(=O)Cc1ccccc1 7a_100000210136_100000233483 [0,2,0,0,0,0|0,0,0]=2 19875 B16R1.693 CCOCCOCC(=O)Nc1ccccc1 34a_100000210136_100000182850 [0,2,0,0,0,0|1,0,0]=3 19876 B16R1.693 CCOCCOCC(=O)Nc1ccccc1 34a_100000246334_100000210147 [0,2,0,0,0,0|1,0,0]=3 19877 B16R1.693 CCOCCOCC(=O)Nc1ccccc1 7a_100000210136_100000182850 [0,2,0,0,0,0|1,0,0]=3 19878 B16R1.693 CCOCCOCC(=O)Nc1ccccn1 7a_100000210136_100020662008 [0,2,0,0,0,0|2,0,0]=4 19879 B16R1.693 CCOCCOCC(=O)Nc1ccncc1 7a_100000210136_100000754145 [0,2,0,0,0,0|2,0,0]=4 19880 B16R1.693 CCOCCOCC(=O)Oc1ccccc1 34a_100000210136_100009813826 [0,2,0,0,0,0|1,0,0]=3 19881 B16R1.693 CCOCCOCC(=O)Oc1ccccc1 7a_100000210136_100009813826 [0,2,0,0,0,0|1,0,0]=3 19882 B16R1.693 CCOCCOCC(C)Cc1ccccc1 34a_100012125295_100000210147 [0,2,0,0,0,0|1,0,1]=4 19883 B16R1.693 CCOCCOCC(C)Cc1ccccc1 7a_100012125295_100011215890 [0,2,0,0,0,0|1,0,1]=4 19884 B16R1.693 CCOCCOCC(N)Cc1ccccc1 34a_100000739027_100000210147 [0,2,0,0,0,0|1,0,1]=4 19885 B16R1.693 CCOCCOC[C@@H](O)Cc1ccccc1 34a_100000210136_100000729385 [0,2,0,0,0,0|0,0,2]=4 19886 B16R1.693 CCOCCOC[C@@H](O)Cc1ccccc1 7a_100000210136_100000729385 [0,2,0,0,0,0|0,0,2]=4 19887 B16R1.693 CCOCCSCC(=O)Cc1ccccc1 62a_100000210147_100000233483 [0,2,0,0,0,0|0,1,0]=3 19888 B16R1.693 CCOCCSCC(=O)Cc1ccccc1 62a_100000233483_100011215890 [0,2,0,0,0,0|0,1,0]=3 19889 B16R1.693 CCOCCSCC(=O)Nc1ccccc1 62a_100000210147_100000182850 [0,2,0,0,0,0|1,1,0]=4 19890 B16R1.693 CCOCCSCC(=O)Nc1ccccc1 62a_100012148978_100011215890 [0,2,0,0,0,0|1,1,0]=4 19891 B16R1.693 CCOCCSCC(=O)Oc1ccccc1 62a_100000210147_100009813826 [0,2,0,0,0,0|1,1,0]=4 19892 B16R1.693 CCOCCSCC(=O)Oc1ccccc1 62a_100009813826_100011215890 [0,2,0,0,0,0|1,1,0]=4 19893 B16R1.693 CCOCSCCC(=O)Nc1ccccc1 62a_100000739092_100000242058 [0,2,0,0,0,0|2,0,0]=4 19894 B16R1.693 CCOCSCCC(=O)Oc1ccccc1 62a_100000739092_200000035796 [0,2,0,0,0,0|2,0,0]=4 19895 B16R1.693 CCSCCCOC(C)Cc1ccccc1 34a_100011216438_200011218536 [0,2,0,0,0,0|1,0,1]=4 19896 B16R1.693 CCSCCCOC(C)Cc1ccccc1 7a_100011216438_200011218536 [0,2,0,0,0,0|1,0,1]=4 19897 B16R1.693 CCSCCNCC(=O)Cc1ccccc1 2230a_100000106463_100000233483 [0,2,0,0,0,0|1,0,0]=3 19898 B16R1.693 CCSCCNCC(=O)Nc1ccccc1 2230a_100000106463_100000182850 [0,2,0,0,0,0|2,0,0]=4 19899 B16R1.693 CCSCCNCC(=O)Oc1ccccc1 2230a_100000106463_100009813826 [0,2,0,0,0,0|2,0,0]=4 19900 B16R1.693 CCSCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000757381 [0,2,0,0,0,0|1,0,1]=4 19901 B16R1.693 CCSCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000757381 [0,2,0,0,0,0|1,0,1]=4 19902 B16R1.693 CCSCCOCC(=O)Cc1ccccc1 7a_100000212035_100000233483 [0,2,0,0,0,0|0,0,0]=2 19903 B16R1.693 CCSCCOCC(=O)Nc1ccccc1 34a_100000212035_100000182850 [0,2,0,0,0,0|1,0,0]=3 19904 B16R1.693 CCSCCOCC(=O)Nc1ccccc1 34a_100000246334_100000757381 [0,2,0,0,0,0|1,0,0]=3 19905 B16R1.693 CCSCCOCC(=O)Nc1ccccc1 7a_100000212035_100000182850 [0,2,0,0,0,0|1,0,0]=3 19906 B16R1.693 CCSCCOCC(=O)Nc1ccccn1 7a_100000212035_100020662008 [0,2,0,0,0,0|2,0,0]=4 19907 B16R1.693 CCSCCOCC(=O)Nc1ccncc1 7a_100000212035_100000754145 [0,2,0,0,0,0|2,0,0]=4 19908 B16R1.693 CCSCCOCC(=O)Oc1ccccc1 34a_100000212035_100009813826 [0,2,0,0,0,0|1,0,0]=3 19909 B16R1.693 CCSCCOCC(=O)Oc1ccccc1 7a_100000212035_100009813826 [0,2,0,0,0,0|1,0,0]=3 19910 B16R1.693 CCSCCOCC(C)Cc1ccccc1 34a_100012125295_100000757381 [0,2,0,0,0,0|1,0,1]=4 19911 B16R1.693 CCSCCOCC(C)Cc1ccccc1 7a_100012125295_100000757381 [0,2,0,0,0,0|1,0,1]=4 19912 B16R1.693 CCSCCOCC(N)Cc1ccccc1 34a_100000739027_100000757381 [0,2,0,0,0,0|1,0,1]=4 19913 B16R1.693 CCSCCOC[C@@H](O)Cc1ccccc1 34a_100000212035_100000729385 [0,2,0,0,0,0|0,0,2]=4 19914 B16R1.693 CCSCCOC[C@@H](O)Cc1ccccc1 7a_100000212035_100000729385 [0,2,0,0,0,0|0,0,2]=4 19915 B16R1.693 CCSCCSCC(=O)Cc1ccccc1 62a_100000233483_100000757381 [0,2,0,0,0,0|0,1,0]=3 19916 B16R1.693 CCSCCSCC(=O)Cc1ccccc1 62a_100000757381_100000233483 [0,2,0,0,0,0|0,1,0]=3 19917 B16R1.693 CCSCCSCC(=O)Nc1ccccc1 62a_100000757381_100000182850 [0,2,0,0,0,0|1,1,0]=4 19918 B16R1.693 CCSCCSCC(=O)Nc1ccccc1 62a_100012148978_100000757381 [0,2,0,0,0,0|1,1,0]=4 19919 B16R1.693 CCSCCSCC(=O)Oc1ccccc1 62a_100000757381_100009813826 [0,2,0,0,0,0|1,1,0]=4 19920 B16R1.693 CCSCCSCC(=O)Oc1ccccc1 62a_100009813826_100000757381 [0,2,0,0,0,0|1,1,0]=4 19921 B16R1.693 CNCCCOCC(=O)Nc1ccccc1 34a_100000213112_100000182850 [0,2,0,0,0,0|1,0,0]=3 19922 B16R1.693 CNCCCOCC(=O)Oc1ccccc1 34a_100000213112_100009813826 [0,2,0,0,0,0|1,0,0]=3 19923 B16R1.693 CNCCCOC[C@@H](O)Cc1ccccc1 34a_100000213112_100000729385 [0,2,0,0,0,0|0,0,2]=4 19924 B16R1.693 COCCCCCC(=O)Cc1ccccc1 1458a_100011935119_100015291786 [0,2,0,0,0,0|1,0,0]=3 19925 B16R1.693 COCCCCCC(=O)Cc1ccccn1 1458a_100011935119_100000721315 [0,2,0,0,0,0|2,0,0]=4 19926 B16R1.693 COCCCCCC(=O)Cc1cccnc1 1458a_100011935119_100000733263 [0,2,0,0,0,0|2,0,0]=4 19927 B16R1.693 COCCCCCC(=O)Cc1ccncc1 1458a_100011935119_100000705612 [0,2,0,0,0,0|2,0,0]=4 19928 B16R1.693 COCCCCCC(=O)Nc1ccccc1 11a_100000106764_100011935119 [0,2,0,0,0,0|2,0,0]=4 19929 B16R1.693 COCCCCCC(=O)Nc1ccccc1 1626a_100000106764_100011935119 [0,2,0,0,0,0|2,0,0]=4 19930 B16R1.693 COCCCCCC(=O)Nc1ccccc1 22a_100000106764_100011935119 [0,2,0,0,0,0|2,0,0]=4 19931 B16R1.693 COCCCCCC(=O)Nc1ccccc1 527a_100000106764_100011935119 [0,2,0,0,0,0|2,0,0]=4 19932 B16R1.693 COCCCCOC(C)Cc1ccccc1 34a_100000740925_200011218536 [0,2,0,0,0,0|1,0,1]=4 19933 B16R1.693 COCCCCOC(C)Cc1ccccc1 34a_100000748627_100000755781 [0,2,0,0,0,0|1,0,1]=4 19934 B16R1.693 COCCCCOC(C)Cc1ccccc1 7a_100000748627_100000730899 [0,2,0,0,0,0|1,0,1]=4 19935 B16R1.693 COCCCNCC(=O)Nc1ccccc1 34a_100150723488_100000182850 [0,2,0,0,0,0|2,0,0]=4 19936 B16R1.693 COCCCNCC(=O)Oc1ccccc1 34a_100150723488_100009813826 [0,2,0,0,0,0|2,0,0]=4 19937 B16R1.693 COCCCNNC(=O)C[n+]1ccccc1 22a_100025702787_200000086051 [0,2,0,0,0,0|2,0,0]=4 19938 B16R1.693 COCCCNNC(=O)Cc1ccccn1 22a_100025702787_100000233486 [0,2,0,0,0,0|2,0,0]=4 19939 B16R1.693 COCCCNNC(=O)Cc1cccnc1 22a_100025702787_100000737805 [0,2,0,0,0,0|2,0,0]=4 19940 B16R1.693 COCCCNNC(=O)Cc1ccncc1 22a_100025702787_100011201483 [0,2,0,0,0,0|2,0,0]=4 19941 B16R1.693 COCCCOC/C(=C/c1ccccc1)/C 34a_200025717232_100000740836 [0,2,0,0,0,0|1,0,1]=4 19942 B16R1.693 COCCCOC/C(=C/c1ccccc1)/C 7a_200025717232_100000740836 [0,2,0,0,0,0|1,0,1]=4 19943 B16R1.693 COCCCOCC(=O)Nc1ccccc1 34a_100000246334_100000740836 [0,2,0,0,0,0|1,0,0]=3 19944 B16R1.693 COCCCOCC(=O)Nc1ccccc1 34a_100000740835_100000182850 [0,2,0,0,0,0|1,0,0]=3 19945 B16R1.693 COCCCOCC(=O)Oc1ccccc1 34a_100000740835_100009813826 [0,2,0,0,0,0|1,0,0]=3 19946 B16R1.693 COCCCOCC(C)Cc1ccccc1 34a_100012125295_100000740836 [0,2,0,0,0,0|1,0,1]=4 19947 B16R1.693 COCCCOCC(C)Cc1ccccc1 7a_100012125295_100000740836 [0,2,0,0,0,0|1,0,1]=4 19948 B16R1.693 COCCCOCC(N)Cc1ccccc1 34a_100000739027_100000740836 [0,2,0,0,0,0|1,0,1]=4 19949 B16R1.693 COCCCOC[C@@H](O)Cc1ccccc1 34a_100000740835_100000729385 [0,2,0,0,0,0|0,0,2]=4 19950 B16R1.693 COCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000709357 [0,2,0,0,0,0|0,1,0]=3 19951 B16R1.693 COCCCSCC(=O)Cc1ccccc1 62a_100000709357_100000233483 [0,2,0,0,0,0|0,1,0]=3 19952 B16R1.693 COCCCSCC(=O)Nc1ccccc1 62a_100000709357_100000182850 [0,2,0,0,0,0|1,1,0]=4 19953 B16R1.693 COCCCSCC(=O)Nc1ccccc1 62a_100012148978_100000709357 [0,2,0,0,0,0|1,1,0]=4 19954 B16R1.693 COCCCSCC(=O)Oc1ccccc1 62a_100000709357_100009813826 [0,2,0,0,0,0|1,1,0]=4 19955 B16R1.693 COCCCSCC(=O)Oc1ccccc1 62a_100009813826_100000709357 [0,2,0,0,0,0|1,1,0]=4 19956 B16R1.693 COCCNCCC(=O)Nc1ccccc1 2230a_100000209980_100000242058 [0,2,0,0,0,0|2,0,0]=4 19957 B16R1.693 COCCNCCC(=O)Oc1ccccc1 2230a_100000209980_200000035796 [0,2,0,0,0,0|2,0,0]=4 19958 B16R1.693 COCCOCCC(=O)C[n+]1ccccc1 1458a_200000086051_100000695917 [0,2,0,0,0,0|2,0,0]=4 19959 B16R1.693 COCCOCCC(=O)Cc1ccccc1 1458a_100000745395_100015291786 [0,2,0,0,0,0|1,0,0]=3 19960 B16R1.693 COCCOCCC(=O)Cc1ccccn1 1458a_100000233486_100000695917 [0,2,0,0,0,0|2,0,0]=4 19961 B16R1.693 COCCOCCC(=O)Cc1ccccn1 1458a_100000745395_100000721315 [0,2,0,0,0,0|2,0,0]=4 19962 B16R1.693 COCCOCCC(=O)Cc1cccnc1 1458a_100000737805_100000695917 [0,2,0,0,0,0|2,0,0]=4 19963 B16R1.693 COCCOCCC(=O)Cc1cccnc1 1458a_100000745395_100000733263 [0,2,0,0,0,0|2,0,0]=4 19964 B16R1.693 COCCOCCC(=O)Cc1ccncc1 1458a_100000745395_100000705612 [0,2,0,0,0,0|2,0,0]=4 19965 B16R1.693 COCCOCCC(=O)Nc1ccccc1 11a_100000106764_100000745395 [0,2,0,0,0,0|2,0,0]=4 19966 B16R1.693 COCCOCCC(=O)Nc1ccccc1 1626a_100000106764_100000745395 [0,2,0,0,0,0|2,0,0]=4 19967 B16R1.693 COCCOCCC(=O)Nc1ccccc1 22a_100000106764_100000745395 [0,2,0,0,0,0|2,0,0]=4 19968 B16R1.693 COCCOCCC(=O)Nc1ccccc1 34a_100000210237_100000242058 [0,2,0,0,0,0|2,0,0]=4 19969 B16R1.693 COCCOCCC(=O)Nc1ccccc1 527a_100000106764_100000745395 [0,2,0,0,0,0|2,0,0]=4 19970 B16R1.693 COCCSCCC(=O)Nc1ccccc1 62a_100000233755_100000242058 [0,2,0,0,0,0|2,0,0]=4 19971 B16R1.693 COCCSCCC(=O)Oc1ccccc1 62a_100000233755_200000035796 [0,2,0,0,0,0|2,0,0]=4 19972 B16R1.693 COCSCCCC(=O)Nc1ccccc1 62a_100000766300_100011194425 [0,2,0,0,0,0|2,0,0]=4 19973 B16R1.693 CSCCC=NNC(=O)Cc1ccccc1 4a_100000182964_100000210997 [0,2,0,0,0,0|1,0,1]=4 19974 B16R1.693 CSCCCCOC(C)Cc1ccccc1 34a_100011217163_200011218536 [0,2,0,0,0,0|1,0,1]=4 19975 B16R1.693 CSCCCCOC(C)Cc1ccccc1 7a_100011217163_200011218536 [0,2,0,0,0,0|1,0,1]=4 19976 B16R1.693 CSCCCNCC(=O)Cc1ccccc1 2230a_100000749238_100000233483 [0,2,0,0,0,0|1,0,0]=3 19977 B16R1.693 CSCCCNCC(=O)Nc1ccccc1 2230a_100000749238_100000182850 [0,2,0,0,0,0|2,0,0]=4 19978 B16R1.693 CSCCCNCC(=O)Oc1ccccc1 2230a_100000749238_100009813826 [0,2,0,0,0,0|2,0,0]=4 19979 B16R1.693 CSCCCOCC(=O)Cc1ccccc1 7a_100000690336_100000233483 [0,2,0,0,0,0|0,0,0]=2 19980 B16R1.693 CSCCCOCC(=O)Nc1ccccc1 34a_100000690336_100000182850 [0,2,0,0,0,0|1,0,0]=3 19981 B16R1.693 CSCCCOCC(=O)Nc1ccccc1 7a_100000690336_100000182850 [0,2,0,0,0,0|1,0,0]=3 19982 B16R1.693 CSCCCOCC(=O)Nc1ccccn1 7a_100000690336_100020662008 [0,2,0,0,0,0|2,0,0]=4 19983 B16R1.693 CSCCCOCC(=O)Nc1ccncc1 7a_100000690336_100000754145 [0,2,0,0,0,0|2,0,0]=4 19984 B16R1.693 CSCCCOCC(=O)Oc1ccccc1 34a_100000690336_100009813826 [0,2,0,0,0,0|1,0,0]=3 19985 B16R1.693 CSCCCOCC(=O)Oc1ccccc1 7a_100000690336_100009813826 [0,2,0,0,0,0|1,0,0]=3 19986 B16R1.693 CSCCCOC[C@@H](O)Cc1ccccc1 34a_100000690336_100000729385 [0,2,0,0,0,0|0,0,2]=4 19987 B16R1.693 CSCCCOC[C@@H](O)Cc1ccccc1 7a_100000690336_100000729385 [0,2,0,0,0,0|0,0,2]=4 19988 B16R1.693 CSCCNCCC(=O)Nc1ccccc1 2230a_100020590264_100000242058 [0,2,0,0,0,0|2,0,0]=4 19989 B16R1.693 CSCCNCCC(=O)Oc1ccccc1 2230a_100020590264_200000035796 [0,2,0,0,0,0|2,0,0]=4 19990 B16R1.693 CSCCOCCC(=O)Nc1ccccc1 34a_100000230434_100000242058 [0,2,0,0,0,0|2,0,0]=4 19991 B16R1.693 CSCCOCCC(=O)Nc1ccccc1 7a_100000230434_100000242058 [0,2,0,0,0,0|2,0,0]=4 19992 B16R1.693 CSCCOCCC(=O)Oc1ccccc1 7a_100000230434_200000035796 [0,2,0,0,0,0|2,0,0]=4 19993 B16R1.693 CSCCSCCC(=O)Nc1ccccc1 62a_100000212216_100000242058 [0,2,0,0,0,0|2,0,0]=4 19994 B16R1.693 CSCCSCCC(=O)Oc1ccccc1 62a_100000212216_200000035796 [0,2,0,0,0,0|2,0,0]=4 19995 B16R1.693 CSCNCCCC(=O)Nc1ccccc1 34a_100000750157_100011218213 [0,2,0,0,0,0|2,0,0]=4 19996 B16R1.693 CSCSCCCC(=O)Nc1ccccc1 62a_100011218213_100011194425 [0,2,0,0,0,0|2,0,0]=4 19997 B16R1.693 N#CCCCCCC(=O)C[n+]1ccccc1 1458a_200000086051_100009813376 [0,2,0,0,0,0|2,0,0]=4 19998 B16R1.693 N#CCCCCCC(=O)Cc1ccccn1 1458a_100000233486_100009813376 [0,2,0,0,0,0|2,0,0]=4 19999 B16R1.693 N#CCCCCCC(=O)Cc1cccnc1 1458a_100000737805_100009813376 [0,2,0,0,0,0|2,0,0]=4 20000 B16R1.693 N#CCCCCNC(=O)C[n+]1ccccc1 11a_100000751965_200000086051 [0,2,0,0,0,0|2,0,0]=4 20001 B16R1.693 N#CCCCCNC(=O)C[n+]1ccccc1 240690a_100000751965_200000086051 [0,2,0,0,0,0|2,0,0]=4 20002 B16R1.693 N#CCCCCNC(=O)C[n+]1ccccc1 527a_100000751965_200000086051 [0,2,0,0,0,0|2,0,0]=4 20003 B16R1.693 N#CCCCCNC(=O)Cc1ccccn1 11a_100000751965_100000233486 [0,2,0,0,0,0|2,0,0]=4 20004 B16R1.693 N#CCCCCNC(=O)Cc1cccnc1 11a_100000751965_100000737805 [0,2,0,0,0,0|2,0,0]=4 20005 B16R1.693 N#CCCCCNC(=O)Cc1cccnc1 240690a_100000751965_100000737805 [0,2,0,0,0,0|2,0,0]=4 20006 B16R1.693 N#CCCCCNC(=O)Cc1cccnc1 527a_100000751965_100000737805 [0,2,0,0,0,0|2,0,0]=4 20007 B16R1.693 N#CCCCCNC(=O)Cc1ccncc1 11a_100000751965_100011201483 [0,2,0,0,0,0|2,0,0]=4 20008 B16R1.693 N#CCCCCNC(=O)Cc1ccncc1 240690a_100000751965_100011201483 [0,2,0,0,0,0|2,0,0]=4 20009 B16R1.693 N#CCCCCNC(=O)Nc1ccccc1 2430a_100000106764_100000751965 [0,2,0,0,0,0|2,0,0]=4 20010 B16R1.693 N#CCCCSCC(=O)Cc1ccccc1 62a_100000233483_100000687738 [0,2,0,0,0,0|0,1,1]=4 20011 B16R1.693 N#CCCCSCC(=O)Cc1ccccc1 62a_100000687738_100000233483 [0,2,0,0,0,0|0,1,1]=4 20012 B16R1.693 NC(COCCCCF)Cc1ccccc1 34a_100000739027_100000729493 [0,2,0,0,0,0|1,0,1]=4 20013 B16R1.693 NC(COCCCCO)Cc1ccccc1 34a_100000739027_100011216708 [0,2,0,0,0,0|1,0,1]=4 20014 B16R1.693 NCCCCOCC(=O)Nc1ccccc1 34a_100000750430_100000182850 [0,2,0,0,0,0|1,0,0]=3 20015 B16R1.693 NCCCCOCC(=O)Oc1ccccc1 34a_100000750430_100009813826 [0,2,0,0,0,0|1,0,0]=3 20016 B16R1.693 NCCCCOC[C@@H](O)Cc1ccccc1 34a_100000750430_100000729385 [0,2,0,0,0,0|0,0,2]=4 20017 B16R1.693 NCCCOCCC(=O)Nc1ccccc1 34a_100000182051_100000242058 [0,2,0,0,0,0|2,0,0]=4 20018 B16R1.693 NCCOCCCC(=O)Nc1ccccc1 34a_100000210304_100011194425 [0,2,0,0,0,0|2,0,0]=4 20019 B16R1.693 O=C(CCCCCCF)C[n+]1ccccc1 1458a_200000086051_100015922095 [0,2,0,0,0,0|2,0,0]=4 20020 B16R1.693 O=C(CCCCCCF)Cc1ccccn1 1458a_100000233486_100015922095 [0,2,0,0,0,0|2,0,0]=4 20021 B16R1.693 O=C(CCCCCCF)Cc1cccnc1 1458a_100000737805_100015922095 [0,2,0,0,0,0|2,0,0]=4 20022 B16R1.693 O=C(CCCCCCO)C[n+]1ccccc1 1458a_200000086051_100000766143 [0,2,0,0,0,0|2,0,0]=4 20023 B16R1.693 O=C(CCCCCCO)Cc1ccccc1 1458a_100011996774_100015291786 [0,2,0,0,0,0|1,0,0]=3 20024 B16R1.693 O=C(CCCCCCO)Cc1ccccn1 1458a_100000233486_100000766143 [0,2,0,0,0,0|2,0,0]=4 20025 B16R1.693 O=C(CCCCCCO)Cc1ccccn1 1458a_100011996774_100000721315 [0,2,0,0,0,0|2,0,0]=4 20026 B16R1.693 O=C(CCCCCCO)Cc1cccnc1 1458a_100000737805_100000766143 [0,2,0,0,0,0|2,0,0]=4 20027 B16R1.693 O=C(CCCCCCO)Cc1cccnc1 1458a_100011996774_100000733263 [0,2,0,0,0,0|2,0,0]=4 20028 B16R1.693 O=C(CCCCCCO)Cc1ccncc1 1458a_100011996774_100000705612 [0,2,0,0,0,0|2,0,0]=4 20029 B16R1.693 O=C(CCCNCCF)Nc1ccccc1 34a_100000724931_100011194425 [0,2,0,0,0,0|2,0,0]=4 20030 B16R1.693 O=C(CCCNCCF)Nc1ccccc1 34a_100000750157_100011217306 [0,2,0,0,0,0|2,0,0]=4 20031 B16R1.693 O=C(CCCNCCO)Nc1ccccc1 2230a_100016997473_100011194425 [0,2,0,0,0,0|2,0,0]=4 20032 B16R1.693 O=C(CCCNCCO)Nc1ccccc1 34a_100000750157_100000211926 [0,2,0,0,0,0|2,0,0]=4 20033 B16R1.693 O=C(CCCNCCO)Nc1ccccc1 34a_100016990907_100011194425 [0,2,0,0,0,0|2,0,0]=4 20034 B16R1.693 O=C(CCCOCCBr)Nc1ccccc1 34a_100000211926_100011194425 [0,2,0,0,0,0|2,0,0]=4 20035 B16R1.693 O=C(CCCSCCF)Nc1ccccc1 62a_100011217306_100011194425 [0,2,0,0,0,0|2,0,0]=4 20036 B16R1.693 O=C(CCCSCCO)Nc1ccccc1 62a_100000211926_100011194425 [0,2,0,0,0,0|2,0,0]=4 20037 B16R1.693 O=C(CCNCCCF)Nc1ccccc1 2230a_100015189416_100000242058 [0,2,0,0,0,0|2,0,0]=4 20038 B16R1.693 O=C(CCNCCCF)Nc1ccccc1 34a_100015189416_100000242058 [0,2,0,0,0,0|2,0,0]=4 20039 B16R1.693 O=C(CCNCCCF)Oc1ccccc1 2230a_100015189416_200000035796 [0,2,0,0,0,0|2,0,0]=4 20040 B16R1.693 O=C(CCOCCCBr)Nc1ccccc1 34a_100011217188_100000242058 [0,2,0,0,0,0|2,0,0]=4 20041 B16R1.693 O=C(CCOCCCCl)Nc1ccccc1 34a_100000230001_100000242058 [0,2,0,0,0,0|2,0,0]=4 20042 B16R1.693 O=C(CCOCCCF)Nc1ccccc1 34a_100000759539_100000242058 [0,2,0,0,0,0|2,0,0]=4 20043 B16R1.693 O=C(CCSCCCF)Nc1ccccc1 62a_100011934791_100000242058 [0,2,0,0,0,0|2,0,0]=4 20044 B16R1.693 O=C(CCSCCCF)Oc1ccccc1 62a_100011934791_200000035796 [0,2,0,0,0,0|2,0,0]=4 20045 B16R1.693 O=C(CCSCCCO)Nc1ccccc1 62a_100011215043_100000242058 [0,2,0,0,0,0|2,0,0]=4 20046 B16R1.693 O=C(CCSCCCO)Oc1ccccc1 62a_100011215043_200000035796 [0,2,0,0,0,0|2,0,0]=4 20047 B16R1.693 O=C(CNCCCCO)Cc1ccccc1 2230a_100000750430_100000233483 [0,2,0,0,0,0|1,0,0]=3 20048 B16R1.693 O=C(CNCCCCO)Nc1ccccc1 2230a_100000750430_100000182850 [0,2,0,0,0,0|2,0,0]=4 20049 B16R1.693 O=C(CNCCCCO)Nc1ccccc1 34a_100000750430_100000182850 [0,2,0,0,0,0|2,0,0]=4 20050 B16R1.693 O=C(CNCCCCO)Oc1ccccc1 2230a_100000750430_100009813826 [0,2,0,0,0,0|2,0,0]=4 20051 B16R1.693 O=C(CNCCCCO)Oc1ccccc1 34a_100000750430_100009813826 [0,2,0,0,0,0|2,0,0]=4 20052 B16R1.693 O=C(COCCCCBr)Nc1ccccc1 34a_100011216708_100000182850 [0,2,0,0,0,0|1,0,0]=3 20053 B16R1.693 O=C(COCCCCBr)Oc1ccccc1 34a_100011216708_100009813826 [0,2,0,0,0,0|1,0,0]=3 20054 B16R1.693 O=C(COCCCCCl)Cc1ccccc1 7a_100000210776_100000233483 [0,2,0,0,0,0|0,0,0]=2 20055 B16R1.693 O=C(COCCCCCl)Nc1ccccc1 34a_100000210776_100000182850 [0,2,0,0,0,0|1,0,0]=3 20056 B16R1.693 O=C(COCCCCCl)Nc1ccccc1 7a_100000210776_100000182850 [0,2,0,0,0,0|1,0,0]=3 20057 B16R1.693 O=C(COCCCCCl)Nc1ccccn1 7a_100000210776_100020662008 [0,2,0,0,0,0|2,0,0]=4 20058 B16R1.693 O=C(COCCCCCl)Nc1ccncc1 7a_100000210776_100000754145 [0,2,0,0,0,0|2,0,0]=4 20059 B16R1.693 O=C(COCCCCCl)Oc1ccccc1 34a_100000210776_100009813826 [0,2,0,0,0,0|1,0,0]=3 20060 B16R1.693 O=C(COCCCCCl)Oc1ccccc1 7a_100000210776_100009813826 [0,2,0,0,0,0|1,0,0]=3 20061 B16R1.693 O=C(COCCCCF)Cc1ccccc1 7a_100011995726_100000233483 [0,2,0,0,0,0|0,0,0]=2 20062 B16R1.693 O=C(COCCCCF)Nc1ccccc1 34a_100000246334_100000729493 [0,2,0,0,0,0|1,0,0]=3 20063 B16R1.693 O=C(COCCCCF)Nc1ccccc1 34a_100011995726_100000182850 [0,2,0,0,0,0|1,0,0]=3 20064 B16R1.693 O=C(COCCCCF)Nc1ccccc1 7a_100011995726_100000182850 [0,2,0,0,0,0|1,0,0]=3 20065 B16R1.693 O=C(COCCCCF)Nc1ccccn1 7a_100011995726_100020662008 [0,2,0,0,0,0|2,0,0]=4 20066 B16R1.693 O=C(COCCCCF)Nc1ccncc1 7a_100011995726_100000754145 [0,2,0,0,0,0|2,0,0]=4 20067 B16R1.693 O=C(COCCCCF)Oc1ccccc1 34a_100011995726_100009813826 [0,2,0,0,0,0|1,0,0]=3 20068 B16R1.693 O=C(COCCCCF)Oc1ccccc1 7a_100011995726_100009813826 [0,2,0,0,0,0|1,0,0]=3 20069 B16R1.693 O=C(COCCCCI)Nc1ccccc1 34a_200012148704_100000182850 [0,2,0,0,0,0|1,0,0]=3 20070 B16R1.693 O=C(COCCCCI)Oc1ccccc1 34a_200012148704_100009813826 [0,2,0,0,0,0|1,0,0]=3 20071 B16R1.693 O=C(COCCCCO)Nc1ccccc1 34a_100000246334_100011216708 [0,2,0,0,0,0|1,0,0]=3 20072 B16R1.693 O=C(CSCCCCF)Cc1ccccc1 62a_100000233483_100000729493 [0,2,0,0,0,0|0,1,0]=3 20073 B16R1.693 O=C(CSCCCCF)Cc1ccccc1 62a_100000729493_100000233483 [0,2,0,0,0,0|0,1,0]=3 20074 B16R1.693 O=C(CSCCCCF)Nc1ccccc1 62a_100000729493_100000182850 [0,2,0,0,0,0|1,1,0]=4 20075 B16R1.693 O=C(CSCCCCF)Nc1ccccc1 62a_100012148978_100000729493 [0,2,0,0,0,0|1,1,0]=4 20076 B16R1.693 O=C(CSCCCCF)Oc1ccccc1 62a_100000729493_100009813826 [0,2,0,0,0,0|1,1,0]=4 20077 B16R1.693 O=C(CSCCCCF)Oc1ccccc1 62a_100009813826_100000729493 [0,2,0,0,0,0|1,1,0]=4 20078 B16R1.693 O=C(CSCCCCO)Cc1ccccc1 62a_100000210776_100000233483 [0,2,0,0,0,0|0,1,0]=3 20079 B16R1.693 O=C(CSCCCCO)Cc1ccccc1 62a_100000233483_100000210776 [0,2,0,0,0,0|0,1,0]=3 20080 B16R1.693 O=C(CSCCCCO)Nc1ccccc1 62a_100000210776_100000182850 [0,2,0,0,0,0|1,1,0]=4 20081 B16R1.693 O=C(CSCCCCO)Nc1ccccc1 62a_100012148978_100000210776 [0,2,0,0,0,0|1,1,0]=4 20082 B16R1.693 O=C(CSCCCCO)Oc1ccccc1 62a_100000210776_100009813826 [0,2,0,0,0,0|1,1,0]=4 20083 B16R1.693 O=C(CSCCCCO)Oc1ccccc1 62a_100009813826_100000210776 [0,2,0,0,0,0|1,1,0]=4 20084 B16R1.693 O=C(C[n+]1ccccc1)NCCCCCO 240690a_100000762737_200000086051 [0,2,0,0,0,0|2,0,0]=4 20085 B16R1.693 O=C(C[n+]1ccccc1)NCCOCCO 240690a_100000211614_200000086051 [0,2,0,0,0,0|2,0,0]=4 20086 B16R1.693 O=C(C[n+]1ccccc1)NCCSCCO 240690a_100011219999_200000086051 [0,2,0,0,0,0|2,0,0]=4 20087 B16R1.693 O=C(C[n+]1ccccc1)NCCSCCO 527a_100011219999_200000086051 [0,2,0,0,0,0|2,0,0]=4 20088 B16R1.693 O=C(Cc1cccnc1)NCCCCCO 240690a_100000762737_100000737805 [0,2,0,0,0,0|2,0,0]=4 20089 B16R1.693 O=C(Cc1cccnc1)NCCOCCO 240690a_100000211614_100000737805 [0,2,0,0,0,0|2,0,0]=4 20090 B16R1.693 O=C(Cc1cccnc1)NCCSCCO 240690a_100011219999_100000737805 [0,2,0,0,0,0|2,0,0]=4 20091 B16R1.693 O=C(Cc1cccnc1)NCCSCCO 527a_100011219999_100000737805 [0,2,0,0,0,0|2,0,0]=4 20092 B16R1.693 O=C(Cc1ccncc1)NCCCCCO 240690a_100000762737_100011201483 [0,2,0,0,0,0|2,0,0]=4 20093 B16R1.693 O=C(Cc1ccncc1)NCCOCCO 240690a_100000211614_100011201483 [0,2,0,0,0,0|2,0,0]=4 20094 B16R1.693 O=C(Cc1ccncc1)NCCSCCO 240690a_100011219999_100011201483 [0,2,0,0,0,0|2,0,0]=4 20095 B16R1.693 O=C(NCCCCCO)Nc1ccccc1 2430a_100000106764_100000762737 [0,2,0,0,0,0|2,0,0]=4 20096 B16R1.693 O=C(NCCOCCO)Nc1ccccc1 2430a_100000106764_100000211614 [0,2,0,0,0,0|2,0,0]=4 20097 B16R1.693 O=C(NCCSCCO)Nc1ccccc1 2430a_100000106764_100011219999 [0,2,0,0,0,0|2,0,0]=4 20098 B16R1.693 O=CCCCSCC(=O)Cc1ccccc1 62a_100000233483_200011292268 [0,2,0,0,0,0|0,1,1]=4 20099 B16R1.693 O=CCCCSCC(=O)Cc1ccccc1 62a_200011292268_100000233483 [0,2,0,0,0,0|0,1,1]=4 20100 B16R1.693 O[C@H](COCCCCBr)Cc1ccccc1 34a_100011216708_100000729385 [0,2,0,0,0,0|0,0,2]=4 20101 B16R1.693 O[C@H](COCCCCCl)Cc1ccccc1 34a_100000210776_100000729385 [0,2,0,0,0,0|0,0,2]=4 20102 B16R1.693 O[C@H](COCCCCCl)Cc1ccccc1 7a_100000210776_100000729385 [0,2,0,0,0,0|0,0,2]=4 20103 B16R1.693 O[C@H](COCCCCF)Cc1ccccc1 34a_100011995726_100000729385 [0,2,0,0,0,0|0,0,2]=4 20104 B16R1.693 O[C@H](COCCCCF)Cc1ccccc1 7a_100011995726_100000729385 [0,2,0,0,0,0|0,0,2]=4 20105 B16R1.693 O[C@H](COCCCCI)Cc1ccccc1 34a_200012148704_100000729385 [0,2,0,0,0,0|0,0,2]=4 20106 B16R1.693 [N-]=[N+]=NCCCCC(=O)Cc1ccccc1 1458a_100000070148_100015291786 [0,2,0,0,0,0|2,0,0]=4 20107 B16R1.705 C#CCCCCC(=O)C(C)c1ccccc1 1458a_100000696528_100000230085 [0,2,0,0,0,0|1,0,1]=4 20108 B16R1.705 C#CCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100010269958 [0,2,0,0,0,0|1,0,1]=4 20109 B16R1.705 C#CCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100010269958 [0,2,0,0,0,0|1,0,1]=4 20110 B16R1.705 C#CCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100010269958 [0,2,0,0,0,0|1,0,1]=4 20111 B16R1.705 C#CCCCNC(=O)C(F)c1ccccc1 11a_100000718082_100000698975 [0,2,0,0,0,0|1,0,1]=4 20112 B16R1.705 C#CCCCNC(=O)C(F)c1ccccc1 1626a_100000718082_100000698975 [0,2,0,0,0,0|1,0,1]=4 20113 B16R1.705 C#CCCCNC(=O)C(F)c1ccccc1 240690a_100000718082_100000698975 [0,2,0,0,0,0|1,0,1]=4 20114 B16R1.705 C#CCCCNC(=O)C(F)c1ccccc1 527a_100000718082_100000698975 [0,2,0,0,0,0|1,0,1]=4 20115 B16R1.705 C#CCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000718082_100000751047 [0,2,0,0,0,0|1,0,1]=4 20116 B16R1.705 C#CCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000718082_100000751047 [0,2,0,0,0,0|1,0,1]=4 20117 B16R1.705 C#CCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000718082_100000751047 [0,2,0,0,0,0|1,0,1]=4 20118 B16R1.705 C#CCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000718082_100000751047 [0,2,0,0,0,0|1,0,1]=4 20119 B16R1.705 C#CCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000718082_100000684486 [0,2,0,0,0,0|1,0,1]=4 20120 B16R1.705 C=C(C(=O)CCCCCC)c1ccccc1 1458a_100000065200_100000210757 [0,2,0,0,0,0|1,0,1]=4 20121 B16R1.705 C=C(C(=O)CCCCCF)c1ccccc1 1458a_100000065200_100000729378 [0,2,0,0,0,0|1,0,1]=4 20122 B16R1.705 C=C(C(=O)CCCCCO)c1ccccc1 1458a_100000065200_100000746330 [0,2,0,0,0,0|1,0,1]=4 20123 B16R1.705 C=C(C(=O)CCCCOC)c1ccccc1 1458a_100000065200_100000755781 [0,2,0,0,0,0|1,0,1]=4 20124 B16R1.705 C=C(C(=O)CCCOCC)c1ccccc1 1458a_100000065200_100012232248 [0,2,0,0,0,0|1,0,1]=4 20125 B16R1.705 C=C(C(=O)CCOCCC)c1ccccc1 1458a_100000065200_100011215938 [0,2,0,0,0,0|1,0,1]=4 20126 B16R1.705 C=C(C(=O)COCCCC)c1ccccc1 1458a_100000065200_100011995733 [0,2,0,0,0,0|0,0,1]=3 20127 B16R1.705 C=C(C(=O)NCCCCC)c1ccccc1 1626a_100000209983_100000065200 [0,2,0,0,0,0|1,0,1]=4 20128 B16R1.705 C=C(C(=O)NCCCOC)c1ccccc1 1626a_100150723488_100000065200 [0,2,0,0,0,0|1,0,1]=4 20129 B16R1.705 C=C(C(=O)NCCCSC)c1ccccc1 1626a_100000749238_100000065200 [0,2,0,0,0,0|1,0,1]=4 20130 B16R1.705 C=C(C(=O)NCCOCC)c1ccccc1 1626a_102516460346_100000065200 [0,2,0,0,0,0|1,0,1]=4 20131 B16R1.705 C=C(C(=O)NCCSCC)c1ccccc1 1626a_100000106463_100000065200 [0,2,0,0,0,0|1,0,1]=4 20132 B16R1.705 C=C(C(=O)NNCCCC)c1ccccc1 22a_100025702795_100000065200 [0,2,0,0,0,0|1,0,1]=4 20133 B16R1.705 C=CCCCCC(=O)C(C)c1ccccc1 1458a_100011215552_100000230085 [0,2,0,0,0,0|1,0,1]=4 20134 B16R1.705 C=CCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215482 [0,2,0,0,0,0|1,0,1]=4 20135 B16R1.705 C=CCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011215482 [0,2,0,0,0,0|1,0,1]=4 20136 B16R1.705 C=CCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215482 [0,2,0,0,0,0|1,0,1]=4 20137 B16R1.705 C=CCCCNC(=O)C(F)c1ccccc1 11a_100000700776_100000698975 [0,2,0,0,0,0|1,0,1]=4 20138 B16R1.705 C=CCCCNC(=O)C(F)c1ccccc1 1626a_100000700776_100000698975 [0,2,0,0,0,0|1,0,1]=4 20139 B16R1.705 C=CCCCNC(=O)C(F)c1ccccc1 240690a_100000700776_100000698975 [0,2,0,0,0,0|1,0,1]=4 20140 B16R1.705 C=CCCCNC(=O)C(F)c1ccccc1 527a_100000700776_100000698975 [0,2,0,0,0,0|1,0,1]=4 20141 B16R1.705 C=CCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000700776_100000751047 [0,2,0,0,0,0|1,0,1]=4 20142 B16R1.705 C=CCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000700776_100000751047 [0,2,0,0,0,0|1,0,1]=4 20143 B16R1.705 C=CCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000700776_100000751047 [0,2,0,0,0,0|1,0,1]=4 20144 B16R1.705 C=CCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000700776_100000751047 [0,2,0,0,0,0|1,0,1]=4 20145 B16R1.705 C=CCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000700776_100000684486 [0,2,0,0,0,0|1,0,1]=4 20146 B16R1.705 CC(C(=O)CCCCCF)c1ccccn1 1458a_100000722050_100000729378 [0,2,0,0,0,0|2,0,0]=4 20147 B16R1.705 CC(C(=O)CCCCCO)c1ccccc1 1458a_100102619762_100000230085 [0,2,0,0,0,0|1,0,0]=3 20148 B16R1.705 CC(C(=O)CCCCCO)c1ccccn1 1458a_100000722050_100000746330 [0,2,0,0,0,0|2,0,0]=4 20149 B16R1.705 CC(C(=O)CCOCCO)c1ccccc1 1458a_100011229844_100000230085 [0,2,0,0,0,0|2,0,0]=4 20150 B16R1.705 CC(C(=O)NCCCCO)c1ccccn1 240690a_100000750430_100000722050 [0,2,0,0,0,0|2,0,0]=4 20151 B16R1.705 CC(C(=O)NCCCCO)c1ccccn1 527a_100000750430_100000722050 [0,2,0,0,0,0|2,0,0]=4 20152 B16R1.705 CC/C=C\CCC(=O)C(F)c1ccccc1 1458a_100000698975_100015370543 [0,2,0,0,0,0|1,0,1]=4 20153 B16R1.705 CC/C=C\CCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100015370543 [0,2,0,0,0,0|1,0,1]=4 20154 B16R1.705 CC/C=C\CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100015370543 [0,2,0,0,0,0|1,0,1]=4 20155 B16R1.705 CCC/C=C/CC(=O)C(C)c1ccccc1 1458a_200016266809_100000230085 [0,2,0,0,0,0|1,0,1]=4 20156 B16R1.705 CCCCC=CC(=O)C(C)c1ccccc1 1458a_100016266645_100000230085 [0,2,0,0,0,0|1,0,0]=3 20157 B16R1.705 CCCCC=CC(=O)N(C)c1ccccc1 11a_100000210012_100016266645 [0,2,0,0,0,0|2,0,0]=4 20158 B16R1.705 CCCCC=CC(=O)N(C)c1ccccc1 1626a_100000210012_100016266645 [0,2,0,0,0,0|2,0,0]=4 20159 B16R1.705 CCCCC=CC(=O)N(C)c1ccccc1 22a_100000210012_100016266645 [0,2,0,0,0,0|2,0,0]=4 20160 B16R1.705 CCCCCCC(=O)C(C)c1ccccc1 1458a_100102632555_100000230085 [0,2,0,0,0,0|1,0,0]=3 20161 B16R1.705 CCCCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210757 [0,2,0,0,0,0|2,0,0]=4 20162 B16R1.705 CCCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210757 [0,2,0,0,0,0|1,0,0]=3 20163 B16R1.705 CCCCCCC(=O)N(C)c1ccccc1 11a_100000210012_100102632555 [0,2,0,0,0,0|2,0,0]=4 20164 B16R1.705 CCCCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100102632555 [0,2,0,0,0,0|2,0,0]=4 20165 B16R1.705 CCCCCCC(=O)N(C)c1ccccc1 22a_100000210012_100102632555 [0,2,0,0,0,0|2,0,0]=4 20166 B16R1.705 CCCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210757 [0,2,0,0,0,0|1,0,0]=3 20167 B16R1.705 CCCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210757 [0,2,0,0,0,0|1,0,0]=3 20168 B16R1.705 CCCCCNC(=O)C(C)c1ccccn1 11a_100000209983_100000722050 [0,2,0,0,0,0|2,0,0]=4 20169 B16R1.705 CCCCCNC(=O)C(C)c1ccccn1 1626a_100000209983_100000722050 [0,2,0,0,0,0|2,0,0]=4 20170 B16R1.705 CCCCCNC(=O)C(C)c1ccccn1 240690a_100000209983_100000722050 [0,2,0,0,0,0|2,0,0]=4 20171 B16R1.705 CCCCCNC(=O)C(C)c1ccccn1 527a_100000209983_100000722050 [0,2,0,0,0,0|2,0,0]=4 20172 B16R1.705 CCCCCNC(=O)C(F)c1ccccc1 11a_100000209983_100000698975 [0,2,0,0,0,0|1,0,0]=3 20173 B16R1.705 CCCCCNC(=O)C(F)c1ccccc1 1626a_100000209983_100000698975 [0,2,0,0,0,0|1,0,0]=3 20174 B16R1.705 CCCCCNC(=O)C(F)c1ccccc1 240690a_100000209983_100000698975 [0,2,0,0,0,0|1,0,0]=3 20175 B16R1.705 CCCCCNC(=O)C(F)c1ccccc1 527a_100000209983_100000698975 [0,2,0,0,0,0|1,0,0]=3 20176 B16R1.705 CCCCCNC(=O)N(C)c1ccccc1 512a_100000209983_100000210012 [0,2,0,0,0,0|2,0,0]=4 20177 B16R1.705 CCCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000209983_100000751047 [0,2,0,0,0,0|1,0,0]=3 20178 B16R1.705 CCCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000209983_100000751047 [0,2,0,0,0,0|1,0,0]=3 20179 B16R1.705 CCCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000209983_100000751047 [0,2,0,0,0,0|1,0,0]=3 20180 B16R1.705 CCCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000209983_100000751047 [0,2,0,0,0,0|1,0,0]=3 20181 B16R1.705 CCCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000209983_100000684486 [0,2,0,0,0,0|1,0,0]=3 20182 B16R1.705 CCCCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000718602 [0,2,0,0,0,0|1,0,1]=4 20183 B16R1.705 CCCCNCC(=O)N(C)c1ccccc1 2230a_100000102301_100000183487 [0,2,0,0,0,0|2,0,0]=4 20184 B16R1.705 CCCCNCC(=O)N(C)c1ccccc1 2230a_200000174886_100000210211 [0,2,0,0,0,0|2,0,0]=4 20185 B16R1.705 CCCCNCC(=O)N(C)c1ccccc1 7a_106832991798_100000183487 [0,2,0,0,0,0|2,0,0]=4 20186 B16R1.705 CCCCNNC(=O)C(C)c1ccccn1 22a_100025702795_100000722050 [0,2,0,0,0,0|2,0,0]=4 20187 B16R1.705 CCCCNNC(=O)C(F)c1ccccc1 22a_100025702795_100000698975 [0,2,0,0,0,0|1,0,0]=3 20188 B16R1.705 CCCCNNC(=O)N(C)c1ccccc1 512a_100025702795_100000210012 [0,2,0,0,0,0|2,0,0]=4 20189 B16R1.705 CCCCNNC(=O)[C@@H](C)c1ccccc1 22a_100025702795_100000751047 [0,2,0,0,0,0|1,0,0]=3 20190 B16R1.705 CCCCNNC(=O)[C@H](O)c1ccccc1 22a_100025702795_100000684486 [0,2,0,0,0,0|1,0,0]=3 20191 B16R1.705 CCCCOCC(=O)C(C)c1ccccc1 1458a_100000757543_100000230085 [0,2,0,0,0,0|0,0,0]=2 20192 B16R1.705 CCCCOCC(=O)C(C)c1ccccn1 1458a_100000722050_100011995733 [0,2,0,0,0,0|1,0,0]=3 20193 B16R1.705 CCCCOCC(=O)C(C)c1cnccn1 1458a_100000757543_200000703233 [0,2,0,0,0,0|2,0,0]=4 20194 B16R1.705 CCCCOCC(=O)C(F)c1ccccc1 1458a_100000698975_100011995733 [0,2,0,0,0,0|0,0,0]=2 20195 B16R1.705 CCCCOCC(=O)N(C)c1ccccc1 11a_100000210012_100000757543 [0,2,0,0,0,0|1,0,0]=3 20196 B16R1.705 CCCCOCC(=O)N(C)c1ccccc1 1626a_100000210012_100000757543 [0,2,0,0,0,0|1,0,0]=3 20197 B16R1.705 CCCCOCC(=O)N(C)c1ccccc1 22a_100000210012_100000757543 [0,2,0,0,0,0|1,0,0]=3 20198 B16R1.705 CCCCOCC(=O)N(C)c1ccccc1 34a_100000210227_100000183487 [0,2,0,0,0,0|1,0,0]=3 20199 B16R1.705 CCCCOCC(=O)N(C)c1ccccc1 7a_100000210227_100000183487 [0,2,0,0,0,0|1,0,0]=3 20200 B16R1.705 CCCCOCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011995733 [0,2,0,0,0,0|0,0,0]=2 20201 B16R1.705 CCCCOCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011995733 [0,2,0,0,0,0|0,0,0]=2 20202 B16R1.705 CCCCOCN(C)C(C)c1ccccc1 2230a_100000195388_100011995733 [0,2,0,0,0,0|2,0,0]=4 20203 B16R1.705 CCCCOCN(C)C(C)c1ccccc1 269982a_100000195388_100011995733 [0,2,0,0,0,0|2,0,0]=4 20204 B16R1.705 CCCCSCC(=O)C(C)c1ccccc1 1458a_100000191162_100000230085 [0,2,0,0,0,0|0,1,0]=3 20205 B16R1.705 CCCCSCC(=O)N(C)c1ccccc1 11a_100000210012_100000191162 [0,2,0,0,0,0|1,1,0]=4 20206 B16R1.705 CCCCSCC(=O)N(C)c1ccccc1 1626a_100000210012_100000191162 [0,2,0,0,0,0|1,1,0]=4 20207 B16R1.705 CCCCSCC(=O)N(C)c1ccccc1 22a_100000210012_100000191162 [0,2,0,0,0,0|1,1,0]=4 20208 B16R1.705 CCCCSCC(=O)N(C)c1ccccc1 62a_100000183487_100000210210 [0,2,0,0,0,0|1,1,0]=4 20209 B16R1.705 CCCCSCC(=O)N(C)c1ccccc1 62a_100000210211_100000183487 [0,2,0,0,0,0|1,1,0]=4 20210 B16R1.705 CCCOCCC(=O)C(C)c1ccccn1 1458a_100000722050_100011215938 [0,2,0,0,0,0|2,0,0]=4 20211 B16R1.705 CCCOCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215938 [0,2,0,0,0,0|1,0,0]=3 20212 B16R1.705 CCCOCCC(=O)N(C)c1ccccc1 34a_100000210258_100000691765 [0,2,0,0,0,0|2,0,0]=4 20213 B16R1.705 CCCOCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011215938 [0,2,0,0,0,0|1,0,0]=3 20214 B16R1.705 CCCOCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215938 [0,2,0,0,0,0|1,0,0]=3 20215 B16R1.705 CCCSCCC(=O)N(C)c1ccccc1 62a_100000210303_100000691765 [0,2,0,0,0,0|2,0,0]=4 20216 B16R1.705 CCCSCCC(=O)N(C)c1ccccc1 62a_100000691765_100000210303 [0,2,0,0,0,0|2,0,0]=4 20217 B16R1.705 CCOCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100012232248 [0,2,0,0,0,0|2,0,0]=4 20218 B16R1.705 CCOCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100012232248 [0,2,0,0,0,0|1,0,0]=3 20219 B16R1.705 CCOCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100012232248 [0,2,0,0,0,0|1,0,0]=3 20220 B16R1.705 CCOCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100012232248 [0,2,0,0,0,0|1,0,0]=3 20221 B16R1.705 CCOCCNC(=O)C(C)c1ccccn1 11a_100011200944_100000722050 [0,2,0,0,0,0|2,0,0]=4 20222 B16R1.705 CCOCCNC(=O)C(C)c1ccccn1 1626a_102516460346_100000722050 [0,2,0,0,0,0|2,0,0]=4 20223 B16R1.705 CCOCCNC(=O)C(C)c1ccccn1 240690a_100011200944_100000722050 [0,2,0,0,0,0|2,0,0]=4 20224 B16R1.705 CCOCCNC(=O)C(C)c1ccccn1 527a_100011200944_100000722050 [0,2,0,0,0,0|2,0,0]=4 20225 B16R1.705 CCOCCNC(=O)C(F)c1ccccc1 11a_100011200944_100000698975 [0,2,0,0,0,0|1,0,0]=3 20226 B16R1.705 CCOCCNC(=O)C(F)c1ccccc1 1626a_102516460346_100000698975 [0,2,0,0,0,0|1,0,0]=3 20227 B16R1.705 CCOCCNC(=O)C(F)c1ccccc1 240690a_100011200944_100000698975 [0,2,0,0,0,0|1,0,0]=3 20228 B16R1.705 CCOCCNC(=O)C(F)c1ccccc1 527a_100011200944_100000698975 [0,2,0,0,0,0|1,0,0]=3 20229 B16R1.705 CCOCCNC(=O)N(C)c1ccccc1 512a_100011200944_100000210012 [0,2,0,0,0,0|2,0,0]=4 20230 B16R1.705 CCOCCNC(=O)[C@@H](C)c1ccccc1 11a_100011200944_100000751047 [0,2,0,0,0,0|1,0,0]=3 20231 B16R1.705 CCOCCNC(=O)[C@@H](C)c1ccccc1 1626a_102516460346_100000751047 [0,2,0,0,0,0|1,0,0]=3 20232 B16R1.705 CCOCCNC(=O)[C@@H](C)c1ccccc1 240690a_100011200944_100000751047 [0,2,0,0,0,0|1,0,0]=3 20233 B16R1.705 CCOCCNC(=O)[C@@H](C)c1ccccc1 527a_100011200944_100000751047 [0,2,0,0,0,0|1,0,0]=3 20234 B16R1.705 CCOCCNC(=O)[C@H](O)c1ccccc1 240690a_100011200944_100000684486 [0,2,0,0,0,0|1,0,0]=3 20235 B16R1.705 CCOCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000210147 [0,2,0,0,0,0|1,0,1]=4 20236 B16R1.705 CCSCCNC(=O)C(C)c1ccccn1 11a_100000106463_100000722050 [0,2,0,0,0,0|2,0,0]=4 20237 B16R1.705 CCSCCNC(=O)C(C)c1ccccn1 1626a_100000106463_100000722050 [0,2,0,0,0,0|2,0,0]=4 20238 B16R1.705 CCSCCNC(=O)C(C)c1ccccn1 240690a_100000106463_100000722050 [0,2,0,0,0,0|2,0,0]=4 20239 B16R1.705 CCSCCNC(=O)C(C)c1ccccn1 527a_100000106463_100000722050 [0,2,0,0,0,0|2,0,0]=4 20240 B16R1.705 CCSCCNC(=O)C(F)c1ccccc1 11a_100000106463_100000698975 [0,2,0,0,0,0|1,0,0]=3 20241 B16R1.705 CCSCCNC(=O)C(F)c1ccccc1 1626a_100000106463_100000698975 [0,2,0,0,0,0|1,0,0]=3 20242 B16R1.705 CCSCCNC(=O)C(F)c1ccccc1 240690a_100000106463_100000698975 [0,2,0,0,0,0|1,0,0]=3 20243 B16R1.705 CCSCCNC(=O)C(F)c1ccccc1 527a_100000106463_100000698975 [0,2,0,0,0,0|1,0,0]=3 20244 B16R1.705 CCSCCNC(=O)N(C)c1ccccc1 512a_100000106463_100000210012 [0,2,0,0,0,0|2,0,0]=4 20245 B16R1.705 CCSCCNC(=O)[C@@H](C)c1ccccc1 11a_100000106463_100000751047 [0,2,0,0,0,0|1,0,0]=3 20246 B16R1.705 CCSCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000106463_100000751047 [0,2,0,0,0,0|1,0,0]=3 20247 B16R1.705 CCSCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000106463_100000751047 [0,2,0,0,0,0|1,0,0]=3 20248 B16R1.705 CCSCCNC(=O)[C@@H](C)c1ccccc1 527a_100000106463_100000751047 [0,2,0,0,0,0|1,0,0]=3 20249 B16R1.705 CCSCCNC(=O)[C@H](O)c1ccccc1 240690a_100000106463_100000684486 [0,2,0,0,0,0|1,0,0]=3 20250 B16R1.705 CCSCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000757381 [0,2,0,0,0,0|1,0,1]=4 20251 B16R1.705 CN(C(=O)CCCCCO)c1ccccc1 22a_100000210012_100102619762 [0,2,0,0,0,0|2,0,0]=4 20252 B16R1.705 CN(C(=O)COCCCBr)c1ccccc1 34a_100011217188_100000183487 [0,2,0,0,0,0|2,0,0]=4 20253 B16R1.705 CN(C(=O)COCCCCl)c1ccccc1 34a_100000230001_100000183487 [0,2,0,0,0,0|2,0,0]=4 20254 B16R1.705 CN(C(=O)COCCCF)c1ccccc1 34a_100000759539_100000183487 [0,2,0,0,0,0|2,0,0]=4 20255 B16R1.705 CN(C(=O)COCCCN)c1ccccc1 34a_100000182051_100000183487 [0,2,0,0,0,0|2,0,0]=4 20256 B16R1.705 CN(C(=O)NCCCCO)c1ccccc1 512a_100000750430_100000210012 [0,2,0,0,0,0|2,0,0]=4 20257 B16R1.705 COCCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000755781 [0,2,0,0,0,0|2,0,0]=4 20258 B16R1.705 COCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000755781 [0,2,0,0,0,0|1,0,0]=3 20259 B16R1.705 COCCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000755781 [0,2,0,0,0,0|1,0,0]=3 20260 B16R1.705 COCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000755781 [0,2,0,0,0,0|1,0,0]=3 20261 B16R1.705 COCCCNC(=O)C(C)c1ccccn1 1626a_100150723488_100000722050 [0,2,0,0,0,0|2,0,0]=4 20262 B16R1.705 COCCCNC(=O)C(C)c1ccccn1 240690a_100150723488_100000722050 [0,2,0,0,0,0|2,0,0]=4 20263 B16R1.705 COCCCNC(=O)C(C)c1ccccn1 527a_100150723488_100000722050 [0,2,0,0,0,0|2,0,0]=4 20264 B16R1.705 COCCCNC(=O)C(F)c1ccccc1 1626a_100150723488_100000698975 [0,2,0,0,0,0|1,0,0]=3 20265 B16R1.705 COCCCNC(=O)C(F)c1ccccc1 240690a_100150723488_100000698975 [0,2,0,0,0,0|1,0,0]=3 20266 B16R1.705 COCCCNC(=O)C(F)c1ccccc1 527a_100150723488_100000698975 [0,2,0,0,0,0|1,0,0]=3 20267 B16R1.705 COCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100150723488_100000751047 [0,2,0,0,0,0|1,0,0]=3 20268 B16R1.705 COCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100150723488_100000751047 [0,2,0,0,0,0|1,0,0]=3 20269 B16R1.705 COCCCNC(=O)[C@@H](C)c1ccccc1 527a_100150723488_100000751047 [0,2,0,0,0,0|1,0,0]=3 20270 B16R1.705 COCCCNC(=O)[C@H](O)c1ccccc1 240690a_100150723488_100000684486 [0,2,0,0,0,0|1,0,0]=3 20271 B16R1.705 COCCCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000740836 [0,2,0,0,0,0|1,0,1]=4 20272 B16R1.705 COCCNNC(=O)C(F)c1ccccc1 22a_100000741390_100000698975 [0,2,0,0,0,0|2,0,0]=4 20273 B16R1.705 COCCNNC(=O)[C@@H](C)c1ccccc1 22a_100000741390_100000751047 [0,2,0,0,0,0|2,0,0]=4 20274 B16R1.705 COCCNNC(=O)[C@H](O)c1ccccc1 22a_100000741390_100000684486 [0,2,0,0,0,0|2,0,0]=4 20275 B16R1.705 COCCOCC(=O)C(C)c1ccccc1 1458a_100000211095_100000230085 [0,2,0,0,0,0|1,0,0]=3 20276 B16R1.705 COCCOCC(=O)N(C)c1ccccc1 11a_100000210012_100000211095 [0,2,0,0,0,0|2,0,0]=4 20277 B16R1.705 COCCOCC(=O)N(C)c1ccccc1 1626a_100000210012_100000211095 [0,2,0,0,0,0|2,0,0]=4 20278 B16R1.705 COCCOCC(=O)N(C)c1ccccc1 22a_100000210012_100000211095 [0,2,0,0,0,0|2,0,0]=4 20279 B16R1.705 COCCOCC(=O)N(C)c1ccccc1 34a_100000210237_100000183487 [0,2,0,0,0,0|2,0,0]=4 20280 B16R1.705 CSCCCNC(=O)C(C)c1ccccn1 11a_100000749238_100000722050 [0,2,0,0,0,0|2,0,0]=4 20281 B16R1.705 CSCCCNC(=O)C(C)c1ccccn1 1626a_100000749238_100000722050 [0,2,0,0,0,0|2,0,0]=4 20282 B16R1.705 CSCCCNC(=O)C(C)c1ccccn1 240690a_100000749238_100000722050 [0,2,0,0,0,0|2,0,0]=4 20283 B16R1.705 CSCCCNC(=O)C(C)c1ccccn1 527a_100000749238_100000722050 [0,2,0,0,0,0|2,0,0]=4 20284 B16R1.705 CSCCCNC(=O)C(F)c1ccccc1 11a_100000749238_100000698975 [0,2,0,0,0,0|1,0,0]=3 20285 B16R1.705 CSCCCNC(=O)C(F)c1ccccc1 1626a_100000749238_100000698975 [0,2,0,0,0,0|1,0,0]=3 20286 B16R1.705 CSCCCNC(=O)C(F)c1ccccc1 240690a_100000749238_100000698975 [0,2,0,0,0,0|1,0,0]=3 20287 B16R1.705 CSCCCNC(=O)C(F)c1ccccc1 527a_100000749238_100000698975 [0,2,0,0,0,0|1,0,0]=3 20288 B16R1.705 CSCCCNC(=O)N(C)c1ccccc1 512a_100000749238_100000210012 [0,2,0,0,0,0|2,0,0]=4 20289 B16R1.705 CSCCCNC(=O)[C@@H](C)c1ccccc1 11a_100000749238_100000751047 [0,2,0,0,0,0|1,0,0]=3 20290 B16R1.705 CSCCCNC(=O)[C@@H](C)c1ccccc1 1626a_100000749238_100000751047 [0,2,0,0,0,0|1,0,0]=3 20291 B16R1.705 CSCCCNC(=O)[C@@H](C)c1ccccc1 240690a_100000749238_100000751047 [0,2,0,0,0,0|1,0,0]=3 20292 B16R1.705 CSCCCNC(=O)[C@@H](C)c1ccccc1 527a_100000749238_100000751047 [0,2,0,0,0,0|1,0,0]=3 20293 B16R1.705 CSCCCNC(=O)[C@H](O)c1ccccc1 240690a_100000749238_100000684486 [0,2,0,0,0,0|1,0,0]=3 20294 B16R1.705 CSCCOCC(=O)N(C)c1ccccc1 34a_100000230434_100000183487 [0,2,0,0,0,0|2,0,0]=4 20295 B16R1.705 CSCCOCC(=O)N(C)c1ccccc1 7a_100000230434_100000183487 [0,2,0,0,0,0|2,0,0]=4 20296 B16R1.705 C[C@H](C(=O)CCCCC#N)c1ccccc1 1458a_100000751047_100000211819 [0,2,0,0,0,0|1,0,1]=4 20297 B16R1.705 C[C@H](C(=O)CCCCCF)c1ccccc1 1458a_100000751047_100000729378 [0,2,0,0,0,0|1,0,0]=3 20298 B16R1.705 C[C@H](C(=O)CCCCCO)c1ccccc1 1458a_100000751047_100000746330 [0,2,0,0,0,0|1,0,0]=3 20299 B16R1.705 C[C@H](C(=O)CCOCCO)c1ccccc1 1458a_100000751047_100011215305 [0,2,0,0,0,0|2,0,0]=4 20300 B16R1.705 C[C@H](C(=O)NCCCCO)c1ccccc1 240690a_100000750430_100000751047 [0,2,0,0,0,0|1,0,0]=3 20301 B16R1.705 C[C@H](C(=O)NCCCCO)c1ccccc1 527a_100000750430_100000751047 [0,2,0,0,0,0|1,0,0]=3 20302 B16R1.705 C[C@H](OCCCCF)[C@@H](N)c1ccccc1 34a_100134616770_100000729493 [0,2,0,0,0,0|1,0,1]=4 20303 B16R1.705 C[C@H](OCCCCO)[C@@H](N)c1ccccc1 34a_100134616770_100011216708 [0,2,0,0,0,0|1,0,1]=4 20304 B16R1.705 N#CCCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000211819 [0,2,0,0,0,0|1,0,1]=4 20305 B16R1.705 N#CCCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000211819 [0,2,0,0,0,0|1,0,1]=4 20306 B16R1.705 O=C(CCCCCF)C(F)c1ccccc1 1458a_100000698975_100000729378 [0,2,0,0,0,0|1,0,0]=3 20307 B16R1.705 O=C(CCCCCF)[C@H](O)c1ccccc1 1458a_100000684486_100000729378 [0,2,0,0,0,0|1,0,0]=3 20308 B16R1.705 O=C(CCCCCO)C(F)c1ccccc1 1458a_100000698975_100000746330 [0,2,0,0,0,0|1,0,0]=3 20309 B16R1.705 O=C(CCCCCO)[C@H](O)c1ccccc1 1458a_100000684486_100000746330 [0,2,0,0,0,0|1,0,0]=3 20310 B16R1.705 O=C(CCOCCO)C(F)c1ccccc1 1458a_100000698975_100011215305 [0,2,0,0,0,0|2,0,0]=4 20311 B16R1.705 O=C(CCOCCO)[C@H](O)c1ccccc1 1458a_100000684486_100011215305 [0,2,0,0,0,0|2,0,0]=4 20312 B16R1.705 O=C(NCCCCO)C(F)c1ccccc1 240690a_100000750430_100000698975 [0,2,0,0,0,0|1,0,0]=3 20313 B16R1.705 O=C(NCCCCO)C(F)c1ccccc1 527a_100000750430_100000698975 [0,2,0,0,0,0|1,0,0]=3 20314 B16R1.705 O=C(NCCCCO)[C@H](O)c1ccccc1 240690a_100000750430_100000684486 [0,2,0,0,0,0|1,0,0]=3 20315 B16R1.934 C#CCC(C)OCC(=O)Cc1ccccc1 7a_100000685586_100000233483 [0,2,0,0,0,0|0,0,2]=4 20316 B16R1.934 C=CC[C@@H](C)OCC(=O)Cc1ccccc1 7a_100000731007_100000233483 [0,2,0,0,0,0|0,0,2]=4 20317 B16R1.934 CC(CCBr)OCC(=O)Nc1ccccc1 34a_100012276601_100000182850 [0,2,0,0,0,0|2,0,0]=4 20318 B16R1.934 CC(CCBr)OCC(=O)Oc1ccccc1 34a_100012276601_100009813826 [0,2,0,0,0,0|2,0,0]=4 20319 B16R1.934 CC(CCN)COC(C)Cc1ccccc1 34a_106354213184_200011218536 [0,2,0,0,0,0|1,0,1]=4 20320 B16R1.934 CC(CCO)OCC(=O)Nc1ccccc1 34a_100000246334_100009893172 [0,2,0,0,0,0|2,0,0]=4 20321 B16R1.934 CC(CCO)SCC(=O)Cc1ccccc1 62a_100000233483_100009893172 [0,2,0,0,0,0|1,1,0]=4 20322 B16R1.934 CC(CCO)SCC(=O)Cc1ccccc1 62a_100009893172_100000233483 [0,2,0,0,0,0|1,1,0]=4 20323 B16R1.934 CCCC(=NNC(=O)Cc1ccccc1)C 4a_100000182964_100000211909 [0,2,0,0,0,0|1,0,1]=4 20324 B16R1.934 CCCC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_100000210303 [0,2,0,0,0,0|2,0,0]=4 20325 B16R1.934 CCCC(=O)CCC(=O)Nc1ccccc1 1458a_100000211992_100000242058 [0,2,0,0,0,0|2,0,0]=4 20326 B16R1.934 CCCC(=O)CCC(=O)Oc1ccccc1 1458a_100000211992_200000035796 [0,2,0,0,0,0|2,0,0]=4 20327 B16R1.934 CCCC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_100000210303 [0,2,0,0,0,0|1,0,0]=3 20328 B16R1.934 CCCC(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_100000210303 [0,2,0,0,0,0|2,0,0]=4 20329 B16R1.934 CCCC(=O)COC(C)Cc1ccccc1 7a_100000748627_100000747444 [0,2,0,0,0,0|1,0,1]=4 20330 B16R1.934 CCCC(=O)NNC(=O)Cc1ccccc1 22a_100000182964_100000211992 [0,2,0,0,0,0|1,0,1]=4 20331 B16R1.934 CCCC(=O)OCC(=O)C[n+]1ccccc1 1458a_200000086051_100000034017 [0,2,0,0,0,0|1,0,1]=4 20332 B16R1.934 CCCC(=O)OCC(=O)Cc1ccccn1 1458a_100000233486_100000034017 [0,2,0,0,0,0|1,0,1]=4 20333 B16R1.934 CCCC(=O)OCC(=O)Cc1cccnc1 1458a_100000737805_100000034017 [0,2,0,0,0,0|1,0,1]=4 20334 B16R1.934 CCCC(C)COC(C)Cc1ccccc1 34a_100000688023_200011218536 [0,2,0,0,0,0|1,0,1]=4 20335 B16R1.934 CCCC(C)COC(C)Cc1ccccc1 34a_100000748627_100011216630 [0,2,0,0,0,0|1,0,1]=4 20336 B16R1.934 CCCC(C)COC(C)Cc1ccccc1 7a_100000688023_200011218536 [0,2,0,0,0,0|1,0,1]=4 20337 B16R1.934 CCCC(C)COC(C)Cc1ccccc1 7a_100000748627_100011216630 [0,2,0,0,0,0|1,0,1]=4 20338 B16R1.934 CCCC(C)NCC(=O)Cc1ccccc1 2230a_100000741246_100000233483 [0,2,0,0,0,0|1,0,0]=3 20339 B16R1.934 CCCC(C)NCC(=O)Nc1ccccc1 2230a_100000741246_100000182850 [0,2,0,0,0,0|2,0,0]=4 20340 B16R1.934 CCCC(C)NCC(=O)Nc1ccccc1 270004a_100000742222_100000211909 [0,2,0,0,0,0|2,0,0]=4 20341 B16R1.934 CCCC(C)NCC(=O)Oc1ccccc1 2230a_100000741246_100009813826 [0,2,0,0,0,0|2,0,0]=4 20342 B16R1.934 CCCC(C)OC/C(=C/c1ccccc1)/C 34a_200025717232_100000766640 [0,2,0,0,0,0|1,0,1]=4 20343 B16R1.934 CCCC(C)OC/C(=C/c1ccccc1)/C 7a_200025717232_100000766640 [0,2,0,0,0,0|1,0,1]=4 20344 B16R1.934 CCCC(C)OCC(=O)Cc1ccccc1 7a_100000764384_100000233483 [0,2,0,0,0,0|0,0,0]=2 20345 B16R1.934 CCCC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100000766640 [0,2,0,0,0,0|1,0,0]=3 20346 B16R1.934 CCCC(C)OCC(=O)Nc1ccccc1 34a_100000764384_100000182850 [0,2,0,0,0,0|1,0,0]=3 20347 B16R1.934 CCCC(C)OCC(=O)Nc1ccccc1 7a_100000764384_100000182850 [0,2,0,0,0,0|1,0,0]=3 20348 B16R1.934 CCCC(C)OCC(=O)Nc1ccccn1 7a_100000764384_100020662008 [0,2,0,0,0,0|2,0,0]=4 20349 B16R1.934 CCCC(C)OCC(=O)Nc1ccncc1 7a_100000764384_100000754145 [0,2,0,0,0,0|2,0,0]=4 20350 B16R1.934 CCCC(C)OCC(=O)Oc1ccccc1 34a_100000764384_100009813826 [0,2,0,0,0,0|1,0,0]=3 20351 B16R1.934 CCCC(C)OCC(=O)Oc1ccccc1 7a_100000764384_100009813826 [0,2,0,0,0,0|1,0,0]=3 20352 B16R1.934 CCCC(C)OCC(C)Cc1ccccc1 34a_100012125295_100000766640 [0,2,0,0,0,0|1,0,1]=4 20353 B16R1.934 CCCC(C)OCC(C)Cc1ccccc1 7a_100012125295_100000766640 [0,2,0,0,0,0|1,0,1]=4 20354 B16R1.934 CCCC(C)OCC(N)Cc1ccccc1 34a_100000739027_100000766640 [0,2,0,0,0,0|1,0,1]=4 20355 B16R1.934 CCCC(C)OC[C@@H](O)Cc1ccccc1 34a_100000764384_100000729385 [0,2,0,0,0,0|0,0,2]=4 20356 B16R1.934 CCCC(C)OC[C@@H](O)Cc1ccccc1 7a_100000764384_100000729385 [0,2,0,0,0,0|0,0,2]=4 20357 B16R1.934 CCCC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000766640 [0,2,0,0,0,0|0,1,0]=3 20358 B16R1.934 CCCC(C)SCC(=O)Cc1ccccc1 62a_100000766640_100000233483 [0,2,0,0,0,0|0,1,0]=3 20359 B16R1.934 CCCC(C)SCC(=O)Nc1ccccc1 62a_100000766640_100000182850 [0,2,0,0,0,0|1,1,0]=4 20360 B16R1.934 CCCC(C)SCC(=O)Nc1ccccc1 62a_100012148978_100000766640 [0,2,0,0,0,0|1,1,0]=4 20361 B16R1.934 CCCC(C)SCC(=O)Oc1ccccc1 62a_100000766640_100009813826 [0,2,0,0,0,0|1,1,0]=4 20362 B16R1.934 CCCC(C)SCC(=O)Oc1ccccc1 62a_100009813826_100000766640 [0,2,0,0,0,0|1,1,0]=4 20363 B16R1.934 CCCN(C)CCC(=O)Nc1ccccc1 2230a_100000747261_100000242058 [0,2,0,0,0,0|2,0,0]=4 20364 B16R1.934 CCCN(C)CCC(=O)Nc1ccccc1 269982a_100000747261_100000242058 [0,2,0,0,0,0|2,0,0]=4 20365 B16R1.934 CCCN(C)CCC(=O)Oc1ccccc1 2230a_100000747261_200000035796 [0,2,0,0,0,0|2,0,0]=4 20366 B16R1.934 CCCN(C)CCC(=O)Oc1ccccc1 269982a_100000747261_200000035796 [0,2,0,0,0,0|2,0,0]=4 20367 B16R1.934 CCC[C@H](N)COC(C)Cc1ccccc1 34a_100000732646_200011218536 [0,2,0,0,0,0|1,0,1]=4 20368 B16R1.934 CCNC(=O)CCC(=O)Cc1ccccc1 1458a_100000199579_100015291786 [0,2,0,0,0,0|1,0,1]=4 20369 B16R1.934 CCNC(=O)CNC(=O)Cc1ccccc1 11a_100015525214_100000184600 [0,2,0,0,0,0|1,0,1]=4 20370 B16R1.934 CCNC(=O)CNC(=O)Cc1ccccc1 240690a_100015525214_100000184600 [0,2,0,0,0,0|1,0,1]=4 20371 B16R1.934 CCNC(=O)CNC(=O)Cc1ccccc1 527a_100015525214_100000184600 [0,2,0,0,0,0|1,0,1]=4 20372 B16R1.934 CCOC(=O)CCC(=O)Cc1ccccc1 1458a_100000183558_100015291786 [0,2,0,0,0,0|1,0,1]=4 20373 B16R1.934 COCC(C)OCC(=O)Nc1ccccc1 34a_100000246334_100000765312 [0,2,0,0,0,0|2,0,0]=4 20374 B16R1.934 COCC(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000765312 [0,2,0,0,0,0|1,1,0]=4 20375 B16R1.934 COCC(C)SCC(=O)Cc1ccccc1 62a_100000765312_100000233483 [0,2,0,0,0,0|1,1,0]=4 20376 B16R1.934 COCC(N)COC(C)Cc1ccccc1 34a_100000724102_200011218536 [0,2,0,0,0,0|1,0,1]=4 20377 B16R1.934 COCC(O)CNC(=O)C[n+]1ccccc1 240690a_100000756049_200000086051 [0,2,0,0,0,0|2,0,0]=4 20378 B16R1.934 COCC(O)CNC(=O)C[n+]1ccccc1 527a_100000756049_200000086051 [0,2,0,0,0,0|2,0,0]=4 20379 B16R1.934 COCC(O)CNC(=O)Cc1cccnc1 240690a_100000756049_100000737805 [0,2,0,0,0,0|2,0,0]=4 20380 B16R1.934 COCC(O)CNC(=O)Cc1cccnc1 527a_100000756049_100000737805 [0,2,0,0,0,0|2,0,0]=4 20381 B16R1.934 COCC(O)CNC(=O)Cc1ccncc1 240690a_100000756049_100011201483 [0,2,0,0,0,0|2,0,0]=4 20382 B16R1.934 COCC(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000756049 [0,2,0,0,0,0|2,0,0]=4 20383 B16R1.934 COCC(O)COC(C)Cc1ccccc1 34a_100000748627_100011215053 [0,2,0,0,0,0|1,0,1]=4 20384 B16R1.934 COCC(O)COC(C)Cc1ccccc1 7a_100000748627_100011215053 [0,2,0,0,0,0|1,0,1]=4 20385 B16R1.934 COC[C@@H](C)NCC(=O)Cc1ccccc1 2230a_100000764878_100000233483 [0,2,0,0,0,0|2,0,0]=4 20386 B16R1.934 COC[C@@H](C)OCC(=O)Nc1ccccc1 34a_100011934205_100000182850 [0,2,0,0,0,0|2,0,0]=4 20387 B16R1.934 COC[C@@H](C)OCC(=O)Oc1ccccc1 34a_100011934205_100009813826 [0,2,0,0,0,0|2,0,0]=4 20388 B16R1.934 C[C@H](CCO)NCC(=O)Cc1ccccc1 2230a_100000706166_100000233483 [0,2,0,0,0,0|2,0,0]=4 20389 B16R1.934 O=C(CCF)CNC(=O)Cc1ccccc1 1458a_100000184600_100011217306 [0,2,0,0,0,0|1,0,1]=4 20390 B16R1.934 O=C(CCO)CNC(=O)Cc1ccccc1 1458a_100000184600_100000211926 [0,2,0,0,0,0|1,0,1]=4 20391 B16R1.1329 C=CC(C)COCC(=O)Cc1ccccc1 7a_100011215527_100000233483 [0,2,0,0,0,0|0,0,2]=4 20392 B16R1.1329 CC(CN)COCC(=O)Nc1ccccc1 34a_100000744482_100000182850 [0,2,0,0,0,0|2,0,0]=4 20393 B16R1.1329 CC(CN)COCC(=O)Oc1ccccc1 34a_100000744482_100009813826 [0,2,0,0,0,0|2,0,0]=4 20394 B16R1.1329 CC(CO)CCNC(=O)C[n+]1ccccc1 240690a_106354213184_200000086051 [0,2,0,0,0,0|2,0,0]=4 20395 B16R1.1329 CC(CO)CCNC(=O)C[n+]1ccccc1 527a_106354213184_200000086051 [0,2,0,0,0,0|2,0,0]=4 20396 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 240690a_106354213184_100000737805 [0,2,0,0,0,0|2,0,0]=4 20397 B16R1.1329 CC(CO)CCNC(=O)Cc1cccnc1 527a_106354213184_100000737805 [0,2,0,0,0,0|2,0,0]=4 20398 B16R1.1329 CC(CO)CCNC(=O)Cc1ccncc1 240690a_106354213184_100011201483 [0,2,0,0,0,0|2,0,0]=4 20399 B16R1.1329 CC(CO)CCNC(=O)Nc1ccccc1 2430a_100000106764_106354213184 [0,2,0,0,0,0|2,0,0]=4 20400 B16R1.1329 CCC(=O)CCCC(=O)Nc1ccccc1 1458a_100000210414_100011194425 [0,2,0,0,0,0|2,0,0]=4 20401 B16R1.1329 CCC(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_100000210202 [0,2,0,0,0,0|2,0,0]=4 20402 B16R1.1329 CCC(=O)COCC(=O)Nc1ccccc1 1458a_200000199795_100000210202 [0,2,0,0,0,0|1,0,1]=4 20403 B16R1.1329 CCC(=O)COCC(=O)Nc1ccccc1 34a_100000725409_100000182850 [0,2,0,0,0,0|1,0,1]=4 20404 B16R1.1329 CCC(=O)COCC(=O)Oc1ccccc1 34a_100000725409_100009813826 [0,2,0,0,0,0|1,0,1]=4 20405 B16R1.1329 CCC(=O)CSCC(=O)Cc1ccccc1 62a_100000233483_100000747405 [0,2,0,0,0,0|0,1,1]=4 20406 B16R1.1329 CCC(=O)CSCC(=O)Cc1ccccc1 62a_100000747405_100000233483 [0,2,0,0,0,0|0,1,1]=4 20407 B16R1.1329 CCC(C)C=NNC(=O)Cc1ccccc1 4a_100000182964_100000243153 [0,2,0,0,0,0|1,0,1]=4 20408 B16R1.1329 CCC(C)CCNC(=O)C[n+]1ccccc1 11a_100020591266_200000086051 [0,2,0,0,0,0|2,0,0]=4 20409 B16R1.1329 CCC(C)CCNC(=O)C[n+]1ccccc1 240690a_100020591266_200000086051 [0,2,0,0,0,0|2,0,0]=4 20410 B16R1.1329 CCC(C)CCNC(=O)C[n+]1ccccc1 527a_100020591266_200000086051 [0,2,0,0,0,0|2,0,0]=4 20411 B16R1.1329 CCC(C)CCNC(=O)Cc1ccccn1 11a_100020591266_100000233486 [0,2,0,0,0,0|2,0,0]=4 20412 B16R1.1329 CCC(C)CCNC(=O)Cc1cccnc1 11a_100020591266_100000737805 [0,2,0,0,0,0|2,0,0]=4 20413 B16R1.1329 CCC(C)CCNC(=O)Cc1cccnc1 240690a_100020591266_100000737805 [0,2,0,0,0,0|2,0,0]=4 20414 B16R1.1329 CCC(C)CCNC(=O)Cc1cccnc1 527a_100020591266_100000737805 [0,2,0,0,0,0|2,0,0]=4 20415 B16R1.1329 CCC(C)CCNC(=O)Cc1ccncc1 11a_100020591266_100011201483 [0,2,0,0,0,0|2,0,0]=4 20416 B16R1.1329 CCC(C)CCNC(=O)Cc1ccncc1 240690a_100020591266_100011201483 [0,2,0,0,0,0|2,0,0]=4 20417 B16R1.1329 CCC(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100020591266 [0,2,0,0,0,0|2,0,0]=4 20418 B16R1.1329 CCC(C)CCOC(C)Cc1ccccc1 7a_100011215188_200011218536 [0,2,0,0,0,0|1,0,1]=4 20419 B16R1.1329 CCC(C)CNCC(=O)Cc1ccccc1 2230a_100020588543_100000233483 [0,2,0,0,0,0|1,0,0]=3 20420 B16R1.1329 CCC(C)CNCC(=O)Nc1ccccc1 2230a_100020588543_100000182850 [0,2,0,0,0,0|2,0,0]=4 20421 B16R1.1329 CCC(C)CNCC(=O)Nc1ccccc1 270004a_100000742222_100000243153 [0,2,0,0,0,0|2,0,0]=4 20422 B16R1.1329 CCC(C)CNCC(=O)Oc1ccccc1 2230a_100020588543_100009813826 [0,2,0,0,0,0|2,0,0]=4 20423 B16R1.1329 CCC(C)COC/C(=C/c1ccccc1)/C 34a_200025717232_100000748023 [0,2,0,0,0,0|1,0,1]=4 20424 B16R1.1329 CCC(C)COC/C(=C/c1ccccc1)/C 7a_200025717232_100000748023 [0,2,0,0,0,0|1,0,1]=4 20425 B16R1.1329 CCC(C)COCC(=O)Nc1ccccc1 34a_100000246334_100000748023 [0,2,0,0,0,0|1,0,0]=3 20426 B16R1.1329 CCC(C)COCC(C)Cc1ccccc1 34a_100012125295_100000748023 [0,2,0,0,0,0|1,0,1]=4 20427 B16R1.1329 CCC(C)COCC(C)Cc1ccccc1 7a_100012125295_100000748023 [0,2,0,0,0,0|1,0,1]=4 20428 B16R1.1329 CCC(C)COCC(N)Cc1ccccc1 34a_100000739027_100000748023 [0,2,0,0,0,0|1,0,1]=4 20429 B16R1.1329 CCC(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100000748023 [0,2,0,0,0,0|0,1,0]=3 20430 B16R1.1329 CCC(C)CSCC(=O)Cc1ccccc1 62a_100000748023_100000233483 [0,2,0,0,0,0|0,1,0]=3 20431 B16R1.1329 CCC(C)CSCC(=O)Nc1ccccc1 62a_100000748023_100000182850 [0,2,0,0,0,0|1,1,0]=4 20432 B16R1.1329 CCC(C)CSCC(=O)Nc1ccccc1 62a_100012148978_100000748023 [0,2,0,0,0,0|1,1,0]=4 20433 B16R1.1329 CCC(C)CSCC(=O)Oc1ccccc1 62a_100000748023_100009813826 [0,2,0,0,0,0|1,1,0]=4 20434 B16R1.1329 CCC(C)CSCC(=O)Oc1ccccc1 62a_100009813826_100000748023 [0,2,0,0,0,0|1,1,0]=4 20435 B16R1.1329 CCC(C)NCCC(=O)Nc1ccccc1 2230a_100000209981_100000242058 [0,2,0,0,0,0|2,0,0]=4 20436 B16R1.1329 CCC(C)NCCC(=O)Oc1ccccc1 2230a_100000209981_200000035796 [0,2,0,0,0,0|2,0,0]=4 20437 B16R1.1329 CCC(C)OCCC(=O)Nc1ccccc1 7a_100000210228_100000242058 [0,2,0,0,0,0|2,0,0]=4 20438 B16R1.1329 CCC(C)OCCC(=O)Oc1ccccc1 7a_100000210228_200000035796 [0,2,0,0,0,0|2,0,0]=4 20439 B16R1.1329 CCC(C)SCCC(=O)Nc1ccccc1 62a_100000758301_100000242058 [0,2,0,0,0,0|2,0,0]=4 20440 B16R1.1329 CCC(C)SCCC(=O)Oc1ccccc1 62a_100000758301_200000035796 [0,2,0,0,0,0|2,0,0]=4 20441 B16R1.1329 CCC(O)CNCC(=O)Cc1ccccc1 2230a_100011218483_100000233483 [0,2,0,0,0,0|1,0,0]=3 20442 B16R1.1329 CCC(O)CNCC(=O)Nc1ccccc1 2230a_100011218483_100000182850 [0,2,0,0,0,0|2,0,0]=4 20443 B16R1.1329 CCC(O)CNCC(=O)Oc1ccccc1 2230a_100011218483_100009813826 [0,2,0,0,0,0|2,0,0]=4 20444 B16R1.1329 CCC(O)CNNC(=O)C[n+]1ccccc1 22a_100015206393_200000086051 [0,2,0,0,0,0|2,0,0]=4 20445 B16R1.1329 CCC(O)CNNC(=O)Cc1ccccn1 22a_100015206393_100000233486 [0,2,0,0,0,0|2,0,0]=4 20446 B16R1.1329 CCC(O)CNNC(=O)Cc1cccnc1 22a_100015206393_100000737805 [0,2,0,0,0,0|2,0,0]=4 20447 B16R1.1329 CCC(O)CNNC(=O)Cc1ccncc1 22a_100015206393_100011201483 [0,2,0,0,0,0|2,0,0]=4 20448 B16R1.1329 CCC(O)COC/C(=C/c1ccccc1)/C 34a_200025717232_100011218378 [0,2,0,0,0,0|1,0,1]=4 20449 B16R1.1329 CCC(O)COC/C(=C/c1ccccc1)/C 7a_200025717232_100011218378 [0,2,0,0,0,0|1,0,1]=4 20450 B16R1.1329 CCC(O)COCC(=O)Nc1ccccc1 34a_100000246334_100011218378 [0,2,0,0,0,0|1,0,0]=3 20451 B16R1.1329 CCC(O)COCC(C)Cc1ccccc1 34a_100012125295_100011218378 [0,2,0,0,0,0|1,0,1]=4 20452 B16R1.1329 CCC(O)COCC(C)Cc1ccccc1 7a_100012125295_100011218378 [0,2,0,0,0,0|1,0,1]=4 20453 B16R1.1329 CCC(O)COCC(N)Cc1ccccc1 34a_100000739027_100011218378 [0,2,0,0,0,0|1,0,1]=4 20454 B16R1.1329 CCC(O)CSCC(=O)Cc1ccccc1 62a_100000233483_100011218378 [0,2,0,0,0,0|0,1,0]=3 20455 B16R1.1329 CCC(O)CSCC(=O)Cc1ccccc1 62a_100011218378_100000233483 [0,2,0,0,0,0|0,1,0]=3 20456 B16R1.1329 CCC(O)CSCC(=O)Nc1ccccc1 62a_100011218378_100000182850 [0,2,0,0,0,0|1,1,0]=4 20457 B16R1.1329 CCC(O)CSCC(=O)Nc1ccccc1 62a_100012148978_100011218378 [0,2,0,0,0,0|1,1,0]=4 20458 B16R1.1329 CCC(O)CSCC(=O)Oc1ccccc1 62a_100009813826_100011218378 [0,2,0,0,0,0|1,1,0]=4 20459 B16R1.1329 CCC(O)CSCC(=O)Oc1ccccc1 62a_100011218378_100009813826 [0,2,0,0,0,0|1,1,0]=4 20460 B16R1.1329 CCN(C)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100015186262 [0,2,0,0,0,0|2,0,0]=4 20461 B16R1.1329 CCN(C)CCCC(=O)Cc1ccccn1 1458a_100000233486_100015186262 [0,2,0,0,0,0|2,0,0]=4 20462 B16R1.1329 CCN(C)CCCC(=O)Cc1cccnc1 1458a_100000737805_100015186262 [0,2,0,0,0,0|2,0,0]=4 20463 B16R1.1329 CCN(C)CCCC(=O)Nc1ccccc1 2230a_100000225621_100011194425 [0,2,0,0,0,0|2,0,0]=4 20464 B16R1.1329 CCN(C)CCCC(=O)Nc1ccccc1 269982a_100000225621_100011194425 [0,2,0,0,0,0|2,0,0]=4 20465 B16R1.1329 CC[C@H](C)COC/C(=C/c1ccccc1)/C 34a_200025717232_100009816398 [0,2,0,0,0,0|1,0,1]=4 20466 B16R1.1329 CC[C@H](C)COC/C(=C/c1ccccc1)/C 7a_200025717232_100009816398 [0,2,0,0,0,0|1,0,1]=4 20467 B16R1.1329 CC[C@H](C)COCC(=O)Cc1ccccc1 7a_100009816381_100000233483 [0,2,0,0,0,0|0,0,0]=2 20468 B16R1.1329 CC[C@H](C)COCC(=O)Nc1ccccc1 34a_100000246334_100009816398 [0,2,0,0,0,0|1,0,0]=3 20469 B16R1.1329 CC[C@H](C)COCC(=O)Nc1ccccc1 7a_100009816381_100000182850 [0,2,0,0,0,0|1,0,0]=3 20470 B16R1.1329 CC[C@H](C)COCC(=O)Nc1ccccn1 7a_100009816381_100020662008 [0,2,0,0,0,0|2,0,0]=4 20471 B16R1.1329 CC[C@H](C)COCC(=O)Nc1ccncc1 7a_100009816381_100000754145 [0,2,0,0,0,0|2,0,0]=4 20472 B16R1.1329 CC[C@H](C)COCC(=O)Oc1ccccc1 7a_100009816381_100009813826 [0,2,0,0,0,0|1,0,0]=3 20473 B16R1.1329 CC[C@H](C)COCC(C)Cc1ccccc1 34a_100012125295_100009816398 [0,2,0,0,0,0|1,0,1]=4 20474 B16R1.1329 CC[C@H](C)COCC(C)Cc1ccccc1 7a_100012125295_100009816398 [0,2,0,0,0,0|1,0,1]=4 20475 B16R1.1329 CC[C@H](C)COCC(N)Cc1ccccc1 34a_100000739027_100009816398 [0,2,0,0,0,0|1,0,1]=4 20476 B16R1.1329 CC[C@H](C)COC[C@@H](O)Cc1ccccc1 7a_100009816381_100000729385 [0,2,0,0,0,0|0,0,2]=4 20477 B16R1.1329 CC[C@H](C)CSCC(=O)Cc1ccccc1 62a_100000233483_100009816398 [0,2,0,0,0,0|0,1,0]=3 20478 B16R1.1329 CC[C@H](C)CSCC(=O)Cc1ccccc1 62a_100009816398_100000233483 [0,2,0,0,0,0|0,1,0]=3 20479 B16R1.1329 CC[C@H](C)CSCC(=O)Nc1ccccc1 62a_100009816398_100000182850 [0,2,0,0,0,0|1,1,0]=4 20480 B16R1.1329 CC[C@H](C)CSCC(=O)Nc1ccccc1 62a_100012148978_100009816398 [0,2,0,0,0,0|1,1,0]=4 20481 B16R1.1329 CC[C@H](C)CSCC(=O)Oc1ccccc1 62a_100009813826_100009816398 [0,2,0,0,0,0|1,1,0]=4 20482 B16R1.1329 CC[C@H](C)CSCC(=O)Oc1ccccc1 62a_100009816398_100009813826 [0,2,0,0,0,0|1,1,0]=4 20483 B16R1.1329 CN(CCCC(=O)Cc1ccccc1)N=O 1458a_200000076914_100015291786 [0,2,0,0,0,0|2,0,0]=4 20484 B16R1.1329 COC(=O)CCCC(=O)Cc1ccccc1 1458a_100000239890_100015291786 [0,2,0,0,0,0|1,0,1]=4 20485 B16R1.1329 COC(C)CCOC(C)Cc1ccccc1 7a_100000764861_200011218536 [0,2,0,0,0,0|1,0,1]=4 20486 B16R1.1329 COC(C)COCC(=O)Nc1ccccc1 34a_100000690652_100000182850 [0,2,0,0,0,0|2,0,0]=4 20487 B16R1.1329 COC(C)COCC(=O)Oc1ccccc1 34a_100000690652_100009813826 [0,2,0,0,0,0|2,0,0]=4 20488 B16R1.1329 CO[C@H](C)CNCC(=O)Cc1ccccc1 2230a_100020591295_100000233483 [0,2,0,0,0,0|2,0,0]=4 20489 B16R1.1329 C[C@@H](CO)COCC(=O)Nc1ccccc1 34a_100000246334_100000059175 [0,2,0,0,0,0|2,0,0]=4 20490 B16R1.1329 C[C@@H](CO)CSCC(=O)Cc1ccccc1 62a_100000059175_100000233483 [0,2,0,0,0,0|1,1,0]=4 20491 B16R1.1329 C[C@@H](CO)CSCC(=O)Cc1ccccc1 62a_100000233483_100000059175 [0,2,0,0,0,0|1,1,0]=4 20492 B16R1.1329 NC[C@@H](F)COCC(=O)Nc1ccccc1 34a_100015665980_100000182850 [0,2,0,0,0,0|2,0,0]=4 20493 B16R1.1329 NC[C@@H](F)COCC(=O)Oc1ccccc1 34a_100015665980_100009813826 [0,2,0,0,0,0|2,0,0]=4 20494 B16R1.1329 O=C(CNC[C@H](O)CO)Cc1ccccc1 2230a_100020644852_100000233483 [0,2,0,0,0,0|2,0,0]=4 20495 B16R1.1329 O=C(COCC(Cl)CCl)Nc1ccccc1 34a_100000033668_100000182850 [0,2,0,0,0,0|2,0,0]=4 20496 B16R1.1329 O=C(COCC(Cl)CCl)Oc1ccccc1 34a_100000033668_100009813826 [0,2,0,0,0,0|2,0,0]=4 20497 B16R1.1329 O=C(COCC(O)CO)Nc1ccccc1 34a_100000246334_100011219619 [0,2,0,0,0,0|2,0,0]=4 20498 B16R1.1329 O=C(COC[C@@H](O)CF)Nc1ccccc1 34a_100000246334_100015614560 [0,2,0,0,0,0|2,0,0]=4 20499 B16R1.1329 O=C(COC[C@@H](O)CO)Nc1ccccc1 34a_100000246334_100009815848 [0,2,0,0,0,0|2,0,0]=4 20500 B16R1.1329 O=C(CSCC(O)CO)Cc1ccccc1 62a_100000233483_100011219619 [0,2,0,0,0,0|1,1,0]=4 20501 B16R1.1329 O=C(CSCC(O)CO)Cc1ccccc1 62a_100011219619_100000233483 [0,2,0,0,0,0|1,1,0]=4 20502 B16R1.1329 O=C(CSC[C@@H](O)CF)Cc1ccccc1 62a_100000233483_100015614560 [0,2,0,0,0,0|1,1,0]=4 20503 B16R1.1329 O=C(CSC[C@@H](O)CF)Cc1ccccc1 62a_100015614560_100000233483 [0,2,0,0,0,0|1,1,0]=4 20504 B16R1.1329 O=C(CSC[C@@H](O)CO)Cc1ccccc1 62a_100000233483_100009815848 [0,2,0,0,0,0|1,1,0]=4 20505 B16R1.1329 O=C(CSC[C@@H](O)CO)Cc1ccccc1 62a_100009815848_100000233483 [0,2,0,0,0,0|1,1,0]=4 20506 B16R1.1407 C#CC(Cc1ccccc1)OCCCCC 34a_100000685211_100000718602 [0,2,0,0,0,0|1,0,1]=4 20507 B16R1.1407 C#CC(Cc1ccccc1)OCCCCC 7a_100000685211_100000210326 [0,2,0,0,0,0|1,0,1]=4 20508 B16R1.1407 C#CC(Cc1ccccc1)OCCCCF 34a_100000685211_100000729493 [0,2,0,0,0,0|1,0,1]=4 20509 B16R1.1407 C#CC(Cc1ccccc1)OCCCCF 7a_100000685211_100000729493 [0,2,0,0,0,0|1,0,1]=4 20510 B16R1.1407 C#CC(Cc1ccccc1)OCCCCO 34a_100000685211_100011216708 [0,2,0,0,0,0|1,0,1]=4 20511 B16R1.1407 C#CC(Cc1ccccc1)OCCCCO 7a_100000685211_100000210776 [0,2,0,0,0,0|1,0,1]=4 20512 B16R1.1407 C#CC(Cc1ccccc1)OCCCOC 34a_100000685211_100000740836 [0,2,0,0,0,0|1,0,1]=4 20513 B16R1.1407 C#CC(Cc1ccccc1)OCCCOC 7a_100000685211_100000740836 [0,2,0,0,0,0|1,0,1]=4 20514 B16R1.1407 C#CC(Cc1ccccc1)OCCOCC 34a_100000685211_100000210147 [0,2,0,0,0,0|1,0,1]=4 20515 B16R1.1407 C#CC(Cc1ccccc1)OCCOCC 7a_100000685211_100011215890 [0,2,0,0,0,0|1,0,1]=4 20516 B16R1.1407 C#CC(Cc1ccccc1)OCCSCC 34a_100000685211_100000757381 [0,2,0,0,0,0|1,0,1]=4 20517 B16R1.1407 C#CC(Cc1ccccc1)OCCSCC 7a_100000685211_100000757381 [0,2,0,0,0,0|1,0,1]=4 20518 B16R1.1407 CCC(Cc1ccccc1)OCCCCF 7a_100000760156_100000729493 [0,2,0,0,0,0|1,0,1]=4 20519 B16R1.1407 CCC(Cc1ccccc1)OCCCCO 7a_100000760156_100000210776 [0,2,0,0,0,0|1,0,1]=4 20520 B16R1.1407 CCC(Cc1ccccc1)OCCCOC 7a_100000760156_100000740836 [0,2,0,0,0,0|1,0,1]=4 20521 B16R1.1407 CCCCCOC(C#N)Cc1ccccc1 7a_100000210253_100000183401 [0,2,0,0,0,0|1,0,1]=4 20522 B16R1.1407 CCCCCOC(CC)Cc1ccccc1 7a_100000760156_100000210326 [0,2,0,0,0,0|1,0,1]=4 20523 B16R1.1407 CCCCCOC(CN)Cc1ccccc1 34a_100000752270_100000718602 [0,2,0,0,0,0|1,0,1]=4 20524 B16R1.1407 CCCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210326 [0,2,0,0,0,0|1,0,1]=4 20525 B16R1.1407 CCCCNN=C(CC)Cc1ccccc1 4a_100025702795_100000212045 [0,2,0,0,0,0|2,0,0]=4 20526 B16R1.1407 CCCCOCC(C#N)Cc1ccccc1 34a_100000684917_100000210210 [0,2,0,0,0,0|1,0,1]=4 20527 B16R1.1407 CCCCOCC(C#N)Cc1ccccc1 7a_100000684917_100000210211 [0,2,0,0,0,0|1,0,1]=4 20528 B16R1.1407 CCCCOCC(CN)Cc1ccccc1 34a_100160572655_100000210210 [0,2,0,0,0,0|1,0,1]=4 20529 B16R1.1407 CCCCOCN(CC)Cc1ccccc1 2230a_100000186914_100011995733 [0,2,0,0,0,0|2,0,0]=4 20530 B16R1.1407 CCCCOCN(CC)Cc1ccccc1 269982a_100000186914_100011995733 [0,2,0,0,0,0|2,0,0]=4 20531 B16R1.1407 CCCCOC[C@H](Cc1ccccc1)NC 34a_100016995599_100000210210 [0,2,0,0,0,0|1,0,1]=4 20532 B16R1.1407 CCOCCOC(C#N)Cc1ccccc1 7a_100000210136_100000183401 [0,2,0,0,0,0|1,0,1]=4 20533 B16R1.1407 CCOCCOC(CC)Cc1ccccc1 7a_100000760156_100011215890 [0,2,0,0,0,0|1,0,1]=4 20534 B16R1.1407 CCOCCOC(CN)Cc1ccccc1 34a_100000752270_100000210147 [0,2,0,0,0,0|1,0,1]=4 20535 B16R1.1407 CCOCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100011215890 [0,2,0,0,0,0|1,0,1]=4 20536 B16R1.1407 CCSCCOC(C#N)Cc1ccccc1 7a_100000212035_100000183401 [0,2,0,0,0,0|1,0,1]=4 20537 B16R1.1407 CCSCCOC(CC)Cc1ccccc1 7a_100000760156_100000757381 [0,2,0,0,0,0|1,0,1]=4 20538 B16R1.1407 CCSCCOC(CN)Cc1ccccc1 34a_100000752270_100000757381 [0,2,0,0,0,0|1,0,1]=4 20539 B16R1.1407 CCSCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000757381 [0,2,0,0,0,0|1,0,1]=4 20540 B16R1.1407 COCCCOC(CN)Cc1ccccc1 34a_100000752270_100000740836 [0,2,0,0,0,0|1,0,1]=4 20541 B16R1.1407 COCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000740836 [0,2,0,0,0,0|1,0,1]=4 20542 B16R1.1407 CSCCCOC(C#N)Cc1ccccc1 7a_100000690336_100000183401 [0,2,0,0,0,0|1,0,1]=4 20543 B16R1.1407 FCCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000729493 [0,2,0,0,0,0|1,0,1]=4 20544 B16R1.1407 N#CC(Cc1ccccc1)OCCCCCl 7a_100000210776_100000183401 [0,2,0,0,0,0|1,0,1]=4 20545 B16R1.1407 N#CC(Cc1ccccc1)OCCCCF 7a_100011995726_100000183401 [0,2,0,0,0,0|1,0,1]=4 20546 B16R1.1407 NCC(Cc1ccccc1)OCCCCF 34a_100000752270_100000729493 [0,2,0,0,0,0|1,0,1]=4 20547 B16R1.1407 NCC(Cc1ccccc1)OCCCCO 34a_100000752270_100011216708 [0,2,0,0,0,0|1,0,1]=4 20548 B16R1.1407 OCCCCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210776 [0,2,0,0,0,0|1,0,1]=4 20549 B16R1.1497 CC(CCCCl)OC(C)Cc1ccccc1 34a_200000718107_200011218536 [0,2,0,0,0,0|1,0,1]=4 20550 B16R1.1497 CC(CCCCl)OC(C)Cc1ccccc1 7a_200000718107_200011218536 [0,2,0,0,0,0|1,0,1]=4 20551 B16R1.1497 CCCCC(=O)CC(=O)Cc1ccccc1 1458a_100000210183_100000233483 [0,2,0,0,0,0|1,0,0]=3 20552 B16R1.1497 CCCCC(=O)CC(=O)Nc1ccccc1 1458a_100000210183_100000182850 [0,2,0,0,0,0|2,0,0]=4 20553 B16R1.1497 CCCCC(=O)CC(=O)Oc1ccccc1 1458a_100000210183_100009813826 [0,2,0,0,0,0|2,0,0]=4 20554 B16R1.1497 CCCCC(C)NC(=O)C[n+]1ccccc1 11a_100000126638_200000086051 [0,2,0,0,0,0|2,0,0]=4 20555 B16R1.1497 CCCCC(C)NC(=O)C[n+]1ccccc1 240690a_100000126638_200000086051 [0,2,0,0,0,0|2,0,0]=4 20556 B16R1.1497 CCCCC(C)NC(=O)C[n+]1ccccc1 527a_100000126638_200000086051 [0,2,0,0,0,0|2,0,0]=4 20557 B16R1.1497 CCCCC(C)NC(=O)Cc1ccccn1 11a_100000126638_100000233486 [0,2,0,0,0,0|2,0,0]=4 20558 B16R1.1497 CCCCC(C)NC(=O)Cc1cccnc1 11a_100000126638_100000737805 [0,2,0,0,0,0|2,0,0]=4 20559 B16R1.1497 CCCCC(C)NC(=O)Cc1cccnc1 240690a_100000126638_100000737805 [0,2,0,0,0,0|2,0,0]=4 20560 B16R1.1497 CCCCC(C)NC(=O)Cc1cccnc1 527a_100000126638_100000737805 [0,2,0,0,0,0|2,0,0]=4 20561 B16R1.1497 CCCCC(C)NC(=O)Cc1ccncc1 11a_100000126638_100011201483 [0,2,0,0,0,0|2,0,0]=4 20562 B16R1.1497 CCCCC(C)NC(=O)Cc1ccncc1 240690a_100000126638_100011201483 [0,2,0,0,0,0|2,0,0]=4 20563 B16R1.1497 CCCCC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000126638 [0,2,0,0,0,0|2,0,0]=4 20564 B16R1.1497 CCCCC(C)OC(C)Cc1ccccc1 34a_100000687866_200011218536 [0,2,0,0,0,0|1,0,1]=4 20565 B16R1.1497 CCCCC(C)OC(C)Cc1ccccc1 34a_100000748627_200011215066 [0,2,0,0,0,0|1,0,1]=4 20566 B16R1.1497 CCCCC(C)OC(C)Cc1ccccc1 7a_100000687866_200011218536 [0,2,0,0,0,0|1,0,1]=4 20567 B16R1.1497 CCCCC(C)OC(C)Cc1ccccc1 7a_100000748627_200011215066 [0,2,0,0,0,0|1,0,1]=4 20568 B16R1.1497 CCCCN(C)CC(=O)Cc1ccccc1 2230a_100000207549_100000233483 [0,2,0,0,0,0|1,0,0]=3 20569 B16R1.1497 CCCCN(C)CC(=O)Cc1ccccc1 269982a_100000207549_100000233483 [0,2,0,0,0,0|1,0,0]=3 20570 B16R1.1497 CCCCN(C)CC(=O)Nc1ccccc1 2230a_100000207549_100000182850 [0,2,0,0,0,0|2,0,0]=4 20571 B16R1.1497 CCCCN(C)CC(=O)Nc1ccccc1 269982a_100000207549_100000182850 [0,2,0,0,0,0|2,0,0]=4 20572 B16R1.1497 CCCCN(C)CC(=O)Oc1ccccc1 2230a_100000207549_100009813826 [0,2,0,0,0,0|2,0,0]=4 20573 B16R1.1497 CCCCN(C)CC(=O)Oc1ccccc1 269982a_100000207549_100009813826 [0,2,0,0,0,0|2,0,0]=4 20574 B16R1.1497 CCNCC(=O)NC(=O)Cc1ccccc1 2230a_100015525214_100000010274 [0,2,0,0,0,0|1,0,1]=4 20575 B16R1.1497 CCOCC(=O)CC(=O)Cc1ccccc1 1458a_100000211967_100000233483 [0,2,0,0,0,0|1,0,1]=4 20576 B16R1.1497 CCOCC(C)OC(C)Cc1ccccc1 34a_100000718985_200011218536 [0,2,0,0,0,0|1,0,1]=4 20577 B16R1.1497 CCOCC(C)OC(C)Cc1ccccc1 7a_100000718985_200011218536 [0,2,0,0,0,0|1,0,1]=4 20578 B16R1.1497 CCSCC(=O)CC(=O)Cc1ccccc1 1458a_100000230394_100000233483 [0,2,0,0,0,0|1,0,1]=4 20579 B16R1.1497 CCSCC(=O)NC(=O)Cc1ccccc1 62a_100000210202_100000010274 [0,2,0,0,0,0|1,0,1]=4 20580 B16R1.1497 CN(CCCO)CC(=O)Cc1ccccc1 2230a_100000213112_100000233483 [0,2,0,0,0,0|2,0,0]=4 20581 B16R1.1497 CN(CCCO)CC(=O)Cc1ccccc1 269982a_100000213112_100000233483 [0,2,0,0,0,0|2,0,0]=4 20582 B16R1.1497 COCCC(=O)CC(=O)Cc1ccccc1 1458a_100000749529_100000233483 [0,2,0,0,0,0|1,0,1]=4 20583 B16R1.1497 COCCN(C)CC(=O)Cc1ccccc1 2230a_100000743101_100000233483 [0,2,0,0,0,0|2,0,0]=4 20584 B16R1.1497 COCCN(C)CC(=O)Cc1ccccc1 269982a_100000743101_100000233483 [0,2,0,0,0,0|2,0,0]=4 20585 B16R1.1497 CSCCC(=O)CC(=O)Cc1ccccc1 1458a_100000174002_100000233483 [0,2,0,0,0,0|1,0,1]=4 20586 B16R1.1497 CSCCN(C)CC(=O)Cc1ccccc1 2230a_100000686725_100000233483 [0,2,0,0,0,0|2,0,0]=4 20587 B16R1.1497 CSCCN(C)CC(=O)Cc1ccccc1 269982a_100000686725_100000233483 [0,2,0,0,0,0|2,0,0]=4 20588 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1Br 1458a_100000696528_100000184730 [0,2,0,0,0,0|1,0,1]=4 20589 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100010269958 [0,2,0,0,0,0|1,0,1]=4 20590 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100010269958 [0,2,0,0,0,0|1,0,1]=4 20591 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1C 1458a_100000696528_100000211839 [0,2,0,0,0,0|1,0,1]=4 20592 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100010269958 [0,2,0,0,0,0|1,0,1]=4 20593 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1Cl 1458a_100000696528_100000187162 [0,2,0,0,0,0|1,0,1]=4 20594 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100010269958 [0,2,0,0,0,0|1,0,1]=4 20595 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1F 1458a_100000696528_100000187165 [0,2,0,0,0,0|1,0,1]=4 20596 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100010269958 [0,2,0,0,0,0|1,0,1]=4 20597 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1I 1458a_100000696528_100011216222 [0,2,0,0,0,0|1,0,1]=4 20598 B16R1.4621 C#CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100010269958 [0,2,0,0,0,0|1,0,1]=4 20599 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Br 11a_100000718082_100000751119 [0,2,0,0,0,0|1,0,1]=4 20600 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Br 240690a_100000718082_100000751119 [0,2,0,0,0,0|1,0,1]=4 20601 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Br 527a_100000718082_100000751119 [0,2,0,0,0,0|1,0,1]=4 20602 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C 11a_100000718082_100000212180 [0,2,0,0,0,0|1,0,1]=4 20603 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C 1626a_100000718082_100000212180 [0,2,0,0,0,0|1,0,1]=4 20604 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C 240690a_100000718082_100000212180 [0,2,0,0,0,0|1,0,1]=4 20605 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1C 527a_100000718082_100000212180 [0,2,0,0,0,0|1,0,1]=4 20606 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl 11a_100000718082_100000183793 [0,2,0,0,0,0|1,0,1]=4 20607 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl 1626a_100000718082_100000183793 [0,2,0,0,0,0|1,0,1]=4 20608 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl 240690a_100000718082_100000183793 [0,2,0,0,0,0|1,0,1]=4 20609 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1Cl 527a_100000718082_100000183793 [0,2,0,0,0,0|1,0,1]=4 20610 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F 11a_100000718082_100000212012 [0,2,0,0,0,0|1,0,1]=4 20611 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F 1626a_100000718082_100000212012 [0,2,0,0,0,0|1,0,1]=4 20612 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F 240690a_100000718082_100000212012 [0,2,0,0,0,0|1,0,1]=4 20613 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1F 527a_100000718082_100000212012 [0,2,0,0,0,0|1,0,1]=4 20614 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I 11a_100000718082_100000036491 [0,2,0,0,0,0|1,0,1]=4 20615 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I 1626a_100000718082_100000036491 [0,2,0,0,0,0|1,0,1]=4 20616 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I 240690a_100000718082_100000036491 [0,2,0,0,0,0|1,0,1]=4 20617 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1I 527a_100000718082_100000036491 [0,2,0,0,0,0|1,0,1]=4 20618 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O 240690a_100000718082_100000743006 [0,2,0,0,0,0|1,0,1]=4 20619 B16R1.4621 C#CCCCNC(=O)Cc1ccccc1O 527a_100000718082_100000743006 [0,2,0,0,0,0|1,0,1]=4 20620 B16R1.4621 C#CCCOCC(=O)Cc1ccccc1Br 34a_100011215631_100000700504 [0,2,0,0,0,0|0,0,2]=4 20621 B16R1.4621 C/C=C/COCC(=O)Cc1ccccc1Br 34a_100016270725_100000700504 [0,2,0,0,0,0|0,0,2]=4 20622 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215482 [0,2,0,0,0,0|1,0,1]=4 20623 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1Br 1458a_100011215552_100000184730 [0,2,0,0,0,0|1,0,1]=4 20624 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215482 [0,2,0,0,0,0|1,0,1]=4 20625 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1C 1458a_100011215552_100000211839 [0,2,0,0,0,0|1,0,1]=4 20626 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215482 [0,2,0,0,0,0|1,0,1]=4 20627 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1Cl 1458a_100011215552_100000187162 [0,2,0,0,0,0|1,0,1]=4 20628 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215482 [0,2,0,0,0,0|1,0,1]=4 20629 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1F 1458a_100011215552_100000187165 [0,2,0,0,0,0|1,0,1]=4 20630 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215482 [0,2,0,0,0,0|1,0,1]=4 20631 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1I 1458a_100011215552_100011216222 [0,2,0,0,0,0|1,0,1]=4 20632 B16R1.4621 C=CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215482 [0,2,0,0,0,0|1,0,1]=4 20633 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Br 11a_100000700776_100000751119 [0,2,0,0,0,0|1,0,1]=4 20634 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Br 240690a_100000700776_100000751119 [0,2,0,0,0,0|1,0,1]=4 20635 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Br 527a_100000700776_100000751119 [0,2,0,0,0,0|1,0,1]=4 20636 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1C 11a_100000700776_100000212180 [0,2,0,0,0,0|1,0,1]=4 20637 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1C 1626a_100000700776_100000212180 [0,2,0,0,0,0|1,0,1]=4 20638 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1C 240690a_100000700776_100000212180 [0,2,0,0,0,0|1,0,1]=4 20639 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1C 527a_100000700776_100000212180 [0,2,0,0,0,0|1,0,1]=4 20640 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Cl 11a_100000700776_100000183793 [0,2,0,0,0,0|1,0,1]=4 20641 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Cl 1626a_100000700776_100000183793 [0,2,0,0,0,0|1,0,1]=4 20642 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Cl 240690a_100000700776_100000183793 [0,2,0,0,0,0|1,0,1]=4 20643 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1Cl 527a_100000700776_100000183793 [0,2,0,0,0,0|1,0,1]=4 20644 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1F 11a_100000700776_100000212012 [0,2,0,0,0,0|1,0,1]=4 20645 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1F 1626a_100000700776_100000212012 [0,2,0,0,0,0|1,0,1]=4 20646 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1F 240690a_100000700776_100000212012 [0,2,0,0,0,0|1,0,1]=4 20647 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1F 527a_100000700776_100000212012 [0,2,0,0,0,0|1,0,1]=4 20648 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1I 11a_100000700776_100000036491 [0,2,0,0,0,0|1,0,1]=4 20649 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1I 1626a_100000700776_100000036491 [0,2,0,0,0,0|1,0,1]=4 20650 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1I 240690a_100000700776_100000036491 [0,2,0,0,0,0|1,0,1]=4 20651 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1I 527a_100000700776_100000036491 [0,2,0,0,0,0|1,0,1]=4 20652 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1O 240690a_100000700776_100000743006 [0,2,0,0,0,0|1,0,1]=4 20653 B16R1.4621 C=CCCCNC(=O)Cc1ccccc1O 527a_100000700776_100000743006 [0,2,0,0,0,0|1,0,1]=4 20654 B16R1.4621 C=CCCOCC(=O)Cc1ccccc1Br 34a_100011205117_100000700504 [0,2,0,0,0,0|0,0,2]=4 20655 B16R1.4621 CC#CCOCC(=O)Cc1ccccc1Br 34a_100000761923_100000700504 [0,2,0,0,0,0|0,0,2]=4 20656 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1Br 1458a_100000751119_100015370543 [0,2,0,0,0,0|1,0,1]=4 20657 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1C 1458a_100000212180_100015370543 [0,2,0,0,0,0|1,0,1]=4 20658 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100015370543 [0,2,0,0,0,0|1,0,1]=4 20659 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1F 1458a_100000212012_100015370543 [0,2,0,0,0,0|1,0,1]=4 20660 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1I 1458a_100000036491_100015370543 [0,2,0,0,0,0|1,0,1]=4 20661 B16R1.4621 CC/C=C\CCC(=O)Cc1ccccc1O 1458a_100000743006_100015370543 [0,2,0,0,0,0|1,0,1]=4 20662 B16R1.4621 CCC/C=C/CC(=O)Cc1ccccc1Br 1458a_200016266809_100000184730 [0,2,0,0,0,0|1,0,1]=4 20663 B16R1.4621 CCC/C=C/CC(=O)Cc1ccccc1C 1458a_200016266809_100000211839 [0,2,0,0,0,0|1,0,1]=4 20664 B16R1.4621 CCC/C=C/CC(=O)Cc1ccccc1Cl 1458a_200016266809_100000187162 [0,2,0,0,0,0|1,0,1]=4 20665 B16R1.4621 CCC/C=C/CC(=O)Cc1ccccc1F 1458a_200016266809_100000187165 [0,2,0,0,0,0|1,0,1]=4 20666 B16R1.4621 CCC/C=C/CC(=O)Cc1ccccc1I 1458a_200016266809_100011216222 [0,2,0,0,0,0|1,0,1]=4 20667 B16R1.4621 CCCC=NNC(=O)Cc1ccccc1Br 4a_200010210069_100000185831 [0,2,0,0,0,0|1,0,1]=4 20668 B16R1.4621 CCCC=NNC(=O)Cc1ccccc1Cl 4a_100000189918_100000185831 [0,2,0,0,0,0|1,0,1]=4 20669 B16R1.4621 CCCC=NNC(=O)Cc1ccccc1F 4a_100000190036_100000185831 [0,2,0,0,0,0|1,0,1]=4 20670 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1Br 1458a_100016266645_100000184730 [0,2,0,0,0,0|1,0,0]=3 20671 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1C 1458a_100016266645_100000211839 [0,2,0,0,0,0|1,0,0]=3 20672 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1Cl 1458a_100016266645_100000187162 [0,2,0,0,0,0|1,0,0]=3 20673 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1F 1458a_100016266645_100000187165 [0,2,0,0,0,0|1,0,0]=3 20674 B16R1.4621 CCCCC=CC(=O)Cc1ccccc1I 1458a_100016266645_100011216222 [0,2,0,0,0,0|1,0,0]=3 20675 B16R1.4621 CCCCC=CC(=O)Cc1cccnc1Br 1458a_100016266645_100010140945 [0,2,0,0,0,0|2,0,0]=4 20676 B16R1.4621 CCCCC=CC(=O)Cc1cccnc1C 1458a_100016266645_100000732876 [0,2,0,0,0,0|2,0,0]=4 20677 B16R1.4621 CCCCC=CC(=O)Cc1cccnc1Cl 1458a_100016266645_100000045678 [0,2,0,0,0,0|2,0,0]=4 20678 B16R1.4621 CCCCC=CC(=O)Cc1cccnc1F 1458a_100016266645_100000099810 [0,2,0,0,0,0|2,0,0]=4 20679 B16R1.4621 CCCCC=CC(=O)Cc1ccncc1C 1458a_100016266645_100020672808 [0,2,0,0,0,0|2,0,0]=4 20680 B16R1.4621 CCCCC=CC(=O)Cc1ccncc1Cl 1458a_100016266645_100000763264 [0,2,0,0,0,0|2,0,0]=4 20681 B16R1.4621 CCCCC=CC(=O)Cc1cnccc1C 1458a_100016266645_100000690890 [0,2,0,0,0,0|2,0,0]=4 20682 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1Br 1458a_100016266645_100025702911 [0,2,0,0,0,0|2,0,0]=4 20683 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1C 1458a_100016266645_100000696600 [0,2,0,0,0,0|2,0,0]=4 20684 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1Cl 1458a_100016266645_100000099807 [0,2,0,0,0,0|2,0,0]=4 20685 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1F 1458a_100016266645_100000104219 [0,2,0,0,0,0|2,0,0]=4 20686 B16R1.4621 CCCCC=CC(=O)Cc1ncccc1O 1458a_100016266645_200020655725 [0,2,0,0,0,0|2,0,0]=4 20687 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Br 11a_100000210017_100016266645 [0,2,0,0,0,0|2,0,0]=4 20688 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Br 1626a_100000210017_100016266645 [0,2,0,0,0,0|2,0,0]=4 20689 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 11a_100015192222_100016266645 [0,2,0,0,0,0|2,0,0]=4 20690 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 1626a_100015192222_100016266645 [0,2,0,0,0,0|2,0,0]=4 20691 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1C 22a_100015192222_100016266645 [0,2,0,0,0,0|2,0,0]=4 20692 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 11a_100000185783_100016266645 [0,2,0,0,0,0|2,0,0]=4 20693 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100016266645 [0,2,0,0,0,0|2,0,0]=4 20694 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1Cl 22a_100000185783_100016266645 [0,2,0,0,0,0|2,0,0]=4 20695 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 11a_100000210422_100016266645 [0,2,0,0,0,0|2,0,0]=4 20696 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 1626a_100000210422_100016266645 [0,2,0,0,0,0|2,0,0]=4 20697 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1F 22a_100000210422_100016266645 [0,2,0,0,0,0|2,0,0]=4 20698 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1I 11a_100000210053_100016266645 [0,2,0,0,0,0|2,0,0]=4 20699 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1I 1626a_100000210053_100016266645 [0,2,0,0,0,0|2,0,0]=4 20700 B16R1.4621 CCCCC=CC(=O)Nc1ccccc1O 22a_100000185747_100016266645 [0,2,0,0,0,0|2,0,0]=4 20701 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210757 [0,2,0,0,0,0|1,0,0]=3 20702 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Br 1458a_100102632555_100000184730 [0,2,0,0,0,0|1,0,0]=3 20703 B16R1.4621 CCCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210757 [0,2,0,0,0,0|1,0,0]=3 20704 B16R1.4621 CCCCCCC(=O)Cc1ccccc1C 1458a_100102632555_100000211839 [0,2,0,0,0,0|1,0,0]=3 20705 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210757 [0,2,0,0,0,0|1,0,0]=3 20706 B16R1.4621 CCCCCCC(=O)Cc1ccccc1Cl 1458a_100102632555_100000187162 [0,2,0,0,0,0|1,0,0]=3 20707 B16R1.4621 CCCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210757 [0,2,0,0,0,0|1,0,0]=3 20708 B16R1.4621 CCCCCCC(=O)Cc1ccccc1F 1458a_100102632555_100000187165 [0,2,0,0,0,0|1,0,0]=3 20709 B16R1.4621 CCCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210757 [0,2,0,0,0,0|1,0,0]=3 20710 B16R1.4621 CCCCCCC(=O)Cc1ccccc1I 1458a_100102632555_100011216222 [0,2,0,0,0,0|1,0,0]=3 20711 B16R1.4621 CCCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210757 [0,2,0,0,0,0|1,0,0]=3 20712 B16R1.4621 CCCCCCC(=O)Cc1cccnc1Br 1458a_100102632555_100010140945 [0,2,0,0,0,0|2,0,0]=4 20713 B16R1.4621 CCCCCCC(=O)Cc1cccnc1C 1458a_100102632555_100000732876 [0,2,0,0,0,0|2,0,0]=4 20714 B16R1.4621 CCCCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210757 [0,2,0,0,0,0|2,0,0]=4 20715 B16R1.4621 CCCCCCC(=O)Cc1cccnc1Cl 1458a_100102632555_100000045678 [0,2,0,0,0,0|2,0,0]=4 20716 B16R1.4621 CCCCCCC(=O)Cc1cccnc1F 1458a_100102632555_100000099810 [0,2,0,0,0,0|2,0,0]=4 20717 B16R1.4621 CCCCCCC(=O)Cc1ccncc1C 1458a_100102632555_100020672808 [0,2,0,0,0,0|2,0,0]=4 20718 B16R1.4621 CCCCCCC(=O)Cc1ccncc1Cl 1458a_100102632555_100000763264 [0,2,0,0,0,0|2,0,0]=4 20719 B16R1.4621 CCCCCCC(=O)Cc1cnccc1C 1458a_100102632555_100000690890 [0,2,0,0,0,0|2,0,0]=4 20720 B16R1.4621 CCCCCCC(=O)Cc1ncccc1Br 1458a_100102632555_100025702911 [0,2,0,0,0,0|2,0,0]=4 20721 B16R1.4621 CCCCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210757 [0,2,0,0,0,0|2,0,0]=4 20722 B16R1.4621 CCCCCCC(=O)Cc1ncccc1C 1458a_100102632555_100000696600 [0,2,0,0,0,0|2,0,0]=4 20723 B16R1.4621 CCCCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210757 [0,2,0,0,0,0|2,0,0]=4 20724 B16R1.4621 CCCCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210757 [0,2,0,0,0,0|2,0,0]=4 20725 B16R1.4621 CCCCCCC(=O)Cc1ncccc1Cl 1458a_100102632555_100000099807 [0,2,0,0,0,0|2,0,0]=4 20726 B16R1.4621 CCCCCCC(=O)Cc1ncccc1F 1458a_100102632555_100000104219 [0,2,0,0,0,0|2,0,0]=4 20727 B16R1.4621 CCCCCCC(=O)Cc1ncccc1O 1458a_100102632555_200020655725 [0,2,0,0,0,0|2,0,0]=4 20728 B16R1.4621 CCCCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210757 [0,2,0,0,0,0|2,0,0]=4 20729 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Br 11a_100000210017_100102632555 [0,2,0,0,0,0|2,0,0]=4 20730 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100102632555 [0,2,0,0,0,0|2,0,0]=4 20731 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 11a_100015192222_100102632555 [0,2,0,0,0,0|2,0,0]=4 20732 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 1626a_100015192222_100102632555 [0,2,0,0,0,0|2,0,0]=4 20733 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 22a_100015192222_100102632555 [0,2,0,0,0,0|2,0,0]=4 20734 B16R1.4621 CCCCCCC(=O)Nc1ccccc1C 527a_100015192222_100102632555 [0,2,0,0,0,0|2,0,0]=4 20735 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100102632555 [0,2,0,0,0,0|2,0,0]=4 20736 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100102632555 [0,2,0,0,0,0|2,0,0]=4 20737 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100102632555 [0,2,0,0,0,0|2,0,0]=4 20738 B16R1.4621 CCCCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100102632555 [0,2,0,0,0,0|2,0,0]=4 20739 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 11a_100000210422_100102632555 [0,2,0,0,0,0|2,0,0]=4 20740 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 1626a_100000210422_100102632555 [0,2,0,0,0,0|2,0,0]=4 20741 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 22a_100000210422_100102632555 [0,2,0,0,0,0|2,0,0]=4 20742 B16R1.4621 CCCCCCC(=O)Nc1ccccc1F 527a_100000210422_100102632555 [0,2,0,0,0,0|2,0,0]=4 20743 B16R1.4621 CCCCCCC(=O)Nc1ccccc1I 11a_100000210053_100102632555 [0,2,0,0,0,0|2,0,0]=4 20744 B16R1.4621 CCCCCCC(=O)Nc1ccccc1I 1626a_100000210053_100102632555 [0,2,0,0,0,0|2,0,0]=4 20745 B16R1.4621 CCCCCCC(=O)Nc1ccccc1O 22a_100000185747_100102632555 [0,2,0,0,0,0|2,0,0]=4 20746 B16R1.4621 CCCCCCC(=O)Nc1ccccc1O 527a_100000185747_100102632555 [0,2,0,0,0,0|2,0,0]=4 20747 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 11a_100000209983_100000751119 [0,2,0,0,0,0|1,0,0]=3 20748 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 240690a_100000209983_100000751119 [0,2,0,0,0,0|1,0,0]=3 20749 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Br 527a_100000209983_100000751119 [0,2,0,0,0,0|1,0,0]=3 20750 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 11a_100000209983_100000212180 [0,2,0,0,0,0|1,0,0]=3 20751 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 1626a_100000209983_100000212180 [0,2,0,0,0,0|1,0,0]=3 20752 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 240690a_100000209983_100000212180 [0,2,0,0,0,0|1,0,0]=3 20753 B16R1.4621 CCCCCNC(=O)Cc1ccccc1C 527a_100000209983_100000212180 [0,2,0,0,0,0|1,0,0]=3 20754 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 11a_100000209983_100000183793 [0,2,0,0,0,0|1,0,0]=3 20755 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 1626a_100000209983_100000183793 [0,2,0,0,0,0|1,0,0]=3 20756 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 240690a_100000209983_100000183793 [0,2,0,0,0,0|1,0,0]=3 20757 B16R1.4621 CCCCCNC(=O)Cc1ccccc1Cl 527a_100000209983_100000183793 [0,2,0,0,0,0|1,0,0]=3 20758 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 11a_100000209983_100000212012 [0,2,0,0,0,0|1,0,0]=3 20759 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 1626a_100000209983_100000212012 [0,2,0,0,0,0|1,0,0]=3 20760 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 240690a_100000209983_100000212012 [0,2,0,0,0,0|1,0,0]=3 20761 B16R1.4621 CCCCCNC(=O)Cc1ccccc1F 527a_100000209983_100000212012 [0,2,0,0,0,0|1,0,0]=3 20762 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 11a_100000209983_100000036491 [0,2,0,0,0,0|1,0,0]=3 20763 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 1626a_100000209983_100000036491 [0,2,0,0,0,0|1,0,0]=3 20764 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 240690a_100000209983_100000036491 [0,2,0,0,0,0|1,0,0]=3 20765 B16R1.4621 CCCCCNC(=O)Cc1ccccc1I 527a_100000209983_100000036491 [0,2,0,0,0,0|1,0,0]=3 20766 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O 240690a_100000209983_100000743006 [0,2,0,0,0,0|1,0,0]=3 20767 B16R1.4621 CCCCCNC(=O)Cc1ccccc1O 527a_100000209983_100000743006 [0,2,0,0,0,0|1,0,0]=3 20768 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl 11a_100000209983_100000093521 [0,2,0,0,0,0|2,0,0]=4 20769 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl 1626a_100000209983_100000093521 [0,2,0,0,0,0|2,0,0]=4 20770 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl 240690a_100000209983_100000093521 [0,2,0,0,0,0|2,0,0]=4 20771 B16R1.4621 CCCCCNC(=O)Cc1cccnc1Cl 527a_100000209983_100000093521 [0,2,0,0,0,0|2,0,0]=4 20772 B16R1.4621 CCCCCNC(=O)Cc1ncccc1Br 11a_100000209983_200012357574 [0,2,0,0,0,0|2,0,0]=4 20773 B16R1.4621 CCCCCNC(=O)Cc1ncccc1Br 240690a_100000209983_200012357574 [0,2,0,0,0,0|2,0,0]=4 20774 B16R1.4621 CCCCCNC(=O)Cc1ncccc1C 11a_100000209983_200000722269 [0,2,0,0,0,0|2,0,0]=4 20775 B16R1.4621 CCCCCNC(=O)Cc1ncccc1C 1626a_100000209983_200000722269 [0,2,0,0,0,0|2,0,0]=4 20776 B16R1.4621 CCCCCNC(=O)Cc1ncccc1C 240690a_100000209983_200000722269 [0,2,0,0,0,0|2,0,0]=4 20777 B16R1.4621 CCCCCNC(=O)Cc1ncccc1Cl 11a_100000209983_100011998755 [0,2,0,0,0,0|2,0,0]=4 20778 B16R1.4621 CCCCCNC(=O)Cc1ncccc1Cl 240690a_100000209983_100011998755 [0,2,0,0,0,0|2,0,0]=4 20779 B16R1.4621 CCCCCNC(=O)Cc1ncccc1Cl 527a_100000209983_100011998755 [0,2,0,0,0,0|2,0,0]=4 20780 B16R1.4621 CCCCCNC(=O)Cn1ccccc1=O 1626a_100000209983_100000189665 [0,2,0,0,0,0|2,0,0]=4 20781 B16R1.4621 CCCCCNC(=O)Cn1ccccc1=O 240690a_100000209983_100000189665 [0,2,0,0,0,0|2,0,0]=4 20782 B16R1.4621 CCCCCNC(=O)Cn1ccccc1=O 527a_100000209983_100000189665 [0,2,0,0,0,0|2,0,0]=4 20783 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000209983 [0,2,0,0,0,0|2,0,0]=4 20784 B16R1.4621 CCCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000209983 [0,2,0,0,0,0|2,0,0]=4 20785 B16R1.4621 CCCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000209983 [0,2,0,0,0,0|2,0,0]=4 20786 B16R1.4621 CCCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000209983 [0,2,0,0,0,0|2,0,0]=4 20787 B16R1.4621 CCCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000209983 [0,2,0,0,0,0|2,0,0]=4 20788 B16R1.4621 CCCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000209983 [0,2,0,0,0,0|2,0,0]=4 20789 B16R1.4621 CCCCNCC(=O)Cc1ccccc1Br 2230a_100000102301_100000700504 [0,2,0,0,0,0|1,0,0]=3 20790 B16R1.4621 CCCCNCC(=O)Cc1ccccc1Br 7a_106832991798_100000700504 [0,2,0,0,0,0|1,0,0]=3 20791 B16R1.4621 CCCCNCC(=O)Cc1ccccc1C 2230a_100000102301_100011223134 [0,2,0,0,0,0|1,0,0]=3 20792 B16R1.4621 CCCCNCC(=O)Cc1ccccc1C 7a_106832991798_100011223134 [0,2,0,0,0,0|1,0,0]=3 20793 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 2230a_100000102301_100000182372 [0,2,0,0,0,0|2,0,0]=4 20794 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 2230a_100000683505_100000210211 [0,2,0,0,0,0|2,0,0]=4 20795 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Br 7a_106832991798_100000182372 [0,2,0,0,0,0|2,0,0]=4 20796 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 2230a_100000102301_100000183529 [0,2,0,0,0,0|2,0,0]=4 20797 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 2230a_100015186652_100000210211 [0,2,0,0,0,0|2,0,0]=4 20798 B16R1.4621 CCCCNCC(=O)Nc1ccccc1C 7a_106832991798_100000183529 [0,2,0,0,0,0|2,0,0]=4 20799 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Cl 2230a_100000102301_100000182448 [0,2,0,0,0,0|2,0,0]=4 20800 B16R1.4621 CCCCNCC(=O)Nc1ccccc1Cl 7a_106832991798_100000182448 [0,2,0,0,0,0|2,0,0]=4 20801 B16R1.4621 CCCCNCC(=O)Nc1ccccc1F 2230a_100000102301_100000182988 [0,2,0,0,0,0|2,0,0]=4 20802 B16R1.4621 CCCCNCC(=O)Nc1ccccc1F 7a_106832991798_100000182988 [0,2,0,0,0,0|2,0,0]=4 20803 B16R1.4621 CCCCNCC(=O)Nc1ccccc1I 2230a_100000102301_100000180142 [0,2,0,0,0,0|2,0,0]=4 20804 B16R1.4621 CCCCNCC(=O)Nc1ccccc1I 7a_106832991798_100000180142 [0,2,0,0,0,0|2,0,0]=4 20805 B16R1.4621 CCCCNCC(=O)Nc1ccccc1O 7a_106832991798_100000014494 [0,2,0,0,0,0|2,0,0]=4 20806 B16R1.4621 CCCCNN=C(C)Cc1ccccc1Cl 4a_100025702795_100000758791 [0,2,0,0,0,0|2,0,0]=4 20807 B16R1.4621 CCCCNNC(=O)Cc1ccccc1Br 22a_100025702795_100000751119 [0,2,0,0,0,0|1,0,0]=3 20808 B16R1.4621 CCCCNNC(=O)Cc1ccccc1C 22a_100025702795_100000212180 [0,2,0,0,0,0|1,0,0]=3 20809 B16R1.4621 CCCCNNC(=O)Cc1ccccc1Cl 22a_100025702795_100000183793 [0,2,0,0,0,0|1,0,0]=3 20810 B16R1.4621 CCCCNNC(=O)Cc1ccccc1F 22a_100025702795_100000212012 [0,2,0,0,0,0|1,0,0]=3 20811 B16R1.4621 CCCCNNC(=O)Cc1ccccc1I 22a_100025702795_100000036491 [0,2,0,0,0,0|1,0,0]=3 20812 B16R1.4621 CCCCNNC(=O)Cc1ccccc1O 22a_100025702795_100000743006 [0,2,0,0,0,0|1,0,0]=3 20813 B16R1.4621 CCCCNNC(=O)Cc1cccnc1Cl 22a_100025702795_100000093521 [0,2,0,0,0,0|2,0,0]=4 20814 B16R1.4621 CCCCNNC(=O)Cc1ncccc1Br 22a_100025702795_200012357574 [0,2,0,0,0,0|2,0,0]=4 20815 B16R1.4621 CCCCNNC(=O)Cn1ccccc1=O 22a_100025702795_100000189665 [0,2,0,0,0,0|2,0,0]=4 20816 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 1458a_100000751119_100011995733 [0,2,0,0,0,0|0,0,0]=2 20817 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 1458a_100000757543_100000184730 [0,2,0,0,0,0|0,0,0]=2 20818 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 34a_100000210227_100000700504 [0,2,0,0,0,0|0,0,0]=2 20819 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Br 7a_100000210227_100000700504 [0,2,0,0,0,0|0,0,0]=2 20820 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 1458a_100000212180_100011995733 [0,2,0,0,0,0|0,0,0]=2 20821 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 1458a_100000757543_100000211839 [0,2,0,0,0,0|0,0,0]=2 20822 B16R1.4621 CCCCOCC(=O)Cc1ccccc1C 7a_100000210227_100011223134 [0,2,0,0,0,0|0,0,0]=2 20823 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011995733 [0,2,0,0,0,0|0,0,0]=2 20824 B16R1.4621 CCCCOCC(=O)Cc1ccccc1Cl 1458a_100000757543_100000187162 [0,2,0,0,0,0|0,0,0]=2 20825 B16R1.4621 CCCCOCC(=O)Cc1ccccc1F 1458a_100000212012_100011995733 [0,2,0,0,0,0|0,0,0]=2 20826 B16R1.4621 CCCCOCC(=O)Cc1ccccc1F 1458a_100000757543_100000187165 [0,2,0,0,0,0|0,0,0]=2 20827 B16R1.4621 CCCCOCC(=O)Cc1ccccc1I 1458a_100000036491_100011995733 [0,2,0,0,0,0|0,0,0]=2 20828 B16R1.4621 CCCCOCC(=O)Cc1ccccc1I 1458a_100000757543_100011216222 [0,2,0,0,0,0|0,0,0]=2 20829 B16R1.4621 CCCCOCC(=O)Cc1ccccc1O 1458a_100000743006_100011995733 [0,2,0,0,0,0|0,0,0]=2 20830 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Br 1458a_100000757543_100010140945 [0,2,0,0,0,0|1,0,0]=3 20831 B16R1.4621 CCCCOCC(=O)Cc1cccnc1C 1458a_100000757543_100000732876 [0,2,0,0,0,0|1,0,0]=3 20832 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Cl 1458a_100000093521_100011995733 [0,2,0,0,0,0|1,0,0]=3 20833 B16R1.4621 CCCCOCC(=O)Cc1cccnc1Cl 1458a_100000757543_100000045678 [0,2,0,0,0,0|1,0,0]=3 20834 B16R1.4621 CCCCOCC(=O)Cc1cccnc1F 1458a_100000757543_100000099810 [0,2,0,0,0,0|1,0,0]=3 20835 B16R1.4621 CCCCOCC(=O)Cc1ccncc1C 1458a_100000757543_100020672808 [0,2,0,0,0,0|1,0,0]=3 20836 B16R1.4621 CCCCOCC(=O)Cc1ccncc1Cl 1458a_100000757543_100000763264 [0,2,0,0,0,0|1,0,0]=3 20837 B16R1.4621 CCCCOCC(=O)Cc1cnccc1C 1458a_100000757543_100000690890 [0,2,0,0,0,0|1,0,0]=3 20838 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Br 1458a_100000757543_100025702911 [0,2,0,0,0,0|1,0,0]=3 20839 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Br 1458a_200012357574_100011995733 [0,2,0,0,0,0|1,0,0]=3 20840 B16R1.4621 CCCCOCC(=O)Cc1ncccc1C 1458a_100000757543_100000696600 [0,2,0,0,0,0|1,0,0]=3 20841 B16R1.4621 CCCCOCC(=O)Cc1ncccc1C 1458a_200000722269_100011995733 [0,2,0,0,0,0|1,0,0]=3 20842 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Cl 1458a_100000757543_100000099807 [0,2,0,0,0,0|1,0,0]=3 20843 B16R1.4621 CCCCOCC(=O)Cc1ncccc1Cl 1458a_100011998755_100011995733 [0,2,0,0,0,0|1,0,0]=3 20844 B16R1.4621 CCCCOCC(=O)Cc1ncccc1F 1458a_100000757543_100000104219 [0,2,0,0,0,0|1,0,0]=3 20845 B16R1.4621 CCCCOCC(=O)Cc1ncccc1O 1458a_100000757543_200020655725 [0,2,0,0,0,0|1,0,0]=3 20846 B16R1.4621 CCCCOCC(=O)Cn1ccccc1=O 1458a_100000189665_100011995733 [0,2,0,0,0,0|1,0,0]=3 20847 B16R1.4621 CCCCOCC(=O)Cn1cccnc1=O 1458a_100000738077_100011995733 [0,2,0,0,0,0|2,0,0]=4 20848 B16R1.4621 CCCCOCC(=O)Cn1ncccc1=O 1458a_100000238584_100011995733 [0,2,0,0,0,0|2,0,0]=4 20849 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000757543 [0,2,0,0,0,0|1,0,0]=3 20850 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000757543 [0,2,0,0,0,0|1,0,0]=3 20851 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Br 7a_100000210227_100000182372 [0,2,0,0,0,0|1,0,0]=3 20852 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000757543 [0,2,0,0,0,0|1,0,0]=3 20853 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000757543 [0,2,0,0,0,0|1,0,0]=3 20854 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000757543 [0,2,0,0,0,0|1,0,0]=3 20855 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 34a_100000210227_100000183529 [0,2,0,0,0,0|1,0,0]=3 20856 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000757543 [0,2,0,0,0,0|1,0,0]=3 20857 B16R1.4621 CCCCOCC(=O)Nc1ccccc1C 7a_100000210227_100000183529 [0,2,0,0,0,0|1,0,0]=3 20858 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000757543 [0,2,0,0,0,0|1,0,0]=3 20859 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000757543 [0,2,0,0,0,0|1,0,0]=3 20860 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000757543 [0,2,0,0,0,0|1,0,0]=3 20861 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 34a_100000210227_100000182448 [0,2,0,0,0,0|1,0,0]=3 20862 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000757543 [0,2,0,0,0,0|1,0,0]=3 20863 B16R1.4621 CCCCOCC(=O)Nc1ccccc1Cl 7a_100000210227_100000182448 [0,2,0,0,0,0|1,0,0]=3 20864 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000757543 [0,2,0,0,0,0|1,0,0]=3 20865 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000757543 [0,2,0,0,0,0|1,0,0]=3 20866 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000757543 [0,2,0,0,0,0|1,0,0]=3 20867 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 34a_100000210227_100000243840 [0,2,0,0,0,0|1,0,0]=3 20868 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000757543 [0,2,0,0,0,0|1,0,0]=3 20869 B16R1.4621 CCCCOCC(=O)Nc1ccccc1F 7a_100000210227_100000182988 [0,2,0,0,0,0|1,0,0]=3 20870 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000757543 [0,2,0,0,0,0|1,0,0]=3 20871 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000757543 [0,2,0,0,0,0|1,0,0]=3 20872 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 34a_100000210227_100000180142 [0,2,0,0,0,0|1,0,0]=3 20873 B16R1.4621 CCCCOCC(=O)Nc1ccccc1I 7a_100000210227_100000180142 [0,2,0,0,0,0|1,0,0]=3 20874 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000757543 [0,2,0,0,0,0|1,0,0]=3 20875 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000757543 [0,2,0,0,0,0|1,0,0]=3 20876 B16R1.4621 CCCCOCC(=O)Nc1ccccc1O 7a_100000210227_100000014494 [0,2,0,0,0,0|1,0,0]=3 20877 B16R1.4621 CCCCOCC(N)Cc1ccccc1Cl 34a_100012001541_100000210210 [0,2,0,0,0,0|1,0,1]=4 20878 B16R1.4621 CCCCOCN(C)Cc1ccccc1Br 2230a_100000184654_100011995733 [0,2,0,0,0,0|2,0,0]=4 20879 B16R1.4621 CCCCOCN(C)Cc1ccccc1Br 269982a_100000184654_100011995733 [0,2,0,0,0,0|2,0,0]=4 20880 B16R1.4621 CCCCOCN(C)Cc1ccccc1C 2230a_100000184421_100011995733 [0,2,0,0,0,0|2,0,0]=4 20881 B16R1.4621 CCCCOCN(C)Cc1ccccc1C 269982a_100000184421_100011995733 [0,2,0,0,0,0|2,0,0]=4 20882 B16R1.4621 CCCCOCN(C)Cc1ccccc1Cl 2230a_100000184507_100011995733 [0,2,0,0,0,0|2,0,0]=4 20883 B16R1.4621 CCCCOCN(C)Cc1ccccc1Cl 269982a_100000184507_100011995733 [0,2,0,0,0,0|2,0,0]=4 20884 B16R1.4621 CCCCOCN(C)Cc1ccccc1F 2230a_100000742528_100011995733 [0,2,0,0,0,0|2,0,0]=4 20885 B16R1.4621 CCCCOCN(C)Cc1ccccc1F 269982a_100000742528_100011995733 [0,2,0,0,0,0|2,0,0]=4 20886 B16R1.4621 CCCCOCN(C)Cc1ccccc1F 34a_100000742528_100011995733 [0,2,0,0,0,0|2,0,0]=4 20887 B16R1.4621 CCCCOCN(C)Cc1ccccc1O 2230a_100015189988_100011995733 [0,2,0,0,0,0|2,0,0]=4 20888 B16R1.4621 CCCCOCN(C)Cc1ccccc1O 269982a_100015189988_100011995733 [0,2,0,0,0,0|2,0,0]=4 20889 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 1458a_100000191162_100000184730 [0,2,0,0,0,0|0,1,0]=3 20890 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 62a_100000210211_100000700504 [0,2,0,0,0,0|0,1,0]=3 20891 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210210 [0,2,0,0,0,0|0,1,0]=3 20892 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 1458a_100000191162_100000211839 [0,2,0,0,0,0|0,1,0]=3 20893 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 62a_100000210211_100011223134 [0,2,0,0,0,0|0,1,0]=3 20894 B16R1.4621 CCCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210210 [0,2,0,0,0,0|0,1,0]=3 20895 B16R1.4621 CCCCSCC(=O)Cc1ccccc1Cl 1458a_100000191162_100000187162 [0,2,0,0,0,0|0,1,0]=3 20896 B16R1.4621 CCCCSCC(=O)Cc1ccccc1F 1458a_100000191162_100000187165 [0,2,0,0,0,0|0,1,0]=3 20897 B16R1.4621 CCCCSCC(=O)Cc1ccccc1I 1458a_100000191162_100011216222 [0,2,0,0,0,0|0,1,0]=3 20898 B16R1.4621 CCCCSCC(=O)Cc1cccnc1Br 1458a_100000191162_100010140945 [0,2,0,0,0,0|1,1,0]=4 20899 B16R1.4621 CCCCSCC(=O)Cc1cccnc1C 1458a_100000191162_100000732876 [0,2,0,0,0,0|1,1,0]=4 20900 B16R1.4621 CCCCSCC(=O)Cc1cccnc1Cl 1458a_100000191162_100000045678 [0,2,0,0,0,0|1,1,0]=4 20901 B16R1.4621 CCCCSCC(=O)Cc1cccnc1F 1458a_100000191162_100000099810 [0,2,0,0,0,0|1,1,0]=4 20902 B16R1.4621 CCCCSCC(=O)Cc1ccncc1C 1458a_100000191162_100020672808 [0,2,0,0,0,0|1,1,0]=4 20903 B16R1.4621 CCCCSCC(=O)Cc1ccncc1Cl 1458a_100000191162_100000763264 [0,2,0,0,0,0|1,1,0]=4 20904 B16R1.4621 CCCCSCC(=O)Cc1cnccc1C 1458a_100000191162_100000690890 [0,2,0,0,0,0|1,1,0]=4 20905 B16R1.4621 CCCCSCC(=O)Cc1ncccc1Br 1458a_100000191162_100025702911 [0,2,0,0,0,0|1,1,0]=4 20906 B16R1.4621 CCCCSCC(=O)Cc1ncccc1C 1458a_100000191162_100000696600 [0,2,0,0,0,0|1,1,0]=4 20907 B16R1.4621 CCCCSCC(=O)Cc1ncccc1Cl 1458a_100000191162_100000099807 [0,2,0,0,0,0|1,1,0]=4 20908 B16R1.4621 CCCCSCC(=O)Cc1ncccc1F 1458a_100000191162_100000104219 [0,2,0,0,0,0|1,1,0]=4 20909 B16R1.4621 CCCCSCC(=O)Cc1ncccc1O 1458a_100000191162_200020655725 [0,2,0,0,0,0|1,1,0]=4 20910 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 11a_100000210017_100000191162 [0,2,0,0,0,0|1,1,0]=4 20911 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 1626a_100000210017_100000191162 [0,2,0,0,0,0|1,1,0]=4 20912 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 62a_100000182372_100000210210 [0,2,0,0,0,0|1,1,0]=4 20913 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Br 62a_100000210211_100000182372 [0,2,0,0,0,0|1,1,0]=4 20914 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 11a_100015192222_100000191162 [0,2,0,0,0,0|1,1,0]=4 20915 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 1626a_100015192222_100000191162 [0,2,0,0,0,0|1,1,0]=4 20916 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 22a_100015192222_100000191162 [0,2,0,0,0,0|1,1,0]=4 20917 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 527a_100015192222_100000191162 [0,2,0,0,0,0|1,1,0]=4 20918 B16R1.4621 CCCCSCC(=O)Nc1ccccc1C 62a_100000210211_100000183529 [0,2,0,0,0,0|1,1,0]=4 20919 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000191162 [0,2,0,0,0,0|1,1,0]=4 20920 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000191162 [0,2,0,0,0,0|1,1,0]=4 20921 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000191162 [0,2,0,0,0,0|1,1,0]=4 20922 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000191162 [0,2,0,0,0,0|1,1,0]=4 20923 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 62a_100000210211_100000182448 [0,2,0,0,0,0|1,1,0]=4 20924 B16R1.4621 CCCCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210210 [0,2,0,0,0,0|1,1,0]=4 20925 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 11a_100000210422_100000191162 [0,2,0,0,0,0|1,1,0]=4 20926 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 1626a_100000210422_100000191162 [0,2,0,0,0,0|1,1,0]=4 20927 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 22a_100000210422_100000191162 [0,2,0,0,0,0|1,1,0]=4 20928 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 527a_100000210422_100000191162 [0,2,0,0,0,0|1,1,0]=4 20929 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 62a_100000182988_100000210210 [0,2,0,0,0,0|1,1,0]=4 20930 B16R1.4621 CCCCSCC(=O)Nc1ccccc1F 62a_100000210211_100000182988 [0,2,0,0,0,0|1,1,0]=4 20931 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 11a_100000210053_100000191162 [0,2,0,0,0,0|1,1,0]=4 20932 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 1626a_100000210053_100000191162 [0,2,0,0,0,0|1,1,0]=4 20933 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 62a_100000180142_100000210210 [0,2,0,0,0,0|1,1,0]=4 20934 B16R1.4621 CCCCSCC(=O)Nc1ccccc1I 62a_100000210211_100000180142 [0,2,0,0,0,0|1,1,0]=4 20935 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 22a_100000185747_100000191162 [0,2,0,0,0,0|1,1,0]=4 20936 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 527a_100000185747_100000191162 [0,2,0,0,0,0|1,1,0]=4 20937 B16R1.4621 CCCCSCC(=O)Nc1ccccc1O 62a_100000210211_100000014494 [0,2,0,0,0,0|1,1,0]=4 20938 B16R1.4621 CCCNCCC(=O)Nc1ccccc1C 2230a_200015185780_100000210303 [0,2,0,0,0,0|2,0,0]=4 20939 B16R1.4621 CCCNCCC(=O)Nc1ccccc1C 34a_200015185780_100000210303 [0,2,0,0,0,0|2,0,0]=4 20940 B16R1.4621 CCCNCCC(=O)Nc1ccccc1F 2230a_100015185137_100000210303 [0,2,0,0,0,0|2,0,0]=4 20941 B16R1.4621 CCCNCCC(=O)Nc1ccccc1F 34a_100015185137_100000210303 [0,2,0,0,0,0|2,0,0]=4 20942 B16R1.4621 CCCOCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215938 [0,2,0,0,0,0|1,0,0]=3 20943 B16R1.4621 CCCOCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215938 [0,2,0,0,0,0|1,0,0]=3 20944 B16R1.4621 CCCOCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215938 [0,2,0,0,0,0|1,0,0]=3 20945 B16R1.4621 CCCOCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215938 [0,2,0,0,0,0|1,0,0]=3 20946 B16R1.4621 CCCOCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215938 [0,2,0,0,0,0|1,0,0]=3 20947 B16R1.4621 CCCOCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215938 [0,2,0,0,0,0|1,0,0]=3 20948 B16R1.4621 CCCOCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100011215938 [0,2,0,0,0,0|2,0,0]=4 20949 B16R1.4621 CCCOCCC(=O)Cc1ncccc1Br 1458a_200012357574_100011215938 [0,2,0,0,0,0|2,0,0]=4 20950 B16R1.4621 CCCOCCC(=O)Cc1ncccc1C 1458a_200000722269_100011215938 [0,2,0,0,0,0|2,0,0]=4 20951 B16R1.4621 CCCOCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100011215938 [0,2,0,0,0,0|2,0,0]=4 20952 B16R1.4621 CCCOCCC(=O)Cn1ccccc1=O 1458a_100000189665_100011215938 [0,2,0,0,0,0|2,0,0]=4 20953 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Br 62a_100000181489_100000210303 [0,2,0,0,0,0|2,0,0]=4 20954 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Br 62a_100000210303_100000181489 [0,2,0,0,0,0|2,0,0]=4 20955 B16R1.4621 CCCSCCC(=O)Nc1ccccc1C 62a_100000210303_200011206476 [0,2,0,0,0,0|2,0,0]=4 20956 B16R1.4621 CCCSCCC(=O)Nc1ccccc1Cl 62a_100000210303_100000242055 [0,2,0,0,0,0|2,0,0]=4 20957 B16R1.4621 CCCSCCC(=O)Nc1ccccc1F 62a_100000210303_100000242066 [0,2,0,0,0,0|2,0,0]=4 20958 B16R1.4621 CCCSCCC(=O)Nc1ccccc1F 62a_100011216740_100000210303 [0,2,0,0,0,0|2,0,0]=4 20959 B16R1.4621 CCOCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100012232248 [0,2,0,0,0,0|1,0,0]=3 20960 B16R1.4621 CCOCCCC(=O)Cc1ccccc1C 1458a_100000212180_100012232248 [0,2,0,0,0,0|1,0,0]=3 20961 B16R1.4621 CCOCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100012232248 [0,2,0,0,0,0|1,0,0]=3 20962 B16R1.4621 CCOCCCC(=O)Cc1ccccc1F 1458a_100000212012_100012232248 [0,2,0,0,0,0|1,0,0]=3 20963 B16R1.4621 CCOCCCC(=O)Cc1ccccc1I 1458a_100000036491_100012232248 [0,2,0,0,0,0|1,0,0]=3 20964 B16R1.4621 CCOCCCC(=O)Cc1ccccc1O 1458a_100000743006_100012232248 [0,2,0,0,0,0|1,0,0]=3 20965 B16R1.4621 CCOCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100012232248 [0,2,0,0,0,0|2,0,0]=4 20966 B16R1.4621 CCOCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100012232248 [0,2,0,0,0,0|2,0,0]=4 20967 B16R1.4621 CCOCCCC(=O)Cc1ncccc1C 1458a_200000722269_100012232248 [0,2,0,0,0,0|2,0,0]=4 20968 B16R1.4621 CCOCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100012232248 [0,2,0,0,0,0|2,0,0]=4 20969 B16R1.4621 CCOCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100012232248 [0,2,0,0,0,0|2,0,0]=4 20970 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 11a_100011200944_100000751119 [0,2,0,0,0,0|1,0,0]=3 20971 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 240690a_100011200944_100000751119 [0,2,0,0,0,0|1,0,0]=3 20972 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Br 527a_100011200944_100000751119 [0,2,0,0,0,0|1,0,0]=3 20973 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 11a_100011200944_100000212180 [0,2,0,0,0,0|1,0,0]=3 20974 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 1626a_102516460346_100000212180 [0,2,0,0,0,0|1,0,0]=3 20975 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 240690a_100011200944_100000212180 [0,2,0,0,0,0|1,0,0]=3 20976 B16R1.4621 CCOCCNC(=O)Cc1ccccc1C 527a_100011200944_100000212180 [0,2,0,0,0,0|1,0,0]=3 20977 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 11a_100011200944_100000183793 [0,2,0,0,0,0|1,0,0]=3 20978 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 1626a_102516460346_100000183793 [0,2,0,0,0,0|1,0,0]=3 20979 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 240690a_100011200944_100000183793 [0,2,0,0,0,0|1,0,0]=3 20980 B16R1.4621 CCOCCNC(=O)Cc1ccccc1Cl 527a_100011200944_100000183793 [0,2,0,0,0,0|1,0,0]=3 20981 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 11a_100011200944_100000212012 [0,2,0,0,0,0|1,0,0]=3 20982 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 1626a_102516460346_100000212012 [0,2,0,0,0,0|1,0,0]=3 20983 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 240690a_100011200944_100000212012 [0,2,0,0,0,0|1,0,0]=3 20984 B16R1.4621 CCOCCNC(=O)Cc1ccccc1F 527a_100011200944_100000212012 [0,2,0,0,0,0|1,0,0]=3 20985 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 11a_100011200944_100000036491 [0,2,0,0,0,0|1,0,0]=3 20986 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 1626a_102516460346_100000036491 [0,2,0,0,0,0|1,0,0]=3 20987 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 240690a_100011200944_100000036491 [0,2,0,0,0,0|1,0,0]=3 20988 B16R1.4621 CCOCCNC(=O)Cc1ccccc1I 527a_100011200944_100000036491 [0,2,0,0,0,0|1,0,0]=3 20989 B16R1.4621 CCOCCNC(=O)Cc1ccccc1O 240690a_100011200944_100000743006 [0,2,0,0,0,0|1,0,0]=3 20990 B16R1.4621 CCOCCNC(=O)Cc1ccccc1O 527a_100011200944_100000743006 [0,2,0,0,0,0|1,0,0]=3 20991 B16R1.4621 CCOCCNC(=O)Cc1cccnc1Cl 11a_100011200944_100000093521 [0,2,0,0,0,0|2,0,0]=4 20992 B16R1.4621 CCOCCNC(=O)Cc1cccnc1Cl 1626a_102516460346_100000093521 [0,2,0,0,0,0|2,0,0]=4 20993 B16R1.4621 CCOCCNC(=O)Cc1cccnc1Cl 240690a_100011200944_100000093521 [0,2,0,0,0,0|2,0,0]=4 20994 B16R1.4621 CCOCCNC(=O)Cc1cccnc1Cl 527a_100011200944_100000093521 [0,2,0,0,0,0|2,0,0]=4 20995 B16R1.4621 CCOCCNC(=O)Cc1ncccc1Br 11a_100011200944_200012357574 [0,2,0,0,0,0|2,0,0]=4 20996 B16R1.4621 CCOCCNC(=O)Cc1ncccc1Br 240690a_100011200944_200012357574 [0,2,0,0,0,0|2,0,0]=4 20997 B16R1.4621 CCOCCNC(=O)Cc1ncccc1C 11a_100011200944_200000722269 [0,2,0,0,0,0|2,0,0]=4 20998 B16R1.4621 CCOCCNC(=O)Cc1ncccc1C 1626a_102516460346_200000722269 [0,2,0,0,0,0|2,0,0]=4 20999 B16R1.4621 CCOCCNC(=O)Cc1ncccc1C 240690a_100011200944_200000722269 [0,2,0,0,0,0|2,0,0]=4 21000 B16R1.4621 CCOCCNC(=O)Cc1ncccc1Cl 11a_100011200944_100011998755 [0,2,0,0,0,0|2,0,0]=4 21001 B16R1.4621 CCOCCNC(=O)Cc1ncccc1Cl 240690a_100011200944_100011998755 [0,2,0,0,0,0|2,0,0]=4 21002 B16R1.4621 CCOCCNC(=O)Cc1ncccc1Cl 527a_100011200944_100011998755 [0,2,0,0,0,0|2,0,0]=4 21003 B16R1.4621 CCOCCNC(=O)Cn1ccccc1=O 1626a_102516460346_100000189665 [0,2,0,0,0,0|2,0,0]=4 21004 B16R1.4621 CCOCCNC(=O)Cn1ccccc1=O 240690a_100011200944_100000189665 [0,2,0,0,0,0|2,0,0]=4 21005 B16R1.4621 CCOCCNC(=O)Cn1ccccc1=O 527a_100011200944_100000189665 [0,2,0,0,0,0|2,0,0]=4 21006 B16R1.4621 CCOCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100011200944 [0,2,0,0,0,0|2,0,0]=4 21007 B16R1.4621 CCOCCNC(=O)Nc1ccccc1C 2430a_100015192222_100011200944 [0,2,0,0,0,0|2,0,0]=4 21008 B16R1.4621 CCOCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100011200944 [0,2,0,0,0,0|2,0,0]=4 21009 B16R1.4621 CCOCCNC(=O)Nc1ccccc1F 2430a_100000210422_100011200944 [0,2,0,0,0,0|2,0,0]=4 21010 B16R1.4621 CCOCCNC(=O)Nc1ccccc1I 2430a_100000210053_100011200944 [0,2,0,0,0,0|2,0,0]=4 21011 B16R1.4621 CCOCCNC(=O)Nc1ccccc1O 2430a_100000185747_100011200944 [0,2,0,0,0,0|2,0,0]=4 21012 B16R1.4621 CCOCCOC(=O)Nc1ccccc1Br 34a_100121572206_100020589338 [0,2,0,0,0,0|1,0,0]=3 21013 B16R1.4621 CCOCCOC(=O)Nc1ccccc1Cl 34a_100121572206_200000178450 [0,2,0,0,0,0|1,0,0]=3 21014 B16R1.4621 CCOCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000739092 [0,2,0,0,0,0|1,1,0]=4 21015 B16R1.4621 CCOCSCC(=O)Cc1ccccc1Br 62a_100000739092_100000700504 [0,2,0,0,0,0|1,1,0]=4 21016 B16R1.4621 CCOCSCC(=O)Cc1ccccc1C 62a_100000739092_100011223134 [0,2,0,0,0,0|1,1,0]=4 21017 B16R1.4621 CCOCSCC(=O)Cc1ccccc1C 62a_100011223134_100000739092 [0,2,0,0,0,0|1,1,0]=4 21018 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 11a_100000106463_100000751119 [0,2,0,0,0,0|1,0,0]=3 21019 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 240690a_100000106463_100000751119 [0,2,0,0,0,0|1,0,0]=3 21020 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Br 527a_100000106463_100000751119 [0,2,0,0,0,0|1,0,0]=3 21021 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 11a_100000106463_100000212180 [0,2,0,0,0,0|1,0,0]=3 21022 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 1626a_100000106463_100000212180 [0,2,0,0,0,0|1,0,0]=3 21023 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 240690a_100000106463_100000212180 [0,2,0,0,0,0|1,0,0]=3 21024 B16R1.4621 CCSCCNC(=O)Cc1ccccc1C 527a_100000106463_100000212180 [0,2,0,0,0,0|1,0,0]=3 21025 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 11a_100000106463_100000183793 [0,2,0,0,0,0|1,0,0]=3 21026 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 1626a_100000106463_100000183793 [0,2,0,0,0,0|1,0,0]=3 21027 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 240690a_100000106463_100000183793 [0,2,0,0,0,0|1,0,0]=3 21028 B16R1.4621 CCSCCNC(=O)Cc1ccccc1Cl 527a_100000106463_100000183793 [0,2,0,0,0,0|1,0,0]=3 21029 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 11a_100000106463_100000212012 [0,2,0,0,0,0|1,0,0]=3 21030 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 1626a_100000106463_100000212012 [0,2,0,0,0,0|1,0,0]=3 21031 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 240690a_100000106463_100000212012 [0,2,0,0,0,0|1,0,0]=3 21032 B16R1.4621 CCSCCNC(=O)Cc1ccccc1F 527a_100000106463_100000212012 [0,2,0,0,0,0|1,0,0]=3 21033 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 11a_100000106463_100000036491 [0,2,0,0,0,0|1,0,0]=3 21034 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 1626a_100000106463_100000036491 [0,2,0,0,0,0|1,0,0]=3 21035 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 240690a_100000106463_100000036491 [0,2,0,0,0,0|1,0,0]=3 21036 B16R1.4621 CCSCCNC(=O)Cc1ccccc1I 527a_100000106463_100000036491 [0,2,0,0,0,0|1,0,0]=3 21037 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O 240690a_100000106463_100000743006 [0,2,0,0,0,0|1,0,0]=3 21038 B16R1.4621 CCSCCNC(=O)Cc1ccccc1O 527a_100000106463_100000743006 [0,2,0,0,0,0|1,0,0]=3 21039 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl 11a_100000106463_100000093521 [0,2,0,0,0,0|2,0,0]=4 21040 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl 1626a_100000106463_100000093521 [0,2,0,0,0,0|2,0,0]=4 21041 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl 240690a_100000106463_100000093521 [0,2,0,0,0,0|2,0,0]=4 21042 B16R1.4621 CCSCCNC(=O)Cc1cccnc1Cl 527a_100000106463_100000093521 [0,2,0,0,0,0|2,0,0]=4 21043 B16R1.4621 CCSCCNC(=O)Cc1ncccc1Br 11a_100000106463_200012357574 [0,2,0,0,0,0|2,0,0]=4 21044 B16R1.4621 CCSCCNC(=O)Cc1ncccc1Br 240690a_100000106463_200012357574 [0,2,0,0,0,0|2,0,0]=4 21045 B16R1.4621 CCSCCNC(=O)Cc1ncccc1C 11a_100000106463_200000722269 [0,2,0,0,0,0|2,0,0]=4 21046 B16R1.4621 CCSCCNC(=O)Cc1ncccc1C 1626a_100000106463_200000722269 [0,2,0,0,0,0|2,0,0]=4 21047 B16R1.4621 CCSCCNC(=O)Cc1ncccc1C 240690a_100000106463_200000722269 [0,2,0,0,0,0|2,0,0]=4 21048 B16R1.4621 CCSCCNC(=O)Cc1ncccc1Cl 11a_100000106463_100011998755 [0,2,0,0,0,0|2,0,0]=4 21049 B16R1.4621 CCSCCNC(=O)Cc1ncccc1Cl 240690a_100000106463_100011998755 [0,2,0,0,0,0|2,0,0]=4 21050 B16R1.4621 CCSCCNC(=O)Cc1ncccc1Cl 527a_100000106463_100011998755 [0,2,0,0,0,0|2,0,0]=4 21051 B16R1.4621 CCSCCNC(=O)Cn1ccccc1=O 1626a_100000106463_100000189665 [0,2,0,0,0,0|2,0,0]=4 21052 B16R1.4621 CCSCCNC(=O)Cn1ccccc1=O 240690a_100000106463_100000189665 [0,2,0,0,0,0|2,0,0]=4 21053 B16R1.4621 CCSCCNC(=O)Cn1ccccc1=O 527a_100000106463_100000189665 [0,2,0,0,0,0|2,0,0]=4 21054 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000106463 [0,2,0,0,0,0|2,0,0]=4 21055 B16R1.4621 CCSCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000106463 [0,2,0,0,0,0|2,0,0]=4 21056 B16R1.4621 CCSCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000106463 [0,2,0,0,0,0|2,0,0]=4 21057 B16R1.4621 CCSCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000106463 [0,2,0,0,0,0|2,0,0]=4 21058 B16R1.4621 CCSCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000106463 [0,2,0,0,0,0|2,0,0]=4 21059 B16R1.4621 CCSCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000106463 [0,2,0,0,0,0|2,0,0]=4 21060 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Br 62a_100000210202_100020589338 [0,2,0,0,0,0|1,0,0]=3 21061 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Br 62a_100020589338_100000210202 [0,2,0,0,0,0|1,0,0]=3 21062 B16R1.4621 CCSCCOC(=O)Nc1ccccc1Cl 62a_100000210202_200000178450 [0,2,0,0,0,0|1,0,0]=3 21063 B16R1.4621 COCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000755781 [0,2,0,0,0,0|1,0,0]=3 21064 B16R1.4621 COCCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000755781 [0,2,0,0,0,0|1,0,0]=3 21065 B16R1.4621 COCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000755781 [0,2,0,0,0,0|1,0,0]=3 21066 B16R1.4621 COCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000755781 [0,2,0,0,0,0|1,0,0]=3 21067 B16R1.4621 COCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000755781 [0,2,0,0,0,0|1,0,0]=3 21068 B16R1.4621 COCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000755781 [0,2,0,0,0,0|1,0,0]=3 21069 B16R1.4621 COCCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000755781 [0,2,0,0,0,0|2,0,0]=4 21070 B16R1.4621 COCCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000755781 [0,2,0,0,0,0|2,0,0]=4 21071 B16R1.4621 COCCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000755781 [0,2,0,0,0,0|2,0,0]=4 21072 B16R1.4621 COCCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000755781 [0,2,0,0,0,0|2,0,0]=4 21073 B16R1.4621 COCCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000755781 [0,2,0,0,0,0|2,0,0]=4 21074 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br 240690a_100150723488_100000751119 [0,2,0,0,0,0|1,0,0]=3 21075 B16R1.4621 COCCCNC(=O)Cc1ccccc1Br 527a_100150723488_100000751119 [0,2,0,0,0,0|1,0,0]=3 21076 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 1626a_100150723488_100000212180 [0,2,0,0,0,0|1,0,0]=3 21077 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 240690a_100150723488_100000212180 [0,2,0,0,0,0|1,0,0]=3 21078 B16R1.4621 COCCCNC(=O)Cc1ccccc1C 527a_100150723488_100000212180 [0,2,0,0,0,0|1,0,0]=3 21079 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 1626a_100150723488_100000183793 [0,2,0,0,0,0|1,0,0]=3 21080 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 240690a_100150723488_100000183793 [0,2,0,0,0,0|1,0,0]=3 21081 B16R1.4621 COCCCNC(=O)Cc1ccccc1Cl 527a_100150723488_100000183793 [0,2,0,0,0,0|1,0,0]=3 21082 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 1626a_100150723488_100000212012 [0,2,0,0,0,0|1,0,0]=3 21083 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 240690a_100150723488_100000212012 [0,2,0,0,0,0|1,0,0]=3 21084 B16R1.4621 COCCCNC(=O)Cc1ccccc1F 527a_100150723488_100000212012 [0,2,0,0,0,0|1,0,0]=3 21085 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 1626a_100150723488_100000036491 [0,2,0,0,0,0|1,0,0]=3 21086 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 240690a_100150723488_100000036491 [0,2,0,0,0,0|1,0,0]=3 21087 B16R1.4621 COCCCNC(=O)Cc1ccccc1I 527a_100150723488_100000036491 [0,2,0,0,0,0|1,0,0]=3 21088 B16R1.4621 COCCCNC(=O)Cc1ccccc1O 240690a_100150723488_100000743006 [0,2,0,0,0,0|1,0,0]=3 21089 B16R1.4621 COCCCNC(=O)Cc1ccccc1O 527a_100150723488_100000743006 [0,2,0,0,0,0|1,0,0]=3 21090 B16R1.4621 COCCCNC(=O)Cc1cccnc1Cl 1626a_100150723488_100000093521 [0,2,0,0,0,0|2,0,0]=4 21091 B16R1.4621 COCCCNC(=O)Cc1cccnc1Cl 240690a_100150723488_100000093521 [0,2,0,0,0,0|2,0,0]=4 21092 B16R1.4621 COCCCNC(=O)Cc1cccnc1Cl 527a_100150723488_100000093521 [0,2,0,0,0,0|2,0,0]=4 21093 B16R1.4621 COCCCNC(=O)Cc1ncccc1Br 240690a_100150723488_200012357574 [0,2,0,0,0,0|2,0,0]=4 21094 B16R1.4621 COCCCNC(=O)Cc1ncccc1C 1626a_100150723488_200000722269 [0,2,0,0,0,0|2,0,0]=4 21095 B16R1.4621 COCCCNC(=O)Cc1ncccc1C 240690a_100150723488_200000722269 [0,2,0,0,0,0|2,0,0]=4 21096 B16R1.4621 COCCCNC(=O)Cc1ncccc1Cl 240690a_100150723488_100011998755 [0,2,0,0,0,0|2,0,0]=4 21097 B16R1.4621 COCCCNC(=O)Cc1ncccc1Cl 527a_100150723488_100011998755 [0,2,0,0,0,0|2,0,0]=4 21098 B16R1.4621 COCCCNC(=O)Cn1ccccc1=O 1626a_100150723488_100000189665 [0,2,0,0,0,0|2,0,0]=4 21099 B16R1.4621 COCCCNC(=O)Cn1ccccc1=O 240690a_100150723488_100000189665 [0,2,0,0,0,0|2,0,0]=4 21100 B16R1.4621 COCCCNC(=O)Cn1ccccc1=O 527a_100150723488_100000189665 [0,2,0,0,0,0|2,0,0]=4 21101 B16R1.4621 COCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100150723488 [0,2,0,0,0,0|2,0,0]=4 21102 B16R1.4621 COCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100150723488 [0,2,0,0,0,0|2,0,0]=4 21103 B16R1.4621 COCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100150723488 [0,2,0,0,0,0|2,0,0]=4 21104 B16R1.4621 COCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100150723488 [0,2,0,0,0,0|2,0,0]=4 21105 B16R1.4621 COCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100150723488 [0,2,0,0,0,0|2,0,0]=4 21106 B16R1.4621 COCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100150723488 [0,2,0,0,0,0|2,0,0]=4 21107 B16R1.4621 COCCNCC(=O)Cc1ccccc1Br 2230a_100000209980_100000700504 [0,2,0,0,0,0|2,0,0]=4 21108 B16R1.4621 COCCNCC(=O)Cc1ccccc1C 2230a_100000209980_100011223134 [0,2,0,0,0,0|2,0,0]=4 21109 B16R1.4621 COCCNNC(=O)Cc1ccccc1Br 22a_100000741390_100000751119 [0,2,0,0,0,0|2,0,0]=4 21110 B16R1.4621 COCCNNC(=O)Cc1ccccc1C 22a_100000741390_100000212180 [0,2,0,0,0,0|2,0,0]=4 21111 B16R1.4621 COCCNNC(=O)Cc1ccccc1Cl 22a_100000741390_100000183793 [0,2,0,0,0,0|2,0,0]=4 21112 B16R1.4621 COCCNNC(=O)Cc1ccccc1F 22a_100000741390_100000212012 [0,2,0,0,0,0|2,0,0]=4 21113 B16R1.4621 COCCNNC(=O)Cc1ccccc1I 22a_100000741390_100000036491 [0,2,0,0,0,0|2,0,0]=4 21114 B16R1.4621 COCCNNC(=O)Cc1ccccc1O 22a_100000741390_100000743006 [0,2,0,0,0,0|2,0,0]=4 21115 B16R1.4621 COCCOCC(=O)Cc1ccccc1Br 1458a_100000211095_100000184730 [0,2,0,0,0,0|1,0,0]=3 21116 B16R1.4621 COCCOCC(=O)Cc1ccccc1Br 34a_100000210237_100000700504 [0,2,0,0,0,0|1,0,0]=3 21117 B16R1.4621 COCCOCC(=O)Cc1ccccc1C 1458a_100000211095_100000211839 [0,2,0,0,0,0|1,0,0]=3 21118 B16R1.4621 COCCOCC(=O)Cc1ccccc1Cl 1458a_100000211095_100000187162 [0,2,0,0,0,0|1,0,0]=3 21119 B16R1.4621 COCCOCC(=O)Cc1ccccc1F 1458a_100000211095_100000187165 [0,2,0,0,0,0|1,0,0]=3 21120 B16R1.4621 COCCOCC(=O)Cc1ccccc1I 1458a_100000211095_100011216222 [0,2,0,0,0,0|1,0,0]=3 21121 B16R1.4621 COCCOCC(=O)Cc1cccnc1Br 1458a_100000211095_100010140945 [0,2,0,0,0,0|2,0,0]=4 21122 B16R1.4621 COCCOCC(=O)Cc1cccnc1C 1458a_100000211095_100000732876 [0,2,0,0,0,0|2,0,0]=4 21123 B16R1.4621 COCCOCC(=O)Cc1cccnc1Cl 1458a_100000211095_100000045678 [0,2,0,0,0,0|2,0,0]=4 21124 B16R1.4621 COCCOCC(=O)Cc1cccnc1F 1458a_100000211095_100000099810 [0,2,0,0,0,0|2,0,0]=4 21125 B16R1.4621 COCCOCC(=O)Cc1ccncc1C 1458a_100000211095_100020672808 [0,2,0,0,0,0|2,0,0]=4 21126 B16R1.4621 COCCOCC(=O)Cc1ccncc1Cl 1458a_100000211095_100000763264 [0,2,0,0,0,0|2,0,0]=4 21127 B16R1.4621 COCCOCC(=O)Cc1cnccc1C 1458a_100000211095_100000690890 [0,2,0,0,0,0|2,0,0]=4 21128 B16R1.4621 COCCOCC(=O)Cc1ncccc1Br 1458a_100000211095_100025702911 [0,2,0,0,0,0|2,0,0]=4 21129 B16R1.4621 COCCOCC(=O)Cc1ncccc1C 1458a_100000211095_100000696600 [0,2,0,0,0,0|2,0,0]=4 21130 B16R1.4621 COCCOCC(=O)Cc1ncccc1Cl 1458a_100000211095_100000099807 [0,2,0,0,0,0|2,0,0]=4 21131 B16R1.4621 COCCOCC(=O)Cc1ncccc1F 1458a_100000211095_100000104219 [0,2,0,0,0,0|2,0,0]=4 21132 B16R1.4621 COCCOCC(=O)Cc1ncccc1O 1458a_100000211095_200020655725 [0,2,0,0,0,0|2,0,0]=4 21133 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br 11a_100000210017_100000211095 [0,2,0,0,0,0|2,0,0]=4 21134 B16R1.4621 COCCOCC(=O)Nc1ccccc1Br 1626a_100000210017_100000211095 [0,2,0,0,0,0|2,0,0]=4 21135 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 11a_100015192222_100000211095 [0,2,0,0,0,0|2,0,0]=4 21136 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 1626a_100015192222_100000211095 [0,2,0,0,0,0|2,0,0]=4 21137 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 22a_100015192222_100000211095 [0,2,0,0,0,0|2,0,0]=4 21138 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 34a_100000210237_100000183529 [0,2,0,0,0,0|2,0,0]=4 21139 B16R1.4621 COCCOCC(=O)Nc1ccccc1C 527a_100015192222_100000211095 [0,2,0,0,0,0|2,0,0]=4 21140 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211095 [0,2,0,0,0,0|2,0,0]=4 21141 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211095 [0,2,0,0,0,0|2,0,0]=4 21142 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211095 [0,2,0,0,0,0|2,0,0]=4 21143 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 34a_100000210237_100000182448 [0,2,0,0,0,0|2,0,0]=4 21144 B16R1.4621 COCCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211095 [0,2,0,0,0,0|2,0,0]=4 21145 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 11a_100000210422_100000211095 [0,2,0,0,0,0|2,0,0]=4 21146 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 1626a_100000210422_100000211095 [0,2,0,0,0,0|2,0,0]=4 21147 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 22a_100000210422_100000211095 [0,2,0,0,0,0|2,0,0]=4 21148 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 34a_100000210237_100000243840 [0,2,0,0,0,0|2,0,0]=4 21149 B16R1.4621 COCCOCC(=O)Nc1ccccc1F 527a_100000210422_100000211095 [0,2,0,0,0,0|2,0,0]=4 21150 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 11a_100000210053_100000211095 [0,2,0,0,0,0|2,0,0]=4 21151 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 1626a_100000210053_100000211095 [0,2,0,0,0,0|2,0,0]=4 21152 B16R1.4621 COCCOCC(=O)Nc1ccccc1I 34a_100000210237_100000180142 [0,2,0,0,0,0|2,0,0]=4 21153 B16R1.4621 COCCOCC(=O)Nc1ccccc1O 22a_100000185747_100000211095 [0,2,0,0,0,0|2,0,0]=4 21154 B16R1.4621 COCCOCC(=O)Nc1ccccc1O 527a_100000185747_100000211095 [0,2,0,0,0,0|2,0,0]=4 21155 B16R1.4621 COCCSCC(=O)Cc1ccccc1Br 62a_100000233755_100000700504 [0,2,0,0,0,0|1,1,0]=4 21156 B16R1.4621 COCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000233755 [0,2,0,0,0,0|1,1,0]=4 21157 B16R1.4621 COCCSCC(=O)Cc1ccccc1C 62a_100000233755_100011223134 [0,2,0,0,0,0|1,1,0]=4 21158 B16R1.4621 COCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000233755 [0,2,0,0,0,0|1,1,0]=4 21159 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 11a_100000749238_100000751119 [0,2,0,0,0,0|1,0,0]=3 21160 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 240690a_100000749238_100000751119 [0,2,0,0,0,0|1,0,0]=3 21161 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Br 527a_100000749238_100000751119 [0,2,0,0,0,0|1,0,0]=3 21162 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 11a_100000749238_100000212180 [0,2,0,0,0,0|1,0,0]=3 21163 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 1626a_100000749238_100000212180 [0,2,0,0,0,0|1,0,0]=3 21164 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 240690a_100000749238_100000212180 [0,2,0,0,0,0|1,0,0]=3 21165 B16R1.4621 CSCCCNC(=O)Cc1ccccc1C 527a_100000749238_100000212180 [0,2,0,0,0,0|1,0,0]=3 21166 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 11a_100000749238_100000183793 [0,2,0,0,0,0|1,0,0]=3 21167 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 1626a_100000749238_100000183793 [0,2,0,0,0,0|1,0,0]=3 21168 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 240690a_100000749238_100000183793 [0,2,0,0,0,0|1,0,0]=3 21169 B16R1.4621 CSCCCNC(=O)Cc1ccccc1Cl 527a_100000749238_100000183793 [0,2,0,0,0,0|1,0,0]=3 21170 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 11a_100000749238_100000212012 [0,2,0,0,0,0|1,0,0]=3 21171 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 1626a_100000749238_100000212012 [0,2,0,0,0,0|1,0,0]=3 21172 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 240690a_100000749238_100000212012 [0,2,0,0,0,0|1,0,0]=3 21173 B16R1.4621 CSCCCNC(=O)Cc1ccccc1F 527a_100000749238_100000212012 [0,2,0,0,0,0|1,0,0]=3 21174 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 11a_100000749238_100000036491 [0,2,0,0,0,0|1,0,0]=3 21175 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 1626a_100000749238_100000036491 [0,2,0,0,0,0|1,0,0]=3 21176 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 240690a_100000749238_100000036491 [0,2,0,0,0,0|1,0,0]=3 21177 B16R1.4621 CSCCCNC(=O)Cc1ccccc1I 527a_100000749238_100000036491 [0,2,0,0,0,0|1,0,0]=3 21178 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O 240690a_100000749238_100000743006 [0,2,0,0,0,0|1,0,0]=3 21179 B16R1.4621 CSCCCNC(=O)Cc1ccccc1O 527a_100000749238_100000743006 [0,2,0,0,0,0|1,0,0]=3 21180 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl 11a_100000749238_100000093521 [0,2,0,0,0,0|2,0,0]=4 21181 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl 1626a_100000749238_100000093521 [0,2,0,0,0,0|2,0,0]=4 21182 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl 240690a_100000749238_100000093521 [0,2,0,0,0,0|2,0,0]=4 21183 B16R1.4621 CSCCCNC(=O)Cc1cccnc1Cl 527a_100000749238_100000093521 [0,2,0,0,0,0|2,0,0]=4 21184 B16R1.4621 CSCCCNC(=O)Cc1ncccc1Br 11a_100000749238_200012357574 [0,2,0,0,0,0|2,0,0]=4 21185 B16R1.4621 CSCCCNC(=O)Cc1ncccc1Br 240690a_100000749238_200012357574 [0,2,0,0,0,0|2,0,0]=4 21186 B16R1.4621 CSCCCNC(=O)Cc1ncccc1C 11a_100000749238_200000722269 [0,2,0,0,0,0|2,0,0]=4 21187 B16R1.4621 CSCCCNC(=O)Cc1ncccc1C 1626a_100000749238_200000722269 [0,2,0,0,0,0|2,0,0]=4 21188 B16R1.4621 CSCCCNC(=O)Cc1ncccc1C 240690a_100000749238_200000722269 [0,2,0,0,0,0|2,0,0]=4 21189 B16R1.4621 CSCCCNC(=O)Cc1ncccc1Cl 11a_100000749238_100011998755 [0,2,0,0,0,0|2,0,0]=4 21190 B16R1.4621 CSCCCNC(=O)Cc1ncccc1Cl 240690a_100000749238_100011998755 [0,2,0,0,0,0|2,0,0]=4 21191 B16R1.4621 CSCCCNC(=O)Cc1ncccc1Cl 527a_100000749238_100011998755 [0,2,0,0,0,0|2,0,0]=4 21192 B16R1.4621 CSCCCNC(=O)Cn1ccccc1=O 1626a_100000749238_100000189665 [0,2,0,0,0,0|2,0,0]=4 21193 B16R1.4621 CSCCCNC(=O)Cn1ccccc1=O 240690a_100000749238_100000189665 [0,2,0,0,0,0|2,0,0]=4 21194 B16R1.4621 CSCCCNC(=O)Cn1ccccc1=O 527a_100000749238_100000189665 [0,2,0,0,0,0|2,0,0]=4 21195 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000749238 [0,2,0,0,0,0|2,0,0]=4 21196 B16R1.4621 CSCCCNC(=O)Nc1ccccc1C 2430a_100015192222_100000749238 [0,2,0,0,0,0|2,0,0]=4 21197 B16R1.4621 CSCCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000749238 [0,2,0,0,0,0|2,0,0]=4 21198 B16R1.4621 CSCCCNC(=O)Nc1ccccc1F 2430a_100000210422_100000749238 [0,2,0,0,0,0|2,0,0]=4 21199 B16R1.4621 CSCCCNC(=O)Nc1ccccc1I 2430a_100000210053_100000749238 [0,2,0,0,0,0|2,0,0]=4 21200 B16R1.4621 CSCCCNC(=O)Nc1ccccc1O 2430a_100000185747_100000749238 [0,2,0,0,0,0|2,0,0]=4 21201 B16R1.4621 CSCCNCC(=O)Cc1ccccc1Br 2230a_100020590264_100000700504 [0,2,0,0,0,0|2,0,0]=4 21202 B16R1.4621 CSCCNCC(=O)Cc1ccccc1C 2230a_100020590264_100011223134 [0,2,0,0,0,0|2,0,0]=4 21203 B16R1.4621 CSCCOCC(=O)Cc1ccccc1Br 34a_100000230434_100000700504 [0,2,0,0,0,0|1,0,0]=3 21204 B16R1.4621 CSCCOCC(=O)Cc1ccccc1Br 7a_100000230434_100000700504 [0,2,0,0,0,0|1,0,0]=3 21205 B16R1.4621 CSCCOCC(=O)Cc1ccccc1C 7a_100000230434_100011223134 [0,2,0,0,0,0|1,0,0]=3 21206 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Br 7a_100000230434_100000182372 [0,2,0,0,0,0|2,0,0]=4 21207 B16R1.4621 CSCCOCC(=O)Nc1ccccc1C 34a_100000230434_100000183529 [0,2,0,0,0,0|2,0,0]=4 21208 B16R1.4621 CSCCOCC(=O)Nc1ccccc1C 7a_100000230434_100000183529 [0,2,0,0,0,0|2,0,0]=4 21209 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Cl 34a_100000230434_100000182448 [0,2,0,0,0,0|2,0,0]=4 21210 B16R1.4621 CSCCOCC(=O)Nc1ccccc1Cl 7a_100000230434_100000182448 [0,2,0,0,0,0|2,0,0]=4 21211 B16R1.4621 CSCCOCC(=O)Nc1ccccc1F 34a_100000230434_100000243840 [0,2,0,0,0,0|2,0,0]=4 21212 B16R1.4621 CSCCOCC(=O)Nc1ccccc1F 7a_100000230434_100000182988 [0,2,0,0,0,0|2,0,0]=4 21213 B16R1.4621 CSCCOCC(=O)Nc1ccccc1I 34a_100000230434_100000180142 [0,2,0,0,0,0|2,0,0]=4 21214 B16R1.4621 CSCCOCC(=O)Nc1ccccc1I 7a_100000230434_100000180142 [0,2,0,0,0,0|2,0,0]=4 21215 B16R1.4621 CSCCOCC(=O)Nc1ccccc1O 7a_100000230434_100000014494 [0,2,0,0,0,0|2,0,0]=4 21216 B16R1.4621 CSCCSCC(=O)Cc1ccccc1Br 62a_100000212216_100000700504 [0,2,0,0,0,0|1,1,0]=4 21217 B16R1.4621 CSCCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000751147 [0,2,0,0,0,0|1,1,0]=4 21218 B16R1.4621 CSCCSCC(=O)Cc1ccccc1C 62a_100000212216_100011223134 [0,2,0,0,0,0|1,1,0]=4 21219 B16R1.4621 CSCCSCC(=O)Cc1ccccc1C 62a_100011223134_100000751147 [0,2,0,0,0,0|1,1,0]=4 21220 B16R1.4621 Cc1ccccc1CC(=O)CCCCC#N 1458a_100000212180_100000211819 [0,2,0,0,0,0|1,0,1]=4 21221 B16R1.4621 Cc1ccccc1CC(=O)CCCCCF 1458a_100000212180_100000729378 [0,2,0,0,0,0|1,0,0]=3 21222 B16R1.4621 Cc1ccccc1CC(=O)CCCCCO 1458a_100000212180_100000746330 [0,2,0,0,0,0|1,0,0]=3 21223 B16R1.4621 Cc1ccccc1CC(=O)CCCCCO 1458a_100102619762_100000211839 [0,2,0,0,0,0|1,0,0]=3 21224 B16R1.4621 Cc1ccccc1CC(=O)CCOCCO 1458a_100000212180_100011215305 [0,2,0,0,0,0|2,0,0]=4 21225 B16R1.4621 Cc1ccccc1CC(=O)CCOCCO 1458a_100011229844_100000211839 [0,2,0,0,0,0|2,0,0]=4 21226 B16R1.4621 Cc1ccccc1CC(=O)CNCCCF 2230a_100015189416_100011223134 [0,2,0,0,0,0|2,0,0]=4 21227 B16R1.4621 Cc1ccccc1CC(=O)CSCCCF 62a_100011223134_100011934791 [0,2,0,0,0,0|1,1,0]=4 21228 B16R1.4621 Cc1ccccc1CC(=O)CSCCCF 62a_100011934791_100011223134 [0,2,0,0,0,0|1,1,0]=4 21229 B16R1.4621 Cc1ccccc1CC(=O)CSCCCO 62a_100011215043_100011223134 [0,2,0,0,0,0|1,1,0]=4 21230 B16R1.4621 Cc1ccccc1CC(=O)CSCCCO 62a_100011223134_100011215043 [0,2,0,0,0,0|1,1,0]=4 21231 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO 240690a_100000750430_100000212180 [0,2,0,0,0,0|1,0,0]=3 21232 B16R1.4621 Cc1ccccc1CC(=O)NCCCCO 527a_100000750430_100000212180 [0,2,0,0,0,0|1,0,0]=3 21233 B16R1.4621 Cc1ccccc1NC(=O)CCCCCO 22a_100015192222_100102619762 [0,2,0,0,0,0|2,0,0]=4 21234 B16R1.4621 Cc1ccccc1NC(=O)COCCCBr 34a_100011217188_100000183529 [0,2,0,0,0,0|2,0,0]=4 21235 B16R1.4621 Cc1ccccc1NC(=O)COCCCCl 34a_100000230001_100000183529 [0,2,0,0,0,0|2,0,0]=4 21236 B16R1.4621 Cc1ccccc1NC(=O)COCCCF 34a_100000759539_100000183529 [0,2,0,0,0,0|2,0,0]=4 21237 B16R1.4621 Cc1ccccc1NC(=O)COCCCN 34a_100000182051_100000183529 [0,2,0,0,0,0|2,0,0]=4 21238 B16R1.4621 Cc1ccccc1NC(=O)NCCCCO 2430a_100015192222_100000750430 [0,2,0,0,0,0|2,0,0]=4 21239 B16R1.4621 Cc1cccnc1CC(=O)CCCCCF 1458a_200000722269_100000729378 [0,2,0,0,0,0|2,0,0]=4 21240 B16R1.4621 Cc1cccnc1CC(=O)CCCCCO 1458a_100102619762_100000696600 [0,2,0,0,0,0|2,0,0]=4 21241 B16R1.4621 Cc1cccnc1CC(=O)CCCCCO 1458a_200000722269_100000746330 [0,2,0,0,0,0|2,0,0]=4 21242 B16R1.4621 Cc1cccnc1CC(=O)NCCCCO 240690a_100000750430_200000722269 [0,2,0,0,0,0|2,0,0]=4 21243 B16R1.4621 Cc1ccncc1CC(=O)CCCCCO 1458a_100102619762_100000690890 [0,2,0,0,0,0|2,0,0]=4 21244 B16R1.4621 Cc1cnccc1CC(=O)CCCCCO 1458a_100102619762_100020672808 [0,2,0,0,0,0|2,0,0]=4 21245 B16R1.4621 Cc1ncccc1CC(=O)CCCCCO 1458a_100102619762_100000732876 [0,2,0,0,0,0|2,0,0]=4 21246 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000211819 [0,2,0,0,0,0|1,0,1]=4 21247 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000211819 [0,2,0,0,0,0|1,0,1]=4 21248 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000211819 [0,2,0,0,0,0|1,0,1]=4 21249 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000211819 [0,2,0,0,0,0|1,0,1]=4 21250 B16R1.4621 N#CCCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211819 [0,2,0,0,0,0|1,0,1]=4 21251 B16R1.4621 NCCCOCC(=O)Cc1ccccc1Br 34a_100000182051_100000700504 [0,2,0,0,0,0|1,0,0]=3 21252 B16R1.4621 NCCCOCC(=O)Nc1ccccc1Cl 34a_100000182051_100000182448 [0,2,0,0,0,0|2,0,0]=4 21253 B16R1.4621 NCCCOCC(=O)Nc1ccccc1F 34a_100000182051_100000243840 [0,2,0,0,0,0|2,0,0]=4 21254 B16R1.4621 NCCCOCC(=O)Nc1ccccc1I 34a_100000182051_100000180142 [0,2,0,0,0,0|2,0,0]=4 21255 B16R1.4621 NOCCOCC(=O)Cc1ccccc1Br 34a_100000700252_100000700504 [0,2,0,0,0,0|2,0,0]=4 21256 B16R1.4621 O=C(CCCCCF)Cc1ccccc1Br 1458a_100000751119_100000729378 [0,2,0,0,0,0|1,0,0]=3 21257 B16R1.4621 O=C(CCCCCF)Cc1ccccc1Cl 1458a_100000183793_100000729378 [0,2,0,0,0,0|1,0,0]=3 21258 B16R1.4621 O=C(CCCCCF)Cc1ccccc1F 1458a_100000212012_100000729378 [0,2,0,0,0,0|1,0,0]=3 21259 B16R1.4621 O=C(CCCCCF)Cc1ccccc1I 1458a_100000036491_100000729378 [0,2,0,0,0,0|1,0,0]=3 21260 B16R1.4621 O=C(CCCCCF)Cc1ccccc1O 1458a_100000743006_100000729378 [0,2,0,0,0,0|1,0,0]=3 21261 B16R1.4621 O=C(CCCCCF)Cc1cccnc1Cl 1458a_100000093521_100000729378 [0,2,0,0,0,0|2,0,0]=4 21262 B16R1.4621 O=C(CCCCCF)Cc1ncccc1Br 1458a_200012357574_100000729378 [0,2,0,0,0,0|2,0,0]=4 21263 B16R1.4621 O=C(CCCCCF)Cc1ncccc1Cl 1458a_100011998755_100000729378 [0,2,0,0,0,0|2,0,0]=4 21264 B16R1.4621 O=C(CCCCCF)Cn1ccccc1=O 1458a_100000189665_100000729378 [0,2,0,0,0,0|2,0,0]=4 21265 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Br 1458a_100000751119_100000746330 [0,2,0,0,0,0|1,0,0]=3 21266 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Br 1458a_100102619762_100000184730 [0,2,0,0,0,0|1,0,0]=3 21267 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Cl 1458a_100000183793_100000746330 [0,2,0,0,0,0|1,0,0]=3 21268 B16R1.4621 O=C(CCCCCO)Cc1ccccc1Cl 1458a_100102619762_100000187162 [0,2,0,0,0,0|1,0,0]=3 21269 B16R1.4621 O=C(CCCCCO)Cc1ccccc1F 1458a_100000212012_100000746330 [0,2,0,0,0,0|1,0,0]=3 21270 B16R1.4621 O=C(CCCCCO)Cc1ccccc1F 1458a_100102619762_100000187165 [0,2,0,0,0,0|1,0,0]=3 21271 B16R1.4621 O=C(CCCCCO)Cc1ccccc1I 1458a_100000036491_100000746330 [0,2,0,0,0,0|1,0,0]=3 21272 B16R1.4621 O=C(CCCCCO)Cc1ccccc1I 1458a_100102619762_100011216222 [0,2,0,0,0,0|1,0,0]=3 21273 B16R1.4621 O=C(CCCCCO)Cc1ccccc1O 1458a_100000743006_100000746330 [0,2,0,0,0,0|1,0,0]=3 21274 B16R1.4621 O=C(CCCCCO)Cc1cccnc1Br 1458a_100102619762_100010140945 [0,2,0,0,0,0|2,0,0]=4 21275 B16R1.4621 O=C(CCCCCO)Cc1cccnc1Cl 1458a_100000093521_100000746330 [0,2,0,0,0,0|2,0,0]=4 21276 B16R1.4621 O=C(CCCCCO)Cc1cccnc1Cl 1458a_100102619762_100000045678 [0,2,0,0,0,0|2,0,0]=4 21277 B16R1.4621 O=C(CCCCCO)Cc1cccnc1F 1458a_100102619762_100000099810 [0,2,0,0,0,0|2,0,0]=4 21278 B16R1.4621 O=C(CCCCCO)Cc1ccncc1Cl 1458a_100102619762_100000763264 [0,2,0,0,0,0|2,0,0]=4 21279 B16R1.4621 O=C(CCCCCO)Cc1ncccc1Br 1458a_100102619762_100025702911 [0,2,0,0,0,0|2,0,0]=4 21280 B16R1.4621 O=C(CCCCCO)Cc1ncccc1Br 1458a_200012357574_100000746330 [0,2,0,0,0,0|2,0,0]=4 21281 B16R1.4621 O=C(CCCCCO)Cc1ncccc1Cl 1458a_100011998755_100000746330 [0,2,0,0,0,0|2,0,0]=4 21282 B16R1.4621 O=C(CCCCCO)Cc1ncccc1Cl 1458a_100102619762_100000099807 [0,2,0,0,0,0|2,0,0]=4 21283 B16R1.4621 O=C(CCCCCO)Cc1ncccc1F 1458a_100102619762_100000104219 [0,2,0,0,0,0|2,0,0]=4 21284 B16R1.4621 O=C(CCCCCO)Cc1ncccc1O 1458a_100102619762_200020655725 [0,2,0,0,0,0|2,0,0]=4 21285 B16R1.4621 O=C(CCCCCO)Cn1ccccc1=O 1458a_100000189665_100000746330 [0,2,0,0,0,0|2,0,0]=4 21286 B16R1.4621 O=C(CCCCCO)Nc1ccccc1Cl 22a_100000185783_100102619762 [0,2,0,0,0,0|2,0,0]=4 21287 B16R1.4621 O=C(CCCCCO)Nc1ccccc1F 22a_100000210422_100102619762 [0,2,0,0,0,0|2,0,0]=4 21288 B16R1.4621 O=C(CCCCCO)Nc1ccccc1O 22a_100000185747_100102619762 [0,2,0,0,0,0|2,0,0]=4 21289 B16R1.4621 O=C(CCOCCO)Cc1ccccc1Br 1458a_100000751119_100011215305 [0,2,0,0,0,0|2,0,0]=4 21290 B16R1.4621 O=C(CCOCCO)Cc1ccccc1Br 1458a_100011229844_100000184730 [0,2,0,0,0,0|2,0,0]=4 21291 B16R1.4621 O=C(CCOCCO)Cc1ccccc1Cl 1458a_100000183793_100011215305 [0,2,0,0,0,0|2,0,0]=4 21292 B16R1.4621 O=C(CCOCCO)Cc1ccccc1Cl 1458a_100011229844_100000187162 [0,2,0,0,0,0|2,0,0]=4 21293 B16R1.4621 O=C(CCOCCO)Cc1ccccc1F 1458a_100000212012_100011215305 [0,2,0,0,0,0|2,0,0]=4 21294 B16R1.4621 O=C(CCOCCO)Cc1ccccc1F 1458a_100011229844_100000187165 [0,2,0,0,0,0|2,0,0]=4 21295 B16R1.4621 O=C(CCOCCO)Cc1ccccc1I 1458a_100000036491_100011215305 [0,2,0,0,0,0|2,0,0]=4 21296 B16R1.4621 O=C(CCOCCO)Cc1ccccc1I 1458a_100011229844_100011216222 [0,2,0,0,0,0|2,0,0]=4 21297 B16R1.4621 O=C(CCOCCO)Cc1ccccc1O 1458a_100000743006_100011215305 [0,2,0,0,0,0|2,0,0]=4 21298 B16R1.4621 O=C(CNCCCF)Cc1ccccc1Br 2230a_100015189416_100000700504 [0,2,0,0,0,0|2,0,0]=4 21299 B16R1.4621 O=C(CNCCCF)Cc1ccccc1Br 34a_100015189416_100000700504 [0,2,0,0,0,0|2,0,0]=4 21300 B16R1.4621 O=C(COCCCBr)Cc1ccccc1Br 34a_100011217188_100000700504 [0,2,0,0,0,0|1,0,0]=3 21301 B16R1.4621 O=C(COCCCBr)Nc1ccccc1Cl 34a_100011217188_100000182448 [0,2,0,0,0,0|2,0,0]=4 21302 B16R1.4621 O=C(COCCCBr)Nc1ccccc1F 34a_100011217188_100000243840 [0,2,0,0,0,0|2,0,0]=4 21303 B16R1.4621 O=C(COCCCBr)Nc1ccccc1I 34a_100011217188_100000180142 [0,2,0,0,0,0|2,0,0]=4 21304 B16R1.4621 O=C(COCCCCl)Cc1ccccc1Br 34a_100000230001_100000700504 [0,2,0,0,0,0|1,0,0]=3 21305 B16R1.4621 O=C(COCCCCl)Nc1ccccc1Cl 34a_100000230001_100000182448 [0,2,0,0,0,0|2,0,0]=4 21306 B16R1.4621 O=C(COCCCCl)Nc1ccccc1F 34a_100000230001_100000243840 [0,2,0,0,0,0|2,0,0]=4 21307 B16R1.4621 O=C(COCCCCl)Nc1ccccc1I 34a_100000230001_100000180142 [0,2,0,0,0,0|2,0,0]=4 21308 B16R1.4621 O=C(COCCCF)Cc1ccccc1Br 34a_100000759539_100000700504 [0,2,0,0,0,0|1,0,0]=3 21309 B16R1.4621 O=C(COCCCF)Nc1ccccc1Cl 34a_100000759539_100000182448 [0,2,0,0,0,0|2,0,0]=4 21310 B16R1.4621 O=C(COCCCF)Nc1ccccc1F 34a_100000759539_100000243840 [0,2,0,0,0,0|2,0,0]=4 21311 B16R1.4621 O=C(COCCCF)Nc1ccccc1I 34a_100000759539_100000180142 [0,2,0,0,0,0|2,0,0]=4 21312 B16R1.4621 O=C(CSCCCF)Cc1ccccc1Br 62a_100000700504_100011934791 [0,2,0,0,0,0|1,1,0]=4 21313 B16R1.4621 O=C(CSCCCF)Cc1ccccc1Br 62a_100011934791_100000700504 [0,2,0,0,0,0|1,1,0]=4 21314 B16R1.4621 O=C(CSCCCO)Cc1ccccc1Br 62a_100000700504_100011215043 [0,2,0,0,0,0|1,1,0]=4 21315 B16R1.4621 O=C(CSCCCO)Cc1ccccc1Br 62a_100011215043_100000700504 [0,2,0,0,0,0|1,1,0]=4 21316 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO 240690a_100000750430_100000751119 [0,2,0,0,0,0|1,0,0]=3 21317 B16R1.4621 O=C(Cc1ccccc1Br)NCCCCO 527a_100000750430_100000751119 [0,2,0,0,0,0|1,0,0]=3 21318 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO 240690a_100000750430_100000183793 [0,2,0,0,0,0|1,0,0]=3 21319 B16R1.4621 O=C(Cc1ccccc1Cl)NCCCCO 527a_100000750430_100000183793 [0,2,0,0,0,0|1,0,0]=3 21320 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO 240690a_100000750430_100000212012 [0,2,0,0,0,0|1,0,0]=3 21321 B16R1.4621 O=C(Cc1ccccc1F)NCCCCO 527a_100000750430_100000212012 [0,2,0,0,0,0|1,0,0]=3 21322 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO 240690a_100000750430_100000036491 [0,2,0,0,0,0|1,0,0]=3 21323 B16R1.4621 O=C(Cc1ccccc1I)NCCCCO 527a_100000750430_100000036491 [0,2,0,0,0,0|1,0,0]=3 21324 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO 240690a_100000750430_100000743006 [0,2,0,0,0,0|1,0,0]=3 21325 B16R1.4621 O=C(Cc1ccccc1O)NCCCCO 527a_100000750430_100000743006 [0,2,0,0,0,0|1,0,0]=3 21326 B16R1.4621 O=C(Cc1cccnc1Cl)NCCCCO 240690a_100000750430_100000093521 [0,2,0,0,0,0|2,0,0]=4 21327 B16R1.4621 O=C(Cc1cccnc1Cl)NCCCCO 527a_100000750430_100000093521 [0,2,0,0,0,0|2,0,0]=4 21328 B16R1.4621 O=C(Cc1ncccc1Br)NCCCCO 240690a_100000750430_200012357574 [0,2,0,0,0,0|2,0,0]=4 21329 B16R1.4621 O=C(Cc1ncccc1Cl)NCCCCO 240690a_100000750430_100011998755 [0,2,0,0,0,0|2,0,0]=4 21330 B16R1.4621 O=C(Cc1ncccc1Cl)NCCCCO 527a_100000750430_100011998755 [0,2,0,0,0,0|2,0,0]=4 21331 B16R1.4621 O=C(Cn1ccccc1=O)NCCCCO 240690a_100000750430_100000189665 [0,2,0,0,0,0|2,0,0]=4 21332 B16R1.4621 O=C(Cn1ccccc1=O)NCCCCO 527a_100000750430_100000189665 [0,2,0,0,0,0|2,0,0]=4 21333 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Br 2430a_100000210017_100000750430 [0,2,0,0,0,0|2,0,0]=4 21334 B16R1.4621 O=C(NCCCCO)Nc1ccccc1Cl 2430a_100000185783_100000750430 [0,2,0,0,0,0|2,0,0]=4 21335 B16R1.4621 O=C(NCCCCO)Nc1ccccc1F 2430a_100000210422_100000750430 [0,2,0,0,0,0|2,0,0]=4 21336 B16R1.4621 O=C(NCCCCO)Nc1ccccc1I 2430a_100000210053_100000750430 [0,2,0,0,0,0|2,0,0]=4 21337 B16R1.4621 O=C(NCCCCO)Nc1ccccc1O 2430a_100000185747_100000750430 [0,2,0,0,0,0|2,0,0]=4 21338 B16R1.4621 O=C(Nc1ccccc1Br)OCCSCF 62a_100015361967_100020589338 [0,2,0,0,0,0|2,0,0]=4 21339 B16R1.4621 O=C(Nc1ccccc1Br)OCCSCF 62a_100020589338_100015361967 [0,2,0,0,0,0|2,0,0]=4 21340 B16R1.4621 O=C(Nc1ccccc1Cl)OCCSCF 62a_100015361967_200000178450 [0,2,0,0,0,0|2,0,0]=4 21341 B16R1.8504 CC(C)(Cc1ccccc1)OCCCCF 7a_100011215222_100000729493 [0,2,0,0,0,0|1,0,1]=4 21342 B16R1.8504 CC(C)(Cc1ccccc1)OCCCCO 7a_100011215222_100000210776 [0,2,0,0,0,0|1,0,1]=4 21343 B16R1.8504 CCCCCNS(=O)(=O)Cc1ccccc1 270084a_100000209983_100000211737 [0,2,0,0,0,0|2,0,0]=4 21344 B16R1.8504 CCCCCNS(=O)(=O)Cc1ccccc1 274078a_100000209983_100000211737 [0,2,0,0,0,0|2,0,0]=4 21345 B16R1.8504 CCCCCNS(=O)(=O)Cc1ccccc1 40a_100000209983_100000235865 [0,2,0,0,0,0|2,0,0]=4 21346 B16R1.8504 CCCCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000210326 [0,2,0,0,0,0|1,0,1]=4 21347 B16R1.8504 CCCCNNS(=O)(=O)Cc1ccccc1 40a_100025702795_100000235865 [0,2,0,0,0,0|2,0,0]=4 21348 B16R1.8504 CCOCCNS(=O)(=O)Cc1ccccc1 270084a_102516460346_100000211737 [0,2,0,0,0,0|2,0,0]=4 21349 B16R1.8504 CCOCCNS(=O)(=O)Cc1ccccc1 274078a_102516460346_100000211737 [0,2,0,0,0,0|2,0,0]=4 21350 B16R1.8504 CCOCCNS(=O)(=O)Cc1ccccc1 40a_100011200944_100000235865 [0,2,0,0,0,0|2,0,0]=4 21351 B16R1.8504 CCOCCOC(C)(C)Cc1ccccc1 7a_100011215222_100011215890 [0,2,0,0,0,0|1,0,1]=4 21352 B16R1.8504 CCSCCNS(=O)(=O)Cc1ccccc1 270084a_100000106463_100000211737 [0,2,0,0,0,0|2,0,0]=4 21353 B16R1.8504 CCSCCNS(=O)(=O)Cc1ccccc1 274078a_100000106463_100000211737 [0,2,0,0,0,0|2,0,0]=4 21354 B16R1.8504 CCSCCNS(=O)(=O)Cc1ccccc1 40a_100000106463_100000235865 [0,2,0,0,0,0|2,0,0]=4 21355 B16R1.8504 CCSCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000757381 [0,2,0,0,0,0|1,0,1]=4 21356 B16R1.8504 COCCCNS(=O)(=O)Cc1ccccc1 270084a_100150723488_100000211737 [0,2,0,0,0,0|2,0,0]=4 21357 B16R1.8504 COCCCNS(=O)(=O)Cc1ccccc1 274078a_100150723488_100000211737 [0,2,0,0,0,0|2,0,0]=4 21358 B16R1.8504 COCCCNS(=O)(=O)Cc1ccccc1 40a_100150723488_100000235865 [0,2,0,0,0,0|2,0,0]=4 21359 B16R1.8504 COCCCOC(C)(C)Cc1ccccc1 7a_100011215222_100000740836 [0,2,0,0,0,0|1,0,1]=4 21360 B16R1.8504 CSCCCNS(=O)(=O)Cc1ccccc1 270084a_100000749238_100000211737 [0,2,0,0,0,0|2,0,0]=4 21361 B16R1.8504 CSCCCNS(=O)(=O)Cc1ccccc1 274078a_100000749238_100000211737 [0,2,0,0,0,0|2,0,0]=4 21362 B16R1.8504 CSCCCNS(=O)(=O)Cc1ccccc1 40a_100000749238_100000235865 [0,2,0,0,0,0|2,0,0]=4 21363 B16R1.8504 O=S(=O)(Cc1ccccc1)NCCCCO 270084a_100000750430_100000211737 [0,2,0,0,0,0|2,0,0]=4 21364 B16R1.8504 O=S(=O)(Cc1ccccc1)NCCCCO 274078a_100000750430_100000211737 [0,2,0,0,0,0|2,0,0]=4 21365 B16R1.8504 O=S(=O)(Cc1ccccc1)NCCCCO 40a_100000750430_100000235865 [0,2,0,0,0,0|2,0,0]=4 21366 B16R1.61 CC(C(=O)CCCCF)c1ccc(cc1)Cl 1458a_100011216001_100000729493 [0,2,0,0,0,0|2,0,0]=4 21367 B16R1.61 CC(C(=O)CCCCF)c1ccc(cc1)F 1458a_100011435297_100000729493 [0,2,0,0,0,0|2,0,0]=4 21368 B16R1.61 CC(C(=O)CCCCF)c1ccc(cc1)O 1458a_100000031422_100000729493 [0,2,0,0,0,0|2,0,0]=4 21369 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)Br 1458a_100000695505_100000755118 [0,2,0,0,0,0|2,0,0]=4 21370 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)Cl 1458a_100000695505_100000684792 [0,2,0,0,0,0|2,0,0]=4 21371 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)Cl 1458a_100011216001_100000210776 [0,2,0,0,0,0|2,0,0]=4 21372 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)F 1458a_100000695505_100000743420 [0,2,0,0,0,0|2,0,0]=4 21373 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)F 1458a_100011435297_100000210776 [0,2,0,0,0,0|2,0,0]=4 21374 B16R1.61 CC(C(=O)CCCCO)c1ccc(cc1)O 1458a_100000031422_100000210776 [0,2,0,0,0,0|2,0,0]=4 21375 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)Cl 11a_100015189416_100011216001 [0,2,0,0,0,0|2,0,0]=4 21376 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)Cl 1626a_100015189416_100011216001 [0,2,0,0,0,0|2,0,0]=4 21377 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)Cl 240690a_100015189416_100011216001 [0,2,0,0,0,0|2,0,0]=4 21378 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)Cl 527a_100015189416_100011216001 [0,2,0,0,0,0|2,0,0]=4 21379 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)F 11a_100015189416_100011435297 [0,2,0,0,0,0|2,0,0]=4 21380 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)F 1626a_100015189416_100011435297 [0,2,0,0,0,0|2,0,0]=4 21381 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)F 240690a_100015189416_100011435297 [0,2,0,0,0,0|2,0,0]=4 21382 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)F 527a_100015189416_100011435297 [0,2,0,0,0,0|2,0,0]=4 21383 B16R1.61 CC(C(=O)NCCCF)c1ccc(cc1)O 240690a_100015189416_100000031422 [0,2,0,0,0,0|2,0,0]=4 21384 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)Cl 240690a_100000182051_100011216001 [0,2,0,0,0,0|2,0,0]=4 21385 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)Cl 527a_100000182051_100011216001 [0,2,0,0,0,0|2,0,0]=4 21386 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)F 240690a_100000182051_100011435297 [0,2,0,0,0,0|2,0,0]=4 21387 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)F 527a_100000182051_100011435297 [0,2,0,0,0,0|2,0,0]=4 21388 B16R1.61 CC(C(=O)NCCCO)c1ccc(cc1)O 240690a_100000182051_100000031422 [0,2,0,0,0,0|2,0,0]=4 21389 B16R1.61 CCCC#CC(=O)C(C)c1ccc(cc1)Br 1458a_200011218047_100000755118 [0,2,0,0,0,0|1,0,1]=4 21390 B16R1.61 CCCC#CC(=O)C(C)c1ccc(cc1)C 1458a_200011218047_100011261388 [0,2,0,0,0,0|1,0,1]=4 21391 B16R1.61 CCCC#CC(=O)C(C)c1ccc(cc1)Cl 1458a_200011218047_100000684792 [0,2,0,0,0,0|1,0,1]=4 21392 B16R1.61 CCCC#CC(=O)C(C)c1ccc(cc1)F 1458a_200011218047_100000743420 [0,2,0,0,0,0|1,0,1]=4 21393 B16R1.61 CCCC=CC(=O)C(C)c1ccc(cc1)Br 1458a_100000212230_100000755118 [0,2,0,0,0,0|1,0,1]=4 21394 B16R1.61 CCCC=CC(=O)C(C)c1ccc(cc1)C 1458a_100000212230_100011261388 [0,2,0,0,0,0|1,0,1]=4 21395 B16R1.61 CCCC=CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000212230_100000684792 [0,2,0,0,0,0|1,0,1]=4 21396 B16R1.61 CCCC=CC(=O)C(C)c1ccc(cc1)F 1458a_100000212230_100000743420 [0,2,0,0,0,0|1,0,1]=4 21397 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)Br 1458a_100000212188_100000755118 [0,2,0,0,0,0|1,0,0]=3 21398 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)C 1458a_100000212188_100011261388 [0,2,0,0,0,0|1,0,0]=3 21399 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000210326 [0,2,0,0,0,0|1,0,0]=3 21400 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000212188_100000684792 [0,2,0,0,0,0|1,0,0]=3 21401 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000210326 [0,2,0,0,0,0|1,0,0]=3 21402 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)F 1458a_100000212188_100000743420 [0,2,0,0,0,0|1,0,0]=3 21403 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000210326 [0,2,0,0,0,0|1,0,0]=3 21404 B16R1.61 CCCCCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210326 [0,2,0,0,0,0|1,0,0]=3 21405 B16R1.61 CCCCCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210326 [0,2,0,0,0,0|1,0,0]=3 21406 B16R1.61 CCCCCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210326 [0,2,0,0,0,0|1,0,0]=3 21407 B16R1.61 CCCCCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210326 [0,2,0,0,0,0|1,0,0]=3 21408 B16R1.61 CCCCCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210326 [0,2,0,0,0,0|1,0,0]=3 21409 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100000212188 [0,2,0,0,0,0|2,0,0]=4 21410 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100000212188 [0,2,0,0,0,0|2,0,0]=4 21411 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000212188 [0,2,0,0,0,0|2,0,0]=4 21412 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100000212188 [0,2,0,0,0,0|2,0,0]=4 21413 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100000212188 [0,2,0,0,0,0|2,0,0]=4 21414 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000212188 [0,2,0,0,0,0|2,0,0]=4 21415 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100000212188 [0,2,0,0,0,0|2,0,0]=4 21416 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100000212188 [0,2,0,0,0,0|2,0,0]=4 21417 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000212188 [0,2,0,0,0,0|2,0,0]=4 21418 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100000212188 [0,2,0,0,0,0|2,0,0]=4 21419 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100000212188 [0,2,0,0,0,0|2,0,0]=4 21420 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000212188 [0,2,0,0,0,0|2,0,0]=4 21421 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100000212188 [0,2,0,0,0,0|2,0,0]=4 21422 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100000212188 [0,2,0,0,0,0|2,0,0]=4 21423 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000212188 [0,2,0,0,0,0|2,0,0]=4 21424 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000212188 [0,2,0,0,0,0|2,0,0]=4 21425 B16R1.61 CCCCCC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100000212188 [0,2,0,0,0,0|2,0,0]=4 21426 B16R1.61 CCCCCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000210326 [0,2,0,0,0,0|1,0,0]=3 21427 B16R1.61 CCCCCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210326 [0,2,0,0,0,0|1,0,0]=3 21428 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C 11a_100000102301_100000751627 [0,2,0,0,0,0|1,0,0]=3 21429 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C 1626a_100000102301_100000751627 [0,2,0,0,0,0|1,0,0]=3 21430 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C 240690a_100000102301_100000751627 [0,2,0,0,0,0|1,0,0]=3 21431 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)C 527a_100000102301_100000751627 [0,2,0,0,0,0|1,0,0]=3 21432 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl 11a_100000102301_100011216001 [0,2,0,0,0,0|1,0,0]=3 21433 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100000102301_100011216001 [0,2,0,0,0,0|1,0,0]=3 21434 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100000102301_100011216001 [0,2,0,0,0,0|1,0,0]=3 21435 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)Cl 527a_100000102301_100011216001 [0,2,0,0,0,0|1,0,0]=3 21436 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)F 11a_100000102301_100011435297 [0,2,0,0,0,0|1,0,0]=3 21437 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)F 1626a_100000102301_100011435297 [0,2,0,0,0,0|1,0,0]=3 21438 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)F 240690a_100000102301_100011435297 [0,2,0,0,0,0|1,0,0]=3 21439 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)F 527a_100000102301_100011435297 [0,2,0,0,0,0|1,0,0]=3 21440 B16R1.61 CCCCNC(=O)C(C)c1ccc(cc1)O 240690a_100000102301_100000031422 [0,2,0,0,0,0|1,0,0]=3 21441 B16R1.61 CCCCNC(=O)C(F)c1ccc(cc1)Cl 11a_100000102301_100012277543 [0,2,0,0,0,0|1,0,0]=3 21442 B16R1.61 CCCCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100000102301_100012277543 [0,2,0,0,0,0|1,0,0]=3 21443 B16R1.61 CCCCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100000102301_100012277543 [0,2,0,0,0,0|1,0,0]=3 21444 B16R1.61 CCCCNC(=O)C(F)c1ccc(cc1)Cl 527a_100000102301_100012277543 [0,2,0,0,0,0|1,0,0]=3 21445 B16R1.61 CCCCNC(=O)C(O)c1ccc(cc1)Br 240690a_100000102301_100000756554 [0,2,0,0,0,0|1,0,0]=3 21446 B16R1.61 CCCCNC(=O)C(O)c1ccc(cc1)F 240690a_100000102301_100000209909 [0,2,0,0,0,0|1,0,0]=3 21447 B16R1.61 CCCCNC(=O)C(O)c1ccc(cc1)O 240690a_100000102301_100011215213 [0,2,0,0,0,0|1,0,0]=3 21448 B16R1.61 CCCCNC(=O)N(C)c1ccc(cc1)Br 512a_100000102301_100000219623 [0,2,0,0,0,0|2,0,0]=4 21449 B16R1.61 CCCCNC(=O)N(C)c1ccc(cc1)C 512a_100000102301_100000219977 [0,2,0,0,0,0|2,0,0]=4 21450 B16R1.61 CCCCNC(=O)N(C)c1ccc(cc1)I 512a_100000743151_100000102301 [0,2,0,0,0,0|2,0,0]=4 21451 B16R1.61 CCCCNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100000102301_100009815954 [0,2,0,0,0,0|1,0,0]=3 21452 B16R1.61 CCCCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100000102301_100009817493 [0,2,0,0,0,0|1,0,0]=3 21453 B16R1.61 CCCNNC(=O)C(C)c1ccc(cc1)C 22a_100000740057_100000751627 [0,2,0,0,0,0|2,0,0]=4 21454 B16R1.61 CCCNNC(=O)C(C)c1ccc(cc1)Cl 22a_100000740057_100011216001 [0,2,0,0,0,0|2,0,0]=4 21455 B16R1.61 CCCNNC(=O)C(C)c1ccc(cc1)F 22a_100000740057_100011435297 [0,2,0,0,0,0|2,0,0]=4 21456 B16R1.61 CCCNNC(=O)C(C)c1ccc(cc1)O 22a_100000740057_100000031422 [0,2,0,0,0,0|2,0,0]=4 21457 B16R1.61 CCCNNC(=O)C(F)c1ccc(cc1)Cl 22a_100000740057_100012277543 [0,2,0,0,0,0|2,0,0]=4 21458 B16R1.61 CCCNNC(=O)C(O)c1ccc(cc1)Br 22a_100000740057_100000756554 [0,2,0,0,0,0|2,0,0]=4 21459 B16R1.61 CCCNNC(=O)C(O)c1ccc(cc1)F 22a_100000740057_100000209909 [0,2,0,0,0,0|2,0,0]=4 21460 B16R1.61 CCCNNC(=O)C(O)c1ccc(cc1)O 22a_100000740057_100011215213 [0,2,0,0,0,0|2,0,0]=4 21461 B16R1.61 CCCNNC(=O)[C@H](O)c1ccc(cc1)C 22a_100000740057_100009815954 [0,2,0,0,0,0|2,0,0]=4 21462 B16R1.61 CCCNNC(=O)[C@H](O)c1ccc(cc1)Cl 22a_100000740057_100009817493 [0,2,0,0,0,0|2,0,0]=4 21463 B16R1.61 CCCOCC(=O)C(C)c1ccc(cc1)Br 1458a_100000745993_100000755118 [0,2,0,0,0,0|2,0,0]=4 21464 B16R1.61 CCCOCC(=O)C(C)c1ccc(cc1)C 1458a_100000745993_100011261388 [0,2,0,0,0,0|2,0,0]=4 21465 B16R1.61 CCCOCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000745993_100000684792 [0,2,0,0,0,0|2,0,0]=4 21466 B16R1.61 CCCOCC(=O)C(C)c1ccc(cc1)F 1458a_100000745993_100000743420 [0,2,0,0,0,0|2,0,0]=4 21467 B16R1.61 CCCSCC(=O)C(C)c1ccc(cc1)Br 1458a_100000217233_100000755118 [0,2,0,0,0,0|2,0,0]=4 21468 B16R1.61 CCCSCC(=O)C(C)c1ccc(cc1)C 1458a_100000217233_100011261388 [0,2,0,0,0,0|2,0,0]=4 21469 B16R1.61 CCCSCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000217233_100000684792 [0,2,0,0,0,0|2,0,0]=4 21470 B16R1.61 CCCSCC(=O)C(C)c1ccc(cc1)F 1458a_100000217233_100000743420 [0,2,0,0,0,0|2,0,0]=4 21471 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)Br 1458a_100000749530_100000755118 [0,2,0,0,0,0|2,0,0]=4 21472 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)C 1458a_100000749530_100011261388 [0,2,0,0,0,0|2,0,0]=4 21473 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100011215890 [0,2,0,0,0,0|2,0,0]=4 21474 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000749530_100000684792 [0,2,0,0,0,0|2,0,0]=4 21475 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100011215890 [0,2,0,0,0,0|2,0,0]=4 21476 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)F 1458a_100000749530_100000743420 [0,2,0,0,0,0|2,0,0]=4 21477 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100011215890 [0,2,0,0,0,0|2,0,0]=4 21478 B16R1.61 CCOCCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100011215890 [0,2,0,0,0,0|2,0,0]=4 21479 B16R1.61 CCOCCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100011215890 [0,2,0,0,0,0|2,0,0]=4 21480 B16R1.61 CCOCCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100011215890 [0,2,0,0,0,0|2,0,0]=4 21481 B16R1.61 CCOCCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100011215890 [0,2,0,0,0,0|2,0,0]=4 21482 B16R1.61 CCOCCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100011215890 [0,2,0,0,0,0|2,0,0]=4 21483 B16R1.61 CCOCCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100011215890 [0,2,0,0,0,0|2,0,0]=4 21484 B16R1.61 CCOCCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100011215890 [0,2,0,0,0,0|2,0,0]=4 21485 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)Br 1458a_100000230768_100000755118 [0,2,0,0,0,0|2,0,0]=4 21486 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)C 1458a_100000230768_100011261388 [0,2,0,0,0,0|2,0,0]=4 21487 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000757381 [0,2,0,0,0,0|2,0,0]=4 21488 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000230768_100000684792 [0,2,0,0,0,0|2,0,0]=4 21489 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000757381 [0,2,0,0,0,0|2,0,0]=4 21490 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)F 1458a_100000230768_100000743420 [0,2,0,0,0,0|2,0,0]=4 21491 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000757381 [0,2,0,0,0,0|2,0,0]=4 21492 B16R1.61 CCSCCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000757381 [0,2,0,0,0,0|2,0,0]=4 21493 B16R1.61 CCSCCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000757381 [0,2,0,0,0,0|2,0,0]=4 21494 B16R1.61 CCSCCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000757381 [0,2,0,0,0,0|2,0,0]=4 21495 B16R1.61 CCSCCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000757381 [0,2,0,0,0,0|2,0,0]=4 21496 B16R1.61 CCSCCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000757381 [0,2,0,0,0,0|2,0,0]=4 21497 B16R1.61 CCSCCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000757381 [0,2,0,0,0,0|2,0,0]=4 21498 B16R1.61 CCSCCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000757381 [0,2,0,0,0,0|2,0,0]=4 21499 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)Br 1458a_100000741012_100000755118 [0,2,0,0,0,0|2,0,0]=4 21500 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)C 1458a_100000741012_100011261388 [0,2,0,0,0,0|2,0,0]=4 21501 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_100000740836 [0,2,0,0,0,0|2,0,0]=4 21502 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000741012_100000684792 [0,2,0,0,0,0|2,0,0]=4 21503 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_100000740836 [0,2,0,0,0,0|2,0,0]=4 21504 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)F 1458a_100000741012_100000743420 [0,2,0,0,0,0|2,0,0]=4 21505 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_100000740836 [0,2,0,0,0,0|2,0,0]=4 21506 B16R1.61 COCCCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000740836 [0,2,0,0,0,0|2,0,0]=4 21507 B16R1.61 COCCCC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000740836 [0,2,0,0,0,0|2,0,0]=4 21508 B16R1.61 COCCCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000740836 [0,2,0,0,0,0|2,0,0]=4 21509 B16R1.61 COCCCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000740836 [0,2,0,0,0,0|2,0,0]=4 21510 B16R1.61 COCCCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000740836 [0,2,0,0,0,0|2,0,0]=4 21511 B16R1.61 COCCCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000740836 [0,2,0,0,0,0|2,0,0]=4 21512 B16R1.61 COCCCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000740836 [0,2,0,0,0,0|2,0,0]=4 21513 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)C 1626a_100000209980_100000751627 [0,2,0,0,0,0|2,0,0]=4 21514 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)C 240690a_100000209980_100000751627 [0,2,0,0,0,0|2,0,0]=4 21515 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)C 527a_100000209980_100000751627 [0,2,0,0,0,0|2,0,0]=4 21516 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100000209980_100011216001 [0,2,0,0,0,0|2,0,0]=4 21517 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100000209980_100011216001 [0,2,0,0,0,0|2,0,0]=4 21518 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)Cl 527a_100000209980_100011216001 [0,2,0,0,0,0|2,0,0]=4 21519 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)F 1626a_100000209980_100011435297 [0,2,0,0,0,0|2,0,0]=4 21520 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)F 240690a_100000209980_100011435297 [0,2,0,0,0,0|2,0,0]=4 21521 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)F 527a_100000209980_100011435297 [0,2,0,0,0,0|2,0,0]=4 21522 B16R1.61 COCCNC(=O)C(C)c1ccc(cc1)O 240690a_100000209980_100000031422 [0,2,0,0,0,0|2,0,0]=4 21523 B16R1.61 COCCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100000209980_100012277543 [0,2,0,0,0,0|2,0,0]=4 21524 B16R1.61 COCCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100000209980_100012277543 [0,2,0,0,0,0|2,0,0]=4 21525 B16R1.61 COCCNC(=O)C(F)c1ccc(cc1)Cl 527a_100000209980_100012277543 [0,2,0,0,0,0|2,0,0]=4 21526 B16R1.61 COCCNC(=O)C(O)c1ccc(cc1)Br 240690a_100000209980_100000756554 [0,2,0,0,0,0|2,0,0]=4 21527 B16R1.61 COCCNC(=O)C(O)c1ccc(cc1)F 240690a_100000209980_100000209909 [0,2,0,0,0,0|2,0,0]=4 21528 B16R1.61 COCCNC(=O)C(O)c1ccc(cc1)O 240690a_100000209980_100011215213 [0,2,0,0,0,0|2,0,0]=4 21529 B16R1.61 COCCNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100000209980_100009815954 [0,2,0,0,0,0|2,0,0]=4 21530 B16R1.61 COCCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100000209980_100009817493 [0,2,0,0,0,0|2,0,0]=4 21531 B16R1.61 CSCCCC(=O)C(C)c1ccc(cc1)Br 1458a_100000173376_100000755118 [0,2,0,0,0,0|2,0,0]=4 21532 B16R1.61 CSCCCC(=O)C(C)c1ccc(cc1)C 1458a_100000173376_100011261388 [0,2,0,0,0,0|2,0,0]=4 21533 B16R1.61 CSCCCC(=O)C(C)c1ccc(cc1)Cl 1458a_100000173376_100000684792 [0,2,0,0,0,0|2,0,0]=4 21534 B16R1.61 CSCCCC(=O)C(C)c1ccc(cc1)F 1458a_100000173376_100000743420 [0,2,0,0,0,0|2,0,0]=4 21535 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C 11a_100020590264_100000751627 [0,2,0,0,0,0|2,0,0]=4 21536 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C 1626a_100020590264_100000751627 [0,2,0,0,0,0|2,0,0]=4 21537 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C 240690a_100020590264_100000751627 [0,2,0,0,0,0|2,0,0]=4 21538 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)C 527a_100020590264_100000751627 [0,2,0,0,0,0|2,0,0]=4 21539 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl 11a_100020590264_100011216001 [0,2,0,0,0,0|2,0,0]=4 21540 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl 1626a_100020590264_100011216001 [0,2,0,0,0,0|2,0,0]=4 21541 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl 240690a_100020590264_100011216001 [0,2,0,0,0,0|2,0,0]=4 21542 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)Cl 527a_100020590264_100011216001 [0,2,0,0,0,0|2,0,0]=4 21543 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)F 11a_100020590264_100011435297 [0,2,0,0,0,0|2,0,0]=4 21544 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)F 1626a_100020590264_100011435297 [0,2,0,0,0,0|2,0,0]=4 21545 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)F 240690a_100020590264_100011435297 [0,2,0,0,0,0|2,0,0]=4 21546 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)F 527a_100020590264_100011435297 [0,2,0,0,0,0|2,0,0]=4 21547 B16R1.61 CSCCNC(=O)C(C)c1ccc(cc1)O 240690a_100020590264_100000031422 [0,2,0,0,0,0|2,0,0]=4 21548 B16R1.61 CSCCNC(=O)C(F)c1ccc(cc1)Cl 11a_100020590264_100012277543 [0,2,0,0,0,0|2,0,0]=4 21549 B16R1.61 CSCCNC(=O)C(F)c1ccc(cc1)Cl 1626a_100020590264_100012277543 [0,2,0,0,0,0|2,0,0]=4 21550 B16R1.61 CSCCNC(=O)C(F)c1ccc(cc1)Cl 240690a_100020590264_100012277543 [0,2,0,0,0,0|2,0,0]=4 21551 B16R1.61 CSCCNC(=O)C(F)c1ccc(cc1)Cl 527a_100020590264_100012277543 [0,2,0,0,0,0|2,0,0]=4 21552 B16R1.61 CSCCNC(=O)C(O)c1ccc(cc1)Br 240690a_100020590264_100000756554 [0,2,0,0,0,0|2,0,0]=4 21553 B16R1.61 CSCCNC(=O)C(O)c1ccc(cc1)F 240690a_100020590264_100000209909 [0,2,0,0,0,0|2,0,0]=4 21554 B16R1.61 CSCCNC(=O)C(O)c1ccc(cc1)O 240690a_100020590264_100011215213 [0,2,0,0,0,0|2,0,0]=4 21555 B16R1.61 CSCCNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100020590264_100009815954 [0,2,0,0,0,0|2,0,0]=4 21556 B16R1.61 CSCCNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100020590264_100009817493 [0,2,0,0,0,0|2,0,0]=4 21557 B16R1.61 Cc1ccc(cc1)C(C)C(=O)CCCCF 1458a_100000751627_100000729493 [0,2,0,0,0,0|2,0,0]=4 21558 B16R1.61 Cc1ccc(cc1)C(C)C(=O)CCCCO 1458a_100000695505_100011261388 [0,2,0,0,0,0|2,0,0]=4 21559 B16R1.61 Cc1ccc(cc1)C(C)C(=O)CCCCO 1458a_100000751627_100000210776 [0,2,0,0,0,0|2,0,0]=4 21560 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCF 11a_100015189416_100000751627 [0,2,0,0,0,0|2,0,0]=4 21561 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCF 1626a_100015189416_100000751627 [0,2,0,0,0,0|2,0,0]=4 21562 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCF 240690a_100015189416_100000751627 [0,2,0,0,0,0|2,0,0]=4 21563 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCF 527a_100015189416_100000751627 [0,2,0,0,0,0|2,0,0]=4 21564 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCO 240690a_100000182051_100000751627 [0,2,0,0,0,0|2,0,0]=4 21565 B16R1.61 Cc1ccc(cc1)C(C)C(=O)NCCCO 527a_100000182051_100000751627 [0,2,0,0,0,0|2,0,0]=4 21566 B16R1.61 Cc1ccc(cc1)[C@@H](O)C(=O)CCCCF 1458a_100009815954_100000729493 [0,2,0,0,0,0|2,0,0]=4 21567 B16R1.61 Cc1ccc(cc1)[C@@H](O)C(=O)CCCCO 1458a_100009815954_100000210776 [0,2,0,0,0,0|2,0,0]=4 21568 B16R1.61 Cc1ccc(cc1)[C@@H](O)C(=O)NCCCF 240690a_100015189416_100009815954 [0,2,0,0,0,0|2,0,0]=4 21569 B16R1.61 Cc1ccc(cc1)[C@@H](O)C(=O)NCCCO 240690a_100000182051_100009815954 [0,2,0,0,0,0|2,0,0]=4 21570 B16R1.61 O=C(CCCCF)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000729493 [0,2,0,0,0,0|2,0,0]=4 21571 B16R1.61 O=C(CCCCF)C(O)c1ccc(cc1)Br 1458a_100000756554_100000729493 [0,2,0,0,0,0|2,0,0]=4 21572 B16R1.61 O=C(CCCCF)C(O)c1ccc(cc1)F 1458a_100000209909_100000729493 [0,2,0,0,0,0|2,0,0]=4 21573 B16R1.61 O=C(CCCCF)C(O)c1ccc(cc1)O 1458a_100011215213_100000729493 [0,2,0,0,0,0|2,0,0]=4 21574 B16R1.61 O=C(CCCCF)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000729493 [0,2,0,0,0,0|2,0,0]=4 21575 B16R1.61 O=C(CCCCO)C(F)c1ccc(cc1)Cl 1458a_100012277543_100000210776 [0,2,0,0,0,0|2,0,0]=4 21576 B16R1.61 O=C(CCCCO)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210776 [0,2,0,0,0,0|2,0,0]=4 21577 B16R1.61 O=C(CCCCO)C(O)c1ccc(cc1)F 1458a_100000209909_100000210776 [0,2,0,0,0,0|2,0,0]=4 21578 B16R1.61 O=C(CCCCO)C(O)c1ccc(cc1)O 1458a_100011215213_100000210776 [0,2,0,0,0,0|2,0,0]=4 21579 B16R1.61 O=C(CCCCO)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210776 [0,2,0,0,0,0|2,0,0]=4 21580 B16R1.61 O=C(NCCCF)C(F)c1ccc(cc1)Cl 11a_100015189416_100012277543 [0,2,0,0,0,0|2,0,0]=4 21581 B16R1.61 O=C(NCCCF)C(F)c1ccc(cc1)Cl 1626a_100015189416_100012277543 [0,2,0,0,0,0|2,0,0]=4 21582 B16R1.61 O=C(NCCCF)C(F)c1ccc(cc1)Cl 240690a_100015189416_100012277543 [0,2,0,0,0,0|2,0,0]=4 21583 B16R1.61 O=C(NCCCF)C(F)c1ccc(cc1)Cl 527a_100015189416_100012277543 [0,2,0,0,0,0|2,0,0]=4 21584 B16R1.61 O=C(NCCCF)C(O)c1ccc(cc1)Br 240690a_100015189416_100000756554 [0,2,0,0,0,0|2,0,0]=4 21585 B16R1.61 O=C(NCCCF)C(O)c1ccc(cc1)F 240690a_100015189416_100000209909 [0,2,0,0,0,0|2,0,0]=4 21586 B16R1.61 O=C(NCCCF)C(O)c1ccc(cc1)O 240690a_100015189416_100011215213 [0,2,0,0,0,0|2,0,0]=4 21587 B16R1.61 O=C(NCCCF)[C@H](O)c1ccc(cc1)Cl 240690a_100015189416_100009817493 [0,2,0,0,0,0|2,0,0]=4 21588 B16R1.61 O=C(NCCCO)C(F)c1ccc(cc1)Cl 240690a_100000182051_100012277543 [0,2,0,0,0,0|2,0,0]=4 21589 B16R1.61 O=C(NCCCO)C(F)c1ccc(cc1)Cl 527a_100000182051_100012277543 [0,2,0,0,0,0|2,0,0]=4 21590 B16R1.61 O=C(NCCCO)C(O)c1ccc(cc1)Br 240690a_100000182051_100000756554 [0,2,0,0,0,0|2,0,0]=4 21591 B16R1.61 O=C(NCCCO)C(O)c1ccc(cc1)F 240690a_100000182051_100000209909 [0,2,0,0,0,0|2,0,0]=4 21592 B16R1.61 O=C(NCCCO)C(O)c1ccc(cc1)O 240690a_100000182051_100011215213 [0,2,0,0,0,0|2,0,0]=4 21593 B16R1.61 O=C(NCCCO)[C@H](O)c1ccc(cc1)Cl 240690a_100000182051_100009817493 [0,2,0,0,0,0|2,0,0]=4 21594 B16R1.62 CC(C(=O)CCCCF)c1cccc(c1)Br 1458a_100000722698_100000729493 [0,2,0,0,0,0|2,0,0]=4 21595 B16R1.62 CC(C(=O)CCCCF)c1cccc(c1)Cl 1458a_100000762818_100000729493 [0,2,0,0,0,0|2,0,0]=4 21596 B16R1.62 CC(C(=O)CCCCF)c1cccc(c1)F 1458a_100000762896_100000729493 [0,2,0,0,0,0|2,0,0]=4 21597 B16R1.62 CC(C(=O)CCCCO)c1cccc(c1)Br 1458a_100000722698_100000210776 [0,2,0,0,0,0|2,0,0]=4 21598 B16R1.62 CC(C(=O)CCCCO)c1cccc(c1)Cl 1458a_100000762818_100000210776 [0,2,0,0,0,0|2,0,0]=4 21599 B16R1.62 CC(C(=O)CCCCO)c1cccc(c1)F 1458a_100000762896_100000210776 [0,2,0,0,0,0|2,0,0]=4 21600 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Br 11a_100015189416_100000722698 [0,2,0,0,0,0|2,0,0]=4 21601 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Br 1626a_100015189416_100000722698 [0,2,0,0,0,0|2,0,0]=4 21602 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Br 240690a_100015189416_100000722698 [0,2,0,0,0,0|2,0,0]=4 21603 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Br 527a_100015189416_100000722698 [0,2,0,0,0,0|2,0,0]=4 21604 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Cl 11a_100015189416_100000762818 [0,2,0,0,0,0|2,0,0]=4 21605 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Cl 1626a_100015189416_100000762818 [0,2,0,0,0,0|2,0,0]=4 21606 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Cl 240690a_100015189416_100000762818 [0,2,0,0,0,0|2,0,0]=4 21607 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)Cl 527a_100015189416_100000762818 [0,2,0,0,0,0|2,0,0]=4 21608 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)F 11a_100015189416_100000762896 [0,2,0,0,0,0|2,0,0]=4 21609 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)F 1626a_100015189416_100000762896 [0,2,0,0,0,0|2,0,0]=4 21610 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)F 240690a_100015189416_100000762896 [0,2,0,0,0,0|2,0,0]=4 21611 B16R1.62 CC(C(=O)NCCCF)c1cccc(c1)F 527a_100015189416_100000762896 [0,2,0,0,0,0|2,0,0]=4 21612 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)Br 240690a_100000182051_100000722698 [0,2,0,0,0,0|2,0,0]=4 21613 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)Br 527a_100000182051_100000722698 [0,2,0,0,0,0|2,0,0]=4 21614 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)Cl 240690a_100000182051_100000762818 [0,2,0,0,0,0|2,0,0]=4 21615 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)Cl 527a_100000182051_100000762818 [0,2,0,0,0,0|2,0,0]=4 21616 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)F 240690a_100000182051_100000762896 [0,2,0,0,0,0|2,0,0]=4 21617 B16R1.62 CC(C(=O)NCCCO)c1cccc(c1)F 527a_100000182051_100000762896 [0,2,0,0,0,0|2,0,0]=4 21618 B16R1.62 CCCCCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000210326 [0,2,0,0,0,0|1,0,0]=3 21619 B16R1.62 CCCCCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000210326 [0,2,0,0,0,0|1,0,0]=3 21620 B16R1.62 CCCCCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000210326 [0,2,0,0,0,0|1,0,0]=3 21621 B16R1.62 CCCCCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000210326 [0,2,0,0,0,0|1,0,0]=3 21622 B16R1.62 CCCCCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210326 [0,2,0,0,0,0|1,0,0]=3 21623 B16R1.62 CCCCCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210326 [0,2,0,0,0,0|1,0,0]=3 21624 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100000212188 [0,2,0,0,0,0|2,0,0]=4 21625 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100000212188 [0,2,0,0,0,0|2,0,0]=4 21626 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000212188 [0,2,0,0,0,0|2,0,0]=4 21627 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100000212188 [0,2,0,0,0,0|2,0,0]=4 21628 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)C 11a_100000219674_100000212188 [0,2,0,0,0,0|2,0,0]=4 21629 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100000212188 [0,2,0,0,0,0|2,0,0]=4 21630 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000212188 [0,2,0,0,0,0|2,0,0]=4 21631 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100000212188 [0,2,0,0,0,0|2,0,0]=4 21632 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100000212188 [0,2,0,0,0,0|2,0,0]=4 21633 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000212188 [0,2,0,0,0,0|2,0,0]=4 21634 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)F 11a_100020633736_100000212188 [0,2,0,0,0,0|2,0,0]=4 21635 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100000212188 [0,2,0,0,0,0|2,0,0]=4 21636 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000212188 [0,2,0,0,0,0|2,0,0]=4 21637 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)I 11a_100000221217_100000212188 [0,2,0,0,0,0|2,0,0]=4 21638 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100000212188 [0,2,0,0,0,0|2,0,0]=4 21639 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000212188 [0,2,0,0,0,0|2,0,0]=4 21640 B16R1.62 CCCCCC(=O)N(C)c1cccc(c1)O 527a_100000756613_100000212188 [0,2,0,0,0,0|2,0,0]=4 21641 B16R1.62 CCCCCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000210326 [0,2,0,0,0,0|1,0,0]=3 21642 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Br 11a_100000102301_100000722698 [0,2,0,0,0,0|1,0,0]=3 21643 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Br 1626a_100000102301_100000722698 [0,2,0,0,0,0|1,0,0]=3 21644 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Br 240690a_100000102301_100000722698 [0,2,0,0,0,0|1,0,0]=3 21645 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Br 527a_100000102301_100000722698 [0,2,0,0,0,0|1,0,0]=3 21646 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Cl 11a_100000102301_100000762818 [0,2,0,0,0,0|1,0,0]=3 21647 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Cl 1626a_100000102301_100000762818 [0,2,0,0,0,0|1,0,0]=3 21648 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Cl 240690a_100000102301_100000762818 [0,2,0,0,0,0|1,0,0]=3 21649 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)Cl 527a_100000102301_100000762818 [0,2,0,0,0,0|1,0,0]=3 21650 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)F 11a_100000102301_100000762896 [0,2,0,0,0,0|1,0,0]=3 21651 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)F 1626a_100000102301_100000762896 [0,2,0,0,0,0|1,0,0]=3 21652 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)F 240690a_100000102301_100000762896 [0,2,0,0,0,0|1,0,0]=3 21653 B16R1.62 CCCCNC(=O)C(C)c1cccc(c1)F 527a_100000102301_100000762896 [0,2,0,0,0,0|1,0,0]=3 21654 B16R1.62 CCCCNC(=O)C(O)c1cccc(c1)C 240690a_100000102301_100011434945 [0,2,0,0,0,0|1,0,0]=3 21655 B16R1.62 CCCCNC(=O)C(O)c1cccc(c1)Cl 240690a_100000102301_100011216955 [0,2,0,0,0,0|1,0,0]=3 21656 B16R1.62 CCCCNC(=O)C(O)c1cccc(c1)F 240690a_100000102301_100011434943 [0,2,0,0,0,0|1,0,0]=3 21657 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)Br 512a_100000102301_100000219648 [0,2,0,0,0,0|2,0,0]=4 21658 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)Br 512a_100000219648_100000102301 [0,2,0,0,0,0|2,0,0]=4 21659 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)C 512a_100000102301_100000219674 [0,2,0,0,0,0|2,0,0]=4 21660 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)C 512a_100000219674_100000102301 [0,2,0,0,0,0|2,0,0]=4 21661 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)Cl 512a_100000220044_100000102301 [0,2,0,0,0,0|2,0,0]=4 21662 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)F 512a_100020633736_100000102301 [0,2,0,0,0,0|2,0,0]=4 21663 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)I 512a_100000102301_100000221217 [0,2,0,0,0,0|2,0,0]=4 21664 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)I 512a_100000221217_100000102301 [0,2,0,0,0,0|2,0,0]=4 21665 B16R1.62 CCCCNC(=O)N(C)c1cccc(c1)O 512a_100000756613_100000102301 [0,2,0,0,0,0|2,0,0]=4 21666 B16R1.62 CCCCNC(=O)[C@H](C)c1cccc(c1)C 11a_100000102301_200009911544 [0,2,0,0,0,0|1,0,0]=3 21667 B16R1.62 CCCCNC(=O)[C@H](C)c1cccc(c1)C 1626a_100000102301_200009911544 [0,2,0,0,0,0|1,0,0]=3 21668 B16R1.62 CCCCNC(=O)[C@H](C)c1cccc(c1)C 240690a_100000102301_200009911544 [0,2,0,0,0,0|1,0,0]=3 21669 B16R1.62 CCCCNC(=O)[C@H](C)c1cccc(c1)C 527a_100000102301_200009911544 [0,2,0,0,0,0|1,0,0]=3 21670 B16R1.62 CCCNNC(=O)C(C)c1cccc(c1)Br 22a_100000740057_100000722698 [0,2,0,0,0,0|2,0,0]=4 21671 B16R1.62 CCCNNC(=O)C(C)c1cccc(c1)Cl 22a_100000740057_100000762818 [0,2,0,0,0,0|2,0,0]=4 21672 B16R1.62 CCCNNC(=O)C(C)c1cccc(c1)F 22a_100000740057_100000762896 [0,2,0,0,0,0|2,0,0]=4 21673 B16R1.62 CCCNNC(=O)C(O)c1cccc(c1)C 22a_100000740057_100011434945 [0,2,0,0,0,0|2,0,0]=4 21674 B16R1.62 CCCNNC(=O)C(O)c1cccc(c1)Cl 22a_100000740057_100011216955 [0,2,0,0,0,0|2,0,0]=4 21675 B16R1.62 CCCNNC(=O)C(O)c1cccc(c1)F 22a_100000740057_100011434943 [0,2,0,0,0,0|2,0,0]=4 21676 B16R1.62 CCCNNC(=O)[C@H](C)c1cccc(c1)C 22a_100000740057_200009911544 [0,2,0,0,0,0|2,0,0]=4 21677 B16R1.62 CCOCCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100011215890 [0,2,0,0,0,0|2,0,0]=4 21678 B16R1.62 CCOCCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100011215890 [0,2,0,0,0,0|2,0,0]=4 21679 B16R1.62 CCOCCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100011215890 [0,2,0,0,0,0|2,0,0]=4 21680 B16R1.62 CCOCCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100011215890 [0,2,0,0,0,0|2,0,0]=4 21681 B16R1.62 CCOCCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100011215890 [0,2,0,0,0,0|2,0,0]=4 21682 B16R1.62 CCOCCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100011215890 [0,2,0,0,0,0|2,0,0]=4 21683 B16R1.62 CCOCCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100011215890 [0,2,0,0,0,0|2,0,0]=4 21684 B16R1.62 CCSCCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000757381 [0,2,0,0,0,0|2,0,0]=4 21685 B16R1.62 CCSCCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000757381 [0,2,0,0,0,0|2,0,0]=4 21686 B16R1.62 CCSCCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000757381 [0,2,0,0,0,0|2,0,0]=4 21687 B16R1.62 CCSCCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000757381 [0,2,0,0,0,0|2,0,0]=4 21688 B16R1.62 CCSCCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000757381 [0,2,0,0,0,0|2,0,0]=4 21689 B16R1.62 CCSCCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000757381 [0,2,0,0,0,0|2,0,0]=4 21690 B16R1.62 CCSCCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000757381 [0,2,0,0,0,0|2,0,0]=4 21691 B16R1.62 COCCCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000740836 [0,2,0,0,0,0|2,0,0]=4 21692 B16R1.62 COCCCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000740836 [0,2,0,0,0,0|2,0,0]=4 21693 B16R1.62 COCCCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000740836 [0,2,0,0,0,0|2,0,0]=4 21694 B16R1.62 COCCCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000740836 [0,2,0,0,0,0|2,0,0]=4 21695 B16R1.62 COCCCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000740836 [0,2,0,0,0,0|2,0,0]=4 21696 B16R1.62 COCCCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000740836 [0,2,0,0,0,0|2,0,0]=4 21697 B16R1.62 COCCCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000740836 [0,2,0,0,0,0|2,0,0]=4 21698 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Br 1626a_100000209980_100000722698 [0,2,0,0,0,0|2,0,0]=4 21699 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Br 240690a_100000209980_100000722698 [0,2,0,0,0,0|2,0,0]=4 21700 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Br 527a_100000209980_100000722698 [0,2,0,0,0,0|2,0,0]=4 21701 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Cl 1626a_100000209980_100000762818 [0,2,0,0,0,0|2,0,0]=4 21702 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Cl 240690a_100000209980_100000762818 [0,2,0,0,0,0|2,0,0]=4 21703 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)Cl 527a_100000209980_100000762818 [0,2,0,0,0,0|2,0,0]=4 21704 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)F 1626a_100000209980_100000762896 [0,2,0,0,0,0|2,0,0]=4 21705 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)F 240690a_100000209980_100000762896 [0,2,0,0,0,0|2,0,0]=4 21706 B16R1.62 COCCNC(=O)C(C)c1cccc(c1)F 527a_100000209980_100000762896 [0,2,0,0,0,0|2,0,0]=4 21707 B16R1.62 COCCNC(=O)C(O)c1cccc(c1)C 240690a_100000209980_100011434945 [0,2,0,0,0,0|2,0,0]=4 21708 B16R1.62 COCCNC(=O)C(O)c1cccc(c1)Cl 240690a_100000209980_100011216955 [0,2,0,0,0,0|2,0,0]=4 21709 B16R1.62 COCCNC(=O)C(O)c1cccc(c1)F 240690a_100000209980_100011434943 [0,2,0,0,0,0|2,0,0]=4 21710 B16R1.62 COCCNC(=O)[C@H](C)c1cccc(c1)C 1626a_100000209980_200009911544 [0,2,0,0,0,0|2,0,0]=4 21711 B16R1.62 COCCNC(=O)[C@H](C)c1cccc(c1)C 240690a_100000209980_200009911544 [0,2,0,0,0,0|2,0,0]=4 21712 B16R1.62 COCCNC(=O)[C@H](C)c1cccc(c1)C 527a_100000209980_200009911544 [0,2,0,0,0,0|2,0,0]=4 21713 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Br 11a_100020590264_100000722698 [0,2,0,0,0,0|2,0,0]=4 21714 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Br 1626a_100020590264_100000722698 [0,2,0,0,0,0|2,0,0]=4 21715 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Br 240690a_100020590264_100000722698 [0,2,0,0,0,0|2,0,0]=4 21716 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Br 527a_100020590264_100000722698 [0,2,0,0,0,0|2,0,0]=4 21717 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Cl 11a_100020590264_100000762818 [0,2,0,0,0,0|2,0,0]=4 21718 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Cl 1626a_100020590264_100000762818 [0,2,0,0,0,0|2,0,0]=4 21719 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Cl 240690a_100020590264_100000762818 [0,2,0,0,0,0|2,0,0]=4 21720 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)Cl 527a_100020590264_100000762818 [0,2,0,0,0,0|2,0,0]=4 21721 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)F 11a_100020590264_100000762896 [0,2,0,0,0,0|2,0,0]=4 21722 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)F 1626a_100020590264_100000762896 [0,2,0,0,0,0|2,0,0]=4 21723 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)F 240690a_100020590264_100000762896 [0,2,0,0,0,0|2,0,0]=4 21724 B16R1.62 CSCCNC(=O)C(C)c1cccc(c1)F 527a_100020590264_100000762896 [0,2,0,0,0,0|2,0,0]=4 21725 B16R1.62 CSCCNC(=O)C(O)c1cccc(c1)C 240690a_100020590264_100011434945 [0,2,0,0,0,0|2,0,0]=4 21726 B16R1.62 CSCCNC(=O)C(O)c1cccc(c1)Cl 240690a_100020590264_100011216955 [0,2,0,0,0,0|2,0,0]=4 21727 B16R1.62 CSCCNC(=O)C(O)c1cccc(c1)F 240690a_100020590264_100011434943 [0,2,0,0,0,0|2,0,0]=4 21728 B16R1.62 CSCCNC(=O)[C@H](C)c1cccc(c1)C 11a_100020590264_200009911544 [0,2,0,0,0,0|2,0,0]=4 21729 B16R1.62 CSCCNC(=O)[C@H](C)c1cccc(c1)C 1626a_100020590264_200009911544 [0,2,0,0,0,0|2,0,0]=4 21730 B16R1.62 CSCCNC(=O)[C@H](C)c1cccc(c1)C 240690a_100020590264_200009911544 [0,2,0,0,0,0|2,0,0]=4 21731 B16R1.62 CSCCNC(=O)[C@H](C)c1cccc(c1)C 527a_100020590264_200009911544 [0,2,0,0,0,0|2,0,0]=4 21732 B16R1.62 Cc1cccc(c1)C(O)C(=O)CCCCF 1458a_100011434945_100000729493 [0,2,0,0,0,0|2,0,0]=4 21733 B16R1.62 Cc1cccc(c1)C(O)C(=O)CCCCO 1458a_100011434945_100000210776 [0,2,0,0,0,0|2,0,0]=4 21734 B16R1.62 Cc1cccc(c1)C(O)C(=O)NCCCF 240690a_100015189416_100011434945 [0,2,0,0,0,0|2,0,0]=4 21735 B16R1.62 Cc1cccc(c1)C(O)C(=O)NCCCO 240690a_100000182051_100011434945 [0,2,0,0,0,0|2,0,0]=4 21736 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)CCCCF 1458a_200009911544_100000729493 [0,2,0,0,0,0|2,0,0]=4 21737 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)CCCCO 1458a_200009911544_100000210776 [0,2,0,0,0,0|2,0,0]=4 21738 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCF 11a_100015189416_200009911544 [0,2,0,0,0,0|2,0,0]=4 21739 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCF 1626a_100015189416_200009911544 [0,2,0,0,0,0|2,0,0]=4 21740 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCF 240690a_100015189416_200009911544 [0,2,0,0,0,0|2,0,0]=4 21741 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCF 527a_100015189416_200009911544 [0,2,0,0,0,0|2,0,0]=4 21742 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCO 240690a_100000182051_200009911544 [0,2,0,0,0,0|2,0,0]=4 21743 B16R1.62 Cc1cccc(c1)[C@@H](C)C(=O)NCCCO 527a_100000182051_200009911544 [0,2,0,0,0,0|2,0,0]=4 21744 B16R1.62 O=C(CCCCF)C(O)c1cccc(c1)Cl 1458a_100011216955_100000729493 [0,2,0,0,0,0|2,0,0]=4 21745 B16R1.62 O=C(CCCCF)C(O)c1cccc(c1)F 1458a_100011434943_100000729493 [0,2,0,0,0,0|2,0,0]=4 21746 B16R1.62 O=C(CCCCO)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210776 [0,2,0,0,0,0|2,0,0]=4 21747 B16R1.62 O=C(CCCCO)C(O)c1cccc(c1)F 1458a_100011434943_100000210776 [0,2,0,0,0,0|2,0,0]=4 21748 B16R1.62 O=C(NCCCF)C(O)c1cccc(c1)Cl 240690a_100015189416_100011216955 [0,2,0,0,0,0|2,0,0]=4 21749 B16R1.62 O=C(NCCCF)C(O)c1cccc(c1)F 240690a_100015189416_100011434943 [0,2,0,0,0,0|2,0,0]=4 21750 B16R1.62 O=C(NCCCO)C(O)c1cccc(c1)Cl 240690a_100000182051_100011216955 [0,2,0,0,0,0|2,0,0]=4 21751 B16R1.62 O=C(NCCCO)C(O)c1cccc(c1)F 240690a_100000182051_100011434943 [0,2,0,0,0,0|2,0,0]=4 21752 B16R1.613 C=C(C(=O)CCCC(C)C)c1ccccc1 1458a_100000065200_100011214892 [0,2,0,0,0,0|1,0,1]=4 21753 B16R1.613 C=C(C(=O)CCCC(C)O)c1ccccc1 1458a_100000065200_200000718107 [0,2,0,0,0,0|1,0,1]=4 21754 B16R1.613 C=C(C(=O)NCCC(C)C)c1ccccc1 1626a_100000210545_100000065200 [0,2,0,0,0,0|1,0,1]=4 21755 B16R1.613 CC(=O)CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011215641 [0,2,0,0,0,0|1,0,1]=4 21756 B16R1.613 CC(=O)CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011215641 [0,2,0,0,0,0|1,0,1]=4 21757 B16R1.613 CC(=O)CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011215641 [0,2,0,0,0,0|1,0,1]=4 21758 B16R1.613 CC(C)CCCC(=O)C(C)c1ccccc1 1458a_100011216857_100000230085 [0,2,0,0,0,0|1,0,0]=3 21759 B16R1.613 CC(C)CCCC(=O)C(C)c1ccccn1 1458a_100000722050_100011214892 [0,2,0,0,0,0|2,0,0]=4 21760 B16R1.613 CC(C)CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100011214892 [0,2,0,0,0,0|1,0,0]=3 21761 B16R1.613 CC(C)CCCC(=O)N(C)c1ccccc1 11a_100000210012_100011216857 [0,2,0,0,0,0|2,0,0]=4 21762 B16R1.613 CC(C)CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100011216857 [0,2,0,0,0,0|2,0,0]=4 21763 B16R1.613 CC(C)CCCC(=O)N(C)c1ccccc1 22a_100000210012_100011216857 [0,2,0,0,0,0|2,0,0]=4 21764 B16R1.613 CC(C)CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011214892 [0,2,0,0,0,0|1,0,0]=3 21765 B16R1.613 CC(C)CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011214892 [0,2,0,0,0,0|1,0,0]=3 21766 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccn1 11a_100000210545_100000722050 [0,2,0,0,0,0|2,0,0]=4 21767 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccn1 1626a_100000210545_100000722050 [0,2,0,0,0,0|2,0,0]=4 21768 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccn1 240690a_100000210545_100000722050 [0,2,0,0,0,0|2,0,0]=4 21769 B16R1.613 CC(C)CCNC(=O)C(C)c1ccccn1 527a_100000210545_100000722050 [0,2,0,0,0,0|2,0,0]=4 21770 B16R1.613 CC(C)CCNC(=O)C(F)c1ccccc1 11a_100000210545_100000698975 [0,2,0,0,0,0|1,0,0]=3 21771 B16R1.613 CC(C)CCNC(=O)C(F)c1ccccc1 1626a_100000210545_100000698975 [0,2,0,0,0,0|1,0,0]=3 21772 B16R1.613 CC(C)CCNC(=O)C(F)c1ccccc1 240690a_100000210545_100000698975 [0,2,0,0,0,0|1,0,0]=3 21773 B16R1.613 CC(C)CCNC(=O)C(F)c1ccccc1 527a_100000210545_100000698975 [0,2,0,0,0,0|1,0,0]=3 21774 B16R1.613 CC(C)CCNC(=O)N(C)c1ccccc1 512a_100000210545_100000210012 [0,2,0,0,0,0|2,0,0]=4 21775 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 11a_100000210545_100000751047 [0,2,0,0,0,0|1,0,0]=3 21776 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 1626a_100000210545_100000751047 [0,2,0,0,0,0|1,0,0]=3 21777 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 240690a_100000210545_100000751047 [0,2,0,0,0,0|1,0,0]=3 21778 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 527a_100000210545_100000751047 [0,2,0,0,0,0|1,0,0]=3 21779 B16R1.613 CC(C)CCNC(=O)[C@H](O)c1ccccc1 240690a_100000210545_100000684486 [0,2,0,0,0,0|1,0,0]=3 21780 B16R1.613 CC(C)CCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000210312 [0,2,0,0,0,0|1,0,1]=4 21781 B16R1.613 CC(C)CNNC(=O)C(F)c1ccccc1 22a_100000696102_100000698975 [0,2,0,0,0,0|2,0,0]=4 21782 B16R1.613 CC(C)CNNC(=O)[C@@H](C)c1ccccc1 22a_100000696102_100000751047 [0,2,0,0,0,0|2,0,0]=4 21783 B16R1.613 CC(C)CNNC(=O)[C@H](O)c1ccccc1 22a_100000696102_100000684486 [0,2,0,0,0,0|2,0,0]=4 21784 B16R1.613 CC(C)COCC(=O)C(C)c1ccccc1 1458a_100011223364_100000230085 [0,2,0,0,0,0|2,0,0]=4 21785 B16R1.613 CC(C)OCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000211751 [0,2,0,0,0,0|2,0,0]=4 21786 B16R1.613 CC(C)OCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000211751 [0,2,0,0,0,0|2,0,0]=4 21787 B16R1.613 CC(C)OCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000211751 [0,2,0,0,0,0|2,0,0]=4 21788 B16R1.613 CC(C)SCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000730970 [0,2,0,0,0,0|2,0,0]=4 21789 B16R1.613 CC(C)SCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000730970 [0,2,0,0,0,0|2,0,0]=4 21790 B16R1.613 CC(C)SCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000730970 [0,2,0,0,0,0|2,0,0]=4 21791 B16R1.613 CC(O)CCCC(=O)C(C)c1ccccn1 1458a_100000722050_200000718107 [0,2,0,0,0,0|2,0,0]=4 21792 B16R1.613 CC(O)CCCC(=O)C(F)c1ccccc1 1458a_100000698975_200000718107 [0,2,0,0,0,0|1,0,0]=3 21793 B16R1.613 CC(O)CCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000761597 [0,2,0,0,0,0|2,0,0]=4 21794 B16R1.613 CC(O)CCCC(=O)N(C)c1ccccc1 22a_100000210012_100000761597 [0,2,0,0,0,0|2,0,0]=4 21795 B16R1.613 CC(O)CCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000718107 [0,2,0,0,0,0|1,0,0]=3 21796 B16R1.613 CC(O)CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000718107 [0,2,0,0,0,0|1,0,0]=3 21797 B16R1.613 CC(O)CCNC(=O)C(C)c1ccccn1 240690a_200000755665_100000722050 [0,2,0,0,0,0|2,0,0]=4 21798 B16R1.613 CC(O)CCNC(=O)C(C)c1ccccn1 527a_200000755665_100000722050 [0,2,0,0,0,0|2,0,0]=4 21799 B16R1.613 CC(O)CCNC(=O)C(F)c1ccccc1 240690a_200000755665_100000698975 [0,2,0,0,0,0|1,0,0]=3 21800 B16R1.613 CC(O)CCNC(=O)C(F)c1ccccc1 527a_200000755665_100000698975 [0,2,0,0,0,0|1,0,0]=3 21801 B16R1.613 CC(O)CCNC(=O)N(C)c1ccccc1 512a_200000755665_100000210012 [0,2,0,0,0,0|2,0,0]=4 21802 B16R1.613 CC(O)CCNC(=O)[C@@H](C)c1ccccc1 240690a_200000755665_100000751047 [0,2,0,0,0,0|1,0,0]=3 21803 B16R1.613 CC(O)CCNC(=O)[C@@H](C)c1ccccc1 527a_200000755665_100000751047 [0,2,0,0,0,0|1,0,0]=3 21804 B16R1.613 CC(O)CCNC(=O)[C@H](O)c1ccccc1 240690a_200000755665_100000684486 [0,2,0,0,0,0|1,0,0]=3 21805 B16R1.613 CC(O)CCO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100012276601 [0,2,0,0,0,0|1,0,1]=4 21806 B16R1.613 CC(O)CNNC(=O)C(F)c1ccccc1 22a_200000730056_100000698975 [0,2,0,0,0,0|2,0,0]=4 21807 B16R1.613 CC(O)CNNC(=O)[C@@H](C)c1ccccc1 22a_200000730056_100000751047 [0,2,0,0,0,0|2,0,0]=4 21808 B16R1.613 CC(O)CNNC(=O)[C@H](O)c1ccccc1 22a_200000730056_100000684486 [0,2,0,0,0,0|2,0,0]=4 21809 B16R1.613 CN(C)CCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000695564 [0,2,0,0,0,0|2,0,0]=4 21810 B16R1.613 CN(C)CCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000695564 [0,2,0,0,0,0|2,0,0]=4 21811 B16R1.613 CN(C)CCNC(=O)C(F)c1ccccc1 240690a_100000210585_100000698975 [0,2,0,0,0,0|2,0,0]=4 21812 B16R1.613 CN(C)CCNC(=O)C(F)c1ccccc1 527a_100000210585_100000698975 [0,2,0,0,0,0|2,0,0]=4 21813 B16R1.613 CN(C)CCNC(=O)[C@H](O)c1ccccc1 240690a_100000210585_100000684486 [0,2,0,0,0,0|2,0,0]=4 21814 B16R1.613 C[C@H](C(=O)CCCN(C)C)c1ccccc1 1458a_100000751047_100000695564 [0,2,0,0,0,0|2,0,0]=4 21815 B16R1.613 C[C@H](C(=O)NCCN(C)C)c1ccccc1 240690a_100000210585_100000751047 [0,2,0,0,0,0|2,0,0]=4 21816 B16R1.613 C[C@H](C(=O)NCCN(C)C)c1ccccc1 527a_100000210585_100000751047 [0,2,0,0,0,0|2,0,0]=4 21817 B16R1.915 C=C(C(=O)CC(C)CCC)c1ccccc1 1458a_100000065200_100011216630 [0,2,0,0,0,0|1,0,1]=4 21818 B16R1.915 C=C(C(=O)NC(C)CCC)c1ccccc1 1626a_100000741246_100000065200 [0,2,0,0,0,0|1,0,1]=4 21819 B16R1.915 C=C(CCC)CC(=O)C(C)c1ccccc1 1458a_100000138376_100000230085 [0,2,0,0,0,0|1,0,1]=4 21820 B16R1.915 CCCC(=CC(=O)C(C)c1ccccc1)C 1458a_100020676950_100000230085 [0,2,0,0,0,0|1,0,1]=4 21821 B16R1.915 CCCC(=O)CC(=O)C(F)c1ccccc1 1458a_100000698975_100000747444 [0,2,0,0,0,0|1,0,1]=4 21822 B16R1.915 CCCC(=O)CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000747444 [0,2,0,0,0,0|1,0,1]=4 21823 B16R1.915 CCCC(=O)CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000747444 [0,2,0,0,0,0|1,0,1]=4 21824 B16R1.915 CCCC(C)CC(=O)C(C)c1ccccc1 1458a_100000748435_100000230085 [0,2,0,0,0,0|1,0,0]=3 21825 B16R1.915 CCCC(C)CC(=O)C(C)c1ccccn1 1458a_100000722050_100011216630 [0,2,0,0,0,0|2,0,0]=4 21826 B16R1.915 CCCC(C)CC(=O)C(F)c1ccccc1 1458a_100000698975_100011216630 [0,2,0,0,0,0|1,0,0]=3 21827 B16R1.915 CCCC(C)CC(=O)N(C)c1ccccc1 11a_100000210012_100000748435 [0,2,0,0,0,0|2,0,0]=4 21828 B16R1.915 CCCC(C)CC(=O)N(C)c1ccccc1 1626a_100000210012_100000748435 [0,2,0,0,0,0|2,0,0]=4 21829 B16R1.915 CCCC(C)CC(=O)N(C)c1ccccc1 22a_100000210012_100000748435 [0,2,0,0,0,0|2,0,0]=4 21830 B16R1.915 CCCC(C)CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100011216630 [0,2,0,0,0,0|1,0,0]=3 21831 B16R1.915 CCCC(C)CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100011216630 [0,2,0,0,0,0|1,0,0]=3 21832 B16R1.915 CCCC(C)NC(=O)C(C)c1ccccn1 11a_100000741246_100000722050 [0,2,0,0,0,0|2,0,0]=4 21833 B16R1.915 CCCC(C)NC(=O)C(C)c1ccccn1 1626a_100000741246_100000722050 [0,2,0,0,0,0|2,0,0]=4 21834 B16R1.915 CCCC(C)NC(=O)C(C)c1ccccn1 240690a_100000741246_100000722050 [0,2,0,0,0,0|2,0,0]=4 21835 B16R1.915 CCCC(C)NC(=O)C(C)c1ccccn1 527a_100000741246_100000722050 [0,2,0,0,0,0|2,0,0]=4 21836 B16R1.915 CCCC(C)NC(=O)C(F)c1ccccc1 11a_100000741246_100000698975 [0,2,0,0,0,0|1,0,0]=3 21837 B16R1.915 CCCC(C)NC(=O)C(F)c1ccccc1 1626a_100000741246_100000698975 [0,2,0,0,0,0|1,0,0]=3 21838 B16R1.915 CCCC(C)NC(=O)C(F)c1ccccc1 240690a_100000741246_100000698975 [0,2,0,0,0,0|1,0,0]=3 21839 B16R1.915 CCCC(C)NC(=O)C(F)c1ccccc1 527a_100000741246_100000698975 [0,2,0,0,0,0|1,0,0]=3 21840 B16R1.915 CCCC(C)NC(=O)N(C)c1ccccc1 512a_100000741246_100000210012 [0,2,0,0,0,0|2,0,0]=4 21841 B16R1.915 CCCC(C)NC(=O)[C@@H](C)c1ccccc1 11a_100000741246_100000751047 [0,2,0,0,0,0|1,0,0]=3 21842 B16R1.915 CCCC(C)NC(=O)[C@@H](C)c1ccccc1 1626a_100000741246_100000751047 [0,2,0,0,0,0|1,0,0]=3 21843 B16R1.915 CCCC(C)NC(=O)[C@@H](C)c1ccccc1 240690a_100000741246_100000751047 [0,2,0,0,0,0|1,0,0]=3 21844 B16R1.915 CCCC(C)NC(=O)[C@@H](C)c1ccccc1 527a_100000741246_100000751047 [0,2,0,0,0,0|1,0,0]=3 21845 B16R1.915 CCCC(C)NC(=O)[C@H](O)c1ccccc1 240690a_100000741246_100000684486 [0,2,0,0,0,0|1,0,0]=3 21846 B16R1.915 CCCC(C)O[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000766640 [0,2,0,0,0,0|1,0,1]=4 21847 B16R1.915 CCCS(=O)CC(=O)C(C)c1ccccc1 1458a_100011387404_100000230085 [0,2,0,0,0,0|2,0,0]=4 21848 B16R1.915 CCSC(C)CC(=O)C(C)c1ccccc1 1458a_200011311441_100000230085 [0,2,0,0,0,0|2,0,0]=4 21849 B16R1.915 COC[C@@H](C)NC(=O)C(F)c1ccccc1 11a_100000764878_100000698975 [0,2,0,0,0,0|2,0,0]=4 21850 B16R1.915 COC[C@@H](C)NC(=O)C(F)c1ccccc1 1626a_100000764878_100000698975 [0,2,0,0,0,0|2,0,0]=4 21851 B16R1.915 COC[C@@H](C)NC(=O)C(F)c1ccccc1 240690a_100000764878_100000698975 [0,2,0,0,0,0|2,0,0]=4 21852 B16R1.915 COC[C@@H](C)NC(=O)C(F)c1ccccc1 527a_100000764878_100000698975 [0,2,0,0,0,0|2,0,0]=4 21853 B16R1.915 COC[C@@H](C)NC(=O)[C@@H](C)c1ccccc1 11a_100000764878_100000751047 [0,2,0,0,0,0|2,0,0]=4 21854 B16R1.915 COC[C@@H](C)NC(=O)[C@@H](C)c1ccccc1 1626a_100000764878_100000751047 [0,2,0,0,0,0|2,0,0]=4 21855 B16R1.915 COC[C@@H](C)NC(=O)[C@@H](C)c1ccccc1 240690a_100000764878_100000751047 [0,2,0,0,0,0|2,0,0]=4 21856 B16R1.915 COC[C@@H](C)NC(=O)[C@@H](C)c1ccccc1 527a_100000764878_100000751047 [0,2,0,0,0,0|2,0,0]=4 21857 B16R1.915 COC[C@@H](C)NC(=O)[C@H](O)c1ccccc1 240690a_100000764878_100000684486 [0,2,0,0,0,0|2,0,0]=4 21858 B16R1.915 C[C@H](CCO)NC(=O)C(F)c1ccccc1 240690a_100000706166_100000698975 [0,2,0,0,0,0|2,0,0]=4 21859 B16R1.915 C[C@H](CCO)NC(=O)C(F)c1ccccc1 527a_100000706166_100000698975 [0,2,0,0,0,0|2,0,0]=4 21860 B16R1.915 C[C@H](CCO)NC(=O)[C@@H](C)c1ccccc1 240690a_100000706166_100000751047 [0,2,0,0,0,0|2,0,0]=4 21861 B16R1.915 C[C@H](CCO)NC(=O)[C@@H](C)c1ccccc1 527a_100000706166_100000751047 [0,2,0,0,0,0|2,0,0]=4 21862 B16R1.915 C[C@H](CCO)NC(=O)[C@H](O)c1ccccc1 240690a_100000706166_100000684486 [0,2,0,0,0,0|2,0,0]=4 21863 B16R1.1244 C=C(C(=O)C(C)CCCC)c1ccccc1 1458a_100000065200_200011215066 [0,2,0,0,0,0|1,0,1]=4 21864 B16R1.1244 C=C(C(=O)N(C)CCCC)c1ccccc1 1626a_100000207549_100000065200 [0,2,0,0,0,0|1,0,1]=4 21865 B16R1.1244 CCC/C=C(\C)/C(=O)C(C)c1ccccc1 1458a_200020648666_100000230085 [0,2,0,0,0,0|1,0,1]=4 21866 B16R1.1244 CCCCC(=O)C(=O)N(C)c1ccccc1 1458a_100011297159_100000210211 [0,2,0,0,0,0|2,0,0]=4 21867 B16R1.1244 CCCCC(C)C(=O)C(C)c1ccccc1 1458a_100000725509_100000230085 [0,2,0,0,0,0|1,0,0]=3 21868 B16R1.1244 CCCCC(C)C(=O)C(C)c1ccccn1 1458a_100000722050_200011215066 [0,2,0,0,0,0|2,0,0]=4 21869 B16R1.1244 CCCCC(C)C(=O)C(F)c1ccccc1 1458a_100000698975_200011215066 [0,2,0,0,0,0|1,0,0]=3 21870 B16R1.1244 CCCCC(C)C(=O)N(C)c1ccccc1 11a_100000210012_100000725509 [0,2,0,0,0,0|2,0,0]=4 21871 B16R1.1244 CCCCC(C)C(=O)N(C)c1ccccc1 1626a_100000210012_100000725509 [0,2,0,0,0,0|2,0,0]=4 21872 B16R1.1244 CCCCC(C)C(=O)N(C)c1ccccc1 22a_100000210012_100000725509 [0,2,0,0,0,0|2,0,0]=4 21873 B16R1.1244 CCCCC(C)C(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200011215066 [0,2,0,0,0,0|1,0,0]=3 21874 B16R1.1244 CCCCC(C)C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200011215066 [0,2,0,0,0,0|1,0,0]=3 21875 B16R1.1244 CCCCC(O)C(=O)C(C)c1ccccc1 1458a_100000720857_100000230085 [0,2,0,0,0,0|1,0,0]=3 21876 B16R1.1244 CCCCC(O)C(=O)N(C)c1ccccc1 22a_100000210012_100000720857 [0,2,0,0,0,0|2,0,0]=4 21877 B16R1.1244 CCCCN(C)C(=O)C(C)c1ccccn1 11a_100000207549_100000722050 [0,2,0,0,0,0|2,0,0]=4 21878 B16R1.1244 CCCCN(C)C(=O)C(C)c1ccccn1 1626a_100000207549_100000722050 [0,2,0,0,0,0|2,0,0]=4 21879 B16R1.1244 CCCCN(C)C(=O)C(C)c1ccccn1 240690a_100000207549_100000722050 [0,2,0,0,0,0|2,0,0]=4 21880 B16R1.1244 CCCCN(C)C(=O)C(C)c1ccccn1 527a_100000207549_100000722050 [0,2,0,0,0,0|2,0,0]=4 21881 B16R1.1244 CCCCN(C)C(=O)C(F)c1ccccc1 11a_100000207549_100000698975 [0,2,0,0,0,0|1,0,0]=3 21882 B16R1.1244 CCCCN(C)C(=O)C(F)c1ccccc1 1626a_100000207549_100000698975 [0,2,0,0,0,0|1,0,0]=3 21883 B16R1.1244 CCCCN(C)C(=O)C(F)c1ccccc1 240690a_100000207549_100000698975 [0,2,0,0,0,0|1,0,0]=3 21884 B16R1.1244 CCCCN(C)C(=O)C(F)c1ccccc1 527a_100000207549_100000698975 [0,2,0,0,0,0|1,0,0]=3 21885 B16R1.1244 CCCCN(C)C(=O)[C@@H](C)c1ccccc1 11a_100000207549_100000751047 [0,2,0,0,0,0|1,0,0]=3 21886 B16R1.1244 CCCCN(C)C(=O)[C@@H](C)c1ccccc1 1626a_100000207549_100000751047 [0,2,0,0,0,0|1,0,0]=3 21887 B16R1.1244 CCCCN(C)C(=O)[C@@H](C)c1ccccc1 240690a_100000207549_100000751047 [0,2,0,0,0,0|1,0,0]=3 21888 B16R1.1244 CCCCN(C)C(=O)[C@@H](C)c1ccccc1 527a_100000207549_100000751047 [0,2,0,0,0,0|1,0,0]=3 21889 B16R1.1244 CCCCN(C)C(=O)[C@H](O)c1ccccc1 240690a_100000207549_100000684486 [0,2,0,0,0,0|1,0,0]=3 21890 B16R1.1244 CCCNC(=O)C(=O)C(C)c1ccccc1 1458a_200011297150_100000230085 [0,2,0,0,0,0|2,0,0]=4 21891 B16R1.1244 CN(CCCO)C(=O)C(F)c1ccccc1 240690a_100000213112_100000698975 [0,2,0,0,0,0|2,0,0]=4 21892 B16R1.1244 CN(CCCO)C(=O)C(F)c1ccccc1 527a_100000213112_100000698975 [0,2,0,0,0,0|2,0,0]=4 21893 B16R1.1244 CN(CCCO)C(=O)[C@H](O)c1ccccc1 240690a_100000213112_100000684486 [0,2,0,0,0,0|2,0,0]=4 21894 B16R1.1244 COCCN(C)C(=O)C(F)c1ccccc1 11a_100000743101_100000698975 [0,2,0,0,0,0|2,0,0]=4 21895 B16R1.1244 COCCN(C)C(=O)C(F)c1ccccc1 1626a_100000743101_100000698975 [0,2,0,0,0,0|2,0,0]=4 21896 B16R1.1244 COCCN(C)C(=O)C(F)c1ccccc1 240690a_100000743101_100000698975 [0,2,0,0,0,0|2,0,0]=4 21897 B16R1.1244 COCCN(C)C(=O)C(F)c1ccccc1 527a_100000743101_100000698975 [0,2,0,0,0,0|2,0,0]=4 21898 B16R1.1244 COCCN(C)C(=O)[C@@H](C)c1ccccc1 11a_100000743101_100000751047 [0,2,0,0,0,0|2,0,0]=4 21899 B16R1.1244 COCCN(C)C(=O)[C@@H](C)c1ccccc1 1626a_100000743101_100000751047 [0,2,0,0,0,0|2,0,0]=4 21900 B16R1.1244 COCCN(C)C(=O)[C@@H](C)c1ccccc1 240690a_100000743101_100000751047 [0,2,0,0,0,0|2,0,0]=4 21901 B16R1.1244 COCCN(C)C(=O)[C@@H](C)c1ccccc1 527a_100000743101_100000751047 [0,2,0,0,0,0|2,0,0]=4 21902 B16R1.1244 COCCN(C)C(=O)[C@H](O)c1ccccc1 240690a_100000743101_100000684486 [0,2,0,0,0,0|2,0,0]=4 21903 B16R1.1244 CSCCC(O)C(=O)C(C)c1ccccc1 1458a_100000685904_100000230085 [0,2,0,0,0,0|2,0,0]=4 21904 B16R1.1244 CSCCN(C)C(=O)C(F)c1ccccc1 11a_100000686725_100000698975 [0,2,0,0,0,0|2,0,0]=4 21905 B16R1.1244 CSCCN(C)C(=O)C(F)c1ccccc1 1626a_100000686725_100000698975 [0,2,0,0,0,0|2,0,0]=4 21906 B16R1.1244 CSCCN(C)C(=O)C(F)c1ccccc1 240690a_100000686725_100000698975 [0,2,0,0,0,0|2,0,0]=4 21907 B16R1.1244 CSCCN(C)C(=O)C(F)c1ccccc1 527a_100000686725_100000698975 [0,2,0,0,0,0|2,0,0]=4 21908 B16R1.1244 CSCCN(C)C(=O)[C@@H](C)c1ccccc1 11a_100000686725_100000751047 [0,2,0,0,0,0|2,0,0]=4 21909 B16R1.1244 CSCCN(C)C(=O)[C@@H](C)c1ccccc1 1626a_100000686725_100000751047 [0,2,0,0,0,0|2,0,0]=4 21910 B16R1.1244 CSCCN(C)C(=O)[C@@H](C)c1ccccc1 240690a_100000686725_100000751047 [0,2,0,0,0,0|2,0,0]=4 21911 B16R1.1244 CSCCN(C)C(=O)[C@@H](C)c1ccccc1 527a_100000686725_100000751047 [0,2,0,0,0,0|2,0,0]=4 21912 B16R1.1244 CSCCN(C)C(=O)[C@H](O)c1ccccc1 240690a_100000686725_100000684486 [0,2,0,0,0,0|2,0,0]=4 21913 B16R1.1244 C[C@H](C(=O)N(C)CCCO)c1ccccc1 240690a_100000213112_100000751047 [0,2,0,0,0,0|2,0,0]=4 21914 B16R1.1244 C[C@H](C(=O)N(C)CCCO)c1ccccc1 527a_100000213112_100000751047 [0,2,0,0,0,0|2,0,0]=4 21915 B16R1.1701 CC(C)(C(=O)CCCCF)c1ccccc1 1458a_100000211857_100000729493 [0,2,0,0,0,0|2,0,0]=4 21916 B16R1.1701 CC(C)(C(=O)CCCCO)c1ccccc1 1458a_100000211857_100000210776 [0,2,0,0,0,0|2,0,0]=4 21917 B16R1.1701 CC(C)(C(=O)CCCCO)c1ccccc1 1458a_100000695505_100000034625 [0,2,0,0,0,0|2,0,0]=4 21918 B16R1.1701 CC(C)(C(=O)NCCCF)c1ccccc1 11a_100015189416_100000211857 [0,2,0,0,0,0|2,0,0]=4 21919 B16R1.1701 CC(C)(C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000211857 [0,2,0,0,0,0|2,0,0]=4 21920 B16R1.1701 CC(C)(C(=O)NCCCF)c1ccccc1 240690a_100015189416_100000211857 [0,2,0,0,0,0|2,0,0]=4 21921 B16R1.1701 CC(C)(C(=O)NCCCF)c1ccccc1 527a_100015189416_100000211857 [0,2,0,0,0,0|2,0,0]=4 21922 B16R1.1701 CC(C)(C(=O)NCCCO)c1ccccc1 240690a_100000182051_100000211857 [0,2,0,0,0,0|2,0,0]=4 21923 B16R1.1701 CC(C)(C(=O)NCCCO)c1ccccc1 527a_100000182051_100000211857 [0,2,0,0,0,0|2,0,0]=4 21924 B16R1.1701 CCCC#CC(=O)C(C)(C)c1ccccc1 1458a_200011218047_100000034625 [0,2,0,0,0,0|1,0,1]=4 21925 B16R1.1701 CCCC#CC(=O)C(F)(F)c1ccccc1 1458a_200011218047_100000036403 [0,2,0,0,0,0|1,0,1]=4 21926 B16R1.1701 CCCC=CC(=O)C(C)(C)c1ccccc1 1458a_100000212230_100000034625 [0,2,0,0,0,0|1,0,1]=4 21927 B16R1.1701 CCCC=CC(=O)C(F)(F)c1ccccc1 1458a_100000212230_100000036403 [0,2,0,0,0,0|1,0,1]=4 21928 B16R1.1701 CCCCCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000210326 [0,2,0,0,0,0|1,0,0]=3 21929 B16R1.1701 CCCCCC(=O)C(C)(C)c1ccccc1 1458a_100000212188_100000034625 [0,2,0,0,0,0|1,0,0]=3 21930 B16R1.1701 CCCCCC(=O)C(F)(F)c1ccccc1 1458a_100000212188_100000036403 [0,2,0,0,0,0|1,0,0]=3 21931 B16R1.1701 CCCCCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000210326 [0,2,0,0,0,0|1,0,0]=3 21932 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 11a_100000102301_100000211857 [0,2,0,0,0,0|1,0,0]=3 21933 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 1626a_100000102301_100000211857 [0,2,0,0,0,0|1,0,0]=3 21934 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 240690a_100000102301_100000211857 [0,2,0,0,0,0|1,0,0]=3 21935 B16R1.1701 CCCCNC(=O)C(C)(C)c1ccccc1 527a_100000102301_100000211857 [0,2,0,0,0,0|1,0,0]=3 21936 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 11a_100000102301_100000182030 [0,2,0,0,0,0|1,0,0]=3 21937 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 1626a_100000102301_100000182030 [0,2,0,0,0,0|1,0,0]=3 21938 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 240690a_100000102301_100000182030 [0,2,0,0,0,0|1,0,0]=3 21939 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccc1 527a_100000102301_100000182030 [0,2,0,0,0,0|1,0,0]=3 21940 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccn1 11a_100000102301_100000690563 [0,2,0,0,0,0|2,0,0]=4 21941 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccn1 1626a_100000102301_100000690563 [0,2,0,0,0,0|2,0,0]=4 21942 B16R1.1701 CCCCNC(=O)C(F)(F)c1ccccn1 527a_100000102301_100000690563 [0,2,0,0,0,0|2,0,0]=4 21943 B16R1.1701 CCCCNC(=O)[C@](C)(O)c1ccccc1 240690a_100000102301_100000753667 [0,2,0,0,0,0|1,0,0]=3 21944 B16R1.1701 CCCNNC(=O)C(C)(C)c1ccccc1 22a_100000740057_100000211857 [0,2,0,0,0,0|2,0,0]=4 21945 B16R1.1701 CCCNNC(=O)C(F)(F)c1ccccc1 22a_100000740057_100000182030 [0,2,0,0,0,0|2,0,0]=4 21946 B16R1.1701 CCCNNC(=O)[C@](C)(O)c1ccccc1 22a_100000740057_100000753667 [0,2,0,0,0,0|2,0,0]=4 21947 B16R1.1701 CCCOCC(=O)C(C)(C)c1ccccc1 1458a_100000745993_100000034625 [0,2,0,0,0,0|2,0,0]=4 21948 B16R1.1701 CCCOCC(=O)C(F)(F)c1ccccc1 1458a_100000745993_100000036403 [0,2,0,0,0,0|2,0,0]=4 21949 B16R1.1701 CCCSCC(=O)C(C)(C)c1ccccc1 1458a_100000217233_100000034625 [0,2,0,0,0,0|2,0,0]=4 21950 B16R1.1701 CCCSCC(=O)C(F)(F)c1ccccc1 1458a_100000217233_100000036403 [0,2,0,0,0,0|2,0,0]=4 21951 B16R1.1701 CCOCCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100011215890 [0,2,0,0,0,0|2,0,0]=4 21952 B16R1.1701 CCOCCC(=O)C(C)(C)c1ccccc1 1458a_100000749530_100000034625 [0,2,0,0,0,0|2,0,0]=4 21953 B16R1.1701 CCOCCC(=O)C(F)(F)c1ccccc1 1458a_100000749530_100000036403 [0,2,0,0,0,0|2,0,0]=4 21954 B16R1.1701 CCOCCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100011215890 [0,2,0,0,0,0|2,0,0]=4 21955 B16R1.1701 CCSCCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000757381 [0,2,0,0,0,0|2,0,0]=4 21956 B16R1.1701 CCSCCC(=O)C(C)(C)c1ccccc1 1458a_100000230768_100000034625 [0,2,0,0,0,0|2,0,0]=4 21957 B16R1.1701 CCSCCC(=O)C(F)(F)c1ccccc1 1458a_100000230768_100000036403 [0,2,0,0,0,0|2,0,0]=4 21958 B16R1.1701 CCSCCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000757381 [0,2,0,0,0,0|2,0,0]=4 21959 B16R1.1701 COCCCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000740836 [0,2,0,0,0,0|2,0,0]=4 21960 B16R1.1701 COCCCC(=O)C(C)(C)c1ccccc1 1458a_100000741012_100000034625 [0,2,0,0,0,0|2,0,0]=4 21961 B16R1.1701 COCCCC(=O)C(F)(F)c1ccccc1 1458a_100000741012_100000036403 [0,2,0,0,0,0|2,0,0]=4 21962 B16R1.1701 COCCCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000740836 [0,2,0,0,0,0|2,0,0]=4 21963 B16R1.1701 COCCNC(=O)C(C)(C)c1ccccc1 1626a_100000209980_100000211857 [0,2,0,0,0,0|2,0,0]=4 21964 B16R1.1701 COCCNC(=O)C(C)(C)c1ccccc1 240690a_100000209980_100000211857 [0,2,0,0,0,0|2,0,0]=4 21965 B16R1.1701 COCCNC(=O)C(C)(C)c1ccccc1 527a_100000209980_100000211857 [0,2,0,0,0,0|2,0,0]=4 21966 B16R1.1701 COCCNC(=O)C(F)(F)c1ccccc1 1626a_100000209980_100000182030 [0,2,0,0,0,0|2,0,0]=4 21967 B16R1.1701 COCCNC(=O)C(F)(F)c1ccccc1 240690a_100000209980_100000182030 [0,2,0,0,0,0|2,0,0]=4 21968 B16R1.1701 COCCNC(=O)C(F)(F)c1ccccc1 527a_100000209980_100000182030 [0,2,0,0,0,0|2,0,0]=4 21969 B16R1.1701 COCCNC(=O)[C@](C)(O)c1ccccc1 240690a_100000209980_100000753667 [0,2,0,0,0,0|2,0,0]=4 21970 B16R1.1701 CSCCCC(=O)C(C)(C)c1ccccc1 1458a_100000173376_100000034625 [0,2,0,0,0,0|2,0,0]=4 21971 B16R1.1701 CSCCCC(=O)C(F)(F)c1ccccc1 1458a_100000173376_100000036403 [0,2,0,0,0,0|2,0,0]=4 21972 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 11a_100020590264_100000211857 [0,2,0,0,0,0|2,0,0]=4 21973 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 1626a_100020590264_100000211857 [0,2,0,0,0,0|2,0,0]=4 21974 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 240690a_100020590264_100000211857 [0,2,0,0,0,0|2,0,0]=4 21975 B16R1.1701 CSCCNC(=O)C(C)(C)c1ccccc1 527a_100020590264_100000211857 [0,2,0,0,0,0|2,0,0]=4 21976 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 11a_100020590264_100000182030 [0,2,0,0,0,0|2,0,0]=4 21977 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 1626a_100020590264_100000182030 [0,2,0,0,0,0|2,0,0]=4 21978 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 240690a_100020590264_100000182030 [0,2,0,0,0,0|2,0,0]=4 21979 B16R1.1701 CSCCNC(=O)C(F)(F)c1ccccc1 527a_100020590264_100000182030 [0,2,0,0,0,0|2,0,0]=4 21980 B16R1.1701 CSCCNC(=O)[C@](C)(O)c1ccccc1 240690a_100020590264_100000753667 [0,2,0,0,0,0|2,0,0]=4 21981 B16R1.1701 C[C@](O)(C(=O)CCCCF)c1ccccc1 1458a_100000753667_100000729493 [0,2,0,0,0,0|2,0,0]=4 21982 B16R1.1701 C[C@](O)(C(=O)CCCCO)c1ccccc1 1458a_100000753667_100000210776 [0,2,0,0,0,0|2,0,0]=4 21983 B16R1.1701 C[C@](O)(C(=O)NCCCF)c1ccccc1 240690a_100015189416_100000753667 [0,2,0,0,0,0|2,0,0]=4 21984 B16R1.1701 C[C@](O)(C(=O)NCCCO)c1ccccc1 240690a_100000182051_100000753667 [0,2,0,0,0,0|2,0,0]=4 21985 B16R1.1701 O=C(CCCCO)C(F)(F)c1ccccc1 1458a_100000695505_100000036403 [0,2,0,0,0,0|2,0,0]=4 21986 B16R1.1701 O=C(NCCCF)C(F)(F)c1ccccc1 11a_100015189416_100000182030 [0,2,0,0,0,0|2,0,0]=4 21987 B16R1.1701 O=C(NCCCF)C(F)(F)c1ccccc1 1626a_100015189416_100000182030 [0,2,0,0,0,0|2,0,0]=4 21988 B16R1.1701 O=C(NCCCF)C(F)(F)c1ccccc1 240690a_100015189416_100000182030 [0,2,0,0,0,0|2,0,0]=4 21989 B16R1.1701 O=C(NCCCF)C(F)(F)c1ccccc1 527a_100015189416_100000182030 [0,2,0,0,0,0|2,0,0]=4 21990 B16R1.1701 O=C(NCCCO)C(F)(F)c1ccccc1 240690a_100000182051_100000182030 [0,2,0,0,0,0|2,0,0]=4 21991 B16R1.1701 O=C(NCCCO)C(F)(F)c1ccccc1 527a_100000182051_100000182030 [0,2,0,0,0,0|2,0,0]=4 21992 B16R1.1705 CCC(C(=O)CCCCF)c1ccccc1 1458a_100000211302_100000729493 [0,2,0,0,0,0|2,0,0]=4 21993 B16R1.1705 CCC(C(=O)CCCCO)c1ccccc1 1458a_100000211302_100000210776 [0,2,0,0,0,0|2,0,0]=4 21994 B16R1.1705 CCC(C(=O)CCCOC)c1ccccc1 1458a_100000211302_100000740836 [0,2,0,0,0,0|2,0,0]=4 21995 B16R1.1705 CCC(C(=O)NCCCF)c1ccccc1 11a_100015189416_100000211302 [0,2,0,0,0,0|2,0,0]=4 21996 B16R1.1705 CCC(C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000211302 [0,2,0,0,0,0|2,0,0]=4 21997 B16R1.1705 CCC(C(=O)NCCCF)c1ccccc1 240690a_100015189416_100000211302 [0,2,0,0,0,0|2,0,0]=4 21998 B16R1.1705 CCC(C(=O)NCCCF)c1ccccc1 527a_100015189416_100000211302 [0,2,0,0,0,0|2,0,0]=4 21999 B16R1.1705 CCC(C(=O)NCCCO)c1ccccc1 240690a_100000182051_100000211302 [0,2,0,0,0,0|2,0,0]=4 22000 B16R1.1705 CCC(C(=O)NCCCO)c1ccccc1 527a_100000182051_100000211302 [0,2,0,0,0,0|2,0,0]=4 22001 B16R1.1705 CCC(C(=O)NCCOC)c1ccccc1 1626a_100000209980_100000211302 [0,2,0,0,0,0|2,0,0]=4 22002 B16R1.1705 CCC(C(=O)NCCOC)c1ccccc1 240690a_100000209980_100000211302 [0,2,0,0,0,0|2,0,0]=4 22003 B16R1.1705 CCC(C(=O)NCCOC)c1ccccc1 527a_100000209980_100000211302 [0,2,0,0,0,0|2,0,0]=4 22004 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 11a_100020590264_100000211302 [0,2,0,0,0,0|2,0,0]=4 22005 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 1626a_100020590264_100000211302 [0,2,0,0,0,0|2,0,0]=4 22006 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 240690a_100020590264_100000211302 [0,2,0,0,0,0|2,0,0]=4 22007 B16R1.1705 CCC(C(=O)NCCSC)c1ccccc1 527a_100020590264_100000211302 [0,2,0,0,0,0|2,0,0]=4 22008 B16R1.1705 CCCCCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210326 [0,2,0,0,0,0|1,0,0]=3 22009 B16R1.1705 CCCCCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000210326 [0,2,0,0,0,0|1,0,0]=3 22010 B16R1.1705 CCCCCC(=O)N(CC)c1ccccc1 11a_100000210013_100000212188 [0,2,0,0,0,0|2,0,0]=4 22011 B16R1.1705 CCCCCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000212188 [0,2,0,0,0,0|2,0,0]=4 22012 B16R1.1705 CCCCCC(=O)N(CC)c1ccccc1 22a_100000210013_100000212188 [0,2,0,0,0,0|2,0,0]=4 22013 B16R1.1705 CCCCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000210326 [0,2,0,0,0,0|1,0,0]=3 22014 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 11a_100000102301_100000211302 [0,2,0,0,0,0|1,0,0]=3 22015 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 1626a_100000102301_100000211302 [0,2,0,0,0,0|1,0,0]=3 22016 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 240690a_100000102301_100000211302 [0,2,0,0,0,0|1,0,0]=3 22017 B16R1.1705 CCCCNC(=O)C(CC)c1ccccc1 527a_100000102301_100000211302 [0,2,0,0,0,0|1,0,0]=3 22018 B16R1.1705 CCCCNC(=O)C(CO)c1ccccc1 240690a_100000102301_100011218805 [0,2,0,0,0,0|1,0,0]=3 22019 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 11a_100000102301_100000698336 [0,2,0,0,0,0|1,0,0]=3 22020 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 1626a_100000102301_100000698336 [0,2,0,0,0,0|1,0,0]=3 22021 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 240690a_100000102301_100000698336 [0,2,0,0,0,0|1,0,0]=3 22022 B16R1.1705 CCCCNC(=O)[C@H](OC)c1ccccc1 527a_100000102301_100000698336 [0,2,0,0,0,0|1,0,0]=3 22023 B16R1.1705 CCCNNC(=O)C(CC)c1ccccc1 22a_100000740057_100000211302 [0,2,0,0,0,0|2,0,0]=4 22024 B16R1.1705 CCCNNC(=O)C(CO)c1ccccc1 22a_100000740057_100011218805 [0,2,0,0,0,0|2,0,0]=4 22025 B16R1.1705 CCCNNC(=O)[C@H](OC)c1ccccc1 22a_100000740057_100000698336 [0,2,0,0,0,0|2,0,0]=4 22026 B16R1.1705 CCOCCC(=O)C(CC)c1ccccc1 1458a_100000211302_100011215890 [0,2,0,0,0,0|2,0,0]=4 22027 B16R1.1705 CCOCCC(=O)C(CO)c1ccccc1 1458a_100011218805_100011215890 [0,2,0,0,0,0|2,0,0]=4 22028 B16R1.1705 CCOCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100011215890 [0,2,0,0,0,0|2,0,0]=4 22029 B16R1.1705 CCSCCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000757381 [0,2,0,0,0,0|2,0,0]=4 22030 B16R1.1705 CCSCCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000757381 [0,2,0,0,0,0|2,0,0]=4 22031 B16R1.1705 CCSCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000757381 [0,2,0,0,0,0|2,0,0]=4 22032 B16R1.1705 COCCCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000740836 [0,2,0,0,0,0|2,0,0]=4 22033 B16R1.1705 COCCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000740836 [0,2,0,0,0,0|2,0,0]=4 22034 B16R1.1705 COCCNC(=O)C(CO)c1ccccc1 240690a_100000209980_100011218805 [0,2,0,0,0,0|2,0,0]=4 22035 B16R1.1705 COCCNC(=O)[C@H](OC)c1ccccc1 1626a_100000209980_100000698336 [0,2,0,0,0,0|2,0,0]=4 22036 B16R1.1705 COCCNC(=O)[C@H](OC)c1ccccc1 240690a_100000209980_100000698336 [0,2,0,0,0,0|2,0,0]=4 22037 B16R1.1705 COCCNC(=O)[C@H](OC)c1ccccc1 527a_100000209980_100000698336 [0,2,0,0,0,0|2,0,0]=4 22038 B16R1.1705 CO[C@@H](C(=O)CCCCF)c1ccccc1 1458a_100000698336_100000729493 [0,2,0,0,0,0|2,0,0]=4 22039 B16R1.1705 CO[C@@H](C(=O)CCCCO)c1ccccc1 1458a_100000698336_100000210776 [0,2,0,0,0,0|2,0,0]=4 22040 B16R1.1705 CO[C@@H](C(=O)NCCCF)c1ccccc1 11a_100015189416_100000698336 [0,2,0,0,0,0|2,0,0]=4 22041 B16R1.1705 CO[C@@H](C(=O)NCCCF)c1ccccc1 1626a_100015189416_100000698336 [0,2,0,0,0,0|2,0,0]=4 22042 B16R1.1705 CO[C@@H](C(=O)NCCCF)c1ccccc1 240690a_100015189416_100000698336 [0,2,0,0,0,0|2,0,0]=4 22043 B16R1.1705 CO[C@@H](C(=O)NCCCF)c1ccccc1 527a_100015189416_100000698336 [0,2,0,0,0,0|2,0,0]=4 22044 B16R1.1705 CO[C@@H](C(=O)NCCCO)c1ccccc1 240690a_100000182051_100000698336 [0,2,0,0,0,0|2,0,0]=4 22045 B16R1.1705 CO[C@@H](C(=O)NCCCO)c1ccccc1 527a_100000182051_100000698336 [0,2,0,0,0,0|2,0,0]=4 22046 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 11a_100020590264_100000698336 [0,2,0,0,0,0|2,0,0]=4 22047 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 1626a_100020590264_100000698336 [0,2,0,0,0,0|2,0,0]=4 22048 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 240690a_100020590264_100000698336 [0,2,0,0,0,0|2,0,0]=4 22049 B16R1.1705 CO[C@@H](C(=O)NCCSC)c1ccccc1 527a_100020590264_100000698336 [0,2,0,0,0,0|2,0,0]=4 22050 B16R1.1705 CSCCNC(=O)C(CO)c1ccccc1 240690a_100020590264_100011218805 [0,2,0,0,0,0|2,0,0]=4 22051 B16R1.1705 O=C(CCCCF)C(CO)c1ccccc1 1458a_100011218805_100000729493 [0,2,0,0,0,0|2,0,0]=4 22052 B16R1.1705 O=C(CCCCO)C(CO)c1ccccc1 1458a_100011218805_100000210776 [0,2,0,0,0,0|2,0,0]=4 22053 B16R1.1705 O=C(NCCCF)C(CO)c1ccccc1 240690a_100015189416_100011218805 [0,2,0,0,0,0|2,0,0]=4 22054 B16R1.1705 O=C(NCCCO)C(CO)c1ccccc1 240690a_100000182051_100011218805 [0,2,0,0,0,0|2,0,0]=4 22055 B16R1.2925 C=C(C(=O)NCC(C)CC)c1ccccc1 1626a_100020588543_100000065200 [0,2,0,0,0,0|1,0,1]=4 22056 B16R1.2925 CC(CO)CNC(=O)C(F)c1ccccc1 240690a_100000744482_100000698975 [0,2,0,0,0,0|2,0,0]=4 22057 B16R1.2925 CC(CO)CNC(=O)C(F)c1ccccc1 527a_100000744482_100000698975 [0,2,0,0,0,0|2,0,0]=4 22058 B16R1.2925 CC(CO)CNC(=O)[C@@H](C)c1ccccc1 240690a_100000744482_100000751047 [0,2,0,0,0,0|2,0,0]=4 22059 B16R1.2925 CC(CO)CNC(=O)[C@@H](C)c1ccccc1 527a_100000744482_100000751047 [0,2,0,0,0,0|2,0,0]=4 22060 B16R1.2925 CC(CO)CNC(=O)[C@H](O)c1ccccc1 240690a_100000744482_100000684486 [0,2,0,0,0,0|2,0,0]=4 22061 B16R1.2925 CCC(C)CCC(=O)C(C)c1ccccc1 1458a_100000701222_100000230085 [0,2,0,0,0,0|1,0,0]=3 22062 B16R1.2925 CCC(C)CCC(=O)N(C)c1ccccc1 11a_100000210012_100000701222 [0,2,0,0,0,0|2,0,0]=4 22063 B16R1.2925 CCC(C)CCC(=O)N(C)c1ccccc1 1626a_100000210012_100000701222 [0,2,0,0,0,0|2,0,0]=4 22064 B16R1.2925 CCC(C)CCC(=O)N(C)c1ccccc1 22a_100000210012_100000701222 [0,2,0,0,0,0|2,0,0]=4 22065 B16R1.2925 CCC(C)CNC(=O)C(C)c1ccccn1 11a_100020588543_100000722050 [0,2,0,0,0,0|2,0,0]=4 22066 B16R1.2925 CCC(C)CNC(=O)C(C)c1ccccn1 1626a_100020588543_100000722050 [0,2,0,0,0,0|2,0,0]=4 22067 B16R1.2925 CCC(C)CNC(=O)C(C)c1ccccn1 240690a_100020588543_100000722050 [0,2,0,0,0,0|2,0,0]=4 22068 B16R1.2925 CCC(C)CNC(=O)C(C)c1ccccn1 527a_100020588543_100000722050 [0,2,0,0,0,0|2,0,0]=4 22069 B16R1.2925 CCC(C)CNC(=O)C(F)c1ccccc1 11a_100020588543_100000698975 [0,2,0,0,0,0|1,0,0]=3 22070 B16R1.2925 CCC(C)CNC(=O)C(F)c1ccccc1 1626a_100020588543_100000698975 [0,2,0,0,0,0|1,0,0]=3 22071 B16R1.2925 CCC(C)CNC(=O)C(F)c1ccccc1 240690a_100020588543_100000698975 [0,2,0,0,0,0|1,0,0]=3 22072 B16R1.2925 CCC(C)CNC(=O)C(F)c1ccccc1 527a_100020588543_100000698975 [0,2,0,0,0,0|1,0,0]=3 22073 B16R1.2925 CCC(C)CNC(=O)N(C)c1ccccc1 512a_100020588543_100000210012 [0,2,0,0,0,0|2,0,0]=4 22074 B16R1.2925 CCC(C)CNC(=O)[C@@H](C)c1ccccc1 11a_100020588543_100000751047 [0,2,0,0,0,0|1,0,0]=3 22075 B16R1.2925 CCC(C)CNC(=O)[C@@H](C)c1ccccc1 1626a_100020588543_100000751047 [0,2,0,0,0,0|1,0,0]=3 22076 B16R1.2925 CCC(C)CNC(=O)[C@@H](C)c1ccccc1 240690a_100020588543_100000751047 [0,2,0,0,0,0|1,0,0]=3 22077 B16R1.2925 CCC(C)CNC(=O)[C@@H](C)c1ccccc1 527a_100020588543_100000751047 [0,2,0,0,0,0|1,0,0]=3 22078 B16R1.2925 CCC(C)CNC(=O)[C@H](O)c1ccccc1 240690a_100020588543_100000684486 [0,2,0,0,0,0|1,0,0]=3 22079 B16R1.2925 CCC(C)CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100000748023 [0,2,0,0,0,0|1,0,1]=4 22080 B16R1.2925 CCC(C)NNC(=O)C(F)c1ccccc1 22a_100000718999_100000698975 [0,2,0,0,0,0|2,0,0]=4 22081 B16R1.2925 CCC(C)NNC(=O)[C@@H](C)c1ccccc1 22a_100000718999_100000751047 [0,2,0,0,0,0|2,0,0]=4 22082 B16R1.2925 CCC(C)NNC(=O)[C@H](O)c1ccccc1 22a_100000718999_100000684486 [0,2,0,0,0,0|2,0,0]=4 22083 B16R1.2925 CCC(O)CCC(=O)N(C)c1ccccc1 1626a_100000210012_203496584001 [0,2,0,0,0,0|2,0,0]=4 22084 B16R1.2925 CCC(O)CCC(=O)N(C)c1ccccc1 22a_100000210012_203496584001 [0,2,0,0,0,0|2,0,0]=4 22085 B16R1.2925 CCC(O)CNC(=O)C(C)c1ccccn1 11a_100011218483_100000722050 [0,2,0,0,0,0|2,0,0]=4 22086 B16R1.2925 CCC(O)CNC(=O)C(C)c1ccccn1 240690a_100011218483_100000722050 [0,2,0,0,0,0|2,0,0]=4 22087 B16R1.2925 CCC(O)CNC(=O)C(C)c1ccccn1 527a_100011218483_100000722050 [0,2,0,0,0,0|2,0,0]=4 22088 B16R1.2925 CCC(O)CNC(=O)C(F)c1ccccc1 11a_100011218483_100000698975 [0,2,0,0,0,0|1,0,0]=3 22089 B16R1.2925 CCC(O)CNC(=O)C(F)c1ccccc1 240690a_100011218483_100000698975 [0,2,0,0,0,0|1,0,0]=3 22090 B16R1.2925 CCC(O)CNC(=O)C(F)c1ccccc1 527a_100011218483_100000698975 [0,2,0,0,0,0|1,0,0]=3 22091 B16R1.2925 CCC(O)CNC(=O)N(C)c1ccccc1 512a_100011218483_100000210012 [0,2,0,0,0,0|2,0,0]=4 22092 B16R1.2925 CCC(O)CNC(=O)[C@@H](C)c1ccccc1 11a_100011218483_100000751047 [0,2,0,0,0,0|1,0,0]=3 22093 B16R1.2925 CCC(O)CNC(=O)[C@@H](C)c1ccccc1 240690a_100011218483_100000751047 [0,2,0,0,0,0|1,0,0]=3 22094 B16R1.2925 CCC(O)CNC(=O)[C@@H](C)c1ccccc1 527a_100011218483_100000751047 [0,2,0,0,0,0|1,0,0]=3 22095 B16R1.2925 CCC(O)CNC(=O)[C@H](O)c1ccccc1 240690a_100011218483_100000684486 [0,2,0,0,0,0|1,0,0]=3 22096 B16R1.2925 CCC(O)CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100011218378 [0,2,0,0,0,0|1,0,1]=4 22097 B16R1.2925 CCN(C)CCC(=O)C(C)c1ccccc1 1458a_100000755305_100000230085 [0,2,0,0,0,0|2,0,0]=4 22098 B16R1.2925 CCS(=O)CCC(=O)C(C)c1ccccc1 1458a_100011387550_100000230085 [0,2,0,0,0,0|2,0,0]=4 22099 B16R1.2925 CC[C@H](C)CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_100009816398 [0,2,0,0,0,0|1,0,1]=4 22100 B16R1.2925 CO[C@H](C)CNC(=O)C(F)c1ccccc1 11a_100020591295_100000698975 [0,2,0,0,0,0|2,0,0]=4 22101 B16R1.2925 CO[C@H](C)CNC(=O)C(F)c1ccccc1 1626a_100020591295_100000698975 [0,2,0,0,0,0|2,0,0]=4 22102 B16R1.2925 CO[C@H](C)CNC(=O)C(F)c1ccccc1 240690a_100020591295_100000698975 [0,2,0,0,0,0|2,0,0]=4 22103 B16R1.2925 CO[C@H](C)CNC(=O)C(F)c1ccccc1 527a_100020591295_100000698975 [0,2,0,0,0,0|2,0,0]=4 22104 B16R1.2925 CO[C@H](C)CNC(=O)[C@@H](C)c1ccccc1 11a_100020591295_100000751047 [0,2,0,0,0,0|2,0,0]=4 22105 B16R1.2925 CO[C@H](C)CNC(=O)[C@@H](C)c1ccccc1 1626a_100020591295_100000751047 [0,2,0,0,0,0|2,0,0]=4 22106 B16R1.2925 CO[C@H](C)CNC(=O)[C@@H](C)c1ccccc1 240690a_100020591295_100000751047 [0,2,0,0,0,0|2,0,0]=4 22107 B16R1.2925 CO[C@H](C)CNC(=O)[C@@H](C)c1ccccc1 527a_100020591295_100000751047 [0,2,0,0,0,0|2,0,0]=4 22108 B16R1.2925 CO[C@H](C)CNC(=O)[C@H](O)c1ccccc1 240690a_100020591295_100000684486 [0,2,0,0,0,0|2,0,0]=4 22109 B16R1.2925 C[C@H](C(=O)NC[C@@H](F)CO)c1ccccc1 240690a_100015665980_100000751047 [0,2,0,0,0,0|2,0,0]=4 22110 B16R1.2925 C[C@H](C(=O)NC[C@@H](F)CO)c1ccccc1 527a_100015665980_100000751047 [0,2,0,0,0,0|2,0,0]=4 22111 B16R1.2925 C[C@H](C(=O)NC[C@H](O)CO)c1ccccc1 240690a_100020644852_100000751047 [0,2,0,0,0,0|2,0,0]=4 22112 B16R1.2925 C[C@H](C(=O)NC[C@H](O)CO)c1ccccc1 527a_100020644852_100000751047 [0,2,0,0,0,0|2,0,0]=4 22113 B16R1.2925 O=C(NC[C@@H](F)CO)C(F)c1ccccc1 240690a_100015665980_100000698975 [0,2,0,0,0,0|2,0,0]=4 22114 B16R1.2925 O=C(NC[C@@H](F)CO)C(F)c1ccccc1 527a_100015665980_100000698975 [0,2,0,0,0,0|2,0,0]=4 22115 B16R1.2925 O=C(NC[C@@H](F)CO)[C@H](O)c1ccccc1 240690a_100015665980_100000684486 [0,2,0,0,0,0|2,0,0]=4 22116 B16R1.2925 O=C(NC[C@H](O)CO)C(F)c1ccccc1 240690a_100020644852_100000698975 [0,2,0,0,0,0|2,0,0]=4 22117 B16R1.2925 O=C(NC[C@H](O)CO)C(F)c1ccccc1 527a_100020644852_100000698975 [0,2,0,0,0,0|2,0,0]=4 22118 B16R1.2925 O=C(NC[C@H](O)CO)[C@H](O)c1ccccc1 240690a_100020644852_100000684486 [0,2,0,0,0,0|2,0,0]=4 22119 B16R1.5684 CC(C(=O)CCCCF)c1ccccc1Br 1458a_100012359601_100000729493 [0,2,0,0,0,0|2,0,0]=4 22120 B16R1.5684 CC(C(=O)CCCCF)c1ccccc1Cl 1458a_100011667492_100000729493 [0,2,0,0,0,0|2,0,0]=4 22121 B16R1.5684 CC(C(=O)CCCCO)c1ccccc1Br 1458a_100012359601_100000210776 [0,2,0,0,0,0|2,0,0]=4 22122 B16R1.5684 CC(C(=O)CCCCO)c1ccccc1Cl 1458a_100000695505_100000181259 [0,2,0,0,0,0|2,0,0]=4 22123 B16R1.5684 CC(C(=O)CCCCO)c1ccccc1Cl 1458a_100011667492_100000210776 [0,2,0,0,0,0|2,0,0]=4 22124 B16R1.5684 CC(C(=O)CCCCO)c1ccccc1F 1458a_100000695505_200000741388 [0,2,0,0,0,0|2,0,0]=4 22125 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Br 11a_100015189416_100012359601 [0,2,0,0,0,0|2,0,0]=4 22126 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Br 1626a_100015189416_100012359601 [0,2,0,0,0,0|2,0,0]=4 22127 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Br 240690a_100015189416_100012359601 [0,2,0,0,0,0|2,0,0]=4 22128 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Br 527a_100015189416_100012359601 [0,2,0,0,0,0|2,0,0]=4 22129 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Cl 11a_100015189416_100011667492 [0,2,0,0,0,0|2,0,0]=4 22130 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Cl 1626a_100015189416_100011667492 [0,2,0,0,0,0|2,0,0]=4 22131 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Cl 240690a_100015189416_100011667492 [0,2,0,0,0,0|2,0,0]=4 22132 B16R1.5684 CC(C(=O)NCCCF)c1ccccc1Cl 527a_100015189416_100011667492 [0,2,0,0,0,0|2,0,0]=4 22133 B16R1.5684 CC(C(=O)NCCCO)c1ccccc1Br 240690a_100000182051_100012359601 [0,2,0,0,0,0|2,0,0]=4 22134 B16R1.5684 CC(C(=O)NCCCO)c1ccccc1Br 527a_100000182051_100012359601 [0,2,0,0,0,0|2,0,0]=4 22135 B16R1.5684 CC(C(=O)NCCCO)c1ccccc1Cl 240690a_100000182051_100011667492 [0,2,0,0,0,0|2,0,0]=4 22136 B16R1.5684 CC(C(=O)NCCCO)c1ccccc1Cl 527a_100000182051_100011667492 [0,2,0,0,0,0|2,0,0]=4 22137 B16R1.5684 CCCC#CC(=O)C(C)c1ccccc1Cl 1458a_200011218047_100000181259 [0,2,0,0,0,0|1,0,1]=4 22138 B16R1.5684 CCCC#CC(=O)C(C)c1ccccc1F 1458a_200011218047_200000741388 [0,2,0,0,0,0|1,0,1]=4 22139 B16R1.5684 CCCC=CC(=O)C(C)c1ccccc1Cl 1458a_100000212230_100000181259 [0,2,0,0,0,0|1,0,1]=4 22140 B16R1.5684 CCCC=CC(=O)C(C)c1ccccc1F 1458a_100000212230_200000741388 [0,2,0,0,0,0|1,0,1]=4 22141 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210326 [0,2,0,0,0,0|1,0,0]=3 22142 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Cl 1458a_100000212188_100000181259 [0,2,0,0,0,0|1,0,0]=3 22143 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210326 [0,2,0,0,0,0|1,0,0]=3 22144 B16R1.5684 CCCCCC(=O)C(C)c1ccccc1F 1458a_100000212188_200000741388 [0,2,0,0,0,0|1,0,0]=3 22145 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210326 [0,2,0,0,0,0|1,0,0]=3 22146 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210326 [0,2,0,0,0,0|1,0,0]=3 22147 B16R1.5684 CCCCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210326 [0,2,0,0,0,0|1,0,0]=3 22148 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000212188 [0,2,0,0,0,0|2,0,0]=4 22149 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000212188 [0,2,0,0,0,0|2,0,0]=4 22150 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000212188 [0,2,0,0,0,0|2,0,0]=4 22151 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000212188 [0,2,0,0,0,0|2,0,0]=4 22152 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000212188 [0,2,0,0,0,0|2,0,0]=4 22153 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000212188 [0,2,0,0,0,0|2,0,0]=4 22154 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000212188 [0,2,0,0,0,0|2,0,0]=4 22155 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000212188 [0,2,0,0,0,0|2,0,0]=4 22156 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000212188 [0,2,0,0,0,0|2,0,0]=4 22157 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000212188 [0,2,0,0,0,0|2,0,0]=4 22158 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000212188 [0,2,0,0,0,0|2,0,0]=4 22159 B16R1.5684 CCCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000212188 [0,2,0,0,0,0|2,0,0]=4 22160 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 11a_100000102301_100012359601 [0,2,0,0,0,0|1,0,0]=3 22161 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 1626a_100000102301_100012359601 [0,2,0,0,0,0|1,0,0]=3 22162 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 240690a_100000102301_100012359601 [0,2,0,0,0,0|1,0,0]=3 22163 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Br 527a_100000102301_100012359601 [0,2,0,0,0,0|1,0,0]=3 22164 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 11a_100000102301_100011667492 [0,2,0,0,0,0|1,0,0]=3 22165 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 1626a_100000102301_100011667492 [0,2,0,0,0,0|1,0,0]=3 22166 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 240690a_100000102301_100011667492 [0,2,0,0,0,0|1,0,0]=3 22167 B16R1.5684 CCCCNC(=O)C(C)c1ccccc1Cl 527a_100000102301_100011667492 [0,2,0,0,0,0|1,0,0]=3 22168 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1Br 240690a_100000102301_200011356456 [0,2,0,0,0,0|1,0,0]=3 22169 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1Cl 240690a_100000102301_100011217820 [0,2,0,0,0,0|1,0,0]=3 22170 B16R1.5684 CCCCNC(=O)C(O)c1ccccc1F 240690a_100000102301_100011219519 [0,2,0,0,0,0|1,0,0]=3 22171 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1Br 512a_100000102301_100020606079 [0,2,0,0,0,0|2,0,0]=4 22172 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1C 512a_100000102301_100000219699 [0,2,0,0,0,0|2,0,0]=4 22173 B16R1.5684 CCCCNC(=O)N(C)c1ccccc1Cl 512a_100000102301_100000219374 [0,2,0,0,0,0|2,0,0]=4 22174 B16R1.5684 CCCNNC(=O)C(C)c1ccccc1Br 22a_100000740057_100012359601 [0,2,0,0,0,0|2,0,0]=4 22175 B16R1.5684 CCCNNC(=O)C(C)c1ccccc1Cl 22a_100000740057_100011667492 [0,2,0,0,0,0|2,0,0]=4 22176 B16R1.5684 CCCNNC(=O)C(O)c1ccccc1Br 22a_100000740057_200011356456 [0,2,0,0,0,0|2,0,0]=4 22177 B16R1.5684 CCCNNC(=O)C(O)c1ccccc1Cl 22a_100000740057_100011217820 [0,2,0,0,0,0|2,0,0]=4 22178 B16R1.5684 CCCNNC(=O)C(O)c1ccccc1F 22a_100000740057_100011219519 [0,2,0,0,0,0|2,0,0]=4 22179 B16R1.5684 CCCOCC(=O)C(C)c1ccccc1Cl 1458a_100000745993_100000181259 [0,2,0,0,0,0|2,0,0]=4 22180 B16R1.5684 CCCOCC(=O)C(C)c1ccccc1F 1458a_100000745993_200000741388 [0,2,0,0,0,0|2,0,0]=4 22181 B16R1.5684 CCCSCC(=O)C(C)c1ccccc1Cl 1458a_100000217233_100000181259 [0,2,0,0,0,0|2,0,0]=4 22182 B16R1.5684 CCCSCC(=O)C(C)c1ccccc1F 1458a_100000217233_200000741388 [0,2,0,0,0,0|2,0,0]=4 22183 B16R1.5684 CCOCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100011215890 [0,2,0,0,0,0|2,0,0]=4 22184 B16R1.5684 CCOCCC(=O)C(C)c1ccccc1Cl 1458a_100000749530_100000181259 [0,2,0,0,0,0|2,0,0]=4 22185 B16R1.5684 CCOCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100011215890 [0,2,0,0,0,0|2,0,0]=4 22186 B16R1.5684 CCOCCC(=O)C(C)c1ccccc1F 1458a_100000749530_200000741388 [0,2,0,0,0,0|2,0,0]=4 22187 B16R1.5684 CCOCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100011215890 [0,2,0,0,0,0|2,0,0]=4 22188 B16R1.5684 CCOCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100011215890 [0,2,0,0,0,0|2,0,0]=4 22189 B16R1.5684 CCOCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100011215890 [0,2,0,0,0,0|2,0,0]=4 22190 B16R1.5684 CCSCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000757381 [0,2,0,0,0,0|2,0,0]=4 22191 B16R1.5684 CCSCCC(=O)C(C)c1ccccc1Cl 1458a_100000230768_100000181259 [0,2,0,0,0,0|2,0,0]=4 22192 B16R1.5684 CCSCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000757381 [0,2,0,0,0,0|2,0,0]=4 22193 B16R1.5684 CCSCCC(=O)C(C)c1ccccc1F 1458a_100000230768_200000741388 [0,2,0,0,0,0|2,0,0]=4 22194 B16R1.5684 CCSCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000757381 [0,2,0,0,0,0|2,0,0]=4 22195 B16R1.5684 CCSCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000757381 [0,2,0,0,0,0|2,0,0]=4 22196 B16R1.5684 CCSCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000757381 [0,2,0,0,0,0|2,0,0]=4 22197 B16R1.5684 COCCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000740836 [0,2,0,0,0,0|2,0,0]=4 22198 B16R1.5684 COCCCC(=O)C(C)c1ccccc1Cl 1458a_100000741012_100000181259 [0,2,0,0,0,0|2,0,0]=4 22199 B16R1.5684 COCCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000740836 [0,2,0,0,0,0|2,0,0]=4 22200 B16R1.5684 COCCCC(=O)C(C)c1ccccc1F 1458a_100000741012_200000741388 [0,2,0,0,0,0|2,0,0]=4 22201 B16R1.5684 COCCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000740836 [0,2,0,0,0,0|2,0,0]=4 22202 B16R1.5684 COCCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000740836 [0,2,0,0,0,0|2,0,0]=4 22203 B16R1.5684 COCCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000740836 [0,2,0,0,0,0|2,0,0]=4 22204 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Br 1626a_100000209980_100012359601 [0,2,0,0,0,0|2,0,0]=4 22205 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Br 240690a_100000209980_100012359601 [0,2,0,0,0,0|2,0,0]=4 22206 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Br 527a_100000209980_100012359601 [0,2,0,0,0,0|2,0,0]=4 22207 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Cl 1626a_100000209980_100011667492 [0,2,0,0,0,0|2,0,0]=4 22208 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Cl 240690a_100000209980_100011667492 [0,2,0,0,0,0|2,0,0]=4 22209 B16R1.5684 COCCNC(=O)C(C)c1ccccc1Cl 527a_100000209980_100011667492 [0,2,0,0,0,0|2,0,0]=4 22210 B16R1.5684 COCCNC(=O)C(O)c1ccccc1Br 240690a_100000209980_200011356456 [0,2,0,0,0,0|2,0,0]=4 22211 B16R1.5684 COCCNC(=O)C(O)c1ccccc1Cl 240690a_100000209980_100011217820 [0,2,0,0,0,0|2,0,0]=4 22212 B16R1.5684 COCCNC(=O)C(O)c1ccccc1F 240690a_100000209980_100011219519 [0,2,0,0,0,0|2,0,0]=4 22213 B16R1.5684 CSCCCC(=O)C(C)c1ccccc1Cl 1458a_100000173376_100000181259 [0,2,0,0,0,0|2,0,0]=4 22214 B16R1.5684 CSCCCC(=O)C(C)c1ccccc1F 1458a_100000173376_200000741388 [0,2,0,0,0,0|2,0,0]=4 22215 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Br 11a_100020590264_100012359601 [0,2,0,0,0,0|2,0,0]=4 22216 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Br 1626a_100020590264_100012359601 [0,2,0,0,0,0|2,0,0]=4 22217 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Br 240690a_100020590264_100012359601 [0,2,0,0,0,0|2,0,0]=4 22218 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Br 527a_100020590264_100012359601 [0,2,0,0,0,0|2,0,0]=4 22219 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Cl 11a_100020590264_100011667492 [0,2,0,0,0,0|2,0,0]=4 22220 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Cl 1626a_100020590264_100011667492 [0,2,0,0,0,0|2,0,0]=4 22221 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Cl 240690a_100020590264_100011667492 [0,2,0,0,0,0|2,0,0]=4 22222 B16R1.5684 CSCCNC(=O)C(C)c1ccccc1Cl 527a_100020590264_100011667492 [0,2,0,0,0,0|2,0,0]=4 22223 B16R1.5684 CSCCNC(=O)C(O)c1ccccc1Br 240690a_100020590264_200011356456 [0,2,0,0,0,0|2,0,0]=4 22224 B16R1.5684 CSCCNC(=O)C(O)c1ccccc1Cl 240690a_100020590264_100011217820 [0,2,0,0,0,0|2,0,0]=4 22225 B16R1.5684 CSCCNC(=O)C(O)c1ccccc1F 240690a_100020590264_100011219519 [0,2,0,0,0,0|2,0,0]=4 22226 B16R1.5684 O=C(CCCCF)C(O)c1ccccc1Br 1458a_200011356456_100000729493 [0,2,0,0,0,0|2,0,0]=4 22227 B16R1.5684 O=C(CCCCF)C(O)c1ccccc1Cl 1458a_100011217820_100000729493 [0,2,0,0,0,0|2,0,0]=4 22228 B16R1.5684 O=C(CCCCF)C(O)c1ccccc1F 1458a_100011219519_100000729493 [0,2,0,0,0,0|2,0,0]=4 22229 B16R1.5684 O=C(CCCCO)C(O)c1ccccc1Br 1458a_200011356456_100000210776 [0,2,0,0,0,0|2,0,0]=4 22230 B16R1.5684 O=C(CCCCO)C(O)c1ccccc1Cl 1458a_100011217820_100000210776 [0,2,0,0,0,0|2,0,0]=4 22231 B16R1.5684 O=C(CCCCO)C(O)c1ccccc1F 1458a_100011219519_100000210776 [0,2,0,0,0,0|2,0,0]=4 22232 B16R1.5684 O=C(NCCCF)C(O)c1ccccc1Br 240690a_100015189416_200011356456 [0,2,0,0,0,0|2,0,0]=4 22233 B16R1.5684 O=C(NCCCF)C(O)c1ccccc1Cl 240690a_100015189416_100011217820 [0,2,0,0,0,0|2,0,0]=4 22234 B16R1.5684 O=C(NCCCF)C(O)c1ccccc1F 240690a_100015189416_100011219519 [0,2,0,0,0,0|2,0,0]=4 22235 B16R1.5684 O=C(NCCCO)C(O)c1ccccc1Br 240690a_100000182051_200011356456 [0,2,0,0,0,0|2,0,0]=4 22236 B16R1.5684 O=C(NCCCO)C(O)c1ccccc1Cl 240690a_100000182051_100011217820 [0,2,0,0,0,0|2,0,0]=4 22237 B16R1.5684 O=C(NCCCO)C(O)c1ccccc1F 240690a_100000182051_100011219519 [0,2,0,0,0,0|2,0,0]=4 22238 B16R1.658 CCC/C=C(\C)/C(=O)Cc1ccc(cc1)Br 1458a_200020648666_100000189115 [0,2,0,0,0,0|1,0,1]=4 22239 B16R1.658 CCC/C=C(\C)/C(=O)Cc1ccc(cc1)C 1458a_200020648666_100000210814 [0,2,0,0,0,0|1,0,1]=4 22240 B16R1.658 CCC/C=C(\C)/C(=O)Cc1ccc(cc1)Cl 1458a_200020648666_100000694040 [0,2,0,0,0,0|1,0,1]=4 22241 B16R1.658 CCC/C=C(\C)/C(=O)Cc1ccc(cc1)F 1458a_200020648666_100000198546 [0,2,0,0,0,0|1,0,1]=4 22242 B16R1.658 CCC/C=C(\C)/C(=O)Cc1ccc(cc1)I 1458a_200020648666_100000189116 [0,2,0,0,0,0|1,0,1]=4 22243 B16R1.658 CCCCC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_100000210211 [0,2,0,0,0,0|2,0,0]=4 22244 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200011215066 [0,2,0,0,0,0|1,0,0]=3 22245 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)Br 1458a_100000725509_100000189115 [0,2,0,0,0,0|1,0,0]=3 22246 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)C 1458a_100000212244_200011215066 [0,2,0,0,0,0|1,0,0]=3 22247 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)C 1458a_100000725509_100000210814 [0,2,0,0,0,0|1,0,0]=3 22248 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200011215066 [0,2,0,0,0,0|1,0,0]=3 22249 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000725509_100000694040 [0,2,0,0,0,0|1,0,0]=3 22250 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)F 1458a_100000210951_200011215066 [0,2,0,0,0,0|1,0,0]=3 22251 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)F 1458a_100000725509_100000198546 [0,2,0,0,0,0|1,0,0]=3 22252 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)I 1458a_100000688869_200011215066 [0,2,0,0,0,0|1,0,0]=3 22253 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)I 1458a_100000725509_100000189116 [0,2,0,0,0,0|1,0,0]=3 22254 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_200011215066 [0,2,0,0,0,0|1,0,0]=3 22255 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)Br 1458a_100000725509_100000702658 [0,2,0,0,0,0|2,0,0]=4 22256 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200011215066 [0,2,0,0,0,0|2,0,0]=4 22257 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)C 1458a_100000725509_100000691093 [0,2,0,0,0,0|2,0,0]=4 22258 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)C 1458a_100025705728_200011215066 [0,2,0,0,0,0|2,0,0]=4 22259 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)Cl 1458a_100000725509_100012066911 [0,2,0,0,0,0|2,0,0]=4 22260 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200011215066 [0,2,0,0,0,0|2,0,0]=4 22261 B16R1.658 CCCCC(C)C(=O)Cc1ccc(cn1)F 1458a_100000725509_100000703193 [0,2,0,0,0,0|2,0,0]=4 22262 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)Br 1458a_100000725509_100009831999 [0,2,0,0,0,0|2,0,0]=4 22263 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200011215066 [0,2,0,0,0,0|2,0,0]=4 22264 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)C 1458a_100000725509_100016987292 [0,2,0,0,0,0|2,0,0]=4 22265 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)C 1458a_100000740413_200011215066 [0,2,0,0,0,0|2,0,0]=4 22266 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200011215066 [0,2,0,0,0,0|2,0,0]=4 22267 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)Cl 1458a_100000725509_100000735431 [0,2,0,0,0,0|2,0,0]=4 22268 B16R1.658 CCCCC(C)C(=O)Cc1ccc(nc1)F 1458a_100000725509_100009820150 [0,2,0,0,0,0|2,0,0]=4 22269 B16R1.658 CCCCC(C)C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200011215066 [0,2,0,0,0,0|2,0,0]=4 22270 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000725509 [0,2,0,0,0,0|2,0,0]=4 22271 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000725509 [0,2,0,0,0,0|2,0,0]=4 22272 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000725509 [0,2,0,0,0,0|2,0,0]=4 22273 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000725509 [0,2,0,0,0,0|2,0,0]=4 22274 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000725509 [0,2,0,0,0,0|2,0,0]=4 22275 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000725509 [0,2,0,0,0,0|2,0,0]=4 22276 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000725509 [0,2,0,0,0,0|2,0,0]=4 22277 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)C 527a_100000124888_100000725509 [0,2,0,0,0,0|2,0,0]=4 22278 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000725509 [0,2,0,0,0,0|2,0,0]=4 22279 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000725509 [0,2,0,0,0,0|2,0,0]=4 22280 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000725509 [0,2,0,0,0,0|2,0,0]=4 22281 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000725509 [0,2,0,0,0,0|2,0,0]=4 22282 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000725509 [0,2,0,0,0,0|2,0,0]=4 22283 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000725509 [0,2,0,0,0,0|2,0,0]=4 22284 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000725509 [0,2,0,0,0,0|2,0,0]=4 22285 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000725509 [0,2,0,0,0,0|2,0,0]=4 22286 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000725509 [0,2,0,0,0,0|2,0,0]=4 22287 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000725509 [0,2,0,0,0,0|2,0,0]=4 22288 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000725509 [0,2,0,0,0,0|2,0,0]=4 22289 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000725509 [0,2,0,0,0,0|2,0,0]=4 22290 B16R1.658 CCCCC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000725509 [0,2,0,0,0,0|2,0,0]=4 22291 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cc1)Br 1458a_100000720857_100000189115 [0,2,0,0,0,0|1,0,0]=3 22292 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cc1)C 1458a_100000720857_100000210814 [0,2,0,0,0,0|1,0,0]=3 22293 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cc1)Cl 1458a_100000720857_100000694040 [0,2,0,0,0,0|1,0,0]=3 22294 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cc1)F 1458a_100000720857_100000198546 [0,2,0,0,0,0|1,0,0]=3 22295 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cc1)I 1458a_100000720857_100000189116 [0,2,0,0,0,0|1,0,0]=3 22296 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cn1)Br 1458a_100000720857_100000702658 [0,2,0,0,0,0|2,0,0]=4 22297 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cn1)C 1458a_100000720857_100000691093 [0,2,0,0,0,0|2,0,0]=4 22298 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cn1)Cl 1458a_100000720857_100012066911 [0,2,0,0,0,0|2,0,0]=4 22299 B16R1.658 CCCCC(O)C(=O)Cc1ccc(cn1)F 1458a_100000720857_100000703193 [0,2,0,0,0,0|2,0,0]=4 22300 B16R1.658 CCCCC(O)C(=O)Cc1ccc(nc1)Br 1458a_100000720857_100009831999 [0,2,0,0,0,0|2,0,0]=4 22301 B16R1.658 CCCCC(O)C(=O)Cc1ccc(nc1)C 1458a_100000720857_100016987292 [0,2,0,0,0,0|2,0,0]=4 22302 B16R1.658 CCCCC(O)C(=O)Cc1ccc(nc1)Cl 1458a_100000720857_100000735431 [0,2,0,0,0,0|2,0,0]=4 22303 B16R1.658 CCCCC(O)C(=O)Cc1ccc(nc1)F 1458a_100000720857_100009820150 [0,2,0,0,0,0|2,0,0]=4 22304 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000720857 [0,2,0,0,0,0|2,0,0]=4 22305 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000720857 [0,2,0,0,0,0|2,0,0]=4 22306 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000720857 [0,2,0,0,0,0|2,0,0]=4 22307 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)C 527a_100000124888_100000720857 [0,2,0,0,0,0|2,0,0]=4 22308 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000720857 [0,2,0,0,0,0|2,0,0]=4 22309 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000720857 [0,2,0,0,0,0|2,0,0]=4 22310 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000720857 [0,2,0,0,0,0|2,0,0]=4 22311 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000720857 [0,2,0,0,0,0|2,0,0]=4 22312 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000720857 [0,2,0,0,0,0|2,0,0]=4 22313 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000720857 [0,2,0,0,0,0|2,0,0]=4 22314 B16R1.658 CCCCC(O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000720857 [0,2,0,0,0,0|2,0,0]=4 22315 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Br 11a_100000207549_100000198978 [0,2,0,0,0,0|1,0,0]=3 22316 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Br 240690a_100000207549_100000198978 [0,2,0,0,0,0|1,0,0]=3 22317 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Br 527a_100000207549_100000198978 [0,2,0,0,0,0|1,0,0]=3 22318 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)C 11a_100000207549_100000212244 [0,2,0,0,0,0|1,0,0]=3 22319 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)C 240690a_100000207549_100000212244 [0,2,0,0,0,0|1,0,0]=3 22320 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)C 527a_100000207549_100000212244 [0,2,0,0,0,0|1,0,0]=3 22321 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000207549_100000211027 [0,2,0,0,0,0|1,0,0]=3 22322 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100000207549_100000211027 [0,2,0,0,0,0|1,0,0]=3 22323 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000207549_100000211027 [0,2,0,0,0,0|1,0,0]=3 22324 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)F 11a_100000207549_100000210951 [0,2,0,0,0,0|1,0,0]=3 22325 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)F 1626a_100000207549_100000210951 [0,2,0,0,0,0|1,0,0]=3 22326 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)F 240690a_100000207549_100000210951 [0,2,0,0,0,0|1,0,0]=3 22327 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)F 527a_100000207549_100000210951 [0,2,0,0,0,0|1,0,0]=3 22328 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)I 11a_100000207549_100000688869 [0,2,0,0,0,0|1,0,0]=3 22329 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)I 1626a_100000207549_100000688869 [0,2,0,0,0,0|1,0,0]=3 22330 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)I 240690a_100000207549_100000688869 [0,2,0,0,0,0|1,0,0]=3 22331 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)I 527a_100000207549_100000688869 [0,2,0,0,0,0|1,0,0]=3 22332 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)O 1626a_100000207549_100000198540 [0,2,0,0,0,0|1,0,0]=3 22333 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)O 240690a_100000207549_100000198540 [0,2,0,0,0,0|1,0,0]=3 22334 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cc1)O 527a_100000207549_100000198540 [0,2,0,0,0,0|1,0,0]=3 22335 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Br 11a_100000207549_100020629044 [0,2,0,0,0,0|2,0,0]=4 22336 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Br 240690a_100000207549_100020629044 [0,2,0,0,0,0|2,0,0]=4 22337 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)C 11a_100000207549_100025705728 [0,2,0,0,0,0|2,0,0]=4 22338 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)C 1626a_100000207549_100025705728 [0,2,0,0,0,0|2,0,0]=4 22339 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)C 240690a_100000207549_100025705728 [0,2,0,0,0,0|2,0,0]=4 22340 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Cl 11a_100000207549_100000728320 [0,2,0,0,0,0|2,0,0]=4 22341 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Cl 1626a_100000207549_100000728320 [0,2,0,0,0,0|2,0,0]=4 22342 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Cl 240690a_100000207549_100000728320 [0,2,0,0,0,0|2,0,0]=4 22343 B16R1.658 CCCCN(C)C(=O)Cc1ccc(cn1)Cl 527a_100000207549_100000728320 [0,2,0,0,0,0|2,0,0]=4 22344 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Br 11a_100000207549_100010067268 [0,2,0,0,0,0|2,0,0]=4 22345 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Br 240690a_100000207549_100010067268 [0,2,0,0,0,0|2,0,0]=4 22346 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Br 527a_100000207549_100010067268 [0,2,0,0,0,0|2,0,0]=4 22347 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)C 11a_100000207549_100000740413 [0,2,0,0,0,0|2,0,0]=4 22348 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)C 1626a_100000207549_100000740413 [0,2,0,0,0,0|2,0,0]=4 22349 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)C 240690a_100000207549_100000740413 [0,2,0,0,0,0|2,0,0]=4 22350 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)C 527a_100000207549_100000740413 [0,2,0,0,0,0|2,0,0]=4 22351 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Cl 11a_100000207549_100000061944 [0,2,0,0,0,0|2,0,0]=4 22352 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Cl 1626a_100000207549_100000061944 [0,2,0,0,0,0|2,0,0]=4 22353 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Cl 240690a_100000207549_100000061944 [0,2,0,0,0,0|2,0,0]=4 22354 B16R1.658 CCCCN(C)C(=O)Cc1ccc(nc1)Cl 527a_100000207549_100000061944 [0,2,0,0,0,0|2,0,0]=4 22355 B16R1.658 CCCCN(C)C(=O)Cn1ccc(=O)cc1 11a_100000207549_200000238563 [0,2,0,0,0,0|2,0,0]=4 22356 B16R1.658 CCCCN(C)C(=O)Cn1ccc(=O)cc1 1626a_100000207549_200000238563 [0,2,0,0,0,0|2,0,0]=4 22357 B16R1.658 CCCCN(C)C(=O)Cn1ccc(=O)cc1 240690a_100000207549_200000238563 [0,2,0,0,0,0|2,0,0]=4 22358 B16R1.658 CCCCN(C)C(=O)Cn1ccc(=O)cc1 527a_100000207549_200000238563 [0,2,0,0,0,0|2,0,0]=4 22359 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000207549 [0,2,0,0,0,0|2,0,0]=4 22360 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)C 2430a_100000124888_100000207549 [0,2,0,0,0,0|2,0,0]=4 22361 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000207549 [0,2,0,0,0,0|2,0,0]=4 22362 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)F 2430a_100000185862_100000207549 [0,2,0,0,0,0|2,0,0]=4 22363 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)I 2430a_100000185761_100000207549 [0,2,0,0,0,0|2,0,0]=4 22364 B16R1.658 CCCCN(C)C(=O)Nc1ccc(cc1)O 2430a_100000185829_100000207549 [0,2,0,0,0,0|2,0,0]=4 22365 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)Br 1458a_200011297150_100000189115 [0,2,0,0,0,0|2,0,0]=4 22366 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)C 1458a_200011297150_100000210814 [0,2,0,0,0,0|2,0,0]=4 22367 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)Cl 1458a_200011297150_100000694040 [0,2,0,0,0,0|2,0,0]=4 22368 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)F 1458a_200011297150_100000198546 [0,2,0,0,0,0|2,0,0]=4 22369 B16R1.658 CCCNC(=O)C(=O)Cc1ccc(cc1)I 1458a_200011297150_100000189116 [0,2,0,0,0,0|2,0,0]=4 22370 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)Br 240690a_100000213112_100000198978 [0,2,0,0,0,0|2,0,0]=4 22371 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)Br 527a_100000213112_100000198978 [0,2,0,0,0,0|2,0,0]=4 22372 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)Cl 240690a_100000213112_100000211027 [0,2,0,0,0,0|2,0,0]=4 22373 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)Cl 527a_100000213112_100000211027 [0,2,0,0,0,0|2,0,0]=4 22374 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)F 240690a_100000213112_100000210951 [0,2,0,0,0,0|2,0,0]=4 22375 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)F 527a_100000213112_100000210951 [0,2,0,0,0,0|2,0,0]=4 22376 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)I 240690a_100000213112_100000688869 [0,2,0,0,0,0|2,0,0]=4 22377 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)I 527a_100000213112_100000688869 [0,2,0,0,0,0|2,0,0]=4 22378 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)O 240690a_100000213112_100000198540 [0,2,0,0,0,0|2,0,0]=4 22379 B16R1.658 CN(CCCO)C(=O)Cc1ccc(cc1)O 527a_100000213112_100000198540 [0,2,0,0,0,0|2,0,0]=4 22380 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Br 11a_100000743101_100000198978 [0,2,0,0,0,0|2,0,0]=4 22381 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Br 240690a_100000743101_100000198978 [0,2,0,0,0,0|2,0,0]=4 22382 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Br 527a_100000743101_100000198978 [0,2,0,0,0,0|2,0,0]=4 22383 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)C 11a_100000743101_100000212244 [0,2,0,0,0,0|2,0,0]=4 22384 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)C 240690a_100000743101_100000212244 [0,2,0,0,0,0|2,0,0]=4 22385 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)C 527a_100000743101_100000212244 [0,2,0,0,0,0|2,0,0]=4 22386 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000743101_100000211027 [0,2,0,0,0,0|2,0,0]=4 22387 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100000743101_100000211027 [0,2,0,0,0,0|2,0,0]=4 22388 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000743101_100000211027 [0,2,0,0,0,0|2,0,0]=4 22389 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F 11a_100000743101_100000210951 [0,2,0,0,0,0|2,0,0]=4 22390 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F 1626a_100000743101_100000210951 [0,2,0,0,0,0|2,0,0]=4 22391 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F 240690a_100000743101_100000210951 [0,2,0,0,0,0|2,0,0]=4 22392 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)F 527a_100000743101_100000210951 [0,2,0,0,0,0|2,0,0]=4 22393 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)I 11a_100000743101_100000688869 [0,2,0,0,0,0|2,0,0]=4 22394 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)I 1626a_100000743101_100000688869 [0,2,0,0,0,0|2,0,0]=4 22395 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)I 240690a_100000743101_100000688869 [0,2,0,0,0,0|2,0,0]=4 22396 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)I 527a_100000743101_100000688869 [0,2,0,0,0,0|2,0,0]=4 22397 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)O 1626a_100000743101_100000198540 [0,2,0,0,0,0|2,0,0]=4 22398 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)O 240690a_100000743101_100000198540 [0,2,0,0,0,0|2,0,0]=4 22399 B16R1.658 COCCN(C)C(=O)Cc1ccc(cc1)O 527a_100000743101_100000198540 [0,2,0,0,0,0|2,0,0]=4 22400 B16R1.658 CSCCC(O)C(=O)Cc1ccc(cc1)Br 1458a_100000685904_100000189115 [0,2,0,0,0,0|2,0,0]=4 22401 B16R1.658 CSCCC(O)C(=O)Cc1ccc(cc1)C 1458a_100000685904_100000210814 [0,2,0,0,0,0|2,0,0]=4 22402 B16R1.658 CSCCC(O)C(=O)Cc1ccc(cc1)Cl 1458a_100000685904_100000694040 [0,2,0,0,0,0|2,0,0]=4 22403 B16R1.658 CSCCC(O)C(=O)Cc1ccc(cc1)F 1458a_100000685904_100000198546 [0,2,0,0,0,0|2,0,0]=4 22404 B16R1.658 CSCCC(O)C(=O)Cc1ccc(cc1)I 1458a_100000685904_100000189116 [0,2,0,0,0,0|2,0,0]=4 22405 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Br 11a_100000686725_100000198978 [0,2,0,0,0,0|2,0,0]=4 22406 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Br 240690a_100000686725_100000198978 [0,2,0,0,0,0|2,0,0]=4 22407 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Br 527a_100000686725_100000198978 [0,2,0,0,0,0|2,0,0]=4 22408 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)C 11a_100000686725_100000212244 [0,2,0,0,0,0|2,0,0]=4 22409 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)C 240690a_100000686725_100000212244 [0,2,0,0,0,0|2,0,0]=4 22410 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)C 527a_100000686725_100000212244 [0,2,0,0,0,0|2,0,0]=4 22411 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Cl 11a_100000686725_100000211027 [0,2,0,0,0,0|2,0,0]=4 22412 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Cl 240690a_100000686725_100000211027 [0,2,0,0,0,0|2,0,0]=4 22413 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)Cl 527a_100000686725_100000211027 [0,2,0,0,0,0|2,0,0]=4 22414 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)F 11a_100000686725_100000210951 [0,2,0,0,0,0|2,0,0]=4 22415 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)F 1626a_100000686725_100000210951 [0,2,0,0,0,0|2,0,0]=4 22416 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)F 240690a_100000686725_100000210951 [0,2,0,0,0,0|2,0,0]=4 22417 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)F 527a_100000686725_100000210951 [0,2,0,0,0,0|2,0,0]=4 22418 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)I 11a_100000686725_100000688869 [0,2,0,0,0,0|2,0,0]=4 22419 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)I 1626a_100000686725_100000688869 [0,2,0,0,0,0|2,0,0]=4 22420 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)I 240690a_100000686725_100000688869 [0,2,0,0,0,0|2,0,0]=4 22421 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)I 527a_100000686725_100000688869 [0,2,0,0,0,0|2,0,0]=4 22422 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)O 1626a_100000686725_100000198540 [0,2,0,0,0,0|2,0,0]=4 22423 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)O 240690a_100000686725_100000198540 [0,2,0,0,0,0|2,0,0]=4 22424 B16R1.658 CSCCN(C)C(=O)Cc1ccc(cc1)O 527a_100000686725_100000198540 [0,2,0,0,0,0|2,0,0]=4 22425 B16R1.658 Cc1ccc(cc1)CC(=O)N(C)CCCO 240690a_100000213112_100000212244 [0,2,0,0,0,0|2,0,0]=4 22426 B16R1.658 Cc1ccc(cc1)CC(=O)N(C)CCCO 527a_100000213112_100000212244 [0,2,0,0,0,0|2,0,0]=4 22427 B16R1.955 C=C(CCC)CC(=O)Cc1ccc(cc1)Br 1458a_100000138376_100000189115 [0,2,0,0,0,0|1,0,1]=4 22428 B16R1.955 C=C(CCC)CC(=O)Cc1ccc(cc1)C 1458a_100000138376_100000210814 [0,2,0,0,0,0|1,0,1]=4 22429 B16R1.955 C=C(CCC)CC(=O)Cc1ccc(cc1)Cl 1458a_100000138376_100000694040 [0,2,0,0,0,0|1,0,1]=4 22430 B16R1.955 C=C(CCC)CC(=O)Cc1ccc(cc1)F 1458a_100000138376_100000198546 [0,2,0,0,0,0|1,0,1]=4 22431 B16R1.955 C=C(CCC)CC(=O)Cc1ccc(cc1)I 1458a_100000138376_100000189116 [0,2,0,0,0,0|1,0,1]=4 22432 B16R1.955 CCCC(=CC(=O)Cc1ccc(cc1)Br)C 1458a_100020676950_100000189115 [0,2,0,0,0,0|1,0,1]=4 22433 B16R1.955 CCCC(=CC(=O)Cc1ccc(cc1)C)C 1458a_100020676950_100000210814 [0,2,0,0,0,0|1,0,1]=4 22434 B16R1.955 CCCC(=CC(=O)Cc1ccc(cc1)Cl)C 1458a_100020676950_100000694040 [0,2,0,0,0,0|1,0,1]=4 22435 B16R1.955 CCCC(=CC(=O)Cc1ccc(cc1)F)C 1458a_100020676950_100000198546 [0,2,0,0,0,0|1,0,1]=4 22436 B16R1.955 CCCC(=CC(=O)Cc1ccc(cc1)I)C 1458a_100020676950_100000189116 [0,2,0,0,0,0|1,0,1]=4 22437 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000747444 [0,2,0,0,0,0|1,0,1]=4 22438 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000747444 [0,2,0,0,0,0|1,0,1]=4 22439 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000747444 [0,2,0,0,0,0|1,0,1]=4 22440 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000747444 [0,2,0,0,0,0|1,0,1]=4 22441 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000747444 [0,2,0,0,0,0|1,0,1]=4 22442 B16R1.955 CCCC(=O)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000747444 [0,2,0,0,0,0|1,0,1]=4 22443 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011216630 [0,2,0,0,0,0|1,0,0]=3 22444 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)Br 1458a_100000748435_100000189115 [0,2,0,0,0,0|1,0,0]=3 22445 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011216630 [0,2,0,0,0,0|1,0,0]=3 22446 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)C 1458a_100000748435_100000210814 [0,2,0,0,0,0|1,0,0]=3 22447 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011216630 [0,2,0,0,0,0|1,0,0]=3 22448 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)Cl 1458a_100000748435_100000694040 [0,2,0,0,0,0|1,0,0]=3 22449 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011216630 [0,2,0,0,0,0|1,0,0]=3 22450 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)F 1458a_100000748435_100000198546 [0,2,0,0,0,0|1,0,0]=3 22451 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011216630 [0,2,0,0,0,0|1,0,0]=3 22452 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)I 1458a_100000748435_100000189116 [0,2,0,0,0,0|1,0,0]=3 22453 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011216630 [0,2,0,0,0,0|1,0,0]=3 22454 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)Br 1458a_100000748435_100000702658 [0,2,0,0,0,0|2,0,0]=4 22455 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100011216630 [0,2,0,0,0,0|2,0,0]=4 22456 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)C 1458a_100000748435_100000691093 [0,2,0,0,0,0|2,0,0]=4 22457 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)C 1458a_100025705728_100011216630 [0,2,0,0,0,0|2,0,0]=4 22458 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100011216630 [0,2,0,0,0,0|2,0,0]=4 22459 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)Cl 1458a_100000748435_100012066911 [0,2,0,0,0,0|2,0,0]=4 22460 B16R1.955 CCCC(C)CC(=O)Cc1ccc(cn1)F 1458a_100000748435_100000703193 [0,2,0,0,0,0|2,0,0]=4 22461 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)Br 1458a_100000748435_100009831999 [0,2,0,0,0,0|2,0,0]=4 22462 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100011216630 [0,2,0,0,0,0|2,0,0]=4 22463 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)C 1458a_100000740413_100011216630 [0,2,0,0,0,0|2,0,0]=4 22464 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)C 1458a_100000748435_100016987292 [0,2,0,0,0,0|2,0,0]=4 22465 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100011216630 [0,2,0,0,0,0|2,0,0]=4 22466 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)Cl 1458a_100000748435_100000735431 [0,2,0,0,0,0|2,0,0]=4 22467 B16R1.955 CCCC(C)CC(=O)Cc1ccc(nc1)F 1458a_100000748435_100009820150 [0,2,0,0,0,0|2,0,0]=4 22468 B16R1.955 CCCC(C)CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100011216630 [0,2,0,0,0,0|2,0,0]=4 22469 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000748435 [0,2,0,0,0,0|2,0,0]=4 22470 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000748435 [0,2,0,0,0,0|2,0,0]=4 22471 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000748435 [0,2,0,0,0,0|2,0,0]=4 22472 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000748435 [0,2,0,0,0,0|2,0,0]=4 22473 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)C 11a_100000124888_100000748435 [0,2,0,0,0,0|2,0,0]=4 22474 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000748435 [0,2,0,0,0,0|2,0,0]=4 22475 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000748435 [0,2,0,0,0,0|2,0,0]=4 22476 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)C 527a_100000124888_100000748435 [0,2,0,0,0,0|2,0,0]=4 22477 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000748435 [0,2,0,0,0,0|2,0,0]=4 22478 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000748435 [0,2,0,0,0,0|2,0,0]=4 22479 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000748435 [0,2,0,0,0,0|2,0,0]=4 22480 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000748435 [0,2,0,0,0,0|2,0,0]=4 22481 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)F 11a_100000185862_100000748435 [0,2,0,0,0,0|2,0,0]=4 22482 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000748435 [0,2,0,0,0,0|2,0,0]=4 22483 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000748435 [0,2,0,0,0,0|2,0,0]=4 22484 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)F 527a_100000185862_100000748435 [0,2,0,0,0,0|2,0,0]=4 22485 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)I 11a_100000185761_100000748435 [0,2,0,0,0,0|2,0,0]=4 22486 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000748435 [0,2,0,0,0,0|2,0,0]=4 22487 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000748435 [0,2,0,0,0,0|2,0,0]=4 22488 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)I 527a_100000185761_100000748435 [0,2,0,0,0,0|2,0,0]=4 22489 B16R1.955 CCCC(C)CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000748435 [0,2,0,0,0,0|2,0,0]=4 22490 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Br 11a_100000741246_100000198978 [0,2,0,0,0,0|1,0,0]=3 22491 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Br 240690a_100000741246_100000198978 [0,2,0,0,0,0|1,0,0]=3 22492 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Br 527a_100000741246_100000198978 [0,2,0,0,0,0|1,0,0]=3 22493 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)C 11a_100000741246_100000212244 [0,2,0,0,0,0|1,0,0]=3 22494 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)C 240690a_100000741246_100000212244 [0,2,0,0,0,0|1,0,0]=3 22495 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)C 527a_100000741246_100000212244 [0,2,0,0,0,0|1,0,0]=3 22496 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Cl 11a_100000741246_100000211027 [0,2,0,0,0,0|1,0,0]=3 22497 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Cl 240690a_100000741246_100000211027 [0,2,0,0,0,0|1,0,0]=3 22498 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)Cl 527a_100000741246_100000211027 [0,2,0,0,0,0|1,0,0]=3 22499 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)F 11a_100000741246_100000210951 [0,2,0,0,0,0|1,0,0]=3 22500 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)F 1626a_100000741246_100000210951 [0,2,0,0,0,0|1,0,0]=3 22501 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)F 240690a_100000741246_100000210951 [0,2,0,0,0,0|1,0,0]=3 22502 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)F 527a_100000741246_100000210951 [0,2,0,0,0,0|1,0,0]=3 22503 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)I 11a_100000741246_100000688869 [0,2,0,0,0,0|1,0,0]=3 22504 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)I 1626a_100000741246_100000688869 [0,2,0,0,0,0|1,0,0]=3 22505 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)I 240690a_100000741246_100000688869 [0,2,0,0,0,0|1,0,0]=3 22506 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)I 527a_100000741246_100000688869 [0,2,0,0,0,0|1,0,0]=3 22507 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)O 1626a_100000741246_100000198540 [0,2,0,0,0,0|1,0,0]=3 22508 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)O 240690a_100000741246_100000198540 [0,2,0,0,0,0|1,0,0]=3 22509 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cc1)O 527a_100000741246_100000198540 [0,2,0,0,0,0|1,0,0]=3 22510 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Br 11a_100000741246_100020629044 [0,2,0,0,0,0|2,0,0]=4 22511 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Br 240690a_100000741246_100020629044 [0,2,0,0,0,0|2,0,0]=4 22512 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)C 11a_100000741246_100025705728 [0,2,0,0,0,0|2,0,0]=4 22513 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)C 1626a_100000741246_100025705728 [0,2,0,0,0,0|2,0,0]=4 22514 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)C 240690a_100000741246_100025705728 [0,2,0,0,0,0|2,0,0]=4 22515 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Cl 11a_100000741246_100000728320 [0,2,0,0,0,0|2,0,0]=4 22516 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Cl 1626a_100000741246_100000728320 [0,2,0,0,0,0|2,0,0]=4 22517 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Cl 240690a_100000741246_100000728320 [0,2,0,0,0,0|2,0,0]=4 22518 B16R1.955 CCCC(C)NC(=O)Cc1ccc(cn1)Cl 527a_100000741246_100000728320 [0,2,0,0,0,0|2,0,0]=4 22519 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Br 11a_100000741246_100010067268 [0,2,0,0,0,0|2,0,0]=4 22520 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Br 240690a_100000741246_100010067268 [0,2,0,0,0,0|2,0,0]=4 22521 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Br 527a_100000741246_100010067268 [0,2,0,0,0,0|2,0,0]=4 22522 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)C 11a_100000741246_100000740413 [0,2,0,0,0,0|2,0,0]=4 22523 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)C 1626a_100000741246_100000740413 [0,2,0,0,0,0|2,0,0]=4 22524 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)C 240690a_100000741246_100000740413 [0,2,0,0,0,0|2,0,0]=4 22525 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)C 527a_100000741246_100000740413 [0,2,0,0,0,0|2,0,0]=4 22526 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Cl 11a_100000741246_100000061944 [0,2,0,0,0,0|2,0,0]=4 22527 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Cl 1626a_100000741246_100000061944 [0,2,0,0,0,0|2,0,0]=4 22528 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Cl 240690a_100000741246_100000061944 [0,2,0,0,0,0|2,0,0]=4 22529 B16R1.955 CCCC(C)NC(=O)Cc1ccc(nc1)Cl 527a_100000741246_100000061944 [0,2,0,0,0,0|2,0,0]=4 22530 B16R1.955 CCCC(C)NC(=O)Cn1ccc(=O)cc1 11a_100000741246_200000238563 [0,2,0,0,0,0|2,0,0]=4 22531 B16R1.955 CCCC(C)NC(=O)Cn1ccc(=O)cc1 1626a_100000741246_200000238563 [0,2,0,0,0,0|2,0,0]=4 22532 B16R1.955 CCCC(C)NC(=O)Cn1ccc(=O)cc1 240690a_100000741246_200000238563 [0,2,0,0,0,0|2,0,0]=4 22533 B16R1.955 CCCC(C)NC(=O)Cn1ccc(=O)cc1 527a_100000741246_200000238563 [0,2,0,0,0,0|2,0,0]=4 22534 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000741246 [0,2,0,0,0,0|2,0,0]=4 22535 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)C 2430a_100000124888_100000741246 [0,2,0,0,0,0|2,0,0]=4 22536 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000741246 [0,2,0,0,0,0|2,0,0]=4 22537 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000741246 [0,2,0,0,0,0|2,0,0]=4 22538 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000741246 [0,2,0,0,0,0|2,0,0]=4 22539 B16R1.955 CCCC(C)NC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000741246 [0,2,0,0,0,0|2,0,0]=4 22540 B16R1.955 CCCC(C)OC(C)Cc1ccc(cc1)F 34a_100011351027_100000766640 [0,2,0,0,0,0|1,0,1]=4 22541 B16R1.955 CCCC(C)OC(C)Cc1ccc(cc1)F 7a_100011351027_100000766640 [0,2,0,0,0,0|1,0,1]=4 22542 B16R1.955 CCCS(=O)CC(=O)Cc1ccc(cc1)Br 1458a_100011387404_100000189115 [0,2,0,0,0,0|2,0,0]=4 22543 B16R1.955 CCCS(=O)CC(=O)Cc1ccc(cc1)C 1458a_100011387404_100000210814 [0,2,0,0,0,0|2,0,0]=4 22544 B16R1.955 CCCS(=O)CC(=O)Cc1ccc(cc1)Cl 1458a_100011387404_100000694040 [0,2,0,0,0,0|2,0,0]=4 22545 B16R1.955 CCCS(=O)CC(=O)Cc1ccc(cc1)F 1458a_100011387404_100000198546 [0,2,0,0,0,0|2,0,0]=4 22546 B16R1.955 CCCS(=O)CC(=O)Cc1ccc(cc1)I 1458a_100011387404_100000189116 [0,2,0,0,0,0|2,0,0]=4 22547 B16R1.955 CCSC(C)CC(=O)Cc1ccc(cc1)Br 1458a_200011311441_100000189115 [0,2,0,0,0,0|2,0,0]=4 22548 B16R1.955 CCSC(C)CC(=O)Cc1ccc(cc1)C 1458a_200011311441_100000210814 [0,2,0,0,0,0|2,0,0]=4 22549 B16R1.955 CCSC(C)CC(=O)Cc1ccc(cc1)Cl 1458a_200011311441_100000694040 [0,2,0,0,0,0|2,0,0]=4 22550 B16R1.955 CCSC(C)CC(=O)Cc1ccc(cc1)F 1458a_200011311441_100000198546 [0,2,0,0,0,0|2,0,0]=4 22551 B16R1.955 CCSC(C)CC(=O)Cc1ccc(cc1)I 1458a_200011311441_100000189116 [0,2,0,0,0,0|2,0,0]=4 22552 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Br 11a_100000764878_100000198978 [0,2,0,0,0,0|2,0,0]=4 22553 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Br 240690a_100000764878_100000198978 [0,2,0,0,0,0|2,0,0]=4 22554 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Br 527a_100000764878_100000198978 [0,2,0,0,0,0|2,0,0]=4 22555 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)C 11a_100000764878_100000212244 [0,2,0,0,0,0|2,0,0]=4 22556 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)C 240690a_100000764878_100000212244 [0,2,0,0,0,0|2,0,0]=4 22557 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)C 527a_100000764878_100000212244 [0,2,0,0,0,0|2,0,0]=4 22558 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Cl 11a_100000764878_100000211027 [0,2,0,0,0,0|2,0,0]=4 22559 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Cl 240690a_100000764878_100000211027 [0,2,0,0,0,0|2,0,0]=4 22560 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)Cl 527a_100000764878_100000211027 [0,2,0,0,0,0|2,0,0]=4 22561 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F 11a_100000764878_100000210951 [0,2,0,0,0,0|2,0,0]=4 22562 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F 1626a_100000764878_100000210951 [0,2,0,0,0,0|2,0,0]=4 22563 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F 240690a_100000764878_100000210951 [0,2,0,0,0,0|2,0,0]=4 22564 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)F 527a_100000764878_100000210951 [0,2,0,0,0,0|2,0,0]=4 22565 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)I 11a_100000764878_100000688869 [0,2,0,0,0,0|2,0,0]=4 22566 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)I 1626a_100000764878_100000688869 [0,2,0,0,0,0|2,0,0]=4 22567 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)I 240690a_100000764878_100000688869 [0,2,0,0,0,0|2,0,0]=4 22568 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)I 527a_100000764878_100000688869 [0,2,0,0,0,0|2,0,0]=4 22569 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)O 1626a_100000764878_100000198540 [0,2,0,0,0,0|2,0,0]=4 22570 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)O 240690a_100000764878_100000198540 [0,2,0,0,0,0|2,0,0]=4 22571 B16R1.955 COC[C@@H](C)NC(=O)Cc1ccc(cc1)O 527a_100000764878_100000198540 [0,2,0,0,0,0|2,0,0]=4 22572 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)Br 240690a_100000706166_100000198978 [0,2,0,0,0,0|2,0,0]=4 22573 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)Br 527a_100000706166_100000198978 [0,2,0,0,0,0|2,0,0]=4 22574 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)Cl 240690a_100000706166_100000211027 [0,2,0,0,0,0|2,0,0]=4 22575 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)Cl 527a_100000706166_100000211027 [0,2,0,0,0,0|2,0,0]=4 22576 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)F 240690a_100000706166_100000210951 [0,2,0,0,0,0|2,0,0]=4 22577 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)F 527a_100000706166_100000210951 [0,2,0,0,0,0|2,0,0]=4 22578 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)I 240690a_100000706166_100000688869 [0,2,0,0,0,0|2,0,0]=4 22579 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)I 527a_100000706166_100000688869 [0,2,0,0,0,0|2,0,0]=4 22580 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)O 240690a_100000706166_100000198540 [0,2,0,0,0,0|2,0,0]=4 22581 B16R1.955 C[C@H](CCO)NC(=O)Cc1ccc(cc1)O 527a_100000706166_100000198540 [0,2,0,0,0,0|2,0,0]=4 22582 B16R1.955 Cc1ccc(cc1)CC(=O)N[C@H](C)CCO 240690a_100000706166_100000212244 [0,2,0,0,0,0|2,0,0]=4 22583 B16R1.955 Cc1ccc(cc1)CC(=O)N[C@H](C)CCO 527a_100000706166_100000212244 [0,2,0,0,0,0|2,0,0]=4 22584 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011215641 [0,2,0,0,0,0|1,0,1]=4 22585 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100011215641 [0,2,0,0,0,0|1,0,1]=4 22586 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011215641 [0,2,0,0,0,0|1,0,1]=4 22587 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011215641 [0,2,0,0,0,0|1,0,1]=4 22588 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011215641 [0,2,0,0,0,0|1,0,1]=4 22589 B16R1.1067 CC(=O)CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011215641 [0,2,0,0,0,0|1,0,1]=4 22590 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100011214892 [0,2,0,0,0,0|1,0,0]=3 22591 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)Br 1458a_100011216857_100000189115 [0,2,0,0,0,0|1,0,0]=3 22592 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100011214892 [0,2,0,0,0,0|1,0,0]=3 22593 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)Cl 1458a_100011216857_100000694040 [0,2,0,0,0,0|1,0,0]=3 22594 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100011214892 [0,2,0,0,0,0|1,0,0]=3 22595 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)F 1458a_100011216857_100000198546 [0,2,0,0,0,0|1,0,0]=3 22596 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100011214892 [0,2,0,0,0,0|1,0,0]=3 22597 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)I 1458a_100011216857_100000189116 [0,2,0,0,0,0|1,0,0]=3 22598 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100011214892 [0,2,0,0,0,0|1,0,0]=3 22599 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cn1)Br 1458a_100011216857_100000702658 [0,2,0,0,0,0|2,0,0]=4 22600 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100011214892 [0,2,0,0,0,0|2,0,0]=4 22601 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100011214892 [0,2,0,0,0,0|2,0,0]=4 22602 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cn1)Cl 1458a_100011216857_100012066911 [0,2,0,0,0,0|2,0,0]=4 22603 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(cn1)F 1458a_100011216857_100000703193 [0,2,0,0,0,0|2,0,0]=4 22604 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100011214892 [0,2,0,0,0,0|2,0,0]=4 22605 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(nc1)Br 1458a_100011216857_100009831999 [0,2,0,0,0,0|2,0,0]=4 22606 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100011214892 [0,2,0,0,0,0|2,0,0]=4 22607 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(nc1)Cl 1458a_100011216857_100000735431 [0,2,0,0,0,0|2,0,0]=4 22608 B16R1.1067 CC(C)CCCC(=O)Cc1ccc(nc1)F 1458a_100011216857_100009820150 [0,2,0,0,0,0|2,0,0]=4 22609 B16R1.1067 CC(C)CCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100011214892 [0,2,0,0,0,0|2,0,0]=4 22610 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100011216857 [0,2,0,0,0,0|2,0,0]=4 22611 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100011216857 [0,2,0,0,0,0|2,0,0]=4 22612 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100011216857 [0,2,0,0,0,0|2,0,0]=4 22613 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100011216857 [0,2,0,0,0,0|2,0,0]=4 22614 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100011216857 [0,2,0,0,0,0|2,0,0]=4 22615 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100011216857 [0,2,0,0,0,0|2,0,0]=4 22616 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011216857 [0,2,0,0,0,0|2,0,0]=4 22617 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100011216857 [0,2,0,0,0,0|2,0,0]=4 22618 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F 11a_100000185862_100011216857 [0,2,0,0,0,0|2,0,0]=4 22619 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100011216857 [0,2,0,0,0,0|2,0,0]=4 22620 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100011216857 [0,2,0,0,0,0|2,0,0]=4 22621 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100011216857 [0,2,0,0,0,0|2,0,0]=4 22622 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I 11a_100000185761_100011216857 [0,2,0,0,0,0|2,0,0]=4 22623 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100011216857 [0,2,0,0,0,0|2,0,0]=4 22624 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100011216857 [0,2,0,0,0,0|2,0,0]=4 22625 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100011216857 [0,2,0,0,0,0|2,0,0]=4 22626 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100011216857 [0,2,0,0,0,0|2,0,0]=4 22627 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Br 11a_100000210545_100000198978 [0,2,0,0,0,0|1,0,0]=3 22628 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Br 240690a_100000210545_100000198978 [0,2,0,0,0,0|1,0,0]=3 22629 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Br 527a_100000210545_100000198978 [0,2,0,0,0,0|1,0,0]=3 22630 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Cl 11a_100000210545_100000211027 [0,2,0,0,0,0|1,0,0]=3 22631 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Cl 240690a_100000210545_100000211027 [0,2,0,0,0,0|1,0,0]=3 22632 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)Cl 527a_100000210545_100000211027 [0,2,0,0,0,0|1,0,0]=3 22633 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F 11a_100000210545_100000210951 [0,2,0,0,0,0|1,0,0]=3 22634 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F 1626a_100000210545_100000210951 [0,2,0,0,0,0|1,0,0]=3 22635 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F 240690a_100000210545_100000210951 [0,2,0,0,0,0|1,0,0]=3 22636 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)F 527a_100000210545_100000210951 [0,2,0,0,0,0|1,0,0]=3 22637 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)I 11a_100000210545_100000688869 [0,2,0,0,0,0|1,0,0]=3 22638 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)I 1626a_100000210545_100000688869 [0,2,0,0,0,0|1,0,0]=3 22639 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)I 240690a_100000210545_100000688869 [0,2,0,0,0,0|1,0,0]=3 22640 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)I 527a_100000210545_100000688869 [0,2,0,0,0,0|1,0,0]=3 22641 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)O 1626a_100000210545_100000198540 [0,2,0,0,0,0|1,0,0]=3 22642 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)O 240690a_100000210545_100000198540 [0,2,0,0,0,0|1,0,0]=3 22643 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cc1)O 527a_100000210545_100000198540 [0,2,0,0,0,0|1,0,0]=3 22644 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Br 11a_100000210545_100020629044 [0,2,0,0,0,0|2,0,0]=4 22645 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Br 240690a_100000210545_100020629044 [0,2,0,0,0,0|2,0,0]=4 22646 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl 11a_100000210545_100000728320 [0,2,0,0,0,0|2,0,0]=4 22647 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl 1626a_100000210545_100000728320 [0,2,0,0,0,0|2,0,0]=4 22648 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl 240690a_100000210545_100000728320 [0,2,0,0,0,0|2,0,0]=4 22649 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(cn1)Cl 527a_100000210545_100000728320 [0,2,0,0,0,0|2,0,0]=4 22650 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Br 11a_100000210545_100010067268 [0,2,0,0,0,0|2,0,0]=4 22651 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Br 240690a_100000210545_100010067268 [0,2,0,0,0,0|2,0,0]=4 22652 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Br 527a_100000210545_100010067268 [0,2,0,0,0,0|2,0,0]=4 22653 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Cl 11a_100000210545_100000061944 [0,2,0,0,0,0|2,0,0]=4 22654 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Cl 1626a_100000210545_100000061944 [0,2,0,0,0,0|2,0,0]=4 22655 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Cl 240690a_100000210545_100000061944 [0,2,0,0,0,0|2,0,0]=4 22656 B16R1.1067 CC(C)CCNC(=O)Cc1ccc(nc1)Cl 527a_100000210545_100000061944 [0,2,0,0,0,0|2,0,0]=4 22657 B16R1.1067 CC(C)CCNC(=O)Cn1ccc(=O)cc1 11a_100000210545_200000238563 [0,2,0,0,0,0|2,0,0]=4 22658 B16R1.1067 CC(C)CCNC(=O)Cn1ccc(=O)cc1 1626a_100000210545_200000238563 [0,2,0,0,0,0|2,0,0]=4 22659 B16R1.1067 CC(C)CCNC(=O)Cn1ccc(=O)cc1 240690a_100000210545_200000238563 [0,2,0,0,0,0|2,0,0]=4 22660 B16R1.1067 CC(C)CCNC(=O)Cn1ccc(=O)cc1 527a_100000210545_200000238563 [0,2,0,0,0,0|2,0,0]=4 22661 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100000210545 [0,2,0,0,0,0|2,0,0]=4 22662 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100000210545 [0,2,0,0,0,0|2,0,0]=4 22663 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100000210545 [0,2,0,0,0,0|2,0,0]=4 22664 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100000210545 [0,2,0,0,0,0|2,0,0]=4 22665 B16R1.1067 CC(C)CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100000210545 [0,2,0,0,0,0|2,0,0]=4 22666 B16R1.1067 CC(C)CCOC(C)Cc1ccc(cc1)F 34a_100011351027_100000210312 [0,2,0,0,0,0|1,0,1]=4 22667 B16R1.1067 CC(C)CCOC(C)Cc1ccc(cc1)F 7a_100011351027_100000210626 [0,2,0,0,0,0|1,0,1]=4 22668 B16R1.1067 CC(C)CNNC(=O)Cc1ccc(cc1)Br 22a_100000696102_100000198978 [0,2,0,0,0,0|2,0,0]=4 22669 B16R1.1067 CC(C)CNNC(=O)Cc1ccc(cc1)Cl 22a_100000696102_100000211027 [0,2,0,0,0,0|2,0,0]=4 22670 B16R1.1067 CC(C)CNNC(=O)Cc1ccc(cc1)F 22a_100000696102_100000210951 [0,2,0,0,0,0|2,0,0]=4 22671 B16R1.1067 CC(C)CNNC(=O)Cc1ccc(cc1)I 22a_100000696102_100000688869 [0,2,0,0,0,0|2,0,0]=4 22672 B16R1.1067 CC(C)CNNC(=O)Cc1ccc(cc1)O 22a_100000696102_100000198540 [0,2,0,0,0,0|2,0,0]=4 22673 B16R1.1067 CC(C)COCC(=O)Cc1ccc(cc1)Br 1458a_100011223364_100000189115 [0,2,0,0,0,0|2,0,0]=4 22674 B16R1.1067 CC(C)COCC(=O)Cc1ccc(cc1)Cl 1458a_100011223364_100000694040 [0,2,0,0,0,0|2,0,0]=4 22675 B16R1.1067 CC(C)COCC(=O)Cc1ccc(cc1)F 1458a_100011223364_100000198546 [0,2,0,0,0,0|2,0,0]=4 22676 B16R1.1067 CC(C)COCC(=O)Cc1ccc(cc1)I 1458a_100011223364_100000189116 [0,2,0,0,0,0|2,0,0]=4 22677 B16R1.1067 CC(C)OCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000211751 [0,2,0,0,0,0|2,0,0]=4 22678 B16R1.1067 CC(C)OCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000211751 [0,2,0,0,0,0|2,0,0]=4 22679 B16R1.1067 CC(C)OCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000211751 [0,2,0,0,0,0|2,0,0]=4 22680 B16R1.1067 CC(C)OCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000211751 [0,2,0,0,0,0|2,0,0]=4 22681 B16R1.1067 CC(C)OCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000211751 [0,2,0,0,0,0|2,0,0]=4 22682 B16R1.1067 CC(C)SCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000730970 [0,2,0,0,0,0|2,0,0]=4 22683 B16R1.1067 CC(C)SCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000730970 [0,2,0,0,0,0|2,0,0]=4 22684 B16R1.1067 CC(C)SCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000730970 [0,2,0,0,0,0|2,0,0]=4 22685 B16R1.1067 CC(C)SCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000730970 [0,2,0,0,0,0|2,0,0]=4 22686 B16R1.1067 CC(C)SCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000730970 [0,2,0,0,0,0|2,0,0]=4 22687 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000718107 [0,2,0,0,0,0|1,0,0]=3 22688 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000718107 [0,2,0,0,0,0|1,0,0]=3 22689 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000718107 [0,2,0,0,0,0|1,0,0]=3 22690 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000718107 [0,2,0,0,0,0|1,0,0]=3 22691 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000718107 [0,2,0,0,0,0|1,0,0]=3 22692 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000718107 [0,2,0,0,0,0|2,0,0]=4 22693 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000718107 [0,2,0,0,0,0|2,0,0]=4 22694 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000718107 [0,2,0,0,0,0|2,0,0]=4 22695 B16R1.1067 CC(O)CCCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000718107 [0,2,0,0,0,0|2,0,0]=4 22696 B16R1.1067 CC(O)CCCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000718107 [0,2,0,0,0,0|2,0,0]=4 22697 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000761597 [0,2,0,0,0,0|2,0,0]=4 22698 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000761597 [0,2,0,0,0,0|2,0,0]=4 22699 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000761597 [0,2,0,0,0,0|2,0,0]=4 22700 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000761597 [0,2,0,0,0,0|2,0,0]=4 22701 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000761597 [0,2,0,0,0,0|2,0,0]=4 22702 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000761597 [0,2,0,0,0,0|2,0,0]=4 22703 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000761597 [0,2,0,0,0,0|2,0,0]=4 22704 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000761597 [0,2,0,0,0,0|2,0,0]=4 22705 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000761597 [0,2,0,0,0,0|2,0,0]=4 22706 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000761597 [0,2,0,0,0,0|2,0,0]=4 22707 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000761597 [0,2,0,0,0,0|2,0,0]=4 22708 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000761597 [0,2,0,0,0,0|2,0,0]=4 22709 B16R1.1067 CC(O)CCCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000761597 [0,2,0,0,0,0|2,0,0]=4 22710 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)Br 240690a_200000755665_100000198978 [0,2,0,0,0,0|1,0,0]=3 22711 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)Br 527a_200000755665_100000198978 [0,2,0,0,0,0|1,0,0]=3 22712 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)Cl 240690a_200000755665_100000211027 [0,2,0,0,0,0|1,0,0]=3 22713 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)Cl 527a_200000755665_100000211027 [0,2,0,0,0,0|1,0,0]=3 22714 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)F 240690a_200000755665_100000210951 [0,2,0,0,0,0|1,0,0]=3 22715 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)F 527a_200000755665_100000210951 [0,2,0,0,0,0|1,0,0]=3 22716 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)I 240690a_200000755665_100000688869 [0,2,0,0,0,0|1,0,0]=3 22717 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)I 527a_200000755665_100000688869 [0,2,0,0,0,0|1,0,0]=3 22718 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)O 240690a_200000755665_100000198540 [0,2,0,0,0,0|1,0,0]=3 22719 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cc1)O 527a_200000755665_100000198540 [0,2,0,0,0,0|1,0,0]=3 22720 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cn1)Br 240690a_200000755665_100020629044 [0,2,0,0,0,0|2,0,0]=4 22721 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cn1)Cl 240690a_200000755665_100000728320 [0,2,0,0,0,0|2,0,0]=4 22722 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(cn1)Cl 527a_200000755665_100000728320 [0,2,0,0,0,0|2,0,0]=4 22723 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(nc1)Br 240690a_200000755665_100010067268 [0,2,0,0,0,0|2,0,0]=4 22724 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(nc1)Br 527a_200000755665_100010067268 [0,2,0,0,0,0|2,0,0]=4 22725 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(nc1)Cl 240690a_200000755665_100000061944 [0,2,0,0,0,0|2,0,0]=4 22726 B16R1.1067 CC(O)CCNC(=O)Cc1ccc(nc1)Cl 527a_200000755665_100000061944 [0,2,0,0,0,0|2,0,0]=4 22727 B16R1.1067 CC(O)CCNC(=O)Cn1ccc(=O)cc1 240690a_200000755665_200000238563 [0,2,0,0,0,0|2,0,0]=4 22728 B16R1.1067 CC(O)CCNC(=O)Cn1ccc(=O)cc1 527a_200000755665_200000238563 [0,2,0,0,0,0|2,0,0]=4 22729 B16R1.1067 CC(O)CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_200000755665 [0,2,0,0,0,0|2,0,0]=4 22730 B16R1.1067 CC(O)CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_200000755665 [0,2,0,0,0,0|2,0,0]=4 22731 B16R1.1067 CC(O)CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_200000755665 [0,2,0,0,0,0|2,0,0]=4 22732 B16R1.1067 CC(O)CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_200000755665 [0,2,0,0,0,0|2,0,0]=4 22733 B16R1.1067 CC(O)CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_200000755665 [0,2,0,0,0,0|2,0,0]=4 22734 B16R1.1067 CC(O)CCOC(C)Cc1ccc(cc1)F 34a_100011351027_100012276601 [0,2,0,0,0,0|1,0,1]=4 22735 B16R1.1067 CC(O)CCOC(C)Cc1ccc(cc1)F 7a_100011351027_100012276601 [0,2,0,0,0,0|1,0,1]=4 22736 B16R1.1067 CC(O)CNNC(=O)Cc1ccc(cc1)Br 22a_200000730056_100000198978 [0,2,0,0,0,0|2,0,0]=4 22737 B16R1.1067 CC(O)CNNC(=O)Cc1ccc(cc1)Cl 22a_200000730056_100000211027 [0,2,0,0,0,0|2,0,0]=4 22738 B16R1.1067 CC(O)CNNC(=O)Cc1ccc(cc1)F 22a_200000730056_100000210951 [0,2,0,0,0,0|2,0,0]=4 22739 B16R1.1067 CC(O)CNNC(=O)Cc1ccc(cc1)I 22a_200000730056_100000688869 [0,2,0,0,0,0|2,0,0]=4 22740 B16R1.1067 CC(O)CNNC(=O)Cc1ccc(cc1)O 22a_200000730056_100000198540 [0,2,0,0,0,0|2,0,0]=4 22741 B16R1.1067 CN(C)CCCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000695564 [0,2,0,0,0,0|2,0,0]=4 22742 B16R1.1067 CN(C)CCCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000695564 [0,2,0,0,0,0|2,0,0]=4 22743 B16R1.1067 CN(C)CCCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000695564 [0,2,0,0,0,0|2,0,0]=4 22744 B16R1.1067 CN(C)CCCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000695564 [0,2,0,0,0,0|2,0,0]=4 22745 B16R1.1067 CN(C)CCCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000695564 [0,2,0,0,0,0|2,0,0]=4 22746 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Br 240690a_100000210585_100000198978 [0,2,0,0,0,0|2,0,0]=4 22747 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Br 527a_100000210585_100000198978 [0,2,0,0,0,0|2,0,0]=4 22748 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Cl 240690a_100000210585_100000211027 [0,2,0,0,0,0|2,0,0]=4 22749 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)Cl 527a_100000210585_100000211027 [0,2,0,0,0,0|2,0,0]=4 22750 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F 240690a_100000210585_100000210951 [0,2,0,0,0,0|2,0,0]=4 22751 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F 527a_100000210585_100000210951 [0,2,0,0,0,0|2,0,0]=4 22752 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)I 240690a_100000210585_100000688869 [0,2,0,0,0,0|2,0,0]=4 22753 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)I 527a_100000210585_100000688869 [0,2,0,0,0,0|2,0,0]=4 22754 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)O 240690a_100000210585_100000198540 [0,2,0,0,0,0|2,0,0]=4 22755 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)O 527a_100000210585_100000198540 [0,2,0,0,0,0|2,0,0]=4 22756 B16R1.1067 Cc1ccc(cc1)CC(=O)CCCC(C)C 1458a_100000212244_100011214892 [0,2,0,0,0,0|1,0,0]=3 22757 B16R1.1067 Cc1ccc(cc1)CC(=O)CCCC(C)C 1458a_100011216857_100000210814 [0,2,0,0,0,0|1,0,0]=3 22758 B16R1.1067 Cc1ccc(cc1)CC(=O)CCCC(C)O 1458a_100000212244_200000718107 [0,2,0,0,0,0|1,0,0]=3 22759 B16R1.1067 Cc1ccc(cc1)CC(=O)CCCN(C)C 1458a_100000212244_100000695564 [0,2,0,0,0,0|2,0,0]=4 22760 B16R1.1067 Cc1ccc(cc1)CC(=O)CCOC(C)C 1458a_100000212244_100000211751 [0,2,0,0,0,0|2,0,0]=4 22761 B16R1.1067 Cc1ccc(cc1)CC(=O)CCSC(C)C 1458a_100000212244_100000730970 [0,2,0,0,0,0|2,0,0]=4 22762 B16R1.1067 Cc1ccc(cc1)CC(=O)COCC(C)C 1458a_100011223364_100000210814 [0,2,0,0,0,0|2,0,0]=4 22763 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)C 11a_100000210545_100000212244 [0,2,0,0,0,0|1,0,0]=3 22764 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)C 240690a_100000210545_100000212244 [0,2,0,0,0,0|1,0,0]=3 22765 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)C 527a_100000210545_100000212244 [0,2,0,0,0,0|1,0,0]=3 22766 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)O 240690a_200000755665_100000212244 [0,2,0,0,0,0|1,0,0]=3 22767 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCC(C)O 527a_200000755665_100000212244 [0,2,0,0,0,0|1,0,0]=3 22768 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCN(C)C 240690a_100000210585_100000212244 [0,2,0,0,0,0|2,0,0]=4 22769 B16R1.1067 Cc1ccc(cc1)CC(=O)NCCN(C)C 527a_100000210585_100000212244 [0,2,0,0,0,0|2,0,0]=4 22770 B16R1.1067 Cc1ccc(cc1)CC(=O)NNCC(C)C 22a_100000696102_100000212244 [0,2,0,0,0,0|2,0,0]=4 22771 B16R1.1067 Cc1ccc(cc1)CC(=O)NNCC(C)O 22a_200000730056_100000212244 [0,2,0,0,0,0|2,0,0]=4 22772 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C 11a_100000124888_100011216857 [0,2,0,0,0,0|2,0,0]=4 22773 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C 1626a_100000124888_100011216857 [0,2,0,0,0,0|2,0,0]=4 22774 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C 22a_100000124888_100011216857 [0,2,0,0,0,0|2,0,0]=4 22775 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C 527a_100000124888_100011216857 [0,2,0,0,0,0|2,0,0]=4 22776 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)O 1626a_100000124888_100000761597 [0,2,0,0,0,0|2,0,0]=4 22777 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)O 22a_100000124888_100000761597 [0,2,0,0,0,0|2,0,0]=4 22778 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)O 527a_100000124888_100000761597 [0,2,0,0,0,0|2,0,0]=4 22779 B16R1.1067 Cc1ccc(cc1)NC(=O)NCCC(C)C 2430a_100000124888_100000210545 [0,2,0,0,0,0|2,0,0]=4 22780 B16R1.1067 Cc1ccc(cc1)NC(=O)NCCC(C)O 2430a_100000124888_200000755665 [0,2,0,0,0,0|2,0,0]=4 22781 B16R1.1067 Cc1ccc(cn1)CC(=O)CCCC(C)C 1458a_100000740413_100011214892 [0,2,0,0,0,0|2,0,0]=4 22782 B16R1.1067 Cc1ccc(cn1)CC(=O)CCCC(C)C 1458a_100011216857_100016987292 [0,2,0,0,0,0|2,0,0]=4 22783 B16R1.1067 Cc1ccc(cn1)CC(=O)CCCC(C)O 1458a_100000740413_200000718107 [0,2,0,0,0,0|2,0,0]=4 22784 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C 11a_100000210545_100000740413 [0,2,0,0,0,0|2,0,0]=4 22785 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C 1626a_100000210545_100000740413 [0,2,0,0,0,0|2,0,0]=4 22786 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C 240690a_100000210545_100000740413 [0,2,0,0,0,0|2,0,0]=4 22787 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)C 527a_100000210545_100000740413 [0,2,0,0,0,0|2,0,0]=4 22788 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)O 240690a_200000755665_100000740413 [0,2,0,0,0,0|2,0,0]=4 22789 B16R1.1067 Cc1ccc(cn1)CC(=O)NCCC(C)O 527a_200000755665_100000740413 [0,2,0,0,0,0|2,0,0]=4 22790 B16R1.1067 Cc1ccc(nc1)CC(=O)CCCC(C)C 1458a_100011216857_100000691093 [0,2,0,0,0,0|2,0,0]=4 22791 B16R1.1067 Cc1ccc(nc1)CC(=O)CCCC(C)C 1458a_100025705728_100011214892 [0,2,0,0,0,0|2,0,0]=4 22792 B16R1.1067 Cc1ccc(nc1)CC(=O)CCCC(C)O 1458a_100025705728_200000718107 [0,2,0,0,0,0|2,0,0]=4 22793 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)C 11a_100000210545_100025705728 [0,2,0,0,0,0|2,0,0]=4 22794 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)C 1626a_100000210545_100025705728 [0,2,0,0,0,0|2,0,0]=4 22795 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)C 240690a_100000210545_100025705728 [0,2,0,0,0,0|2,0,0]=4 22796 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)O 240690a_200000755665_100025705728 [0,2,0,0,0,0|2,0,0]=4 22797 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)Br 240690a_100000744482_100000198978 [0,2,0,0,0,0|2,0,0]=4 22798 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)Br 527a_100000744482_100000198978 [0,2,0,0,0,0|2,0,0]=4 22799 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)Cl 240690a_100000744482_100000211027 [0,2,0,0,0,0|2,0,0]=4 22800 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)Cl 527a_100000744482_100000211027 [0,2,0,0,0,0|2,0,0]=4 22801 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)F 240690a_100000744482_100000210951 [0,2,0,0,0,0|2,0,0]=4 22802 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)F 527a_100000744482_100000210951 [0,2,0,0,0,0|2,0,0]=4 22803 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)I 240690a_100000744482_100000688869 [0,2,0,0,0,0|2,0,0]=4 22804 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)I 527a_100000744482_100000688869 [0,2,0,0,0,0|2,0,0]=4 22805 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)O 240690a_100000744482_100000198540 [0,2,0,0,0,0|2,0,0]=4 22806 B16R1.1147 CC(CO)CNC(=O)Cc1ccc(cc1)O 527a_100000744482_100000198540 [0,2,0,0,0,0|2,0,0]=4 22807 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cc1)Br 1458a_100000701222_100000189115 [0,2,0,0,0,0|1,0,0]=3 22808 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cc1)C 1458a_100000701222_100000210814 [0,2,0,0,0,0|1,0,0]=3 22809 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000701222_100000694040 [0,2,0,0,0,0|1,0,0]=3 22810 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cc1)F 1458a_100000701222_100000198546 [0,2,0,0,0,0|1,0,0]=3 22811 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cc1)I 1458a_100000701222_100000189116 [0,2,0,0,0,0|1,0,0]=3 22812 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cn1)Br 1458a_100000701222_100000702658 [0,2,0,0,0,0|2,0,0]=4 22813 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cn1)C 1458a_100000701222_100000691093 [0,2,0,0,0,0|2,0,0]=4 22814 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cn1)Cl 1458a_100000701222_100012066911 [0,2,0,0,0,0|2,0,0]=4 22815 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(cn1)F 1458a_100000701222_100000703193 [0,2,0,0,0,0|2,0,0]=4 22816 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(nc1)Br 1458a_100000701222_100009831999 [0,2,0,0,0,0|2,0,0]=4 22817 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(nc1)C 1458a_100000701222_100016987292 [0,2,0,0,0,0|2,0,0]=4 22818 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(nc1)Cl 1458a_100000701222_100000735431 [0,2,0,0,0,0|2,0,0]=4 22819 B16R1.1147 CCC(C)CCC(=O)Cc1ccc(nc1)F 1458a_100000701222_100009820150 [0,2,0,0,0,0|2,0,0]=4 22820 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000701222 [0,2,0,0,0,0|2,0,0]=4 22821 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000701222 [0,2,0,0,0,0|2,0,0]=4 22822 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000701222 [0,2,0,0,0,0|2,0,0]=4 22823 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000701222 [0,2,0,0,0,0|2,0,0]=4 22824 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000701222 [0,2,0,0,0,0|2,0,0]=4 22825 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000701222 [0,2,0,0,0,0|2,0,0]=4 22826 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000701222 [0,2,0,0,0,0|2,0,0]=4 22827 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000701222 [0,2,0,0,0,0|2,0,0]=4 22828 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000701222 [0,2,0,0,0,0|2,0,0]=4 22829 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000701222 [0,2,0,0,0,0|2,0,0]=4 22830 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000701222 [0,2,0,0,0,0|2,0,0]=4 22831 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000701222 [0,2,0,0,0,0|2,0,0]=4 22832 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000701222 [0,2,0,0,0,0|2,0,0]=4 22833 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000701222 [0,2,0,0,0,0|2,0,0]=4 22834 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000701222 [0,2,0,0,0,0|2,0,0]=4 22835 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000701222 [0,2,0,0,0,0|2,0,0]=4 22836 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000701222 [0,2,0,0,0,0|2,0,0]=4 22837 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000701222 [0,2,0,0,0,0|2,0,0]=4 22838 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000701222 [0,2,0,0,0,0|2,0,0]=4 22839 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000701222 [0,2,0,0,0,0|2,0,0]=4 22840 B16R1.1147 CCC(C)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000701222 [0,2,0,0,0,0|2,0,0]=4 22841 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Br 11a_100020588543_100000198978 [0,2,0,0,0,0|1,0,0]=3 22842 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Br 240690a_100020588543_100000198978 [0,2,0,0,0,0|1,0,0]=3 22843 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Br 527a_100020588543_100000198978 [0,2,0,0,0,0|1,0,0]=3 22844 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)C 11a_100020588543_100000212244 [0,2,0,0,0,0|1,0,0]=3 22845 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)C 240690a_100020588543_100000212244 [0,2,0,0,0,0|1,0,0]=3 22846 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)C 527a_100020588543_100000212244 [0,2,0,0,0,0|1,0,0]=3 22847 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Cl 11a_100020588543_100000211027 [0,2,0,0,0,0|1,0,0]=3 22848 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Cl 240690a_100020588543_100000211027 [0,2,0,0,0,0|1,0,0]=3 22849 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)Cl 527a_100020588543_100000211027 [0,2,0,0,0,0|1,0,0]=3 22850 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)F 11a_100020588543_100000210951 [0,2,0,0,0,0|1,0,0]=3 22851 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)F 1626a_100020588543_100000210951 [0,2,0,0,0,0|1,0,0]=3 22852 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)F 240690a_100020588543_100000210951 [0,2,0,0,0,0|1,0,0]=3 22853 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)F 527a_100020588543_100000210951 [0,2,0,0,0,0|1,0,0]=3 22854 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)I 11a_100020588543_100000688869 [0,2,0,0,0,0|1,0,0]=3 22855 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)I 1626a_100020588543_100000688869 [0,2,0,0,0,0|1,0,0]=3 22856 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)I 240690a_100020588543_100000688869 [0,2,0,0,0,0|1,0,0]=3 22857 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)I 527a_100020588543_100000688869 [0,2,0,0,0,0|1,0,0]=3 22858 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)O 1626a_100020588543_100000198540 [0,2,0,0,0,0|1,0,0]=3 22859 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)O 240690a_100020588543_100000198540 [0,2,0,0,0,0|1,0,0]=3 22860 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cc1)O 527a_100020588543_100000198540 [0,2,0,0,0,0|1,0,0]=3 22861 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Br 11a_100020588543_100020629044 [0,2,0,0,0,0|2,0,0]=4 22862 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Br 240690a_100020588543_100020629044 [0,2,0,0,0,0|2,0,0]=4 22863 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)C 11a_100020588543_100025705728 [0,2,0,0,0,0|2,0,0]=4 22864 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)C 1626a_100020588543_100025705728 [0,2,0,0,0,0|2,0,0]=4 22865 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)C 240690a_100020588543_100025705728 [0,2,0,0,0,0|2,0,0]=4 22866 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Cl 11a_100020588543_100000728320 [0,2,0,0,0,0|2,0,0]=4 22867 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Cl 1626a_100020588543_100000728320 [0,2,0,0,0,0|2,0,0]=4 22868 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Cl 240690a_100020588543_100000728320 [0,2,0,0,0,0|2,0,0]=4 22869 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(cn1)Cl 527a_100020588543_100000728320 [0,2,0,0,0,0|2,0,0]=4 22870 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Br 11a_100020588543_100010067268 [0,2,0,0,0,0|2,0,0]=4 22871 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Br 240690a_100020588543_100010067268 [0,2,0,0,0,0|2,0,0]=4 22872 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Br 527a_100020588543_100010067268 [0,2,0,0,0,0|2,0,0]=4 22873 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)C 11a_100020588543_100000740413 [0,2,0,0,0,0|2,0,0]=4 22874 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)C 1626a_100020588543_100000740413 [0,2,0,0,0,0|2,0,0]=4 22875 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)C 240690a_100020588543_100000740413 [0,2,0,0,0,0|2,0,0]=4 22876 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)C 527a_100020588543_100000740413 [0,2,0,0,0,0|2,0,0]=4 22877 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Cl 11a_100020588543_100000061944 [0,2,0,0,0,0|2,0,0]=4 22878 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Cl 1626a_100020588543_100000061944 [0,2,0,0,0,0|2,0,0]=4 22879 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Cl 240690a_100020588543_100000061944 [0,2,0,0,0,0|2,0,0]=4 22880 B16R1.1147 CCC(C)CNC(=O)Cc1ccc(nc1)Cl 527a_100020588543_100000061944 [0,2,0,0,0,0|2,0,0]=4 22881 B16R1.1147 CCC(C)CNC(=O)Cn1ccc(=O)cc1 11a_100020588543_200000238563 [0,2,0,0,0,0|2,0,0]=4 22882 B16R1.1147 CCC(C)CNC(=O)Cn1ccc(=O)cc1 1626a_100020588543_200000238563 [0,2,0,0,0,0|2,0,0]=4 22883 B16R1.1147 CCC(C)CNC(=O)Cn1ccc(=O)cc1 240690a_100020588543_200000238563 [0,2,0,0,0,0|2,0,0]=4 22884 B16R1.1147 CCC(C)CNC(=O)Cn1ccc(=O)cc1 527a_100020588543_200000238563 [0,2,0,0,0,0|2,0,0]=4 22885 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100020588543 [0,2,0,0,0,0|2,0,0]=4 22886 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100020588543 [0,2,0,0,0,0|2,0,0]=4 22887 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100020588543 [0,2,0,0,0,0|2,0,0]=4 22888 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100020588543 [0,2,0,0,0,0|2,0,0]=4 22889 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100020588543 [0,2,0,0,0,0|2,0,0]=4 22890 B16R1.1147 CCC(C)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100020588543 [0,2,0,0,0,0|2,0,0]=4 22891 B16R1.1147 CCC(C)COC(C)Cc1ccc(cc1)F 34a_100011351027_100000748023 [0,2,0,0,0,0|1,0,1]=4 22892 B16R1.1147 CCC(C)COC(C)Cc1ccc(cc1)F 7a_100011351027_100000748023 [0,2,0,0,0,0|1,0,1]=4 22893 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)Br 22a_100000718999_100000198978 [0,2,0,0,0,0|2,0,0]=4 22894 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)C 22a_100000718999_100000212244 [0,2,0,0,0,0|2,0,0]=4 22895 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)Cl 22a_100000718999_100000211027 [0,2,0,0,0,0|2,0,0]=4 22896 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)F 22a_100000718999_100000210951 [0,2,0,0,0,0|2,0,0]=4 22897 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)I 22a_100000718999_100000688869 [0,2,0,0,0,0|2,0,0]=4 22898 B16R1.1147 CCC(C)NNC(=O)Cc1ccc(cc1)O 22a_100000718999_100000198540 [0,2,0,0,0,0|2,0,0]=4 22899 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_203496584001 [0,2,0,0,0,0|2,0,0]=4 22900 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_203496584001 [0,2,0,0,0,0|2,0,0]=4 22901 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_203496584001 [0,2,0,0,0,0|2,0,0]=4 22902 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)C 22a_100000124888_203496584001 [0,2,0,0,0,0|2,0,0]=4 22903 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_203496584001 [0,2,0,0,0,0|2,0,0]=4 22904 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_203496584001 [0,2,0,0,0,0|2,0,0]=4 22905 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_203496584001 [0,2,0,0,0,0|2,0,0]=4 22906 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)F 22a_100000185862_203496584001 [0,2,0,0,0,0|2,0,0]=4 22907 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_203496584001 [0,2,0,0,0,0|2,0,0]=4 22908 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)I 22a_100000185761_203496584001 [0,2,0,0,0,0|2,0,0]=4 22909 B16R1.1147 CCC(O)CCC(=O)Nc1ccc(cc1)O 22a_100000185829_203496584001 [0,2,0,0,0,0|2,0,0]=4 22910 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Br 11a_100011218483_100000198978 [0,2,0,0,0,0|1,0,0]=3 22911 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Br 240690a_100011218483_100000198978 [0,2,0,0,0,0|1,0,0]=3 22912 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Br 527a_100011218483_100000198978 [0,2,0,0,0,0|1,0,0]=3 22913 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)C 11a_100011218483_100000212244 [0,2,0,0,0,0|1,0,0]=3 22914 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)C 240690a_100011218483_100000212244 [0,2,0,0,0,0|1,0,0]=3 22915 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)C 527a_100011218483_100000212244 [0,2,0,0,0,0|1,0,0]=3 22916 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Cl 11a_100011218483_100000211027 [0,2,0,0,0,0|1,0,0]=3 22917 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Cl 240690a_100011218483_100000211027 [0,2,0,0,0,0|1,0,0]=3 22918 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)Cl 527a_100011218483_100000211027 [0,2,0,0,0,0|1,0,0]=3 22919 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)F 11a_100011218483_100000210951 [0,2,0,0,0,0|1,0,0]=3 22920 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)F 240690a_100011218483_100000210951 [0,2,0,0,0,0|1,0,0]=3 22921 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)F 527a_100011218483_100000210951 [0,2,0,0,0,0|1,0,0]=3 22922 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)I 11a_100011218483_100000688869 [0,2,0,0,0,0|1,0,0]=3 22923 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)I 240690a_100011218483_100000688869 [0,2,0,0,0,0|1,0,0]=3 22924 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)I 527a_100011218483_100000688869 [0,2,0,0,0,0|1,0,0]=3 22925 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)O 240690a_100011218483_100000198540 [0,2,0,0,0,0|1,0,0]=3 22926 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cc1)O 527a_100011218483_100000198540 [0,2,0,0,0,0|1,0,0]=3 22927 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)Br 11a_100011218483_100020629044 [0,2,0,0,0,0|2,0,0]=4 22928 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)Br 240690a_100011218483_100020629044 [0,2,0,0,0,0|2,0,0]=4 22929 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)C 11a_100011218483_100025705728 [0,2,0,0,0,0|2,0,0]=4 22930 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)C 240690a_100011218483_100025705728 [0,2,0,0,0,0|2,0,0]=4 22931 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)Cl 11a_100011218483_100000728320 [0,2,0,0,0,0|2,0,0]=4 22932 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)Cl 240690a_100011218483_100000728320 [0,2,0,0,0,0|2,0,0]=4 22933 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(cn1)Cl 527a_100011218483_100000728320 [0,2,0,0,0,0|2,0,0]=4 22934 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Br 11a_100011218483_100010067268 [0,2,0,0,0,0|2,0,0]=4 22935 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Br 240690a_100011218483_100010067268 [0,2,0,0,0,0|2,0,0]=4 22936 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Br 527a_100011218483_100010067268 [0,2,0,0,0,0|2,0,0]=4 22937 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)C 11a_100011218483_100000740413 [0,2,0,0,0,0|2,0,0]=4 22938 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)C 240690a_100011218483_100000740413 [0,2,0,0,0,0|2,0,0]=4 22939 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)C 527a_100011218483_100000740413 [0,2,0,0,0,0|2,0,0]=4 22940 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Cl 11a_100011218483_100000061944 [0,2,0,0,0,0|2,0,0]=4 22941 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Cl 240690a_100011218483_100000061944 [0,2,0,0,0,0|2,0,0]=4 22942 B16R1.1147 CCC(O)CNC(=O)Cc1ccc(nc1)Cl 527a_100011218483_100000061944 [0,2,0,0,0,0|2,0,0]=4 22943 B16R1.1147 CCC(O)CNC(=O)Cn1ccc(=O)cc1 11a_100011218483_200000238563 [0,2,0,0,0,0|2,0,0]=4 22944 B16R1.1147 CCC(O)CNC(=O)Cn1ccc(=O)cc1 240690a_100011218483_200000238563 [0,2,0,0,0,0|2,0,0]=4 22945 B16R1.1147 CCC(O)CNC(=O)Cn1ccc(=O)cc1 527a_100011218483_200000238563 [0,2,0,0,0,0|2,0,0]=4 22946 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100011218483 [0,2,0,0,0,0|2,0,0]=4 22947 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100011218483 [0,2,0,0,0,0|2,0,0]=4 22948 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100011218483 [0,2,0,0,0,0|2,0,0]=4 22949 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100011218483 [0,2,0,0,0,0|2,0,0]=4 22950 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100011218483 [0,2,0,0,0,0|2,0,0]=4 22951 B16R1.1147 CCC(O)CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100011218483 [0,2,0,0,0,0|2,0,0]=4 22952 B16R1.1147 CCC(O)COC(C)Cc1ccc(cc1)F 34a_100011351027_100011218378 [0,2,0,0,0,0|1,0,1]=4 22953 B16R1.1147 CCC(O)COC(C)Cc1ccc(cc1)F 7a_100011351027_100011218378 [0,2,0,0,0,0|1,0,1]=4 22954 B16R1.1147 CCN(C)CCC(=O)Cc1ccc(cc1)Br 1458a_100000755305_100000189115 [0,2,0,0,0,0|2,0,0]=4 22955 B16R1.1147 CCN(C)CCC(=O)Cc1ccc(cc1)C 1458a_100000755305_100000210814 [0,2,0,0,0,0|2,0,0]=4 22956 B16R1.1147 CCN(C)CCC(=O)Cc1ccc(cc1)Cl 1458a_100000755305_100000694040 [0,2,0,0,0,0|2,0,0]=4 22957 B16R1.1147 CCN(C)CCC(=O)Cc1ccc(cc1)F 1458a_100000755305_100000198546 [0,2,0,0,0,0|2,0,0]=4 22958 B16R1.1147 CCN(C)CCC(=O)Cc1ccc(cc1)I 1458a_100000755305_100000189116 [0,2,0,0,0,0|2,0,0]=4 22959 B16R1.1147 CCS(=O)CCC(=O)Cc1ccc(cc1)Br 1458a_100011387550_100000189115 [0,2,0,0,0,0|2,0,0]=4 22960 B16R1.1147 CCS(=O)CCC(=O)Cc1ccc(cc1)C 1458a_100011387550_100000210814 [0,2,0,0,0,0|2,0,0]=4 22961 B16R1.1147 CCS(=O)CCC(=O)Cc1ccc(cc1)Cl 1458a_100011387550_100000694040 [0,2,0,0,0,0|2,0,0]=4 22962 B16R1.1147 CCS(=O)CCC(=O)Cc1ccc(cc1)F 1458a_100011387550_100000198546 [0,2,0,0,0,0|2,0,0]=4 22963 B16R1.1147 CCS(=O)CCC(=O)Cc1ccc(cc1)I 1458a_100011387550_100000189116 [0,2,0,0,0,0|2,0,0]=4 22964 B16R1.1147 CC[C@H](C)COC(C)Cc1ccc(cc1)F 34a_100011351027_100009816398 [0,2,0,0,0,0|1,0,1]=4 22965 B16R1.1147 CC[C@H](C)COC(C)Cc1ccc(cc1)F 7a_100011351027_100009816398 [0,2,0,0,0,0|1,0,1]=4 22966 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Br 11a_100020591295_100000198978 [0,2,0,0,0,0|2,0,0]=4 22967 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Br 240690a_100020591295_100000198978 [0,2,0,0,0,0|2,0,0]=4 22968 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Br 527a_100020591295_100000198978 [0,2,0,0,0,0|2,0,0]=4 22969 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)C 11a_100020591295_100000212244 [0,2,0,0,0,0|2,0,0]=4 22970 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)C 240690a_100020591295_100000212244 [0,2,0,0,0,0|2,0,0]=4 22971 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)C 527a_100020591295_100000212244 [0,2,0,0,0,0|2,0,0]=4 22972 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Cl 11a_100020591295_100000211027 [0,2,0,0,0,0|2,0,0]=4 22973 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Cl 240690a_100020591295_100000211027 [0,2,0,0,0,0|2,0,0]=4 22974 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)Cl 527a_100020591295_100000211027 [0,2,0,0,0,0|2,0,0]=4 22975 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F 11a_100020591295_100000210951 [0,2,0,0,0,0|2,0,0]=4 22976 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F 1626a_100020591295_100000210951 [0,2,0,0,0,0|2,0,0]=4 22977 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F 240690a_100020591295_100000210951 [0,2,0,0,0,0|2,0,0]=4 22978 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)F 527a_100020591295_100000210951 [0,2,0,0,0,0|2,0,0]=4 22979 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)I 11a_100020591295_100000688869 [0,2,0,0,0,0|2,0,0]=4 22980 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)I 1626a_100020591295_100000688869 [0,2,0,0,0,0|2,0,0]=4 22981 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)I 240690a_100020591295_100000688869 [0,2,0,0,0,0|2,0,0]=4 22982 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)I 527a_100020591295_100000688869 [0,2,0,0,0,0|2,0,0]=4 22983 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O 1626a_100020591295_100000198540 [0,2,0,0,0,0|2,0,0]=4 22984 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O 240690a_100020591295_100000198540 [0,2,0,0,0,0|2,0,0]=4 22985 B16R1.1147 CO[C@H](C)CNC(=O)Cc1ccc(cc1)O 527a_100020591295_100000198540 [0,2,0,0,0,0|2,0,0]=4 22986 B16R1.1147 Cc1ccc(cc1)CC(=O)NCC(C)CO 240690a_100000744482_100000212244 [0,2,0,0,0,0|2,0,0]=4 22987 B16R1.1147 Cc1ccc(cc1)CC(=O)NCC(C)CO 527a_100000744482_100000212244 [0,2,0,0,0,0|2,0,0]=4 22988 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@@H](F)CO 240690a_100015665980_100000212244 [0,2,0,0,0,0|2,0,0]=4 22989 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@@H](F)CO 527a_100015665980_100000212244 [0,2,0,0,0,0|2,0,0]=4 22990 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100000212244 [0,2,0,0,0,0|2,0,0]=4 22991 B16R1.1147 Cc1ccc(cc1)CC(=O)NC[C@H](O)CO 527a_100020644852_100000212244 [0,2,0,0,0,0|2,0,0]=4 22992 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@@H](F)CO 240690a_100015665980_100000198978 [0,2,0,0,0,0|2,0,0]=4 22993 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@@H](F)CO 527a_100015665980_100000198978 [0,2,0,0,0,0|2,0,0]=4 22994 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@H](O)CO 240690a_100020644852_100000198978 [0,2,0,0,0,0|2,0,0]=4 22995 B16R1.1147 O=C(Cc1ccc(cc1)Br)NC[C@H](O)CO 527a_100020644852_100000198978 [0,2,0,0,0,0|2,0,0]=4 22996 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@@H](F)CO 240690a_100015665980_100000211027 [0,2,0,0,0,0|2,0,0]=4 22997 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@@H](F)CO 527a_100015665980_100000211027 [0,2,0,0,0,0|2,0,0]=4 22998 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@H](O)CO 240690a_100020644852_100000211027 [0,2,0,0,0,0|2,0,0]=4 22999 B16R1.1147 O=C(Cc1ccc(cc1)Cl)NC[C@H](O)CO 527a_100020644852_100000211027 [0,2,0,0,0,0|2,0,0]=4 23000 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@@H](F)CO 240690a_100015665980_100000210951 [0,2,0,0,0,0|2,0,0]=4 23001 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@@H](F)CO 527a_100015665980_100000210951 [0,2,0,0,0,0|2,0,0]=4 23002 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@H](O)CO 240690a_100020644852_100000210951 [0,2,0,0,0,0|2,0,0]=4 23003 B16R1.1147 O=C(Cc1ccc(cc1)F)NC[C@H](O)CO 527a_100020644852_100000210951 [0,2,0,0,0,0|2,0,0]=4 23004 B16R1.1147 O=C(Cc1ccc(cc1)I)NC[C@@H](F)CO 240690a_100015665980_100000688869 [0,2,0,0,0,0|2,0,0]=4 23005 B16R1.1147 O=C(Cc1ccc(cc1)I)NC[C@@H](F)CO 527a_100015665980_100000688869 [0,2,0,0,0,0|2,0,0]=4 23006 B16R1.1147 O=C(Cc1ccc(cc1)I)NC[C@H](O)CO 240690a_100020644852_100000688869 [0,2,0,0,0,0|2,0,0]=4 23007 B16R1.1147 O=C(Cc1ccc(cc1)I)NC[C@H](O)CO 527a_100020644852_100000688869 [0,2,0,0,0,0|2,0,0]=4 23008 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@@H](F)CO 240690a_100015665980_100000198540 [0,2,0,0,0,0|2,0,0]=4 23009 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@@H](F)CO 527a_100015665980_100000198540 [0,2,0,0,0,0|2,0,0]=4 23010 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@H](O)CO 240690a_100020644852_100000198540 [0,2,0,0,0,0|2,0,0]=4 23011 B16R1.1147 O=C(Cc1ccc(cc1)O)NC[C@H](O)CO 527a_100020644852_100000198540 [0,2,0,0,0,0|2,0,0]=4 23012 B16R1.1230 CCCCOC(C#N)Cc1ccc(cc1)C 34a_100000210227_100000697087 [0,2,0,0,0,0|1,0,1]=4 23013 B16R1.1230 CCCCOC(C#N)Cc1ccc(cc1)C 7a_100000210227_100000697087 [0,2,0,0,0,0|1,0,1]=4 23014 B16R1.7382 C#Cc1ccc(cc1)CC(=O)C#CCCC 1458a_200011218047_100000140223 [0,2,0,0,0,0|1,0,1]=4 23015 B16R1.7382 C#Cc1ccc(cc1)CC(=O)C=CCCC 1458a_100000212230_100000140223 [0,2,0,0,0,0|1,0,1]=4 23016 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCCC 1458a_100000212188_100000140223 [0,2,0,0,0,0|1,0,0]=3 23017 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCCC 1458a_200009884166_100000210326 [0,2,0,0,0,0|1,0,0]=3 23018 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCCF 1458a_200009884166_100000729493 [0,2,0,0,0,0|2,0,0]=4 23019 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000140223 [0,2,0,0,0,0|2,0,0]=4 23020 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCCO 1458a_200009884166_100000210776 [0,2,0,0,0,0|2,0,0]=4 23021 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCOC 1458a_100000741012_100000140223 [0,2,0,0,0,0|2,0,0]=4 23022 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCOC 1458a_200009884166_100000740836 [0,2,0,0,0,0|2,0,0]=4 23023 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCCSC 1458a_100000173376_100000140223 [0,2,0,0,0,0|2,0,0]=4 23024 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCOCC 1458a_100000749530_100000140223 [0,2,0,0,0,0|2,0,0]=4 23025 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCOCC 1458a_200009884166_100011215890 [0,2,0,0,0,0|2,0,0]=4 23026 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCSCC 1458a_100000230768_100000140223 [0,2,0,0,0,0|2,0,0]=4 23027 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CCSCC 1458a_200009884166_100000757381 [0,2,0,0,0,0|2,0,0]=4 23028 B16R1.7382 C#Cc1ccc(cc1)CC(=O)COCCC 1458a_100000745993_100000140223 [0,2,0,0,0,0|2,0,0]=4 23029 B16R1.7382 C#Cc1ccc(cc1)CC(=O)CSCCC 1458a_100000217233_100000140223 [0,2,0,0,0,0|2,0,0]=4 23030 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCC 11a_100000102301_200009884166 [0,2,0,0,0,0|1,0,0]=3 23031 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCC 1626a_100000102301_200009884166 [0,2,0,0,0,0|1,0,0]=3 23032 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCC 240690a_100000102301_200009884166 [0,2,0,0,0,0|1,0,0]=3 23033 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCC 527a_100000102301_200009884166 [0,2,0,0,0,0|1,0,0]=3 23034 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_200009884166 [0,2,0,0,0,0|2,0,0]=4 23035 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCF 1626a_100015189416_200009884166 [0,2,0,0,0,0|2,0,0]=4 23036 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_200009884166 [0,2,0,0,0,0|2,0,0]=4 23037 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_200009884166 [0,2,0,0,0,0|2,0,0]=4 23038 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_200009884166 [0,2,0,0,0,0|2,0,0]=4 23039 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_200009884166 [0,2,0,0,0,0|2,0,0]=4 23040 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCOC 1626a_100000209980_200009884166 [0,2,0,0,0,0|2,0,0]=4 23041 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCOC 240690a_100000209980_200009884166 [0,2,0,0,0,0|2,0,0]=4 23042 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCOC 527a_100000209980_200009884166 [0,2,0,0,0,0|2,0,0]=4 23043 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCSC 11a_100020590264_200009884166 [0,2,0,0,0,0|2,0,0]=4 23044 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCSC 1626a_100020590264_200009884166 [0,2,0,0,0,0|2,0,0]=4 23045 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCSC 240690a_100020590264_200009884166 [0,2,0,0,0,0|2,0,0]=4 23046 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NCCSC 527a_100020590264_200009884166 [0,2,0,0,0,0|2,0,0]=4 23047 B16R1.7382 C#Cc1ccc(cc1)CC(=O)NNCCC 22a_100000740057_200009884166 [0,2,0,0,0,0|2,0,0]=4 23048 B16R1.7382 C#Cc1ccc(cc1)NC(=O)CCCCC 11a_100011215031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23049 B16R1.7382 C#Cc1ccc(cc1)NC(=O)CCCCC 1626a_100011215031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23050 B16R1.7382 C#Cc1ccc(cc1)NC(=O)CCCCC 22a_100011215031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23051 B16R1.7382 C#Cc1ccc(cc1)NC(=O)CCCCC 527a_100011215031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23052 B16R1.7382 C#Cc1ccc(cc1)NC(=O)NCCCC 2430a_100011215031_100000102301 [0,2,0,0,0,0|2,0,0]=4 23053 B16R1.7382 C#Cc1ccc(cc1)NC(=O)NCCCC 512a_100011215031_100000102301 [0,2,0,0,0,0|2,0,0]=4 23054 B16R1.7382 C=Cc1ccc(cc1)CC(=O)C#CCCC 1458a_200011218047_100000034074 [0,2,0,0,0,0|1,0,1]=4 23055 B16R1.7382 C=Cc1ccc(cc1)CC(=O)C=CCCC 1458a_100000212230_100000034074 [0,2,0,0,0,0|1,0,1]=4 23056 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCCCC 1458a_100000212188_100000034074 [0,2,0,0,0,0|1,0,0]=3 23057 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000034074 [0,2,0,0,0,0|2,0,0]=4 23058 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCCOC 1458a_100000741012_100000034074 [0,2,0,0,0,0|2,0,0]=4 23059 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCCSC 1458a_100000173376_100000034074 [0,2,0,0,0,0|2,0,0]=4 23060 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCOCC 1458a_100000749530_100000034074 [0,2,0,0,0,0|2,0,0]=4 23061 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CCSCC 1458a_100000230768_100000034074 [0,2,0,0,0,0|2,0,0]=4 23062 B16R1.7382 C=Cc1ccc(cc1)CC(=O)COCCC 1458a_100000745993_100000034074 [0,2,0,0,0,0|2,0,0]=4 23063 B16R1.7382 C=Cc1ccc(cc1)CC(=O)CSCCC 1458a_100000217233_100000034074 [0,2,0,0,0,0|2,0,0]=4 23064 B16R1.7382 C=Cc1ccc(cc1)NC(=O)CCCCC 11a_100011218248_100000212188 [0,2,0,0,0,0|2,0,0]=4 23065 B16R1.7382 C=Cc1ccc(cc1)NC(=O)CCCCC 1626a_100011218248_100000212188 [0,2,0,0,0,0|2,0,0]=4 23066 B16R1.7382 C=Cc1ccc(cc1)NC(=O)CCCCC 22a_100011218248_100000212188 [0,2,0,0,0,0|2,0,0]=4 23067 B16R1.7382 C=Cc1ccc(cc1)NC(=O)CCCCC 527a_100011218248_100000212188 [0,2,0,0,0,0|2,0,0]=4 23068 B16R1.7382 C=Cc1ccc(cc1)NC(=O)NCCCC 2430a_100011218248_100000102301 [0,2,0,0,0,0|2,0,0]=4 23069 B16R1.7382 C=Cc1ccc(cc1)NC(=O)NCCCC 271570a_100011290941_200000163291 [0,2,0,0,0,0|2,0,0]=4 23070 B16R1.7382 CCCC#CC(=O)Cc1ccc(cc1)C#N 1458a_200011218047_100000184898 [0,2,0,0,0,0|1,0,1]=4 23071 B16R1.7382 CCCC#CC(=O)Cc1ccc(cc1)C=O 1458a_200011218047_100000075337 [0,2,0,0,0,0|1,0,1]=4 23072 B16R1.7382 CCCC#CC(=O)Cc1ccc(cc1)CC 1458a_200011218047_100000747183 [0,2,0,0,0,0|1,0,1]=4 23073 B16R1.7382 CCCC#CC(=O)Cc1ccc(cc1)CO 1458a_200011218047_100000067286 [0,2,0,0,0,0|1,0,1]=4 23074 B16R1.7382 CCCC#CC(=O)Cc1ccc(cc1)SC 1458a_200011218047_100000181263 [0,2,0,0,0,0|1,0,1]=4 23075 B16R1.7382 CCCC=CC(=O)Cc1ccc(cc1)C#N 1458a_100000212230_100000184898 [0,2,0,0,0,0|1,0,1]=4 23076 B16R1.7382 CCCC=CC(=O)Cc1ccc(cc1)C=O 1458a_100000212230_100000075337 [0,2,0,0,0,0|1,0,1]=4 23077 B16R1.7382 CCCC=CC(=O)Cc1ccc(cc1)CC 1458a_100000212230_100000747183 [0,2,0,0,0,0|1,0,1]=4 23078 B16R1.7382 CCCC=CC(=O)Cc1ccc(cc1)CO 1458a_100000212230_100000067286 [0,2,0,0,0,0|1,0,1]=4 23079 B16R1.7382 CCCC=CC(=O)Cc1ccc(cc1)SC 1458a_100000212230_100000181263 [0,2,0,0,0,0|1,0,1]=4 23080 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)C#N 1458a_100000212188_100000184898 [0,2,0,0,0,0|1,0,0]=3 23081 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210326 [0,2,0,0,0,0|1,0,0]=3 23082 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)C=O 1458a_100000212188_100000075337 [0,2,0,0,0,0|1,0,0]=3 23083 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)CC 1458a_100000212188_100000747183 [0,2,0,0,0,0|1,0,0]=3 23084 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210326 [0,2,0,0,0,0|1,0,0]=3 23085 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)CO 1458a_100000212188_100000067286 [0,2,0,0,0,0|1,0,0]=3 23086 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210326 [0,2,0,0,0,0|1,0,0]=3 23087 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210326 [0,2,0,0,0,0|1,0,0]=3 23088 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)SC 1458a_100000212188_100000181263 [0,2,0,0,0,0|1,0,0]=3 23089 B16R1.7382 CCCCCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210326 [0,2,0,0,0,0|1,0,0]=3 23090 B16R1.7382 CCCCCC(=O)Cc1ccc(cn1)C#N 1458a_100000212188_100000693164 [0,2,0,0,0,0|2,0,0]=4 23091 B16R1.7382 CCCCCC(=O)Cc1ccc(cn1)OC 1458a_100000212188_200000757186 [0,2,0,0,0,0|2,0,0]=4 23092 B16R1.7382 CCCCCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000210326 [0,2,0,0,0,0|2,0,0]=4 23093 B16R1.7382 CCCCCC(=O)Cc1ccc(nc1)C#N 1458a_100000212188_100009816919 [0,2,0,0,0,0|2,0,0]=4 23094 B16R1.7382 CCCCCC(=O)Cc1ccc(nc1)OC 1458a_100000212188_100020631284 [0,2,0,0,0,0|2,0,0]=4 23095 B16R1.7382 CCCCCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000210326 [0,2,0,0,0,0|2,0,0]=4 23096 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100000212188 [0,2,0,0,0,0|2,0,0]=4 23097 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100000212188 [0,2,0,0,0,0|2,0,0]=4 23098 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000212188 [0,2,0,0,0,0|2,0,0]=4 23099 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000212188 [0,2,0,0,0,0|2,0,0]=4 23100 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000212188 [0,2,0,0,0,0|2,0,0]=4 23101 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000212188 [0,2,0,0,0,0|2,0,0]=4 23102 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000212188 [0,2,0,0,0,0|2,0,0]=4 23103 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000212188 [0,2,0,0,0,0|2,0,0]=4 23104 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000212188 [0,2,0,0,0,0|2,0,0]=4 23105 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000212188 [0,2,0,0,0,0|2,0,0]=4 23106 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000212188 [0,2,0,0,0,0|2,0,0]=4 23107 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000212188 [0,2,0,0,0,0|2,0,0]=4 23108 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000212188 [0,2,0,0,0,0|2,0,0]=4 23109 B16R1.7382 CCCCCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000212188 [0,2,0,0,0,0|2,0,0]=4 23110 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N 11a_100000102301_100000748677 [0,2,0,0,0,0|1,0,0]=3 23111 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N 1626a_100000102301_100000748677 [0,2,0,0,0,0|1,0,0]=3 23112 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N 240690a_100000102301_100000748677 [0,2,0,0,0,0|1,0,0]=3 23113 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)C#N 527a_100000102301_100000748677 [0,2,0,0,0,0|1,0,0]=3 23114 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)CC 11a_100000102301_200000759805 [0,2,0,0,0,0|1,0,0]=3 23115 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)CC 1626a_100000102301_200000759805 [0,2,0,0,0,0|1,0,0]=3 23116 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)CC 240690a_100000102301_200000759805 [0,2,0,0,0,0|1,0,0]=3 23117 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)CC 527a_100000102301_200000759805 [0,2,0,0,0,0|1,0,0]=3 23118 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)CO 240690a_100000102301_100011356463 [0,2,0,0,0,0|1,0,0]=3 23119 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)OC 11a_100000102301_100000210706 [0,2,0,0,0,0|1,0,0]=3 23120 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)OC 240690a_100000102301_100000210706 [0,2,0,0,0,0|1,0,0]=3 23121 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)OC 527a_100000102301_100000210706 [0,2,0,0,0,0|1,0,0]=3 23122 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC 11a_100000102301_100000756958 [0,2,0,0,0,0|1,0,0]=3 23123 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC 1626a_100000102301_100000756958 [0,2,0,0,0,0|1,0,0]=3 23124 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC 240690a_100000102301_100000756958 [0,2,0,0,0,0|1,0,0]=3 23125 B16R1.7382 CCCCNC(=O)Cc1ccc(cc1)SC 527a_100000102301_100000756958 [0,2,0,0,0,0|1,0,0]=3 23126 B16R1.7382 CCCCNC(=O)Cc1ccc(cn1)OC 11a_100000102301_100000722272 [0,2,0,0,0,0|2,0,0]=4 23127 B16R1.7382 CCCCNC(=O)Cc1ccc(cn1)OC 240690a_100000102301_100000722272 [0,2,0,0,0,0|2,0,0]=4 23128 B16R1.7382 CCCCNC(=O)Cc1ccc(cn1)OC 527a_100000102301_100000722272 [0,2,0,0,0,0|2,0,0]=4 23129 B16R1.7382 CCCCNC(=O)Cc1ccc(nc1)OC 11a_100000102301_100012001117 [0,2,0,0,0,0|2,0,0]=4 23130 B16R1.7382 CCCCNC(=O)Cc1ccc(nc1)OC 240690a_100000102301_100012001117 [0,2,0,0,0,0|2,0,0]=4 23131 B16R1.7382 CCCCNC(=O)Cc1ccc(nc1)OC 527a_100000102301_100012001117 [0,2,0,0,0,0|2,0,0]=4 23132 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)C#N 2430a_100000185469_100000102301 [0,2,0,0,0,0|2,0,0]=4 23133 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)CC 2430a_100000211069_100000102301 [0,2,0,0,0,0|2,0,0]=4 23134 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)CO 2430a_100011215238_100000102301 [0,2,0,0,0,0|2,0,0]=4 23135 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100000102301 [0,2,0,0,0,0|2,0,0]=4 23136 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100000102301 [0,2,0,0,0,0|2,0,0]=4 23137 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)SC 62a_200000210301_200000163291 [0,2,0,0,0,0|2,0,0]=4 23138 B16R1.7382 CCCCNC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_200000163291 [0,2,0,0,0,0|2,0,0]=4 23139 B16R1.7382 CCCNNC(=O)Cc1ccc(cc1)C#N 22a_100000740057_100000748677 [0,2,0,0,0,0|2,0,0]=4 23140 B16R1.7382 CCCNNC(=O)Cc1ccc(cc1)CC 22a_100000740057_200000759805 [0,2,0,0,0,0|2,0,0]=4 23141 B16R1.7382 CCCNNC(=O)Cc1ccc(cc1)CO 22a_100000740057_100011356463 [0,2,0,0,0,0|2,0,0]=4 23142 B16R1.7382 CCCNNC(=O)Cc1ccc(cc1)OC 22a_100000740057_100000210706 [0,2,0,0,0,0|2,0,0]=4 23143 B16R1.7382 CCCNNC(=O)Cc1ccc(cc1)SC 22a_100000740057_100000756958 [0,2,0,0,0,0|2,0,0]=4 23144 B16R1.7382 CCCOCC(=O)Cc1ccc(cc1)C#N 1458a_100000745993_100000184898 [0,2,0,0,0,0|2,0,0]=4 23145 B16R1.7382 CCCOCC(=O)Cc1ccc(cc1)C=O 1458a_100000745993_100000075337 [0,2,0,0,0,0|2,0,0]=4 23146 B16R1.7382 CCCOCC(=O)Cc1ccc(cc1)CC 1458a_100000745993_100000747183 [0,2,0,0,0,0|2,0,0]=4 23147 B16R1.7382 CCCOCC(=O)Cc1ccc(cc1)CO 1458a_100000745993_100000067286 [0,2,0,0,0,0|2,0,0]=4 23148 B16R1.7382 CCCOCC(=O)Cc1ccc(cc1)SC 1458a_100000745993_100000181263 [0,2,0,0,0,0|2,0,0]=4 23149 B16R1.7382 CCCSCC(=O)Cc1ccc(cc1)C#N 1458a_100000217233_100000184898 [0,2,0,0,0,0|2,0,0]=4 23150 B16R1.7382 CCCSCC(=O)Cc1ccc(cc1)C=O 1458a_100000217233_100000075337 [0,2,0,0,0,0|2,0,0]=4 23151 B16R1.7382 CCCSCC(=O)Cc1ccc(cc1)CC 1458a_100000217233_100000747183 [0,2,0,0,0,0|2,0,0]=4 23152 B16R1.7382 CCCSCC(=O)Cc1ccc(cc1)CO 1458a_100000217233_100000067286 [0,2,0,0,0,0|2,0,0]=4 23153 B16R1.7382 CCCSCC(=O)Cc1ccc(cc1)SC 1458a_100000217233_100000181263 [0,2,0,0,0,0|2,0,0]=4 23154 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100011215890 [0,2,0,0,0,0|2,0,0]=4 23155 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)C#N 1458a_100000749530_100000184898 [0,2,0,0,0,0|2,0,0]=4 23156 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)C=O 1458a_100000749530_100000075337 [0,2,0,0,0,0|2,0,0]=4 23157 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)CC 1458a_100000749530_100000747183 [0,2,0,0,0,0|2,0,0]=4 23158 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100011215890 [0,2,0,0,0,0|2,0,0]=4 23159 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)CO 1458a_100000749530_100000067286 [0,2,0,0,0,0|2,0,0]=4 23160 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100011215890 [0,2,0,0,0,0|2,0,0]=4 23161 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100011215890 [0,2,0,0,0,0|2,0,0]=4 23162 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)SC 1458a_100000749530_100000181263 [0,2,0,0,0,0|2,0,0]=4 23163 B16R1.7382 CCOCCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100011215890 [0,2,0,0,0,0|2,0,0]=4 23164 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)C#N 1458a_100000230768_100000184898 [0,2,0,0,0,0|2,0,0]=4 23165 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000757381 [0,2,0,0,0,0|2,0,0]=4 23166 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)C=O 1458a_100000230768_100000075337 [0,2,0,0,0,0|2,0,0]=4 23167 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)CC 1458a_100000230768_100000747183 [0,2,0,0,0,0|2,0,0]=4 23168 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000757381 [0,2,0,0,0,0|2,0,0]=4 23169 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)CO 1458a_100000230768_100000067286 [0,2,0,0,0,0|2,0,0]=4 23170 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000757381 [0,2,0,0,0,0|2,0,0]=4 23171 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000757381 [0,2,0,0,0,0|2,0,0]=4 23172 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)SC 1458a_100000230768_100000181263 [0,2,0,0,0,0|2,0,0]=4 23173 B16R1.7382 CCSCCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000757381 [0,2,0,0,0,0|2,0,0]=4 23174 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCCF 1458a_200000759805_100000729493 [0,2,0,0,0,0|2,0,0]=4 23175 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000747183 [0,2,0,0,0,0|2,0,0]=4 23176 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCCO 1458a_200000759805_100000210776 [0,2,0,0,0,0|2,0,0]=4 23177 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCOC 1458a_100000741012_100000747183 [0,2,0,0,0,0|2,0,0]=4 23178 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCOC 1458a_200000759805_100000740836 [0,2,0,0,0,0|2,0,0]=4 23179 B16R1.7382 CCc1ccc(cc1)CC(=O)CCCSC 1458a_100000173376_100000747183 [0,2,0,0,0,0|2,0,0]=4 23180 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_200000759805 [0,2,0,0,0,0|2,0,0]=4 23181 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCF 1626a_100015189416_200000759805 [0,2,0,0,0,0|2,0,0]=4 23182 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_200000759805 [0,2,0,0,0,0|2,0,0]=4 23183 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_200000759805 [0,2,0,0,0,0|2,0,0]=4 23184 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_200000759805 [0,2,0,0,0,0|2,0,0]=4 23185 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_200000759805 [0,2,0,0,0,0|2,0,0]=4 23186 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCOC 1626a_100000209980_200000759805 [0,2,0,0,0,0|2,0,0]=4 23187 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCOC 240690a_100000209980_200000759805 [0,2,0,0,0,0|2,0,0]=4 23188 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCOC 527a_100000209980_200000759805 [0,2,0,0,0,0|2,0,0]=4 23189 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCSC 11a_100020590264_200000759805 [0,2,0,0,0,0|2,0,0]=4 23190 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCSC 1626a_100020590264_200000759805 [0,2,0,0,0,0|2,0,0]=4 23191 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCSC 240690a_100020590264_200000759805 [0,2,0,0,0,0|2,0,0]=4 23192 B16R1.7382 CCc1ccc(cc1)CC(=O)NCCSC 527a_100020590264_200000759805 [0,2,0,0,0,0|2,0,0]=4 23193 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)C#N 1458a_100000741012_100000184898 [0,2,0,0,0,0|2,0,0]=4 23194 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000740836 [0,2,0,0,0,0|2,0,0]=4 23195 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)C=O 1458a_100000741012_100000075337 [0,2,0,0,0,0|2,0,0]=4 23196 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)CO 1458a_100000741012_100000067286 [0,2,0,0,0,0|2,0,0]=4 23197 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000740836 [0,2,0,0,0,0|2,0,0]=4 23198 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000740836 [0,2,0,0,0,0|2,0,0]=4 23199 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)SC 1458a_100000741012_100000181263 [0,2,0,0,0,0|2,0,0]=4 23200 B16R1.7382 COCCCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000740836 [0,2,0,0,0,0|2,0,0]=4 23201 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)C#N 1626a_100000209980_100000748677 [0,2,0,0,0,0|2,0,0]=4 23202 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)C#N 240690a_100000209980_100000748677 [0,2,0,0,0,0|2,0,0]=4 23203 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)C#N 527a_100000209980_100000748677 [0,2,0,0,0,0|2,0,0]=4 23204 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)CO 240690a_100000209980_100011356463 [0,2,0,0,0,0|2,0,0]=4 23205 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)OC 240690a_100000209980_100000210706 [0,2,0,0,0,0|2,0,0]=4 23206 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)OC 527a_100000209980_100000210706 [0,2,0,0,0,0|2,0,0]=4 23207 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)SC 1626a_100000209980_100000756958 [0,2,0,0,0,0|2,0,0]=4 23208 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)SC 240690a_100000209980_100000756958 [0,2,0,0,0,0|2,0,0]=4 23209 B16R1.7382 COCCNC(=O)Cc1ccc(cc1)SC 527a_100000209980_100000756958 [0,2,0,0,0,0|2,0,0]=4 23210 B16R1.7382 COc1ccc(cc1)CC(=O)CCCCF 1458a_100000210706_100000729493 [0,2,0,0,0,0|2,0,0]=4 23211 B16R1.7382 COc1ccc(cc1)CC(=O)CCCCO 1458a_100000210706_100000210776 [0,2,0,0,0,0|2,0,0]=4 23212 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_100000210706 [0,2,0,0,0,0|2,0,0]=4 23213 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_100000210706 [0,2,0,0,0,0|2,0,0]=4 23214 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_100000210706 [0,2,0,0,0,0|2,0,0]=4 23215 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_100000210706 [0,2,0,0,0,0|2,0,0]=4 23216 B16R1.7382 COc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_100000210706 [0,2,0,0,0,0|2,0,0]=4 23217 B16R1.7382 COc1ccc(cc1)CC(=O)NCCSC 11a_100020590264_100000210706 [0,2,0,0,0,0|2,0,0]=4 23218 B16R1.7382 COc1ccc(cc1)CC(=O)NCCSC 240690a_100020590264_100000210706 [0,2,0,0,0,0|2,0,0]=4 23219 B16R1.7382 COc1ccc(cc1)CC(=O)NCCSC 527a_100020590264_100000210706 [0,2,0,0,0,0|2,0,0]=4 23220 B16R1.7382 CSCCCC(=O)Cc1ccc(cc1)C#N 1458a_100000173376_100000184898 [0,2,0,0,0,0|2,0,0]=4 23221 B16R1.7382 CSCCCC(=O)Cc1ccc(cc1)C=O 1458a_100000173376_100000075337 [0,2,0,0,0,0|2,0,0]=4 23222 B16R1.7382 CSCCCC(=O)Cc1ccc(cc1)CO 1458a_100000173376_100000067286 [0,2,0,0,0,0|2,0,0]=4 23223 B16R1.7382 CSCCCC(=O)Cc1ccc(cc1)SC 1458a_100000173376_100000181263 [0,2,0,0,0,0|2,0,0]=4 23224 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N 11a_100020590264_100000748677 [0,2,0,0,0,0|2,0,0]=4 23225 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N 1626a_100020590264_100000748677 [0,2,0,0,0,0|2,0,0]=4 23226 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N 240690a_100020590264_100000748677 [0,2,0,0,0,0|2,0,0]=4 23227 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)C#N 527a_100020590264_100000748677 [0,2,0,0,0,0|2,0,0]=4 23228 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)CO 240690a_100020590264_100011356463 [0,2,0,0,0,0|2,0,0]=4 23229 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC 11a_100020590264_100000756958 [0,2,0,0,0,0|2,0,0]=4 23230 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC 1626a_100020590264_100000756958 [0,2,0,0,0,0|2,0,0]=4 23231 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC 240690a_100020590264_100000756958 [0,2,0,0,0,0|2,0,0]=4 23232 B16R1.7382 CSCCNC(=O)Cc1ccc(cc1)SC 527a_100020590264_100000756958 [0,2,0,0,0,0|2,0,0]=4 23233 B16R1.7382 CSc1ccc(cc1)CC(=O)CCCCF 1458a_100000756958_100000729493 [0,2,0,0,0,0|2,0,0]=4 23234 B16R1.7382 CSc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000181263 [0,2,0,0,0,0|2,0,0]=4 23235 B16R1.7382 CSc1ccc(cc1)CC(=O)CCCCO 1458a_100000756958_100000210776 [0,2,0,0,0,0|2,0,0]=4 23236 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_100000756958 [0,2,0,0,0,0|2,0,0]=4 23237 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCF 1626a_100015189416_100000756958 [0,2,0,0,0,0|2,0,0]=4 23238 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_100000756958 [0,2,0,0,0,0|2,0,0]=4 23239 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_100000756958 [0,2,0,0,0,0|2,0,0]=4 23240 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_100000756958 [0,2,0,0,0,0|2,0,0]=4 23241 B16R1.7382 CSc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_100000756958 [0,2,0,0,0,0|2,0,0]=4 23242 B16R1.7382 N#Cc1ccc(cc1)CC(=O)CCCCF 1458a_100000748677_100000729493 [0,2,0,0,0,0|2,0,0]=4 23243 B16R1.7382 N#Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000184898 [0,2,0,0,0,0|2,0,0]=4 23244 B16R1.7382 N#Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000748677_100000210776 [0,2,0,0,0,0|2,0,0]=4 23245 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCF 11a_100015189416_100000748677 [0,2,0,0,0,0|2,0,0]=4 23246 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCF 1626a_100015189416_100000748677 [0,2,0,0,0,0|2,0,0]=4 23247 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCF 240690a_100015189416_100000748677 [0,2,0,0,0,0|2,0,0]=4 23248 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCF 527a_100015189416_100000748677 [0,2,0,0,0,0|2,0,0]=4 23249 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCO 240690a_100000182051_100000748677 [0,2,0,0,0,0|2,0,0]=4 23250 B16R1.7382 N#Cc1ccc(cc1)CC(=O)NCCCO 527a_100000182051_100000748677 [0,2,0,0,0,0|2,0,0]=4 23251 B16R1.7382 O=C(CCCCF)Cc1ccc(cc1)CO 1458a_100011356463_100000729493 [0,2,0,0,0,0|2,0,0]=4 23252 B16R1.7382 O=C(CCCCO)Cc1ccc(cc1)CO 1458a_100000695505_100000067286 [0,2,0,0,0,0|2,0,0]=4 23253 B16R1.7382 O=C(CCCCO)Cc1ccc(cc1)CO 1458a_100011356463_100000210776 [0,2,0,0,0,0|2,0,0]=4 23254 B16R1.7382 O=C(Cc1ccc(cc1)CO)NCCCF 240690a_100015189416_100011356463 [0,2,0,0,0,0|2,0,0]=4 23255 B16R1.7382 O=C(Cc1ccc(cc1)CO)NCCCO 240690a_100000182051_100011356463 [0,2,0,0,0,0|2,0,0]=4 23256 B16R1.7382 O=Cc1ccc(cc1)CC(=O)CCCCO 1458a_100000695505_100000075337 [0,2,0,0,0,0|2,0,0]=4 23257 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Br)Br 1458a_200011218047_100012353900 [0,2,0,0,0,0|1,0,1]=4 23258 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Br)C 1458a_200011218047_100012232412 [0,2,0,0,0,0|1,0,1]=4 23259 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_200011218047_100012353894 [0,2,0,0,0,0|1,0,1]=4 23260 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Br)F 1458a_200011218047_100011206884 [0,2,0,0,0,0|1,0,1]=4 23261 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)C)Br 1458a_200011218047_100000727479 [0,2,0,0,0,0|1,0,1]=4 23262 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)C)C 1458a_200011218047_100000742320 [0,2,0,0,0,0|1,0,1]=4 23263 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)C)Cl 1458a_200011218047_100012184735 [0,2,0,0,0,0|1,0,1]=4 23264 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)C)F 1458a_200011218047_100011216667 [0,2,0,0,0,0|1,0,1]=4 23265 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_200011218047_100012353895 [0,2,0,0,0,0|1,0,1]=4 23266 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Cl)C 1458a_200011218047_100011823929 [0,2,0,0,0,0|1,0,1]=4 23267 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_200011218047_100000184707 [0,2,0,0,0,0|1,0,1]=4 23268 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Cl)F 1458a_200011218047_100000717365 [0,2,0,0,0,0|1,0,1]=4 23269 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)Cl)I 1458a_200011218047_100012349665 [0,2,0,0,0,0|1,0,1]=4 23270 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)F)Br 1458a_200011218047_100000767054 [0,2,0,0,0,0|1,0,1]=4 23271 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)F)C 1458a_200011218047_100011217369 [0,2,0,0,0,0|1,0,1]=4 23272 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)F)Cl 1458a_200011218047_100000716492 [0,2,0,0,0,0|1,0,1]=4 23273 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)F)F 1458a_200011218047_100000757363 [0,2,0,0,0,0|1,0,1]=4 23274 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)F)I 1458a_200011218047_100010149604 [0,2,0,0,0,0|1,0,1]=4 23275 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)I)Br 1458a_200011218047_100010146616 [0,2,0,0,0,0|1,0,1]=4 23276 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)I)C 1458a_200011218047_100010206137 [0,2,0,0,0,0|1,0,1]=4 23277 B16R1.7393 CCCC#CC(=O)Cc1ccc(c(c1)I)F 1458a_200011218047_100010188208 [0,2,0,0,0,0|1,0,1]=4 23278 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000212230_100012353900 [0,2,0,0,0,0|1,0,1]=4 23279 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000212230_100012232412 [0,2,0,0,0,0|1,0,1]=4 23280 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000212230_100012353894 [0,2,0,0,0,0|1,0,1]=4 23281 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000212230_100011206884 [0,2,0,0,0,0|1,0,1]=4 23282 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000212230_100000727479 [0,2,0,0,0,0|1,0,1]=4 23283 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)C)C 1458a_100000212230_100000742320 [0,2,0,0,0,0|1,0,1]=4 23284 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000212230_100012184735 [0,2,0,0,0,0|1,0,1]=4 23285 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)C)F 1458a_100000212230_100011216667 [0,2,0,0,0,0|1,0,1]=4 23286 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000212230_100012353895 [0,2,0,0,0,0|1,0,1]=4 23287 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000212230_100011823929 [0,2,0,0,0,0|1,0,1]=4 23288 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000212230_100000184707 [0,2,0,0,0,0|1,0,1]=4 23289 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000212230_100000717365 [0,2,0,0,0,0|1,0,1]=4 23290 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000212230_100012349665 [0,2,0,0,0,0|1,0,1]=4 23291 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000212230_100000767054 [0,2,0,0,0,0|1,0,1]=4 23292 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)F)C 1458a_100000212230_100011217369 [0,2,0,0,0,0|1,0,1]=4 23293 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000212230_100000716492 [0,2,0,0,0,0|1,0,1]=4 23294 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)F)F 1458a_100000212230_100000757363 [0,2,0,0,0,0|1,0,1]=4 23295 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)F)I 1458a_100000212230_100010149604 [0,2,0,0,0,0|1,0,1]=4 23296 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000212230_100010146616 [0,2,0,0,0,0|1,0,1]=4 23297 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)I)C 1458a_100000212230_100010206137 [0,2,0,0,0,0|1,0,1]=4 23298 B16R1.7393 CCCC=CC(=O)Cc1ccc(c(c1)I)F 1458a_100000212230_100010188208 [0,2,0,0,0,0|1,0,1]=4 23299 B16R1.7393 CCCCCC(=O)Cc1cc(=O)c(co1)O 1458a_100000212188_100000010605 [0,2,0,0,0,0|2,0,0]=4 23300 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000212188_100012353900 [0,2,0,0,0,0|1,0,0]=3 23301 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000212188_100012232412 [0,2,0,0,0,0|1,0,0]=3 23302 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000210326 [0,2,0,0,0,0|1,0,0]=3 23303 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000212188_100012353894 [0,2,0,0,0,0|1,0,0]=3 23304 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210326 [0,2,0,0,0,0|1,0,0]=3 23305 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000212188_100011206884 [0,2,0,0,0,0|1,0,0]=3 23306 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210326 [0,2,0,0,0,0|1,0,0]=3 23307 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210326 [0,2,0,0,0,0|1,0,0]=3 23308 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000212188_100000727479 [0,2,0,0,0,0|1,0,0]=3 23309 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000210326 [0,2,0,0,0,0|1,0,0]=3 23310 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000210326 [0,2,0,0,0,0|1,0,0]=3 23311 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000212188_100000742320 [0,2,0,0,0,0|1,0,0]=3 23312 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000212188_100012184735 [0,2,0,0,0,0|1,0,0]=3 23313 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)F 1458a_100000212188_100011216667 [0,2,0,0,0,0|1,0,0]=3 23314 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000210326 [0,2,0,0,0,0|1,0,0]=3 23315 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210326 [0,2,0,0,0,0|1,0,0]=3 23316 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000212188_100012353895 [0,2,0,0,0,0|1,0,0]=3 23317 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210326 [0,2,0,0,0,0|1,0,0]=3 23318 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000212188_100011823929 [0,2,0,0,0,0|1,0,0]=3 23319 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210326 [0,2,0,0,0,0|1,0,0]=3 23320 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000212188_100000184707 [0,2,0,0,0,0|1,0,0]=3 23321 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000212188_100000717365 [0,2,0,0,0,0|1,0,0]=3 23322 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210326 [0,2,0,0,0,0|1,0,0]=3 23323 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000212188_100012349665 [0,2,0,0,0,0|1,0,0]=3 23324 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210326 [0,2,0,0,0,0|1,0,0]=3 23325 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000212188_100000767054 [0,2,0,0,0,0|1,0,0]=3 23326 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210326 [0,2,0,0,0,0|1,0,0]=3 23327 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)C 1458a_100000212188_100011217369 [0,2,0,0,0,0|1,0,0]=3 23328 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000210326 [0,2,0,0,0,0|1,0,0]=3 23329 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000212188_100000716492 [0,2,0,0,0,0|1,0,0]=3 23330 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210326 [0,2,0,0,0,0|1,0,0]=3 23331 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000212188_100000757363 [0,2,0,0,0,0|1,0,0]=3 23332 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210326 [0,2,0,0,0,0|1,0,0]=3 23333 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)I 1458a_100000212188_100010149604 [0,2,0,0,0,0|1,0,0]=3 23334 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210326 [0,2,0,0,0,0|1,0,0]=3 23335 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210326 [0,2,0,0,0,0|1,0,0]=3 23336 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000212188_100010146616 [0,2,0,0,0,0|1,0,0]=3 23337 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)I)C 1458a_100000212188_100010206137 [0,2,0,0,0,0|1,0,0]=3 23338 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)I)F 1458a_100000212188_100010188208 [0,2,0,0,0,0|1,0,0]=3 23339 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210326 [0,2,0,0,0,0|1,0,0]=3 23340 B16R1.7393 CCCCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210326 [0,2,0,0,0,0|1,0,0]=3 23341 B16R1.7393 CCCCCC(=O)Cc1cnc(c(c1)Br)F 1458a_100000212188_200010066439 [0,2,0,0,0,0|2,0,0]=4 23342 B16R1.7393 CCCCCC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000212188_100009843750 [0,2,0,0,0,0|2,0,0]=4 23343 B16R1.7393 CCCCCC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000212188_100011072623 [0,2,0,0,0,0|2,0,0]=4 23344 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100000212188 [0,2,0,0,0,0|2,0,0]=4 23345 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100000212188 [0,2,0,0,0,0|2,0,0]=4 23346 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000212188 [0,2,0,0,0,0|2,0,0]=4 23347 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000212188 [0,2,0,0,0,0|2,0,0]=4 23348 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100000212188 [0,2,0,0,0,0|2,0,0]=4 23349 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100000212188 [0,2,0,0,0,0|2,0,0]=4 23350 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000212188 [0,2,0,0,0,0|2,0,0]=4 23351 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100000212188 [0,2,0,0,0,0|2,0,0]=4 23352 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23353 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23354 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23355 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000212188 [0,2,0,0,0,0|2,0,0]=4 23356 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100000212188 [0,2,0,0,0,0|2,0,0]=4 23357 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100000212188 [0,2,0,0,0,0|2,0,0]=4 23358 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000212188 [0,2,0,0,0,0|2,0,0]=4 23359 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100000212188 [0,2,0,0,0,0|2,0,0]=4 23360 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100000212188 [0,2,0,0,0,0|2,0,0]=4 23361 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100000212188 [0,2,0,0,0,0|2,0,0]=4 23362 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000212188 [0,2,0,0,0,0|2,0,0]=4 23363 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100000212188 [0,2,0,0,0,0|2,0,0]=4 23364 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000212188 [0,2,0,0,0,0|2,0,0]=4 23365 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000212188 [0,2,0,0,0,0|2,0,0]=4 23366 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100000212188 [0,2,0,0,0,0|2,0,0]=4 23367 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100000212188 [0,2,0,0,0,0|2,0,0]=4 23368 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000212188 [0,2,0,0,0,0|2,0,0]=4 23369 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100000212188 [0,2,0,0,0,0|2,0,0]=4 23370 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100000212188 [0,2,0,0,0,0|2,0,0]=4 23371 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100000212188 [0,2,0,0,0,0|2,0,0]=4 23372 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000212188 [0,2,0,0,0,0|2,0,0]=4 23373 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100000212188 [0,2,0,0,0,0|2,0,0]=4 23374 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000212188 [0,2,0,0,0,0|2,0,0]=4 23375 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000212188 [0,2,0,0,0,0|2,0,0]=4 23376 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000212188 [0,2,0,0,0,0|2,0,0]=4 23377 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000212188 [0,2,0,0,0,0|2,0,0]=4 23378 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100000212188 [0,2,0,0,0,0|2,0,0]=4 23379 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100000212188 [0,2,0,0,0,0|2,0,0]=4 23380 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000212188 [0,2,0,0,0,0|2,0,0]=4 23381 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100000212188 [0,2,0,0,0,0|2,0,0]=4 23382 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100000212188 [0,2,0,0,0,0|2,0,0]=4 23383 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100000212188 [0,2,0,0,0,0|2,0,0]=4 23384 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000212188 [0,2,0,0,0,0|2,0,0]=4 23385 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100000212188 [0,2,0,0,0,0|2,0,0]=4 23386 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000212188 [0,2,0,0,0,0|2,0,0]=4 23387 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000212188 [0,2,0,0,0,0|2,0,0]=4 23388 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000212188 [0,2,0,0,0,0|2,0,0]=4 23389 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100000212188 [0,2,0,0,0,0|2,0,0]=4 23390 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100000212188 [0,2,0,0,0,0|2,0,0]=4 23391 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000212188 [0,2,0,0,0,0|2,0,0]=4 23392 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000212188 [0,2,0,0,0,0|2,0,0]=4 23393 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100000212188 [0,2,0,0,0,0|2,0,0]=4 23394 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100000212188 [0,2,0,0,0,0|2,0,0]=4 23395 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000212188 [0,2,0,0,0,0|2,0,0]=4 23396 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100000212188 [0,2,0,0,0,0|2,0,0]=4 23397 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000212188 [0,2,0,0,0,0|2,0,0]=4 23398 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000212188 [0,2,0,0,0,0|2,0,0]=4 23399 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000212188 [0,2,0,0,0,0|2,0,0]=4 23400 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000212188 [0,2,0,0,0,0|2,0,0]=4 23401 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100000212188 [0,2,0,0,0,0|2,0,0]=4 23402 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100000212188 [0,2,0,0,0,0|2,0,0]=4 23403 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000212188 [0,2,0,0,0,0|2,0,0]=4 23404 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000212188 [0,2,0,0,0,0|2,0,0]=4 23405 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100000212188 [0,2,0,0,0,0|2,0,0]=4 23406 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100000212188 [0,2,0,0,0,0|2,0,0]=4 23407 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000212188 [0,2,0,0,0,0|2,0,0]=4 23408 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000212188 [0,2,0,0,0,0|2,0,0]=4 23409 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100000212188 [0,2,0,0,0,0|2,0,0]=4 23410 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100000212188 [0,2,0,0,0,0|2,0,0]=4 23411 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000212188 [0,2,0,0,0,0|2,0,0]=4 23412 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100000212188 [0,2,0,0,0,0|2,0,0]=4 23413 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100000212188 [0,2,0,0,0,0|2,0,0]=4 23414 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100000212188 [0,2,0,0,0,0|2,0,0]=4 23415 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000212188 [0,2,0,0,0,0|2,0,0]=4 23416 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100000212188 [0,2,0,0,0,0|2,0,0]=4 23417 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000212188 [0,2,0,0,0,0|2,0,0]=4 23418 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000212188 [0,2,0,0,0,0|2,0,0]=4 23419 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000212188 [0,2,0,0,0,0|2,0,0]=4 23420 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100000212188 [0,2,0,0,0,0|2,0,0]=4 23421 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100000212188 [0,2,0,0,0,0|2,0,0]=4 23422 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000212188 [0,2,0,0,0,0|2,0,0]=4 23423 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100000212188 [0,2,0,0,0,0|2,0,0]=4 23424 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100000212188 [0,2,0,0,0,0|2,0,0]=4 23425 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000212188 [0,2,0,0,0,0|2,0,0]=4 23426 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000212188 [0,2,0,0,0,0|2,0,0]=4 23427 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000212188 [0,2,0,0,0,0|2,0,0]=4 23428 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100000212188 [0,2,0,0,0,0|2,0,0]=4 23429 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100000212188 [0,2,0,0,0,0|2,0,0]=4 23430 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000212188 [0,2,0,0,0,0|2,0,0]=4 23431 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100000212188 [0,2,0,0,0,0|2,0,0]=4 23432 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100000212188 [0,2,0,0,0,0|2,0,0]=4 23433 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100000212188 [0,2,0,0,0,0|2,0,0]=4 23434 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000212188 [0,2,0,0,0,0|2,0,0]=4 23435 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100000212188 [0,2,0,0,0,0|2,0,0]=4 23436 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000212188 [0,2,0,0,0,0|2,0,0]=4 23437 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000212188 [0,2,0,0,0,0|2,0,0]=4 23438 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000212188 [0,2,0,0,0,0|2,0,0]=4 23439 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000212188 [0,2,0,0,0,0|2,0,0]=4 23440 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100000212188 [0,2,0,0,0,0|2,0,0]=4 23441 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100000212188 [0,2,0,0,0,0|2,0,0]=4 23442 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000212188 [0,2,0,0,0,0|2,0,0]=4 23443 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100000212188 [0,2,0,0,0,0|2,0,0]=4 23444 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000212188 [0,2,0,0,0,0|2,0,0]=4 23445 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000212188 [0,2,0,0,0,0|2,0,0]=4 23446 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000212188 [0,2,0,0,0,0|2,0,0]=4 23447 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000212188 [0,2,0,0,0,0|2,0,0]=4 23448 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000212188 [0,2,0,0,0,0|2,0,0]=4 23449 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000212188 [0,2,0,0,0,0|2,0,0]=4 23450 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000212188 [0,2,0,0,0,0|2,0,0]=4 23451 B16R1.7393 CCCCCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000212188 [0,2,0,0,0,0|2,0,0]=4 23452 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)C 11a_100000102301_100000709925 [0,2,0,0,0,0|1,0,0]=3 23453 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)C 240690a_100000102301_100000709925 [0,2,0,0,0,0|1,0,0]=3 23454 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)C 527a_100000102301_100000709925 [0,2,0,0,0,0|1,0,0]=3 23455 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)Cl 11a_100000102301_100012349508 [0,2,0,0,0,0|1,0,0]=3 23456 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100000102301_100012349508 [0,2,0,0,0,0|1,0,0]=3 23457 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100000102301_100012349508 [0,2,0,0,0,0|1,0,0]=3 23458 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)F 11a_100000102301_100000742997 [0,2,0,0,0,0|1,0,0]=3 23459 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)F 240690a_100000102301_100000742997 [0,2,0,0,0,0|1,0,0]=3 23460 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)F 527a_100000102301_100000742997 [0,2,0,0,0,0|1,0,0]=3 23461 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100000102301_100009990404 [0,2,0,0,0,0|1,0,0]=3 23462 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Br)O 527a_100000102301_100009990404 [0,2,0,0,0,0|1,0,0]=3 23463 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)Br 11a_100000102301_100012340274 [0,2,0,0,0,0|1,0,0]=3 23464 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)Br 240690a_100000102301_100012340274 [0,2,0,0,0,0|1,0,0]=3 23465 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)Br 527a_100000102301_100012340274 [0,2,0,0,0,0|1,0,0]=3 23466 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)C 11a_100000102301_100000184070 [0,2,0,0,0,0|1,0,0]=3 23467 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)C 240690a_100000102301_100000184070 [0,2,0,0,0,0|1,0,0]=3 23468 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)C 527a_100000102301_100000184070 [0,2,0,0,0,0|1,0,0]=3 23469 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)F 11a_100000102301_100011667458 [0,2,0,0,0,0|1,0,0]=3 23470 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)F 240690a_100000102301_100011667458 [0,2,0,0,0,0|1,0,0]=3 23471 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)F 527a_100000102301_100011667458 [0,2,0,0,0,0|1,0,0]=3 23472 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)O 240690a_100000102301_100000083968 [0,2,0,0,0,0|1,0,0]=3 23473 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)C)O 527a_100000102301_100000083968 [0,2,0,0,0,0|1,0,0]=3 23474 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Br 11a_100000102301_100000766880 [0,2,0,0,0,0|1,0,0]=3 23475 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100000102301_100000766880 [0,2,0,0,0,0|1,0,0]=3 23476 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100000102301_100000766880 [0,2,0,0,0,0|1,0,0]=3 23477 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_100000102301_100000210702 [0,2,0,0,0,0|1,0,0]=3 23478 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100000102301_100000210702 [0,2,0,0,0,0|1,0,0]=3 23479 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100000102301_100000210702 [0,2,0,0,0,0|1,0,0]=3 23480 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)F 11a_100000102301_100011217296 [0,2,0,0,0,0|1,0,0]=3 23481 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100000102301_100011217296 [0,2,0,0,0,0|1,0,0]=3 23482 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100000102301_100011217296 [0,2,0,0,0,0|1,0,0]=3 23483 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)F 527a_100000102301_100011217296 [0,2,0,0,0,0|1,0,0]=3 23484 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100000102301_100000035197 [0,2,0,0,0,0|1,0,0]=3 23485 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100000102301_100000035197 [0,2,0,0,0,0|1,0,0]=3 23486 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Br 11a_100000102301_100000691132 [0,2,0,0,0,0|1,0,0]=3 23487 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Br 240690a_100000102301_100000691132 [0,2,0,0,0,0|1,0,0]=3 23488 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Br 527a_100000102301_100000691132 [0,2,0,0,0,0|1,0,0]=3 23489 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)C 11a_100000102301_100011217375 [0,2,0,0,0,0|1,0,0]=3 23490 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)C 240690a_100000102301_100011217375 [0,2,0,0,0,0|1,0,0]=3 23491 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)C 527a_100000102301_100011217375 [0,2,0,0,0,0|1,0,0]=3 23492 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Cl 11a_100000102301_100000722404 [0,2,0,0,0,0|1,0,0]=3 23493 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100000102301_100000722404 [0,2,0,0,0,0|1,0,0]=3 23494 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100000102301_100000722404 [0,2,0,0,0,0|1,0,0]=3 23495 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F 11a_100000102301_100000684721 [0,2,0,0,0,0|1,0,0]=3 23496 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F 1626a_100000102301_100000684721 [0,2,0,0,0,0|1,0,0]=3 23497 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F 240690a_100000102301_100000684721 [0,2,0,0,0,0|1,0,0]=3 23498 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)F 527a_100000102301_100000684721 [0,2,0,0,0,0|1,0,0]=3 23499 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)I 11a_100000102301_100010149632 [0,2,0,0,0,0|1,0,0]=3 23500 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)I 1626a_100000102301_100010149632 [0,2,0,0,0,0|1,0,0]=3 23501 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)I 240690a_100000102301_100010149632 [0,2,0,0,0,0|1,0,0]=3 23502 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)I 527a_100000102301_100010149632 [0,2,0,0,0,0|1,0,0]=3 23503 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)O 240690a_100000102301_100000039761 [0,2,0,0,0,0|1,0,0]=3 23504 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)F)O 527a_100000102301_100000039761 [0,2,0,0,0,0|1,0,0]=3 23505 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)C 11a_100000102301_100000082272 [0,2,0,0,0,0|1,0,0]=3 23506 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)C 240690a_100000102301_100000082272 [0,2,0,0,0,0|1,0,0]=3 23507 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)C 527a_100000102301_100000082272 [0,2,0,0,0,0|1,0,0]=3 23508 B16R1.7393 CCCCNC(=O)Cc1ccc(c(c1)O)O 527a_100000102301_100000031429 [0,2,0,0,0,0|1,0,0]=3 23509 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100000102301 [0,2,0,0,0,0|2,0,0]=4 23510 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)C 2430a_100000736455_100000102301 [0,2,0,0,0,0|2,0,0]=4 23511 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100000102301 [0,2,0,0,0,0|2,0,0]=4 23512 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)F 2430a_100000760356_100000102301 [0,2,0,0,0,0|2,0,0]=4 23513 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)I 2430a_100000750458_100000102301 [0,2,0,0,0,0|2,0,0]=4 23514 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100000102301 [0,2,0,0,0,0|2,0,0]=4 23515 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)Br 2430a_100000210723_100000102301 [0,2,0,0,0,0|2,0,0]=4 23516 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)C 2430a_100000724040_100000102301 [0,2,0,0,0,0|2,0,0]=4 23517 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100000102301 [0,2,0,0,0,0|2,0,0]=4 23518 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)F 2430a_100000750164_100000102301 [0,2,0,0,0,0|2,0,0]=4 23519 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)I 2430a_100000198070_100000102301 [0,2,0,0,0,0|2,0,0]=4 23520 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100000102301 [0,2,0,0,0,0|2,0,0]=4 23521 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100000102301 [0,2,0,0,0,0|2,0,0]=4 23522 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)C 2430a_100000188892_100000102301 [0,2,0,0,0,0|2,0,0]=4 23523 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100000102301 [0,2,0,0,0,0|2,0,0]=4 23524 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100000102301 [0,2,0,0,0,0|2,0,0]=4 23525 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100000102301 [0,2,0,0,0,0|2,0,0]=4 23526 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100000102301 [0,2,0,0,0,0|2,0,0]=4 23527 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)Br 2430a_100000759894_100000102301 [0,2,0,0,0,0|2,0,0]=4 23528 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)C 2430a_100000210958_100000102301 [0,2,0,0,0,0|2,0,0]=4 23529 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100000102301 [0,2,0,0,0,0|2,0,0]=4 23530 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)F 2430a_100000210724_100000102301 [0,2,0,0,0,0|2,0,0]=4 23531 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)I 2430a_100011356925_100000102301 [0,2,0,0,0,0|2,0,0]=4 23532 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100000102301 [0,2,0,0,0,0|2,0,0]=4 23533 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)I)Br 2430a_100000750459_100000102301 [0,2,0,0,0,0|2,0,0]=4 23534 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)I)C 2430a_100000184131_100000102301 [0,2,0,0,0,0|2,0,0]=4 23535 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100000102301 [0,2,0,0,0,0|2,0,0]=4 23536 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)I)F 2430a_114828291077_100000102301 [0,2,0,0,0,0|2,0,0]=4 23537 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)I)F 512a_114828291077_100000102301 [0,2,0,0,0,0|2,0,0]=4 23538 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100000102301 [0,2,0,0,0,0|2,0,0]=4 23539 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100000102301 [0,2,0,0,0,0|2,0,0]=4 23540 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100000102301 [0,2,0,0,0,0|2,0,0]=4 23541 B16R1.7393 CCCCNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100000102301 [0,2,0,0,0,0|2,0,0]=4 23542 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Br)C 22a_100000740057_100000709925 [0,2,0,0,0,0|2,0,0]=4 23543 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Br)Cl 22a_100000740057_100012349508 [0,2,0,0,0,0|2,0,0]=4 23544 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Br)F 22a_100000740057_100000742997 [0,2,0,0,0,0|2,0,0]=4 23545 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Br)O 22a_100000740057_100009990404 [0,2,0,0,0,0|2,0,0]=4 23546 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)C)Br 22a_100000740057_100012340274 [0,2,0,0,0,0|2,0,0]=4 23547 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)C)C 22a_100000740057_100000184070 [0,2,0,0,0,0|2,0,0]=4 23548 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)C)F 22a_100000740057_100011667458 [0,2,0,0,0,0|2,0,0]=4 23549 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)C)O 22a_100000740057_100000083968 [0,2,0,0,0,0|2,0,0]=4 23550 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Cl)Br 22a_100000740057_100000766880 [0,2,0,0,0,0|2,0,0]=4 23551 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Cl)Cl 22a_100000740057_100000210702 [0,2,0,0,0,0|2,0,0]=4 23552 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Cl)F 22a_100000740057_100011217296 [0,2,0,0,0,0|2,0,0]=4 23553 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)Cl)O 22a_100000740057_100000035197 [0,2,0,0,0,0|2,0,0]=4 23554 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)Br 22a_100000740057_100000691132 [0,2,0,0,0,0|2,0,0]=4 23555 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)C 22a_100000740057_100011217375 [0,2,0,0,0,0|2,0,0]=4 23556 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)Cl 22a_100000740057_100000722404 [0,2,0,0,0,0|2,0,0]=4 23557 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)F 22a_100000740057_100000684721 [0,2,0,0,0,0|2,0,0]=4 23558 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)I 22a_100000740057_100010149632 [0,2,0,0,0,0|2,0,0]=4 23559 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)F)O 22a_100000740057_100000039761 [0,2,0,0,0,0|2,0,0]=4 23560 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)O)C 22a_100000740057_100000082272 [0,2,0,0,0,0|2,0,0]=4 23561 B16R1.7393 CCCNNC(=O)Cc1ccc(c(c1)O)O 22a_100000740057_100000031429 [0,2,0,0,0,0|2,0,0]=4 23562 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000745993_100012353900 [0,2,0,0,0,0|2,0,0]=4 23563 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000745993_100012232412 [0,2,0,0,0,0|2,0,0]=4 23564 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000745993_100012353894 [0,2,0,0,0,0|2,0,0]=4 23565 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000745993_100011206884 [0,2,0,0,0,0|2,0,0]=4 23566 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000745993_100000727479 [0,2,0,0,0,0|2,0,0]=4 23567 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)C)C 1458a_100000745993_100000742320 [0,2,0,0,0,0|2,0,0]=4 23568 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000745993_100012184735 [0,2,0,0,0,0|2,0,0]=4 23569 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)C)F 1458a_100000745993_100011216667 [0,2,0,0,0,0|2,0,0]=4 23570 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000745993_100012353895 [0,2,0,0,0,0|2,0,0]=4 23571 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000745993_100011823929 [0,2,0,0,0,0|2,0,0]=4 23572 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000745993_100000184707 [0,2,0,0,0,0|2,0,0]=4 23573 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000745993_100000717365 [0,2,0,0,0,0|2,0,0]=4 23574 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000745993_100012349665 [0,2,0,0,0,0|2,0,0]=4 23575 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000745993_100000767054 [0,2,0,0,0,0|2,0,0]=4 23576 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)F)C 1458a_100000745993_100011217369 [0,2,0,0,0,0|2,0,0]=4 23577 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000745993_100000716492 [0,2,0,0,0,0|2,0,0]=4 23578 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)F)F 1458a_100000745993_100000757363 [0,2,0,0,0,0|2,0,0]=4 23579 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)F)I 1458a_100000745993_100010149604 [0,2,0,0,0,0|2,0,0]=4 23580 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000745993_100010146616 [0,2,0,0,0,0|2,0,0]=4 23581 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)I)C 1458a_100000745993_100010206137 [0,2,0,0,0,0|2,0,0]=4 23582 B16R1.7393 CCCOCC(=O)Cc1ccc(c(c1)I)F 1458a_100000745993_100010188208 [0,2,0,0,0,0|2,0,0]=4 23583 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000217233_100012353900 [0,2,0,0,0,0|2,0,0]=4 23584 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000217233_100012232412 [0,2,0,0,0,0|2,0,0]=4 23585 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000217233_100012353894 [0,2,0,0,0,0|2,0,0]=4 23586 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000217233_100011206884 [0,2,0,0,0,0|2,0,0]=4 23587 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000217233_100000727479 [0,2,0,0,0,0|2,0,0]=4 23588 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)C)C 1458a_100000217233_100000742320 [0,2,0,0,0,0|2,0,0]=4 23589 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000217233_100012184735 [0,2,0,0,0,0|2,0,0]=4 23590 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)C)F 1458a_100000217233_100011216667 [0,2,0,0,0,0|2,0,0]=4 23591 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000217233_100012353895 [0,2,0,0,0,0|2,0,0]=4 23592 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000217233_100011823929 [0,2,0,0,0,0|2,0,0]=4 23593 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000217233_100000184707 [0,2,0,0,0,0|2,0,0]=4 23594 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000217233_100000717365 [0,2,0,0,0,0|2,0,0]=4 23595 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000217233_100012349665 [0,2,0,0,0,0|2,0,0]=4 23596 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000217233_100000767054 [0,2,0,0,0,0|2,0,0]=4 23597 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)F)C 1458a_100000217233_100011217369 [0,2,0,0,0,0|2,0,0]=4 23598 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000217233_100000716492 [0,2,0,0,0,0|2,0,0]=4 23599 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)F)F 1458a_100000217233_100000757363 [0,2,0,0,0,0|2,0,0]=4 23600 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)F)I 1458a_100000217233_100010149604 [0,2,0,0,0,0|2,0,0]=4 23601 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000217233_100010146616 [0,2,0,0,0,0|2,0,0]=4 23602 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)I)C 1458a_100000217233_100010206137 [0,2,0,0,0,0|2,0,0]=4 23603 B16R1.7393 CCCSCC(=O)Cc1ccc(c(c1)I)F 1458a_100000217233_100010188208 [0,2,0,0,0,0|2,0,0]=4 23604 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000749530_100012353900 [0,2,0,0,0,0|2,0,0]=4 23605 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100011215890 [0,2,0,0,0,0|2,0,0]=4 23606 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000749530_100012232412 [0,2,0,0,0,0|2,0,0]=4 23607 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000749530_100012353894 [0,2,0,0,0,0|2,0,0]=4 23608 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100011215890 [0,2,0,0,0,0|2,0,0]=4 23609 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100011215890 [0,2,0,0,0,0|2,0,0]=4 23610 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000749530_100011206884 [0,2,0,0,0,0|2,0,0]=4 23611 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100011215890 [0,2,0,0,0,0|2,0,0]=4 23612 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000749530_100000727479 [0,2,0,0,0,0|2,0,0]=4 23613 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100011215890 [0,2,0,0,0,0|2,0,0]=4 23614 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100011215890 [0,2,0,0,0,0|2,0,0]=4 23615 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000749530_100000742320 [0,2,0,0,0,0|2,0,0]=4 23616 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000749530_100012184735 [0,2,0,0,0,0|2,0,0]=4 23617 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)F 1458a_100000749530_100011216667 [0,2,0,0,0,0|2,0,0]=4 23618 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100011215890 [0,2,0,0,0,0|2,0,0]=4 23619 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100011215890 [0,2,0,0,0,0|2,0,0]=4 23620 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000749530_100012353895 [0,2,0,0,0,0|2,0,0]=4 23621 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100011215890 [0,2,0,0,0,0|2,0,0]=4 23622 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000749530_100011823929 [0,2,0,0,0,0|2,0,0]=4 23623 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100011215890 [0,2,0,0,0,0|2,0,0]=4 23624 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000749530_100000184707 [0,2,0,0,0,0|2,0,0]=4 23625 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000749530_100000717365 [0,2,0,0,0,0|2,0,0]=4 23626 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100011215890 [0,2,0,0,0,0|2,0,0]=4 23627 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000749530_100012349665 [0,2,0,0,0,0|2,0,0]=4 23628 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100011215890 [0,2,0,0,0,0|2,0,0]=4 23629 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100011215890 [0,2,0,0,0,0|2,0,0]=4 23630 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000749530_100000767054 [0,2,0,0,0,0|2,0,0]=4 23631 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)C 1458a_100000749530_100011217369 [0,2,0,0,0,0|2,0,0]=4 23632 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100011215890 [0,2,0,0,0,0|2,0,0]=4 23633 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100011215890 [0,2,0,0,0,0|2,0,0]=4 23634 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000749530_100000716492 [0,2,0,0,0,0|2,0,0]=4 23635 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100011215890 [0,2,0,0,0,0|2,0,0]=4 23636 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000749530_100000757363 [0,2,0,0,0,0|2,0,0]=4 23637 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)I 1458a_100000749530_100010149604 [0,2,0,0,0,0|2,0,0]=4 23638 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100011215890 [0,2,0,0,0,0|2,0,0]=4 23639 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100011215890 [0,2,0,0,0,0|2,0,0]=4 23640 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000749530_100010146616 [0,2,0,0,0,0|2,0,0]=4 23641 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)I)C 1458a_100000749530_100010206137 [0,2,0,0,0,0|2,0,0]=4 23642 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)I)F 1458a_100000749530_100010188208 [0,2,0,0,0,0|2,0,0]=4 23643 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100011215890 [0,2,0,0,0,0|2,0,0]=4 23644 B16R1.7393 CCOCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100011215890 [0,2,0,0,0,0|2,0,0]=4 23645 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000230768_100012353900 [0,2,0,0,0,0|2,0,0]=4 23646 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000230768_100012232412 [0,2,0,0,0,0|2,0,0]=4 23647 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000757381 [0,2,0,0,0,0|2,0,0]=4 23648 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000230768_100012353894 [0,2,0,0,0,0|2,0,0]=4 23649 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000757381 [0,2,0,0,0,0|2,0,0]=4 23650 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000230768_100011206884 [0,2,0,0,0,0|2,0,0]=4 23651 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000757381 [0,2,0,0,0,0|2,0,0]=4 23652 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000757381 [0,2,0,0,0,0|2,0,0]=4 23653 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000230768_100000727479 [0,2,0,0,0,0|2,0,0]=4 23654 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000757381 [0,2,0,0,0,0|2,0,0]=4 23655 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000757381 [0,2,0,0,0,0|2,0,0]=4 23656 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000230768_100000742320 [0,2,0,0,0,0|2,0,0]=4 23657 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000230768_100012184735 [0,2,0,0,0,0|2,0,0]=4 23658 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)F 1458a_100000230768_100011216667 [0,2,0,0,0,0|2,0,0]=4 23659 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000757381 [0,2,0,0,0,0|2,0,0]=4 23660 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000757381 [0,2,0,0,0,0|2,0,0]=4 23661 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000230768_100012353895 [0,2,0,0,0,0|2,0,0]=4 23662 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000757381 [0,2,0,0,0,0|2,0,0]=4 23663 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000230768_100011823929 [0,2,0,0,0,0|2,0,0]=4 23664 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000757381 [0,2,0,0,0,0|2,0,0]=4 23665 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000230768_100000184707 [0,2,0,0,0,0|2,0,0]=4 23666 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000230768_100000717365 [0,2,0,0,0,0|2,0,0]=4 23667 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000757381 [0,2,0,0,0,0|2,0,0]=4 23668 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000230768_100012349665 [0,2,0,0,0,0|2,0,0]=4 23669 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000757381 [0,2,0,0,0,0|2,0,0]=4 23670 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000230768_100000767054 [0,2,0,0,0,0|2,0,0]=4 23671 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000757381 [0,2,0,0,0,0|2,0,0]=4 23672 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)C 1458a_100000230768_100011217369 [0,2,0,0,0,0|2,0,0]=4 23673 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000757381 [0,2,0,0,0,0|2,0,0]=4 23674 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000230768_100000716492 [0,2,0,0,0,0|2,0,0]=4 23675 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000757381 [0,2,0,0,0,0|2,0,0]=4 23676 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000230768_100000757363 [0,2,0,0,0,0|2,0,0]=4 23677 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000757381 [0,2,0,0,0,0|2,0,0]=4 23678 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)I 1458a_100000230768_100010149604 [0,2,0,0,0,0|2,0,0]=4 23679 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000757381 [0,2,0,0,0,0|2,0,0]=4 23680 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000757381 [0,2,0,0,0,0|2,0,0]=4 23681 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000230768_100010146616 [0,2,0,0,0,0|2,0,0]=4 23682 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)I)C 1458a_100000230768_100010206137 [0,2,0,0,0,0|2,0,0]=4 23683 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)I)F 1458a_100000230768_100010188208 [0,2,0,0,0,0|2,0,0]=4 23684 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000757381 [0,2,0,0,0,0|2,0,0]=4 23685 B16R1.7393 CCSCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000757381 [0,2,0,0,0,0|2,0,0]=4 23686 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000741012_100012353900 [0,2,0,0,0,0|2,0,0]=4 23687 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000740836 [0,2,0,0,0,0|2,0,0]=4 23688 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000741012_100012232412 [0,2,0,0,0,0|2,0,0]=4 23689 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000741012_100012353894 [0,2,0,0,0,0|2,0,0]=4 23690 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000740836 [0,2,0,0,0,0|2,0,0]=4 23691 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000741012_100011206884 [0,2,0,0,0,0|2,0,0]=4 23692 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000740836 [0,2,0,0,0,0|2,0,0]=4 23693 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000740836 [0,2,0,0,0,0|2,0,0]=4 23694 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000741012_100000727479 [0,2,0,0,0,0|2,0,0]=4 23695 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000740836 [0,2,0,0,0,0|2,0,0]=4 23696 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000740836 [0,2,0,0,0,0|2,0,0]=4 23697 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000741012_100000742320 [0,2,0,0,0,0|2,0,0]=4 23698 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000741012_100012184735 [0,2,0,0,0,0|2,0,0]=4 23699 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)F 1458a_100000741012_100011216667 [0,2,0,0,0,0|2,0,0]=4 23700 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000740836 [0,2,0,0,0,0|2,0,0]=4 23701 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000740836 [0,2,0,0,0,0|2,0,0]=4 23702 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000741012_100012353895 [0,2,0,0,0,0|2,0,0]=4 23703 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000740836 [0,2,0,0,0,0|2,0,0]=4 23704 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000741012_100011823929 [0,2,0,0,0,0|2,0,0]=4 23705 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000740836 [0,2,0,0,0,0|2,0,0]=4 23706 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000741012_100000184707 [0,2,0,0,0,0|2,0,0]=4 23707 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000741012_100000717365 [0,2,0,0,0,0|2,0,0]=4 23708 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000740836 [0,2,0,0,0,0|2,0,0]=4 23709 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000741012_100012349665 [0,2,0,0,0,0|2,0,0]=4 23710 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000740836 [0,2,0,0,0,0|2,0,0]=4 23711 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000740836 [0,2,0,0,0,0|2,0,0]=4 23712 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000741012_100000767054 [0,2,0,0,0,0|2,0,0]=4 23713 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)C 1458a_100000741012_100011217369 [0,2,0,0,0,0|2,0,0]=4 23714 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000740836 [0,2,0,0,0,0|2,0,0]=4 23715 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000740836 [0,2,0,0,0,0|2,0,0]=4 23716 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000741012_100000716492 [0,2,0,0,0,0|2,0,0]=4 23717 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000740836 [0,2,0,0,0,0|2,0,0]=4 23718 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000741012_100000757363 [0,2,0,0,0,0|2,0,0]=4 23719 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)I 1458a_100000741012_100010149604 [0,2,0,0,0,0|2,0,0]=4 23720 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000740836 [0,2,0,0,0,0|2,0,0]=4 23721 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000740836 [0,2,0,0,0,0|2,0,0]=4 23722 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000741012_100010146616 [0,2,0,0,0,0|2,0,0]=4 23723 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)I)C 1458a_100000741012_100010206137 [0,2,0,0,0,0|2,0,0]=4 23724 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)I)F 1458a_100000741012_100010188208 [0,2,0,0,0,0|2,0,0]=4 23725 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000740836 [0,2,0,0,0,0|2,0,0]=4 23726 B16R1.7393 COCCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000740836 [0,2,0,0,0,0|2,0,0]=4 23727 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)C 240690a_100000209980_100000709925 [0,2,0,0,0,0|2,0,0]=4 23728 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)C 527a_100000209980_100000709925 [0,2,0,0,0,0|2,0,0]=4 23729 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100000209980_100012349508 [0,2,0,0,0,0|2,0,0]=4 23730 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100000209980_100012349508 [0,2,0,0,0,0|2,0,0]=4 23731 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)F 240690a_100000209980_100000742997 [0,2,0,0,0,0|2,0,0]=4 23732 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)F 527a_100000209980_100000742997 [0,2,0,0,0,0|2,0,0]=4 23733 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100000209980_100009990404 [0,2,0,0,0,0|2,0,0]=4 23734 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Br)O 527a_100000209980_100009990404 [0,2,0,0,0,0|2,0,0]=4 23735 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)Br 240690a_100000209980_100012340274 [0,2,0,0,0,0|2,0,0]=4 23736 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)Br 527a_100000209980_100012340274 [0,2,0,0,0,0|2,0,0]=4 23737 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)C 240690a_100000209980_100000184070 [0,2,0,0,0,0|2,0,0]=4 23738 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)C 527a_100000209980_100000184070 [0,2,0,0,0,0|2,0,0]=4 23739 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)F 240690a_100000209980_100011667458 [0,2,0,0,0,0|2,0,0]=4 23740 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)F 527a_100000209980_100011667458 [0,2,0,0,0,0|2,0,0]=4 23741 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)O 240690a_100000209980_100000083968 [0,2,0,0,0,0|2,0,0]=4 23742 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)C)O 527a_100000209980_100000083968 [0,2,0,0,0,0|2,0,0]=4 23743 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100000209980_100000766880 [0,2,0,0,0,0|2,0,0]=4 23744 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100000209980_100000766880 [0,2,0,0,0,0|2,0,0]=4 23745 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100000209980_100000210702 [0,2,0,0,0,0|2,0,0]=4 23746 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100000209980_100000210702 [0,2,0,0,0,0|2,0,0]=4 23747 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100000209980_100011217296 [0,2,0,0,0,0|2,0,0]=4 23748 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100000209980_100011217296 [0,2,0,0,0,0|2,0,0]=4 23749 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)F 527a_100000209980_100011217296 [0,2,0,0,0,0|2,0,0]=4 23750 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100000209980_100000035197 [0,2,0,0,0,0|2,0,0]=4 23751 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100000209980_100000035197 [0,2,0,0,0,0|2,0,0]=4 23752 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)Br 240690a_100000209980_100000691132 [0,2,0,0,0,0|2,0,0]=4 23753 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)Br 527a_100000209980_100000691132 [0,2,0,0,0,0|2,0,0]=4 23754 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)C 240690a_100000209980_100011217375 [0,2,0,0,0,0|2,0,0]=4 23755 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)C 527a_100000209980_100011217375 [0,2,0,0,0,0|2,0,0]=4 23756 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100000209980_100000722404 [0,2,0,0,0,0|2,0,0]=4 23757 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100000209980_100000722404 [0,2,0,0,0,0|2,0,0]=4 23758 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)F 1626a_100000209980_100000684721 [0,2,0,0,0,0|2,0,0]=4 23759 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)F 240690a_100000209980_100000684721 [0,2,0,0,0,0|2,0,0]=4 23760 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)F 527a_100000209980_100000684721 [0,2,0,0,0,0|2,0,0]=4 23761 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)I 1626a_100000209980_100010149632 [0,2,0,0,0,0|2,0,0]=4 23762 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)I 240690a_100000209980_100010149632 [0,2,0,0,0,0|2,0,0]=4 23763 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)I 527a_100000209980_100010149632 [0,2,0,0,0,0|2,0,0]=4 23764 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)O 240690a_100000209980_100000039761 [0,2,0,0,0,0|2,0,0]=4 23765 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)F)O 527a_100000209980_100000039761 [0,2,0,0,0,0|2,0,0]=4 23766 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)O)C 240690a_100000209980_100000082272 [0,2,0,0,0,0|2,0,0]=4 23767 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)O)C 527a_100000209980_100000082272 [0,2,0,0,0,0|2,0,0]=4 23768 B16R1.7393 COCCNC(=O)Cc1ccc(c(c1)O)O 527a_100000209980_100000031429 [0,2,0,0,0,0|2,0,0]=4 23769 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000173376_100012353900 [0,2,0,0,0,0|2,0,0]=4 23770 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000173376_100012232412 [0,2,0,0,0,0|2,0,0]=4 23771 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000173376_100012353894 [0,2,0,0,0,0|2,0,0]=4 23772 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000173376_100011206884 [0,2,0,0,0,0|2,0,0]=4 23773 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000173376_100000727479 [0,2,0,0,0,0|2,0,0]=4 23774 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)C)C 1458a_100000173376_100000742320 [0,2,0,0,0,0|2,0,0]=4 23775 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000173376_100012184735 [0,2,0,0,0,0|2,0,0]=4 23776 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)C)F 1458a_100000173376_100011216667 [0,2,0,0,0,0|2,0,0]=4 23777 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000173376_100012353895 [0,2,0,0,0,0|2,0,0]=4 23778 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000173376_100011823929 [0,2,0,0,0,0|2,0,0]=4 23779 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000173376_100000184707 [0,2,0,0,0,0|2,0,0]=4 23780 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000173376_100000717365 [0,2,0,0,0,0|2,0,0]=4 23781 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000173376_100012349665 [0,2,0,0,0,0|2,0,0]=4 23782 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000173376_100000767054 [0,2,0,0,0,0|2,0,0]=4 23783 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)F)C 1458a_100000173376_100011217369 [0,2,0,0,0,0|2,0,0]=4 23784 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000173376_100000716492 [0,2,0,0,0,0|2,0,0]=4 23785 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)F)F 1458a_100000173376_100000757363 [0,2,0,0,0,0|2,0,0]=4 23786 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)F)I 1458a_100000173376_100010149604 [0,2,0,0,0,0|2,0,0]=4 23787 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000173376_100010146616 [0,2,0,0,0,0|2,0,0]=4 23788 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)I)C 1458a_100000173376_100010206137 [0,2,0,0,0,0|2,0,0]=4 23789 B16R1.7393 CSCCCC(=O)Cc1ccc(c(c1)I)F 1458a_100000173376_100010188208 [0,2,0,0,0,0|2,0,0]=4 23790 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)C 11a_100020590264_100000709925 [0,2,0,0,0,0|2,0,0]=4 23791 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)C 240690a_100020590264_100000709925 [0,2,0,0,0,0|2,0,0]=4 23792 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)C 527a_100020590264_100000709925 [0,2,0,0,0,0|2,0,0]=4 23793 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)Cl 11a_100020590264_100012349508 [0,2,0,0,0,0|2,0,0]=4 23794 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100020590264_100012349508 [0,2,0,0,0,0|2,0,0]=4 23795 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100020590264_100012349508 [0,2,0,0,0,0|2,0,0]=4 23796 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)F 11a_100020590264_100000742997 [0,2,0,0,0,0|2,0,0]=4 23797 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)F 240690a_100020590264_100000742997 [0,2,0,0,0,0|2,0,0]=4 23798 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)F 527a_100020590264_100000742997 [0,2,0,0,0,0|2,0,0]=4 23799 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100020590264_100009990404 [0,2,0,0,0,0|2,0,0]=4 23800 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Br)O 527a_100020590264_100009990404 [0,2,0,0,0,0|2,0,0]=4 23801 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)Br 11a_100020590264_100012340274 [0,2,0,0,0,0|2,0,0]=4 23802 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)Br 240690a_100020590264_100012340274 [0,2,0,0,0,0|2,0,0]=4 23803 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)Br 527a_100020590264_100012340274 [0,2,0,0,0,0|2,0,0]=4 23804 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)C 11a_100020590264_100000184070 [0,2,0,0,0,0|2,0,0]=4 23805 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)C 240690a_100020590264_100000184070 [0,2,0,0,0,0|2,0,0]=4 23806 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)C 527a_100020590264_100000184070 [0,2,0,0,0,0|2,0,0]=4 23807 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)F 11a_100020590264_100011667458 [0,2,0,0,0,0|2,0,0]=4 23808 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)F 240690a_100020590264_100011667458 [0,2,0,0,0,0|2,0,0]=4 23809 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)F 527a_100020590264_100011667458 [0,2,0,0,0,0|2,0,0]=4 23810 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)O 240690a_100020590264_100000083968 [0,2,0,0,0,0|2,0,0]=4 23811 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)C)O 527a_100020590264_100000083968 [0,2,0,0,0,0|2,0,0]=4 23812 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Br 11a_100020590264_100000766880 [0,2,0,0,0,0|2,0,0]=4 23813 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100020590264_100000766880 [0,2,0,0,0,0|2,0,0]=4 23814 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100020590264_100000766880 [0,2,0,0,0,0|2,0,0]=4 23815 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_100020590264_100000210702 [0,2,0,0,0,0|2,0,0]=4 23816 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100020590264_100000210702 [0,2,0,0,0,0|2,0,0]=4 23817 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100020590264_100000210702 [0,2,0,0,0,0|2,0,0]=4 23818 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)F 11a_100020590264_100011217296 [0,2,0,0,0,0|2,0,0]=4 23819 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100020590264_100011217296 [0,2,0,0,0,0|2,0,0]=4 23820 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100020590264_100011217296 [0,2,0,0,0,0|2,0,0]=4 23821 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)F 527a_100020590264_100011217296 [0,2,0,0,0,0|2,0,0]=4 23822 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100020590264_100000035197 [0,2,0,0,0,0|2,0,0]=4 23823 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100020590264_100000035197 [0,2,0,0,0,0|2,0,0]=4 23824 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Br 11a_100020590264_100000691132 [0,2,0,0,0,0|2,0,0]=4 23825 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Br 240690a_100020590264_100000691132 [0,2,0,0,0,0|2,0,0]=4 23826 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Br 527a_100020590264_100000691132 [0,2,0,0,0,0|2,0,0]=4 23827 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)C 11a_100020590264_100011217375 [0,2,0,0,0,0|2,0,0]=4 23828 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)C 240690a_100020590264_100011217375 [0,2,0,0,0,0|2,0,0]=4 23829 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)C 527a_100020590264_100011217375 [0,2,0,0,0,0|2,0,0]=4 23830 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Cl 11a_100020590264_100000722404 [0,2,0,0,0,0|2,0,0]=4 23831 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100020590264_100000722404 [0,2,0,0,0,0|2,0,0]=4 23832 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)Cl 527a_100020590264_100000722404 [0,2,0,0,0,0|2,0,0]=4 23833 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F 11a_100020590264_100000684721 [0,2,0,0,0,0|2,0,0]=4 23834 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F 1626a_100020590264_100000684721 [0,2,0,0,0,0|2,0,0]=4 23835 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F 240690a_100020590264_100000684721 [0,2,0,0,0,0|2,0,0]=4 23836 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)F 527a_100020590264_100000684721 [0,2,0,0,0,0|2,0,0]=4 23837 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)I 11a_100020590264_100010149632 [0,2,0,0,0,0|2,0,0]=4 23838 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)I 1626a_100020590264_100010149632 [0,2,0,0,0,0|2,0,0]=4 23839 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)I 240690a_100020590264_100010149632 [0,2,0,0,0,0|2,0,0]=4 23840 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)I 527a_100020590264_100010149632 [0,2,0,0,0,0|2,0,0]=4 23841 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)O 240690a_100020590264_100000039761 [0,2,0,0,0,0|2,0,0]=4 23842 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)F)O 527a_100020590264_100000039761 [0,2,0,0,0,0|2,0,0]=4 23843 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)C 11a_100020590264_100000082272 [0,2,0,0,0,0|2,0,0]=4 23844 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)C 240690a_100020590264_100000082272 [0,2,0,0,0,0|2,0,0]=4 23845 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)C 527a_100020590264_100000082272 [0,2,0,0,0,0|2,0,0]=4 23846 B16R1.7393 CSCCNC(=O)Cc1ccc(c(c1)O)O 527a_100020590264_100000031429 [0,2,0,0,0,0|2,0,0]=4 23847 B16R1.7393 Cc1cc(ccc1Br)CC(=O)CCCCF 1458a_100012340274_100000729493 [0,2,0,0,0,0|2,0,0]=4 23848 B16R1.7393 Cc1cc(ccc1Br)CC(=O)CCCCO 1458a_100000695505_100000727479 [0,2,0,0,0,0|2,0,0]=4 23849 B16R1.7393 Cc1cc(ccc1Br)CC(=O)CCCCO 1458a_100012340274_100000210776 [0,2,0,0,0,0|2,0,0]=4 23850 B16R1.7393 Cc1cc(ccc1Br)CC(=O)NCCCF 11a_100015189416_100012340274 [0,2,0,0,0,0|2,0,0]=4 23851 B16R1.7393 Cc1cc(ccc1Br)CC(=O)NCCCF 240690a_100015189416_100012340274 [0,2,0,0,0,0|2,0,0]=4 23852 B16R1.7393 Cc1cc(ccc1Br)CC(=O)NCCCF 527a_100015189416_100012340274 [0,2,0,0,0,0|2,0,0]=4 23853 B16R1.7393 Cc1cc(ccc1Br)CC(=O)NCCCO 240690a_100000182051_100012340274 [0,2,0,0,0,0|2,0,0]=4 23854 B16R1.7393 Cc1cc(ccc1Br)CC(=O)NCCCO 527a_100000182051_100012340274 [0,2,0,0,0,0|2,0,0]=4 23855 B16R1.7393 Cc1cc(ccc1Cl)CC(=O)CCCCO 1458a_100000695505_100012184735 [0,2,0,0,0,0|2,0,0]=4 23856 B16R1.7393 Cc1cc(ccc1F)CC(=O)CCCCF 1458a_100011667458_100000729493 [0,2,0,0,0,0|2,0,0]=4 23857 B16R1.7393 Cc1cc(ccc1F)CC(=O)CCCCO 1458a_100000695505_100011216667 [0,2,0,0,0,0|2,0,0]=4 23858 B16R1.7393 Cc1cc(ccc1F)CC(=O)CCCCO 1458a_100011667458_100000210776 [0,2,0,0,0,0|2,0,0]=4 23859 B16R1.7393 Cc1cc(ccc1F)CC(=O)NCCCF 11a_100015189416_100011667458 [0,2,0,0,0,0|2,0,0]=4 23860 B16R1.7393 Cc1cc(ccc1F)CC(=O)NCCCF 240690a_100015189416_100011667458 [0,2,0,0,0,0|2,0,0]=4 23861 B16R1.7393 Cc1cc(ccc1F)CC(=O)NCCCF 527a_100015189416_100011667458 [0,2,0,0,0,0|2,0,0]=4 23862 B16R1.7393 Cc1cc(ccc1F)CC(=O)NCCCO 240690a_100000182051_100011667458 [0,2,0,0,0,0|2,0,0]=4 23863 B16R1.7393 Cc1cc(ccc1F)CC(=O)NCCCO 527a_100000182051_100011667458 [0,2,0,0,0,0|2,0,0]=4 23864 B16R1.7393 Cc1cc(ccc1O)CC(=O)CCCCF 1458a_100000083968_100000729493 [0,2,0,0,0,0|2,0,0]=4 23865 B16R1.7393 Cc1cc(ccc1O)CC(=O)CCCCO 1458a_100000083968_100000210776 [0,2,0,0,0,0|2,0,0]=4 23866 B16R1.7393 Cc1cc(ccc1O)CC(=O)NCCCF 240690a_100015189416_100000083968 [0,2,0,0,0,0|2,0,0]=4 23867 B16R1.7393 Cc1cc(ccc1O)CC(=O)NCCCF 527a_100015189416_100000083968 [0,2,0,0,0,0|2,0,0]=4 23868 B16R1.7393 Cc1cc(ccc1O)CC(=O)NCCCO 240690a_100000182051_100000083968 [0,2,0,0,0,0|2,0,0]=4 23869 B16R1.7393 Cc1cc(ccc1O)CC(=O)NCCCO 527a_100000182051_100000083968 [0,2,0,0,0,0|2,0,0]=4 23870 B16R1.7393 Cc1ccc(cc1Br)CC(=O)CCCCF 1458a_100000709925_100000729493 [0,2,0,0,0,0|2,0,0]=4 23871 B16R1.7393 Cc1ccc(cc1Br)CC(=O)CCCCO 1458a_100000695505_100012232412 [0,2,0,0,0,0|2,0,0]=4 23872 B16R1.7393 Cc1ccc(cc1Br)CC(=O)CCCCO 1458a_100000709925_100000210776 [0,2,0,0,0,0|2,0,0]=4 23873 B16R1.7393 Cc1ccc(cc1Br)CC(=O)NCCCF 11a_100015189416_100000709925 [0,2,0,0,0,0|2,0,0]=4 23874 B16R1.7393 Cc1ccc(cc1Br)CC(=O)NCCCF 240690a_100015189416_100000709925 [0,2,0,0,0,0|2,0,0]=4 23875 B16R1.7393 Cc1ccc(cc1Br)CC(=O)NCCCF 527a_100015189416_100000709925 [0,2,0,0,0,0|2,0,0]=4 23876 B16R1.7393 Cc1ccc(cc1Br)CC(=O)NCCCO 240690a_100000182051_100000709925 [0,2,0,0,0,0|2,0,0]=4 23877 B16R1.7393 Cc1ccc(cc1Br)CC(=O)NCCCO 527a_100000182051_100000709925 [0,2,0,0,0,0|2,0,0]=4 23878 B16R1.7393 Cc1ccc(cc1C)CC(=O)CCCCF 1458a_100000184070_100000729493 [0,2,0,0,0,0|2,0,0]=4 23879 B16R1.7393 Cc1ccc(cc1C)CC(=O)CCCCO 1458a_100000184070_100000210776 [0,2,0,0,0,0|2,0,0]=4 23880 B16R1.7393 Cc1ccc(cc1C)CC(=O)CCCCO 1458a_100000695505_100000742320 [0,2,0,0,0,0|2,0,0]=4 23881 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCF 11a_100015189416_100000184070 [0,2,0,0,0,0|2,0,0]=4 23882 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCF 240690a_100015189416_100000184070 [0,2,0,0,0,0|2,0,0]=4 23883 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCF 527a_100015189416_100000184070 [0,2,0,0,0,0|2,0,0]=4 23884 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCO 240690a_100000182051_100000184070 [0,2,0,0,0,0|2,0,0]=4 23885 B16R1.7393 Cc1ccc(cc1C)CC(=O)NCCCO 527a_100000182051_100000184070 [0,2,0,0,0,0|2,0,0]=4 23886 B16R1.7393 Cc1ccc(cc1Cl)CC(=O)CCCCO 1458a_100000695505_100011823929 [0,2,0,0,0,0|2,0,0]=4 23887 B16R1.7393 Cc1ccc(cc1F)CC(=O)CCCCF 1458a_100011217375_100000729493 [0,2,0,0,0,0|2,0,0]=4 23888 B16R1.7393 Cc1ccc(cc1F)CC(=O)CCCCO 1458a_100000695505_100011217369 [0,2,0,0,0,0|2,0,0]=4 23889 B16R1.7393 Cc1ccc(cc1F)CC(=O)CCCCO 1458a_100011217375_100000210776 [0,2,0,0,0,0|2,0,0]=4 23890 B16R1.7393 Cc1ccc(cc1F)CC(=O)NCCCF 11a_100015189416_100011217375 [0,2,0,0,0,0|2,0,0]=4 23891 B16R1.7393 Cc1ccc(cc1F)CC(=O)NCCCF 240690a_100015189416_100011217375 [0,2,0,0,0,0|2,0,0]=4 23892 B16R1.7393 Cc1ccc(cc1F)CC(=O)NCCCF 527a_100015189416_100011217375 [0,2,0,0,0,0|2,0,0]=4 23893 B16R1.7393 Cc1ccc(cc1F)CC(=O)NCCCO 240690a_100000182051_100011217375 [0,2,0,0,0,0|2,0,0]=4 23894 B16R1.7393 Cc1ccc(cc1F)CC(=O)NCCCO 527a_100000182051_100011217375 [0,2,0,0,0,0|2,0,0]=4 23895 B16R1.7393 Cc1ccc(cc1I)CC(=O)CCCCO 1458a_100000695505_100010206137 [0,2,0,0,0,0|2,0,0]=4 23896 B16R1.7393 Cc1ccc(cc1O)CC(=O)CCCCF 1458a_100000082272_100000729493 [0,2,0,0,0,0|2,0,0]=4 23897 B16R1.7393 Cc1ccc(cc1O)CC(=O)CCCCO 1458a_100000082272_100000210776 [0,2,0,0,0,0|2,0,0]=4 23898 B16R1.7393 Cc1ccc(cc1O)CC(=O)NCCCF 11a_100015189416_100000082272 [0,2,0,0,0,0|2,0,0]=4 23899 B16R1.7393 Cc1ccc(cc1O)CC(=O)NCCCF 240690a_100015189416_100000082272 [0,2,0,0,0,0|2,0,0]=4 23900 B16R1.7393 Cc1ccc(cc1O)CC(=O)NCCCF 527a_100015189416_100000082272 [0,2,0,0,0,0|2,0,0]=4 23901 B16R1.7393 Cc1ccc(cc1O)CC(=O)NCCCO 240690a_100000182051_100000082272 [0,2,0,0,0,0|2,0,0]=4 23902 B16R1.7393 Cc1ccc(cc1O)CC(=O)NCCCO 527a_100000182051_100000082272 [0,2,0,0,0,0|2,0,0]=4 23903 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000729493 [0,2,0,0,0,0|2,0,0]=4 23904 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000729493 [0,2,0,0,0,0|2,0,0]=4 23905 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000729493 [0,2,0,0,0,0|2,0,0]=4 23906 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000729493 [0,2,0,0,0,0|2,0,0]=4 23907 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000729493 [0,2,0,0,0,0|2,0,0]=4 23908 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000729493 [0,2,0,0,0,0|2,0,0]=4 23909 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000729493 [0,2,0,0,0,0|2,0,0]=4 23910 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000729493 [0,2,0,0,0,0|2,0,0]=4 23911 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000729493 [0,2,0,0,0,0|2,0,0]=4 23912 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)F)F 1458a_100000684721_100000729493 [0,2,0,0,0,0|2,0,0]=4 23913 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)F)I 1458a_100010149632_100000729493 [0,2,0,0,0,0|2,0,0]=4 23914 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)F)O 1458a_100000039761_100000729493 [0,2,0,0,0,0|2,0,0]=4 23915 B16R1.7393 O=C(CCCCF)Cc1ccc(c(c1)O)O 1458a_100000031429_100000729493 [0,2,0,0,0,0|2,0,0]=4 23916 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)Br 1458a_100000695505_100012353900 [0,2,0,0,0,0|2,0,0]=4 23917 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)Cl 1458a_100000695505_100012353894 [0,2,0,0,0,0|2,0,0]=4 23918 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210776 [0,2,0,0,0,0|2,0,0]=4 23919 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)F 1458a_100000695505_100011206884 [0,2,0,0,0,0|2,0,0]=4 23920 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210776 [0,2,0,0,0,0|2,0,0]=4 23921 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210776 [0,2,0,0,0,0|2,0,0]=4 23922 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)Br 1458a_100000695505_100012353895 [0,2,0,0,0,0|2,0,0]=4 23923 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210776 [0,2,0,0,0,0|2,0,0]=4 23924 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210776 [0,2,0,0,0,0|2,0,0]=4 23925 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)Cl 1458a_100000695505_100000184707 [0,2,0,0,0,0|2,0,0]=4 23926 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)F 1458a_100000695505_100000717365 [0,2,0,0,0,0|2,0,0]=4 23927 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210776 [0,2,0,0,0,0|2,0,0]=4 23928 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)I 1458a_100000695505_100012349665 [0,2,0,0,0,0|2,0,0]=4 23929 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210776 [0,2,0,0,0,0|2,0,0]=4 23930 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210776 [0,2,0,0,0,0|2,0,0]=4 23931 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)Br 1458a_100000695505_100000767054 [0,2,0,0,0,0|2,0,0]=4 23932 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)Cl 1458a_100000695505_100000716492 [0,2,0,0,0,0|2,0,0]=4 23933 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210776 [0,2,0,0,0,0|2,0,0]=4 23934 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210776 [0,2,0,0,0,0|2,0,0]=4 23935 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)F 1458a_100000695505_100000757363 [0,2,0,0,0,0|2,0,0]=4 23936 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)I 1458a_100000695505_100010149604 [0,2,0,0,0,0|2,0,0]=4 23937 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210776 [0,2,0,0,0,0|2,0,0]=4 23938 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210776 [0,2,0,0,0,0|2,0,0]=4 23939 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)I)Br 1458a_100000695505_100010146616 [0,2,0,0,0,0|2,0,0]=4 23940 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)I)F 1458a_100000695505_100010188208 [0,2,0,0,0,0|2,0,0]=4 23941 B16R1.7393 O=C(CCCCO)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210776 [0,2,0,0,0,0|2,0,0]=4 23942 B16R1.7393 O=C(Cc1ccc(c(c1)Br)Cl)NCCCF 11a_100015189416_100012349508 [0,2,0,0,0,0|2,0,0]=4 23943 B16R1.7393 O=C(Cc1ccc(c(c1)Br)Cl)NCCCF 240690a_100015189416_100012349508 [0,2,0,0,0,0|2,0,0]=4 23944 B16R1.7393 O=C(Cc1ccc(c(c1)Br)Cl)NCCCF 527a_100015189416_100012349508 [0,2,0,0,0,0|2,0,0]=4 23945 B16R1.7393 O=C(Cc1ccc(c(c1)Br)Cl)NCCCO 240690a_100000182051_100012349508 [0,2,0,0,0,0|2,0,0]=4 23946 B16R1.7393 O=C(Cc1ccc(c(c1)Br)Cl)NCCCO 527a_100000182051_100012349508 [0,2,0,0,0,0|2,0,0]=4 23947 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCF 11a_100015189416_100000742997 [0,2,0,0,0,0|2,0,0]=4 23948 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCF 240690a_100015189416_100000742997 [0,2,0,0,0,0|2,0,0]=4 23949 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCF 527a_100015189416_100000742997 [0,2,0,0,0,0|2,0,0]=4 23950 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCO 240690a_100000182051_100000742997 [0,2,0,0,0,0|2,0,0]=4 23951 B16R1.7393 O=C(Cc1ccc(c(c1)Br)F)NCCCO 527a_100000182051_100000742997 [0,2,0,0,0,0|2,0,0]=4 23952 B16R1.7393 O=C(Cc1ccc(c(c1)Br)O)NCCCF 240690a_100015189416_100009990404 [0,2,0,0,0,0|2,0,0]=4 23953 B16R1.7393 O=C(Cc1ccc(c(c1)Br)O)NCCCF 527a_100015189416_100009990404 [0,2,0,0,0,0|2,0,0]=4 23954 B16R1.7393 O=C(Cc1ccc(c(c1)Br)O)NCCCO 240690a_100000182051_100009990404 [0,2,0,0,0,0|2,0,0]=4 23955 B16R1.7393 O=C(Cc1ccc(c(c1)Br)O)NCCCO 527a_100000182051_100009990404 [0,2,0,0,0,0|2,0,0]=4 23956 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Br)NCCCF 11a_100015189416_100000766880 [0,2,0,0,0,0|2,0,0]=4 23957 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Br)NCCCF 240690a_100015189416_100000766880 [0,2,0,0,0,0|2,0,0]=4 23958 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Br)NCCCF 527a_100015189416_100000766880 [0,2,0,0,0,0|2,0,0]=4 23959 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Br)NCCCO 240690a_100000182051_100000766880 [0,2,0,0,0,0|2,0,0]=4 23960 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Br)NCCCO 527a_100000182051_100000766880 [0,2,0,0,0,0|2,0,0]=4 23961 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCF 11a_100015189416_100000210702 [0,2,0,0,0,0|2,0,0]=4 23962 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCF 240690a_100015189416_100000210702 [0,2,0,0,0,0|2,0,0]=4 23963 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCF 527a_100015189416_100000210702 [0,2,0,0,0,0|2,0,0]=4 23964 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCO 240690a_100000182051_100000210702 [0,2,0,0,0,0|2,0,0]=4 23965 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)Cl)NCCCO 527a_100000182051_100000210702 [0,2,0,0,0,0|2,0,0]=4 23966 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCF 11a_100015189416_100011217296 [0,2,0,0,0,0|2,0,0]=4 23967 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCF 1626a_100015189416_100011217296 [0,2,0,0,0,0|2,0,0]=4 23968 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCF 240690a_100015189416_100011217296 [0,2,0,0,0,0|2,0,0]=4 23969 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCF 527a_100015189416_100011217296 [0,2,0,0,0,0|2,0,0]=4 23970 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCO 240690a_100000182051_100011217296 [0,2,0,0,0,0|2,0,0]=4 23971 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)F)NCCCO 527a_100000182051_100011217296 [0,2,0,0,0,0|2,0,0]=4 23972 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)O)NCCCF 240690a_100015189416_100000035197 [0,2,0,0,0,0|2,0,0]=4 23973 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)O)NCCCF 527a_100015189416_100000035197 [0,2,0,0,0,0|2,0,0]=4 23974 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)O)NCCCO 240690a_100000182051_100000035197 [0,2,0,0,0,0|2,0,0]=4 23975 B16R1.7393 O=C(Cc1ccc(c(c1)Cl)O)NCCCO 527a_100000182051_100000035197 [0,2,0,0,0,0|2,0,0]=4 23976 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCF 11a_100015189416_100000691132 [0,2,0,0,0,0|2,0,0]=4 23977 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCF 240690a_100015189416_100000691132 [0,2,0,0,0,0|2,0,0]=4 23978 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCF 527a_100015189416_100000691132 [0,2,0,0,0,0|2,0,0]=4 23979 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCO 240690a_100000182051_100000691132 [0,2,0,0,0,0|2,0,0]=4 23980 B16R1.7393 O=C(Cc1ccc(c(c1)F)Br)NCCCO 527a_100000182051_100000691132 [0,2,0,0,0,0|2,0,0]=4 23981 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCF 11a_100015189416_100000722404 [0,2,0,0,0,0|2,0,0]=4 23982 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCF 240690a_100015189416_100000722404 [0,2,0,0,0,0|2,0,0]=4 23983 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCF 527a_100015189416_100000722404 [0,2,0,0,0,0|2,0,0]=4 23984 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCO 240690a_100000182051_100000722404 [0,2,0,0,0,0|2,0,0]=4 23985 B16R1.7393 O=C(Cc1ccc(c(c1)F)Cl)NCCCO 527a_100000182051_100000722404 [0,2,0,0,0,0|2,0,0]=4 23986 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCF 11a_100015189416_100000684721 [0,2,0,0,0,0|2,0,0]=4 23987 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCF 1626a_100015189416_100000684721 [0,2,0,0,0,0|2,0,0]=4 23988 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCF 240690a_100015189416_100000684721 [0,2,0,0,0,0|2,0,0]=4 23989 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCF 527a_100015189416_100000684721 [0,2,0,0,0,0|2,0,0]=4 23990 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCO 240690a_100000182051_100000684721 [0,2,0,0,0,0|2,0,0]=4 23991 B16R1.7393 O=C(Cc1ccc(c(c1)F)F)NCCCO 527a_100000182051_100000684721 [0,2,0,0,0,0|2,0,0]=4 23992 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCF 11a_100015189416_100010149632 [0,2,0,0,0,0|2,0,0]=4 23993 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCF 1626a_100015189416_100010149632 [0,2,0,0,0,0|2,0,0]=4 23994 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCF 240690a_100015189416_100010149632 [0,2,0,0,0,0|2,0,0]=4 23995 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCF 527a_100015189416_100010149632 [0,2,0,0,0,0|2,0,0]=4 23996 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCO 240690a_100000182051_100010149632 [0,2,0,0,0,0|2,0,0]=4 23997 B16R1.7393 O=C(Cc1ccc(c(c1)F)I)NCCCO 527a_100000182051_100010149632 [0,2,0,0,0,0|2,0,0]=4 23998 B16R1.7393 O=C(Cc1ccc(c(c1)F)O)NCCCF 240690a_100015189416_100000039761 [0,2,0,0,0,0|2,0,0]=4 23999 B16R1.7393 O=C(Cc1ccc(c(c1)F)O)NCCCF 527a_100015189416_100000039761 [0,2,0,0,0,0|2,0,0]=4 24000 B16R1.7393 O=C(Cc1ccc(c(c1)F)O)NCCCO 240690a_100000182051_100000039761 [0,2,0,0,0,0|2,0,0]=4 24001 B16R1.7393 O=C(Cc1ccc(c(c1)F)O)NCCCO 527a_100000182051_100000039761 [0,2,0,0,0,0|2,0,0]=4 24002 B16R1.7393 O=C(Cc1ccc(c(c1)O)O)NCCCF 527a_100015189416_100000031429 [0,2,0,0,0,0|2,0,0]=4 24003 B16R1.7393 O=C(Cc1ccc(c(c1)O)O)NCCCO 527a_100000182051_100000031429 [0,2,0,0,0,0|2,0,0]=4 24004 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Br 270084a_100000102301_100000764255 [0,2,0,0,0,0|2,0,0]=4 24005 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Br 274078a_100000102301_100000764255 [0,2,0,0,0,0|2,0,0]=4 24006 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)C 270084a_100000102301_100000689310 [0,2,0,0,0,0|2,0,0]=4 24007 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)C 274078a_100000102301_100000689310 [0,2,0,0,0,0|2,0,0]=4 24008 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Cl 270084a_100000102301_100011198069 [0,2,0,0,0,0|2,0,0]=4 24009 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)Cl 274078a_100000102301_100011198069 [0,2,0,0,0,0|2,0,0]=4 24010 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)F 270084a_100000102301_100000735682 [0,2,0,0,0,0|2,0,0]=4 24011 B16R1.20522 CCCCNS(=O)(=O)Cc1ccc(cc1)F 274078a_100000102301_100000735682 [0,2,0,0,0,0|2,0,0]=4 24012 B16R1.20522 CCCCOC(C)(C)Cc1ccc(cc1)C 7a_200011350412_100000210211 [0,2,0,0,0,0|1,0,1]=4 24013 B16R1.20522 CCCCOC(C)(C)Cc1ccc(cc1)Cl 34a_200011350411_100000210210 [0,2,0,0,0,0|1,0,1]=4 24014 B16R1.20522 CCCCOC(C)(C)Cc1ccc(cc1)Cl 7a_200011350411_100000210211 [0,2,0,0,0,0|1,0,1]=4 24015 B16R1.20522 CCCCOC(C)(C)Cc1ccc(cc1)F 34a_200011350416_100000210210 [0,2,0,0,0,0|1,0,1]=4 24016 B16R1.20522 CCCCOC(C)(C)Cc1ccc(cc1)F 7a_200011350416_100000210211 [0,2,0,0,0,0|1,0,1]=4 24017 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Br)Br 1458a_200011218047_200012351560 [0,2,0,0,0,0|1,0,1]=4 24018 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Br)Cl 1458a_200011218047_100000755608 [0,2,0,0,0,0|1,0,1]=4 24019 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Br)F 1458a_200011218047_100000243222 [0,2,0,0,0,0|1,0,1]=4 24020 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Br)I 1458a_200011218047_100010146610 [0,2,0,0,0,0|1,0,1]=4 24021 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1C)Br 1458a_200011218047_100000708836 [0,2,0,0,0,0|1,0,1]=4 24022 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1C)C 1458a_200011218047_100011219618 [0,2,0,0,0,0|1,0,1]=4 24023 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1C)Cl 1458a_200011218047_100012361307 [0,2,0,0,0,0|1,0,1]=4 24024 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1C)F 1458a_200011218047_100000700533 [0,2,0,0,0,0|1,0,1]=4 24025 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Cl)Br 1458a_200011218047_100011740631 [0,2,0,0,0,0|1,0,1]=4 24026 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Cl)C 1458a_200011218047_100012349684 [0,2,0,0,0,0|1,0,1]=4 24027 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Cl)Cl 1458a_200011218047_100000188473 [0,2,0,0,0,0|1,0,1]=4 24028 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1Cl)F 1458a_200011218047_100011216360 [0,2,0,0,0,0|1,0,1]=4 24029 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1F)Br 1458a_200011218047_100000211606 [0,2,0,0,0,0|1,0,1]=4 24030 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1F)C 1458a_200011218047_100012002367 [0,2,0,0,0,0|1,0,1]=4 24031 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1F)Cl 1458a_200011218047_100000709361 [0,2,0,0,0,0|1,0,1]=4 24032 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1F)F 1458a_200011218047_100000748237 [0,2,0,0,0,0|1,0,1]=4 24033 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1F)I 1458a_200011218047_100010244991 [0,2,0,0,0,0|1,0,1]=4 24034 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1I)Br 1458a_200011218047_100010146615 [0,2,0,0,0,0|1,0,1]=4 24035 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1I)Cl 1458a_200011218047_100010254388 [0,2,0,0,0,0|1,0,1]=4 24036 B16R1.22955 CCCC#CC(=O)Cc1ccc(cc1I)F 1458a_200011218047_100012354799 [0,2,0,0,0,0|1,0,1]=4 24037 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Br)Br 1458a_100000212230_200012351560 [0,2,0,0,0,0|1,0,1]=4 24038 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000212230_100000755608 [0,2,0,0,0,0|1,0,1]=4 24039 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Br)F 1458a_100000212230_100000243222 [0,2,0,0,0,0|1,0,1]=4 24040 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Br)I 1458a_100000212230_100010146610 [0,2,0,0,0,0|1,0,1]=4 24041 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1C)Br 1458a_100000212230_100000708836 [0,2,0,0,0,0|1,0,1]=4 24042 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1C)C 1458a_100000212230_100011219618 [0,2,0,0,0,0|1,0,1]=4 24043 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1C)Cl 1458a_100000212230_100012361307 [0,2,0,0,0,0|1,0,1]=4 24044 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1C)F 1458a_100000212230_100000700533 [0,2,0,0,0,0|1,0,1]=4 24045 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000212230_100011740631 [0,2,0,0,0,0|1,0,1]=4 24046 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Cl)C 1458a_100000212230_100012349684 [0,2,0,0,0,0|1,0,1]=4 24047 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000212230_100000188473 [0,2,0,0,0,0|1,0,1]=4 24048 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1Cl)F 1458a_100000212230_100011216360 [0,2,0,0,0,0|1,0,1]=4 24049 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1F)Br 1458a_100000212230_100000211606 [0,2,0,0,0,0|1,0,1]=4 24050 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1F)C 1458a_100000212230_100012002367 [0,2,0,0,0,0|1,0,1]=4 24051 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1F)Cl 1458a_100000212230_100000709361 [0,2,0,0,0,0|1,0,1]=4 24052 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1F)F 1458a_100000212230_100000748237 [0,2,0,0,0,0|1,0,1]=4 24053 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1F)I 1458a_100000212230_100010244991 [0,2,0,0,0,0|1,0,1]=4 24054 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1I)Br 1458a_100000212230_100010146615 [0,2,0,0,0,0|1,0,1]=4 24055 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1I)Cl 1458a_100000212230_100010254388 [0,2,0,0,0,0|1,0,1]=4 24056 B16R1.22955 CCCC=CC(=O)Cc1ccc(cc1I)F 1458a_100000212230_100012354799 [0,2,0,0,0,0|1,0,1]=4 24057 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000212188_200012351560 [0,2,0,0,0,0|1,0,0]=3 24058 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210326 [0,2,0,0,0,0|1,0,0]=3 24059 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000212188_100000755608 [0,2,0,0,0,0|1,0,0]=3 24060 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210326 [0,2,0,0,0,0|1,0,0]=3 24061 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000212188_100000243222 [0,2,0,0,0,0|1,0,0]=3 24062 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000210326 [0,2,0,0,0,0|1,0,0]=3 24063 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)I 1458a_100000212188_100010146610 [0,2,0,0,0,0|1,0,0]=3 24064 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000210326 [0,2,0,0,0,0|1,0,0]=3 24065 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000212188_100000708836 [0,2,0,0,0,0|1,0,0]=3 24066 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000210326 [0,2,0,0,0,0|1,0,0]=3 24067 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)C 1458a_100000212188_100011219618 [0,2,0,0,0,0|1,0,0]=3 24068 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000210326 [0,2,0,0,0,0|1,0,0]=3 24069 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000212188_100012361307 [0,2,0,0,0,0|1,0,0]=3 24070 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)F 1458a_100000212188_100000700533 [0,2,0,0,0,0|1,0,0]=3 24071 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000210326 [0,2,0,0,0,0|1,0,0]=3 24072 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000212188_100011740631 [0,2,0,0,0,0|1,0,0]=3 24073 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210326 [0,2,0,0,0,0|1,0,0]=3 24074 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000212188_100012349684 [0,2,0,0,0,0|1,0,0]=3 24075 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210326 [0,2,0,0,0,0|1,0,0]=3 24076 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000212188_100000188473 [0,2,0,0,0,0|1,0,0]=3 24077 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000212188_100011216360 [0,2,0,0,0,0|1,0,0]=3 24078 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210326 [0,2,0,0,0,0|1,0,0]=3 24079 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Br 1458a_100000212188_100000211606 [0,2,0,0,0,0|1,0,0]=3 24080 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000210326 [0,2,0,0,0,0|1,0,0]=3 24081 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000210326 [0,2,0,0,0,0|1,0,0]=3 24082 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)C 1458a_100000212188_100012002367 [0,2,0,0,0,0|1,0,0]=3 24083 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000212188_100000709361 [0,2,0,0,0,0|1,0,0]=3 24084 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210326 [0,2,0,0,0,0|1,0,0]=3 24085 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)F 1458a_100000212188_100000748237 [0,2,0,0,0,0|1,0,0]=3 24086 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000210326 [0,2,0,0,0,0|1,0,0]=3 24087 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)I 1458a_100000212188_100010244991 [0,2,0,0,0,0|1,0,0]=3 24088 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000210326 [0,2,0,0,0,0|1,0,0]=3 24089 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000210326 [0,2,0,0,0,0|1,0,0]=3 24090 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)Br 1458a_100000212188_100010146615 [0,2,0,0,0,0|1,0,0]=3 24091 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000212188_100010254388 [0,2,0,0,0,0|1,0,0]=3 24092 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1I)F 1458a_100000212188_100012354799 [0,2,0,0,0,0|1,0,0]=3 24093 B16R1.22955 CCCCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000210326 [0,2,0,0,0,0|1,0,0]=3 24094 B16R1.22955 CCCCCC(=O)Cc1ccc(nc1Br)C 1458a_100000212188_200010064658 [0,2,0,0,0,0|2,0,0]=4 24095 B16R1.22955 CCCCCC(=O)Cc1ccc(nc1Cl)Cl 1458a_100000212188_100000722033 [0,2,0,0,0,0|2,0,0]=4 24096 B16R1.22955 CCCCCC(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_100000210326 [0,2,0,0,0,0|2,0,0]=4 24097 B16R1.22955 CCCCCC(=O)Cc1cnc(cc1C)F 1458a_100000212188_100010382440 [0,2,0,0,0,0|2,0,0]=4 24098 B16R1.22955 CCCCCC(=O)Cc1cnc(cc1Cl)Cl 1458a_100000212188_100011997056 [0,2,0,0,0,0|2,0,0]=4 24099 B16R1.22955 CCCCCC(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_100000210326 [0,2,0,0,0,0|2,0,0]=4 24100 B16R1.22955 CCCCCC(=O)Cc1ncc(cc1C)C 1458a_100000212188_100016990036 [0,2,0,0,0,0|2,0,0]=4 24101 B16R1.22955 CCCCCC(=O)Cc1ncc(cc1F)Br 1458a_100012351917_100000210326 [0,2,0,0,0,0|2,0,0]=4 24102 B16R1.22955 CCCCCC(=O)Cc1ncc(cc1F)Cl 1458a_100000212188_200009879301 [0,2,0,0,0,0|2,0,0]=4 24103 B16R1.22955 CCCCCC(=O)Cn1ccc(cc1=O)C 1458a_100000721392_100000210326 [0,2,0,0,0,0|2,0,0]=4 24104 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100000212188 [0,2,0,0,0,0|2,0,0]=4 24105 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100000212188 [0,2,0,0,0,0|2,0,0]=4 24106 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000212188 [0,2,0,0,0,0|2,0,0]=4 24107 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000212188 [0,2,0,0,0,0|2,0,0]=4 24108 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100000212188 [0,2,0,0,0,0|2,0,0]=4 24109 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100000212188 [0,2,0,0,0,0|2,0,0]=4 24110 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100000212188 [0,2,0,0,0,0|2,0,0]=4 24111 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100000212188 [0,2,0,0,0,0|2,0,0]=4 24112 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100000212188 [0,2,0,0,0,0|2,0,0]=4 24113 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100000212188 [0,2,0,0,0,0|2,0,0]=4 24114 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000212188 [0,2,0,0,0,0|2,0,0]=4 24115 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100000212188 [0,2,0,0,0,0|2,0,0]=4 24116 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100000212188 [0,2,0,0,0,0|2,0,0]=4 24117 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100000212188 [0,2,0,0,0,0|2,0,0]=4 24118 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000212188 [0,2,0,0,0,0|2,0,0]=4 24119 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000212188 [0,2,0,0,0,0|2,0,0]=4 24120 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000212188 [0,2,0,0,0,0|2,0,0]=4 24121 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000212188 [0,2,0,0,0,0|2,0,0]=4 24122 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000212188 [0,2,0,0,0,0|2,0,0]=4 24123 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100000212188 [0,2,0,0,0,0|2,0,0]=4 24124 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100000212188 [0,2,0,0,0,0|2,0,0]=4 24125 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000212188 [0,2,0,0,0,0|2,0,0]=4 24126 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 11a_100000211637_100000212188 [0,2,0,0,0,0|2,0,0]=4 24127 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100000212188 [0,2,0,0,0,0|2,0,0]=4 24128 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000212188 [0,2,0,0,0,0|2,0,0]=4 24129 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)F 527a_100000211637_100000212188 [0,2,0,0,0,0|2,0,0]=4 24130 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 11a_100000184554_100000212188 [0,2,0,0,0,0|2,0,0]=4 24131 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100000212188 [0,2,0,0,0,0|2,0,0]=4 24132 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000212188 [0,2,0,0,0,0|2,0,0]=4 24133 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000212188 [0,2,0,0,0,0|2,0,0]=4 24134 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1C)O 527a_100000756630_100000212188 [0,2,0,0,0,0|2,0,0]=4 24135 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000212188 [0,2,0,0,0,0|2,0,0]=4 24136 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000212188 [0,2,0,0,0,0|2,0,0]=4 24137 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000212188 [0,2,0,0,0,0|2,0,0]=4 24138 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000212188 [0,2,0,0,0,0|2,0,0]=4 24139 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000212188 [0,2,0,0,0,0|2,0,0]=4 24140 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000212188 [0,2,0,0,0,0|2,0,0]=4 24141 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000212188 [0,2,0,0,0,0|2,0,0]=4 24142 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000212188 [0,2,0,0,0,0|2,0,0]=4 24143 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000212188 [0,2,0,0,0,0|2,0,0]=4 24144 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000212188 [0,2,0,0,0,0|2,0,0]=4 24145 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000212188 [0,2,0,0,0,0|2,0,0]=4 24146 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000212188 [0,2,0,0,0,0|2,0,0]=4 24147 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000212188 [0,2,0,0,0,0|2,0,0]=4 24148 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000212188 [0,2,0,0,0,0|2,0,0]=4 24149 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000212188 [0,2,0,0,0,0|2,0,0]=4 24150 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000212188 [0,2,0,0,0,0|2,0,0]=4 24151 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100000212188 [0,2,0,0,0,0|2,0,0]=4 24152 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100000212188 [0,2,0,0,0,0|2,0,0]=4 24153 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000212188 [0,2,0,0,0,0|2,0,0]=4 24154 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000212188 [0,2,0,0,0,0|2,0,0]=4 24155 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000212188 [0,2,0,0,0,0|2,0,0]=4 24156 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000212188 [0,2,0,0,0,0|2,0,0]=4 24157 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000212188 [0,2,0,0,0,0|2,0,0]=4 24158 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100000212188 [0,2,0,0,0,0|2,0,0]=4 24159 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100000212188 [0,2,0,0,0,0|2,0,0]=4 24160 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000212188 [0,2,0,0,0,0|2,0,0]=4 24161 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 11a_100000210720_100000212188 [0,2,0,0,0,0|2,0,0]=4 24162 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100000212188 [0,2,0,0,0,0|2,0,0]=4 24163 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000212188 [0,2,0,0,0,0|2,0,0]=4 24164 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 11a_100011215594_100000212188 [0,2,0,0,0,0|2,0,0]=4 24165 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100000212188 [0,2,0,0,0,0|2,0,0]=4 24166 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000212188 [0,2,0,0,0,0|2,0,0]=4 24167 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000212188 [0,2,0,0,0,0|2,0,0]=4 24168 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1F)O 527a_100000759473_100000212188 [0,2,0,0,0,0|2,0,0]=4 24169 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100000212188 [0,2,0,0,0,0|2,0,0]=4 24170 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100000212188 [0,2,0,0,0,0|2,0,0]=4 24171 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000212188 [0,2,0,0,0,0|2,0,0]=4 24172 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000212188 [0,2,0,0,0,0|2,0,0]=4 24173 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100000212188 [0,2,0,0,0,0|2,0,0]=4 24174 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100000212188 [0,2,0,0,0,0|2,0,0]=4 24175 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 11a_100000760547_100000212188 [0,2,0,0,0,0|2,0,0]=4 24176 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100000212188 [0,2,0,0,0,0|2,0,0]=4 24177 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000212188 [0,2,0,0,0,0|2,0,0]=4 24178 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)I 11a_100010002754_100000212188 [0,2,0,0,0,0|2,0,0]=4 24179 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100000212188 [0,2,0,0,0,0|2,0,0]=4 24180 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000212188 [0,2,0,0,0,0|2,0,0]=4 24181 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1I)O 527a_100010084370_100000212188 [0,2,0,0,0,0|2,0,0]=4 24182 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000212188 [0,2,0,0,0,0|2,0,0]=4 24183 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100000212188 [0,2,0,0,0,0|2,0,0]=4 24184 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000212188 [0,2,0,0,0,0|2,0,0]=4 24185 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000212188 [0,2,0,0,0,0|2,0,0]=4 24186 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000212188 [0,2,0,0,0,0|2,0,0]=4 24187 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100000212188 [0,2,0,0,0,0|2,0,0]=4 24188 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000212188 [0,2,0,0,0,0|2,0,0]=4 24189 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)F 527a_100000753323_100000212188 [0,2,0,0,0,0|2,0,0]=4 24190 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000212188 [0,2,0,0,0,0|2,0,0]=4 24191 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)I 527a_100000057187_100000212188 [0,2,0,0,0,0|2,0,0]=4 24192 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000212188 [0,2,0,0,0,0|2,0,0]=4 24193 B16R1.22955 CCCCCC(=O)Nc1ccc(cc1O)O 527a_100000106777_100000212188 [0,2,0,0,0,0|2,0,0]=4 24194 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 11a_100000102301_100010172832 [0,2,0,0,0,0|1,0,0]=3 24195 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 240690a_100000102301_100010172832 [0,2,0,0,0,0|1,0,0]=3 24196 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Br 527a_100000102301_100010172832 [0,2,0,0,0,0|1,0,0]=3 24197 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 11a_100000102301_100000755479 [0,2,0,0,0,0|1,0,0]=3 24198 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100000102301_100000755479 [0,2,0,0,0,0|1,0,0]=3 24199 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100000102301_100000755479 [0,2,0,0,0,0|1,0,0]=3 24200 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)Cl 527a_100000102301_100000755479 [0,2,0,0,0,0|1,0,0]=3 24201 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 11a_100000102301_100000708238 [0,2,0,0,0,0|1,0,0]=3 24202 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 1626a_100000102301_100000708238 [0,2,0,0,0,0|1,0,0]=3 24203 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 240690a_100000102301_100000708238 [0,2,0,0,0,0|1,0,0]=3 24204 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)F 527a_100000102301_100000708238 [0,2,0,0,0,0|1,0,0]=3 24205 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)O 240690a_100000102301_100010176083 [0,2,0,0,0,0|1,0,0]=3 24206 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Br)O 527a_100000102301_100010176083 [0,2,0,0,0,0|1,0,0]=3 24207 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 11a_100000102301_100000697930 [0,2,0,0,0,0|1,0,0]=3 24208 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 1626a_100000102301_100000697930 [0,2,0,0,0,0|1,0,0]=3 24209 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 240690a_100000102301_100000697930 [0,2,0,0,0,0|1,0,0]=3 24210 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)Br 527a_100000102301_100000697930 [0,2,0,0,0,0|1,0,0]=3 24211 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 11a_100000102301_100011236500 [0,2,0,0,0,0|1,0,0]=3 24212 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 1626a_100000102301_100011236500 [0,2,0,0,0,0|1,0,0]=3 24213 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 240690a_100000102301_100011236500 [0,2,0,0,0,0|1,0,0]=3 24214 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)C 527a_100000102301_100011236500 [0,2,0,0,0,0|1,0,0]=3 24215 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 11a_100000102301_100011667441 [0,2,0,0,0,0|1,0,0]=3 24216 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 1626a_100000102301_100011667441 [0,2,0,0,0,0|1,0,0]=3 24217 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 240690a_100000102301_100011667441 [0,2,0,0,0,0|1,0,0]=3 24218 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1C)F 527a_100000102301_100011667441 [0,2,0,0,0,0|1,0,0]=3 24219 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 11a_100000102301_100012361378 [0,2,0,0,0,0|1,0,0]=3 24220 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 1626a_100000102301_100012361378 [0,2,0,0,0,0|1,0,0]=3 24221 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100000102301_100012361378 [0,2,0,0,0,0|1,0,0]=3 24222 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Br 527a_100000102301_100012361378 [0,2,0,0,0,0|1,0,0]=3 24223 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100000102301_100000210926 [0,2,0,0,0,0|1,0,0]=3 24224 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100000102301_100000210926 [0,2,0,0,0,0|1,0,0]=3 24225 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100000102301_100000210926 [0,2,0,0,0,0|1,0,0]=3 24226 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100000102301_100000210926 [0,2,0,0,0,0|1,0,0]=3 24227 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 11a_100000102301_100000690284 [0,2,0,0,0,0|1,0,0]=3 24228 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 1626a_100000102301_100000690284 [0,2,0,0,0,0|1,0,0]=3 24229 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 240690a_100000102301_100000690284 [0,2,0,0,0,0|1,0,0]=3 24230 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1Cl)F 527a_100000102301_100000690284 [0,2,0,0,0,0|1,0,0]=3 24231 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 11a_100000102301_100011295475 [0,2,0,0,0,0|1,0,0]=3 24232 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 1626a_100000102301_100011295475 [0,2,0,0,0,0|1,0,0]=3 24233 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 240690a_100000102301_100011295475 [0,2,0,0,0,0|1,0,0]=3 24234 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Br 527a_100000102301_100011295475 [0,2,0,0,0,0|1,0,0]=3 24235 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 11a_100000102301_100000042674 [0,2,0,0,0,0|1,0,0]=3 24236 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 1626a_100000102301_100000042674 [0,2,0,0,0,0|1,0,0]=3 24237 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 240690a_100000102301_100000042674 [0,2,0,0,0,0|1,0,0]=3 24238 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)C 527a_100000102301_100000042674 [0,2,0,0,0,0|1,0,0]=3 24239 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 11a_100000102301_100011830378 [0,2,0,0,0,0|1,0,0]=3 24240 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 1626a_100000102301_100011830378 [0,2,0,0,0,0|1,0,0]=3 24241 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 240690a_100000102301_100011830378 [0,2,0,0,0,0|1,0,0]=3 24242 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)Cl 527a_100000102301_100011830378 [0,2,0,0,0,0|1,0,0]=3 24243 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 11a_100000102301_100000684719 [0,2,0,0,0,0|1,0,0]=3 24244 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 1626a_100000102301_100000684719 [0,2,0,0,0,0|1,0,0]=3 24245 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 240690a_100000102301_100000684719 [0,2,0,0,0,0|1,0,0]=3 24246 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)F 527a_100000102301_100000684719 [0,2,0,0,0,0|1,0,0]=3 24247 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 11a_100000102301_100010149628 [0,2,0,0,0,0|1,0,0]=3 24248 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 1626a_100000102301_100010149628 [0,2,0,0,0,0|1,0,0]=3 24249 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 240690a_100000102301_100010149628 [0,2,0,0,0,0|1,0,0]=3 24250 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)I 527a_100000102301_100010149628 [0,2,0,0,0,0|1,0,0]=3 24251 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)O 240690a_100000102301_100000090534 [0,2,0,0,0,0|1,0,0]=3 24252 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1F)O 527a_100000102301_100000090534 [0,2,0,0,0,0|1,0,0]=3 24253 B16R1.22955 CCCCNC(=O)Cc1ccc(cc1O)Br 240690a_100000102301_100000707504 [0,2,0,0,0,0|1,0,0]=3 24254 B16R1.22955 CCCCNC(=O)Cc1ccc(nc1Cl)Cl 11a_100000102301_200010067290 [0,2,0,0,0,0|2,0,0]=4 24255 B16R1.22955 CCCCNC(=O)Cc1ccc(nc1Cl)Cl 1626a_100000102301_200010067290 [0,2,0,0,0,0|2,0,0]=4 24256 B16R1.22955 CCCCNC(=O)Cc1ccc(nc1Cl)Cl 240690a_100000102301_200010067290 [0,2,0,0,0,0|2,0,0]=4 24257 B16R1.22955 CCCCNC(=O)Cc1ccc(nc1Cl)Cl 527a_100000102301_200010067290 [0,2,0,0,0,0|2,0,0]=4 24258 B16R1.22955 CCCCNC(=O)Cc1ncc(cc1Br)Cl 11a_100000102301_200012351915 [0,2,0,0,0,0|2,0,0]=4 24259 B16R1.22955 CCCCNC(=O)Cc1ncc(cc1Br)Cl 240690a_100000102301_200012351915 [0,2,0,0,0,0|2,0,0]=4 24260 B16R1.22955 CCCCNC(=O)Cc1ncc(cc1F)Br 11a_100000102301_100012351917 [0,2,0,0,0,0|2,0,0]=4 24261 B16R1.22955 CCCCNC(=O)Cc1ncc(cc1F)Br 240690a_100000102301_100012351917 [0,2,0,0,0,0|2,0,0]=4 24262 B16R1.22955 CCCCNC(=O)Cc1ncc(cc1F)Br 527a_100000102301_100012351917 [0,2,0,0,0,0|2,0,0]=4 24263 B16R1.22955 CCCCNC(=O)Cn1ccc(cc1=O)C 1626a_100000102301_100000721392 [0,2,0,0,0,0|2,0,0]=4 24264 B16R1.22955 CCCCNC(=O)Cn1ccc(cc1=O)C 240690a_100000102301_100000721392 [0,2,0,0,0,0|2,0,0]=4 24265 B16R1.22955 CCCCNC(=O)Cn1ccc(cc1=O)C 527a_100000102301_100000721392 [0,2,0,0,0,0|2,0,0]=4 24266 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100000102301 [0,2,0,0,0,0|2,0,0]=4 24267 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100000102301 [0,2,0,0,0,0|2,0,0]=4 24268 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100000102301 [0,2,0,0,0,0|2,0,0]=4 24269 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100000102301 [0,2,0,0,0,0|2,0,0]=4 24270 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100000102301 [0,2,0,0,0,0|2,0,0]=4 24271 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100000102301 [0,2,0,0,0,0|2,0,0]=4 24272 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100000102301 [0,2,0,0,0,0|2,0,0]=4 24273 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100000102301 [0,2,0,0,0,0|2,0,0]=4 24274 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100000102301 [0,2,0,0,0,0|2,0,0]=4 24275 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100000102301 [0,2,0,0,0,0|2,0,0]=4 24276 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100000102301 [0,2,0,0,0,0|2,0,0]=4 24277 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100000102301 [0,2,0,0,0,0|2,0,0]=4 24278 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000102301 [0,2,0,0,0,0|2,0,0]=4 24279 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100000102301 [0,2,0,0,0,0|2,0,0]=4 24280 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000102301 [0,2,0,0,0,0|2,0,0]=4 24281 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100000102301 [0,2,0,0,0,0|2,0,0]=4 24282 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100000102301 [0,2,0,0,0,0|2,0,0]=4 24283 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100000102301 [0,2,0,0,0,0|2,0,0]=4 24284 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100000102301 [0,2,0,0,0,0|2,0,0]=4 24285 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100000102301 [0,2,0,0,0,0|2,0,0]=4 24286 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100000102301 [0,2,0,0,0,0|2,0,0]=4 24287 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100000102301 [0,2,0,0,0,0|2,0,0]=4 24288 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100000102301 [0,2,0,0,0,0|2,0,0]=4 24289 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100000102301 [0,2,0,0,0,0|2,0,0]=4 24290 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100000102301 [0,2,0,0,0,0|2,0,0]=4 24291 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100000102301 [0,2,0,0,0,0|2,0,0]=4 24292 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100000102301 [0,2,0,0,0,0|2,0,0]=4 24293 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100000102301 [0,2,0,0,0,0|2,0,0]=4 24294 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100000102301 [0,2,0,0,0,0|2,0,0]=4 24295 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100000102301 [0,2,0,0,0,0|2,0,0]=4 24296 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100000102301 [0,2,0,0,0,0|2,0,0]=4 24297 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100000102301 [0,2,0,0,0,0|2,0,0]=4 24298 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100000102301 [0,2,0,0,0,0|2,0,0]=4 24299 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100000102301 [0,2,0,0,0,0|2,0,0]=4 24300 B16R1.22955 CCCCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100000102301 [0,2,0,0,0,0|2,0,0]=4 24301 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Br)Br 22a_100000740057_100010172832 [0,2,0,0,0,0|2,0,0]=4 24302 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Br)Cl 22a_100000740057_100000755479 [0,2,0,0,0,0|2,0,0]=4 24303 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Br)F 22a_100000740057_100000708238 [0,2,0,0,0,0|2,0,0]=4 24304 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Br)O 22a_100000740057_100010176083 [0,2,0,0,0,0|2,0,0]=4 24305 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1C)Br 22a_100000740057_100000697930 [0,2,0,0,0,0|2,0,0]=4 24306 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1C)C 22a_100000740057_100011236500 [0,2,0,0,0,0|2,0,0]=4 24307 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1C)F 22a_100000740057_100011667441 [0,2,0,0,0,0|2,0,0]=4 24308 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Cl)Br 22a_100000740057_100012361378 [0,2,0,0,0,0|2,0,0]=4 24309 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Cl)Cl 22a_100000740057_100000210926 [0,2,0,0,0,0|2,0,0]=4 24310 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1Cl)F 22a_100000740057_100000690284 [0,2,0,0,0,0|2,0,0]=4 24311 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)Br 22a_100000740057_100011295475 [0,2,0,0,0,0|2,0,0]=4 24312 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)C 22a_100000740057_100000042674 [0,2,0,0,0,0|2,0,0]=4 24313 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)Cl 22a_100000740057_100011830378 [0,2,0,0,0,0|2,0,0]=4 24314 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)F 22a_100000740057_100000684719 [0,2,0,0,0,0|2,0,0]=4 24315 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)I 22a_100000740057_100010149628 [0,2,0,0,0,0|2,0,0]=4 24316 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1F)O 22a_100000740057_100000090534 [0,2,0,0,0,0|2,0,0]=4 24317 B16R1.22955 CCCNNC(=O)Cc1ccc(cc1O)Br 22a_100000740057_100000707504 [0,2,0,0,0,0|2,0,0]=4 24318 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Br)Br 1458a_100000745993_200012351560 [0,2,0,0,0,0|2,0,0]=4 24319 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000745993_100000755608 [0,2,0,0,0,0|2,0,0]=4 24320 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Br)F 1458a_100000745993_100000243222 [0,2,0,0,0,0|2,0,0]=4 24321 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Br)I 1458a_100000745993_100010146610 [0,2,0,0,0,0|2,0,0]=4 24322 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1C)Br 1458a_100000745993_100000708836 [0,2,0,0,0,0|2,0,0]=4 24323 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1C)C 1458a_100000745993_100011219618 [0,2,0,0,0,0|2,0,0]=4 24324 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1C)Cl 1458a_100000745993_100012361307 [0,2,0,0,0,0|2,0,0]=4 24325 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1C)F 1458a_100000745993_100000700533 [0,2,0,0,0,0|2,0,0]=4 24326 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000745993_100011740631 [0,2,0,0,0,0|2,0,0]=4 24327 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Cl)C 1458a_100000745993_100012349684 [0,2,0,0,0,0|2,0,0]=4 24328 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000745993_100000188473 [0,2,0,0,0,0|2,0,0]=4 24329 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1Cl)F 1458a_100000745993_100011216360 [0,2,0,0,0,0|2,0,0]=4 24330 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1F)Br 1458a_100000745993_100000211606 [0,2,0,0,0,0|2,0,0]=4 24331 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1F)C 1458a_100000745993_100012002367 [0,2,0,0,0,0|2,0,0]=4 24332 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1F)Cl 1458a_100000745993_100000709361 [0,2,0,0,0,0|2,0,0]=4 24333 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1F)F 1458a_100000745993_100000748237 [0,2,0,0,0,0|2,0,0]=4 24334 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1F)I 1458a_100000745993_100010244991 [0,2,0,0,0,0|2,0,0]=4 24335 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1I)Br 1458a_100000745993_100010146615 [0,2,0,0,0,0|2,0,0]=4 24336 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1I)Cl 1458a_100000745993_100010254388 [0,2,0,0,0,0|2,0,0]=4 24337 B16R1.22955 CCCOCC(=O)Cc1ccc(cc1I)F 1458a_100000745993_100012354799 [0,2,0,0,0,0|2,0,0]=4 24338 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Br)Br 1458a_100000217233_200012351560 [0,2,0,0,0,0|2,0,0]=4 24339 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000217233_100000755608 [0,2,0,0,0,0|2,0,0]=4 24340 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Br)F 1458a_100000217233_100000243222 [0,2,0,0,0,0|2,0,0]=4 24341 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Br)I 1458a_100000217233_100010146610 [0,2,0,0,0,0|2,0,0]=4 24342 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1C)Br 1458a_100000217233_100000708836 [0,2,0,0,0,0|2,0,0]=4 24343 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1C)C 1458a_100000217233_100011219618 [0,2,0,0,0,0|2,0,0]=4 24344 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1C)Cl 1458a_100000217233_100012361307 [0,2,0,0,0,0|2,0,0]=4 24345 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1C)F 1458a_100000217233_100000700533 [0,2,0,0,0,0|2,0,0]=4 24346 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000217233_100011740631 [0,2,0,0,0,0|2,0,0]=4 24347 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Cl)C 1458a_100000217233_100012349684 [0,2,0,0,0,0|2,0,0]=4 24348 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000217233_100000188473 [0,2,0,0,0,0|2,0,0]=4 24349 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1Cl)F 1458a_100000217233_100011216360 [0,2,0,0,0,0|2,0,0]=4 24350 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1F)Br 1458a_100000217233_100000211606 [0,2,0,0,0,0|2,0,0]=4 24351 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1F)C 1458a_100000217233_100012002367 [0,2,0,0,0,0|2,0,0]=4 24352 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1F)Cl 1458a_100000217233_100000709361 [0,2,0,0,0,0|2,0,0]=4 24353 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1F)F 1458a_100000217233_100000748237 [0,2,0,0,0,0|2,0,0]=4 24354 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1F)I 1458a_100000217233_100010244991 [0,2,0,0,0,0|2,0,0]=4 24355 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1I)Br 1458a_100000217233_100010146615 [0,2,0,0,0,0|2,0,0]=4 24356 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1I)Cl 1458a_100000217233_100010254388 [0,2,0,0,0,0|2,0,0]=4 24357 B16R1.22955 CCCSCC(=O)Cc1ccc(cc1I)F 1458a_100000217233_100012354799 [0,2,0,0,0,0|2,0,0]=4 24358 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000749530_200012351560 [0,2,0,0,0,0|2,0,0]=4 24359 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100011215890 [0,2,0,0,0,0|2,0,0]=4 24360 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000749530_100000755608 [0,2,0,0,0,0|2,0,0]=4 24361 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100011215890 [0,2,0,0,0,0|2,0,0]=4 24362 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100011215890 [0,2,0,0,0,0|2,0,0]=4 24363 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)F 1458a_100000749530_100000243222 [0,2,0,0,0,0|2,0,0]=4 24364 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)I 1458a_100000749530_100010146610 [0,2,0,0,0,0|2,0,0]=4 24365 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100011215890 [0,2,0,0,0,0|2,0,0]=4 24366 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100011215890 [0,2,0,0,0,0|2,0,0]=4 24367 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)Br 1458a_100000749530_100000708836 [0,2,0,0,0,0|2,0,0]=4 24368 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)C 1458a_100000749530_100011219618 [0,2,0,0,0,0|2,0,0]=4 24369 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100011215890 [0,2,0,0,0,0|2,0,0]=4 24370 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000749530_100012361307 [0,2,0,0,0,0|2,0,0]=4 24371 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)F 1458a_100000749530_100000700533 [0,2,0,0,0,0|2,0,0]=4 24372 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100011215890 [0,2,0,0,0,0|2,0,0]=4 24373 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000749530_100011740631 [0,2,0,0,0,0|2,0,0]=4 24374 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100011215890 [0,2,0,0,0,0|2,0,0]=4 24375 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000749530_100012349684 [0,2,0,0,0,0|2,0,0]=4 24376 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100011215890 [0,2,0,0,0,0|2,0,0]=4 24377 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000749530_100000188473 [0,2,0,0,0,0|2,0,0]=4 24378 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100011215890 [0,2,0,0,0,0|2,0,0]=4 24379 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000749530_100011216360 [0,2,0,0,0,0|2,0,0]=4 24380 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)Br 1458a_100000749530_100000211606 [0,2,0,0,0,0|2,0,0]=4 24381 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100011215890 [0,2,0,0,0,0|2,0,0]=4 24382 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100011215890 [0,2,0,0,0,0|2,0,0]=4 24383 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)C 1458a_100000749530_100012002367 [0,2,0,0,0,0|2,0,0]=4 24384 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000749530_100000709361 [0,2,0,0,0,0|2,0,0]=4 24385 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100011215890 [0,2,0,0,0,0|2,0,0]=4 24386 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100011215890 [0,2,0,0,0,0|2,0,0]=4 24387 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)F 1458a_100000749530_100000748237 [0,2,0,0,0,0|2,0,0]=4 24388 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)I 1458a_100000749530_100010244991 [0,2,0,0,0,0|2,0,0]=4 24389 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100011215890 [0,2,0,0,0,0|2,0,0]=4 24390 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100011215890 [0,2,0,0,0,0|2,0,0]=4 24391 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1I)Br 1458a_100000749530_100010146615 [0,2,0,0,0,0|2,0,0]=4 24392 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000749530_100010254388 [0,2,0,0,0,0|2,0,0]=4 24393 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1I)F 1458a_100000749530_100012354799 [0,2,0,0,0,0|2,0,0]=4 24394 B16R1.22955 CCOCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100011215890 [0,2,0,0,0,0|2,0,0]=4 24395 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000230768_200012351560 [0,2,0,0,0,0|2,0,0]=4 24396 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000757381 [0,2,0,0,0,0|2,0,0]=4 24397 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000230768_100000755608 [0,2,0,0,0,0|2,0,0]=4 24398 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000757381 [0,2,0,0,0,0|2,0,0]=4 24399 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)F 1458a_100000230768_100000243222 [0,2,0,0,0,0|2,0,0]=4 24400 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000757381 [0,2,0,0,0,0|2,0,0]=4 24401 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)I 1458a_100000230768_100010146610 [0,2,0,0,0,0|2,0,0]=4 24402 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000757381 [0,2,0,0,0,0|2,0,0]=4 24403 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)Br 1458a_100000230768_100000708836 [0,2,0,0,0,0|2,0,0]=4 24404 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000757381 [0,2,0,0,0,0|2,0,0]=4 24405 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)C 1458a_100000230768_100011219618 [0,2,0,0,0,0|2,0,0]=4 24406 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000757381 [0,2,0,0,0,0|2,0,0]=4 24407 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000230768_100012361307 [0,2,0,0,0,0|2,0,0]=4 24408 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)F 1458a_100000230768_100000700533 [0,2,0,0,0,0|2,0,0]=4 24409 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000757381 [0,2,0,0,0,0|2,0,0]=4 24410 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000230768_100011740631 [0,2,0,0,0,0|2,0,0]=4 24411 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000757381 [0,2,0,0,0,0|2,0,0]=4 24412 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000230768_100012349684 [0,2,0,0,0,0|2,0,0]=4 24413 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000757381 [0,2,0,0,0,0|2,0,0]=4 24414 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000230768_100000188473 [0,2,0,0,0,0|2,0,0]=4 24415 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000230768_100011216360 [0,2,0,0,0,0|2,0,0]=4 24416 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000757381 [0,2,0,0,0,0|2,0,0]=4 24417 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)Br 1458a_100000230768_100000211606 [0,2,0,0,0,0|2,0,0]=4 24418 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000757381 [0,2,0,0,0,0|2,0,0]=4 24419 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000757381 [0,2,0,0,0,0|2,0,0]=4 24420 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)C 1458a_100000230768_100012002367 [0,2,0,0,0,0|2,0,0]=4 24421 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000230768_100000709361 [0,2,0,0,0,0|2,0,0]=4 24422 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000757381 [0,2,0,0,0,0|2,0,0]=4 24423 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)F 1458a_100000230768_100000748237 [0,2,0,0,0,0|2,0,0]=4 24424 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000757381 [0,2,0,0,0,0|2,0,0]=4 24425 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)I 1458a_100000230768_100010244991 [0,2,0,0,0,0|2,0,0]=4 24426 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000757381 [0,2,0,0,0,0|2,0,0]=4 24427 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000757381 [0,2,0,0,0,0|2,0,0]=4 24428 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1I)Br 1458a_100000230768_100010146615 [0,2,0,0,0,0|2,0,0]=4 24429 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000230768_100010254388 [0,2,0,0,0,0|2,0,0]=4 24430 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1I)F 1458a_100000230768_100012354799 [0,2,0,0,0,0|2,0,0]=4 24431 B16R1.22955 CCSCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000757381 [0,2,0,0,0,0|2,0,0]=4 24432 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000741012_200012351560 [0,2,0,0,0,0|2,0,0]=4 24433 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_100000740836 [0,2,0,0,0,0|2,0,0]=4 24434 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000741012_100000755608 [0,2,0,0,0,0|2,0,0]=4 24435 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000740836 [0,2,0,0,0,0|2,0,0]=4 24436 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_100000740836 [0,2,0,0,0,0|2,0,0]=4 24437 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000741012_100000243222 [0,2,0,0,0,0|2,0,0]=4 24438 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)I 1458a_100000741012_100010146610 [0,2,0,0,0,0|2,0,0]=4 24439 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_100000740836 [0,2,0,0,0,0|2,0,0]=4 24440 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_100000740836 [0,2,0,0,0,0|2,0,0]=4 24441 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000741012_100000708836 [0,2,0,0,0,0|2,0,0]=4 24442 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)C 1458a_100000741012_100011219618 [0,2,0,0,0,0|2,0,0]=4 24443 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)C 1458a_100011236500_100000740836 [0,2,0,0,0,0|2,0,0]=4 24444 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000741012_100012361307 [0,2,0,0,0,0|2,0,0]=4 24445 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)F 1458a_100000741012_100000700533 [0,2,0,0,0,0|2,0,0]=4 24446 B16R1.22955 COCCCC(=O)Cc1ccc(cc1C)F 1458a_100011667441_100000740836 [0,2,0,0,0,0|2,0,0]=4 24447 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000741012_100011740631 [0,2,0,0,0,0|2,0,0]=4 24448 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000740836 [0,2,0,0,0,0|2,0,0]=4 24449 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000741012_100012349684 [0,2,0,0,0,0|2,0,0]=4 24450 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000740836 [0,2,0,0,0,0|2,0,0]=4 24451 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000741012_100000188473 [0,2,0,0,0,0|2,0,0]=4 24452 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_100000740836 [0,2,0,0,0,0|2,0,0]=4 24453 B16R1.22955 COCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000741012_100011216360 [0,2,0,0,0,0|2,0,0]=4 24454 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)Br 1458a_100000741012_100000211606 [0,2,0,0,0,0|2,0,0]=4 24455 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_100000740836 [0,2,0,0,0,0|2,0,0]=4 24456 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)C 1458a_100000042674_100000740836 [0,2,0,0,0,0|2,0,0]=4 24457 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)C 1458a_100000741012_100012002367 [0,2,0,0,0,0|2,0,0]=4 24458 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000741012_100000709361 [0,2,0,0,0,0|2,0,0]=4 24459 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_100000740836 [0,2,0,0,0,0|2,0,0]=4 24460 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)F 1458a_100000684719_100000740836 [0,2,0,0,0,0|2,0,0]=4 24461 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)F 1458a_100000741012_100000748237 [0,2,0,0,0,0|2,0,0]=4 24462 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)I 1458a_100000741012_100010244991 [0,2,0,0,0,0|2,0,0]=4 24463 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)I 1458a_100010149628_100000740836 [0,2,0,0,0,0|2,0,0]=4 24464 B16R1.22955 COCCCC(=O)Cc1ccc(cc1F)O 1458a_100000090534_100000740836 [0,2,0,0,0,0|2,0,0]=4 24465 B16R1.22955 COCCCC(=O)Cc1ccc(cc1I)Br 1458a_100000741012_100010146615 [0,2,0,0,0,0|2,0,0]=4 24466 B16R1.22955 COCCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000741012_100010254388 [0,2,0,0,0,0|2,0,0]=4 24467 B16R1.22955 COCCCC(=O)Cc1ccc(cc1I)F 1458a_100000741012_100012354799 [0,2,0,0,0,0|2,0,0]=4 24468 B16R1.22955 COCCCC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_100000740836 [0,2,0,0,0,0|2,0,0]=4 24469 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)Br 240690a_100000209980_100010172832 [0,2,0,0,0,0|2,0,0]=4 24470 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)Br 527a_100000209980_100010172832 [0,2,0,0,0,0|2,0,0]=4 24471 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100000209980_100000755479 [0,2,0,0,0,0|2,0,0]=4 24472 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100000209980_100000755479 [0,2,0,0,0,0|2,0,0]=4 24473 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)Cl 527a_100000209980_100000755479 [0,2,0,0,0,0|2,0,0]=4 24474 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)F 1626a_100000209980_100000708238 [0,2,0,0,0,0|2,0,0]=4 24475 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)F 240690a_100000209980_100000708238 [0,2,0,0,0,0|2,0,0]=4 24476 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)F 527a_100000209980_100000708238 [0,2,0,0,0,0|2,0,0]=4 24477 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)O 240690a_100000209980_100010176083 [0,2,0,0,0,0|2,0,0]=4 24478 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Br)O 527a_100000209980_100010176083 [0,2,0,0,0,0|2,0,0]=4 24479 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)Br 1626a_100000209980_100000697930 [0,2,0,0,0,0|2,0,0]=4 24480 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)Br 240690a_100000209980_100000697930 [0,2,0,0,0,0|2,0,0]=4 24481 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)Br 527a_100000209980_100000697930 [0,2,0,0,0,0|2,0,0]=4 24482 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)C 1626a_100000209980_100011236500 [0,2,0,0,0,0|2,0,0]=4 24483 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)C 240690a_100000209980_100011236500 [0,2,0,0,0,0|2,0,0]=4 24484 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)C 527a_100000209980_100011236500 [0,2,0,0,0,0|2,0,0]=4 24485 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)F 1626a_100000209980_100011667441 [0,2,0,0,0,0|2,0,0]=4 24486 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)F 240690a_100000209980_100011667441 [0,2,0,0,0,0|2,0,0]=4 24487 B16R1.22955 COCCNC(=O)Cc1ccc(cc1C)F 527a_100000209980_100011667441 [0,2,0,0,0,0|2,0,0]=4 24488 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Br 1626a_100000209980_100012361378 [0,2,0,0,0,0|2,0,0]=4 24489 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100000209980_100012361378 [0,2,0,0,0,0|2,0,0]=4 24490 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Br 527a_100000209980_100012361378 [0,2,0,0,0,0|2,0,0]=4 24491 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100000209980_100000210926 [0,2,0,0,0,0|2,0,0]=4 24492 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100000209980_100000210926 [0,2,0,0,0,0|2,0,0]=4 24493 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100000209980_100000210926 [0,2,0,0,0,0|2,0,0]=4 24494 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)F 1626a_100000209980_100000690284 [0,2,0,0,0,0|2,0,0]=4 24495 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)F 240690a_100000209980_100000690284 [0,2,0,0,0,0|2,0,0]=4 24496 B16R1.22955 COCCNC(=O)Cc1ccc(cc1Cl)F 527a_100000209980_100000690284 [0,2,0,0,0,0|2,0,0]=4 24497 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Br 1626a_100000209980_100011295475 [0,2,0,0,0,0|2,0,0]=4 24498 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Br 240690a_100000209980_100011295475 [0,2,0,0,0,0|2,0,0]=4 24499 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Br 527a_100000209980_100011295475 [0,2,0,0,0,0|2,0,0]=4 24500 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)C 1626a_100000209980_100000042674 [0,2,0,0,0,0|2,0,0]=4 24501 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)C 240690a_100000209980_100000042674 [0,2,0,0,0,0|2,0,0]=4 24502 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)C 527a_100000209980_100000042674 [0,2,0,0,0,0|2,0,0]=4 24503 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Cl 1626a_100000209980_100011830378 [0,2,0,0,0,0|2,0,0]=4 24504 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Cl 240690a_100000209980_100011830378 [0,2,0,0,0,0|2,0,0]=4 24505 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)Cl 527a_100000209980_100011830378 [0,2,0,0,0,0|2,0,0]=4 24506 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)F 1626a_100000209980_100000684719 [0,2,0,0,0,0|2,0,0]=4 24507 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)F 240690a_100000209980_100000684719 [0,2,0,0,0,0|2,0,0]=4 24508 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)F 527a_100000209980_100000684719 [0,2,0,0,0,0|2,0,0]=4 24509 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)I 1626a_100000209980_100010149628 [0,2,0,0,0,0|2,0,0]=4 24510 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)I 240690a_100000209980_100010149628 [0,2,0,0,0,0|2,0,0]=4 24511 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)I 527a_100000209980_100010149628 [0,2,0,0,0,0|2,0,0]=4 24512 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)O 240690a_100000209980_100000090534 [0,2,0,0,0,0|2,0,0]=4 24513 B16R1.22955 COCCNC(=O)Cc1ccc(cc1F)O 527a_100000209980_100000090534 [0,2,0,0,0,0|2,0,0]=4 24514 B16R1.22955 COCCNC(=O)Cc1ccc(cc1O)Br 240690a_100000209980_100000707504 [0,2,0,0,0,0|2,0,0]=4 24515 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Br)Br 1458a_100000173376_200012351560 [0,2,0,0,0,0|2,0,0]=4 24516 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Br)Cl 1458a_100000173376_100000755608 [0,2,0,0,0,0|2,0,0]=4 24517 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Br)F 1458a_100000173376_100000243222 [0,2,0,0,0,0|2,0,0]=4 24518 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Br)I 1458a_100000173376_100010146610 [0,2,0,0,0,0|2,0,0]=4 24519 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1C)Br 1458a_100000173376_100000708836 [0,2,0,0,0,0|2,0,0]=4 24520 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1C)C 1458a_100000173376_100011219618 [0,2,0,0,0,0|2,0,0]=4 24521 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1C)Cl 1458a_100000173376_100012361307 [0,2,0,0,0,0|2,0,0]=4 24522 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1C)F 1458a_100000173376_100000700533 [0,2,0,0,0,0|2,0,0]=4 24523 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Cl)Br 1458a_100000173376_100011740631 [0,2,0,0,0,0|2,0,0]=4 24524 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000173376_100012349684 [0,2,0,0,0,0|2,0,0]=4 24525 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000173376_100000188473 [0,2,0,0,0,0|2,0,0]=4 24526 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1Cl)F 1458a_100000173376_100011216360 [0,2,0,0,0,0|2,0,0]=4 24527 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1F)Br 1458a_100000173376_100000211606 [0,2,0,0,0,0|2,0,0]=4 24528 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1F)C 1458a_100000173376_100012002367 [0,2,0,0,0,0|2,0,0]=4 24529 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1F)Cl 1458a_100000173376_100000709361 [0,2,0,0,0,0|2,0,0]=4 24530 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1F)F 1458a_100000173376_100000748237 [0,2,0,0,0,0|2,0,0]=4 24531 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1F)I 1458a_100000173376_100010244991 [0,2,0,0,0,0|2,0,0]=4 24532 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1I)Br 1458a_100000173376_100010146615 [0,2,0,0,0,0|2,0,0]=4 24533 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1I)Cl 1458a_100000173376_100010254388 [0,2,0,0,0,0|2,0,0]=4 24534 B16R1.22955 CSCCCC(=O)Cc1ccc(cc1I)F 1458a_100000173376_100012354799 [0,2,0,0,0,0|2,0,0]=4 24535 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Br 11a_100020590264_100010172832 [0,2,0,0,0,0|2,0,0]=4 24536 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Br 240690a_100020590264_100010172832 [0,2,0,0,0,0|2,0,0]=4 24537 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Br 527a_100020590264_100010172832 [0,2,0,0,0,0|2,0,0]=4 24538 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Cl 11a_100020590264_100000755479 [0,2,0,0,0,0|2,0,0]=4 24539 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Cl 1626a_100020590264_100000755479 [0,2,0,0,0,0|2,0,0]=4 24540 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Cl 240690a_100020590264_100000755479 [0,2,0,0,0,0|2,0,0]=4 24541 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)Cl 527a_100020590264_100000755479 [0,2,0,0,0,0|2,0,0]=4 24542 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F 11a_100020590264_100000708238 [0,2,0,0,0,0|2,0,0]=4 24543 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F 1626a_100020590264_100000708238 [0,2,0,0,0,0|2,0,0]=4 24544 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F 240690a_100020590264_100000708238 [0,2,0,0,0,0|2,0,0]=4 24545 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)F 527a_100020590264_100000708238 [0,2,0,0,0,0|2,0,0]=4 24546 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)O 240690a_100020590264_100010176083 [0,2,0,0,0,0|2,0,0]=4 24547 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Br)O 527a_100020590264_100010176083 [0,2,0,0,0,0|2,0,0]=4 24548 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br 11a_100020590264_100000697930 [0,2,0,0,0,0|2,0,0]=4 24549 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br 1626a_100020590264_100000697930 [0,2,0,0,0,0|2,0,0]=4 24550 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br 240690a_100020590264_100000697930 [0,2,0,0,0,0|2,0,0]=4 24551 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)Br 527a_100020590264_100000697930 [0,2,0,0,0,0|2,0,0]=4 24552 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)C 11a_100020590264_100011236500 [0,2,0,0,0,0|2,0,0]=4 24553 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)C 1626a_100020590264_100011236500 [0,2,0,0,0,0|2,0,0]=4 24554 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)C 240690a_100020590264_100011236500 [0,2,0,0,0,0|2,0,0]=4 24555 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)C 527a_100020590264_100011236500 [0,2,0,0,0,0|2,0,0]=4 24556 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)F 11a_100020590264_100011667441 [0,2,0,0,0,0|2,0,0]=4 24557 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)F 1626a_100020590264_100011667441 [0,2,0,0,0,0|2,0,0]=4 24558 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)F 240690a_100020590264_100011667441 [0,2,0,0,0,0|2,0,0]=4 24559 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1C)F 527a_100020590264_100011667441 [0,2,0,0,0,0|2,0,0]=4 24560 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br 11a_100020590264_100012361378 [0,2,0,0,0,0|2,0,0]=4 24561 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br 1626a_100020590264_100012361378 [0,2,0,0,0,0|2,0,0]=4 24562 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100020590264_100012361378 [0,2,0,0,0,0|2,0,0]=4 24563 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Br 527a_100020590264_100012361378 [0,2,0,0,0,0|2,0,0]=4 24564 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100020590264_100000210926 [0,2,0,0,0,0|2,0,0]=4 24565 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Cl 1626a_100020590264_100000210926 [0,2,0,0,0,0|2,0,0]=4 24566 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100020590264_100000210926 [0,2,0,0,0,0|2,0,0]=4 24567 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100020590264_100000210926 [0,2,0,0,0,0|2,0,0]=4 24568 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F 11a_100020590264_100000690284 [0,2,0,0,0,0|2,0,0]=4 24569 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F 1626a_100020590264_100000690284 [0,2,0,0,0,0|2,0,0]=4 24570 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F 240690a_100020590264_100000690284 [0,2,0,0,0,0|2,0,0]=4 24571 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1Cl)F 527a_100020590264_100000690284 [0,2,0,0,0,0|2,0,0]=4 24572 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br 11a_100020590264_100011295475 [0,2,0,0,0,0|2,0,0]=4 24573 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br 1626a_100020590264_100011295475 [0,2,0,0,0,0|2,0,0]=4 24574 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br 240690a_100020590264_100011295475 [0,2,0,0,0,0|2,0,0]=4 24575 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Br 527a_100020590264_100011295475 [0,2,0,0,0,0|2,0,0]=4 24576 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)C 11a_100020590264_100000042674 [0,2,0,0,0,0|2,0,0]=4 24577 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)C 1626a_100020590264_100000042674 [0,2,0,0,0,0|2,0,0]=4 24578 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)C 240690a_100020590264_100000042674 [0,2,0,0,0,0|2,0,0]=4 24579 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)C 527a_100020590264_100000042674 [0,2,0,0,0,0|2,0,0]=4 24580 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl 11a_100020590264_100011830378 [0,2,0,0,0,0|2,0,0]=4 24581 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl 1626a_100020590264_100011830378 [0,2,0,0,0,0|2,0,0]=4 24582 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl 240690a_100020590264_100011830378 [0,2,0,0,0,0|2,0,0]=4 24583 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)Cl 527a_100020590264_100011830378 [0,2,0,0,0,0|2,0,0]=4 24584 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F 11a_100020590264_100000684719 [0,2,0,0,0,0|2,0,0]=4 24585 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F 1626a_100020590264_100000684719 [0,2,0,0,0,0|2,0,0]=4 24586 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F 240690a_100020590264_100000684719 [0,2,0,0,0,0|2,0,0]=4 24587 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)F 527a_100020590264_100000684719 [0,2,0,0,0,0|2,0,0]=4 24588 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)I 11a_100020590264_100010149628 [0,2,0,0,0,0|2,0,0]=4 24589 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)I 1626a_100020590264_100010149628 [0,2,0,0,0,0|2,0,0]=4 24590 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)I 240690a_100020590264_100010149628 [0,2,0,0,0,0|2,0,0]=4 24591 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)I 527a_100020590264_100010149628 [0,2,0,0,0,0|2,0,0]=4 24592 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)O 240690a_100020590264_100000090534 [0,2,0,0,0,0|2,0,0]=4 24593 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1F)O 527a_100020590264_100000090534 [0,2,0,0,0,0|2,0,0]=4 24594 B16R1.22955 CSCCNC(=O)Cc1ccc(cc1O)Br 240690a_100020590264_100000707504 [0,2,0,0,0,0|2,0,0]=4 24595 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCF)Br 1458a_100000697930_100000729493 [0,2,0,0,0,0|2,0,0]=4 24596 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCF)F 1458a_100011667441_100000729493 [0,2,0,0,0,0|2,0,0]=4 24597 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCO)Br 1458a_100000695505_100000708836 [0,2,0,0,0,0|2,0,0]=4 24598 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCO)Br 1458a_100000697930_100000210776 [0,2,0,0,0,0|2,0,0]=4 24599 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCO)Cl 1458a_100000695505_100012361307 [0,2,0,0,0,0|2,0,0]=4 24600 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCO)F 1458a_100000695505_100000700533 [0,2,0,0,0,0|2,0,0]=4 24601 B16R1.22955 Cc1cc(ccc1CC(=O)CCCCO)F 1458a_100011667441_100000210776 [0,2,0,0,0,0|2,0,0]=4 24602 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)Br 11a_100015189416_100000697930 [0,2,0,0,0,0|2,0,0]=4 24603 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)Br 1626a_100015189416_100000697930 [0,2,0,0,0,0|2,0,0]=4 24604 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)Br 240690a_100015189416_100000697930 [0,2,0,0,0,0|2,0,0]=4 24605 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)Br 527a_100015189416_100000697930 [0,2,0,0,0,0|2,0,0]=4 24606 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)F 11a_100015189416_100011667441 [0,2,0,0,0,0|2,0,0]=4 24607 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)F 1626a_100015189416_100011667441 [0,2,0,0,0,0|2,0,0]=4 24608 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)F 240690a_100015189416_100011667441 [0,2,0,0,0,0|2,0,0]=4 24609 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCF)F 527a_100015189416_100011667441 [0,2,0,0,0,0|2,0,0]=4 24610 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)Br 240690a_100000182051_100000697930 [0,2,0,0,0,0|2,0,0]=4 24611 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)Br 527a_100000182051_100000697930 [0,2,0,0,0,0|2,0,0]=4 24612 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)F 240690a_100000182051_100011667441 [0,2,0,0,0,0|2,0,0]=4 24613 B16R1.22955 Cc1cc(ccc1CC(=O)NCCCO)F 527a_100000182051_100011667441 [0,2,0,0,0,0|2,0,0]=4 24614 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)CCCCF 1458a_100011236500_100000729493 [0,2,0,0,0,0|2,0,0]=4 24615 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)CCCCO 1458a_100000695505_100011219618 [0,2,0,0,0,0|2,0,0]=4 24616 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)CCCCO 1458a_100011236500_100000210776 [0,2,0,0,0,0|2,0,0]=4 24617 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCF 11a_100015189416_100011236500 [0,2,0,0,0,0|2,0,0]=4 24618 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCF 1626a_100015189416_100011236500 [0,2,0,0,0,0|2,0,0]=4 24619 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCF 240690a_100015189416_100011236500 [0,2,0,0,0,0|2,0,0]=4 24620 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCF 527a_100015189416_100011236500 [0,2,0,0,0,0|2,0,0]=4 24621 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCO 240690a_100000182051_100011236500 [0,2,0,0,0,0|2,0,0]=4 24622 B16R1.22955 Cc1ccc(c(c1)C)CC(=O)NCCCO 527a_100000182051_100011236500 [0,2,0,0,0,0|2,0,0]=4 24623 B16R1.22955 Cc1ccc(c(c1)Cl)CC(=O)CCCCO 1458a_100000695505_100012349684 [0,2,0,0,0,0|2,0,0]=4 24624 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)CCCCF 1458a_100000042674_100000729493 [0,2,0,0,0,0|2,0,0]=4 24625 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)CCCCO 1458a_100000042674_100000210776 [0,2,0,0,0,0|2,0,0]=4 24626 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)CCCCO 1458a_100000695505_100012002367 [0,2,0,0,0,0|2,0,0]=4 24627 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCF 11a_100015189416_100000042674 [0,2,0,0,0,0|2,0,0]=4 24628 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCF 1626a_100015189416_100000042674 [0,2,0,0,0,0|2,0,0]=4 24629 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCF 240690a_100015189416_100000042674 [0,2,0,0,0,0|2,0,0]=4 24630 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCF 527a_100015189416_100000042674 [0,2,0,0,0,0|2,0,0]=4 24631 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCO 240690a_100000182051_100000042674 [0,2,0,0,0,0|2,0,0]=4 24632 B16R1.22955 Cc1ccc(c(c1)F)CC(=O)NCCCO 527a_100000182051_100000042674 [0,2,0,0,0,0|2,0,0]=4 24633 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Br)Br 1458a_100010172832_100000729493 [0,2,0,0,0,0|2,0,0]=4 24634 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000729493 [0,2,0,0,0,0|2,0,0]=4 24635 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Br)F 1458a_100000708238_100000729493 [0,2,0,0,0,0|2,0,0]=4 24636 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Br)O 1458a_100010176083_100000729493 [0,2,0,0,0,0|2,0,0]=4 24637 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000729493 [0,2,0,0,0,0|2,0,0]=4 24638 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000729493 [0,2,0,0,0,0|2,0,0]=4 24639 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1Cl)F 1458a_100000690284_100000729493 [0,2,0,0,0,0|2,0,0]=4 24640 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1F)Br 1458a_100011295475_100000729493 [0,2,0,0,0,0|2,0,0]=4 24641 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1F)Cl 1458a_100011830378_100000729493 [0,2,0,0,0,0|2,0,0]=4 24642 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1F)F 1458a_100000684719_100000729493 [0,2,0,0,0,0|2,0,0]=4 24643 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1F)I 1458a_100010149628_100000729493 [0,2,0,0,0,0|2,0,0]=4 24644 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1F)O 1458a_100000090534_100000729493 [0,2,0,0,0,0|2,0,0]=4 24645 B16R1.22955 O=C(CCCCF)Cc1ccc(cc1O)Br 1458a_100000707504_100000729493 [0,2,0,0,0,0|2,0,0]=4 24646 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)Br 1458a_100000695505_200012351560 [0,2,0,0,0,0|2,0,0]=4 24647 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)Br 1458a_100010172832_100000210776 [0,2,0,0,0,0|2,0,0]=4 24648 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)Cl 1458a_100000695505_100000755608 [0,2,0,0,0,0|2,0,0]=4 24649 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)Cl 1458a_100000755479_100000210776 [0,2,0,0,0,0|2,0,0]=4 24650 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)F 1458a_100000695505_100000243222 [0,2,0,0,0,0|2,0,0]=4 24651 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)F 1458a_100000708238_100000210776 [0,2,0,0,0,0|2,0,0]=4 24652 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)I 1458a_100000695505_100010146610 [0,2,0,0,0,0|2,0,0]=4 24653 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Br)O 1458a_100010176083_100000210776 [0,2,0,0,0,0|2,0,0]=4 24654 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)Br 1458a_100000695505_100011740631 [0,2,0,0,0,0|2,0,0]=4 24655 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)Br 1458a_100012361378_100000210776 [0,2,0,0,0,0|2,0,0]=4 24656 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)Cl 1458a_100000210926_100000210776 [0,2,0,0,0,0|2,0,0]=4 24657 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)Cl 1458a_100000695505_100000188473 [0,2,0,0,0,0|2,0,0]=4 24658 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)F 1458a_100000690284_100000210776 [0,2,0,0,0,0|2,0,0]=4 24659 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1Cl)F 1458a_100000695505_100011216360 [0,2,0,0,0,0|2,0,0]=4 24660 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)Br 1458a_100000695505_100000211606 [0,2,0,0,0,0|2,0,0]=4 24661 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)Br 1458a_100011295475_100000210776 [0,2,0,0,0,0|2,0,0]=4 24662 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)Cl 1458a_100000695505_100000709361 [0,2,0,0,0,0|2,0,0]=4 24663 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)Cl 1458a_100011830378_100000210776 [0,2,0,0,0,0|2,0,0]=4 24664 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)F 1458a_100000684719_100000210776 [0,2,0,0,0,0|2,0,0]=4 24665 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)F 1458a_100000695505_100000748237 [0,2,0,0,0,0|2,0,0]=4 24666 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)I 1458a_100000695505_100010244991 [0,2,0,0,0,0|2,0,0]=4 24667 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)I 1458a_100010149628_100000210776 [0,2,0,0,0,0|2,0,0]=4 24668 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1F)O 1458a_100000090534_100000210776 [0,2,0,0,0,0|2,0,0]=4 24669 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1I)Br 1458a_100000695505_100010146615 [0,2,0,0,0,0|2,0,0]=4 24670 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1I)Cl 1458a_100000695505_100010254388 [0,2,0,0,0,0|2,0,0]=4 24671 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1I)F 1458a_100000695505_100012354799 [0,2,0,0,0,0|2,0,0]=4 24672 B16R1.22955 O=C(CCCCO)Cc1ccc(cc1O)Br 1458a_100000707504_100000210776 [0,2,0,0,0,0|2,0,0]=4 24673 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCF 11a_100015189416_100010172832 [0,2,0,0,0,0|2,0,0]=4 24674 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCF 240690a_100015189416_100010172832 [0,2,0,0,0,0|2,0,0]=4 24675 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCF 527a_100015189416_100010172832 [0,2,0,0,0,0|2,0,0]=4 24676 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCO 240690a_100000182051_100010172832 [0,2,0,0,0,0|2,0,0]=4 24677 B16R1.22955 O=C(Cc1ccc(cc1Br)Br)NCCCO 527a_100000182051_100010172832 [0,2,0,0,0,0|2,0,0]=4 24678 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCF 11a_100015189416_100000755479 [0,2,0,0,0,0|2,0,0]=4 24679 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCF 1626a_100015189416_100000755479 [0,2,0,0,0,0|2,0,0]=4 24680 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCF 240690a_100015189416_100000755479 [0,2,0,0,0,0|2,0,0]=4 24681 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCF 527a_100015189416_100000755479 [0,2,0,0,0,0|2,0,0]=4 24682 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCO 240690a_100000182051_100000755479 [0,2,0,0,0,0|2,0,0]=4 24683 B16R1.22955 O=C(Cc1ccc(cc1Br)Cl)NCCCO 527a_100000182051_100000755479 [0,2,0,0,0,0|2,0,0]=4 24684 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCF 11a_100015189416_100000708238 [0,2,0,0,0,0|2,0,0]=4 24685 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCF 1626a_100015189416_100000708238 [0,2,0,0,0,0|2,0,0]=4 24686 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCF 240690a_100015189416_100000708238 [0,2,0,0,0,0|2,0,0]=4 24687 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCF 527a_100015189416_100000708238 [0,2,0,0,0,0|2,0,0]=4 24688 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCO 240690a_100000182051_100000708238 [0,2,0,0,0,0|2,0,0]=4 24689 B16R1.22955 O=C(Cc1ccc(cc1Br)F)NCCCO 527a_100000182051_100000708238 [0,2,0,0,0,0|2,0,0]=4 24690 B16R1.22955 O=C(Cc1ccc(cc1Br)O)NCCCF 240690a_100015189416_100010176083 [0,2,0,0,0,0|2,0,0]=4 24691 B16R1.22955 O=C(Cc1ccc(cc1Br)O)NCCCF 527a_100015189416_100010176083 [0,2,0,0,0,0|2,0,0]=4 24692 B16R1.22955 O=C(Cc1ccc(cc1Br)O)NCCCO 240690a_100000182051_100010176083 [0,2,0,0,0,0|2,0,0]=4 24693 B16R1.22955 O=C(Cc1ccc(cc1Br)O)NCCCO 527a_100000182051_100010176083 [0,2,0,0,0,0|2,0,0]=4 24694 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCF 11a_100015189416_100012361378 [0,2,0,0,0,0|2,0,0]=4 24695 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCF 1626a_100015189416_100012361378 [0,2,0,0,0,0|2,0,0]=4 24696 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCF 240690a_100015189416_100012361378 [0,2,0,0,0,0|2,0,0]=4 24697 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCF 527a_100015189416_100012361378 [0,2,0,0,0,0|2,0,0]=4 24698 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCO 240690a_100000182051_100012361378 [0,2,0,0,0,0|2,0,0]=4 24699 B16R1.22955 O=C(Cc1ccc(cc1Cl)Br)NCCCO 527a_100000182051_100012361378 [0,2,0,0,0,0|2,0,0]=4 24700 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCF 11a_100015189416_100000210926 [0,2,0,0,0,0|2,0,0]=4 24701 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCF 1626a_100015189416_100000210926 [0,2,0,0,0,0|2,0,0]=4 24702 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCF 240690a_100015189416_100000210926 [0,2,0,0,0,0|2,0,0]=4 24703 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCF 527a_100015189416_100000210926 [0,2,0,0,0,0|2,0,0]=4 24704 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCO 240690a_100000182051_100000210926 [0,2,0,0,0,0|2,0,0]=4 24705 B16R1.22955 O=C(Cc1ccc(cc1Cl)Cl)NCCCO 527a_100000182051_100000210926 [0,2,0,0,0,0|2,0,0]=4 24706 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCF 11a_100015189416_100000690284 [0,2,0,0,0,0|2,0,0]=4 24707 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCF 1626a_100015189416_100000690284 [0,2,0,0,0,0|2,0,0]=4 24708 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCF 240690a_100015189416_100000690284 [0,2,0,0,0,0|2,0,0]=4 24709 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCF 527a_100015189416_100000690284 [0,2,0,0,0,0|2,0,0]=4 24710 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCO 240690a_100000182051_100000690284 [0,2,0,0,0,0|2,0,0]=4 24711 B16R1.22955 O=C(Cc1ccc(cc1Cl)F)NCCCO 527a_100000182051_100000690284 [0,2,0,0,0,0|2,0,0]=4 24712 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCF 11a_100015189416_100011295475 [0,2,0,0,0,0|2,0,0]=4 24713 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCF 1626a_100015189416_100011295475 [0,2,0,0,0,0|2,0,0]=4 24714 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCF 240690a_100015189416_100011295475 [0,2,0,0,0,0|2,0,0]=4 24715 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCF 527a_100015189416_100011295475 [0,2,0,0,0,0|2,0,0]=4 24716 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCO 240690a_100000182051_100011295475 [0,2,0,0,0,0|2,0,0]=4 24717 B16R1.22955 O=C(Cc1ccc(cc1F)Br)NCCCO 527a_100000182051_100011295475 [0,2,0,0,0,0|2,0,0]=4 24718 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCF 11a_100015189416_100011830378 [0,2,0,0,0,0|2,0,0]=4 24719 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCF 1626a_100015189416_100011830378 [0,2,0,0,0,0|2,0,0]=4 24720 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCF 240690a_100015189416_100011830378 [0,2,0,0,0,0|2,0,0]=4 24721 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCF 527a_100015189416_100011830378 [0,2,0,0,0,0|2,0,0]=4 24722 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCO 240690a_100000182051_100011830378 [0,2,0,0,0,0|2,0,0]=4 24723 B16R1.22955 O=C(Cc1ccc(cc1F)Cl)NCCCO 527a_100000182051_100011830378 [0,2,0,0,0,0|2,0,0]=4 24724 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCF 11a_100015189416_100000684719 [0,2,0,0,0,0|2,0,0]=4 24725 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCF 1626a_100015189416_100000684719 [0,2,0,0,0,0|2,0,0]=4 24726 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCF 240690a_100015189416_100000684719 [0,2,0,0,0,0|2,0,0]=4 24727 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCF 527a_100015189416_100000684719 [0,2,0,0,0,0|2,0,0]=4 24728 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCO 240690a_100000182051_100000684719 [0,2,0,0,0,0|2,0,0]=4 24729 B16R1.22955 O=C(Cc1ccc(cc1F)F)NCCCO 527a_100000182051_100000684719 [0,2,0,0,0,0|2,0,0]=4 24730 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCF 11a_100015189416_100010149628 [0,2,0,0,0,0|2,0,0]=4 24731 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCF 1626a_100015189416_100010149628 [0,2,0,0,0,0|2,0,0]=4 24732 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCF 240690a_100015189416_100010149628 [0,2,0,0,0,0|2,0,0]=4 24733 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCF 527a_100015189416_100010149628 [0,2,0,0,0,0|2,0,0]=4 24734 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCO 240690a_100000182051_100010149628 [0,2,0,0,0,0|2,0,0]=4 24735 B16R1.22955 O=C(Cc1ccc(cc1F)I)NCCCO 527a_100000182051_100010149628 [0,2,0,0,0,0|2,0,0]=4 24736 B16R1.22955 O=C(Cc1ccc(cc1F)O)NCCCF 240690a_100015189416_100000090534 [0,2,0,0,0,0|2,0,0]=4 24737 B16R1.22955 O=C(Cc1ccc(cc1F)O)NCCCF 527a_100015189416_100000090534 [0,2,0,0,0,0|2,0,0]=4 24738 B16R1.22955 O=C(Cc1ccc(cc1F)O)NCCCO 240690a_100000182051_100000090534 [0,2,0,0,0,0|2,0,0]=4 24739 B16R1.22955 O=C(Cc1ccc(cc1F)O)NCCCO 527a_100000182051_100000090534 [0,2,0,0,0,0|2,0,0]=4 24740 B16R1.22955 O=C(Cc1ccc(cc1O)Br)NCCCF 240690a_100015189416_100000707504 [0,2,0,0,0,0|2,0,0]=4 24741 B16R1.22955 O=C(Cc1ccc(cc1O)Br)NCCCO 240690a_100000182051_100000707504 [0,2,0,0,0,0|2,0,0]=4 24742 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Br)C 1458a_200011218047_200012349612 [0,2,0,0,0,0|1,0,1]=4 24743 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Br)Cl 1458a_200011218047_100010145525 [0,2,0,0,0,0|1,0,1]=4 24744 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Br)F 1458a_200011218047_100012351116 [0,2,0,0,0,0|1,0,1]=4 24745 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Br)I 1458a_200011218047_100010254545 [0,2,0,0,0,0|1,0,1]=4 24746 B16R1.88 CCCC#CC(=O)Cc1cccc(c1C)Br 1458a_200011218047_100000694682 [0,2,0,0,0,0|1,0,1]=4 24747 B16R1.88 CCCC#CC(=O)Cc1cccc(c1C)C 1458a_200011218047_100011515928 [0,2,0,0,0,0|1,0,1]=4 24748 B16R1.88 CCCC#CC(=O)Cc1cccc(c1C)Cl 1458a_200011218047_100012186920 [0,2,0,0,0,0|1,0,1]=4 24749 B16R1.88 CCCC#CC(=O)Cc1cccc(c1C)F 1458a_200011218047_100009813626 [0,2,0,0,0,0|1,0,1]=4 24750 B16R1.88 CCCC#CC(=O)Cc1cccc(c1C)I 1458a_200011218047_100010150147 [0,2,0,0,0,0|1,0,1]=4 24751 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Cl)Br 1458a_200011218047_100012349491 [0,2,0,0,0,0|1,0,1]=4 24752 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Cl)Cl 1458a_200011218047_100000720918 [0,2,0,0,0,0|1,0,1]=4 24753 B16R1.88 CCCC#CC(=O)Cc1cccc(c1Cl)F 1458a_200011218047_100000696688 [0,2,0,0,0,0|1,0,1]=4 24754 B16R1.88 CCCC#CC(=O)Cc1cccc(c1F)Br 1458a_200011218047_100012356507 [0,2,0,0,0,0|1,0,1]=4 24755 B16R1.88 CCCC#CC(=O)Cc1cccc(c1F)C 1458a_200011218047_100011216058 [0,2,0,0,0,0|1,0,1]=4 24756 B16R1.88 CCCC#CC(=O)Cc1cccc(c1F)Cl 1458a_200011218047_100000716733 [0,2,0,0,0,0|1,0,1]=4 24757 B16R1.88 CCCC#CC(=O)Cc1cccc(c1F)F 1458a_200011218047_100000217499 [0,2,0,0,0,0|1,0,1]=4 24758 B16R1.88 CCCC#CC(=O)Cc1cccc(c1I)F 1458a_200011218047_100010149603 [0,2,0,0,0,0|1,0,1]=4 24759 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Br)C 1458a_100000212230_200012349612 [0,2,0,0,0,0|1,0,1]=4 24760 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Br)Cl 1458a_100000212230_100010145525 [0,2,0,0,0,0|1,0,1]=4 24761 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Br)F 1458a_100000212230_100012351116 [0,2,0,0,0,0|1,0,1]=4 24762 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Br)I 1458a_100000212230_100010254545 [0,2,0,0,0,0|1,0,1]=4 24763 B16R1.88 CCCC=CC(=O)Cc1cccc(c1C)Br 1458a_100000212230_100000694682 [0,2,0,0,0,0|1,0,1]=4 24764 B16R1.88 CCCC=CC(=O)Cc1cccc(c1C)C 1458a_100000212230_100011515928 [0,2,0,0,0,0|1,0,1]=4 24765 B16R1.88 CCCC=CC(=O)Cc1cccc(c1C)Cl 1458a_100000212230_100012186920 [0,2,0,0,0,0|1,0,1]=4 24766 B16R1.88 CCCC=CC(=O)Cc1cccc(c1C)F 1458a_100000212230_100009813626 [0,2,0,0,0,0|1,0,1]=4 24767 B16R1.88 CCCC=CC(=O)Cc1cccc(c1C)I 1458a_100000212230_100010150147 [0,2,0,0,0,0|1,0,1]=4 24768 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Cl)Br 1458a_100000212230_100012349491 [0,2,0,0,0,0|1,0,1]=4 24769 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000212230_100000720918 [0,2,0,0,0,0|1,0,1]=4 24770 B16R1.88 CCCC=CC(=O)Cc1cccc(c1Cl)F 1458a_100000212230_100000696688 [0,2,0,0,0,0|1,0,1]=4 24771 B16R1.88 CCCC=CC(=O)Cc1cccc(c1F)Br 1458a_100000212230_100012356507 [0,2,0,0,0,0|1,0,1]=4 24772 B16R1.88 CCCC=CC(=O)Cc1cccc(c1F)C 1458a_100000212230_100011216058 [0,2,0,0,0,0|1,0,1]=4 24773 B16R1.88 CCCC=CC(=O)Cc1cccc(c1F)Cl 1458a_100000212230_100000716733 [0,2,0,0,0,0|1,0,1]=4 24774 B16R1.88 CCCC=CC(=O)Cc1cccc(c1F)F 1458a_100000212230_100000217499 [0,2,0,0,0,0|1,0,1]=4 24775 B16R1.88 CCCC=CC(=O)Cc1cccc(c1I)F 1458a_100000212230_100010149603 [0,2,0,0,0,0|1,0,1]=4 24776 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)C 1458a_100000212188_200012349612 [0,2,0,0,0,0|1,0,0]=3 24777 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210326 [0,2,0,0,0,0|1,0,0]=3 24778 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000212188_100010145525 [0,2,0,0,0,0|1,0,0]=3 24779 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210326 [0,2,0,0,0,0|1,0,0]=3 24780 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)F 1458a_100000212188_100012351116 [0,2,0,0,0,0|1,0,0]=3 24781 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210326 [0,2,0,0,0,0|1,0,0]=3 24782 B16R1.88 CCCCCC(=O)Cc1cccc(c1Br)I 1458a_100000212188_100010254545 [0,2,0,0,0,0|1,0,0]=3 24783 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)Br 1458a_100000212188_100000694682 [0,2,0,0,0,0|1,0,0]=3 24784 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)C 1458a_100000212188_100011515928 [0,2,0,0,0,0|1,0,0]=3 24785 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210326 [0,2,0,0,0,0|1,0,0]=3 24786 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)Cl 1458a_100000212188_100012186920 [0,2,0,0,0,0|1,0,0]=3 24787 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210326 [0,2,0,0,0,0|1,0,0]=3 24788 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)F 1458a_100000212188_100009813626 [0,2,0,0,0,0|1,0,0]=3 24789 B16R1.88 CCCCCC(=O)Cc1cccc(c1C)I 1458a_100000212188_100010150147 [0,2,0,0,0,0|1,0,0]=3 24790 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000212188_100012349491 [0,2,0,0,0,0|1,0,0]=3 24791 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210326 [0,2,0,0,0,0|1,0,0]=3 24792 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000212188_100000720918 [0,2,0,0,0,0|1,0,0]=3 24793 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210326 [0,2,0,0,0,0|1,0,0]=3 24794 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)F 1458a_100000212188_100000696688 [0,2,0,0,0,0|1,0,0]=3 24795 B16R1.88 CCCCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210326 [0,2,0,0,0,0|1,0,0]=3 24796 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Br 1458a_100000212188_100012356507 [0,2,0,0,0,0|1,0,0]=3 24797 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210326 [0,2,0,0,0,0|1,0,0]=3 24798 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)C 1458a_100000212188_100011216058 [0,2,0,0,0,0|1,0,0]=3 24799 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000212188_100000716733 [0,2,0,0,0,0|1,0,0]=3 24800 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210326 [0,2,0,0,0,0|1,0,0]=3 24801 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)F 1458a_100000212188_100000217499 [0,2,0,0,0,0|1,0,0]=3 24802 B16R1.88 CCCCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210326 [0,2,0,0,0,0|1,0,0]=3 24803 B16R1.88 CCCCCC(=O)Cc1cccc(c1I)F 1458a_100000212188_100010149603 [0,2,0,0,0,0|1,0,0]=3 24804 B16R1.88 CCCCCC(=O)Cc1nccc(c1C)Cl 1458a_100000212188_100020614443 [0,2,0,0,0,0|2,0,0]=4 24805 B16R1.88 CCCCCC(=O)Cn1cccc(c1=O)C 1458a_100000697016_100000210326 [0,2,0,0,0,0|2,0,0]=4 24806 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 11a_100000684715_100000212188 [0,2,0,0,0,0|2,0,0]=4 24807 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000212188 [0,2,0,0,0,0|2,0,0]=4 24808 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000212188 [0,2,0,0,0,0|2,0,0]=4 24809 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100000212188 [0,2,0,0,0,0|2,0,0]=4 24810 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100000212188 [0,2,0,0,0,0|2,0,0]=4 24811 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)F 11a_100011934729_100000212188 [0,2,0,0,0,0|2,0,0]=4 24812 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100000212188 [0,2,0,0,0,0|2,0,0]=4 24813 B16R1.88 CCCCCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000212188 [0,2,0,0,0,0|2,0,0]=4 24814 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 11a_100000750434_100000212188 [0,2,0,0,0,0|2,0,0]=4 24815 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100000212188 [0,2,0,0,0,0|2,0,0]=4 24816 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000212188 [0,2,0,0,0,0|2,0,0]=4 24817 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Br 527a_100000750434_100000212188 [0,2,0,0,0,0|2,0,0]=4 24818 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 11a_100000210026_100000212188 [0,2,0,0,0,0|2,0,0]=4 24819 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000212188 [0,2,0,0,0,0|2,0,0]=4 24820 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 22a_100000210026_100000212188 [0,2,0,0,0,0|2,0,0]=4 24821 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)C 527a_100000210026_100000212188 [0,2,0,0,0,0|2,0,0]=4 24822 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100000212188 [0,2,0,0,0,0|2,0,0]=4 24823 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100000212188 [0,2,0,0,0,0|2,0,0]=4 24824 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000212188 [0,2,0,0,0,0|2,0,0]=4 24825 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100000212188 [0,2,0,0,0,0|2,0,0]=4 24826 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 11a_100000745574_100000212188 [0,2,0,0,0,0|2,0,0]=4 24827 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 1626a_100000745574_100000212188 [0,2,0,0,0,0|2,0,0]=4 24828 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 22a_100000745574_100000212188 [0,2,0,0,0,0|2,0,0]=4 24829 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)F 527a_100000745574_100000212188 [0,2,0,0,0,0|2,0,0]=4 24830 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 11a_100000761887_100000212188 [0,2,0,0,0,0|2,0,0]=4 24831 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 1626a_100000761887_100000212188 [0,2,0,0,0,0|2,0,0]=4 24832 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 22a_100000761887_100000212188 [0,2,0,0,0,0|2,0,0]=4 24833 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)I 527a_100000761887_100000212188 [0,2,0,0,0,0|2,0,0]=4 24834 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000212188 [0,2,0,0,0,0|2,0,0]=4 24835 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000212188 [0,2,0,0,0,0|2,0,0]=4 24836 B16R1.88 CCCCCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000212188 [0,2,0,0,0,0|2,0,0]=4 24837 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100000212188 [0,2,0,0,0,0|2,0,0]=4 24838 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100000212188 [0,2,0,0,0,0|2,0,0]=4 24839 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100000212188 [0,2,0,0,0,0|2,0,0]=4 24840 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100000212188 [0,2,0,0,0,0|2,0,0]=4 24841 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000212188 [0,2,0,0,0,0|2,0,0]=4 24842 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000212188 [0,2,0,0,0,0|2,0,0]=4 24843 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100000212188 [0,2,0,0,0,0|2,0,0]=4 24844 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100000212188 [0,2,0,0,0,0|2,0,0]=4 24845 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100000212188 [0,2,0,0,0,0|2,0,0]=4 24846 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100000212188 [0,2,0,0,0,0|2,0,0]=4 24847 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000212188 [0,2,0,0,0,0|2,0,0]=4 24848 B16R1.88 CCCCCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000212188 [0,2,0,0,0,0|2,0,0]=4 24849 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 11a_100011935091_100000212188 [0,2,0,0,0,0|2,0,0]=4 24850 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100000212188 [0,2,0,0,0,0|2,0,0]=4 24851 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000212188 [0,2,0,0,0,0|2,0,0]=4 24852 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100000212188 [0,2,0,0,0,0|2,0,0]=4 24853 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 11a_100000697159_100000212188 [0,2,0,0,0,0|2,0,0]=4 24854 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000212188 [0,2,0,0,0,0|2,0,0]=4 24855 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)C 527a_100000697159_100000212188 [0,2,0,0,0,0|2,0,0]=4 24856 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100000212188 [0,2,0,0,0,0|2,0,0]=4 24857 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100000212188 [0,2,0,0,0,0|2,0,0]=4 24858 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000212188 [0,2,0,0,0,0|2,0,0]=4 24859 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 11a_100000743855_100000212188 [0,2,0,0,0,0|2,0,0]=4 24860 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 1626a_100000743855_100000212188 [0,2,0,0,0,0|2,0,0]=4 24861 B16R1.88 CCCCCC(=O)Nc1cccc(c1F)F 22a_100000743855_100000212188 [0,2,0,0,0,0|2,0,0]=4 24862 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Br 11a_100020590159_100000212188 [0,2,0,0,0,0|2,0,0]=4 24863 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100000212188 [0,2,0,0,0,0|2,0,0]=4 24864 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)C 11a_100000761888_100000212188 [0,2,0,0,0,0|2,0,0]=4 24865 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000212188 [0,2,0,0,0,0|2,0,0]=4 24866 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100000212188 [0,2,0,0,0,0|2,0,0]=4 24867 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100000212188 [0,2,0,0,0,0|2,0,0]=4 24868 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)F 11a_100000690935_100000212188 [0,2,0,0,0,0|2,0,0]=4 24869 B16R1.88 CCCCCC(=O)Nc1cccc(c1I)F 1626a_100000690935_100000212188 [0,2,0,0,0,0|2,0,0]=4 24870 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000212188 [0,2,0,0,0,0|2,0,0]=4 24871 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000212188 [0,2,0,0,0,0|2,0,0]=4 24872 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000212188 [0,2,0,0,0,0|2,0,0]=4 24873 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000212188 [0,2,0,0,0,0|2,0,0]=4 24874 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000212188 [0,2,0,0,0,0|2,0,0]=4 24875 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000212188 [0,2,0,0,0,0|2,0,0]=4 24876 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000212188 [0,2,0,0,0,0|2,0,0]=4 24877 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000212188 [0,2,0,0,0,0|2,0,0]=4 24878 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000212188 [0,2,0,0,0,0|2,0,0]=4 24879 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000212188 [0,2,0,0,0,0|2,0,0]=4 24880 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000212188 [0,2,0,0,0,0|2,0,0]=4 24881 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000212188 [0,2,0,0,0,0|2,0,0]=4 24882 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000212188 [0,2,0,0,0,0|2,0,0]=4 24883 B16R1.88 CCCCCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000212188 [0,2,0,0,0,0|2,0,0]=4 24884 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 11a_100000102301_100010147021 [0,2,0,0,0,0|1,0,0]=3 24885 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 1626a_100000102301_100010147021 [0,2,0,0,0,0|1,0,0]=3 24886 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 240690a_100000102301_100010147021 [0,2,0,0,0,0|1,0,0]=3 24887 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)C 527a_100000102301_100010147021 [0,2,0,0,0,0|1,0,0]=3 24888 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 11a_100000102301_100010145769 [0,2,0,0,0,0|1,0,0]=3 24889 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 1626a_100000102301_100010145769 [0,2,0,0,0,0|1,0,0]=3 24890 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 240690a_100000102301_100010145769 [0,2,0,0,0,0|1,0,0]=3 24891 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)Cl 527a_100000102301_100010145769 [0,2,0,0,0,0|1,0,0]=3 24892 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 11a_100000102301_100012356664 [0,2,0,0,0,0|1,0,0]=3 24893 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 1626a_100000102301_100012356664 [0,2,0,0,0,0|1,0,0]=3 24894 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 240690a_100000102301_100012356664 [0,2,0,0,0,0|1,0,0]=3 24895 B16R1.88 CCCCNC(=O)Cc1cccc(c1Br)F 527a_100000102301_100012356664 [0,2,0,0,0,0|1,0,0]=3 24896 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 11a_100000102301_100011698479 [0,2,0,0,0,0|1,0,0]=3 24897 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 1626a_100000102301_100011698479 [0,2,0,0,0,0|1,0,0]=3 24898 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 240690a_100000102301_100011698479 [0,2,0,0,0,0|1,0,0]=3 24899 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)C 527a_100000102301_100011698479 [0,2,0,0,0,0|1,0,0]=3 24900 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 11a_100000102301_100000035905 [0,2,0,0,0,0|1,0,0]=3 24901 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 1626a_100000102301_100000035905 [0,2,0,0,0,0|1,0,0]=3 24902 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 240690a_100000102301_100000035905 [0,2,0,0,0,0|1,0,0]=3 24903 B16R1.88 CCCCNC(=O)Cc1cccc(c1C)F 527a_100000102301_100000035905 [0,2,0,0,0,0|1,0,0]=3 24904 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 11a_100000102301_100010145770 [0,2,0,0,0,0|1,0,0]=3 24905 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 1626a_100000102301_100010145770 [0,2,0,0,0,0|1,0,0]=3 24906 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 240690a_100000102301_100010145770 [0,2,0,0,0,0|1,0,0]=3 24907 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Br 527a_100000102301_100010145770 [0,2,0,0,0,0|1,0,0]=3 24908 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 11a_100000102301_100000759314 [0,2,0,0,0,0|1,0,0]=3 24909 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 1626a_100000102301_100000759314 [0,2,0,0,0,0|1,0,0]=3 24910 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 240690a_100000102301_100000759314 [0,2,0,0,0,0|1,0,0]=3 24911 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)Cl 527a_100000102301_100000759314 [0,2,0,0,0,0|1,0,0]=3 24912 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 11a_100000102301_100012001123 [0,2,0,0,0,0|1,0,0]=3 24913 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 1626a_100000102301_100012001123 [0,2,0,0,0,0|1,0,0]=3 24914 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 240690a_100000102301_100012001123 [0,2,0,0,0,0|1,0,0]=3 24915 B16R1.88 CCCCNC(=O)Cc1cccc(c1Cl)F 527a_100000102301_100012001123 [0,2,0,0,0,0|1,0,0]=3 24916 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 11a_100000102301_100011935088 [0,2,0,0,0,0|1,0,0]=3 24917 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 1626a_100000102301_100011935088 [0,2,0,0,0,0|1,0,0]=3 24918 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 240690a_100000102301_100011935088 [0,2,0,0,0,0|1,0,0]=3 24919 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Br 527a_100000102301_100011935088 [0,2,0,0,0,0|1,0,0]=3 24920 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 11a_100000102301_100000709823 [0,2,0,0,0,0|1,0,0]=3 24921 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 1626a_100000102301_100000709823 [0,2,0,0,0,0|1,0,0]=3 24922 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 240690a_100000102301_100000709823 [0,2,0,0,0,0|1,0,0]=3 24923 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)Cl 527a_100000102301_100000709823 [0,2,0,0,0,0|1,0,0]=3 24924 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 11a_100000102301_100000684727 [0,2,0,0,0,0|1,0,0]=3 24925 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 1626a_100000102301_100000684727 [0,2,0,0,0,0|1,0,0]=3 24926 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 240690a_100000102301_100000684727 [0,2,0,0,0,0|1,0,0]=3 24927 B16R1.88 CCCCNC(=O)Cc1cccc(c1F)F 527a_100000102301_100000684727 [0,2,0,0,0,0|1,0,0]=3 24928 B16R1.88 CCCCNC(=O)Cn1cccc(c1=O)C 240690a_100000102301_100000697016 [0,2,0,0,0,0|2,0,0]=4 24929 B16R1.88 CCCCNC(=O)Cn1cccc(c1=O)C 527a_100000102301_100000697016 [0,2,0,0,0,0|2,0,0]=4 24930 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)C 2430a_100000684715_100000102301 [0,2,0,0,0,0|2,0,0]=4 24931 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)Cl 2430a_100000687072_100000102301 [0,2,0,0,0,0|2,0,0]=4 24932 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)F 2430a_100011934729_100000102301 [0,2,0,0,0,0|2,0,0]=4 24933 B16R1.88 CCCCNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100000102301 [0,2,0,0,0,0|2,0,0]=4 24934 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)Br 2430a_100000750434_100000102301 [0,2,0,0,0,0|2,0,0]=4 24935 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)C 2430a_100000210026_100000102301 [0,2,0,0,0,0|2,0,0]=4 24936 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)Cl 2430a_100000210441_100000102301 [0,2,0,0,0,0|2,0,0]=4 24937 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)F 2430a_100000745574_100000102301 [0,2,0,0,0,0|2,0,0]=4 24938 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)I 2430a_100000761887_100000102301 [0,2,0,0,0,0|2,0,0]=4 24939 B16R1.88 CCCCNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100000102301 [0,2,0,0,0,0|2,0,0]=4 24940 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Br 2430a_100000687075_100000102301 [0,2,0,0,0,0|2,0,0]=4 24941 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)C 2430a_100000765562_100000102301 [0,2,0,0,0,0|2,0,0]=4 24942 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)Cl 2430a_100000185733_100000102301 [0,2,0,0,0,0|2,0,0]=4 24943 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)F 2430a_100000692321_100000102301 [0,2,0,0,0,0|2,0,0]=4 24944 B16R1.88 CCCCNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100000102301 [0,2,0,0,0,0|2,0,0]=4 24945 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Br 2430a_100011935091_100000102301 [0,2,0,0,0,0|2,0,0]=4 24946 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Br 512a_100011935091_100000102301 [0,2,0,0,0,0|2,0,0]=4 24947 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)C 2430a_100000697159_100000102301 [0,2,0,0,0,0|2,0,0]=4 24948 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)C 512a_100000697159_100000102301 [0,2,0,0,0,0|2,0,0]=4 24949 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)Cl 2430a_100000199060_100000102301 [0,2,0,0,0,0|2,0,0]=4 24950 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)F 2430a_100000743855_100000102301 [0,2,0,0,0,0|2,0,0]=4 24951 B16R1.88 CCCCNC(=O)Nc1cccc(c1F)F 512a_100000743855_100000102301 [0,2,0,0,0,0|2,0,0]=4 24952 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Br 2430a_100020590159_100000102301 [0,2,0,0,0,0|2,0,0]=4 24953 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Br 512a_100020590159_100000102301 [0,2,0,0,0,0|2,0,0]=4 24954 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)C 2430a_100000761888_100000102301 [0,2,0,0,0,0|2,0,0]=4 24955 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)Cl 2430a_100000049713_100000102301 [0,2,0,0,0,0|2,0,0]=4 24956 B16R1.88 CCCCNC(=O)Nc1cccc(c1I)F 512a_100000690935_100000102301 [0,2,0,0,0,0|2,0,0]=4 24957 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100000102301 [0,2,0,0,0,0|2,0,0]=4 24958 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100000102301 [0,2,0,0,0,0|2,0,0]=4 24959 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100000102301 [0,2,0,0,0,0|2,0,0]=4 24960 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100000102301 [0,2,0,0,0,0|2,0,0]=4 24961 B16R1.88 CCCCNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100000102301 [0,2,0,0,0,0|2,0,0]=4 24962 B16R1.88 CCCNNC(=O)Cc1cccc(c1Br)C 22a_100000740057_100010147021 [0,2,0,0,0,0|2,0,0]=4 24963 B16R1.88 CCCNNC(=O)Cc1cccc(c1Br)Cl 22a_100000740057_100010145769 [0,2,0,0,0,0|2,0,0]=4 24964 B16R1.88 CCCNNC(=O)Cc1cccc(c1Br)F 22a_100000740057_100012356664 [0,2,0,0,0,0|2,0,0]=4 24965 B16R1.88 CCCNNC(=O)Cc1cccc(c1C)C 22a_100000740057_100011698479 [0,2,0,0,0,0|2,0,0]=4 24966 B16R1.88 CCCNNC(=O)Cc1cccc(c1C)F 22a_100000740057_100000035905 [0,2,0,0,0,0|2,0,0]=4 24967 B16R1.88 CCCNNC(=O)Cc1cccc(c1Cl)Br 22a_100000740057_100010145770 [0,2,0,0,0,0|2,0,0]=4 24968 B16R1.88 CCCNNC(=O)Cc1cccc(c1Cl)Cl 22a_100000740057_100000759314 [0,2,0,0,0,0|2,0,0]=4 24969 B16R1.88 CCCNNC(=O)Cc1cccc(c1Cl)F 22a_100000740057_100012001123 [0,2,0,0,0,0|2,0,0]=4 24970 B16R1.88 CCCNNC(=O)Cc1cccc(c1F)Br 22a_100000740057_100011935088 [0,2,0,0,0,0|2,0,0]=4 24971 B16R1.88 CCCNNC(=O)Cc1cccc(c1F)Cl 22a_100000740057_100000709823 [0,2,0,0,0,0|2,0,0]=4 24972 B16R1.88 CCCNNC(=O)Cc1cccc(c1F)F 22a_100000740057_100000684727 [0,2,0,0,0,0|2,0,0]=4 24973 B16R1.88 CCCOCC(=O)Cc1cccc(c1Br)C 1458a_100000745993_200012349612 [0,2,0,0,0,0|2,0,0]=4 24974 B16R1.88 CCCOCC(=O)Cc1cccc(c1Br)Cl 1458a_100000745993_100010145525 [0,2,0,0,0,0|2,0,0]=4 24975 B16R1.88 CCCOCC(=O)Cc1cccc(c1Br)F 1458a_100000745993_100012351116 [0,2,0,0,0,0|2,0,0]=4 24976 B16R1.88 CCCOCC(=O)Cc1cccc(c1Br)I 1458a_100000745993_100010254545 [0,2,0,0,0,0|2,0,0]=4 24977 B16R1.88 CCCOCC(=O)Cc1cccc(c1C)Br 1458a_100000745993_100000694682 [0,2,0,0,0,0|2,0,0]=4 24978 B16R1.88 CCCOCC(=O)Cc1cccc(c1C)C 1458a_100000745993_100011515928 [0,2,0,0,0,0|2,0,0]=4 24979 B16R1.88 CCCOCC(=O)Cc1cccc(c1C)Cl 1458a_100000745993_100012186920 [0,2,0,0,0,0|2,0,0]=4 24980 B16R1.88 CCCOCC(=O)Cc1cccc(c1C)F 1458a_100000745993_100009813626 [0,2,0,0,0,0|2,0,0]=4 24981 B16R1.88 CCCOCC(=O)Cc1cccc(c1C)I 1458a_100000745993_100010150147 [0,2,0,0,0,0|2,0,0]=4 24982 B16R1.88 CCCOCC(=O)Cc1cccc(c1Cl)Br 1458a_100000745993_100012349491 [0,2,0,0,0,0|2,0,0]=4 24983 B16R1.88 CCCOCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000745993_100000720918 [0,2,0,0,0,0|2,0,0]=4 24984 B16R1.88 CCCOCC(=O)Cc1cccc(c1Cl)F 1458a_100000745993_100000696688 [0,2,0,0,0,0|2,0,0]=4 24985 B16R1.88 CCCOCC(=O)Cc1cccc(c1F)Br 1458a_100000745993_100012356507 [0,2,0,0,0,0|2,0,0]=4 24986 B16R1.88 CCCOCC(=O)Cc1cccc(c1F)C 1458a_100000745993_100011216058 [0,2,0,0,0,0|2,0,0]=4 24987 B16R1.88 CCCOCC(=O)Cc1cccc(c1F)Cl 1458a_100000745993_100000716733 [0,2,0,0,0,0|2,0,0]=4 24988 B16R1.88 CCCOCC(=O)Cc1cccc(c1F)F 1458a_100000745993_100000217499 [0,2,0,0,0,0|2,0,0]=4 24989 B16R1.88 CCCOCC(=O)Cc1cccc(c1I)F 1458a_100000745993_100010149603 [0,2,0,0,0,0|2,0,0]=4 24990 B16R1.88 CCCSCC(=O)Cc1cccc(c1Br)C 1458a_100000217233_200012349612 [0,2,0,0,0,0|2,0,0]=4 24991 B16R1.88 CCCSCC(=O)Cc1cccc(c1Br)Cl 1458a_100000217233_100010145525 [0,2,0,0,0,0|2,0,0]=4 24992 B16R1.88 CCCSCC(=O)Cc1cccc(c1Br)F 1458a_100000217233_100012351116 [0,2,0,0,0,0|2,0,0]=4 24993 B16R1.88 CCCSCC(=O)Cc1cccc(c1Br)I 1458a_100000217233_100010254545 [0,2,0,0,0,0|2,0,0]=4 24994 B16R1.88 CCCSCC(=O)Cc1cccc(c1C)Br 1458a_100000217233_100000694682 [0,2,0,0,0,0|2,0,0]=4 24995 B16R1.88 CCCSCC(=O)Cc1cccc(c1C)C 1458a_100000217233_100011515928 [0,2,0,0,0,0|2,0,0]=4 24996 B16R1.88 CCCSCC(=O)Cc1cccc(c1C)Cl 1458a_100000217233_100012186920 [0,2,0,0,0,0|2,0,0]=4 24997 B16R1.88 CCCSCC(=O)Cc1cccc(c1C)F 1458a_100000217233_100009813626 [0,2,0,0,0,0|2,0,0]=4 24998 B16R1.88 CCCSCC(=O)Cc1cccc(c1C)I 1458a_100000217233_100010150147 [0,2,0,0,0,0|2,0,0]=4 24999 B16R1.88 CCCSCC(=O)Cc1cccc(c1Cl)Br 1458a_100000217233_100012349491 [0,2,0,0,0,0|2,0,0]=4 25000 B16R1.88 CCCSCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000217233_100000720918 [0,2,0,0,0,0|2,0,0]=4 25001 B16R1.88 CCCSCC(=O)Cc1cccc(c1Cl)F 1458a_100000217233_100000696688 [0,2,0,0,0,0|2,0,0]=4 25002 B16R1.88 CCCSCC(=O)Cc1cccc(c1F)Br 1458a_100000217233_100012356507 [0,2,0,0,0,0|2,0,0]=4 25003 B16R1.88 CCCSCC(=O)Cc1cccc(c1F)C 1458a_100000217233_100011216058 [0,2,0,0,0,0|2,0,0]=4 25004 B16R1.88 CCCSCC(=O)Cc1cccc(c1F)Cl 1458a_100000217233_100000716733 [0,2,0,0,0,0|2,0,0]=4 25005 B16R1.88 CCCSCC(=O)Cc1cccc(c1F)F 1458a_100000217233_100000217499 [0,2,0,0,0,0|2,0,0]=4 25006 B16R1.88 CCCSCC(=O)Cc1cccc(c1I)F 1458a_100000217233_100010149603 [0,2,0,0,0,0|2,0,0]=4 25007 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)C 1458a_100000749530_200012349612 [0,2,0,0,0,0|2,0,0]=4 25008 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100011215890 [0,2,0,0,0,0|2,0,0]=4 25009 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000749530_100010145525 [0,2,0,0,0,0|2,0,0]=4 25010 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100011215890 [0,2,0,0,0,0|2,0,0]=4 25011 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)F 1458a_100000749530_100012351116 [0,2,0,0,0,0|2,0,0]=4 25012 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100011215890 [0,2,0,0,0,0|2,0,0]=4 25013 B16R1.88 CCOCCC(=O)Cc1cccc(c1Br)I 1458a_100000749530_100010254545 [0,2,0,0,0,0|2,0,0]=4 25014 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)Br 1458a_100000749530_100000694682 [0,2,0,0,0,0|2,0,0]=4 25015 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)C 1458a_100000749530_100011515928 [0,2,0,0,0,0|2,0,0]=4 25016 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100011215890 [0,2,0,0,0,0|2,0,0]=4 25017 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)Cl 1458a_100000749530_100012186920 [0,2,0,0,0,0|2,0,0]=4 25018 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100011215890 [0,2,0,0,0,0|2,0,0]=4 25019 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)F 1458a_100000749530_100009813626 [0,2,0,0,0,0|2,0,0]=4 25020 B16R1.88 CCOCCC(=O)Cc1cccc(c1C)I 1458a_100000749530_100010150147 [0,2,0,0,0,0|2,0,0]=4 25021 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000749530_100012349491 [0,2,0,0,0,0|2,0,0]=4 25022 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100011215890 [0,2,0,0,0,0|2,0,0]=4 25023 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000749530_100000720918 [0,2,0,0,0,0|2,0,0]=4 25024 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100011215890 [0,2,0,0,0,0|2,0,0]=4 25025 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)F 1458a_100000749530_100000696688 [0,2,0,0,0,0|2,0,0]=4 25026 B16R1.88 CCOCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100011215890 [0,2,0,0,0,0|2,0,0]=4 25027 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)Br 1458a_100000749530_100012356507 [0,2,0,0,0,0|2,0,0]=4 25028 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100011215890 [0,2,0,0,0,0|2,0,0]=4 25029 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)C 1458a_100000749530_100011216058 [0,2,0,0,0,0|2,0,0]=4 25030 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100011215890 [0,2,0,0,0,0|2,0,0]=4 25031 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)Cl 1458a_100000749530_100000716733 [0,2,0,0,0,0|2,0,0]=4 25032 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100011215890 [0,2,0,0,0,0|2,0,0]=4 25033 B16R1.88 CCOCCC(=O)Cc1cccc(c1F)F 1458a_100000749530_100000217499 [0,2,0,0,0,0|2,0,0]=4 25034 B16R1.88 CCOCCC(=O)Cc1cccc(c1I)F 1458a_100000749530_100010149603 [0,2,0,0,0,0|2,0,0]=4 25035 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)C 1458a_100000230768_200012349612 [0,2,0,0,0,0|2,0,0]=4 25036 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000757381 [0,2,0,0,0,0|2,0,0]=4 25037 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000230768_100010145525 [0,2,0,0,0,0|2,0,0]=4 25038 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000757381 [0,2,0,0,0,0|2,0,0]=4 25039 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)F 1458a_100000230768_100012351116 [0,2,0,0,0,0|2,0,0]=4 25040 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000757381 [0,2,0,0,0,0|2,0,0]=4 25041 B16R1.88 CCSCCC(=O)Cc1cccc(c1Br)I 1458a_100000230768_100010254545 [0,2,0,0,0,0|2,0,0]=4 25042 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)Br 1458a_100000230768_100000694682 [0,2,0,0,0,0|2,0,0]=4 25043 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)C 1458a_100000230768_100011515928 [0,2,0,0,0,0|2,0,0]=4 25044 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000757381 [0,2,0,0,0,0|2,0,0]=4 25045 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)Cl 1458a_100000230768_100012186920 [0,2,0,0,0,0|2,0,0]=4 25046 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000757381 [0,2,0,0,0,0|2,0,0]=4 25047 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)F 1458a_100000230768_100009813626 [0,2,0,0,0,0|2,0,0]=4 25048 B16R1.88 CCSCCC(=O)Cc1cccc(c1C)I 1458a_100000230768_100010150147 [0,2,0,0,0,0|2,0,0]=4 25049 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000230768_100012349491 [0,2,0,0,0,0|2,0,0]=4 25050 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000757381 [0,2,0,0,0,0|2,0,0]=4 25051 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000230768_100000720918 [0,2,0,0,0,0|2,0,0]=4 25052 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000757381 [0,2,0,0,0,0|2,0,0]=4 25053 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)F 1458a_100000230768_100000696688 [0,2,0,0,0,0|2,0,0]=4 25054 B16R1.88 CCSCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000757381 [0,2,0,0,0,0|2,0,0]=4 25055 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)Br 1458a_100000230768_100012356507 [0,2,0,0,0,0|2,0,0]=4 25056 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000757381 [0,2,0,0,0,0|2,0,0]=4 25057 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)C 1458a_100000230768_100011216058 [0,2,0,0,0,0|2,0,0]=4 25058 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)Cl 1458a_100000230768_100000716733 [0,2,0,0,0,0|2,0,0]=4 25059 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000757381 [0,2,0,0,0,0|2,0,0]=4 25060 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)F 1458a_100000230768_100000217499 [0,2,0,0,0,0|2,0,0]=4 25061 B16R1.88 CCSCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000757381 [0,2,0,0,0,0|2,0,0]=4 25062 B16R1.88 CCSCCC(=O)Cc1cccc(c1I)F 1458a_100000230768_100010149603 [0,2,0,0,0,0|2,0,0]=4 25063 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)C 1458a_100000741012_200012349612 [0,2,0,0,0,0|2,0,0]=4 25064 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000740836 [0,2,0,0,0,0|2,0,0]=4 25065 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000741012_100010145525 [0,2,0,0,0,0|2,0,0]=4 25066 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000740836 [0,2,0,0,0,0|2,0,0]=4 25067 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)F 1458a_100000741012_100012351116 [0,2,0,0,0,0|2,0,0]=4 25068 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000740836 [0,2,0,0,0,0|2,0,0]=4 25069 B16R1.88 COCCCC(=O)Cc1cccc(c1Br)I 1458a_100000741012_100010254545 [0,2,0,0,0,0|2,0,0]=4 25070 B16R1.88 COCCCC(=O)Cc1cccc(c1C)Br 1458a_100000741012_100000694682 [0,2,0,0,0,0|2,0,0]=4 25071 B16R1.88 COCCCC(=O)Cc1cccc(c1C)C 1458a_100000741012_100011515928 [0,2,0,0,0,0|2,0,0]=4 25072 B16R1.88 COCCCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000740836 [0,2,0,0,0,0|2,0,0]=4 25073 B16R1.88 COCCCC(=O)Cc1cccc(c1C)Cl 1458a_100000741012_100012186920 [0,2,0,0,0,0|2,0,0]=4 25074 B16R1.88 COCCCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000740836 [0,2,0,0,0,0|2,0,0]=4 25075 B16R1.88 COCCCC(=O)Cc1cccc(c1C)F 1458a_100000741012_100009813626 [0,2,0,0,0,0|2,0,0]=4 25076 B16R1.88 COCCCC(=O)Cc1cccc(c1C)I 1458a_100000741012_100010150147 [0,2,0,0,0,0|2,0,0]=4 25077 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000741012_100012349491 [0,2,0,0,0,0|2,0,0]=4 25078 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000740836 [0,2,0,0,0,0|2,0,0]=4 25079 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000741012_100000720918 [0,2,0,0,0,0|2,0,0]=4 25080 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000740836 [0,2,0,0,0,0|2,0,0]=4 25081 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)F 1458a_100000741012_100000696688 [0,2,0,0,0,0|2,0,0]=4 25082 B16R1.88 COCCCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000740836 [0,2,0,0,0,0|2,0,0]=4 25083 B16R1.88 COCCCC(=O)Cc1cccc(c1F)Br 1458a_100000741012_100012356507 [0,2,0,0,0,0|2,0,0]=4 25084 B16R1.88 COCCCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000740836 [0,2,0,0,0,0|2,0,0]=4 25085 B16R1.88 COCCCC(=O)Cc1cccc(c1F)C 1458a_100000741012_100011216058 [0,2,0,0,0,0|2,0,0]=4 25086 B16R1.88 COCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000740836 [0,2,0,0,0,0|2,0,0]=4 25087 B16R1.88 COCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000741012_100000716733 [0,2,0,0,0,0|2,0,0]=4 25088 B16R1.88 COCCCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000740836 [0,2,0,0,0,0|2,0,0]=4 25089 B16R1.88 COCCCC(=O)Cc1cccc(c1F)F 1458a_100000741012_100000217499 [0,2,0,0,0,0|2,0,0]=4 25090 B16R1.88 COCCCC(=O)Cc1cccc(c1I)F 1458a_100000741012_100010149603 [0,2,0,0,0,0|2,0,0]=4 25091 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)C 1626a_100000209980_100010147021 [0,2,0,0,0,0|2,0,0]=4 25092 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)C 240690a_100000209980_100010147021 [0,2,0,0,0,0|2,0,0]=4 25093 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)C 527a_100000209980_100010147021 [0,2,0,0,0,0|2,0,0]=4 25094 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)Cl 1626a_100000209980_100010145769 [0,2,0,0,0,0|2,0,0]=4 25095 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)Cl 240690a_100000209980_100010145769 [0,2,0,0,0,0|2,0,0]=4 25096 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)Cl 527a_100000209980_100010145769 [0,2,0,0,0,0|2,0,0]=4 25097 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)F 1626a_100000209980_100012356664 [0,2,0,0,0,0|2,0,0]=4 25098 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)F 240690a_100000209980_100012356664 [0,2,0,0,0,0|2,0,0]=4 25099 B16R1.88 COCCNC(=O)Cc1cccc(c1Br)F 527a_100000209980_100012356664 [0,2,0,0,0,0|2,0,0]=4 25100 B16R1.88 COCCNC(=O)Cc1cccc(c1C)C 1626a_100000209980_100011698479 [0,2,0,0,0,0|2,0,0]=4 25101 B16R1.88 COCCNC(=O)Cc1cccc(c1C)C 240690a_100000209980_100011698479 [0,2,0,0,0,0|2,0,0]=4 25102 B16R1.88 COCCNC(=O)Cc1cccc(c1C)C 527a_100000209980_100011698479 [0,2,0,0,0,0|2,0,0]=4 25103 B16R1.88 COCCNC(=O)Cc1cccc(c1C)F 1626a_100000209980_100000035905 [0,2,0,0,0,0|2,0,0]=4 25104 B16R1.88 COCCNC(=O)Cc1cccc(c1C)F 240690a_100000209980_100000035905 [0,2,0,0,0,0|2,0,0]=4 25105 B16R1.88 COCCNC(=O)Cc1cccc(c1C)F 527a_100000209980_100000035905 [0,2,0,0,0,0|2,0,0]=4 25106 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Br 1626a_100000209980_100010145770 [0,2,0,0,0,0|2,0,0]=4 25107 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Br 240690a_100000209980_100010145770 [0,2,0,0,0,0|2,0,0]=4 25108 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Br 527a_100000209980_100010145770 [0,2,0,0,0,0|2,0,0]=4 25109 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Cl 1626a_100000209980_100000759314 [0,2,0,0,0,0|2,0,0]=4 25110 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Cl 240690a_100000209980_100000759314 [0,2,0,0,0,0|2,0,0]=4 25111 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)Cl 527a_100000209980_100000759314 [0,2,0,0,0,0|2,0,0]=4 25112 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)F 1626a_100000209980_100012001123 [0,2,0,0,0,0|2,0,0]=4 25113 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)F 240690a_100000209980_100012001123 [0,2,0,0,0,0|2,0,0]=4 25114 B16R1.88 COCCNC(=O)Cc1cccc(c1Cl)F 527a_100000209980_100012001123 [0,2,0,0,0,0|2,0,0]=4 25115 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Br 1626a_100000209980_100011935088 [0,2,0,0,0,0|2,0,0]=4 25116 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Br 240690a_100000209980_100011935088 [0,2,0,0,0,0|2,0,0]=4 25117 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Br 527a_100000209980_100011935088 [0,2,0,0,0,0|2,0,0]=4 25118 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Cl 1626a_100000209980_100000709823 [0,2,0,0,0,0|2,0,0]=4 25119 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Cl 240690a_100000209980_100000709823 [0,2,0,0,0,0|2,0,0]=4 25120 B16R1.88 COCCNC(=O)Cc1cccc(c1F)Cl 527a_100000209980_100000709823 [0,2,0,0,0,0|2,0,0]=4 25121 B16R1.88 COCCNC(=O)Cc1cccc(c1F)F 1626a_100000209980_100000684727 [0,2,0,0,0,0|2,0,0]=4 25122 B16R1.88 COCCNC(=O)Cc1cccc(c1F)F 240690a_100000209980_100000684727 [0,2,0,0,0,0|2,0,0]=4 25123 B16R1.88 COCCNC(=O)Cc1cccc(c1F)F 527a_100000209980_100000684727 [0,2,0,0,0,0|2,0,0]=4 25124 B16R1.88 CSCCCC(=O)Cc1cccc(c1Br)C 1458a_100000173376_200012349612 [0,2,0,0,0,0|2,0,0]=4 25125 B16R1.88 CSCCCC(=O)Cc1cccc(c1Br)Cl 1458a_100000173376_100010145525 [0,2,0,0,0,0|2,0,0]=4 25126 B16R1.88 CSCCCC(=O)Cc1cccc(c1Br)F 1458a_100000173376_100012351116 [0,2,0,0,0,0|2,0,0]=4 25127 B16R1.88 CSCCCC(=O)Cc1cccc(c1Br)I 1458a_100000173376_100010254545 [0,2,0,0,0,0|2,0,0]=4 25128 B16R1.88 CSCCCC(=O)Cc1cccc(c1C)Br 1458a_100000173376_100000694682 [0,2,0,0,0,0|2,0,0]=4 25129 B16R1.88 CSCCCC(=O)Cc1cccc(c1C)C 1458a_100000173376_100011515928 [0,2,0,0,0,0|2,0,0]=4 25130 B16R1.88 CSCCCC(=O)Cc1cccc(c1C)Cl 1458a_100000173376_100012186920 [0,2,0,0,0,0|2,0,0]=4 25131 B16R1.88 CSCCCC(=O)Cc1cccc(c1C)F 1458a_100000173376_100009813626 [0,2,0,0,0,0|2,0,0]=4 25132 B16R1.88 CSCCCC(=O)Cc1cccc(c1C)I 1458a_100000173376_100010150147 [0,2,0,0,0,0|2,0,0]=4 25133 B16R1.88 CSCCCC(=O)Cc1cccc(c1Cl)Br 1458a_100000173376_100012349491 [0,2,0,0,0,0|2,0,0]=4 25134 B16R1.88 CSCCCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000173376_100000720918 [0,2,0,0,0,0|2,0,0]=4 25135 B16R1.88 CSCCCC(=O)Cc1cccc(c1Cl)F 1458a_100000173376_100000696688 [0,2,0,0,0,0|2,0,0]=4 25136 B16R1.88 CSCCCC(=O)Cc1cccc(c1F)Br 1458a_100000173376_100012356507 [0,2,0,0,0,0|2,0,0]=4 25137 B16R1.88 CSCCCC(=O)Cc1cccc(c1F)C 1458a_100000173376_100011216058 [0,2,0,0,0,0|2,0,0]=4 25138 B16R1.88 CSCCCC(=O)Cc1cccc(c1F)Cl 1458a_100000173376_100000716733 [0,2,0,0,0,0|2,0,0]=4 25139 B16R1.88 CSCCCC(=O)Cc1cccc(c1F)F 1458a_100000173376_100000217499 [0,2,0,0,0,0|2,0,0]=4 25140 B16R1.88 CSCCCC(=O)Cc1cccc(c1I)F 1458a_100000173376_100010149603 [0,2,0,0,0,0|2,0,0]=4 25141 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)C 11a_100020590264_100010147021 [0,2,0,0,0,0|2,0,0]=4 25142 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)C 1626a_100020590264_100010147021 [0,2,0,0,0,0|2,0,0]=4 25143 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)C 240690a_100020590264_100010147021 [0,2,0,0,0,0|2,0,0]=4 25144 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)C 527a_100020590264_100010147021 [0,2,0,0,0,0|2,0,0]=4 25145 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)Cl 11a_100020590264_100010145769 [0,2,0,0,0,0|2,0,0]=4 25146 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)Cl 1626a_100020590264_100010145769 [0,2,0,0,0,0|2,0,0]=4 25147 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)Cl 240690a_100020590264_100010145769 [0,2,0,0,0,0|2,0,0]=4 25148 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)Cl 527a_100020590264_100010145769 [0,2,0,0,0,0|2,0,0]=4 25149 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)F 11a_100020590264_100012356664 [0,2,0,0,0,0|2,0,0]=4 25150 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)F 1626a_100020590264_100012356664 [0,2,0,0,0,0|2,0,0]=4 25151 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)F 240690a_100020590264_100012356664 [0,2,0,0,0,0|2,0,0]=4 25152 B16R1.88 CSCCNC(=O)Cc1cccc(c1Br)F 527a_100020590264_100012356664 [0,2,0,0,0,0|2,0,0]=4 25153 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)C 11a_100020590264_100011698479 [0,2,0,0,0,0|2,0,0]=4 25154 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)C 1626a_100020590264_100011698479 [0,2,0,0,0,0|2,0,0]=4 25155 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)C 240690a_100020590264_100011698479 [0,2,0,0,0,0|2,0,0]=4 25156 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)C 527a_100020590264_100011698479 [0,2,0,0,0,0|2,0,0]=4 25157 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)F 11a_100020590264_100000035905 [0,2,0,0,0,0|2,0,0]=4 25158 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)F 1626a_100020590264_100000035905 [0,2,0,0,0,0|2,0,0]=4 25159 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)F 240690a_100020590264_100000035905 [0,2,0,0,0,0|2,0,0]=4 25160 B16R1.88 CSCCNC(=O)Cc1cccc(c1C)F 527a_100020590264_100000035905 [0,2,0,0,0,0|2,0,0]=4 25161 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Br 11a_100020590264_100010145770 [0,2,0,0,0,0|2,0,0]=4 25162 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Br 1626a_100020590264_100010145770 [0,2,0,0,0,0|2,0,0]=4 25163 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Br 240690a_100020590264_100010145770 [0,2,0,0,0,0|2,0,0]=4 25164 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Br 527a_100020590264_100010145770 [0,2,0,0,0,0|2,0,0]=4 25165 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Cl 11a_100020590264_100000759314 [0,2,0,0,0,0|2,0,0]=4 25166 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Cl 1626a_100020590264_100000759314 [0,2,0,0,0,0|2,0,0]=4 25167 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Cl 240690a_100020590264_100000759314 [0,2,0,0,0,0|2,0,0]=4 25168 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)Cl 527a_100020590264_100000759314 [0,2,0,0,0,0|2,0,0]=4 25169 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)F 11a_100020590264_100012001123 [0,2,0,0,0,0|2,0,0]=4 25170 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)F 1626a_100020590264_100012001123 [0,2,0,0,0,0|2,0,0]=4 25171 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)F 240690a_100020590264_100012001123 [0,2,0,0,0,0|2,0,0]=4 25172 B16R1.88 CSCCNC(=O)Cc1cccc(c1Cl)F 527a_100020590264_100012001123 [0,2,0,0,0,0|2,0,0]=4 25173 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br 11a_100020590264_100011935088 [0,2,0,0,0,0|2,0,0]=4 25174 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br 1626a_100020590264_100011935088 [0,2,0,0,0,0|2,0,0]=4 25175 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br 240690a_100020590264_100011935088 [0,2,0,0,0,0|2,0,0]=4 25176 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Br 527a_100020590264_100011935088 [0,2,0,0,0,0|2,0,0]=4 25177 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl 11a_100020590264_100000709823 [0,2,0,0,0,0|2,0,0]=4 25178 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl 1626a_100020590264_100000709823 [0,2,0,0,0,0|2,0,0]=4 25179 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl 240690a_100020590264_100000709823 [0,2,0,0,0,0|2,0,0]=4 25180 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)Cl 527a_100020590264_100000709823 [0,2,0,0,0,0|2,0,0]=4 25181 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F 11a_100020590264_100000684727 [0,2,0,0,0,0|2,0,0]=4 25182 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F 1626a_100020590264_100000684727 [0,2,0,0,0,0|2,0,0]=4 25183 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F 240690a_100020590264_100000684727 [0,2,0,0,0,0|2,0,0]=4 25184 B16R1.88 CSCCNC(=O)Cc1cccc(c1F)F 527a_100020590264_100000684727 [0,2,0,0,0,0|2,0,0]=4 25185 B16R1.88 Cc1c(cccc1CC(=O)CCCCF)F 1458a_100000035905_100000729493 [0,2,0,0,0,0|2,0,0]=4 25186 B16R1.88 Cc1c(cccc1CC(=O)CCCCO)Br 1458a_100000695505_100000694682 [0,2,0,0,0,0|2,0,0]=4 25187 B16R1.88 Cc1c(cccc1CC(=O)CCCCO)Cl 1458a_100000695505_100012186920 [0,2,0,0,0,0|2,0,0]=4 25188 B16R1.88 Cc1c(cccc1CC(=O)CCCCO)F 1458a_100000035905_100000210776 [0,2,0,0,0,0|2,0,0]=4 25189 B16R1.88 Cc1c(cccc1CC(=O)CCCCO)F 1458a_100000695505_100009813626 [0,2,0,0,0,0|2,0,0]=4 25190 B16R1.88 Cc1c(cccc1CC(=O)CCCCO)I 1458a_100000695505_100010150147 [0,2,0,0,0,0|2,0,0]=4 25191 B16R1.88 Cc1c(cccc1CC(=O)NCCCF)F 11a_100015189416_100000035905 [0,2,0,0,0,0|2,0,0]=4 25192 B16R1.88 Cc1c(cccc1CC(=O)NCCCF)F 1626a_100015189416_100000035905 [0,2,0,0,0,0|2,0,0]=4 25193 B16R1.88 Cc1c(cccc1CC(=O)NCCCF)F 240690a_100015189416_100000035905 [0,2,0,0,0,0|2,0,0]=4 25194 B16R1.88 Cc1c(cccc1CC(=O)NCCCF)F 527a_100015189416_100000035905 [0,2,0,0,0,0|2,0,0]=4 25195 B16R1.88 Cc1c(cccc1CC(=O)NCCCO)F 240690a_100000182051_100000035905 [0,2,0,0,0,0|2,0,0]=4 25196 B16R1.88 Cc1c(cccc1CC(=O)NCCCO)F 527a_100000182051_100000035905 [0,2,0,0,0,0|2,0,0]=4 25197 B16R1.88 Cc1cccc(c1Br)CC(=O)CCCCF 1458a_100010147021_100000729493 [0,2,0,0,0,0|2,0,0]=4 25198 B16R1.88 Cc1cccc(c1Br)CC(=O)CCCCO 1458a_100000695505_200012349612 [0,2,0,0,0,0|2,0,0]=4 25199 B16R1.88 Cc1cccc(c1Br)CC(=O)CCCCO 1458a_100010147021_100000210776 [0,2,0,0,0,0|2,0,0]=4 25200 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCF 11a_100015189416_100010147021 [0,2,0,0,0,0|2,0,0]=4 25201 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCF 1626a_100015189416_100010147021 [0,2,0,0,0,0|2,0,0]=4 25202 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCF 240690a_100015189416_100010147021 [0,2,0,0,0,0|2,0,0]=4 25203 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCF 527a_100015189416_100010147021 [0,2,0,0,0,0|2,0,0]=4 25204 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCO 240690a_100000182051_100010147021 [0,2,0,0,0,0|2,0,0]=4 25205 B16R1.88 Cc1cccc(c1Br)CC(=O)NCCCO 527a_100000182051_100010147021 [0,2,0,0,0,0|2,0,0]=4 25206 B16R1.88 Cc1cccc(c1C)CC(=O)CCCCF 1458a_100011698479_100000729493 [0,2,0,0,0,0|2,0,0]=4 25207 B16R1.88 Cc1cccc(c1C)CC(=O)CCCCO 1458a_100000695505_100011515928 [0,2,0,0,0,0|2,0,0]=4 25208 B16R1.88 Cc1cccc(c1C)CC(=O)CCCCO 1458a_100011698479_100000210776 [0,2,0,0,0,0|2,0,0]=4 25209 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCF 11a_100015189416_100011698479 [0,2,0,0,0,0|2,0,0]=4 25210 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCF 1626a_100015189416_100011698479 [0,2,0,0,0,0|2,0,0]=4 25211 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCF 240690a_100015189416_100011698479 [0,2,0,0,0,0|2,0,0]=4 25212 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCF 527a_100015189416_100011698479 [0,2,0,0,0,0|2,0,0]=4 25213 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCO 240690a_100000182051_100011698479 [0,2,0,0,0,0|2,0,0]=4 25214 B16R1.88 Cc1cccc(c1C)CC(=O)NCCCO 527a_100000182051_100011698479 [0,2,0,0,0,0|2,0,0]=4 25215 B16R1.88 Cc1cccc(c1F)CC(=O)CCCCO 1458a_100000695505_100011216058 [0,2,0,0,0,0|2,0,0]=4 25216 B16R1.88 O=C(CCCCF)Cc1cccc(c1Br)Cl 1458a_100010145769_100000729493 [0,2,0,0,0,0|2,0,0]=4 25217 B16R1.88 O=C(CCCCF)Cc1cccc(c1Br)F 1458a_100012356664_100000729493 [0,2,0,0,0,0|2,0,0]=4 25218 B16R1.88 O=C(CCCCF)Cc1cccc(c1Cl)Br 1458a_100010145770_100000729493 [0,2,0,0,0,0|2,0,0]=4 25219 B16R1.88 O=C(CCCCF)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000729493 [0,2,0,0,0,0|2,0,0]=4 25220 B16R1.88 O=C(CCCCF)Cc1cccc(c1Cl)F 1458a_100012001123_100000729493 [0,2,0,0,0,0|2,0,0]=4 25221 B16R1.88 O=C(CCCCF)Cc1cccc(c1F)Br 1458a_100011935088_100000729493 [0,2,0,0,0,0|2,0,0]=4 25222 B16R1.88 O=C(CCCCF)Cc1cccc(c1F)Cl 1458a_100000709823_100000729493 [0,2,0,0,0,0|2,0,0]=4 25223 B16R1.88 O=C(CCCCF)Cc1cccc(c1F)F 1458a_100000684727_100000729493 [0,2,0,0,0,0|2,0,0]=4 25224 B16R1.88 O=C(CCCCO)Cc1cccc(c1Br)Cl 1458a_100000695505_100010145525 [0,2,0,0,0,0|2,0,0]=4 25225 B16R1.88 O=C(CCCCO)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210776 [0,2,0,0,0,0|2,0,0]=4 25226 B16R1.88 O=C(CCCCO)Cc1cccc(c1Br)F 1458a_100000695505_100012351116 [0,2,0,0,0,0|2,0,0]=4 25227 B16R1.88 O=C(CCCCO)Cc1cccc(c1Br)F 1458a_100012356664_100000210776 [0,2,0,0,0,0|2,0,0]=4 25228 B16R1.88 O=C(CCCCO)Cc1cccc(c1Br)I 1458a_100000695505_100010254545 [0,2,0,0,0,0|2,0,0]=4 25229 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)Br 1458a_100000695505_100012349491 [0,2,0,0,0,0|2,0,0]=4 25230 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210776 [0,2,0,0,0,0|2,0,0]=4 25231 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)Cl 1458a_100000695505_100000720918 [0,2,0,0,0,0|2,0,0]=4 25232 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210776 [0,2,0,0,0,0|2,0,0]=4 25233 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)F 1458a_100000695505_100000696688 [0,2,0,0,0,0|2,0,0]=4 25234 B16R1.88 O=C(CCCCO)Cc1cccc(c1Cl)F 1458a_100012001123_100000210776 [0,2,0,0,0,0|2,0,0]=4 25235 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)Br 1458a_100000695505_100012356507 [0,2,0,0,0,0|2,0,0]=4 25236 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)Br 1458a_100011935088_100000210776 [0,2,0,0,0,0|2,0,0]=4 25237 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)Cl 1458a_100000695505_100000716733 [0,2,0,0,0,0|2,0,0]=4 25238 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)Cl 1458a_100000709823_100000210776 [0,2,0,0,0,0|2,0,0]=4 25239 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)F 1458a_100000684727_100000210776 [0,2,0,0,0,0|2,0,0]=4 25240 B16R1.88 O=C(CCCCO)Cc1cccc(c1F)F 1458a_100000695505_100000217499 [0,2,0,0,0,0|2,0,0]=4 25241 B16R1.88 O=C(CCCCO)Cc1cccc(c1I)F 1458a_100000695505_100010149603 [0,2,0,0,0,0|2,0,0]=4 25242 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCF 11a_100015189416_100010145769 [0,2,0,0,0,0|2,0,0]=4 25243 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCF 1626a_100015189416_100010145769 [0,2,0,0,0,0|2,0,0]=4 25244 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCF 240690a_100015189416_100010145769 [0,2,0,0,0,0|2,0,0]=4 25245 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCF 527a_100015189416_100010145769 [0,2,0,0,0,0|2,0,0]=4 25246 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCO 240690a_100000182051_100010145769 [0,2,0,0,0,0|2,0,0]=4 25247 B16R1.88 O=C(Cc1cccc(c1Br)Cl)NCCCO 527a_100000182051_100010145769 [0,2,0,0,0,0|2,0,0]=4 25248 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCF 11a_100015189416_100012356664 [0,2,0,0,0,0|2,0,0]=4 25249 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCF 1626a_100015189416_100012356664 [0,2,0,0,0,0|2,0,0]=4 25250 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCF 240690a_100015189416_100012356664 [0,2,0,0,0,0|2,0,0]=4 25251 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCF 527a_100015189416_100012356664 [0,2,0,0,0,0|2,0,0]=4 25252 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCO 240690a_100000182051_100012356664 [0,2,0,0,0,0|2,0,0]=4 25253 B16R1.88 O=C(Cc1cccc(c1Br)F)NCCCO 527a_100000182051_100012356664 [0,2,0,0,0,0|2,0,0]=4 25254 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCF 11a_100015189416_100010145770 [0,2,0,0,0,0|2,0,0]=4 25255 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCF 1626a_100015189416_100010145770 [0,2,0,0,0,0|2,0,0]=4 25256 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCF 240690a_100015189416_100010145770 [0,2,0,0,0,0|2,0,0]=4 25257 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCF 527a_100015189416_100010145770 [0,2,0,0,0,0|2,0,0]=4 25258 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCO 240690a_100000182051_100010145770 [0,2,0,0,0,0|2,0,0]=4 25259 B16R1.88 O=C(Cc1cccc(c1Cl)Br)NCCCO 527a_100000182051_100010145770 [0,2,0,0,0,0|2,0,0]=4 25260 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCF 11a_100015189416_100000759314 [0,2,0,0,0,0|2,0,0]=4 25261 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCF 1626a_100015189416_100000759314 [0,2,0,0,0,0|2,0,0]=4 25262 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCF 240690a_100015189416_100000759314 [0,2,0,0,0,0|2,0,0]=4 25263 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCF 527a_100015189416_100000759314 [0,2,0,0,0,0|2,0,0]=4 25264 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCO 240690a_100000182051_100000759314 [0,2,0,0,0,0|2,0,0]=4 25265 B16R1.88 O=C(Cc1cccc(c1Cl)Cl)NCCCO 527a_100000182051_100000759314 [0,2,0,0,0,0|2,0,0]=4 25266 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCF 11a_100015189416_100012001123 [0,2,0,0,0,0|2,0,0]=4 25267 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCF 1626a_100015189416_100012001123 [0,2,0,0,0,0|2,0,0]=4 25268 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCF 240690a_100015189416_100012001123 [0,2,0,0,0,0|2,0,0]=4 25269 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCF 527a_100015189416_100012001123 [0,2,0,0,0,0|2,0,0]=4 25270 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCO 240690a_100000182051_100012001123 [0,2,0,0,0,0|2,0,0]=4 25271 B16R1.88 O=C(Cc1cccc(c1Cl)F)NCCCO 527a_100000182051_100012001123 [0,2,0,0,0,0|2,0,0]=4 25272 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCF 11a_100015189416_100011935088 [0,2,0,0,0,0|2,0,0]=4 25273 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCF 1626a_100015189416_100011935088 [0,2,0,0,0,0|2,0,0]=4 25274 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCF 240690a_100015189416_100011935088 [0,2,0,0,0,0|2,0,0]=4 25275 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCF 527a_100015189416_100011935088 [0,2,0,0,0,0|2,0,0]=4 25276 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCO 240690a_100000182051_100011935088 [0,2,0,0,0,0|2,0,0]=4 25277 B16R1.88 O=C(Cc1cccc(c1F)Br)NCCCO 527a_100000182051_100011935088 [0,2,0,0,0,0|2,0,0]=4 25278 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCF 11a_100015189416_100000709823 [0,2,0,0,0,0|2,0,0]=4 25279 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCF 1626a_100015189416_100000709823 [0,2,0,0,0,0|2,0,0]=4 25280 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCF 240690a_100015189416_100000709823 [0,2,0,0,0,0|2,0,0]=4 25281 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCF 527a_100015189416_100000709823 [0,2,0,0,0,0|2,0,0]=4 25282 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCO 240690a_100000182051_100000709823 [0,2,0,0,0,0|2,0,0]=4 25283 B16R1.88 O=C(Cc1cccc(c1F)Cl)NCCCO 527a_100000182051_100000709823 [0,2,0,0,0,0|2,0,0]=4 25284 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCF 11a_100015189416_100000684727 [0,2,0,0,0,0|2,0,0]=4 25285 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCF 1626a_100015189416_100000684727 [0,2,0,0,0,0|2,0,0]=4 25286 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCF 240690a_100015189416_100000684727 [0,2,0,0,0,0|2,0,0]=4 25287 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCF 527a_100015189416_100000684727 [0,2,0,0,0,0|2,0,0]=4 25288 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCO 240690a_100000182051_100000684727 [0,2,0,0,0,0|2,0,0]=4 25289 B16R1.88 O=C(Cc1cccc(c1F)F)NCCCO 527a_100000182051_100000684727 [0,2,0,0,0,0|2,0,0]=4 25290 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)Br 1458a_200020648666_100000211773 [0,2,0,0,0,0|1,0,1]=4 25291 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)C 1458a_200020648666_100000211840 [0,2,0,0,0,0|1,0,1]=4 25292 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)Cl 1458a_200020648666_100000181238 [0,2,0,0,0,0|1,0,1]=4 25293 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)F 1458a_200020648666_100000230114 [0,2,0,0,0,0|1,0,1]=4 25294 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)I 1458a_200020648666_100011218688 [0,2,0,0,0,0|1,0,1]=4 25295 B16R1.659 CCC/C=C(\C)/C(=O)Cc1cccc(c1)O 1458a_200020648666_100011660834 [0,2,0,0,0,0|1,0,1]=4 25296 B16R1.659 CCCCC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_100000210211 [0,2,0,0,0,0|2,0,0]=4 25297 B16R1.659 CCCCC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_100000210211 [0,2,0,0,0,0|2,0,0]=4 25298 B16R1.659 CCCCC(C)C(=O)Cc1cc(ccn1)Br 1458a_100000725509_100010173614 [0,2,0,0,0,0|2,0,0]=4 25299 B16R1.659 CCCCC(C)C(=O)Cc1cc(ccn1)C 1458a_100000725509_100000718516 [0,2,0,0,0,0|2,0,0]=4 25300 B16R1.659 CCCCC(C)C(=O)Cc1cc(ccn1)Cl 1458a_100000725509_100016988179 [0,2,0,0,0,0|2,0,0]=4 25301 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)Br 1458a_100000725509_100000211773 [0,2,0,0,0,0|1,0,0]=3 25302 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)Br 1458a_100000747190_200011215066 [0,2,0,0,0,0|1,0,0]=3 25303 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)C 1458a_100000725509_100000211840 [0,2,0,0,0,0|1,0,0]=3 25304 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)C 1458a_100011206899_200011215066 [0,2,0,0,0,0|1,0,0]=3 25305 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)Cl 1458a_100000725509_100000181238 [0,2,0,0,0,0|1,0,0]=3 25306 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200011215066 [0,2,0,0,0,0|1,0,0]=3 25307 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)F 1458a_100000211661_200011215066 [0,2,0,0,0,0|1,0,0]=3 25308 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)F 1458a_100000725509_100000230114 [0,2,0,0,0,0|1,0,0]=3 25309 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)I 1458a_100000238430_200011215066 [0,2,0,0,0,0|1,0,0]=3 25310 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)I 1458a_100000725509_100011218688 [0,2,0,0,0,0|1,0,0]=3 25311 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)O 1458a_100000725509_100011660834 [0,2,0,0,0,0|1,0,0]=3 25312 B16R1.659 CCCCC(C)C(=O)Cc1cccc(c1)O 1458a_100000745134_200011215066 [0,2,0,0,0,0|1,0,0]=3 25313 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)Br 1458a_100000725509_100009889011 [0,2,0,0,0,0|2,0,0]=4 25314 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)Br 1458a_100010201708_200011215066 [0,2,0,0,0,0|2,0,0]=4 25315 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)C 1458a_100000725509_100000757606 [0,2,0,0,0,0|2,0,0]=4 25316 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)C 1458a_100012001110_200011215066 [0,2,0,0,0,0|2,0,0]=4 25317 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200011215066 [0,2,0,0,0,0|2,0,0]=4 25318 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)Cl 1458a_100000725509_100000086093 [0,2,0,0,0,0|2,0,0]=4 25319 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)F 1458a_100000096803_200011215066 [0,2,0,0,0,0|2,0,0]=4 25320 B16R1.659 CCCCC(C)C(=O)Cc1cccc(n1)F 1458a_100000725509_100009819644 [0,2,0,0,0,0|2,0,0]=4 25321 B16R1.659 CCCCC(C)C(=O)Cc1ccnc(c1)Br 1458a_100000725509_100010243470 [0,2,0,0,0,0|2,0,0]=4 25322 B16R1.659 CCCCC(C)C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200011215066 [0,2,0,0,0,0|2,0,0]=4 25323 B16R1.659 CCCCC(C)C(=O)Cc1ccnc(c1)C 1458a_100000725509_200020672517 [0,2,0,0,0,0|2,0,0]=4 25324 B16R1.659 CCCCC(C)C(=O)Cc1ccnc(c1)Cl 1458a_100000725509_100000764220 [0,2,0,0,0,0|2,0,0]=4 25325 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)Br 1458a_100000239331_200011215066 [0,2,0,0,0,0|2,0,0]=4 25326 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)Br 1458a_100000725509_100011740620 [0,2,0,0,0,0|2,0,0]=4 25327 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)C 1458a_100000725509_100000716715 [0,2,0,0,0,0|2,0,0]=4 25328 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)Cl 1458a_100000725509_100016992070 [0,2,0,0,0,0|2,0,0]=4 25329 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)F 1458a_100000725509_100000725299 [0,2,0,0,0,0|2,0,0]=4 25330 B16R1.659 CCCCC(C)C(=O)Cc1cncc(c1)F 1458a_100011667516_200011215066 [0,2,0,0,0,0|2,0,0]=4 25331 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000725509 [0,2,0,0,0,0|2,0,0]=4 25332 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000725509 [0,2,0,0,0,0|2,0,0]=4 25333 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000725509 [0,2,0,0,0,0|2,0,0]=4 25334 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Br 527a_100000210019_100000725509 [0,2,0,0,0,0|2,0,0]=4 25335 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)C 11a_100000188690_100000725509 [0,2,0,0,0,0|2,0,0]=4 25336 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)C 1626a_100000188690_100000725509 [0,2,0,0,0,0|2,0,0]=4 25337 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)C 22a_100000188690_100000725509 [0,2,0,0,0,0|2,0,0]=4 25338 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)C 527a_100000188690_100000725509 [0,2,0,0,0,0|2,0,0]=4 25339 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000725509 [0,2,0,0,0,0|2,0,0]=4 25340 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000725509 [0,2,0,0,0,0|2,0,0]=4 25341 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000725509 [0,2,0,0,0,0|2,0,0]=4 25342 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)F 11a_100000210047_100000725509 [0,2,0,0,0,0|2,0,0]=4 25343 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000725509 [0,2,0,0,0,0|2,0,0]=4 25344 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)F 22a_100000210047_100000725509 [0,2,0,0,0,0|2,0,0]=4 25345 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)F 527a_100000210047_100000725509 [0,2,0,0,0,0|2,0,0]=4 25346 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)I 11a_100000211102_100000725509 [0,2,0,0,0,0|2,0,0]=4 25347 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000725509 [0,2,0,0,0,0|2,0,0]=4 25348 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)I 22a_100000211102_100000725509 [0,2,0,0,0,0|2,0,0]=4 25349 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)I 527a_100000211102_100000725509 [0,2,0,0,0,0|2,0,0]=4 25350 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000725509 [0,2,0,0,0,0|2,0,0]=4 25351 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000725509 [0,2,0,0,0,0|2,0,0]=4 25352 B16R1.659 CCCCC(C)C(=O)Nc1cccc(c1)O 527a_100000210217_100000725509 [0,2,0,0,0,0|2,0,0]=4 25353 B16R1.659 CCCCC(O)C(=O)Cc1cc(ccn1)Br 1458a_100000720857_100010173614 [0,2,0,0,0,0|2,0,0]=4 25354 B16R1.659 CCCCC(O)C(=O)Cc1cc(ccn1)C 1458a_100000720857_100000718516 [0,2,0,0,0,0|2,0,0]=4 25355 B16R1.659 CCCCC(O)C(=O)Cc1cc(ccn1)Cl 1458a_100000720857_100016988179 [0,2,0,0,0,0|2,0,0]=4 25356 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)Br 1458a_100000720857_100000211773 [0,2,0,0,0,0|1,0,0]=3 25357 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)C 1458a_100000720857_100000211840 [0,2,0,0,0,0|1,0,0]=3 25358 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)Cl 1458a_100000720857_100000181238 [0,2,0,0,0,0|1,0,0]=3 25359 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)F 1458a_100000720857_100000230114 [0,2,0,0,0,0|1,0,0]=3 25360 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)I 1458a_100000720857_100011218688 [0,2,0,0,0,0|1,0,0]=3 25361 B16R1.659 CCCCC(O)C(=O)Cc1cccc(c1)O 1458a_100000720857_100011660834 [0,2,0,0,0,0|1,0,0]=3 25362 B16R1.659 CCCCC(O)C(=O)Cc1cccc(n1)Br 1458a_100000720857_100009889011 [0,2,0,0,0,0|2,0,0]=4 25363 B16R1.659 CCCCC(O)C(=O)Cc1cccc(n1)C 1458a_100000720857_100000757606 [0,2,0,0,0,0|2,0,0]=4 25364 B16R1.659 CCCCC(O)C(=O)Cc1cccc(n1)Cl 1458a_100000720857_100000086093 [0,2,0,0,0,0|2,0,0]=4 25365 B16R1.659 CCCCC(O)C(=O)Cc1cccc(n1)F 1458a_100000720857_100009819644 [0,2,0,0,0,0|2,0,0]=4 25366 B16R1.659 CCCCC(O)C(=O)Cc1ccnc(c1)Br 1458a_100000720857_100010243470 [0,2,0,0,0,0|2,0,0]=4 25367 B16R1.659 CCCCC(O)C(=O)Cc1ccnc(c1)C 1458a_100000720857_200020672517 [0,2,0,0,0,0|2,0,0]=4 25368 B16R1.659 CCCCC(O)C(=O)Cc1ccnc(c1)Cl 1458a_100000720857_100000764220 [0,2,0,0,0,0|2,0,0]=4 25369 B16R1.659 CCCCC(O)C(=O)Cc1cncc(c1)Br 1458a_100000720857_100011740620 [0,2,0,0,0,0|2,0,0]=4 25370 B16R1.659 CCCCC(O)C(=O)Cc1cncc(c1)C 1458a_100000720857_100000716715 [0,2,0,0,0,0|2,0,0]=4 25371 B16R1.659 CCCCC(O)C(=O)Cc1cncc(c1)Cl 1458a_100000720857_100016992070 [0,2,0,0,0,0|2,0,0]=4 25372 B16R1.659 CCCCC(O)C(=O)Cc1cncc(c1)F 1458a_100000720857_100000725299 [0,2,0,0,0,0|2,0,0]=4 25373 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000720857 [0,2,0,0,0,0|2,0,0]=4 25374 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)Br 527a_100000210019_100000720857 [0,2,0,0,0,0|2,0,0]=4 25375 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)C 22a_100000188690_100000720857 [0,2,0,0,0,0|2,0,0]=4 25376 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)C 527a_100000188690_100000720857 [0,2,0,0,0,0|2,0,0]=4 25377 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000720857 [0,2,0,0,0,0|2,0,0]=4 25378 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)F 22a_100000210047_100000720857 [0,2,0,0,0,0|2,0,0]=4 25379 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)F 527a_100000210047_100000720857 [0,2,0,0,0,0|2,0,0]=4 25380 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)I 22a_100000211102_100000720857 [0,2,0,0,0,0|2,0,0]=4 25381 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)I 527a_100000211102_100000720857 [0,2,0,0,0,0|2,0,0]=4 25382 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)O 22a_100000210217_100000720857 [0,2,0,0,0,0|2,0,0]=4 25383 B16R1.659 CCCCC(O)C(=O)Nc1cccc(c1)O 527a_100000210217_100000720857 [0,2,0,0,0,0|2,0,0]=4 25384 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Br 11a_100000207549_100000747190 [0,2,0,0,0,0|1,0,0]=3 25385 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Br 240690a_100000207549_100000747190 [0,2,0,0,0,0|1,0,0]=3 25386 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Br 527a_100000207549_100000747190 [0,2,0,0,0,0|1,0,0]=3 25387 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)C 11a_100000207549_100011206899 [0,2,0,0,0,0|1,0,0]=3 25388 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)C 1626a_100000207549_100011206899 [0,2,0,0,0,0|1,0,0]=3 25389 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)C 240690a_100000207549_100011206899 [0,2,0,0,0,0|1,0,0]=3 25390 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)C 527a_100000207549_100011206899 [0,2,0,0,0,0|1,0,0]=3 25391 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Cl 11a_100000207549_100000749307 [0,2,0,0,0,0|1,0,0]=3 25392 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Cl 1626a_100000207549_100000749307 [0,2,0,0,0,0|1,0,0]=3 25393 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Cl 240690a_100000207549_100000749307 [0,2,0,0,0,0|1,0,0]=3 25394 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)Cl 527a_100000207549_100000749307 [0,2,0,0,0,0|1,0,0]=3 25395 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)F 11a_100000207549_100000211661 [0,2,0,0,0,0|1,0,0]=3 25396 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)F 1626a_100000207549_100000211661 [0,2,0,0,0,0|1,0,0]=3 25397 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)F 240690a_100000207549_100000211661 [0,2,0,0,0,0|1,0,0]=3 25398 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)F 527a_100000207549_100000211661 [0,2,0,0,0,0|1,0,0]=3 25399 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)I 11a_100000207549_100000238430 [0,2,0,0,0,0|1,0,0]=3 25400 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)I 1626a_100000207549_100000238430 [0,2,0,0,0,0|1,0,0]=3 25401 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)I 240690a_100000207549_100000238430 [0,2,0,0,0,0|1,0,0]=3 25402 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)I 527a_100000207549_100000238430 [0,2,0,0,0,0|1,0,0]=3 25403 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)O 240690a_100000207549_100000745134 [0,2,0,0,0,0|1,0,0]=3 25404 B16R1.659 CCCCN(C)C(=O)Cc1cccc(c1)O 527a_100000207549_100000745134 [0,2,0,0,0,0|1,0,0]=3 25405 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Br 11a_100000207549_100010201708 [0,2,0,0,0,0|2,0,0]=4 25406 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Br 240690a_100000207549_100010201708 [0,2,0,0,0,0|2,0,0]=4 25407 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Br 527a_100000207549_100010201708 [0,2,0,0,0,0|2,0,0]=4 25408 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)C 11a_100000207549_100012001110 [0,2,0,0,0,0|2,0,0]=4 25409 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)C 1626a_100000207549_100012001110 [0,2,0,0,0,0|2,0,0]=4 25410 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)C 240690a_100000207549_100012001110 [0,2,0,0,0,0|2,0,0]=4 25411 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)C 527a_100000207549_100012001110 [0,2,0,0,0,0|2,0,0]=4 25412 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Cl 11a_100000207549_100000090259 [0,2,0,0,0,0|2,0,0]=4 25413 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Cl 1626a_100000207549_100000090259 [0,2,0,0,0,0|2,0,0]=4 25414 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)Cl 240690a_100000207549_100000090259 [0,2,0,0,0,0|2,0,0]=4 25415 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)F 11a_100000207549_100000096803 [0,2,0,0,0,0|2,0,0]=4 25416 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)F 1626a_100000207549_100000096803 [0,2,0,0,0,0|2,0,0]=4 25417 B16R1.659 CCCCN(C)C(=O)Cc1cccc(n1)F 240690a_100000207549_100000096803 [0,2,0,0,0,0|2,0,0]=4 25418 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Br 11a_100000207549_100010126891 [0,2,0,0,0,0|2,0,0]=4 25419 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Br 240690a_100000207549_100010126891 [0,2,0,0,0,0|2,0,0]=4 25420 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Br 527a_100000207549_100010126891 [0,2,0,0,0,0|2,0,0]=4 25421 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Cl 11a_100000207549_100000085289 [0,2,0,0,0,0|2,0,0]=4 25422 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Cl 1626a_100000207549_100000085289 [0,2,0,0,0,0|2,0,0]=4 25423 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Cl 240690a_100000207549_100000085289 [0,2,0,0,0,0|2,0,0]=4 25424 B16R1.659 CCCCN(C)C(=O)Cc1ccnc(c1)Cl 527a_100000207549_100000085289 [0,2,0,0,0,0|2,0,0]=4 25425 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)Br 11a_100000207549_100000239331 [0,2,0,0,0,0|2,0,0]=4 25426 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)Br 240690a_100000207549_100000239331 [0,2,0,0,0,0|2,0,0]=4 25427 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)Br 527a_100000207549_100000239331 [0,2,0,0,0,0|2,0,0]=4 25428 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)F 11a_100000207549_100011667516 [0,2,0,0,0,0|2,0,0]=4 25429 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)F 240690a_100000207549_100011667516 [0,2,0,0,0,0|2,0,0]=4 25430 B16R1.659 CCCCN(C)C(=O)Cc1cncc(c1)F 527a_100000207549_100011667516 [0,2,0,0,0,0|2,0,0]=4 25431 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)Br 2430a_100000210019_100000207549 [0,2,0,0,0,0|2,0,0]=4 25432 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)C 2430a_100000188690_100000207549 [0,2,0,0,0,0|2,0,0]=4 25433 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000207549 [0,2,0,0,0,0|2,0,0]=4 25434 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)F 2430a_100000210047_100000207549 [0,2,0,0,0,0|2,0,0]=4 25435 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)I 2430a_100000211102_100000207549 [0,2,0,0,0,0|2,0,0]=4 25436 B16R1.659 CCCCN(C)C(=O)Nc1cccc(c1)O 2430a_100000210217_100000207549 [0,2,0,0,0,0|2,0,0]=4 25437 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)Br 1458a_200011297150_100000211773 [0,2,0,0,0,0|2,0,0]=4 25438 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)C 1458a_200011297150_100000211840 [0,2,0,0,0,0|2,0,0]=4 25439 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)Cl 1458a_200011297150_100000181238 [0,2,0,0,0,0|2,0,0]=4 25440 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)F 1458a_200011297150_100000230114 [0,2,0,0,0,0|2,0,0]=4 25441 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)I 1458a_200011297150_100011218688 [0,2,0,0,0,0|2,0,0]=4 25442 B16R1.659 CCCNC(=O)C(=O)Cc1cccc(c1)O 1458a_200011297150_100011660834 [0,2,0,0,0,0|2,0,0]=4 25443 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)Br 240690a_100000213112_100000747190 [0,2,0,0,0,0|2,0,0]=4 25444 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)Br 527a_100000213112_100000747190 [0,2,0,0,0,0|2,0,0]=4 25445 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)Cl 240690a_100000213112_100000749307 [0,2,0,0,0,0|2,0,0]=4 25446 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)Cl 527a_100000213112_100000749307 [0,2,0,0,0,0|2,0,0]=4 25447 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)F 240690a_100000213112_100000211661 [0,2,0,0,0,0|2,0,0]=4 25448 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)F 527a_100000213112_100000211661 [0,2,0,0,0,0|2,0,0]=4 25449 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)I 240690a_100000213112_100000238430 [0,2,0,0,0,0|2,0,0]=4 25450 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)I 527a_100000213112_100000238430 [0,2,0,0,0,0|2,0,0]=4 25451 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)O 240690a_100000213112_100000745134 [0,2,0,0,0,0|2,0,0]=4 25452 B16R1.659 CN(CCCO)C(=O)Cc1cccc(c1)O 527a_100000213112_100000745134 [0,2,0,0,0,0|2,0,0]=4 25453 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Br 11a_100000743101_100000747190 [0,2,0,0,0,0|2,0,0]=4 25454 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Br 240690a_100000743101_100000747190 [0,2,0,0,0,0|2,0,0]=4 25455 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Br 527a_100000743101_100000747190 [0,2,0,0,0,0|2,0,0]=4 25456 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C 11a_100000743101_100011206899 [0,2,0,0,0,0|2,0,0]=4 25457 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C 1626a_100000743101_100011206899 [0,2,0,0,0,0|2,0,0]=4 25458 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C 240690a_100000743101_100011206899 [0,2,0,0,0,0|2,0,0]=4 25459 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)C 527a_100000743101_100011206899 [0,2,0,0,0,0|2,0,0]=4 25460 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl 11a_100000743101_100000749307 [0,2,0,0,0,0|2,0,0]=4 25461 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl 1626a_100000743101_100000749307 [0,2,0,0,0,0|2,0,0]=4 25462 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl 240690a_100000743101_100000749307 [0,2,0,0,0,0|2,0,0]=4 25463 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)Cl 527a_100000743101_100000749307 [0,2,0,0,0,0|2,0,0]=4 25464 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F 11a_100000743101_100000211661 [0,2,0,0,0,0|2,0,0]=4 25465 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F 1626a_100000743101_100000211661 [0,2,0,0,0,0|2,0,0]=4 25466 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F 240690a_100000743101_100000211661 [0,2,0,0,0,0|2,0,0]=4 25467 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)F 527a_100000743101_100000211661 [0,2,0,0,0,0|2,0,0]=4 25468 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)I 11a_100000743101_100000238430 [0,2,0,0,0,0|2,0,0]=4 25469 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)I 1626a_100000743101_100000238430 [0,2,0,0,0,0|2,0,0]=4 25470 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)I 240690a_100000743101_100000238430 [0,2,0,0,0,0|2,0,0]=4 25471 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)I 527a_100000743101_100000238430 [0,2,0,0,0,0|2,0,0]=4 25472 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)O 240690a_100000743101_100000745134 [0,2,0,0,0,0|2,0,0]=4 25473 B16R1.659 COCCN(C)C(=O)Cc1cccc(c1)O 527a_100000743101_100000745134 [0,2,0,0,0,0|2,0,0]=4 25474 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)Br 1458a_100000685904_100000211773 [0,2,0,0,0,0|2,0,0]=4 25475 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)C 1458a_100000685904_100000211840 [0,2,0,0,0,0|2,0,0]=4 25476 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)Cl 1458a_100000685904_100000181238 [0,2,0,0,0,0|2,0,0]=4 25477 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)F 1458a_100000685904_100000230114 [0,2,0,0,0,0|2,0,0]=4 25478 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)I 1458a_100000685904_100011218688 [0,2,0,0,0,0|2,0,0]=4 25479 B16R1.659 CSCCC(O)C(=O)Cc1cccc(c1)O 1458a_100000685904_100011660834 [0,2,0,0,0,0|2,0,0]=4 25480 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Br 11a_100000686725_100000747190 [0,2,0,0,0,0|2,0,0]=4 25481 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Br 240690a_100000686725_100000747190 [0,2,0,0,0,0|2,0,0]=4 25482 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Br 527a_100000686725_100000747190 [0,2,0,0,0,0|2,0,0]=4 25483 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)C 11a_100000686725_100011206899 [0,2,0,0,0,0|2,0,0]=4 25484 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)C 1626a_100000686725_100011206899 [0,2,0,0,0,0|2,0,0]=4 25485 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)C 240690a_100000686725_100011206899 [0,2,0,0,0,0|2,0,0]=4 25486 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)C 527a_100000686725_100011206899 [0,2,0,0,0,0|2,0,0]=4 25487 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Cl 11a_100000686725_100000749307 [0,2,0,0,0,0|2,0,0]=4 25488 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Cl 1626a_100000686725_100000749307 [0,2,0,0,0,0|2,0,0]=4 25489 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Cl 240690a_100000686725_100000749307 [0,2,0,0,0,0|2,0,0]=4 25490 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)Cl 527a_100000686725_100000749307 [0,2,0,0,0,0|2,0,0]=4 25491 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)F 11a_100000686725_100000211661 [0,2,0,0,0,0|2,0,0]=4 25492 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)F 1626a_100000686725_100000211661 [0,2,0,0,0,0|2,0,0]=4 25493 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)F 240690a_100000686725_100000211661 [0,2,0,0,0,0|2,0,0]=4 25494 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)F 527a_100000686725_100000211661 [0,2,0,0,0,0|2,0,0]=4 25495 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)I 11a_100000686725_100000238430 [0,2,0,0,0,0|2,0,0]=4 25496 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)I 1626a_100000686725_100000238430 [0,2,0,0,0,0|2,0,0]=4 25497 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)I 240690a_100000686725_100000238430 [0,2,0,0,0,0|2,0,0]=4 25498 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)I 527a_100000686725_100000238430 [0,2,0,0,0,0|2,0,0]=4 25499 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)O 240690a_100000686725_100000745134 [0,2,0,0,0,0|2,0,0]=4 25500 B16R1.659 CSCCN(C)C(=O)Cc1cccc(c1)O 527a_100000686725_100000745134 [0,2,0,0,0,0|2,0,0]=4 25501 B16R1.659 Cc1cccc(c1)CC(=O)N(C)CCCO 240690a_100000213112_100011206899 [0,2,0,0,0,0|2,0,0]=4 25502 B16R1.659 Cc1cccc(c1)CC(=O)N(C)CCCO 527a_100000213112_100011206899 [0,2,0,0,0,0|2,0,0]=4 25503 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)Br 1458a_100000138376_100000211773 [0,2,0,0,0,0|1,0,1]=4 25504 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)C 1458a_100000138376_100000211840 [0,2,0,0,0,0|1,0,1]=4 25505 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)Cl 1458a_100000138376_100000181238 [0,2,0,0,0,0|1,0,1]=4 25506 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)F 1458a_100000138376_100000230114 [0,2,0,0,0,0|1,0,1]=4 25507 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)I 1458a_100000138376_100011218688 [0,2,0,0,0,0|1,0,1]=4 25508 B16R1.956 C=C(CCC)CC(=O)Cc1cccc(c1)O 1458a_100000138376_100011660834 [0,2,0,0,0,0|1,0,1]=4 25509 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)Br)C 1458a_100020676950_100000211773 [0,2,0,0,0,0|1,0,1]=4 25510 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)C)C 1458a_100020676950_100000211840 [0,2,0,0,0,0|1,0,1]=4 25511 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)Cl)C 1458a_100020676950_100000181238 [0,2,0,0,0,0|1,0,1]=4 25512 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)F)C 1458a_100020676950_100000230114 [0,2,0,0,0,0|1,0,1]=4 25513 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)I)C 1458a_100020676950_100011218688 [0,2,0,0,0,0|1,0,1]=4 25514 B16R1.956 CCCC(=CC(=O)Cc1cccc(c1)O)C 1458a_100020676950_100011660834 [0,2,0,0,0,0|1,0,1]=4 25515 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000747444 [0,2,0,0,0,0|1,0,1]=4 25516 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)C 1458a_100011206899_100000747444 [0,2,0,0,0,0|1,0,1]=4 25517 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000747444 [0,2,0,0,0,0|1,0,1]=4 25518 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)F 1458a_100000211661_100000747444 [0,2,0,0,0,0|1,0,1]=4 25519 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)I 1458a_100000238430_100000747444 [0,2,0,0,0,0|1,0,1]=4 25520 B16R1.956 CCCC(=O)CC(=O)Cc1cccc(c1)O 1458a_100000745134_100000747444 [0,2,0,0,0,0|1,0,1]=4 25521 B16R1.956 CCCC(C)CC(=O)Cc1cc(ccn1)Br 1458a_100000748435_100010173614 [0,2,0,0,0,0|2,0,0]=4 25522 B16R1.956 CCCC(C)CC(=O)Cc1cc(ccn1)C 1458a_100000748435_100000718516 [0,2,0,0,0,0|2,0,0]=4 25523 B16R1.956 CCCC(C)CC(=O)Cc1cc(ccn1)Cl 1458a_100000748435_100016988179 [0,2,0,0,0,0|2,0,0]=4 25524 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011216630 [0,2,0,0,0,0|1,0,0]=3 25525 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)Br 1458a_100000748435_100000211773 [0,2,0,0,0,0|1,0,0]=3 25526 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)C 1458a_100000748435_100000211840 [0,2,0,0,0,0|1,0,0]=3 25527 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)C 1458a_100011206899_100011216630 [0,2,0,0,0,0|1,0,0]=3 25528 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)Cl 1458a_100000748435_100000181238 [0,2,0,0,0,0|1,0,0]=3 25529 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011216630 [0,2,0,0,0,0|1,0,0]=3 25530 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)F 1458a_100000211661_100011216630 [0,2,0,0,0,0|1,0,0]=3 25531 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)F 1458a_100000748435_100000230114 [0,2,0,0,0,0|1,0,0]=3 25532 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)I 1458a_100000238430_100011216630 [0,2,0,0,0,0|1,0,0]=3 25533 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)I 1458a_100000748435_100011218688 [0,2,0,0,0,0|1,0,0]=3 25534 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)O 1458a_100000745134_100011216630 [0,2,0,0,0,0|1,0,0]=3 25535 B16R1.956 CCCC(C)CC(=O)Cc1cccc(c1)O 1458a_100000748435_100011660834 [0,2,0,0,0,0|1,0,0]=3 25536 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)Br 1458a_100000748435_100009889011 [0,2,0,0,0,0|2,0,0]=4 25537 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)Br 1458a_100010201708_100011216630 [0,2,0,0,0,0|2,0,0]=4 25538 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)C 1458a_100000748435_100000757606 [0,2,0,0,0,0|2,0,0]=4 25539 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)C 1458a_100012001110_100011216630 [0,2,0,0,0,0|2,0,0]=4 25540 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100011216630 [0,2,0,0,0,0|2,0,0]=4 25541 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)Cl 1458a_100000748435_100000086093 [0,2,0,0,0,0|2,0,0]=4 25542 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)F 1458a_100000096803_100011216630 [0,2,0,0,0,0|2,0,0]=4 25543 B16R1.956 CCCC(C)CC(=O)Cc1cccc(n1)F 1458a_100000748435_100009819644 [0,2,0,0,0,0|2,0,0]=4 25544 B16R1.956 CCCC(C)CC(=O)Cc1ccnc(c1)Br 1458a_100000748435_100010243470 [0,2,0,0,0,0|2,0,0]=4 25545 B16R1.956 CCCC(C)CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100011216630 [0,2,0,0,0,0|2,0,0]=4 25546 B16R1.956 CCCC(C)CC(=O)Cc1ccnc(c1)C 1458a_100000748435_200020672517 [0,2,0,0,0,0|2,0,0]=4 25547 B16R1.956 CCCC(C)CC(=O)Cc1ccnc(c1)Cl 1458a_100000748435_100000764220 [0,2,0,0,0,0|2,0,0]=4 25548 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)Br 1458a_100000239331_100011216630 [0,2,0,0,0,0|2,0,0]=4 25549 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)Br 1458a_100000748435_100011740620 [0,2,0,0,0,0|2,0,0]=4 25550 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)C 1458a_100000748435_100000716715 [0,2,0,0,0,0|2,0,0]=4 25551 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)Cl 1458a_100000748435_100016992070 [0,2,0,0,0,0|2,0,0]=4 25552 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)F 1458a_100000748435_100000725299 [0,2,0,0,0,0|2,0,0]=4 25553 B16R1.956 CCCC(C)CC(=O)Cc1cncc(c1)F 1458a_100011667516_100011216630 [0,2,0,0,0,0|2,0,0]=4 25554 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000748435 [0,2,0,0,0,0|2,0,0]=4 25555 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000748435 [0,2,0,0,0,0|2,0,0]=4 25556 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000748435 [0,2,0,0,0,0|2,0,0]=4 25557 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Br 527a_100000210019_100000748435 [0,2,0,0,0,0|2,0,0]=4 25558 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)C 11a_100000188690_100000748435 [0,2,0,0,0,0|2,0,0]=4 25559 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000748435 [0,2,0,0,0,0|2,0,0]=4 25560 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)C 22a_100000188690_100000748435 [0,2,0,0,0,0|2,0,0]=4 25561 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)C 527a_100000188690_100000748435 [0,2,0,0,0,0|2,0,0]=4 25562 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000748435 [0,2,0,0,0,0|2,0,0]=4 25563 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000748435 [0,2,0,0,0,0|2,0,0]=4 25564 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000748435 [0,2,0,0,0,0|2,0,0]=4 25565 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)F 11a_100000210047_100000748435 [0,2,0,0,0,0|2,0,0]=4 25566 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000748435 [0,2,0,0,0,0|2,0,0]=4 25567 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)F 22a_100000210047_100000748435 [0,2,0,0,0,0|2,0,0]=4 25568 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)F 527a_100000210047_100000748435 [0,2,0,0,0,0|2,0,0]=4 25569 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)I 11a_100000211102_100000748435 [0,2,0,0,0,0|2,0,0]=4 25570 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000748435 [0,2,0,0,0,0|2,0,0]=4 25571 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)I 22a_100000211102_100000748435 [0,2,0,0,0,0|2,0,0]=4 25572 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)I 527a_100000211102_100000748435 [0,2,0,0,0,0|2,0,0]=4 25573 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000748435 [0,2,0,0,0,0|2,0,0]=4 25574 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)O 22a_100000210217_100000748435 [0,2,0,0,0,0|2,0,0]=4 25575 B16R1.956 CCCC(C)CC(=O)Nc1cccc(c1)O 527a_100000210217_100000748435 [0,2,0,0,0,0|2,0,0]=4 25576 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Br 11a_100000741246_100000747190 [0,2,0,0,0,0|1,0,0]=3 25577 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Br 240690a_100000741246_100000747190 [0,2,0,0,0,0|1,0,0]=3 25578 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Br 527a_100000741246_100000747190 [0,2,0,0,0,0|1,0,0]=3 25579 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)C 11a_100000741246_100011206899 [0,2,0,0,0,0|1,0,0]=3 25580 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)C 1626a_100000741246_100011206899 [0,2,0,0,0,0|1,0,0]=3 25581 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)C 240690a_100000741246_100011206899 [0,2,0,0,0,0|1,0,0]=3 25582 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)C 527a_100000741246_100011206899 [0,2,0,0,0,0|1,0,0]=3 25583 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Cl 11a_100000741246_100000749307 [0,2,0,0,0,0|1,0,0]=3 25584 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Cl 1626a_100000741246_100000749307 [0,2,0,0,0,0|1,0,0]=3 25585 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Cl 240690a_100000741246_100000749307 [0,2,0,0,0,0|1,0,0]=3 25586 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)Cl 527a_100000741246_100000749307 [0,2,0,0,0,0|1,0,0]=3 25587 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)F 11a_100000741246_100000211661 [0,2,0,0,0,0|1,0,0]=3 25588 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)F 1626a_100000741246_100000211661 [0,2,0,0,0,0|1,0,0]=3 25589 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)F 240690a_100000741246_100000211661 [0,2,0,0,0,0|1,0,0]=3 25590 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)F 527a_100000741246_100000211661 [0,2,0,0,0,0|1,0,0]=3 25591 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)I 11a_100000741246_100000238430 [0,2,0,0,0,0|1,0,0]=3 25592 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)I 1626a_100000741246_100000238430 [0,2,0,0,0,0|1,0,0]=3 25593 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)I 240690a_100000741246_100000238430 [0,2,0,0,0,0|1,0,0]=3 25594 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)I 527a_100000741246_100000238430 [0,2,0,0,0,0|1,0,0]=3 25595 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)O 240690a_100000741246_100000745134 [0,2,0,0,0,0|1,0,0]=3 25596 B16R1.956 CCCC(C)NC(=O)Cc1cccc(c1)O 527a_100000741246_100000745134 [0,2,0,0,0,0|1,0,0]=3 25597 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Br 11a_100000741246_100010201708 [0,2,0,0,0,0|2,0,0]=4 25598 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Br 240690a_100000741246_100010201708 [0,2,0,0,0,0|2,0,0]=4 25599 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Br 527a_100000741246_100010201708 [0,2,0,0,0,0|2,0,0]=4 25600 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)C 11a_100000741246_100012001110 [0,2,0,0,0,0|2,0,0]=4 25601 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)C 1626a_100000741246_100012001110 [0,2,0,0,0,0|2,0,0]=4 25602 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)C 240690a_100000741246_100012001110 [0,2,0,0,0,0|2,0,0]=4 25603 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)C 527a_100000741246_100012001110 [0,2,0,0,0,0|2,0,0]=4 25604 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Cl 11a_100000741246_100000090259 [0,2,0,0,0,0|2,0,0]=4 25605 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Cl 1626a_100000741246_100000090259 [0,2,0,0,0,0|2,0,0]=4 25606 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)Cl 240690a_100000741246_100000090259 [0,2,0,0,0,0|2,0,0]=4 25607 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)F 11a_100000741246_100000096803 [0,2,0,0,0,0|2,0,0]=4 25608 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)F 1626a_100000741246_100000096803 [0,2,0,0,0,0|2,0,0]=4 25609 B16R1.956 CCCC(C)NC(=O)Cc1cccc(n1)F 240690a_100000741246_100000096803 [0,2,0,0,0,0|2,0,0]=4 25610 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Br 11a_100000741246_100010126891 [0,2,0,0,0,0|2,0,0]=4 25611 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Br 240690a_100000741246_100010126891 [0,2,0,0,0,0|2,0,0]=4 25612 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Br 527a_100000741246_100010126891 [0,2,0,0,0,0|2,0,0]=4 25613 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Cl 11a_100000741246_100000085289 [0,2,0,0,0,0|2,0,0]=4 25614 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Cl 1626a_100000741246_100000085289 [0,2,0,0,0,0|2,0,0]=4 25615 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Cl 240690a_100000741246_100000085289 [0,2,0,0,0,0|2,0,0]=4 25616 B16R1.956 CCCC(C)NC(=O)Cc1ccnc(c1)Cl 527a_100000741246_100000085289 [0,2,0,0,0,0|2,0,0]=4 25617 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)Br 11a_100000741246_100000239331 [0,2,0,0,0,0|2,0,0]=4 25618 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)Br 240690a_100000741246_100000239331 [0,2,0,0,0,0|2,0,0]=4 25619 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)Br 527a_100000741246_100000239331 [0,2,0,0,0,0|2,0,0]=4 25620 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)F 11a_100000741246_100011667516 [0,2,0,0,0,0|2,0,0]=4 25621 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)F 240690a_100000741246_100011667516 [0,2,0,0,0,0|2,0,0]=4 25622 B16R1.956 CCCC(C)NC(=O)Cc1cncc(c1)F 527a_100000741246_100011667516 [0,2,0,0,0,0|2,0,0]=4 25623 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000741246 [0,2,0,0,0,0|2,0,0]=4 25624 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)Br 512a_100000210019_100000741246 [0,2,0,0,0,0|2,0,0]=4 25625 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)C 2430a_100000188690_100000741246 [0,2,0,0,0,0|2,0,0]=4 25626 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)C 512a_100000188690_100000741246 [0,2,0,0,0,0|2,0,0]=4 25627 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000741246 [0,2,0,0,0,0|2,0,0]=4 25628 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)F 2430a_100000210047_100000741246 [0,2,0,0,0,0|2,0,0]=4 25629 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)F 512a_100000210047_100000741246 [0,2,0,0,0,0|2,0,0]=4 25630 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)I 2430a_100000211102_100000741246 [0,2,0,0,0,0|2,0,0]=4 25631 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)I 512a_100000211102_100000741246 [0,2,0,0,0,0|2,0,0]=4 25632 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)O 2430a_100000210217_100000741246 [0,2,0,0,0,0|2,0,0]=4 25633 B16R1.956 CCCC(C)NC(=O)Nc1cccc(c1)O 512a_100000210217_100000741246 [0,2,0,0,0,0|2,0,0]=4 25634 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)Br 1458a_100011387404_100000211773 [0,2,0,0,0,0|2,0,0]=4 25635 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)C 1458a_100011387404_100000211840 [0,2,0,0,0,0|2,0,0]=4 25636 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)Cl 1458a_100011387404_100000181238 [0,2,0,0,0,0|2,0,0]=4 25637 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)F 1458a_100011387404_100000230114 [0,2,0,0,0,0|2,0,0]=4 25638 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)I 1458a_100011387404_100011218688 [0,2,0,0,0,0|2,0,0]=4 25639 B16R1.956 CCCS(=O)CC(=O)Cc1cccc(c1)O 1458a_100011387404_100011660834 [0,2,0,0,0,0|2,0,0]=4 25640 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)Br 1458a_200011311441_100000211773 [0,2,0,0,0,0|2,0,0]=4 25641 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)C 1458a_200011311441_100000211840 [0,2,0,0,0,0|2,0,0]=4 25642 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)Cl 1458a_200011311441_100000181238 [0,2,0,0,0,0|2,0,0]=4 25643 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)F 1458a_200011311441_100000230114 [0,2,0,0,0,0|2,0,0]=4 25644 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)I 1458a_200011311441_100011218688 [0,2,0,0,0,0|2,0,0]=4 25645 B16R1.956 CCSC(C)CC(=O)Cc1cccc(c1)O 1458a_200011311441_100011660834 [0,2,0,0,0,0|2,0,0]=4 25646 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Br 11a_100000764878_100000747190 [0,2,0,0,0,0|2,0,0]=4 25647 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Br 240690a_100000764878_100000747190 [0,2,0,0,0,0|2,0,0]=4 25648 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Br 527a_100000764878_100000747190 [0,2,0,0,0,0|2,0,0]=4 25649 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C 11a_100000764878_100011206899 [0,2,0,0,0,0|2,0,0]=4 25650 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C 1626a_100000764878_100011206899 [0,2,0,0,0,0|2,0,0]=4 25651 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C 240690a_100000764878_100011206899 [0,2,0,0,0,0|2,0,0]=4 25652 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)C 527a_100000764878_100011206899 [0,2,0,0,0,0|2,0,0]=4 25653 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl 11a_100000764878_100000749307 [0,2,0,0,0,0|2,0,0]=4 25654 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl 1626a_100000764878_100000749307 [0,2,0,0,0,0|2,0,0]=4 25655 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl 240690a_100000764878_100000749307 [0,2,0,0,0,0|2,0,0]=4 25656 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)Cl 527a_100000764878_100000749307 [0,2,0,0,0,0|2,0,0]=4 25657 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F 11a_100000764878_100000211661 [0,2,0,0,0,0|2,0,0]=4 25658 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F 1626a_100000764878_100000211661 [0,2,0,0,0,0|2,0,0]=4 25659 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F 240690a_100000764878_100000211661 [0,2,0,0,0,0|2,0,0]=4 25660 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)F 527a_100000764878_100000211661 [0,2,0,0,0,0|2,0,0]=4 25661 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)I 11a_100000764878_100000238430 [0,2,0,0,0,0|2,0,0]=4 25662 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)I 1626a_100000764878_100000238430 [0,2,0,0,0,0|2,0,0]=4 25663 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)I 240690a_100000764878_100000238430 [0,2,0,0,0,0|2,0,0]=4 25664 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)I 527a_100000764878_100000238430 [0,2,0,0,0,0|2,0,0]=4 25665 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)O 240690a_100000764878_100000745134 [0,2,0,0,0,0|2,0,0]=4 25666 B16R1.956 COC[C@@H](C)NC(=O)Cc1cccc(c1)O 527a_100000764878_100000745134 [0,2,0,0,0,0|2,0,0]=4 25667 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)Br 240690a_100000706166_100000747190 [0,2,0,0,0,0|2,0,0]=4 25668 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)Br 527a_100000706166_100000747190 [0,2,0,0,0,0|2,0,0]=4 25669 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)Cl 240690a_100000706166_100000749307 [0,2,0,0,0,0|2,0,0]=4 25670 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)Cl 527a_100000706166_100000749307 [0,2,0,0,0,0|2,0,0]=4 25671 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)F 240690a_100000706166_100000211661 [0,2,0,0,0,0|2,0,0]=4 25672 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)F 527a_100000706166_100000211661 [0,2,0,0,0,0|2,0,0]=4 25673 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)I 240690a_100000706166_100000238430 [0,2,0,0,0,0|2,0,0]=4 25674 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)I 527a_100000706166_100000238430 [0,2,0,0,0,0|2,0,0]=4 25675 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)O 240690a_100000706166_100000745134 [0,2,0,0,0,0|2,0,0]=4 25676 B16R1.956 C[C@H](CCO)NC(=O)Cc1cccc(c1)O 527a_100000706166_100000745134 [0,2,0,0,0,0|2,0,0]=4 25677 B16R1.956 Cc1cccc(c1)CC(=O)N[C@H](C)CCO 240690a_100000706166_100011206899 [0,2,0,0,0,0|2,0,0]=4 25678 B16R1.956 Cc1cccc(c1)CC(=O)N[C@H](C)CCO 527a_100000706166_100011206899 [0,2,0,0,0,0|2,0,0]=4 25679 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)Br 240690a_100000744482_100000747190 [0,2,0,0,0,0|2,0,0]=4 25680 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)Br 527a_100000744482_100000747190 [0,2,0,0,0,0|2,0,0]=4 25681 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)Cl 240690a_100000744482_100000749307 [0,2,0,0,0,0|2,0,0]=4 25682 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)Cl 527a_100000744482_100000749307 [0,2,0,0,0,0|2,0,0]=4 25683 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)F 240690a_100000744482_100000211661 [0,2,0,0,0,0|2,0,0]=4 25684 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)F 527a_100000744482_100000211661 [0,2,0,0,0,0|2,0,0]=4 25685 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)I 240690a_100000744482_100000238430 [0,2,0,0,0,0|2,0,0]=4 25686 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)I 527a_100000744482_100000238430 [0,2,0,0,0,0|2,0,0]=4 25687 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)O 240690a_100000744482_100000745134 [0,2,0,0,0,0|2,0,0]=4 25688 B16R1.1148 CC(CO)CNC(=O)Cc1cccc(c1)O 527a_100000744482_100000745134 [0,2,0,0,0,0|2,0,0]=4 25689 B16R1.1148 CCC(C)CCC(=O)Cc1cc(ccn1)Br 1458a_100000701222_100010173614 [0,2,0,0,0,0|2,0,0]=4 25690 B16R1.1148 CCC(C)CCC(=O)Cc1cc(ccn1)C 1458a_100000701222_100000718516 [0,2,0,0,0,0|2,0,0]=4 25691 B16R1.1148 CCC(C)CCC(=O)Cc1cc(ccn1)Cl 1458a_100000701222_100016988179 [0,2,0,0,0,0|2,0,0]=4 25692 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)Br 1458a_100000701222_100000211773 [0,2,0,0,0,0|1,0,0]=3 25693 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)C 1458a_100000701222_100000211840 [0,2,0,0,0,0|1,0,0]=3 25694 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)Cl 1458a_100000701222_100000181238 [0,2,0,0,0,0|1,0,0]=3 25695 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)F 1458a_100000701222_100000230114 [0,2,0,0,0,0|1,0,0]=3 25696 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)I 1458a_100000701222_100011218688 [0,2,0,0,0,0|1,0,0]=3 25697 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(c1)O 1458a_100000701222_100011660834 [0,2,0,0,0,0|1,0,0]=3 25698 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(n1)Br 1458a_100000701222_100009889011 [0,2,0,0,0,0|2,0,0]=4 25699 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(n1)C 1458a_100000701222_100000757606 [0,2,0,0,0,0|2,0,0]=4 25700 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(n1)Cl 1458a_100000701222_100000086093 [0,2,0,0,0,0|2,0,0]=4 25701 B16R1.1148 CCC(C)CCC(=O)Cc1cccc(n1)F 1458a_100000701222_100009819644 [0,2,0,0,0,0|2,0,0]=4 25702 B16R1.1148 CCC(C)CCC(=O)Cc1ccnc(c1)Br 1458a_100000701222_100010243470 [0,2,0,0,0,0|2,0,0]=4 25703 B16R1.1148 CCC(C)CCC(=O)Cc1ccnc(c1)C 1458a_100000701222_200020672517 [0,2,0,0,0,0|2,0,0]=4 25704 B16R1.1148 CCC(C)CCC(=O)Cc1ccnc(c1)Cl 1458a_100000701222_100000764220 [0,2,0,0,0,0|2,0,0]=4 25705 B16R1.1148 CCC(C)CCC(=O)Cc1cncc(c1)Br 1458a_100000701222_100011740620 [0,2,0,0,0,0|2,0,0]=4 25706 B16R1.1148 CCC(C)CCC(=O)Cc1cncc(c1)C 1458a_100000701222_100000716715 [0,2,0,0,0,0|2,0,0]=4 25707 B16R1.1148 CCC(C)CCC(=O)Cc1cncc(c1)Cl 1458a_100000701222_100016992070 [0,2,0,0,0,0|2,0,0]=4 25708 B16R1.1148 CCC(C)CCC(=O)Cc1cncc(c1)F 1458a_100000701222_100000725299 [0,2,0,0,0,0|2,0,0]=4 25709 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000701222 [0,2,0,0,0,0|2,0,0]=4 25710 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000701222 [0,2,0,0,0,0|2,0,0]=4 25711 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000701222 [0,2,0,0,0,0|2,0,0]=4 25712 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000701222 [0,2,0,0,0,0|2,0,0]=4 25713 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000701222 [0,2,0,0,0,0|2,0,0]=4 25714 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000701222 [0,2,0,0,0,0|2,0,0]=4 25715 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000701222 [0,2,0,0,0,0|2,0,0]=4 25716 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000701222 [0,2,0,0,0,0|2,0,0]=4 25717 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000701222 [0,2,0,0,0,0|2,0,0]=4 25718 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000701222 [0,2,0,0,0,0|2,0,0]=4 25719 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000701222 [0,2,0,0,0,0|2,0,0]=4 25720 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000701222 [0,2,0,0,0,0|2,0,0]=4 25721 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000701222 [0,2,0,0,0,0|2,0,0]=4 25722 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000701222 [0,2,0,0,0,0|2,0,0]=4 25723 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000701222 [0,2,0,0,0,0|2,0,0]=4 25724 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000701222 [0,2,0,0,0,0|2,0,0]=4 25725 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000701222 [0,2,0,0,0,0|2,0,0]=4 25726 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000701222 [0,2,0,0,0,0|2,0,0]=4 25727 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000701222 [0,2,0,0,0,0|2,0,0]=4 25728 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000701222 [0,2,0,0,0,0|2,0,0]=4 25729 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000701222 [0,2,0,0,0,0|2,0,0]=4 25730 B16R1.1148 CCC(C)CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000701222 [0,2,0,0,0,0|2,0,0]=4 25731 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Br 11a_100020588543_100000747190 [0,2,0,0,0,0|1,0,0]=3 25732 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Br 240690a_100020588543_100000747190 [0,2,0,0,0,0|1,0,0]=3 25733 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Br 527a_100020588543_100000747190 [0,2,0,0,0,0|1,0,0]=3 25734 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)C 11a_100020588543_100011206899 [0,2,0,0,0,0|1,0,0]=3 25735 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)C 1626a_100020588543_100011206899 [0,2,0,0,0,0|1,0,0]=3 25736 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)C 240690a_100020588543_100011206899 [0,2,0,0,0,0|1,0,0]=3 25737 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)C 527a_100020588543_100011206899 [0,2,0,0,0,0|1,0,0]=3 25738 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Cl 11a_100020588543_100000749307 [0,2,0,0,0,0|1,0,0]=3 25739 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Cl 1626a_100020588543_100000749307 [0,2,0,0,0,0|1,0,0]=3 25740 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Cl 240690a_100020588543_100000749307 [0,2,0,0,0,0|1,0,0]=3 25741 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)Cl 527a_100020588543_100000749307 [0,2,0,0,0,0|1,0,0]=3 25742 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)F 11a_100020588543_100000211661 [0,2,0,0,0,0|1,0,0]=3 25743 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)F 1626a_100020588543_100000211661 [0,2,0,0,0,0|1,0,0]=3 25744 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)F 240690a_100020588543_100000211661 [0,2,0,0,0,0|1,0,0]=3 25745 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)F 527a_100020588543_100000211661 [0,2,0,0,0,0|1,0,0]=3 25746 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)I 11a_100020588543_100000238430 [0,2,0,0,0,0|1,0,0]=3 25747 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)I 1626a_100020588543_100000238430 [0,2,0,0,0,0|1,0,0]=3 25748 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)I 240690a_100020588543_100000238430 [0,2,0,0,0,0|1,0,0]=3 25749 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)I 527a_100020588543_100000238430 [0,2,0,0,0,0|1,0,0]=3 25750 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)O 240690a_100020588543_100000745134 [0,2,0,0,0,0|1,0,0]=3 25751 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(c1)O 527a_100020588543_100000745134 [0,2,0,0,0,0|1,0,0]=3 25752 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Br 11a_100020588543_100010201708 [0,2,0,0,0,0|2,0,0]=4 25753 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Br 240690a_100020588543_100010201708 [0,2,0,0,0,0|2,0,0]=4 25754 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Br 527a_100020588543_100010201708 [0,2,0,0,0,0|2,0,0]=4 25755 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)C 11a_100020588543_100012001110 [0,2,0,0,0,0|2,0,0]=4 25756 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)C 1626a_100020588543_100012001110 [0,2,0,0,0,0|2,0,0]=4 25757 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)C 240690a_100020588543_100012001110 [0,2,0,0,0,0|2,0,0]=4 25758 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)C 527a_100020588543_100012001110 [0,2,0,0,0,0|2,0,0]=4 25759 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Cl 11a_100020588543_100000090259 [0,2,0,0,0,0|2,0,0]=4 25760 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Cl 1626a_100020588543_100000090259 [0,2,0,0,0,0|2,0,0]=4 25761 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)Cl 240690a_100020588543_100000090259 [0,2,0,0,0,0|2,0,0]=4 25762 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)F 11a_100020588543_100000096803 [0,2,0,0,0,0|2,0,0]=4 25763 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)F 1626a_100020588543_100000096803 [0,2,0,0,0,0|2,0,0]=4 25764 B16R1.1148 CCC(C)CNC(=O)Cc1cccc(n1)F 240690a_100020588543_100000096803 [0,2,0,0,0,0|2,0,0]=4 25765 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Br 11a_100020588543_100010126891 [0,2,0,0,0,0|2,0,0]=4 25766 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Br 240690a_100020588543_100010126891 [0,2,0,0,0,0|2,0,0]=4 25767 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Br 527a_100020588543_100010126891 [0,2,0,0,0,0|2,0,0]=4 25768 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Cl 11a_100020588543_100000085289 [0,2,0,0,0,0|2,0,0]=4 25769 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Cl 1626a_100020588543_100000085289 [0,2,0,0,0,0|2,0,0]=4 25770 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Cl 240690a_100020588543_100000085289 [0,2,0,0,0,0|2,0,0]=4 25771 B16R1.1148 CCC(C)CNC(=O)Cc1ccnc(c1)Cl 527a_100020588543_100000085289 [0,2,0,0,0,0|2,0,0]=4 25772 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)Br 11a_100020588543_100000239331 [0,2,0,0,0,0|2,0,0]=4 25773 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)Br 240690a_100020588543_100000239331 [0,2,0,0,0,0|2,0,0]=4 25774 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)Br 527a_100020588543_100000239331 [0,2,0,0,0,0|2,0,0]=4 25775 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)F 11a_100020588543_100011667516 [0,2,0,0,0,0|2,0,0]=4 25776 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)F 240690a_100020588543_100011667516 [0,2,0,0,0,0|2,0,0]=4 25777 B16R1.1148 CCC(C)CNC(=O)Cc1cncc(c1)F 527a_100020588543_100011667516 [0,2,0,0,0,0|2,0,0]=4 25778 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100020588543 [0,2,0,0,0,0|2,0,0]=4 25779 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100020588543 [0,2,0,0,0,0|2,0,0]=4 25780 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100020588543 [0,2,0,0,0,0|2,0,0]=4 25781 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)C 512a_100000188690_100020588543 [0,2,0,0,0,0|2,0,0]=4 25782 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100020588543 [0,2,0,0,0,0|2,0,0]=4 25783 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100020588543 [0,2,0,0,0,0|2,0,0]=4 25784 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)F 512a_100000210047_100020588543 [0,2,0,0,0,0|2,0,0]=4 25785 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100020588543 [0,2,0,0,0,0|2,0,0]=4 25786 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)I 512a_100000211102_100020588543 [0,2,0,0,0,0|2,0,0]=4 25787 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100020588543 [0,2,0,0,0,0|2,0,0]=4 25788 B16R1.1148 CCC(C)CNC(=O)Nc1cccc(c1)O 512a_100000210217_100020588543 [0,2,0,0,0,0|2,0,0]=4 25789 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)Br 22a_100000718999_100000747190 [0,2,0,0,0,0|2,0,0]=4 25790 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)C 22a_100000718999_100011206899 [0,2,0,0,0,0|2,0,0]=4 25791 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)Cl 22a_100000718999_100000749307 [0,2,0,0,0,0|2,0,0]=4 25792 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)F 22a_100000718999_100000211661 [0,2,0,0,0,0|2,0,0]=4 25793 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)I 22a_100000718999_100000238430 [0,2,0,0,0,0|2,0,0]=4 25794 B16R1.1148 CCC(C)NNC(=O)Cc1cccc(c1)O 22a_100000718999_100000745134 [0,2,0,0,0,0|2,0,0]=4 25795 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_203496584001 [0,2,0,0,0,0|2,0,0]=4 25796 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)Br 22a_100000210019_203496584001 [0,2,0,0,0,0|2,0,0]=4 25797 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)C 1626a_100000188690_203496584001 [0,2,0,0,0,0|2,0,0]=4 25798 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)C 22a_100000188690_203496584001 [0,2,0,0,0,0|2,0,0]=4 25799 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_203496584001 [0,2,0,0,0,0|2,0,0]=4 25800 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_203496584001 [0,2,0,0,0,0|2,0,0]=4 25801 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)F 1626a_100000210047_203496584001 [0,2,0,0,0,0|2,0,0]=4 25802 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)F 22a_100000210047_203496584001 [0,2,0,0,0,0|2,0,0]=4 25803 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)I 1626a_100000211102_203496584001 [0,2,0,0,0,0|2,0,0]=4 25804 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)I 22a_100000211102_203496584001 [0,2,0,0,0,0|2,0,0]=4 25805 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)O 1626a_100000210217_203496584001 [0,2,0,0,0,0|2,0,0]=4 25806 B16R1.1148 CCC(O)CCC(=O)Nc1cccc(c1)O 22a_100000210217_203496584001 [0,2,0,0,0,0|2,0,0]=4 25807 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Br 11a_100011218483_100000747190 [0,2,0,0,0,0|1,0,0]=3 25808 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Br 240690a_100011218483_100000747190 [0,2,0,0,0,0|1,0,0]=3 25809 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Br 527a_100011218483_100000747190 [0,2,0,0,0,0|1,0,0]=3 25810 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)C 11a_100011218483_100011206899 [0,2,0,0,0,0|1,0,0]=3 25811 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)C 240690a_100011218483_100011206899 [0,2,0,0,0,0|1,0,0]=3 25812 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)C 527a_100011218483_100011206899 [0,2,0,0,0,0|1,0,0]=3 25813 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Cl 11a_100011218483_100000749307 [0,2,0,0,0,0|1,0,0]=3 25814 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Cl 240690a_100011218483_100000749307 [0,2,0,0,0,0|1,0,0]=3 25815 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)Cl 527a_100011218483_100000749307 [0,2,0,0,0,0|1,0,0]=3 25816 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)F 11a_100011218483_100000211661 [0,2,0,0,0,0|1,0,0]=3 25817 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)F 240690a_100011218483_100000211661 [0,2,0,0,0,0|1,0,0]=3 25818 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)F 527a_100011218483_100000211661 [0,2,0,0,0,0|1,0,0]=3 25819 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)I 11a_100011218483_100000238430 [0,2,0,0,0,0|1,0,0]=3 25820 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)I 240690a_100011218483_100000238430 [0,2,0,0,0,0|1,0,0]=3 25821 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)I 527a_100011218483_100000238430 [0,2,0,0,0,0|1,0,0]=3 25822 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)O 240690a_100011218483_100000745134 [0,2,0,0,0,0|1,0,0]=3 25823 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(c1)O 527a_100011218483_100000745134 [0,2,0,0,0,0|1,0,0]=3 25824 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)Br 11a_100011218483_100010201708 [0,2,0,0,0,0|2,0,0]=4 25825 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)Br 240690a_100011218483_100010201708 [0,2,0,0,0,0|2,0,0]=4 25826 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)Br 527a_100011218483_100010201708 [0,2,0,0,0,0|2,0,0]=4 25827 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)C 11a_100011218483_100012001110 [0,2,0,0,0,0|2,0,0]=4 25828 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)C 240690a_100011218483_100012001110 [0,2,0,0,0,0|2,0,0]=4 25829 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)C 527a_100011218483_100012001110 [0,2,0,0,0,0|2,0,0]=4 25830 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)Cl 11a_100011218483_100000090259 [0,2,0,0,0,0|2,0,0]=4 25831 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)Cl 240690a_100011218483_100000090259 [0,2,0,0,0,0|2,0,0]=4 25832 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)F 11a_100011218483_100000096803 [0,2,0,0,0,0|2,0,0]=4 25833 B16R1.1148 CCC(O)CNC(=O)Cc1cccc(n1)F 240690a_100011218483_100000096803 [0,2,0,0,0,0|2,0,0]=4 25834 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Br 11a_100011218483_100010126891 [0,2,0,0,0,0|2,0,0]=4 25835 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Br 240690a_100011218483_100010126891 [0,2,0,0,0,0|2,0,0]=4 25836 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Br 527a_100011218483_100010126891 [0,2,0,0,0,0|2,0,0]=4 25837 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Cl 11a_100011218483_100000085289 [0,2,0,0,0,0|2,0,0]=4 25838 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Cl 240690a_100011218483_100000085289 [0,2,0,0,0,0|2,0,0]=4 25839 B16R1.1148 CCC(O)CNC(=O)Cc1ccnc(c1)Cl 527a_100011218483_100000085289 [0,2,0,0,0,0|2,0,0]=4 25840 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)Br 11a_100011218483_100000239331 [0,2,0,0,0,0|2,0,0]=4 25841 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)Br 240690a_100011218483_100000239331 [0,2,0,0,0,0|2,0,0]=4 25842 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)Br 527a_100011218483_100000239331 [0,2,0,0,0,0|2,0,0]=4 25843 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)F 11a_100011218483_100011667516 [0,2,0,0,0,0|2,0,0]=4 25844 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)F 240690a_100011218483_100011667516 [0,2,0,0,0,0|2,0,0]=4 25845 B16R1.1148 CCC(O)CNC(=O)Cc1cncc(c1)F 527a_100011218483_100011667516 [0,2,0,0,0,0|2,0,0]=4 25846 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100011218483 [0,2,0,0,0,0|2,0,0]=4 25847 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100011218483 [0,2,0,0,0,0|2,0,0]=4 25848 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100011218483 [0,2,0,0,0,0|2,0,0]=4 25849 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100011218483 [0,2,0,0,0,0|2,0,0]=4 25850 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100011218483 [0,2,0,0,0,0|2,0,0]=4 25851 B16R1.1148 CCC(O)CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100011218483 [0,2,0,0,0,0|2,0,0]=4 25852 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)Br 1458a_100000755305_100000211773 [0,2,0,0,0,0|2,0,0]=4 25853 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)C 1458a_100000755305_100000211840 [0,2,0,0,0,0|2,0,0]=4 25854 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)Cl 1458a_100000755305_100000181238 [0,2,0,0,0,0|2,0,0]=4 25855 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)F 1458a_100000755305_100000230114 [0,2,0,0,0,0|2,0,0]=4 25856 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)I 1458a_100000755305_100011218688 [0,2,0,0,0,0|2,0,0]=4 25857 B16R1.1148 CCN(C)CCC(=O)Cc1cccc(c1)O 1458a_100000755305_100011660834 [0,2,0,0,0,0|2,0,0]=4 25858 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)Br 1458a_100011387550_100000211773 [0,2,0,0,0,0|2,0,0]=4 25859 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)C 1458a_100011387550_100000211840 [0,2,0,0,0,0|2,0,0]=4 25860 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)Cl 1458a_100011387550_100000181238 [0,2,0,0,0,0|2,0,0]=4 25861 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)F 1458a_100011387550_100000230114 [0,2,0,0,0,0|2,0,0]=4 25862 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)I 1458a_100011387550_100011218688 [0,2,0,0,0,0|2,0,0]=4 25863 B16R1.1148 CCS(=O)CCC(=O)Cc1cccc(c1)O 1458a_100011387550_100011660834 [0,2,0,0,0,0|2,0,0]=4 25864 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br 11a_100020591295_100000747190 [0,2,0,0,0,0|2,0,0]=4 25865 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br 240690a_100020591295_100000747190 [0,2,0,0,0,0|2,0,0]=4 25866 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Br 527a_100020591295_100000747190 [0,2,0,0,0,0|2,0,0]=4 25867 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C 11a_100020591295_100011206899 [0,2,0,0,0,0|2,0,0]=4 25868 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C 1626a_100020591295_100011206899 [0,2,0,0,0,0|2,0,0]=4 25869 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C 240690a_100020591295_100011206899 [0,2,0,0,0,0|2,0,0]=4 25870 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)C 527a_100020591295_100011206899 [0,2,0,0,0,0|2,0,0]=4 25871 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl 11a_100020591295_100000749307 [0,2,0,0,0,0|2,0,0]=4 25872 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl 1626a_100020591295_100000749307 [0,2,0,0,0,0|2,0,0]=4 25873 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl 240690a_100020591295_100000749307 [0,2,0,0,0,0|2,0,0]=4 25874 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)Cl 527a_100020591295_100000749307 [0,2,0,0,0,0|2,0,0]=4 25875 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F 11a_100020591295_100000211661 [0,2,0,0,0,0|2,0,0]=4 25876 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F 1626a_100020591295_100000211661 [0,2,0,0,0,0|2,0,0]=4 25877 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F 240690a_100020591295_100000211661 [0,2,0,0,0,0|2,0,0]=4 25878 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)F 527a_100020591295_100000211661 [0,2,0,0,0,0|2,0,0]=4 25879 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)I 11a_100020591295_100000238430 [0,2,0,0,0,0|2,0,0]=4 25880 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)I 1626a_100020591295_100000238430 [0,2,0,0,0,0|2,0,0]=4 25881 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)I 240690a_100020591295_100000238430 [0,2,0,0,0,0|2,0,0]=4 25882 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)I 527a_100020591295_100000238430 [0,2,0,0,0,0|2,0,0]=4 25883 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)O 240690a_100020591295_100000745134 [0,2,0,0,0,0|2,0,0]=4 25884 B16R1.1148 CO[C@H](C)CNC(=O)Cc1cccc(c1)O 527a_100020591295_100000745134 [0,2,0,0,0,0|2,0,0]=4 25885 B16R1.1148 Cc1cccc(c1)CC(=O)NCC(C)CO 240690a_100000744482_100011206899 [0,2,0,0,0,0|2,0,0]=4 25886 B16R1.1148 Cc1cccc(c1)CC(=O)NCC(C)CO 527a_100000744482_100011206899 [0,2,0,0,0,0|2,0,0]=4 25887 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@@H](F)CO 240690a_100015665980_100011206899 [0,2,0,0,0,0|2,0,0]=4 25888 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@@H](F)CO 527a_100015665980_100011206899 [0,2,0,0,0,0|2,0,0]=4 25889 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@H](O)CO 240690a_100020644852_100011206899 [0,2,0,0,0,0|2,0,0]=4 25890 B16R1.1148 Cc1cccc(c1)CC(=O)NC[C@H](O)CO 527a_100020644852_100011206899 [0,2,0,0,0,0|2,0,0]=4 25891 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@@H](F)CO 240690a_100015665980_100000747190 [0,2,0,0,0,0|2,0,0]=4 25892 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@@H](F)CO 527a_100015665980_100000747190 [0,2,0,0,0,0|2,0,0]=4 25893 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@H](O)CO 240690a_100020644852_100000747190 [0,2,0,0,0,0|2,0,0]=4 25894 B16R1.1148 O=C(Cc1cccc(c1)Br)NC[C@H](O)CO 527a_100020644852_100000747190 [0,2,0,0,0,0|2,0,0]=4 25895 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@@H](F)CO 240690a_100015665980_100000749307 [0,2,0,0,0,0|2,0,0]=4 25896 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@@H](F)CO 527a_100015665980_100000749307 [0,2,0,0,0,0|2,0,0]=4 25897 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@H](O)CO 240690a_100020644852_100000749307 [0,2,0,0,0,0|2,0,0]=4 25898 B16R1.1148 O=C(Cc1cccc(c1)Cl)NC[C@H](O)CO 527a_100020644852_100000749307 [0,2,0,0,0,0|2,0,0]=4 25899 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@@H](F)CO 240690a_100015665980_100000211661 [0,2,0,0,0,0|2,0,0]=4 25900 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@@H](F)CO 527a_100015665980_100000211661 [0,2,0,0,0,0|2,0,0]=4 25901 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@H](O)CO 240690a_100020644852_100000211661 [0,2,0,0,0,0|2,0,0]=4 25902 B16R1.1148 O=C(Cc1cccc(c1)F)NC[C@H](O)CO 527a_100020644852_100000211661 [0,2,0,0,0,0|2,0,0]=4 25903 B16R1.1148 O=C(Cc1cccc(c1)I)NC[C@@H](F)CO 240690a_100015665980_100000238430 [0,2,0,0,0,0|2,0,0]=4 25904 B16R1.1148 O=C(Cc1cccc(c1)I)NC[C@@H](F)CO 527a_100015665980_100000238430 [0,2,0,0,0,0|2,0,0]=4 25905 B16R1.1148 O=C(Cc1cccc(c1)I)NC[C@H](O)CO 240690a_100020644852_100000238430 [0,2,0,0,0,0|2,0,0]=4 25906 B16R1.1148 O=C(Cc1cccc(c1)I)NC[C@H](O)CO 527a_100020644852_100000238430 [0,2,0,0,0,0|2,0,0]=4 25907 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@@H](F)CO 240690a_100015665980_100000745134 [0,2,0,0,0,0|2,0,0]=4 25908 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@@H](F)CO 527a_100015665980_100000745134 [0,2,0,0,0,0|2,0,0]=4 25909 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@H](O)CO 240690a_100020644852_100000745134 [0,2,0,0,0,0|2,0,0]=4 25910 B16R1.1148 O=C(Cc1cccc(c1)O)NC[C@H](O)CO 527a_100020644852_100000745134 [0,2,0,0,0,0|2,0,0]=4 25911 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Br)Br 1458a_200011218047_100011982794 [0,2,0,0,0,0|1,0,1]=4 25912 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Br)Cl 1458a_200011218047_100000733903 [0,2,0,0,0,0|1,0,1]=4 25913 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Br)F 1458a_200011218047_100000736370 [0,2,0,0,0,0|1,0,1]=4 25914 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Br)I 1458a_200011218047_100012355412 [0,2,0,0,0,0|1,0,1]=4 25915 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1C)C 1458a_200011218047_100000184699 [0,2,0,0,0,0|1,0,1]=4 25916 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1C)Cl 1458a_200011218047_100012186985 [0,2,0,0,0,0|1,0,1]=4 25917 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1C)F 1458a_200011218047_100000709795 [0,2,0,0,0,0|1,0,1]=4 25918 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Cl)Br 1458a_200011218047_100000763347 [0,2,0,0,0,0|1,0,1]=4 25919 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Cl)C 1458a_200011218047_100009871730 [0,2,0,0,0,0|1,0,1]=4 25920 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Cl)Cl 1458a_200011218047_100000754809 [0,2,0,0,0,0|1,0,1]=4 25921 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Cl)F 1458a_200011218047_100000709952 [0,2,0,0,0,0|1,0,1]=4 25922 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1Cl)I 1458a_200011218047_100010188191 [0,2,0,0,0,0|1,0,1]=4 25923 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1F)Br 1458a_200011218047_100000736399 [0,2,0,0,0,0|1,0,1]=4 25924 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1F)C 1458a_200011218047_100011260760 [0,2,0,0,0,0|1,0,1]=4 25925 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1F)Cl 1458a_200011218047_100000716957 [0,2,0,0,0,0|1,0,1]=4 25926 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1F)F 1458a_200011218047_100000741279 [0,2,0,0,0,0|1,0,1]=4 25927 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1F)I 1458a_200011218047_200010149601 [0,2,0,0,0,0|1,0,1]=4 25928 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1I)Br 1458a_200011218047_100012362523 [0,2,0,0,0,0|1,0,1]=4 25929 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1I)Cl 1458a_200011218047_100012348826 [0,2,0,0,0,0|1,0,1]=4 25930 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1I)F 1458a_200011218047_100010149606 [0,2,0,0,0,0|1,0,1]=4 25931 B16R1.7379 CCCC#CC(=O)Cc1cc(ccc1O)F 1458a_200011218047_100010161318 [0,2,0,0,0,0|1,0,1]=4 25932 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Br)Br 1458a_100000212230_100011982794 [0,2,0,0,0,0|1,0,1]=4 25933 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000212230_100000733903 [0,2,0,0,0,0|1,0,1]=4 25934 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Br)F 1458a_100000212230_100000736370 [0,2,0,0,0,0|1,0,1]=4 25935 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Br)I 1458a_100000212230_100012355412 [0,2,0,0,0,0|1,0,1]=4 25936 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1C)C 1458a_100000212230_100000184699 [0,2,0,0,0,0|1,0,1]=4 25937 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1C)Cl 1458a_100000212230_100012186985 [0,2,0,0,0,0|1,0,1]=4 25938 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1C)F 1458a_100000212230_100000709795 [0,2,0,0,0,0|1,0,1]=4 25939 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000212230_100000763347 [0,2,0,0,0,0|1,0,1]=4 25940 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Cl)C 1458a_100000212230_100009871730 [0,2,0,0,0,0|1,0,1]=4 25941 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000212230_100000754809 [0,2,0,0,0,0|1,0,1]=4 25942 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Cl)F 1458a_100000212230_100000709952 [0,2,0,0,0,0|1,0,1]=4 25943 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1Cl)I 1458a_100000212230_100010188191 [0,2,0,0,0,0|1,0,1]=4 25944 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1F)Br 1458a_100000212230_100000736399 [0,2,0,0,0,0|1,0,1]=4 25945 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1F)C 1458a_100000212230_100011260760 [0,2,0,0,0,0|1,0,1]=4 25946 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1F)Cl 1458a_100000212230_100000716957 [0,2,0,0,0,0|1,0,1]=4 25947 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1F)F 1458a_100000212230_100000741279 [0,2,0,0,0,0|1,0,1]=4 25948 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1F)I 1458a_100000212230_200010149601 [0,2,0,0,0,0|1,0,1]=4 25949 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1I)Br 1458a_100000212230_100012362523 [0,2,0,0,0,0|1,0,1]=4 25950 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1I)Cl 1458a_100000212230_100012348826 [0,2,0,0,0,0|1,0,1]=4 25951 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1I)F 1458a_100000212230_100010149606 [0,2,0,0,0,0|1,0,1]=4 25952 B16R1.7379 CCCC=CC(=O)Cc1cc(ccc1O)F 1458a_100000212230_100010161318 [0,2,0,0,0,0|1,0,1]=4 25953 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000212188_100011982794 [0,2,0,0,0,0|1,0,0]=3 25954 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210326 [0,2,0,0,0,0|1,0,0]=3 25955 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210326 [0,2,0,0,0,0|1,0,0]=3 25956 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000212188_100000733903 [0,2,0,0,0,0|1,0,0]=3 25957 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210326 [0,2,0,0,0,0|1,0,0]=3 25958 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000212188_100000736370 [0,2,0,0,0,0|1,0,0]=3 25959 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210326 [0,2,0,0,0,0|1,0,0]=3 25960 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Br)I 1458a_100000212188_100012355412 [0,2,0,0,0,0|1,0,0]=3 25961 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210326 [0,2,0,0,0,0|1,0,0]=3 25962 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)C 1458a_100000212188_100000184699 [0,2,0,0,0,0|1,0,0]=3 25963 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210326 [0,2,0,0,0,0|1,0,0]=3 25964 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000212188_100012186985 [0,2,0,0,0,0|1,0,0]=3 25965 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)F 1458a_100000212188_100000709795 [0,2,0,0,0,0|1,0,0]=3 25966 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210326 [0,2,0,0,0,0|1,0,0]=3 25967 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000212188_100000763347 [0,2,0,0,0,0|1,0,0]=3 25968 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210326 [0,2,0,0,0,0|1,0,0]=3 25969 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000212188_100009871730 [0,2,0,0,0,0|1,0,0]=3 25970 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000212188_100000754809 [0,2,0,0,0,0|1,0,0]=3 25971 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210326 [0,2,0,0,0,0|1,0,0]=3 25972 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000212188_100000709952 [0,2,0,0,0,0|1,0,0]=3 25973 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210326 [0,2,0,0,0,0|1,0,0]=3 25974 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000212188_100010188191 [0,2,0,0,0,0|1,0,0]=3 25975 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000212188_100000736399 [0,2,0,0,0,0|1,0,0]=3 25976 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210326 [0,2,0,0,0,0|1,0,0]=3 25977 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)C 1458a_100000212188_100011260760 [0,2,0,0,0,0|1,0,0]=3 25978 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210326 [0,2,0,0,0,0|1,0,0]=3 25979 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000212188_100000716957 [0,2,0,0,0,0|1,0,0]=3 25980 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210326 [0,2,0,0,0,0|1,0,0]=3 25981 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)F 1458a_100000212188_100000741279 [0,2,0,0,0,0|1,0,0]=3 25982 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210326 [0,2,0,0,0,0|1,0,0]=3 25983 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1F)I 1458a_100000212188_200010149601 [0,2,0,0,0,0|1,0,0]=3 25984 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)Br 1458a_100000212188_100012362523 [0,2,0,0,0,0|1,0,0]=3 25985 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000212188_100012348826 [0,2,0,0,0,0|1,0,0]=3 25986 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1I)F 1458a_100000212188_100010149606 [0,2,0,0,0,0|1,0,0]=3 25987 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210326 [0,2,0,0,0,0|1,0,0]=3 25988 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)F 1458a_100000212188_100010161318 [0,2,0,0,0,0|1,0,0]=3 25989 B16R1.7379 CCCCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210326 [0,2,0,0,0,0|1,0,0]=3 25990 B16R1.7379 CCCCCC(=O)Cc1cc(cnc1Br)Br 1458a_100000212188_100010253922 [0,2,0,0,0,0|2,0,0]=4 25991 B16R1.7379 CCCCCC(=O)Cc1cc(cnc1Cl)Br 1458a_100000212188_100009816982 [0,2,0,0,0,0|2,0,0]=4 25992 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1Cl)C 1458a_100000212188_200009852033 [0,2,0,0,0,0|2,0,0]=4 25993 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1Cl)Cl 1458a_100000212188_100000059412 [0,2,0,0,0,0|2,0,0]=4 25994 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1F)Br 1458a_100000212188_100010065826 [0,2,0,0,0,0|2,0,0]=4 25995 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1F)Cl 1458a_100000212188_100009881012 [0,2,0,0,0,0|2,0,0]=4 25996 B16R1.7379 CCCCCC(=O)Cc1nc(ccc1O)C 1458a_100000212188_100020630696 [0,2,0,0,0,0|2,0,0]=4 25997 B16R1.7379 CCCCCC(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_100000210326 [0,2,0,0,0,0|2,0,0]=4 25998 B16R1.7379 CCCCCC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_100000210326 [0,2,0,0,0,0|2,0,0]=4 25999 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000212188 [0,2,0,0,0,0|2,0,0]=4 26000 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000212188 [0,2,0,0,0,0|2,0,0]=4 26001 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000212188 [0,2,0,0,0,0|2,0,0]=4 26002 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000212188 [0,2,0,0,0,0|2,0,0]=4 26003 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000212188 [0,2,0,0,0,0|2,0,0]=4 26004 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000212188 [0,2,0,0,0,0|2,0,0]=4 26005 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000212188 [0,2,0,0,0,0|2,0,0]=4 26006 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000212188 [0,2,0,0,0,0|2,0,0]=4 26007 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000212188 [0,2,0,0,0,0|2,0,0]=4 26008 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000212188 [0,2,0,0,0,0|2,0,0]=4 26009 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000212188 [0,2,0,0,0,0|2,0,0]=4 26010 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000212188 [0,2,0,0,0,0|2,0,0]=4 26011 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000212188 [0,2,0,0,0,0|2,0,0]=4 26012 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000212188 [0,2,0,0,0,0|2,0,0]=4 26013 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000212188 [0,2,0,0,0,0|2,0,0]=4 26014 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000212188 [0,2,0,0,0,0|2,0,0]=4 26015 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000212188 [0,2,0,0,0,0|2,0,0]=4 26016 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000212188 [0,2,0,0,0,0|2,0,0]=4 26017 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000212188 [0,2,0,0,0,0|2,0,0]=4 26018 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000212188 [0,2,0,0,0,0|2,0,0]=4 26019 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000212188 [0,2,0,0,0,0|2,0,0]=4 26020 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000212188 [0,2,0,0,0,0|2,0,0]=4 26021 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000212188 [0,2,0,0,0,0|2,0,0]=4 26022 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000212188 [0,2,0,0,0,0|2,0,0]=4 26023 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000212188 [0,2,0,0,0,0|2,0,0]=4 26024 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000212188 [0,2,0,0,0,0|2,0,0]=4 26025 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000212188 [0,2,0,0,0,0|2,0,0]=4 26026 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000212188 [0,2,0,0,0,0|2,0,0]=4 26027 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000212188 [0,2,0,0,0,0|2,0,0]=4 26028 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000212188 [0,2,0,0,0,0|2,0,0]=4 26029 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000212188 [0,2,0,0,0,0|2,0,0]=4 26030 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000212188 [0,2,0,0,0,0|2,0,0]=4 26031 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000212188 [0,2,0,0,0,0|2,0,0]=4 26032 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000212188 [0,2,0,0,0,0|2,0,0]=4 26033 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000212188 [0,2,0,0,0,0|2,0,0]=4 26034 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000212188 [0,2,0,0,0,0|2,0,0]=4 26035 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000212188 [0,2,0,0,0,0|2,0,0]=4 26036 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000212188 [0,2,0,0,0,0|2,0,0]=4 26037 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000212188 [0,2,0,0,0,0|2,0,0]=4 26038 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000212188 [0,2,0,0,0,0|2,0,0]=4 26039 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000212188 [0,2,0,0,0,0|2,0,0]=4 26040 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000212188 [0,2,0,0,0,0|2,0,0]=4 26041 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000212188 [0,2,0,0,0,0|2,0,0]=4 26042 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000212188 [0,2,0,0,0,0|2,0,0]=4 26043 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000212188 [0,2,0,0,0,0|2,0,0]=4 26044 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000212188 [0,2,0,0,0,0|2,0,0]=4 26045 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000212188 [0,2,0,0,0,0|2,0,0]=4 26046 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000212188 [0,2,0,0,0,0|2,0,0]=4 26047 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000212188 [0,2,0,0,0,0|2,0,0]=4 26048 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000212188 [0,2,0,0,0,0|2,0,0]=4 26049 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000212188 [0,2,0,0,0,0|2,0,0]=4 26050 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000212188 [0,2,0,0,0,0|2,0,0]=4 26051 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000212188 [0,2,0,0,0,0|2,0,0]=4 26052 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000212188 [0,2,0,0,0,0|2,0,0]=4 26053 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000212188 [0,2,0,0,0,0|2,0,0]=4 26054 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000212188 [0,2,0,0,0,0|2,0,0]=4 26055 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000212188 [0,2,0,0,0,0|2,0,0]=4 26056 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000212188 [0,2,0,0,0,0|2,0,0]=4 26057 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000212188 [0,2,0,0,0,0|2,0,0]=4 26058 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000212188 [0,2,0,0,0,0|2,0,0]=4 26059 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000212188 [0,2,0,0,0,0|2,0,0]=4 26060 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26061 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26062 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000212188 [0,2,0,0,0,0|2,0,0]=4 26063 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000212188 [0,2,0,0,0,0|2,0,0]=4 26064 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000212188 [0,2,0,0,0,0|2,0,0]=4 26065 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000212188 [0,2,0,0,0,0|2,0,0]=4 26066 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000212188 [0,2,0,0,0,0|2,0,0]=4 26067 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000212188 [0,2,0,0,0,0|2,0,0]=4 26068 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000212188 [0,2,0,0,0,0|2,0,0]=4 26069 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000212188 [0,2,0,0,0,0|2,0,0]=4 26070 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000212188 [0,2,0,0,0,0|2,0,0]=4 26071 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000212188 [0,2,0,0,0,0|2,0,0]=4 26072 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000212188 [0,2,0,0,0,0|2,0,0]=4 26073 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000212188 [0,2,0,0,0,0|2,0,0]=4 26074 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000212188 [0,2,0,0,0,0|2,0,0]=4 26075 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000212188 [0,2,0,0,0,0|2,0,0]=4 26076 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000212188 [0,2,0,0,0,0|2,0,0]=4 26077 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000212188 [0,2,0,0,0,0|2,0,0]=4 26078 B16R1.7379 CCCCCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000212188 [0,2,0,0,0,0|2,0,0]=4 26079 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 11a_100000102301_100010004897 [0,2,0,0,0,0|1,0,0]=3 26080 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 240690a_100000102301_100010004897 [0,2,0,0,0,0|1,0,0]=3 26081 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Br 527a_100000102301_100010004897 [0,2,0,0,0,0|1,0,0]=3 26082 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 11a_100000102301_100010004923 [0,2,0,0,0,0|1,0,0]=3 26083 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 1626a_100000102301_100010004923 [0,2,0,0,0,0|1,0,0]=3 26084 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 240690a_100000102301_100010004923 [0,2,0,0,0,0|1,0,0]=3 26085 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)C 527a_100000102301_100010004923 [0,2,0,0,0,0|1,0,0]=3 26086 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 11a_100000102301_100000690875 [0,2,0,0,0,0|1,0,0]=3 26087 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 1626a_100000102301_100000690875 [0,2,0,0,0,0|1,0,0]=3 26088 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 240690a_100000102301_100000690875 [0,2,0,0,0,0|1,0,0]=3 26089 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)Cl 527a_100000102301_100000690875 [0,2,0,0,0,0|1,0,0]=3 26090 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 11a_100000102301_100000690878 [0,2,0,0,0,0|1,0,0]=3 26091 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 1626a_100000102301_100000690878 [0,2,0,0,0,0|1,0,0]=3 26092 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 240690a_100000102301_100000690878 [0,2,0,0,0,0|1,0,0]=3 26093 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Br)F 527a_100000102301_100000690878 [0,2,0,0,0,0|1,0,0]=3 26094 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 11a_100000102301_100010244045 [0,2,0,0,0,0|1,0,0]=3 26095 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 1626a_100000102301_100010244045 [0,2,0,0,0,0|1,0,0]=3 26096 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 240690a_100000102301_100010244045 [0,2,0,0,0,0|1,0,0]=3 26097 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)Br 527a_100000102301_100010244045 [0,2,0,0,0,0|1,0,0]=3 26098 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 11a_100000102301_100000749331 [0,2,0,0,0,0|1,0,0]=3 26099 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 1626a_100000102301_100000749331 [0,2,0,0,0,0|1,0,0]=3 26100 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 240690a_100000102301_100000749331 [0,2,0,0,0,0|1,0,0]=3 26101 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)C 527a_100000102301_100000749331 [0,2,0,0,0,0|1,0,0]=3 26102 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 11a_100000102301_100011219217 [0,2,0,0,0,0|1,0,0]=3 26103 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 1626a_100000102301_100011219217 [0,2,0,0,0,0|1,0,0]=3 26104 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 240690a_100000102301_100011219217 [0,2,0,0,0,0|1,0,0]=3 26105 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1C)F 527a_100000102301_100011219217 [0,2,0,0,0,0|1,0,0]=3 26106 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 11a_100000102301_100011600618 [0,2,0,0,0,0|1,0,0]=3 26107 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 1626a_100000102301_100011600618 [0,2,0,0,0,0|1,0,0]=3 26108 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 240690a_100000102301_100011600618 [0,2,0,0,0,0|1,0,0]=3 26109 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Br 527a_100000102301_100011600618 [0,2,0,0,0,0|1,0,0]=3 26110 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 11a_100000102301_100000748246 [0,2,0,0,0,0|1,0,0]=3 26111 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100000102301_100000748246 [0,2,0,0,0,0|1,0,0]=3 26112 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100000102301_100000748246 [0,2,0,0,0,0|1,0,0]=3 26113 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)Cl 527a_100000102301_100000748246 [0,2,0,0,0,0|1,0,0]=3 26114 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 11a_100000102301_100011830335 [0,2,0,0,0,0|1,0,0]=3 26115 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 1626a_100000102301_100011830335 [0,2,0,0,0,0|1,0,0]=3 26116 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 240690a_100000102301_100011830335 [0,2,0,0,0,0|1,0,0]=3 26117 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1Cl)F 527a_100000102301_100011830335 [0,2,0,0,0,0|1,0,0]=3 26118 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 11a_100000102301_100000690877 [0,2,0,0,0,0|1,0,0]=3 26119 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 1626a_100000102301_100000690877 [0,2,0,0,0,0|1,0,0]=3 26120 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 240690a_100000102301_100000690877 [0,2,0,0,0,0|1,0,0]=3 26121 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Br 527a_100000102301_100000690877 [0,2,0,0,0,0|1,0,0]=3 26122 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 11a_100000102301_100011667363 [0,2,0,0,0,0|1,0,0]=3 26123 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 1626a_100000102301_100011667363 [0,2,0,0,0,0|1,0,0]=3 26124 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 240690a_100000102301_100011667363 [0,2,0,0,0,0|1,0,0]=3 26125 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)C 527a_100000102301_100011667363 [0,2,0,0,0,0|1,0,0]=3 26126 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 11a_100000102301_100011217548 [0,2,0,0,0,0|1,0,0]=3 26127 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 1626a_100000102301_100011217548 [0,2,0,0,0,0|1,0,0]=3 26128 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 240690a_100000102301_100011217548 [0,2,0,0,0,0|1,0,0]=3 26129 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)Cl 527a_100000102301_100011217548 [0,2,0,0,0,0|1,0,0]=3 26130 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 11a_100000102301_100000762760 [0,2,0,0,0,0|1,0,0]=3 26131 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 1626a_100000102301_100000762760 [0,2,0,0,0,0|1,0,0]=3 26132 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 240690a_100000102301_100000762760 [0,2,0,0,0,0|1,0,0]=3 26133 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1F)F 527a_100000102301_100000762760 [0,2,0,0,0,0|1,0,0]=3 26134 B16R1.7379 CCCCNC(=O)Cc1cc(ccc1O)Br 240690a_100000102301_100010072483 [0,2,0,0,0,0|1,0,0]=3 26135 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)Br 11a_100000102301_200000738489 [0,2,0,0,0,0|2,0,0]=4 26136 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)Br 1626a_100000102301_200000738489 [0,2,0,0,0,0|2,0,0]=4 26137 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)Br 240690a_100000102301_200000738489 [0,2,0,0,0,0|2,0,0]=4 26138 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)Br 527a_100000102301_200000738489 [0,2,0,0,0,0|2,0,0]=4 26139 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)C 11a_100000102301_100009850670 [0,2,0,0,0,0|2,0,0]=4 26140 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)C 1626a_100000102301_100009850670 [0,2,0,0,0,0|2,0,0]=4 26141 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)C 240690a_100000102301_100009850670 [0,2,0,0,0,0|2,0,0]=4 26142 B16R1.7379 CCCCNC(=O)Cn1cc(ccc1=O)C 527a_100000102301_100009850670 [0,2,0,0,0,0|2,0,0]=4 26143 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100000102301 [0,2,0,0,0,0|2,0,0]=4 26144 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100000102301 [0,2,0,0,0,0|2,0,0]=4 26145 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100000102301 [0,2,0,0,0,0|2,0,0]=4 26146 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100000102301 [0,2,0,0,0,0|2,0,0]=4 26147 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100000102301 [0,2,0,0,0,0|2,0,0]=4 26148 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100000102301 [0,2,0,0,0,0|2,0,0]=4 26149 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100000102301 [0,2,0,0,0,0|2,0,0]=4 26150 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100000102301 [0,2,0,0,0,0|2,0,0]=4 26151 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100000102301 [0,2,0,0,0,0|2,0,0]=4 26152 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100000102301 [0,2,0,0,0,0|2,0,0]=4 26153 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100000102301 [0,2,0,0,0,0|2,0,0]=4 26154 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100000102301 [0,2,0,0,0,0|2,0,0]=4 26155 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100000102301 [0,2,0,0,0,0|2,0,0]=4 26156 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100000102301 [0,2,0,0,0,0|2,0,0]=4 26157 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100000102301 [0,2,0,0,0,0|2,0,0]=4 26158 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100000102301 [0,2,0,0,0,0|2,0,0]=4 26159 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100000102301 [0,2,0,0,0,0|2,0,0]=4 26160 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100000102301 [0,2,0,0,0,0|2,0,0]=4 26161 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100000102301 [0,2,0,0,0,0|2,0,0]=4 26162 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100000102301 [0,2,0,0,0,0|2,0,0]=4 26163 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100000102301 [0,2,0,0,0,0|2,0,0]=4 26164 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100000102301 [0,2,0,0,0,0|2,0,0]=4 26165 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100000102301 [0,2,0,0,0,0|2,0,0]=4 26166 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100000102301 [0,2,0,0,0,0|2,0,0]=4 26167 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100000102301 [0,2,0,0,0,0|2,0,0]=4 26168 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100000102301 [0,2,0,0,0,0|2,0,0]=4 26169 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100000102301 [0,2,0,0,0,0|2,0,0]=4 26170 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100000102301 [0,2,0,0,0,0|2,0,0]=4 26171 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100000102301 [0,2,0,0,0,0|2,0,0]=4 26172 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100000102301 [0,2,0,0,0,0|2,0,0]=4 26173 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100000102301 [0,2,0,0,0,0|2,0,0]=4 26174 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100000102301 [0,2,0,0,0,0|2,0,0]=4 26175 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100000102301 [0,2,0,0,0,0|2,0,0]=4 26176 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100000102301 [0,2,0,0,0,0|2,0,0]=4 26177 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100000102301 [0,2,0,0,0,0|2,0,0]=4 26178 B16R1.7379 CCCCNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100000102301 [0,2,0,0,0,0|2,0,0]=4 26179 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Br)Br 22a_100000740057_100010004897 [0,2,0,0,0,0|2,0,0]=4 26180 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Br)C 22a_100000740057_100010004923 [0,2,0,0,0,0|2,0,0]=4 26181 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Br)Cl 22a_100000740057_100000690875 [0,2,0,0,0,0|2,0,0]=4 26182 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Br)F 22a_100000740057_100000690878 [0,2,0,0,0,0|2,0,0]=4 26183 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1C)Br 22a_100000740057_100010244045 [0,2,0,0,0,0|2,0,0]=4 26184 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1C)C 22a_100000740057_100000749331 [0,2,0,0,0,0|2,0,0]=4 26185 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1C)F 22a_100000740057_100011219217 [0,2,0,0,0,0|2,0,0]=4 26186 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Cl)Br 22a_100000740057_100011600618 [0,2,0,0,0,0|2,0,0]=4 26187 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Cl)Cl 22a_100000740057_100000748246 [0,2,0,0,0,0|2,0,0]=4 26188 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1Cl)F 22a_100000740057_100011830335 [0,2,0,0,0,0|2,0,0]=4 26189 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1F)Br 22a_100000740057_100000690877 [0,2,0,0,0,0|2,0,0]=4 26190 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1F)C 22a_100000740057_100011667363 [0,2,0,0,0,0|2,0,0]=4 26191 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1F)Cl 22a_100000740057_100011217548 [0,2,0,0,0,0|2,0,0]=4 26192 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1F)F 22a_100000740057_100000762760 [0,2,0,0,0,0|2,0,0]=4 26193 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1O)Br 22a_100000740057_100010072483 [0,2,0,0,0,0|2,0,0]=4 26194 B16R1.7379 CCCNNC(=O)Cc1cc(ccc1O)O 22a_100000740057_100000038496 [0,2,0,0,0,0|2,0,0]=4 26195 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Br)Br 1458a_100000745993_100011982794 [0,2,0,0,0,0|2,0,0]=4 26196 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000745993_100000733903 [0,2,0,0,0,0|2,0,0]=4 26197 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Br)F 1458a_100000745993_100000736370 [0,2,0,0,0,0|2,0,0]=4 26198 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Br)I 1458a_100000745993_100012355412 [0,2,0,0,0,0|2,0,0]=4 26199 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1C)C 1458a_100000745993_100000184699 [0,2,0,0,0,0|2,0,0]=4 26200 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1C)Cl 1458a_100000745993_100012186985 [0,2,0,0,0,0|2,0,0]=4 26201 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1C)F 1458a_100000745993_100000709795 [0,2,0,0,0,0|2,0,0]=4 26202 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000745993_100000763347 [0,2,0,0,0,0|2,0,0]=4 26203 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Cl)C 1458a_100000745993_100009871730 [0,2,0,0,0,0|2,0,0]=4 26204 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000745993_100000754809 [0,2,0,0,0,0|2,0,0]=4 26205 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Cl)F 1458a_100000745993_100000709952 [0,2,0,0,0,0|2,0,0]=4 26206 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1Cl)I 1458a_100000745993_100010188191 [0,2,0,0,0,0|2,0,0]=4 26207 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1F)Br 1458a_100000745993_100000736399 [0,2,0,0,0,0|2,0,0]=4 26208 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1F)C 1458a_100000745993_100011260760 [0,2,0,0,0,0|2,0,0]=4 26209 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1F)Cl 1458a_100000745993_100000716957 [0,2,0,0,0,0|2,0,0]=4 26210 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1F)F 1458a_100000745993_100000741279 [0,2,0,0,0,0|2,0,0]=4 26211 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1F)I 1458a_100000745993_200010149601 [0,2,0,0,0,0|2,0,0]=4 26212 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1I)Br 1458a_100000745993_100012362523 [0,2,0,0,0,0|2,0,0]=4 26213 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1I)Cl 1458a_100000745993_100012348826 [0,2,0,0,0,0|2,0,0]=4 26214 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1I)F 1458a_100000745993_100010149606 [0,2,0,0,0,0|2,0,0]=4 26215 B16R1.7379 CCCOCC(=O)Cc1cc(ccc1O)F 1458a_100000745993_100010161318 [0,2,0,0,0,0|2,0,0]=4 26216 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Br)Br 1458a_100000217233_100011982794 [0,2,0,0,0,0|2,0,0]=4 26217 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000217233_100000733903 [0,2,0,0,0,0|2,0,0]=4 26218 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Br)F 1458a_100000217233_100000736370 [0,2,0,0,0,0|2,0,0]=4 26219 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Br)I 1458a_100000217233_100012355412 [0,2,0,0,0,0|2,0,0]=4 26220 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1C)C 1458a_100000217233_100000184699 [0,2,0,0,0,0|2,0,0]=4 26221 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1C)Cl 1458a_100000217233_100012186985 [0,2,0,0,0,0|2,0,0]=4 26222 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1C)F 1458a_100000217233_100000709795 [0,2,0,0,0,0|2,0,0]=4 26223 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000217233_100000763347 [0,2,0,0,0,0|2,0,0]=4 26224 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Cl)C 1458a_100000217233_100009871730 [0,2,0,0,0,0|2,0,0]=4 26225 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000217233_100000754809 [0,2,0,0,0,0|2,0,0]=4 26226 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Cl)F 1458a_100000217233_100000709952 [0,2,0,0,0,0|2,0,0]=4 26227 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1Cl)I 1458a_100000217233_100010188191 [0,2,0,0,0,0|2,0,0]=4 26228 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1F)Br 1458a_100000217233_100000736399 [0,2,0,0,0,0|2,0,0]=4 26229 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1F)C 1458a_100000217233_100011260760 [0,2,0,0,0,0|2,0,0]=4 26230 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1F)Cl 1458a_100000217233_100000716957 [0,2,0,0,0,0|2,0,0]=4 26231 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1F)F 1458a_100000217233_100000741279 [0,2,0,0,0,0|2,0,0]=4 26232 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1F)I 1458a_100000217233_200010149601 [0,2,0,0,0,0|2,0,0]=4 26233 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1I)Br 1458a_100000217233_100012362523 [0,2,0,0,0,0|2,0,0]=4 26234 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1I)Cl 1458a_100000217233_100012348826 [0,2,0,0,0,0|2,0,0]=4 26235 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1I)F 1458a_100000217233_100010149606 [0,2,0,0,0,0|2,0,0]=4 26236 B16R1.7379 CCCSCC(=O)Cc1cc(ccc1O)F 1458a_100000217233_100010161318 [0,2,0,0,0,0|2,0,0]=4 26237 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000749530_100011982794 [0,2,0,0,0,0|2,0,0]=4 26238 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100011215890 [0,2,0,0,0,0|2,0,0]=4 26239 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100011215890 [0,2,0,0,0,0|2,0,0]=4 26240 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100011215890 [0,2,0,0,0,0|2,0,0]=4 26241 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000749530_100000733903 [0,2,0,0,0,0|2,0,0]=4 26242 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100011215890 [0,2,0,0,0,0|2,0,0]=4 26243 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)F 1458a_100000749530_100000736370 [0,2,0,0,0,0|2,0,0]=4 26244 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Br)I 1458a_100000749530_100012355412 [0,2,0,0,0,0|2,0,0]=4 26245 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100011215890 [0,2,0,0,0,0|2,0,0]=4 26246 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100011215890 [0,2,0,0,0,0|2,0,0]=4 26247 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)C 1458a_100000749530_100000184699 [0,2,0,0,0,0|2,0,0]=4 26248 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000749530_100012186985 [0,2,0,0,0,0|2,0,0]=4 26249 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)F 1458a_100000749530_100000709795 [0,2,0,0,0,0|2,0,0]=4 26250 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100011215890 [0,2,0,0,0,0|2,0,0]=4 26251 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000749530_100000763347 [0,2,0,0,0,0|2,0,0]=4 26252 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100011215890 [0,2,0,0,0,0|2,0,0]=4 26253 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000749530_100009871730 [0,2,0,0,0,0|2,0,0]=4 26254 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100011215890 [0,2,0,0,0,0|2,0,0]=4 26255 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000749530_100000754809 [0,2,0,0,0,0|2,0,0]=4 26256 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000749530_100000709952 [0,2,0,0,0,0|2,0,0]=4 26257 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100011215890 [0,2,0,0,0,0|2,0,0]=4 26258 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000749530_100010188191 [0,2,0,0,0,0|2,0,0]=4 26259 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100011215890 [0,2,0,0,0,0|2,0,0]=4 26260 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)Br 1458a_100000749530_100000736399 [0,2,0,0,0,0|2,0,0]=4 26261 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)C 1458a_100000749530_100011260760 [0,2,0,0,0,0|2,0,0]=4 26262 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100011215890 [0,2,0,0,0,0|2,0,0]=4 26263 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000749530_100000716957 [0,2,0,0,0,0|2,0,0]=4 26264 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100011215890 [0,2,0,0,0,0|2,0,0]=4 26265 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)F 1458a_100000749530_100000741279 [0,2,0,0,0,0|2,0,0]=4 26266 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100011215890 [0,2,0,0,0,0|2,0,0]=4 26267 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1F)I 1458a_100000749530_200010149601 [0,2,0,0,0,0|2,0,0]=4 26268 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1I)Br 1458a_100000749530_100012362523 [0,2,0,0,0,0|2,0,0]=4 26269 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000749530_100012348826 [0,2,0,0,0,0|2,0,0]=4 26270 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1I)F 1458a_100000749530_100010149606 [0,2,0,0,0,0|2,0,0]=4 26271 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100011215890 [0,2,0,0,0,0|2,0,0]=4 26272 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)F 1458a_100000749530_100010161318 [0,2,0,0,0,0|2,0,0]=4 26273 B16R1.7379 CCOCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100011215890 [0,2,0,0,0,0|2,0,0]=4 26274 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000230768_100011982794 [0,2,0,0,0,0|2,0,0]=4 26275 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000757381 [0,2,0,0,0,0|2,0,0]=4 26276 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000757381 [0,2,0,0,0,0|2,0,0]=4 26277 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000230768_100000733903 [0,2,0,0,0,0|2,0,0]=4 26278 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000757381 [0,2,0,0,0,0|2,0,0]=4 26279 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)F 1458a_100000230768_100000736370 [0,2,0,0,0,0|2,0,0]=4 26280 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000757381 [0,2,0,0,0,0|2,0,0]=4 26281 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Br)I 1458a_100000230768_100012355412 [0,2,0,0,0,0|2,0,0]=4 26282 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000757381 [0,2,0,0,0,0|2,0,0]=4 26283 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)C 1458a_100000230768_100000184699 [0,2,0,0,0,0|2,0,0]=4 26284 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000757381 [0,2,0,0,0,0|2,0,0]=4 26285 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000230768_100012186985 [0,2,0,0,0,0|2,0,0]=4 26286 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)F 1458a_100000230768_100000709795 [0,2,0,0,0,0|2,0,0]=4 26287 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000757381 [0,2,0,0,0,0|2,0,0]=4 26288 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000230768_100000763347 [0,2,0,0,0,0|2,0,0]=4 26289 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000757381 [0,2,0,0,0,0|2,0,0]=4 26290 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000230768_100009871730 [0,2,0,0,0,0|2,0,0]=4 26291 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000230768_100000754809 [0,2,0,0,0,0|2,0,0]=4 26292 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000757381 [0,2,0,0,0,0|2,0,0]=4 26293 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000230768_100000709952 [0,2,0,0,0,0|2,0,0]=4 26294 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000757381 [0,2,0,0,0,0|2,0,0]=4 26295 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000230768_100010188191 [0,2,0,0,0,0|2,0,0]=4 26296 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)Br 1458a_100000230768_100000736399 [0,2,0,0,0,0|2,0,0]=4 26297 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000757381 [0,2,0,0,0,0|2,0,0]=4 26298 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)C 1458a_100000230768_100011260760 [0,2,0,0,0,0|2,0,0]=4 26299 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000757381 [0,2,0,0,0,0|2,0,0]=4 26300 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000230768_100000716957 [0,2,0,0,0,0|2,0,0]=4 26301 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000757381 [0,2,0,0,0,0|2,0,0]=4 26302 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)F 1458a_100000230768_100000741279 [0,2,0,0,0,0|2,0,0]=4 26303 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000757381 [0,2,0,0,0,0|2,0,0]=4 26304 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1F)I 1458a_100000230768_200010149601 [0,2,0,0,0,0|2,0,0]=4 26305 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1I)Br 1458a_100000230768_100012362523 [0,2,0,0,0,0|2,0,0]=4 26306 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000230768_100012348826 [0,2,0,0,0,0|2,0,0]=4 26307 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1I)F 1458a_100000230768_100010149606 [0,2,0,0,0,0|2,0,0]=4 26308 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000757381 [0,2,0,0,0,0|2,0,0]=4 26309 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)F 1458a_100000230768_100010161318 [0,2,0,0,0,0|2,0,0]=4 26310 B16R1.7379 CCSCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000757381 [0,2,0,0,0,0|2,0,0]=4 26311 B16R1.7379 CNCCOC(=O)Nc1cc(ccc1Cl)Cl 34a_100102657272_200000190521 [0,2,0,0,0,0|2,0,0]=4 26312 B16R1.7379 CNCCOC(=O)Nc1cc(ccc1Cl)Cl 7a_106832991635_200000190521 [0,2,0,0,0,0|2,0,0]=4 26313 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000741012_100011982794 [0,2,0,0,0,0|2,0,0]=4 26314 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000740836 [0,2,0,0,0,0|2,0,0]=4 26315 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000740836 [0,2,0,0,0,0|2,0,0]=4 26316 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000740836 [0,2,0,0,0,0|2,0,0]=4 26317 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000741012_100000733903 [0,2,0,0,0,0|2,0,0]=4 26318 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000740836 [0,2,0,0,0,0|2,0,0]=4 26319 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000741012_100000736370 [0,2,0,0,0,0|2,0,0]=4 26320 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Br)I 1458a_100000741012_100012355412 [0,2,0,0,0,0|2,0,0]=4 26321 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000740836 [0,2,0,0,0,0|2,0,0]=4 26322 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)C 1458a_100000741012_100000184699 [0,2,0,0,0,0|2,0,0]=4 26323 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000740836 [0,2,0,0,0,0|2,0,0]=4 26324 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000741012_100012186985 [0,2,0,0,0,0|2,0,0]=4 26325 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)F 1458a_100000741012_100000709795 [0,2,0,0,0,0|2,0,0]=4 26326 B16R1.7379 COCCCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000740836 [0,2,0,0,0,0|2,0,0]=4 26327 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000741012_100000763347 [0,2,0,0,0,0|2,0,0]=4 26328 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000740836 [0,2,0,0,0,0|2,0,0]=4 26329 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000741012_100009871730 [0,2,0,0,0,0|2,0,0]=4 26330 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000741012_100000754809 [0,2,0,0,0,0|2,0,0]=4 26331 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000740836 [0,2,0,0,0,0|2,0,0]=4 26332 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000741012_100000709952 [0,2,0,0,0,0|2,0,0]=4 26333 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000740836 [0,2,0,0,0,0|2,0,0]=4 26334 B16R1.7379 COCCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000741012_100010188191 [0,2,0,0,0,0|2,0,0]=4 26335 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000740836 [0,2,0,0,0,0|2,0,0]=4 26336 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000741012_100000736399 [0,2,0,0,0,0|2,0,0]=4 26337 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)C 1458a_100000741012_100011260760 [0,2,0,0,0,0|2,0,0]=4 26338 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000740836 [0,2,0,0,0,0|2,0,0]=4 26339 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000741012_100000716957 [0,2,0,0,0,0|2,0,0]=4 26340 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000740836 [0,2,0,0,0,0|2,0,0]=4 26341 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)F 1458a_100000741012_100000741279 [0,2,0,0,0,0|2,0,0]=4 26342 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000740836 [0,2,0,0,0,0|2,0,0]=4 26343 B16R1.7379 COCCCC(=O)Cc1cc(ccc1F)I 1458a_100000741012_200010149601 [0,2,0,0,0,0|2,0,0]=4 26344 B16R1.7379 COCCCC(=O)Cc1cc(ccc1I)Br 1458a_100000741012_100012362523 [0,2,0,0,0,0|2,0,0]=4 26345 B16R1.7379 COCCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000741012_100012348826 [0,2,0,0,0,0|2,0,0]=4 26346 B16R1.7379 COCCCC(=O)Cc1cc(ccc1I)F 1458a_100000741012_100010149606 [0,2,0,0,0,0|2,0,0]=4 26347 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000740836 [0,2,0,0,0,0|2,0,0]=4 26348 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)F 1458a_100000741012_100010161318 [0,2,0,0,0,0|2,0,0]=4 26349 B16R1.7379 COCCCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000740836 [0,2,0,0,0,0|2,0,0]=4 26350 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)Br 240690a_100000209980_100010004897 [0,2,0,0,0,0|2,0,0]=4 26351 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)Br 527a_100000209980_100010004897 [0,2,0,0,0,0|2,0,0]=4 26352 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)C 1626a_100000209980_100010004923 [0,2,0,0,0,0|2,0,0]=4 26353 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)C 240690a_100000209980_100010004923 [0,2,0,0,0,0|2,0,0]=4 26354 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)C 527a_100000209980_100010004923 [0,2,0,0,0,0|2,0,0]=4 26355 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)Cl 1626a_100000209980_100000690875 [0,2,0,0,0,0|2,0,0]=4 26356 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)Cl 240690a_100000209980_100000690875 [0,2,0,0,0,0|2,0,0]=4 26357 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)Cl 527a_100000209980_100000690875 [0,2,0,0,0,0|2,0,0]=4 26358 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)F 1626a_100000209980_100000690878 [0,2,0,0,0,0|2,0,0]=4 26359 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)F 240690a_100000209980_100000690878 [0,2,0,0,0,0|2,0,0]=4 26360 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Br)F 527a_100000209980_100000690878 [0,2,0,0,0,0|2,0,0]=4 26361 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)Br 1626a_100000209980_100010244045 [0,2,0,0,0,0|2,0,0]=4 26362 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)Br 240690a_100000209980_100010244045 [0,2,0,0,0,0|2,0,0]=4 26363 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)Br 527a_100000209980_100010244045 [0,2,0,0,0,0|2,0,0]=4 26364 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)C 1626a_100000209980_100000749331 [0,2,0,0,0,0|2,0,0]=4 26365 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)C 240690a_100000209980_100000749331 [0,2,0,0,0,0|2,0,0]=4 26366 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)C 527a_100000209980_100000749331 [0,2,0,0,0,0|2,0,0]=4 26367 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)F 1626a_100000209980_100011219217 [0,2,0,0,0,0|2,0,0]=4 26368 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)F 240690a_100000209980_100011219217 [0,2,0,0,0,0|2,0,0]=4 26369 B16R1.7379 COCCNC(=O)Cc1cc(ccc1C)F 527a_100000209980_100011219217 [0,2,0,0,0,0|2,0,0]=4 26370 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Br 1626a_100000209980_100011600618 [0,2,0,0,0,0|2,0,0]=4 26371 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Br 240690a_100000209980_100011600618 [0,2,0,0,0,0|2,0,0]=4 26372 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Br 527a_100000209980_100011600618 [0,2,0,0,0,0|2,0,0]=4 26373 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100000209980_100000748246 [0,2,0,0,0,0|2,0,0]=4 26374 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100000209980_100000748246 [0,2,0,0,0,0|2,0,0]=4 26375 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)Cl 527a_100000209980_100000748246 [0,2,0,0,0,0|2,0,0]=4 26376 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)F 1626a_100000209980_100011830335 [0,2,0,0,0,0|2,0,0]=4 26377 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)F 240690a_100000209980_100011830335 [0,2,0,0,0,0|2,0,0]=4 26378 B16R1.7379 COCCNC(=O)Cc1cc(ccc1Cl)F 527a_100000209980_100011830335 [0,2,0,0,0,0|2,0,0]=4 26379 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Br 1626a_100000209980_100000690877 [0,2,0,0,0,0|2,0,0]=4 26380 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Br 240690a_100000209980_100000690877 [0,2,0,0,0,0|2,0,0]=4 26381 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Br 527a_100000209980_100000690877 [0,2,0,0,0,0|2,0,0]=4 26382 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)C 1626a_100000209980_100011667363 [0,2,0,0,0,0|2,0,0]=4 26383 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)C 240690a_100000209980_100011667363 [0,2,0,0,0,0|2,0,0]=4 26384 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)C 527a_100000209980_100011667363 [0,2,0,0,0,0|2,0,0]=4 26385 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Cl 1626a_100000209980_100011217548 [0,2,0,0,0,0|2,0,0]=4 26386 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Cl 240690a_100000209980_100011217548 [0,2,0,0,0,0|2,0,0]=4 26387 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)Cl 527a_100000209980_100011217548 [0,2,0,0,0,0|2,0,0]=4 26388 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)F 1626a_100000209980_100000762760 [0,2,0,0,0,0|2,0,0]=4 26389 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)F 240690a_100000209980_100000762760 [0,2,0,0,0,0|2,0,0]=4 26390 B16R1.7379 COCCNC(=O)Cc1cc(ccc1F)F 527a_100000209980_100000762760 [0,2,0,0,0,0|2,0,0]=4 26391 B16R1.7379 COCCNC(=O)Cc1cc(ccc1O)Br 240690a_100000209980_100010072483 [0,2,0,0,0,0|2,0,0]=4 26392 B16R1.7379 COCCOC(=O)Nc1cc(ccc1Cl)Cl 34a_100138415774_200000190521 [0,2,0,0,0,0|2,0,0]=4 26393 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Br)Br 1458a_100000173376_100011982794 [0,2,0,0,0,0|2,0,0]=4 26394 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000173376_100000733903 [0,2,0,0,0,0|2,0,0]=4 26395 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Br)F 1458a_100000173376_100000736370 [0,2,0,0,0,0|2,0,0]=4 26396 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Br)I 1458a_100000173376_100012355412 [0,2,0,0,0,0|2,0,0]=4 26397 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1C)C 1458a_100000173376_100000184699 [0,2,0,0,0,0|2,0,0]=4 26398 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1C)Cl 1458a_100000173376_100012186985 [0,2,0,0,0,0|2,0,0]=4 26399 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1C)F 1458a_100000173376_100000709795 [0,2,0,0,0,0|2,0,0]=4 26400 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000173376_100000763347 [0,2,0,0,0,0|2,0,0]=4 26401 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Cl)C 1458a_100000173376_100009871730 [0,2,0,0,0,0|2,0,0]=4 26402 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000173376_100000754809 [0,2,0,0,0,0|2,0,0]=4 26403 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Cl)F 1458a_100000173376_100000709952 [0,2,0,0,0,0|2,0,0]=4 26404 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1Cl)I 1458a_100000173376_100010188191 [0,2,0,0,0,0|2,0,0]=4 26405 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1F)Br 1458a_100000173376_100000736399 [0,2,0,0,0,0|2,0,0]=4 26406 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1F)C 1458a_100000173376_100011260760 [0,2,0,0,0,0|2,0,0]=4 26407 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1F)Cl 1458a_100000173376_100000716957 [0,2,0,0,0,0|2,0,0]=4 26408 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1F)F 1458a_100000173376_100000741279 [0,2,0,0,0,0|2,0,0]=4 26409 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1F)I 1458a_100000173376_200010149601 [0,2,0,0,0,0|2,0,0]=4 26410 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1I)Br 1458a_100000173376_100012362523 [0,2,0,0,0,0|2,0,0]=4 26411 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1I)Cl 1458a_100000173376_100012348826 [0,2,0,0,0,0|2,0,0]=4 26412 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1I)F 1458a_100000173376_100010149606 [0,2,0,0,0,0|2,0,0]=4 26413 B16R1.7379 CSCCCC(=O)Cc1cc(ccc1O)F 1458a_100000173376_100010161318 [0,2,0,0,0,0|2,0,0]=4 26414 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Br 11a_100020590264_100010004897 [0,2,0,0,0,0|2,0,0]=4 26415 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Br 240690a_100020590264_100010004897 [0,2,0,0,0,0|2,0,0]=4 26416 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Br 527a_100020590264_100010004897 [0,2,0,0,0,0|2,0,0]=4 26417 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)C 11a_100020590264_100010004923 [0,2,0,0,0,0|2,0,0]=4 26418 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)C 1626a_100020590264_100010004923 [0,2,0,0,0,0|2,0,0]=4 26419 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)C 240690a_100020590264_100010004923 [0,2,0,0,0,0|2,0,0]=4 26420 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)C 527a_100020590264_100010004923 [0,2,0,0,0,0|2,0,0]=4 26421 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl 11a_100020590264_100000690875 [0,2,0,0,0,0|2,0,0]=4 26422 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl 1626a_100020590264_100000690875 [0,2,0,0,0,0|2,0,0]=4 26423 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl 240690a_100020590264_100000690875 [0,2,0,0,0,0|2,0,0]=4 26424 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)Cl 527a_100020590264_100000690875 [0,2,0,0,0,0|2,0,0]=4 26425 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F 11a_100020590264_100000690878 [0,2,0,0,0,0|2,0,0]=4 26426 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F 1626a_100020590264_100000690878 [0,2,0,0,0,0|2,0,0]=4 26427 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F 240690a_100020590264_100000690878 [0,2,0,0,0,0|2,0,0]=4 26428 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Br)F 527a_100020590264_100000690878 [0,2,0,0,0,0|2,0,0]=4 26429 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br 11a_100020590264_100010244045 [0,2,0,0,0,0|2,0,0]=4 26430 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br 1626a_100020590264_100010244045 [0,2,0,0,0,0|2,0,0]=4 26431 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br 240690a_100020590264_100010244045 [0,2,0,0,0,0|2,0,0]=4 26432 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)Br 527a_100020590264_100010244045 [0,2,0,0,0,0|2,0,0]=4 26433 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C 11a_100020590264_100000749331 [0,2,0,0,0,0|2,0,0]=4 26434 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C 1626a_100020590264_100000749331 [0,2,0,0,0,0|2,0,0]=4 26435 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C 240690a_100020590264_100000749331 [0,2,0,0,0,0|2,0,0]=4 26436 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)C 527a_100020590264_100000749331 [0,2,0,0,0,0|2,0,0]=4 26437 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)F 11a_100020590264_100011219217 [0,2,0,0,0,0|2,0,0]=4 26438 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)F 1626a_100020590264_100011219217 [0,2,0,0,0,0|2,0,0]=4 26439 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)F 240690a_100020590264_100011219217 [0,2,0,0,0,0|2,0,0]=4 26440 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1C)F 527a_100020590264_100011219217 [0,2,0,0,0,0|2,0,0]=4 26441 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br 11a_100020590264_100011600618 [0,2,0,0,0,0|2,0,0]=4 26442 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br 1626a_100020590264_100011600618 [0,2,0,0,0,0|2,0,0]=4 26443 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br 240690a_100020590264_100011600618 [0,2,0,0,0,0|2,0,0]=4 26444 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Br 527a_100020590264_100011600618 [0,2,0,0,0,0|2,0,0]=4 26445 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl 11a_100020590264_100000748246 [0,2,0,0,0,0|2,0,0]=4 26446 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100020590264_100000748246 [0,2,0,0,0,0|2,0,0]=4 26447 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100020590264_100000748246 [0,2,0,0,0,0|2,0,0]=4 26448 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)Cl 527a_100020590264_100000748246 [0,2,0,0,0,0|2,0,0]=4 26449 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F 11a_100020590264_100011830335 [0,2,0,0,0,0|2,0,0]=4 26450 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F 1626a_100020590264_100011830335 [0,2,0,0,0,0|2,0,0]=4 26451 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F 240690a_100020590264_100011830335 [0,2,0,0,0,0|2,0,0]=4 26452 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1Cl)F 527a_100020590264_100011830335 [0,2,0,0,0,0|2,0,0]=4 26453 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Br 11a_100020590264_100000690877 [0,2,0,0,0,0|2,0,0]=4 26454 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Br 1626a_100020590264_100000690877 [0,2,0,0,0,0|2,0,0]=4 26455 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Br 240690a_100020590264_100000690877 [0,2,0,0,0,0|2,0,0]=4 26456 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Br 527a_100020590264_100000690877 [0,2,0,0,0,0|2,0,0]=4 26457 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)C 11a_100020590264_100011667363 [0,2,0,0,0,0|2,0,0]=4 26458 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)C 1626a_100020590264_100011667363 [0,2,0,0,0,0|2,0,0]=4 26459 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)C 240690a_100020590264_100011667363 [0,2,0,0,0,0|2,0,0]=4 26460 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)C 527a_100020590264_100011667363 [0,2,0,0,0,0|2,0,0]=4 26461 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Cl 11a_100020590264_100011217548 [0,2,0,0,0,0|2,0,0]=4 26462 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Cl 1626a_100020590264_100011217548 [0,2,0,0,0,0|2,0,0]=4 26463 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Cl 240690a_100020590264_100011217548 [0,2,0,0,0,0|2,0,0]=4 26464 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)Cl 527a_100020590264_100011217548 [0,2,0,0,0,0|2,0,0]=4 26465 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F 11a_100020590264_100000762760 [0,2,0,0,0,0|2,0,0]=4 26466 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F 1626a_100020590264_100000762760 [0,2,0,0,0,0|2,0,0]=4 26467 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F 240690a_100020590264_100000762760 [0,2,0,0,0,0|2,0,0]=4 26468 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1F)F 527a_100020590264_100000762760 [0,2,0,0,0,0|2,0,0]=4 26469 B16R1.7379 CSCCNC(=O)Cc1cc(ccc1O)Br 240690a_100020590264_100010072483 [0,2,0,0,0,0|2,0,0]=4 26470 B16R1.7379 CSCCOC(=O)Nc1cc(ccc1Cl)Cl 62a_200000210301_200000190521 [0,2,0,0,0,0|2,0,0]=4 26471 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCF)Br 1458a_100010004923_100000729493 [0,2,0,0,0,0|2,0,0]=4 26472 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCF)C 1458a_100000749331_100000729493 [0,2,0,0,0,0|2,0,0]=4 26473 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCF)F 1458a_100011667363_100000729493 [0,2,0,0,0,0|2,0,0]=4 26474 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)Br 1458a_100010004923_100000210776 [0,2,0,0,0,0|2,0,0]=4 26475 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)C 1458a_100000695505_100000184699 [0,2,0,0,0,0|2,0,0]=4 26476 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)C 1458a_100000749331_100000210776 [0,2,0,0,0,0|2,0,0]=4 26477 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)Cl 1458a_100000695505_100009871730 [0,2,0,0,0,0|2,0,0]=4 26478 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)F 1458a_100000695505_100011260760 [0,2,0,0,0,0|2,0,0]=4 26479 B16R1.7379 Cc1ccc(c(c1)CC(=O)CCCCO)F 1458a_100011667363_100000210776 [0,2,0,0,0,0|2,0,0]=4 26480 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)Br 11a_100015189416_100010004923 [0,2,0,0,0,0|2,0,0]=4 26481 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)Br 1626a_100015189416_100010004923 [0,2,0,0,0,0|2,0,0]=4 26482 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)Br 240690a_100015189416_100010004923 [0,2,0,0,0,0|2,0,0]=4 26483 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)Br 527a_100015189416_100010004923 [0,2,0,0,0,0|2,0,0]=4 26484 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)C 11a_100015189416_100000749331 [0,2,0,0,0,0|2,0,0]=4 26485 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)C 1626a_100015189416_100000749331 [0,2,0,0,0,0|2,0,0]=4 26486 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)C 240690a_100015189416_100000749331 [0,2,0,0,0,0|2,0,0]=4 26487 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)C 527a_100015189416_100000749331 [0,2,0,0,0,0|2,0,0]=4 26488 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)F 11a_100015189416_100011667363 [0,2,0,0,0,0|2,0,0]=4 26489 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)F 1626a_100015189416_100011667363 [0,2,0,0,0,0|2,0,0]=4 26490 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)F 240690a_100015189416_100011667363 [0,2,0,0,0,0|2,0,0]=4 26491 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCF)F 527a_100015189416_100011667363 [0,2,0,0,0,0|2,0,0]=4 26492 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)Br 240690a_100000182051_100010004923 [0,2,0,0,0,0|2,0,0]=4 26493 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)Br 527a_100000182051_100010004923 [0,2,0,0,0,0|2,0,0]=4 26494 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)C 240690a_100000182051_100000749331 [0,2,0,0,0,0|2,0,0]=4 26495 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)C 527a_100000182051_100000749331 [0,2,0,0,0,0|2,0,0]=4 26496 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)F 240690a_100000182051_100011667363 [0,2,0,0,0,0|2,0,0]=4 26497 B16R1.7379 Cc1ccc(c(c1)CC(=O)NCCCO)F 527a_100000182051_100011667363 [0,2,0,0,0,0|2,0,0]=4 26498 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCF)Br 1458a_100010244045_100000729493 [0,2,0,0,0,0|2,0,0]=4 26499 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCF)F 1458a_100011219217_100000729493 [0,2,0,0,0,0|2,0,0]=4 26500 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCO)Br 1458a_100010244045_100000210776 [0,2,0,0,0,0|2,0,0]=4 26501 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCO)Cl 1458a_100000695505_100012186985 [0,2,0,0,0,0|2,0,0]=4 26502 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCO)F 1458a_100000695505_100000709795 [0,2,0,0,0,0|2,0,0]=4 26503 B16R1.7379 Cc1ccc(cc1CC(=O)CCCCO)F 1458a_100011219217_100000210776 [0,2,0,0,0,0|2,0,0]=4 26504 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)Br 11a_100015189416_100010244045 [0,2,0,0,0,0|2,0,0]=4 26505 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)Br 1626a_100015189416_100010244045 [0,2,0,0,0,0|2,0,0]=4 26506 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)Br 240690a_100015189416_100010244045 [0,2,0,0,0,0|2,0,0]=4 26507 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)Br 527a_100015189416_100010244045 [0,2,0,0,0,0|2,0,0]=4 26508 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)F 11a_100015189416_100011219217 [0,2,0,0,0,0|2,0,0]=4 26509 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)F 1626a_100015189416_100011219217 [0,2,0,0,0,0|2,0,0]=4 26510 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)F 240690a_100015189416_100011219217 [0,2,0,0,0,0|2,0,0]=4 26511 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCF)F 527a_100015189416_100011219217 [0,2,0,0,0,0|2,0,0]=4 26512 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)Br 240690a_100000182051_100010244045 [0,2,0,0,0,0|2,0,0]=4 26513 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)Br 527a_100000182051_100010244045 [0,2,0,0,0,0|2,0,0]=4 26514 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)F 240690a_100000182051_100011219217 [0,2,0,0,0,0|2,0,0]=4 26515 B16R1.7379 Cc1ccc(cc1CC(=O)NCCCO)F 527a_100000182051_100011219217 [0,2,0,0,0,0|2,0,0]=4 26516 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Br)Br 1458a_100010004897_100000729493 [0,2,0,0,0,0|2,0,0]=4 26517 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000729493 [0,2,0,0,0,0|2,0,0]=4 26518 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Br)F 1458a_100000690878_100000729493 [0,2,0,0,0,0|2,0,0]=4 26519 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000729493 [0,2,0,0,0,0|2,0,0]=4 26520 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000729493 [0,2,0,0,0,0|2,0,0]=4 26521 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1Cl)F 1458a_100011830335_100000729493 [0,2,0,0,0,0|2,0,0]=4 26522 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1F)Br 1458a_100000690877_100000729493 [0,2,0,0,0,0|2,0,0]=4 26523 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1F)Cl 1458a_100011217548_100000729493 [0,2,0,0,0,0|2,0,0]=4 26524 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1F)F 1458a_100000762760_100000729493 [0,2,0,0,0,0|2,0,0]=4 26525 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1O)Br 1458a_100010072483_100000729493 [0,2,0,0,0,0|2,0,0]=4 26526 B16R1.7379 O=C(CCCCF)Cc1cc(ccc1O)O 1458a_100000038496_100000729493 [0,2,0,0,0,0|2,0,0]=4 26527 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)Br 1458a_100000695505_100011982794 [0,2,0,0,0,0|2,0,0]=4 26528 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210776 [0,2,0,0,0,0|2,0,0]=4 26529 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210776 [0,2,0,0,0,0|2,0,0]=4 26530 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)Cl 1458a_100000695505_100000733903 [0,2,0,0,0,0|2,0,0]=4 26531 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)F 1458a_100000690878_100000210776 [0,2,0,0,0,0|2,0,0]=4 26532 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)F 1458a_100000695505_100000736370 [0,2,0,0,0,0|2,0,0]=4 26533 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Br)I 1458a_100000695505_100012355412 [0,2,0,0,0,0|2,0,0]=4 26534 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)Br 1458a_100000695505_100000763347 [0,2,0,0,0,0|2,0,0]=4 26535 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210776 [0,2,0,0,0,0|2,0,0]=4 26536 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)Cl 1458a_100000695505_100000754809 [0,2,0,0,0,0|2,0,0]=4 26537 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210776 [0,2,0,0,0,0|2,0,0]=4 26538 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)F 1458a_100000695505_100000709952 [0,2,0,0,0,0|2,0,0]=4 26539 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210776 [0,2,0,0,0,0|2,0,0]=4 26540 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1Cl)I 1458a_100000695505_100010188191 [0,2,0,0,0,0|2,0,0]=4 26541 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)Br 1458a_100000690877_100000210776 [0,2,0,0,0,0|2,0,0]=4 26542 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)Br 1458a_100000695505_100000736399 [0,2,0,0,0,0|2,0,0]=4 26543 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)Cl 1458a_100000695505_100000716957 [0,2,0,0,0,0|2,0,0]=4 26544 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210776 [0,2,0,0,0,0|2,0,0]=4 26545 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)F 1458a_100000695505_100000741279 [0,2,0,0,0,0|2,0,0]=4 26546 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)F 1458a_100000762760_100000210776 [0,2,0,0,0,0|2,0,0]=4 26547 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1F)I 1458a_100000695505_200010149601 [0,2,0,0,0,0|2,0,0]=4 26548 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1I)Br 1458a_100000695505_100012362523 [0,2,0,0,0,0|2,0,0]=4 26549 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1I)Cl 1458a_100000695505_100012348826 [0,2,0,0,0,0|2,0,0]=4 26550 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1I)F 1458a_100000695505_100010149606 [0,2,0,0,0,0|2,0,0]=4 26551 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)Br 1458a_100010072483_100000210776 [0,2,0,0,0,0|2,0,0]=4 26552 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)F 1458a_100000695505_100010161318 [0,2,0,0,0,0|2,0,0]=4 26553 B16R1.7379 O=C(CCCCO)Cc1cc(ccc1O)O 1458a_100000038496_100000210776 [0,2,0,0,0,0|2,0,0]=4 26554 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCF 11a_100015189416_100010004897 [0,2,0,0,0,0|2,0,0]=4 26555 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCF 240690a_100015189416_100010004897 [0,2,0,0,0,0|2,0,0]=4 26556 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCF 527a_100015189416_100010004897 [0,2,0,0,0,0|2,0,0]=4 26557 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCO 240690a_100000182051_100010004897 [0,2,0,0,0,0|2,0,0]=4 26558 B16R1.7379 O=C(Cc1cc(ccc1Br)Br)NCCCO 527a_100000182051_100010004897 [0,2,0,0,0,0|2,0,0]=4 26559 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCF 11a_100015189416_100000690875 [0,2,0,0,0,0|2,0,0]=4 26560 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCF 1626a_100015189416_100000690875 [0,2,0,0,0,0|2,0,0]=4 26561 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCF 240690a_100015189416_100000690875 [0,2,0,0,0,0|2,0,0]=4 26562 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCF 527a_100015189416_100000690875 [0,2,0,0,0,0|2,0,0]=4 26563 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCO 240690a_100000182051_100000690875 [0,2,0,0,0,0|2,0,0]=4 26564 B16R1.7379 O=C(Cc1cc(ccc1Br)Cl)NCCCO 527a_100000182051_100000690875 [0,2,0,0,0,0|2,0,0]=4 26565 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCF 11a_100015189416_100000690878 [0,2,0,0,0,0|2,0,0]=4 26566 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCF 1626a_100015189416_100000690878 [0,2,0,0,0,0|2,0,0]=4 26567 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCF 240690a_100015189416_100000690878 [0,2,0,0,0,0|2,0,0]=4 26568 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCF 527a_100015189416_100000690878 [0,2,0,0,0,0|2,0,0]=4 26569 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCO 240690a_100000182051_100000690878 [0,2,0,0,0,0|2,0,0]=4 26570 B16R1.7379 O=C(Cc1cc(ccc1Br)F)NCCCO 527a_100000182051_100000690878 [0,2,0,0,0,0|2,0,0]=4 26571 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCF 11a_100015189416_100011600618 [0,2,0,0,0,0|2,0,0]=4 26572 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCF 1626a_100015189416_100011600618 [0,2,0,0,0,0|2,0,0]=4 26573 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCF 240690a_100015189416_100011600618 [0,2,0,0,0,0|2,0,0]=4 26574 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCF 527a_100015189416_100011600618 [0,2,0,0,0,0|2,0,0]=4 26575 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCO 240690a_100000182051_100011600618 [0,2,0,0,0,0|2,0,0]=4 26576 B16R1.7379 O=C(Cc1cc(ccc1Cl)Br)NCCCO 527a_100000182051_100011600618 [0,2,0,0,0,0|2,0,0]=4 26577 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCF 11a_100015189416_100000748246 [0,2,0,0,0,0|2,0,0]=4 26578 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCF 1626a_100015189416_100000748246 [0,2,0,0,0,0|2,0,0]=4 26579 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCF 240690a_100015189416_100000748246 [0,2,0,0,0,0|2,0,0]=4 26580 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCF 527a_100015189416_100000748246 [0,2,0,0,0,0|2,0,0]=4 26581 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCO 240690a_100000182051_100000748246 [0,2,0,0,0,0|2,0,0]=4 26582 B16R1.7379 O=C(Cc1cc(ccc1Cl)Cl)NCCCO 527a_100000182051_100000748246 [0,2,0,0,0,0|2,0,0]=4 26583 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCF 11a_100015189416_100011830335 [0,2,0,0,0,0|2,0,0]=4 26584 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCF 1626a_100015189416_100011830335 [0,2,0,0,0,0|2,0,0]=4 26585 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCF 240690a_100015189416_100011830335 [0,2,0,0,0,0|2,0,0]=4 26586 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCF 527a_100015189416_100011830335 [0,2,0,0,0,0|2,0,0]=4 26587 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCO 240690a_100000182051_100011830335 [0,2,0,0,0,0|2,0,0]=4 26588 B16R1.7379 O=C(Cc1cc(ccc1Cl)F)NCCCO 527a_100000182051_100011830335 [0,2,0,0,0,0|2,0,0]=4 26589 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCF 11a_100015189416_100000690877 [0,2,0,0,0,0|2,0,0]=4 26590 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCF 1626a_100015189416_100000690877 [0,2,0,0,0,0|2,0,0]=4 26591 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCF 240690a_100015189416_100000690877 [0,2,0,0,0,0|2,0,0]=4 26592 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCF 527a_100015189416_100000690877 [0,2,0,0,0,0|2,0,0]=4 26593 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCO 240690a_100000182051_100000690877 [0,2,0,0,0,0|2,0,0]=4 26594 B16R1.7379 O=C(Cc1cc(ccc1F)Br)NCCCO 527a_100000182051_100000690877 [0,2,0,0,0,0|2,0,0]=4 26595 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCF 11a_100015189416_100011217548 [0,2,0,0,0,0|2,0,0]=4 26596 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCF 1626a_100015189416_100011217548 [0,2,0,0,0,0|2,0,0]=4 26597 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCF 240690a_100015189416_100011217548 [0,2,0,0,0,0|2,0,0]=4 26598 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCF 527a_100015189416_100011217548 [0,2,0,0,0,0|2,0,0]=4 26599 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCO 240690a_100000182051_100011217548 [0,2,0,0,0,0|2,0,0]=4 26600 B16R1.7379 O=C(Cc1cc(ccc1F)Cl)NCCCO 527a_100000182051_100011217548 [0,2,0,0,0,0|2,0,0]=4 26601 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCF 11a_100015189416_100000762760 [0,2,0,0,0,0|2,0,0]=4 26602 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCF 1626a_100015189416_100000762760 [0,2,0,0,0,0|2,0,0]=4 26603 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCF 240690a_100015189416_100000762760 [0,2,0,0,0,0|2,0,0]=4 26604 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCF 527a_100015189416_100000762760 [0,2,0,0,0,0|2,0,0]=4 26605 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCO 240690a_100000182051_100000762760 [0,2,0,0,0,0|2,0,0]=4 26606 B16R1.7379 O=C(Cc1cc(ccc1F)F)NCCCO 527a_100000182051_100000762760 [0,2,0,0,0,0|2,0,0]=4 26607 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCF 240690a_100015189416_100010072483 [0,2,0,0,0,0|2,0,0]=4 26608 B16R1.7379 O=C(Cc1cc(ccc1O)Br)NCCCO 240690a_100000182051_100010072483 [0,2,0,0,0,0|2,0,0]=4 26609 B16R1.7379 [13CH3]SCCOC(=O)Nc1cc(ccc1Cl)Cl 62a_200025704644_200000190521 [0,2,0,0,0,0|2,0,0]=4 26610 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)Br)Br 1458a_200011218047_100011216082 [0,2,0,0,0,0|1,0,1]=4 26611 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)Br)C 1458a_200011218047_100012348363 [0,2,0,0,0,0|1,0,1]=4 26612 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)Br)F 1458a_200011218047_100000766940 [0,2,0,0,0,0|1,0,1]=4 26613 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)C)C 1458a_200011218047_100000181317 [0,2,0,0,0,0|1,0,1]=4 26614 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_200011218047_100011219208 [0,2,0,0,0,0|1,0,1]=4 26615 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)Cl)F 1458a_200011218047_100011219885 [0,2,0,0,0,0|1,0,1]=4 26616 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)F)C 1458a_200011218047_100011219130 [0,2,0,0,0,0|1,0,1]=4 26617 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)F)F 1458a_200011218047_100000697002 [0,2,0,0,0,0|1,0,1]=4 26618 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)I)Br 1458a_200011218047_100010146614 [0,2,0,0,0,0|1,0,1]=4 26619 B16R1.7381 CCCC#CC(=O)Cc1cc(cc(c1)I)F 1458a_200011218047_100010149605 [0,2,0,0,0,0|1,0,1]=4 26620 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000212230_100011216082 [0,2,0,0,0,0|1,0,1]=4 26621 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)Br)C 1458a_100000212230_100012348363 [0,2,0,0,0,0|1,0,1]=4 26622 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)Br)F 1458a_100000212230_100000766940 [0,2,0,0,0,0|1,0,1]=4 26623 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)C)C 1458a_100000212230_100000181317 [0,2,0,0,0,0|1,0,1]=4 26624 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000212230_100011219208 [0,2,0,0,0,0|1,0,1]=4 26625 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000212230_100011219885 [0,2,0,0,0,0|1,0,1]=4 26626 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)F)C 1458a_100000212230_100011219130 [0,2,0,0,0,0|1,0,1]=4 26627 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)F)F 1458a_100000212230_100000697002 [0,2,0,0,0,0|1,0,1]=4 26628 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000212230_100010146614 [0,2,0,0,0,0|1,0,1]=4 26629 B16R1.7381 CCCC=CC(=O)Cc1cc(cc(c1)I)F 1458a_100000212230_100010149605 [0,2,0,0,0,0|1,0,1]=4 26630 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000212188_100011216082 [0,2,0,0,0,0|1,0,0]=3 26631 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000210326 [0,2,0,0,0,0|1,0,0]=3 26632 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000212188_100012348363 [0,2,0,0,0,0|1,0,0]=3 26633 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000212188_100000766940 [0,2,0,0,0,0|1,0,0]=3 26634 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000210326 [0,2,0,0,0,0|1,0,0]=3 26635 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)C)C 1458a_100000212188_100000181317 [0,2,0,0,0,0|1,0,0]=3 26636 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000210326 [0,2,0,0,0,0|1,0,0]=3 26637 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000212188_100011219208 [0,2,0,0,0,0|1,0,0]=3 26638 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000210326 [0,2,0,0,0,0|1,0,0]=3 26639 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000212188_100011219885 [0,2,0,0,0,0|1,0,0]=3 26640 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000210326 [0,2,0,0,0,0|1,0,0]=3 26641 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)F)C 1458a_100000212188_100011219130 [0,2,0,0,0,0|1,0,0]=3 26642 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000210326 [0,2,0,0,0,0|1,0,0]=3 26643 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)F)F 1458a_100000212188_100000697002 [0,2,0,0,0,0|1,0,0]=3 26644 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000210326 [0,2,0,0,0,0|1,0,0]=3 26645 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000212188_100010146614 [0,2,0,0,0,0|1,0,0]=3 26646 B16R1.7381 CCCCCC(=O)Cc1cc(cc(c1)I)F 1458a_100000212188_100010149605 [0,2,0,0,0,0|1,0,0]=3 26647 B16R1.7381 CCCCCC(=O)Cc1cc(cc(n1)C)C 1458a_100000212188_100012357514 [0,2,0,0,0,0|2,0,0]=4 26648 B16R1.7381 CCCCCC(=O)Cc1cc(nc(c1)C)C 1458a_100000212188_200000139866 [0,2,0,0,0,0|2,0,0]=4 26649 B16R1.7381 CCCCCC(=O)Cc1cc(nc(c1)Cl)Cl 1458a_100000212188_100000052781 [0,2,0,0,0,0|2,0,0]=4 26650 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100000212188 [0,2,0,0,0,0|2,0,0]=4 26651 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100000212188 [0,2,0,0,0,0|2,0,0]=4 26652 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000212188 [0,2,0,0,0,0|2,0,0]=4 26653 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100000212188 [0,2,0,0,0,0|2,0,0]=4 26654 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26655 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26656 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26657 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26658 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100000212188 [0,2,0,0,0,0|2,0,0]=4 26659 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100000212188 [0,2,0,0,0,0|2,0,0]=4 26660 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000212188 [0,2,0,0,0,0|2,0,0]=4 26661 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100000212188 [0,2,0,0,0,0|2,0,0]=4 26662 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100000212188 [0,2,0,0,0,0|2,0,0]=4 26663 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000212188 [0,2,0,0,0,0|2,0,0]=4 26664 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100000212188 [0,2,0,0,0,0|2,0,0]=4 26665 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100000212188 [0,2,0,0,0,0|2,0,0]=4 26666 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000212188 [0,2,0,0,0,0|2,0,0]=4 26667 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100000212188 [0,2,0,0,0,0|2,0,0]=4 26668 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100000212188 [0,2,0,0,0,0|2,0,0]=4 26669 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100000212188 [0,2,0,0,0,0|2,0,0]=4 26670 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000212188 [0,2,0,0,0,0|2,0,0]=4 26671 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100000212188 [0,2,0,0,0,0|2,0,0]=4 26672 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100000212188 [0,2,0,0,0,0|2,0,0]=4 26673 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000212188 [0,2,0,0,0,0|2,0,0]=4 26674 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100000212188 [0,2,0,0,0,0|2,0,0]=4 26675 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100000212188 [0,2,0,0,0,0|2,0,0]=4 26676 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000212188 [0,2,0,0,0,0|2,0,0]=4 26677 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000212188 [0,2,0,0,0,0|2,0,0]=4 26678 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000212188 [0,2,0,0,0,0|2,0,0]=4 26679 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100000212188 [0,2,0,0,0,0|2,0,0]=4 26680 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100000212188 [0,2,0,0,0,0|2,0,0]=4 26681 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000212188 [0,2,0,0,0,0|2,0,0]=4 26682 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100000212188 [0,2,0,0,0,0|2,0,0]=4 26683 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100000212188 [0,2,0,0,0,0|2,0,0]=4 26684 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100000212188 [0,2,0,0,0,0|2,0,0]=4 26685 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000212188 [0,2,0,0,0,0|2,0,0]=4 26686 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100000212188 [0,2,0,0,0,0|2,0,0]=4 26687 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100000212188 [0,2,0,0,0,0|2,0,0]=4 26688 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000212188 [0,2,0,0,0,0|2,0,0]=4 26689 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100000212188 [0,2,0,0,0,0|2,0,0]=4 26690 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100000212188 [0,2,0,0,0,0|2,0,0]=4 26691 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100000212188 [0,2,0,0,0,0|2,0,0]=4 26692 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000212188 [0,2,0,0,0,0|2,0,0]=4 26693 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26694 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26695 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000212188 [0,2,0,0,0,0|2,0,0]=4 26696 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26697 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26698 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26699 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100000212188 [0,2,0,0,0,0|2,0,0]=4 26700 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000212188 [0,2,0,0,0,0|2,0,0]=4 26701 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000212188 [0,2,0,0,0,0|2,0,0]=4 26702 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100000212188 [0,2,0,0,0,0|2,0,0]=4 26703 B16R1.7381 CCCCCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000212188 [0,2,0,0,0,0|2,0,0]=4 26704 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)Br 11a_100000102301_100010186705 [0,2,0,0,0,0|1,0,0]=3 26705 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100000102301_100010186705 [0,2,0,0,0,0|1,0,0]=3 26706 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)Br 527a_100000102301_100010186705 [0,2,0,0,0,0|1,0,0]=3 26707 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)F 11a_100000102301_100011935118 [0,2,0,0,0,0|1,0,0]=3 26708 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)F 240690a_100000102301_100011935118 [0,2,0,0,0,0|1,0,0]=3 26709 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Br)F 527a_100000102301_100011935118 [0,2,0,0,0,0|1,0,0]=3 26710 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)C)C 11a_100000102301_100011202310 [0,2,0,0,0,0|1,0,0]=3 26711 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)C)C 240690a_100000102301_100011202310 [0,2,0,0,0,0|1,0,0]=3 26712 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)C)C 527a_100000102301_100011202310 [0,2,0,0,0,0|1,0,0]=3 26713 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)Cl 11a_100000102301_100012340057 [0,2,0,0,0,0|1,0,0]=3 26714 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100000102301_100012340057 [0,2,0,0,0,0|1,0,0]=3 26715 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100000102301_100012340057 [0,2,0,0,0,0|1,0,0]=3 26716 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100000102301_100012340057 [0,2,0,0,0,0|1,0,0]=3 26717 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F 11a_100000102301_100011217690 [0,2,0,0,0,0|1,0,0]=3 26718 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100000102301_100011217690 [0,2,0,0,0,0|1,0,0]=3 26719 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100000102301_100011217690 [0,2,0,0,0,0|1,0,0]=3 26720 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)Cl)F 527a_100000102301_100011217690 [0,2,0,0,0,0|1,0,0]=3 26721 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C 11a_100000102301_100011216671 [0,2,0,0,0,0|1,0,0]=3 26722 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C 1626a_100000102301_100011216671 [0,2,0,0,0,0|1,0,0]=3 26723 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C 240690a_100000102301_100011216671 [0,2,0,0,0,0|1,0,0]=3 26724 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)C 527a_100000102301_100011216671 [0,2,0,0,0,0|1,0,0]=3 26725 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F 11a_100000102301_100011220011 [0,2,0,0,0,0|1,0,0]=3 26726 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F 1626a_100000102301_100011220011 [0,2,0,0,0,0|1,0,0]=3 26727 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F 240690a_100000102301_100011220011 [0,2,0,0,0,0|1,0,0]=3 26728 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)F)F 527a_100000102301_100011220011 [0,2,0,0,0,0|1,0,0]=3 26729 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)O)O 240690a_100000102301_100000080560 [0,2,0,0,0,0|1,0,0]=3 26730 B16R1.7381 CCCCNC(=O)Cc1cc(cc(c1)O)O 527a_100000102301_100000080560 [0,2,0,0,0,0|1,0,0]=3 26731 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)Br 2430a_100012047176_100000102301 [0,2,0,0,0,0|2,0,0]=4 26732 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)Br 512a_100012047176_100000102301 [0,2,0,0,0,0|2,0,0]=4 26733 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)C 2430a_100000695972_100000102301 [0,2,0,0,0,0|2,0,0]=4 26734 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)C 512a_100000695972_100000102301 [0,2,0,0,0,0|2,0,0]=4 26735 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)Cl 2430a_100011934539_100000102301 [0,2,0,0,0,0|2,0,0]=4 26736 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)Cl 512a_100011934539_100000102301 [0,2,0,0,0,0|2,0,0]=4 26737 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)F 2430a_100000705686_100000102301 [0,2,0,0,0,0|2,0,0]=4 26738 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Br)F 512a_100000705686_100000102301 [0,2,0,0,0,0|2,0,0]=4 26739 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)C)C 2430a_100000210930_100000102301 [0,2,0,0,0,0|2,0,0]=4 26740 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)C)C 512a_100000210930_100000102301 [0,2,0,0,0,0|2,0,0]=4 26741 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)C 2430a_100012022512_100000102301 [0,2,0,0,0,0|2,0,0]=4 26742 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)C 512a_100012022512_100000102301 [0,2,0,0,0,0|2,0,0]=4 26743 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)Cl 2430a_100000210456_100000102301 [0,2,0,0,0,0|2,0,0]=4 26744 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)Cl 512a_100000210456_100000102301 [0,2,0,0,0,0|2,0,0]=4 26745 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)F 2430a_100000686136_100000102301 [0,2,0,0,0,0|2,0,0]=4 26746 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)F 512a_100000686136_100000102301 [0,2,0,0,0,0|2,0,0]=4 26747 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)O 2430a_100000123917_100000102301 [0,2,0,0,0,0|2,0,0]=4 26748 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)Cl)O 512a_100000123917_100000102301 [0,2,0,0,0,0|2,0,0]=4 26749 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)F)C 2430a_100000742734_100000102301 [0,2,0,0,0,0|2,0,0]=4 26750 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)F)C 512a_100000742734_100000102301 [0,2,0,0,0,0|2,0,0]=4 26751 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)F)F 2430a_100000233717_100000102301 [0,2,0,0,0,0|2,0,0]=4 26752 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)F)F 512a_100000233717_100000102301 [0,2,0,0,0,0|2,0,0]=4 26753 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)Br 2430a_100009814763_100000102301 [0,2,0,0,0,0|2,0,0]=4 26754 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)Br 512a_100009814763_100000102301 [0,2,0,0,0,0|2,0,0]=4 26755 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)Cl 2430a_100010147676_100000102301 [0,2,0,0,0,0|2,0,0]=4 26756 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)Cl 512a_100010147676_100000102301 [0,2,0,0,0,0|2,0,0]=4 26757 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)F 2430a_100011356972_100000102301 [0,2,0,0,0,0|2,0,0]=4 26758 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)F 512a_100011356972_100000102301 [0,2,0,0,0,0|2,0,0]=4 26759 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)I 2430a_200000696836_100000102301 [0,2,0,0,0,0|2,0,0]=4 26760 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)I)I 512a_200000696836_100000102301 [0,2,0,0,0,0|2,0,0]=4 26761 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)O)C 2430a_100011995906_100000102301 [0,2,0,0,0,0|2,0,0]=4 26762 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)O)C 512a_100011995906_100000102301 [0,2,0,0,0,0|2,0,0]=4 26763 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)O)O 2430a_100000043371_100000102301 [0,2,0,0,0,0|2,0,0]=4 26764 B16R1.7381 CCCCNC(=O)Nc1cc(cc(c1)O)O 512a_100000043371_100000102301 [0,2,0,0,0,0|2,0,0]=4 26765 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)Br)Br 22a_100000740057_100010186705 [0,2,0,0,0,0|2,0,0]=4 26766 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)Br)F 22a_100000740057_100011935118 [0,2,0,0,0,0|2,0,0]=4 26767 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)C)C 22a_100000740057_100011202310 [0,2,0,0,0,0|2,0,0]=4 26768 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)Cl)Cl 22a_100000740057_100012340057 [0,2,0,0,0,0|2,0,0]=4 26769 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)Cl)F 22a_100000740057_100011217690 [0,2,0,0,0,0|2,0,0]=4 26770 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)F)C 22a_100000740057_100011216671 [0,2,0,0,0,0|2,0,0]=4 26771 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)F)F 22a_100000740057_100011220011 [0,2,0,0,0,0|2,0,0]=4 26772 B16R1.7381 CCCNNC(=O)Cc1cc(cc(c1)O)O 22a_100000740057_100000080560 [0,2,0,0,0,0|2,0,0]=4 26773 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000745993_100011216082 [0,2,0,0,0,0|2,0,0]=4 26774 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000745993_100012348363 [0,2,0,0,0,0|2,0,0]=4 26775 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000745993_100000766940 [0,2,0,0,0,0|2,0,0]=4 26776 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)C)C 1458a_100000745993_100000181317 [0,2,0,0,0,0|2,0,0]=4 26777 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000745993_100011219208 [0,2,0,0,0,0|2,0,0]=4 26778 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000745993_100011219885 [0,2,0,0,0,0|2,0,0]=4 26779 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)F)C 1458a_100000745993_100011219130 [0,2,0,0,0,0|2,0,0]=4 26780 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)F)F 1458a_100000745993_100000697002 [0,2,0,0,0,0|2,0,0]=4 26781 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000745993_100010146614 [0,2,0,0,0,0|2,0,0]=4 26782 B16R1.7381 CCCOCC(=O)Cc1cc(cc(c1)I)F 1458a_100000745993_100010149605 [0,2,0,0,0,0|2,0,0]=4 26783 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000217233_100011216082 [0,2,0,0,0,0|2,0,0]=4 26784 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000217233_100012348363 [0,2,0,0,0,0|2,0,0]=4 26785 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000217233_100000766940 [0,2,0,0,0,0|2,0,0]=4 26786 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)C)C 1458a_100000217233_100000181317 [0,2,0,0,0,0|2,0,0]=4 26787 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000217233_100011219208 [0,2,0,0,0,0|2,0,0]=4 26788 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000217233_100011219885 [0,2,0,0,0,0|2,0,0]=4 26789 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)F)C 1458a_100000217233_100011219130 [0,2,0,0,0,0|2,0,0]=4 26790 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)F)F 1458a_100000217233_100000697002 [0,2,0,0,0,0|2,0,0]=4 26791 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000217233_100010146614 [0,2,0,0,0,0|2,0,0]=4 26792 B16R1.7381 CCCSCC(=O)Cc1cc(cc(c1)I)F 1458a_100000217233_100010149605 [0,2,0,0,0,0|2,0,0]=4 26793 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000749530_100011216082 [0,2,0,0,0,0|2,0,0]=4 26794 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100011215890 [0,2,0,0,0,0|2,0,0]=4 26795 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000749530_100012348363 [0,2,0,0,0,0|2,0,0]=4 26796 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000749530_100000766940 [0,2,0,0,0,0|2,0,0]=4 26797 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100011215890 [0,2,0,0,0,0|2,0,0]=4 26798 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)C)C 1458a_100000749530_100000181317 [0,2,0,0,0,0|2,0,0]=4 26799 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100011215890 [0,2,0,0,0,0|2,0,0]=4 26800 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000749530_100011219208 [0,2,0,0,0,0|2,0,0]=4 26801 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100011215890 [0,2,0,0,0,0|2,0,0]=4 26802 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000749530_100011219885 [0,2,0,0,0,0|2,0,0]=4 26803 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100011215890 [0,2,0,0,0,0|2,0,0]=4 26804 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)F)C 1458a_100000749530_100011219130 [0,2,0,0,0,0|2,0,0]=4 26805 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100011215890 [0,2,0,0,0,0|2,0,0]=4 26806 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)F)F 1458a_100000749530_100000697002 [0,2,0,0,0,0|2,0,0]=4 26807 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100011215890 [0,2,0,0,0,0|2,0,0]=4 26808 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000749530_100010146614 [0,2,0,0,0,0|2,0,0]=4 26809 B16R1.7381 CCOCCC(=O)Cc1cc(cc(c1)I)F 1458a_100000749530_100010149605 [0,2,0,0,0,0|2,0,0]=4 26810 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000230768_100011216082 [0,2,0,0,0,0|2,0,0]=4 26811 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000757381 [0,2,0,0,0,0|2,0,0]=4 26812 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000230768_100012348363 [0,2,0,0,0,0|2,0,0]=4 26813 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000230768_100000766940 [0,2,0,0,0,0|2,0,0]=4 26814 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000757381 [0,2,0,0,0,0|2,0,0]=4 26815 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)C)C 1458a_100000230768_100000181317 [0,2,0,0,0,0|2,0,0]=4 26816 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000757381 [0,2,0,0,0,0|2,0,0]=4 26817 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000230768_100011219208 [0,2,0,0,0,0|2,0,0]=4 26818 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000757381 [0,2,0,0,0,0|2,0,0]=4 26819 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000230768_100011219885 [0,2,0,0,0,0|2,0,0]=4 26820 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000757381 [0,2,0,0,0,0|2,0,0]=4 26821 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)F)C 1458a_100000230768_100011219130 [0,2,0,0,0,0|2,0,0]=4 26822 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000757381 [0,2,0,0,0,0|2,0,0]=4 26823 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)F)F 1458a_100000230768_100000697002 [0,2,0,0,0,0|2,0,0]=4 26824 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000757381 [0,2,0,0,0,0|2,0,0]=4 26825 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000230768_100010146614 [0,2,0,0,0,0|2,0,0]=4 26826 B16R1.7381 CCSCCC(=O)Cc1cc(cc(c1)I)F 1458a_100000230768_100010149605 [0,2,0,0,0,0|2,0,0]=4 26827 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000741012_100011216082 [0,2,0,0,0,0|2,0,0]=4 26828 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000740836 [0,2,0,0,0,0|2,0,0]=4 26829 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000741012_100012348363 [0,2,0,0,0,0|2,0,0]=4 26830 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000741012_100000766940 [0,2,0,0,0,0|2,0,0]=4 26831 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000740836 [0,2,0,0,0,0|2,0,0]=4 26832 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)C)C 1458a_100000741012_100000181317 [0,2,0,0,0,0|2,0,0]=4 26833 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000740836 [0,2,0,0,0,0|2,0,0]=4 26834 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000741012_100011219208 [0,2,0,0,0,0|2,0,0]=4 26835 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000740836 [0,2,0,0,0,0|2,0,0]=4 26836 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000741012_100011219885 [0,2,0,0,0,0|2,0,0]=4 26837 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000740836 [0,2,0,0,0,0|2,0,0]=4 26838 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)F)C 1458a_100000741012_100011219130 [0,2,0,0,0,0|2,0,0]=4 26839 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000740836 [0,2,0,0,0,0|2,0,0]=4 26840 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)F)F 1458a_100000741012_100000697002 [0,2,0,0,0,0|2,0,0]=4 26841 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000740836 [0,2,0,0,0,0|2,0,0]=4 26842 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000741012_100010146614 [0,2,0,0,0,0|2,0,0]=4 26843 B16R1.7381 COCCCC(=O)Cc1cc(cc(c1)I)F 1458a_100000741012_100010149605 [0,2,0,0,0,0|2,0,0]=4 26844 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100000209980_100010186705 [0,2,0,0,0,0|2,0,0]=4 26845 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Br)Br 527a_100000209980_100010186705 [0,2,0,0,0,0|2,0,0]=4 26846 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Br)F 240690a_100000209980_100011935118 [0,2,0,0,0,0|2,0,0]=4 26847 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Br)F 527a_100000209980_100011935118 [0,2,0,0,0,0|2,0,0]=4 26848 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)C)C 240690a_100000209980_100011202310 [0,2,0,0,0,0|2,0,0]=4 26849 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)C)C 527a_100000209980_100011202310 [0,2,0,0,0,0|2,0,0]=4 26850 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100000209980_100012340057 [0,2,0,0,0,0|2,0,0]=4 26851 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100000209980_100012340057 [0,2,0,0,0,0|2,0,0]=4 26852 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100000209980_100012340057 [0,2,0,0,0,0|2,0,0]=4 26853 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100000209980_100011217690 [0,2,0,0,0,0|2,0,0]=4 26854 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100000209980_100011217690 [0,2,0,0,0,0|2,0,0]=4 26855 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)Cl)F 527a_100000209980_100011217690 [0,2,0,0,0,0|2,0,0]=4 26856 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)C 1626a_100000209980_100011216671 [0,2,0,0,0,0|2,0,0]=4 26857 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)C 240690a_100000209980_100011216671 [0,2,0,0,0,0|2,0,0]=4 26858 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)C 527a_100000209980_100011216671 [0,2,0,0,0,0|2,0,0]=4 26859 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)F 1626a_100000209980_100011220011 [0,2,0,0,0,0|2,0,0]=4 26860 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)F 240690a_100000209980_100011220011 [0,2,0,0,0,0|2,0,0]=4 26861 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)F)F 527a_100000209980_100011220011 [0,2,0,0,0,0|2,0,0]=4 26862 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)O)O 240690a_100000209980_100000080560 [0,2,0,0,0,0|2,0,0]=4 26863 B16R1.7381 COCCNC(=O)Cc1cc(cc(c1)O)O 527a_100000209980_100000080560 [0,2,0,0,0,0|2,0,0]=4 26864 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000173376_100011216082 [0,2,0,0,0,0|2,0,0]=4 26865 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000173376_100012348363 [0,2,0,0,0,0|2,0,0]=4 26866 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000173376_100000766940 [0,2,0,0,0,0|2,0,0]=4 26867 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)C)C 1458a_100000173376_100000181317 [0,2,0,0,0,0|2,0,0]=4 26868 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000173376_100011219208 [0,2,0,0,0,0|2,0,0]=4 26869 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000173376_100011219885 [0,2,0,0,0,0|2,0,0]=4 26870 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)F)C 1458a_100000173376_100011219130 [0,2,0,0,0,0|2,0,0]=4 26871 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)F)F 1458a_100000173376_100000697002 [0,2,0,0,0,0|2,0,0]=4 26872 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000173376_100010146614 [0,2,0,0,0,0|2,0,0]=4 26873 B16R1.7381 CSCCCC(=O)Cc1cc(cc(c1)I)F 1458a_100000173376_100010149605 [0,2,0,0,0,0|2,0,0]=4 26874 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)Br 11a_100020590264_100010186705 [0,2,0,0,0,0|2,0,0]=4 26875 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100020590264_100010186705 [0,2,0,0,0,0|2,0,0]=4 26876 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)Br 527a_100020590264_100010186705 [0,2,0,0,0,0|2,0,0]=4 26877 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)F 11a_100020590264_100011935118 [0,2,0,0,0,0|2,0,0]=4 26878 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)F 240690a_100020590264_100011935118 [0,2,0,0,0,0|2,0,0]=4 26879 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Br)F 527a_100020590264_100011935118 [0,2,0,0,0,0|2,0,0]=4 26880 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)C)C 11a_100020590264_100011202310 [0,2,0,0,0,0|2,0,0]=4 26881 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)C)C 240690a_100020590264_100011202310 [0,2,0,0,0,0|2,0,0]=4 26882 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)C)C 527a_100020590264_100011202310 [0,2,0,0,0,0|2,0,0]=4 26883 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)Cl 11a_100020590264_100012340057 [0,2,0,0,0,0|2,0,0]=4 26884 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100020590264_100012340057 [0,2,0,0,0,0|2,0,0]=4 26885 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100020590264_100012340057 [0,2,0,0,0,0|2,0,0]=4 26886 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100020590264_100012340057 [0,2,0,0,0,0|2,0,0]=4 26887 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F 11a_100020590264_100011217690 [0,2,0,0,0,0|2,0,0]=4 26888 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100020590264_100011217690 [0,2,0,0,0,0|2,0,0]=4 26889 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100020590264_100011217690 [0,2,0,0,0,0|2,0,0]=4 26890 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)Cl)F 527a_100020590264_100011217690 [0,2,0,0,0,0|2,0,0]=4 26891 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C 11a_100020590264_100011216671 [0,2,0,0,0,0|2,0,0]=4 26892 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C 1626a_100020590264_100011216671 [0,2,0,0,0,0|2,0,0]=4 26893 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C 240690a_100020590264_100011216671 [0,2,0,0,0,0|2,0,0]=4 26894 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)C 527a_100020590264_100011216671 [0,2,0,0,0,0|2,0,0]=4 26895 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F 11a_100020590264_100011220011 [0,2,0,0,0,0|2,0,0]=4 26896 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F 1626a_100020590264_100011220011 [0,2,0,0,0,0|2,0,0]=4 26897 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F 240690a_100020590264_100011220011 [0,2,0,0,0,0|2,0,0]=4 26898 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)F)F 527a_100020590264_100011220011 [0,2,0,0,0,0|2,0,0]=4 26899 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)O)O 240690a_100020590264_100000080560 [0,2,0,0,0,0|2,0,0]=4 26900 B16R1.7381 CSCCNC(=O)Cc1cc(cc(c1)O)O 527a_100020590264_100000080560 [0,2,0,0,0,0|2,0,0]=4 26901 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCF)C 1458a_100011202310_100000729493 [0,2,0,0,0,0|2,0,0]=4 26902 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCF)F 1458a_100011216671_100000729493 [0,2,0,0,0,0|2,0,0]=4 26903 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCO)Br 1458a_100000695505_100012348363 [0,2,0,0,0,0|2,0,0]=4 26904 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCO)C 1458a_100000695505_100000181317 [0,2,0,0,0,0|2,0,0]=4 26905 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCO)C 1458a_100011202310_100000210776 [0,2,0,0,0,0|2,0,0]=4 26906 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCO)F 1458a_100000695505_100011219130 [0,2,0,0,0,0|2,0,0]=4 26907 B16R1.7381 Cc1cc(cc(c1)CC(=O)CCCCO)F 1458a_100011216671_100000210776 [0,2,0,0,0,0|2,0,0]=4 26908 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)C 11a_100015189416_100011202310 [0,2,0,0,0,0|2,0,0]=4 26909 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)C 240690a_100015189416_100011202310 [0,2,0,0,0,0|2,0,0]=4 26910 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)C 527a_100015189416_100011202310 [0,2,0,0,0,0|2,0,0]=4 26911 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)F 11a_100015189416_100011216671 [0,2,0,0,0,0|2,0,0]=4 26912 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)F 1626a_100015189416_100011216671 [0,2,0,0,0,0|2,0,0]=4 26913 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)F 240690a_100015189416_100011216671 [0,2,0,0,0,0|2,0,0]=4 26914 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCF)F 527a_100015189416_100011216671 [0,2,0,0,0,0|2,0,0]=4 26915 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)C 240690a_100000182051_100011202310 [0,2,0,0,0,0|2,0,0]=4 26916 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)C 527a_100000182051_100011202310 [0,2,0,0,0,0|2,0,0]=4 26917 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)F 240690a_100000182051_100011216671 [0,2,0,0,0,0|2,0,0]=4 26918 B16R1.7381 Cc1cc(cc(c1)CC(=O)NCCCO)F 527a_100000182051_100011216671 [0,2,0,0,0,0|2,0,0]=4 26919 B16R1.7381 O=C(CCCCF)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000729493 [0,2,0,0,0,0|2,0,0]=4 26920 B16R1.7381 O=C(CCCCF)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000729493 [0,2,0,0,0,0|2,0,0]=4 26921 B16R1.7381 O=C(CCCCF)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000729493 [0,2,0,0,0,0|2,0,0]=4 26922 B16R1.7381 O=C(CCCCF)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000729493 [0,2,0,0,0,0|2,0,0]=4 26923 B16R1.7381 O=C(CCCCF)Cc1cc(cc(c1)F)F 1458a_100011220011_100000729493 [0,2,0,0,0,0|2,0,0]=4 26924 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Br)Br 1458a_100000695505_100011216082 [0,2,0,0,0,0|2,0,0]=4 26925 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000210776 [0,2,0,0,0,0|2,0,0]=4 26926 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Br)F 1458a_100000695505_100000766940 [0,2,0,0,0,0|2,0,0]=4 26927 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000210776 [0,2,0,0,0,0|2,0,0]=4 26928 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Cl)Cl 1458a_100000695505_100011219208 [0,2,0,0,0,0|2,0,0]=4 26929 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000210776 [0,2,0,0,0,0|2,0,0]=4 26930 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Cl)F 1458a_100000695505_100011219885 [0,2,0,0,0,0|2,0,0]=4 26931 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000210776 [0,2,0,0,0,0|2,0,0]=4 26932 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)F)F 1458a_100000695505_100000697002 [0,2,0,0,0,0|2,0,0]=4 26933 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)F)F 1458a_100011220011_100000210776 [0,2,0,0,0,0|2,0,0]=4 26934 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)I)Br 1458a_100000695505_100010146614 [0,2,0,0,0,0|2,0,0]=4 26935 B16R1.7381 O=C(CCCCO)Cc1cc(cc(c1)I)F 1458a_100000695505_100010149605 [0,2,0,0,0,0|2,0,0]=4 26936 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCF 11a_100015189416_100010186705 [0,2,0,0,0,0|2,0,0]=4 26937 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCF 240690a_100015189416_100010186705 [0,2,0,0,0,0|2,0,0]=4 26938 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCF 527a_100015189416_100010186705 [0,2,0,0,0,0|2,0,0]=4 26939 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCO 240690a_100000182051_100010186705 [0,2,0,0,0,0|2,0,0]=4 26940 B16R1.7381 O=C(Cc1cc(cc(c1)Br)Br)NCCCO 527a_100000182051_100010186705 [0,2,0,0,0,0|2,0,0]=4 26941 B16R1.7381 O=C(Cc1cc(cc(c1)Br)F)NCCCF 11a_100015189416_100011935118 [0,2,0,0,0,0|2,0,0]=4 26942 B16R1.7381 O=C(Cc1cc(cc(c1)Br)F)NCCCF 240690a_100015189416_100011935118 [0,2,0,0,0,0|2,0,0]=4 26943 B16R1.7381 O=C(Cc1cc(cc(c1)Br)F)NCCCF 527a_100015189416_100011935118 [0,2,0,0,0,0|2,0,0]=4 26944 B16R1.7381 O=C(Cc1cc(cc(c1)Br)F)NCCCO 240690a_100000182051_100011935118 [0,2,0,0,0,0|2,0,0]=4 26945 B16R1.7381 O=C(Cc1cc(cc(c1)Br)F)NCCCO 527a_100000182051_100011935118 [0,2,0,0,0,0|2,0,0]=4 26946 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCF 11a_100015189416_100012340057 [0,2,0,0,0,0|2,0,0]=4 26947 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCF 1626a_100015189416_100012340057 [0,2,0,0,0,0|2,0,0]=4 26948 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCF 240690a_100015189416_100012340057 [0,2,0,0,0,0|2,0,0]=4 26949 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCF 527a_100015189416_100012340057 [0,2,0,0,0,0|2,0,0]=4 26950 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCO 240690a_100000182051_100012340057 [0,2,0,0,0,0|2,0,0]=4 26951 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)Cl)NCCCO 527a_100000182051_100012340057 [0,2,0,0,0,0|2,0,0]=4 26952 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCF 11a_100015189416_100011217690 [0,2,0,0,0,0|2,0,0]=4 26953 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCF 1626a_100015189416_100011217690 [0,2,0,0,0,0|2,0,0]=4 26954 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCF 240690a_100015189416_100011217690 [0,2,0,0,0,0|2,0,0]=4 26955 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCF 527a_100015189416_100011217690 [0,2,0,0,0,0|2,0,0]=4 26956 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCO 240690a_100000182051_100011217690 [0,2,0,0,0,0|2,0,0]=4 26957 B16R1.7381 O=C(Cc1cc(cc(c1)Cl)F)NCCCO 527a_100000182051_100011217690 [0,2,0,0,0,0|2,0,0]=4 26958 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCF 11a_100015189416_100011220011 [0,2,0,0,0,0|2,0,0]=4 26959 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCF 1626a_100015189416_100011220011 [0,2,0,0,0,0|2,0,0]=4 26960 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCF 240690a_100015189416_100011220011 [0,2,0,0,0,0|2,0,0]=4 26961 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCF 527a_100015189416_100011220011 [0,2,0,0,0,0|2,0,0]=4 26962 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCO 240690a_100000182051_100011220011 [0,2,0,0,0,0|2,0,0]=4 26963 B16R1.7381 O=C(Cc1cc(cc(c1)F)F)NCCCO 527a_100000182051_100011220011 [0,2,0,0,0,0|2,0,0]=4 26964 B16R1.7381 O=C(Cc1cc(cc(c1)O)O)NCCCF 240690a_100015189416_100000080560 [0,2,0,0,0,0|2,0,0]=4 26965 B16R1.7381 O=C(Cc1cc(cc(c1)O)O)NCCCF 527a_100015189416_100000080560 [0,2,0,0,0,0|2,0,0]=4 26966 B16R1.7381 O=C(Cc1cc(cc(c1)O)O)NCCCO 240690a_100000182051_100000080560 [0,2,0,0,0,0|2,0,0]=4 26967 B16R1.7381 O=C(Cc1cc(cc(c1)O)O)NCCCO 527a_100000182051_100000080560 [0,2,0,0,0,0|2,0,0]=4 26968 B16R1.7389 C#Cc1cccc(c1)NC(=O)CCCCC 11a_100000735509_100000212188 [0,2,0,0,0,0|2,0,0]=4 26969 B16R1.7389 C#Cc1cccc(c1)NC(=O)CCCCC 1626a_100000735509_100000212188 [0,2,0,0,0,0|2,0,0]=4 26970 B16R1.7389 C#Cc1cccc(c1)NC(=O)CCCCC 22a_100000735509_100000212188 [0,2,0,0,0,0|2,0,0]=4 26971 B16R1.7389 C#Cc1cccc(c1)NC(=O)CCCCC 527a_100000735509_100000212188 [0,2,0,0,0,0|2,0,0]=4 26972 B16R1.7389 C#Cc1cccc(c1)NC(=O)NCCCC 2430a_100000735509_100000102301 [0,2,0,0,0,0|2,0,0]=4 26973 B16R1.7389 C#Cc1cccc(c1)NC(=O)NCCCC 512a_100000735509_100000102301 [0,2,0,0,0,0|2,0,0]=4 26974 B16R1.7389 C=Cc1cccc(c1)NC(=O)CCCCC 11a_100011827668_100000212188 [0,2,0,0,0,0|2,0,0]=4 26975 B16R1.7389 C=Cc1cccc(c1)NC(=O)CCCCC 1626a_100011827668_100000212188 [0,2,0,0,0,0|2,0,0]=4 26976 B16R1.7389 C=Cc1cccc(c1)NC(=O)CCCCC 22a_100011827668_100000212188 [0,2,0,0,0,0|2,0,0]=4 26977 B16R1.7389 C=Cc1cccc(c1)NC(=O)CCCCC 527a_100011827668_100000212188 [0,2,0,0,0,0|2,0,0]=4 26978 B16R1.7389 C=Cc1cccc(c1)NC(=O)NCCCC 2430a_100011827668_100000102301 [0,2,0,0,0,0|2,0,0]=4 26979 B16R1.7389 CCCC#CC(=O)Cc1cccc(c1)C#N 1458a_200011218047_100000233786 [0,2,0,0,0,0|1,0,1]=4 26980 B16R1.7389 CCCC#CC(=O)Cc1cccc(c1)C=O 1458a_200011218047_100009816774 [0,2,0,0,0,0|1,0,1]=4 26981 B16R1.7389 CCCC#CC(=O)Cc1cccc(c1)CO 1458a_200011218047_100010188025 [0,2,0,0,0,0|1,0,1]=4 26982 B16R1.7389 CCCC#CC(=O)Cc1cccc(c1)OC 1458a_200011218047_100000211672 [0,2,0,0,0,0|1,0,1]=4 26983 B16R1.7389 CCCC=CC(=O)Cc1cccc(c1)C#N 1458a_100000212230_100000233786 [0,2,0,0,0,0|1,0,1]=4 26984 B16R1.7389 CCCC=CC(=O)Cc1cccc(c1)C=O 1458a_100000212230_100009816774 [0,2,0,0,0,0|1,0,1]=4 26985 B16R1.7389 CCCC=CC(=O)Cc1cccc(c1)CO 1458a_100000212230_100010188025 [0,2,0,0,0,0|1,0,1]=4 26986 B16R1.7389 CCCC=CC(=O)Cc1cccc(c1)OC 1458a_100000212230_100000211672 [0,2,0,0,0,0|1,0,1]=4 26987 B16R1.7389 CCCCCC(=O)Cc1cc(ccn1)OC 1458a_100000212188_100000752681 [0,2,0,0,0,0|2,0,0]=4 26988 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)C#N 1458a_100000212188_100000233786 [0,2,0,0,0,0|1,0,0]=3 26989 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000210326 [0,2,0,0,0,0|1,0,0]=3 26990 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)C=O 1458a_100000212188_100009816774 [0,2,0,0,0,0|1,0,0]=3 26991 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)CO 1458a_100000212188_100010188025 [0,2,0,0,0,0|1,0,0]=3 26992 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210326 [0,2,0,0,0,0|1,0,0]=3 26993 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)OC 1458a_100000212188_100000211672 [0,2,0,0,0,0|1,0,0]=3 26994 B16R1.7389 CCCCCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000210326 [0,2,0,0,0,0|1,0,0]=3 26995 B16R1.7389 CCCCCC(=O)Cc1cccc(n1)C#N 1458a_100000212188_100000097530 [0,2,0,0,0,0|2,0,0]=4 26996 B16R1.7389 CCCCCC(=O)Cc1cccc(n1)CO 1458a_100000212188_100009813551 [0,2,0,0,0,0|2,0,0]=4 26997 B16R1.7389 CCCCCC(=O)Cc1cccc(n1)OC 1458a_100000212188_100000755263 [0,2,0,0,0,0|2,0,0]=4 26998 B16R1.7389 CCCCCC(=O)Cc1ccnc(c1)OC 1458a_100000212188_100103152439 [0,2,0,0,0,0|2,0,0]=4 26999 B16R1.7389 CCCCCC(=O)Cc1ccnc(c1)OC 1458a_100000718155_100000210326 [0,2,0,0,0,0|2,0,0]=4 27000 B16R1.7389 CCCCCC(=O)Cc1cncc(c1)C#N 1458a_100000212188_200020634941 [0,2,0,0,0,0|2,0,0]=4 27001 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)C#N 11a_100000210922_100000212188 [0,2,0,0,0,0|2,0,0]=4 27002 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100000212188 [0,2,0,0,0,0|2,0,0]=4 27003 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000212188 [0,2,0,0,0,0|2,0,0]=4 27004 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)C#N 527a_100000210922_100000212188 [0,2,0,0,0,0|2,0,0]=4 27005 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CC 11a_100000211250_100000212188 [0,2,0,0,0,0|2,0,0]=4 27006 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CC 1626a_100000211250_100000212188 [0,2,0,0,0,0|2,0,0]=4 27007 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CC 22a_100000211250_100000212188 [0,2,0,0,0,0|2,0,0]=4 27008 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CC 527a_100000211250_100000212188 [0,2,0,0,0,0|2,0,0]=4 27009 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CF 11a_100000126320_100000212188 [0,2,0,0,0,0|2,0,0]=4 27010 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CF 1626a_100000126320_100000212188 [0,2,0,0,0,0|2,0,0]=4 27011 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CF 22a_100000126320_100000212188 [0,2,0,0,0,0|2,0,0]=4 27012 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CF 527a_100000126320_100000212188 [0,2,0,0,0,0|2,0,0]=4 27013 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)CO 22a_100000211919_100000212188 [0,2,0,0,0,0|2,0,0]=4 27014 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)OC 11a_100000210024_100000212188 [0,2,0,0,0,0|2,0,0]=4 27015 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000212188 [0,2,0,0,0,0|2,0,0]=4 27016 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)OC 22a_100000210024_100000212188 [0,2,0,0,0,0|2,0,0]=4 27017 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)OC 527a_100000210024_100000212188 [0,2,0,0,0,0|2,0,0]=4 27018 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)SC 11a_100000210049_100000212188 [0,2,0,0,0,0|2,0,0]=4 27019 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)SC 1626a_100000210049_100000212188 [0,2,0,0,0,0|2,0,0]=4 27020 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)SC 22a_100000210049_100000212188 [0,2,0,0,0,0|2,0,0]=4 27021 B16R1.7389 CCCCCC(=O)Nc1cccc(c1)SC 527a_100000210049_100000212188 [0,2,0,0,0,0|2,0,0]=4 27022 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N 11a_100000102301_100000684415 [0,2,0,0,0,0|1,0,0]=3 27023 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N 1626a_100000102301_100000684415 [0,2,0,0,0,0|1,0,0]=3 27024 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N 240690a_100000102301_100000684415 [0,2,0,0,0,0|1,0,0]=3 27025 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)C#N 527a_100000102301_100000684415 [0,2,0,0,0,0|1,0,0]=3 27026 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC 11a_100000102301_100000211281 [0,2,0,0,0,0|1,0,0]=3 27027 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC 1626a_100000102301_100000211281 [0,2,0,0,0,0|1,0,0]=3 27028 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC 240690a_100000102301_100000211281 [0,2,0,0,0,0|1,0,0]=3 27029 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)OC 527a_100000102301_100000211281 [0,2,0,0,0,0|1,0,0]=3 27030 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC 11a_100000102301_100000035702 [0,2,0,0,0,0|1,0,0]=3 27031 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC 1626a_100000102301_100000035702 [0,2,0,0,0,0|1,0,0]=3 27032 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC 240690a_100000102301_100000035702 [0,2,0,0,0,0|1,0,0]=3 27033 B16R1.7389 CCCCNC(=O)Cc1cccc(c1)SC 527a_100000102301_100000035702 [0,2,0,0,0,0|1,0,0]=3 27034 B16R1.7389 CCCCNC(=O)Cc1ccnc(c1)OC 11a_100000102301_100000718155 [0,2,0,0,0,0|2,0,0]=4 27035 B16R1.7389 CCCCNC(=O)Cc1ccnc(c1)OC 240690a_100000102301_100000718155 [0,2,0,0,0,0|2,0,0]=4 27036 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)C#N 2430a_100000210922_100000102301 [0,2,0,0,0,0|2,0,0]=4 27037 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)C#N 512a_100000210922_100000102301 [0,2,0,0,0,0|2,0,0]=4 27038 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)CC 2430a_100000211250_100000102301 [0,2,0,0,0,0|2,0,0]=4 27039 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)CC 512a_100000211250_100000102301 [0,2,0,0,0,0|2,0,0]=4 27040 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)CF 2430a_100000126320_100000102301 [0,2,0,0,0,0|2,0,0]=4 27041 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)CF 512a_100000126320_100000102301 [0,2,0,0,0,0|2,0,0]=4 27042 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)CO 2430a_100000211919_100000102301 [0,2,0,0,0,0|2,0,0]=4 27043 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)OC 2430a_100000210024_100000102301 [0,2,0,0,0,0|2,0,0]=4 27044 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)OC 512a_100000210024_100000102301 [0,2,0,0,0,0|2,0,0]=4 27045 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)SC 2430a_100000210049_100000102301 [0,2,0,0,0,0|2,0,0]=4 27046 B16R1.7389 CCCCNC(=O)Nc1cccc(c1)SC 512a_100000210049_100000102301 [0,2,0,0,0,0|2,0,0]=4 27047 B16R1.7389 CCCNNC(=O)Cc1cccc(c1)C#N 22a_100000740057_100000684415 [0,2,0,0,0,0|2,0,0]=4 27048 B16R1.7389 CCCNNC(=O)Cc1cccc(c1)OC 22a_100000740057_100000211281 [0,2,0,0,0,0|2,0,0]=4 27049 B16R1.7389 CCCNNC(=O)Cc1cccc(c1)SC 22a_100000740057_100000035702 [0,2,0,0,0,0|2,0,0]=4 27050 B16R1.7389 CCCOCC(=O)Cc1cccc(c1)C#N 1458a_100000745993_100000233786 [0,2,0,0,0,0|2,0,0]=4 27051 B16R1.7389 CCCOCC(=O)Cc1cccc(c1)C=O 1458a_100000745993_100009816774 [0,2,0,0,0,0|2,0,0]=4 27052 B16R1.7389 CCCOCC(=O)Cc1cccc(c1)CO 1458a_100000745993_100010188025 [0,2,0,0,0,0|2,0,0]=4 27053 B16R1.7389 CCCOCC(=O)Cc1cccc(c1)OC 1458a_100000745993_100000211672 [0,2,0,0,0,0|2,0,0]=4 27054 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)C#N 1458a_100000217233_100000233786 [0,2,0,0,0,0|2,0,0]=4 27055 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)C=O 1458a_100000217233_100009816774 [0,2,0,0,0,0|2,0,0]=4 27056 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)CO 1458a_100000217233_100010188025 [0,2,0,0,0,0|2,0,0]=4 27057 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)OC 1458a_100000217233_100000211672 [0,2,0,0,0,0|2,0,0]=4 27058 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)OC 62a_100000210303_100012183207 [0,2,0,0,0,0|2,0,0]=4 27059 B16R1.7389 CCCSCC(=O)Cc1cccc(c1)OC 62a_100012183207_100000210303 [0,2,0,0,0,0|2,0,0]=4 27060 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100011215890 [0,2,0,0,0,0|2,0,0]=4 27061 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)C#N 1458a_100000749530_100000233786 [0,2,0,0,0,0|2,0,0]=4 27062 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)C=O 1458a_100000749530_100009816774 [0,2,0,0,0,0|2,0,0]=4 27063 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)CO 1458a_100000749530_100010188025 [0,2,0,0,0,0|2,0,0]=4 27064 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100011215890 [0,2,0,0,0,0|2,0,0]=4 27065 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)OC 1458a_100000749530_100000211672 [0,2,0,0,0,0|2,0,0]=4 27066 B16R1.7389 CCOCCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100011215890 [0,2,0,0,0,0|2,0,0]=4 27067 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)C#N 1458a_100000230768_100000233786 [0,2,0,0,0,0|2,0,0]=4 27068 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000757381 [0,2,0,0,0,0|2,0,0]=4 27069 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)C=O 1458a_100000230768_100009816774 [0,2,0,0,0,0|2,0,0]=4 27070 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)CO 1458a_100000230768_100010188025 [0,2,0,0,0,0|2,0,0]=4 27071 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000757381 [0,2,0,0,0,0|2,0,0]=4 27072 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)OC 1458a_100000230768_100000211672 [0,2,0,0,0,0|2,0,0]=4 27073 B16R1.7389 CCSCCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000757381 [0,2,0,0,0,0|2,0,0]=4 27074 B16R1.7389 COCCCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000740836 [0,2,0,0,0,0|2,0,0]=4 27075 B16R1.7389 COCCCC(=O)Cc1cccc(c1)C#N 1458a_100000741012_100000233786 [0,2,0,0,0,0|2,0,0]=4 27076 B16R1.7389 COCCCC(=O)Cc1cccc(c1)C=O 1458a_100000741012_100009816774 [0,2,0,0,0,0|2,0,0]=4 27077 B16R1.7389 COCCCC(=O)Cc1cccc(c1)CO 1458a_100000741012_100010188025 [0,2,0,0,0,0|2,0,0]=4 27078 B16R1.7389 COCCCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000740836 [0,2,0,0,0,0|2,0,0]=4 27079 B16R1.7389 COCCCC(=O)Cc1cccc(c1)OC 1458a_100000741012_100000211672 [0,2,0,0,0,0|2,0,0]=4 27080 B16R1.7389 COCCCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000740836 [0,2,0,0,0,0|2,0,0]=4 27081 B16R1.7389 COCCNC(=O)Cc1cccc(c1)C#N 1626a_100000209980_100000684415 [0,2,0,0,0,0|2,0,0]=4 27082 B16R1.7389 COCCNC(=O)Cc1cccc(c1)C#N 240690a_100000209980_100000684415 [0,2,0,0,0,0|2,0,0]=4 27083 B16R1.7389 COCCNC(=O)Cc1cccc(c1)C#N 527a_100000209980_100000684415 [0,2,0,0,0,0|2,0,0]=4 27084 B16R1.7389 COCCNC(=O)Cc1cccc(c1)OC 1626a_100000209980_100000211281 [0,2,0,0,0,0|2,0,0]=4 27085 B16R1.7389 COCCNC(=O)Cc1cccc(c1)OC 240690a_100000209980_100000211281 [0,2,0,0,0,0|2,0,0]=4 27086 B16R1.7389 COCCNC(=O)Cc1cccc(c1)OC 527a_100000209980_100000211281 [0,2,0,0,0,0|2,0,0]=4 27087 B16R1.7389 COCCNC(=O)Cc1cccc(c1)SC 1626a_100000209980_100000035702 [0,2,0,0,0,0|2,0,0]=4 27088 B16R1.7389 COCCNC(=O)Cc1cccc(c1)SC 240690a_100000209980_100000035702 [0,2,0,0,0,0|2,0,0]=4 27089 B16R1.7389 COCCNC(=O)Cc1cccc(c1)SC 527a_100000209980_100000035702 [0,2,0,0,0,0|2,0,0]=4 27090 B16R1.7389 COc1cccc(c1)CC(=O)CCCCF 1458a_100000211281_100000729493 [0,2,0,0,0,0|2,0,0]=4 27091 B16R1.7389 COc1cccc(c1)CC(=O)CCCCO 1458a_100000211281_100000210776 [0,2,0,0,0,0|2,0,0]=4 27092 B16R1.7389 COc1cccc(c1)CC(=O)CCCCO 1458a_100000695505_100000211672 [0,2,0,0,0,0|2,0,0]=4 27093 B16R1.7389 COc1cccc(c1)CC(=O)CCCSC 1458a_100000173376_100000211672 [0,2,0,0,0,0|2,0,0]=4 27094 B16R1.7389 COc1cccc(c1)CC(=O)NCCCF 11a_100015189416_100000211281 [0,2,0,0,0,0|2,0,0]=4 27095 B16R1.7389 COc1cccc(c1)CC(=O)NCCCF 1626a_100015189416_100000211281 [0,2,0,0,0,0|2,0,0]=4 27096 B16R1.7389 COc1cccc(c1)CC(=O)NCCCF 240690a_100015189416_100000211281 [0,2,0,0,0,0|2,0,0]=4 27097 B16R1.7389 COc1cccc(c1)CC(=O)NCCCF 527a_100015189416_100000211281 [0,2,0,0,0,0|2,0,0]=4 27098 B16R1.7389 COc1cccc(c1)CC(=O)NCCCO 240690a_100000182051_100000211281 [0,2,0,0,0,0|2,0,0]=4 27099 B16R1.7389 COc1cccc(c1)CC(=O)NCCCO 527a_100000182051_100000211281 [0,2,0,0,0,0|2,0,0]=4 27100 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC 11a_100020590264_100000211281 [0,2,0,0,0,0|2,0,0]=4 27101 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC 1626a_100020590264_100000211281 [0,2,0,0,0,0|2,0,0]=4 27102 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC 240690a_100020590264_100000211281 [0,2,0,0,0,0|2,0,0]=4 27103 B16R1.7389 COc1cccc(c1)CC(=O)NCCSC 527a_100020590264_100000211281 [0,2,0,0,0,0|2,0,0]=4 27104 B16R1.7389 CSCCCC(=O)Cc1cccc(c1)C#N 1458a_100000173376_100000233786 [0,2,0,0,0,0|2,0,0]=4 27105 B16R1.7389 CSCCCC(=O)Cc1cccc(c1)C=O 1458a_100000173376_100009816774 [0,2,0,0,0,0|2,0,0]=4 27106 B16R1.7389 CSCCCC(=O)Cc1cccc(c1)CO 1458a_100000173376_100010188025 [0,2,0,0,0,0|2,0,0]=4 27107 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N 11a_100020590264_100000684415 [0,2,0,0,0,0|2,0,0]=4 27108 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N 1626a_100020590264_100000684415 [0,2,0,0,0,0|2,0,0]=4 27109 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N 240690a_100020590264_100000684415 [0,2,0,0,0,0|2,0,0]=4 27110 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)C#N 527a_100020590264_100000684415 [0,2,0,0,0,0|2,0,0]=4 27111 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC 11a_100020590264_100000035702 [0,2,0,0,0,0|2,0,0]=4 27112 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC 1626a_100020590264_100000035702 [0,2,0,0,0,0|2,0,0]=4 27113 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC 240690a_100020590264_100000035702 [0,2,0,0,0,0|2,0,0]=4 27114 B16R1.7389 CSCCNC(=O)Cc1cccc(c1)SC 527a_100020590264_100000035702 [0,2,0,0,0,0|2,0,0]=4 27115 B16R1.7389 CSc1cccc(c1)CC(=O)CCCCF 1458a_100000035702_100000729493 [0,2,0,0,0,0|2,0,0]=4 27116 B16R1.7389 CSc1cccc(c1)CC(=O)CCCCO 1458a_100000035702_100000210776 [0,2,0,0,0,0|2,0,0]=4 27117 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCF 11a_100015189416_100000035702 [0,2,0,0,0,0|2,0,0]=4 27118 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCF 1626a_100015189416_100000035702 [0,2,0,0,0,0|2,0,0]=4 27119 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCF 240690a_100015189416_100000035702 [0,2,0,0,0,0|2,0,0]=4 27120 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCF 527a_100015189416_100000035702 [0,2,0,0,0,0|2,0,0]=4 27121 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCO 240690a_100000182051_100000035702 [0,2,0,0,0,0|2,0,0]=4 27122 B16R1.7389 CSc1cccc(c1)CC(=O)NCCCO 527a_100000182051_100000035702 [0,2,0,0,0,0|2,0,0]=4 27123 B16R1.7389 N#Cc1cccc(c1)CC(=O)CCCCF 1458a_100000684415_100000729493 [0,2,0,0,0,0|2,0,0]=4 27124 B16R1.7389 N#Cc1cccc(c1)CC(=O)CCCCO 1458a_100000684415_100000210776 [0,2,0,0,0,0|2,0,0]=4 27125 B16R1.7389 N#Cc1cccc(c1)CC(=O)CCCCO 1458a_100000695505_100000233786 [0,2,0,0,0,0|2,0,0]=4 27126 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCF 11a_100015189416_100000684415 [0,2,0,0,0,0|2,0,0]=4 27127 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCF 1626a_100015189416_100000684415 [0,2,0,0,0,0|2,0,0]=4 27128 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCF 240690a_100015189416_100000684415 [0,2,0,0,0,0|2,0,0]=4 27129 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCF 527a_100015189416_100000684415 [0,2,0,0,0,0|2,0,0]=4 27130 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCO 240690a_100000182051_100000684415 [0,2,0,0,0,0|2,0,0]=4 27131 B16R1.7389 N#Cc1cccc(c1)CC(=O)NCCCO 527a_100000182051_100000684415 [0,2,0,0,0,0|2,0,0]=4 27132 B16R1.7389 O=C(CCCCO)Cc1cccc(c1)CO 1458a_100000695505_100010188025 [0,2,0,0,0,0|2,0,0]=4 27133 B16R1.7389 O=Cc1cccc(c1)CC(=O)CCCCO 1458a_100000695505_100009816774 [0,2,0,0,0,0|2,0,0]=4 27134 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011215641 [0,2,0,0,0,0|1,0,1]=4 27135 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100011215641 [0,2,0,0,0,0|1,0,1]=4 27136 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011215641 [0,2,0,0,0,0|1,0,1]=4 27137 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011215641 [0,2,0,0,0,0|1,0,1]=4 27138 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011215641 [0,2,0,0,0,0|1,0,1]=4 27139 B16R1.11236 CC(=O)CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011215641 [0,2,0,0,0,0|1,0,1]=4 27140 B16R1.11236 CC(=O)CCOC(=O)Nc1cccc(c1)Br 1458a_100000070787_100015757870 [0,2,0,0,0,0|1,0,1]=4 27141 B16R1.11236 CC(C)CCCC(=O)Cc1cc(ccn1)Br 1458a_100011216857_100010173614 [0,2,0,0,0,0|2,0,0]=4 27142 B16R1.11236 CC(C)CCCC(=O)Cc1cc(ccn1)Cl 1458a_100011216857_100016988179 [0,2,0,0,0,0|2,0,0]=4 27143 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011214892 [0,2,0,0,0,0|1,0,0]=3 27144 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)Br 1458a_100011216857_100000211773 [0,2,0,0,0,0|1,0,0]=3 27145 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011214892 [0,2,0,0,0,0|1,0,0]=3 27146 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)Cl 1458a_100011216857_100000181238 [0,2,0,0,0,0|1,0,0]=3 27147 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011214892 [0,2,0,0,0,0|1,0,0]=3 27148 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)F 1458a_100011216857_100000230114 [0,2,0,0,0,0|1,0,0]=3 27149 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011214892 [0,2,0,0,0,0|1,0,0]=3 27150 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)I 1458a_100011216857_100011218688 [0,2,0,0,0,0|1,0,0]=3 27151 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011214892 [0,2,0,0,0,0|1,0,0]=3 27152 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(c1)O 1458a_100011216857_100011660834 [0,2,0,0,0,0|1,0,0]=3 27153 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100011214892 [0,2,0,0,0,0|2,0,0]=4 27154 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)Br 1458a_100011216857_100009889011 [0,2,0,0,0,0|2,0,0]=4 27155 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100011214892 [0,2,0,0,0,0|2,0,0]=4 27156 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)Cl 1458a_100011216857_100000086093 [0,2,0,0,0,0|2,0,0]=4 27157 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)F 1458a_100000096803_100011214892 [0,2,0,0,0,0|2,0,0]=4 27158 B16R1.11236 CC(C)CCCC(=O)Cc1cccc(n1)F 1458a_100011216857_100009819644 [0,2,0,0,0,0|2,0,0]=4 27159 B16R1.11236 CC(C)CCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100011214892 [0,2,0,0,0,0|2,0,0]=4 27160 B16R1.11236 CC(C)CCCC(=O)Cc1ccnc(c1)Br 1458a_100011216857_100010243470 [0,2,0,0,0,0|2,0,0]=4 27161 B16R1.11236 CC(C)CCCC(=O)Cc1ccnc(c1)Cl 1458a_100011216857_100000764220 [0,2,0,0,0,0|2,0,0]=4 27162 B16R1.11236 CC(C)CCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100011214892 [0,2,0,0,0,0|2,0,0]=4 27163 B16R1.11236 CC(C)CCCC(=O)Cc1cncc(c1)Br 1458a_100011216857_100011740620 [0,2,0,0,0,0|2,0,0]=4 27164 B16R1.11236 CC(C)CCCC(=O)Cc1cncc(c1)Cl 1458a_100011216857_100016992070 [0,2,0,0,0,0|2,0,0]=4 27165 B16R1.11236 CC(C)CCCC(=O)Cc1cncc(c1)F 1458a_100011216857_100000725299 [0,2,0,0,0,0|2,0,0]=4 27166 B16R1.11236 CC(C)CCCC(=O)Cc1cncc(c1)F 1458a_100011667516_100011214892 [0,2,0,0,0,0|2,0,0]=4 27167 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100011216857 [0,2,0,0,0,0|2,0,0]=4 27168 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100011216857 [0,2,0,0,0,0|2,0,0]=4 27169 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100011216857 [0,2,0,0,0,0|2,0,0]=4 27170 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100011216857 [0,2,0,0,0,0|2,0,0]=4 27171 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100011216857 [0,2,0,0,0,0|2,0,0]=4 27172 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100011216857 [0,2,0,0,0,0|2,0,0]=4 27173 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100011216857 [0,2,0,0,0,0|2,0,0]=4 27174 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)F 11a_100000210047_100011216857 [0,2,0,0,0,0|2,0,0]=4 27175 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100011216857 [0,2,0,0,0,0|2,0,0]=4 27176 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)F 22a_100000210047_100011216857 [0,2,0,0,0,0|2,0,0]=4 27177 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)F 527a_100000210047_100011216857 [0,2,0,0,0,0|2,0,0]=4 27178 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I 11a_100000211102_100011216857 [0,2,0,0,0,0|2,0,0]=4 27179 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100011216857 [0,2,0,0,0,0|2,0,0]=4 27180 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I 22a_100000211102_100011216857 [0,2,0,0,0,0|2,0,0]=4 27181 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)I 527a_100000211102_100011216857 [0,2,0,0,0,0|2,0,0]=4 27182 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100011216857 [0,2,0,0,0,0|2,0,0]=4 27183 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)O 22a_100000210217_100011216857 [0,2,0,0,0,0|2,0,0]=4 27184 B16R1.11236 CC(C)CCCC(=O)Nc1cccc(c1)O 527a_100000210217_100011216857 [0,2,0,0,0,0|2,0,0]=4 27185 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Br 11a_100000210545_100000747190 [0,2,0,0,0,0|1,0,0]=3 27186 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Br 240690a_100000210545_100000747190 [0,2,0,0,0,0|1,0,0]=3 27187 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Br 527a_100000210545_100000747190 [0,2,0,0,0,0|1,0,0]=3 27188 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl 11a_100000210545_100000749307 [0,2,0,0,0,0|1,0,0]=3 27189 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl 1626a_100000210545_100000749307 [0,2,0,0,0,0|1,0,0]=3 27190 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl 240690a_100000210545_100000749307 [0,2,0,0,0,0|1,0,0]=3 27191 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)Cl 527a_100000210545_100000749307 [0,2,0,0,0,0|1,0,0]=3 27192 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F 11a_100000210545_100000211661 [0,2,0,0,0,0|1,0,0]=3 27193 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F 1626a_100000210545_100000211661 [0,2,0,0,0,0|1,0,0]=3 27194 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F 240690a_100000210545_100000211661 [0,2,0,0,0,0|1,0,0]=3 27195 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)F 527a_100000210545_100000211661 [0,2,0,0,0,0|1,0,0]=3 27196 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)I 11a_100000210545_100000238430 [0,2,0,0,0,0|1,0,0]=3 27197 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)I 1626a_100000210545_100000238430 [0,2,0,0,0,0|1,0,0]=3 27198 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)I 240690a_100000210545_100000238430 [0,2,0,0,0,0|1,0,0]=3 27199 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)I 527a_100000210545_100000238430 [0,2,0,0,0,0|1,0,0]=3 27200 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)O 240690a_100000210545_100000745134 [0,2,0,0,0,0|1,0,0]=3 27201 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(c1)O 527a_100000210545_100000745134 [0,2,0,0,0,0|1,0,0]=3 27202 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Br 11a_100000210545_100010201708 [0,2,0,0,0,0|2,0,0]=4 27203 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Br 240690a_100000210545_100010201708 [0,2,0,0,0,0|2,0,0]=4 27204 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Br 527a_100000210545_100010201708 [0,2,0,0,0,0|2,0,0]=4 27205 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Cl 11a_100000210545_100000090259 [0,2,0,0,0,0|2,0,0]=4 27206 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Cl 1626a_100000210545_100000090259 [0,2,0,0,0,0|2,0,0]=4 27207 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)Cl 240690a_100000210545_100000090259 [0,2,0,0,0,0|2,0,0]=4 27208 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)F 11a_100000210545_100000096803 [0,2,0,0,0,0|2,0,0]=4 27209 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)F 1626a_100000210545_100000096803 [0,2,0,0,0,0|2,0,0]=4 27210 B16R1.11236 CC(C)CCNC(=O)Cc1cccc(n1)F 240690a_100000210545_100000096803 [0,2,0,0,0,0|2,0,0]=4 27211 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Br 11a_100000210545_100010126891 [0,2,0,0,0,0|2,0,0]=4 27212 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Br 240690a_100000210545_100010126891 [0,2,0,0,0,0|2,0,0]=4 27213 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Br 527a_100000210545_100010126891 [0,2,0,0,0,0|2,0,0]=4 27214 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl 11a_100000210545_100000085289 [0,2,0,0,0,0|2,0,0]=4 27215 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl 1626a_100000210545_100000085289 [0,2,0,0,0,0|2,0,0]=4 27216 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl 240690a_100000210545_100000085289 [0,2,0,0,0,0|2,0,0]=4 27217 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl 527a_100000210545_100000085289 [0,2,0,0,0,0|2,0,0]=4 27218 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)Br 11a_100000210545_100000239331 [0,2,0,0,0,0|2,0,0]=4 27219 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)Br 240690a_100000210545_100000239331 [0,2,0,0,0,0|2,0,0]=4 27220 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)Br 527a_100000210545_100000239331 [0,2,0,0,0,0|2,0,0]=4 27221 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)F 11a_100000210545_100011667516 [0,2,0,0,0,0|2,0,0]=4 27222 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)F 240690a_100000210545_100011667516 [0,2,0,0,0,0|2,0,0]=4 27223 B16R1.11236 CC(C)CCNC(=O)Cc1cncc(c1)F 527a_100000210545_100011667516 [0,2,0,0,0,0|2,0,0]=4 27224 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100000210545 [0,2,0,0,0,0|2,0,0]=4 27225 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100000210545 [0,2,0,0,0,0|2,0,0]=4 27226 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100000210545 [0,2,0,0,0,0|2,0,0]=4 27227 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100000210545 [0,2,0,0,0,0|2,0,0]=4 27228 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)F 512a_100000210047_100000210545 [0,2,0,0,0,0|2,0,0]=4 27229 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100000210545 [0,2,0,0,0,0|2,0,0]=4 27230 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)I 512a_100000211102_100000210545 [0,2,0,0,0,0|2,0,0]=4 27231 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100000210545 [0,2,0,0,0,0|2,0,0]=4 27232 B16R1.11236 CC(C)CCNC(=O)Nc1cccc(c1)O 512a_100000210217_100000210545 [0,2,0,0,0,0|2,0,0]=4 27233 B16R1.11236 CC(C)CNNC(=O)Cc1cccc(c1)Br 22a_100000696102_100000747190 [0,2,0,0,0,0|2,0,0]=4 27234 B16R1.11236 CC(C)CNNC(=O)Cc1cccc(c1)Cl 22a_100000696102_100000749307 [0,2,0,0,0,0|2,0,0]=4 27235 B16R1.11236 CC(C)CNNC(=O)Cc1cccc(c1)F 22a_100000696102_100000211661 [0,2,0,0,0,0|2,0,0]=4 27236 B16R1.11236 CC(C)CNNC(=O)Cc1cccc(c1)I 22a_100000696102_100000238430 [0,2,0,0,0,0|2,0,0]=4 27237 B16R1.11236 CC(C)CNNC(=O)Cc1cccc(c1)O 22a_100000696102_100000745134 [0,2,0,0,0,0|2,0,0]=4 27238 B16R1.11236 CC(C)COCC(=O)Cc1cccc(c1)Br 1458a_100011223364_100000211773 [0,2,0,0,0,0|2,0,0]=4 27239 B16R1.11236 CC(C)COCC(=O)Cc1cccc(c1)Cl 1458a_100011223364_100000181238 [0,2,0,0,0,0|2,0,0]=4 27240 B16R1.11236 CC(C)COCC(=O)Cc1cccc(c1)F 1458a_100011223364_100000230114 [0,2,0,0,0,0|2,0,0]=4 27241 B16R1.11236 CC(C)COCC(=O)Cc1cccc(c1)I 1458a_100011223364_100011218688 [0,2,0,0,0,0|2,0,0]=4 27242 B16R1.11236 CC(C)COCC(=O)Cc1cccc(c1)O 1458a_100011223364_100011660834 [0,2,0,0,0,0|2,0,0]=4 27243 B16R1.11236 CC(C)OCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000211751 [0,2,0,0,0,0|2,0,0]=4 27244 B16R1.11236 CC(C)OCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000211751 [0,2,0,0,0,0|2,0,0]=4 27245 B16R1.11236 CC(C)OCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000211751 [0,2,0,0,0,0|2,0,0]=4 27246 B16R1.11236 CC(C)OCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000211751 [0,2,0,0,0,0|2,0,0]=4 27247 B16R1.11236 CC(C)OCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000211751 [0,2,0,0,0,0|2,0,0]=4 27248 B16R1.11236 CC(C)SCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000730970 [0,2,0,0,0,0|2,0,0]=4 27249 B16R1.11236 CC(C)SCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000730970 [0,2,0,0,0,0|2,0,0]=4 27250 B16R1.11236 CC(C)SCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000730970 [0,2,0,0,0,0|2,0,0]=4 27251 B16R1.11236 CC(C)SCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000730970 [0,2,0,0,0,0|2,0,0]=4 27252 B16R1.11236 CC(C)SCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000730970 [0,2,0,0,0,0|2,0,0]=4 27253 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000718107 [0,2,0,0,0,0|1,0,0]=3 27254 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000718107 [0,2,0,0,0,0|1,0,0]=3 27255 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_200000718107 [0,2,0,0,0,0|1,0,0]=3 27256 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_200000718107 [0,2,0,0,0,0|1,0,0]=3 27257 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_200000718107 [0,2,0,0,0,0|1,0,0]=3 27258 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000718107 [0,2,0,0,0,0|2,0,0]=4 27259 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000718107 [0,2,0,0,0,0|2,0,0]=4 27260 B16R1.11236 CC(O)CCCC(=O)Cc1cccc(n1)F 1458a_100000096803_200000718107 [0,2,0,0,0,0|2,0,0]=4 27261 B16R1.11236 CC(O)CCCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000718107 [0,2,0,0,0,0|2,0,0]=4 27262 B16R1.11236 CC(O)CCCC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000718107 [0,2,0,0,0,0|2,0,0]=4 27263 B16R1.11236 CC(O)CCCC(=O)Cc1cncc(c1)F 1458a_100011667516_200000718107 [0,2,0,0,0,0|2,0,0]=4 27264 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000761597 [0,2,0,0,0,0|2,0,0]=4 27265 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000761597 [0,2,0,0,0,0|2,0,0]=4 27266 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000761597 [0,2,0,0,0,0|2,0,0]=4 27267 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000761597 [0,2,0,0,0,0|2,0,0]=4 27268 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000761597 [0,2,0,0,0,0|2,0,0]=4 27269 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000761597 [0,2,0,0,0,0|2,0,0]=4 27270 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000761597 [0,2,0,0,0,0|2,0,0]=4 27271 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000761597 [0,2,0,0,0,0|2,0,0]=4 27272 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000761597 [0,2,0,0,0,0|2,0,0]=4 27273 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000761597 [0,2,0,0,0,0|2,0,0]=4 27274 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000761597 [0,2,0,0,0,0|2,0,0]=4 27275 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000761597 [0,2,0,0,0,0|2,0,0]=4 27276 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000761597 [0,2,0,0,0,0|2,0,0]=4 27277 B16R1.11236 CC(O)CCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000761597 [0,2,0,0,0,0|2,0,0]=4 27278 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)Br 240690a_200000755665_100000747190 [0,2,0,0,0,0|1,0,0]=3 27279 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)Br 527a_200000755665_100000747190 [0,2,0,0,0,0|1,0,0]=3 27280 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)Cl 240690a_200000755665_100000749307 [0,2,0,0,0,0|1,0,0]=3 27281 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)Cl 527a_200000755665_100000749307 [0,2,0,0,0,0|1,0,0]=3 27282 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)F 240690a_200000755665_100000211661 [0,2,0,0,0,0|1,0,0]=3 27283 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)F 527a_200000755665_100000211661 [0,2,0,0,0,0|1,0,0]=3 27284 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)I 240690a_200000755665_100000238430 [0,2,0,0,0,0|1,0,0]=3 27285 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)I 527a_200000755665_100000238430 [0,2,0,0,0,0|1,0,0]=3 27286 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)O 240690a_200000755665_100000745134 [0,2,0,0,0,0|1,0,0]=3 27287 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(c1)O 527a_200000755665_100000745134 [0,2,0,0,0,0|1,0,0]=3 27288 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(n1)Br 240690a_200000755665_100010201708 [0,2,0,0,0,0|2,0,0]=4 27289 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(n1)Br 527a_200000755665_100010201708 [0,2,0,0,0,0|2,0,0]=4 27290 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(n1)Cl 240690a_200000755665_100000090259 [0,2,0,0,0,0|2,0,0]=4 27291 B16R1.11236 CC(O)CCNC(=O)Cc1cccc(n1)F 240690a_200000755665_100000096803 [0,2,0,0,0,0|2,0,0]=4 27292 B16R1.11236 CC(O)CCNC(=O)Cc1ccnc(c1)Br 240690a_200000755665_100010126891 [0,2,0,0,0,0|2,0,0]=4 27293 B16R1.11236 CC(O)CCNC(=O)Cc1ccnc(c1)Br 527a_200000755665_100010126891 [0,2,0,0,0,0|2,0,0]=4 27294 B16R1.11236 CC(O)CCNC(=O)Cc1ccnc(c1)Cl 240690a_200000755665_100000085289 [0,2,0,0,0,0|2,0,0]=4 27295 B16R1.11236 CC(O)CCNC(=O)Cc1ccnc(c1)Cl 527a_200000755665_100000085289 [0,2,0,0,0,0|2,0,0]=4 27296 B16R1.11236 CC(O)CCNC(=O)Cc1cncc(c1)Br 240690a_200000755665_100000239331 [0,2,0,0,0,0|2,0,0]=4 27297 B16R1.11236 CC(O)CCNC(=O)Cc1cncc(c1)Br 527a_200000755665_100000239331 [0,2,0,0,0,0|2,0,0]=4 27298 B16R1.11236 CC(O)CCNC(=O)Cc1cncc(c1)F 240690a_200000755665_100011667516 [0,2,0,0,0,0|2,0,0]=4 27299 B16R1.11236 CC(O)CCNC(=O)Cc1cncc(c1)F 527a_200000755665_100011667516 [0,2,0,0,0,0|2,0,0]=4 27300 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_200000755665 [0,2,0,0,0,0|2,0,0]=4 27301 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)Br 512a_100000210019_200000755665 [0,2,0,0,0,0|2,0,0]=4 27302 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_200000755665 [0,2,0,0,0,0|2,0,0]=4 27303 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)F 2430a_100000210047_200000755665 [0,2,0,0,0,0|2,0,0]=4 27304 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)F 512a_100000210047_200000755665 [0,2,0,0,0,0|2,0,0]=4 27305 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)I 2430a_100000211102_200000755665 [0,2,0,0,0,0|2,0,0]=4 27306 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)I 512a_100000211102_200000755665 [0,2,0,0,0,0|2,0,0]=4 27307 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)O 2430a_100000210217_200000755665 [0,2,0,0,0,0|2,0,0]=4 27308 B16R1.11236 CC(O)CCNC(=O)Nc1cccc(c1)O 512a_100000210217_200000755665 [0,2,0,0,0,0|2,0,0]=4 27309 B16R1.11236 CC(O)CNNC(=O)Cc1cccc(c1)Br 22a_200000730056_100000747190 [0,2,0,0,0,0|2,0,0]=4 27310 B16R1.11236 CC(O)CNNC(=O)Cc1cccc(c1)Cl 22a_200000730056_100000749307 [0,2,0,0,0,0|2,0,0]=4 27311 B16R1.11236 CC(O)CNNC(=O)Cc1cccc(c1)F 22a_200000730056_100000211661 [0,2,0,0,0,0|2,0,0]=4 27312 B16R1.11236 CC(O)CNNC(=O)Cc1cccc(c1)I 22a_200000730056_100000238430 [0,2,0,0,0,0|2,0,0]=4 27313 B16R1.11236 CC(O)CNNC(=O)Cc1cccc(c1)O 22a_200000730056_100000745134 [0,2,0,0,0,0|2,0,0]=4 27314 B16R1.11236 CN(C)CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000695564 [0,2,0,0,0,0|2,0,0]=4 27315 B16R1.11236 CN(C)CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000695564 [0,2,0,0,0,0|2,0,0]=4 27316 B16R1.11236 CN(C)CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000695564 [0,2,0,0,0,0|2,0,0]=4 27317 B16R1.11236 CN(C)CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000695564 [0,2,0,0,0,0|2,0,0]=4 27318 B16R1.11236 CN(C)CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000695564 [0,2,0,0,0,0|2,0,0]=4 27319 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Br 240690a_100000210585_100000747190 [0,2,0,0,0,0|2,0,0]=4 27320 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Br 527a_100000210585_100000747190 [0,2,0,0,0,0|2,0,0]=4 27321 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl 240690a_100000210585_100000749307 [0,2,0,0,0,0|2,0,0]=4 27322 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl 527a_100000210585_100000749307 [0,2,0,0,0,0|2,0,0]=4 27323 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)F 240690a_100000210585_100000211661 [0,2,0,0,0,0|2,0,0]=4 27324 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)F 527a_100000210585_100000211661 [0,2,0,0,0,0|2,0,0]=4 27325 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)I 240690a_100000210585_100000238430 [0,2,0,0,0,0|2,0,0]=4 27326 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)I 527a_100000210585_100000238430 [0,2,0,0,0,0|2,0,0]=4 27327 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)O 240690a_100000210585_100000745134 [0,2,0,0,0,0|2,0,0]=4 27328 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)O 527a_100000210585_100000745134 [0,2,0,0,0,0|2,0,0]=4 27329 B16R1.11236 CN(C)CCOC(=O)Nc1cccc(c1)Br 269982a_100102631434_100015757870 [0,2,0,0,0,0|2,0,0]=4 27330 B16R1.11236 Cc1cc(ccn1)CC(=O)CCCC(C)C 1458a_100011216857_200020672517 [0,2,0,0,0,0|2,0,0]=4 27331 B16R1.11236 Cc1cccc(c1)CC(=O)CCCC(C)C 1458a_100011206899_100011214892 [0,2,0,0,0,0|1,0,0]=3 27332 B16R1.11236 Cc1cccc(c1)CC(=O)CCCC(C)C 1458a_100011216857_100000211840 [0,2,0,0,0,0|1,0,0]=3 27333 B16R1.11236 Cc1cccc(c1)CC(=O)CCCC(C)O 1458a_100011206899_200000718107 [0,2,0,0,0,0|1,0,0]=3 27334 B16R1.11236 Cc1cccc(c1)CC(=O)CCCN(C)C 1458a_100011206899_100000695564 [0,2,0,0,0,0|2,0,0]=4 27335 B16R1.11236 Cc1cccc(c1)CC(=O)CCOC(C)C 1458a_100011206899_100000211751 [0,2,0,0,0,0|2,0,0]=4 27336 B16R1.11236 Cc1cccc(c1)CC(=O)CCSC(C)C 1458a_100011206899_100000730970 [0,2,0,0,0,0|2,0,0]=4 27337 B16R1.11236 Cc1cccc(c1)CC(=O)COCC(C)C 1458a_100011223364_100000211840 [0,2,0,0,0,0|2,0,0]=4 27338 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C 11a_100000210545_100011206899 [0,2,0,0,0,0|1,0,0]=3 27339 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C 1626a_100000210545_100011206899 [0,2,0,0,0,0|1,0,0]=3 27340 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C 240690a_100000210545_100011206899 [0,2,0,0,0,0|1,0,0]=3 27341 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)C 527a_100000210545_100011206899 [0,2,0,0,0,0|1,0,0]=3 27342 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)O 240690a_200000755665_100011206899 [0,2,0,0,0,0|1,0,0]=3 27343 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(C)O 527a_200000755665_100011206899 [0,2,0,0,0,0|1,0,0]=3 27344 B16R1.11236 Cc1cccc(c1)CC(=O)NCCN(C)C 240690a_100000210585_100011206899 [0,2,0,0,0,0|2,0,0]=4 27345 B16R1.11236 Cc1cccc(c1)CC(=O)NCCN(C)C 527a_100000210585_100011206899 [0,2,0,0,0,0|2,0,0]=4 27346 B16R1.11236 Cc1cccc(c1)CC(=O)NNCC(C)C 22a_100000696102_100011206899 [0,2,0,0,0,0|2,0,0]=4 27347 B16R1.11236 Cc1cccc(c1)CC(=O)NNCC(C)O 22a_200000730056_100011206899 [0,2,0,0,0,0|2,0,0]=4 27348 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C 11a_100000188690_100011216857 [0,2,0,0,0,0|2,0,0]=4 27349 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C 1626a_100000188690_100011216857 [0,2,0,0,0,0|2,0,0]=4 27350 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C 22a_100000188690_100011216857 [0,2,0,0,0,0|2,0,0]=4 27351 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)C 527a_100000188690_100011216857 [0,2,0,0,0,0|2,0,0]=4 27352 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)O 1626a_100000188690_100000761597 [0,2,0,0,0,0|2,0,0]=4 27353 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)O 22a_100000188690_100000761597 [0,2,0,0,0,0|2,0,0]=4 27354 B16R1.11236 Cc1cccc(c1)NC(=O)CCCC(C)O 527a_100000188690_100000761597 [0,2,0,0,0,0|2,0,0]=4 27355 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)C 2430a_100000188690_100000210545 [0,2,0,0,0,0|2,0,0]=4 27356 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)C 512a_100000188690_100000210545 [0,2,0,0,0,0|2,0,0]=4 27357 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)O 2430a_100000188690_200000755665 [0,2,0,0,0,0|2,0,0]=4 27358 B16R1.11236 Cc1cccc(c1)NC(=O)NCCC(C)O 512a_100000188690_200000755665 [0,2,0,0,0,0|2,0,0]=4 27359 B16R1.11236 Cc1cccc(n1)CC(=O)CCCC(C)C 1458a_100011216857_100000757606 [0,2,0,0,0,0|2,0,0]=4 27360 B16R1.11236 Cc1cccc(n1)CC(=O)CCCC(C)C 1458a_100012001110_100011214892 [0,2,0,0,0,0|2,0,0]=4 27361 B16R1.11236 Cc1cccc(n1)CC(=O)CCCC(C)O 1458a_100012001110_200000718107 [0,2,0,0,0,0|2,0,0]=4 27362 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C 11a_100000210545_100012001110 [0,2,0,0,0,0|2,0,0]=4 27363 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C 1626a_100000210545_100012001110 [0,2,0,0,0,0|2,0,0]=4 27364 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C 240690a_100000210545_100012001110 [0,2,0,0,0,0|2,0,0]=4 27365 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)C 527a_100000210545_100012001110 [0,2,0,0,0,0|2,0,0]=4 27366 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)O 240690a_200000755665_100012001110 [0,2,0,0,0,0|2,0,0]=4 27367 B16R1.11236 Cc1cccc(n1)CC(=O)NCCC(C)O 527a_200000755665_100012001110 [0,2,0,0,0,0|2,0,0]=4 27368 B16R1.11236 Cc1ccnc(c1)CC(=O)CCCC(C)C 1458a_100011216857_100000718516 [0,2,0,0,0,0|2,0,0]=4 27369 B16R1.11236 Cc1cncc(c1)CC(=O)CCCC(C)C 1458a_100011216857_100000716715 [0,2,0,0,0,0|2,0,0]=4 27370 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Br 270084a_100000102301_100000726588 [0,2,0,0,0,0|2,0,0]=4 27371 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Br 274078a_100000102301_100000726588 [0,2,0,0,0,0|2,0,0]=4 27372 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)C 270084a_100000102301_100000743697 [0,2,0,0,0,0|2,0,0]=4 27373 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)C 274078a_100000102301_100000743697 [0,2,0,0,0,0|2,0,0]=4 27374 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)C 40a_100000102301_100015207158 [0,2,0,0,0,0|2,0,0]=4 27375 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Cl 270084a_100000102301_100000725668 [0,2,0,0,0,0|2,0,0]=4 27376 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)Cl 274078a_100000102301_100000725668 [0,2,0,0,0,0|2,0,0]=4 27377 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)F 270084a_100000102301_100000750188 [0,2,0,0,0,0|2,0,0]=4 27378 B16R1.20523 CCCCNS(=O)(=O)Cc1cccc(c1)F 274078a_100000102301_100000750188 [0,2,0,0,0,0|2,0,0]=4 27379 B16R1.945 CCCC(C)C(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000766640 [0,2,0,0,0,0|2,0,0]=4 27380 B16R1.1127 CCC(C)CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000748023 [0,2,0,0,0,0|2,0,0]=4 27381 B16R1.1127 CCC(C)CN(C)C(=O)C[n+]1ccccc1 11a_100000753921_200000086051 [0,2,0,0,0,0|2,0,0]=4 27382 B16R1.1127 CCC(C)CN(C)C(=O)C[n+]1ccccc1 240690a_100000753921_200000086051 [0,2,0,0,0,0|2,0,0]=4 27383 B16R1.1127 CCC(C)CN(C)C(=O)C[n+]1ccccc1 527a_100000753921_200000086051 [0,2,0,0,0,0|2,0,0]=4 27384 B16R1.1127 CCC(C)CN(C)C(=O)Cc1ccccn1 11a_100000753921_100000233486 [0,2,0,0,0,0|2,0,0]=4 27385 B16R1.1127 CCC(C)CN(C)C(=O)Cc1cccnc1 11a_100000753921_100000737805 [0,2,0,0,0,0|2,0,0]=4 27386 B16R1.1127 CCC(C)CN(C)C(=O)Cc1cccnc1 240690a_100000753921_100000737805 [0,2,0,0,0,0|2,0,0]=4 27387 B16R1.1127 CCC(C)CN(C)C(=O)Cc1cccnc1 527a_100000753921_100000737805 [0,2,0,0,0,0|2,0,0]=4 27388 B16R1.1127 CCC(C)CN(C)C(=O)Cc1ccncc1 11a_100000753921_100011201483 [0,2,0,0,0,0|2,0,0]=4 27389 B16R1.1127 CCC(C)CN(C)C(=O)Cc1ccncc1 240690a_100000753921_100011201483 [0,2,0,0,0,0|2,0,0]=4 27390 B16R1.1127 CCC(C)CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000753921 [0,2,0,0,0,0|2,0,0]=4 27391 B16R1.1127 CCC(C)NC(=O)C(=O)Cc1ccccc1 1458a_200011297154_100015291786 [0,2,0,0,0,0|2,0,0]=4 27392 B16R1.1127 CCC(O)CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100011218378 [0,2,0,0,0,0|2,0,0]=4 27393 B16R1.1127 CCN(C)CC(C)C(=O)Cc1ccccc1 1458a_200015185930_100015291786 [0,2,0,0,0,0|2,0,0]=4 27394 B16R1.1127 CC[C@H](C)CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100009816398 [0,2,0,0,0,0|2,0,0]=4 27395 B16R1.1284 CC(C)CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210312 [0,2,0,0,0,0|2,0,0]=4 27396 B16R1.1284 CC(C)CCC(C)C(=O)C[n+]1ccccc1 1458a_200000086051_100011261404 [0,2,0,0,0,0|2,0,0]=4 27397 B16R1.1284 CC(C)CCC(C)C(=O)Cc1ccccn1 1458a_100000233486_100011261404 [0,2,0,0,0,0|2,0,0]=4 27398 B16R1.1284 CC(C)CCC(C)C(=O)Cc1cccnc1 1458a_100000737805_100011261404 [0,2,0,0,0,0|2,0,0]=4 27399 B16R1.1284 CC(C)CCN(C)C(=O)C[n+]1ccccc1 11a_100000742789_200000086051 [0,2,0,0,0,0|2,0,0]=4 27400 B16R1.1284 CC(C)CCN(C)C(=O)C[n+]1ccccc1 240690a_100000742789_200000086051 [0,2,0,0,0,0|2,0,0]=4 27401 B16R1.1284 CC(C)CCN(C)C(=O)C[n+]1ccccc1 527a_100000742789_200000086051 [0,2,0,0,0,0|2,0,0]=4 27402 B16R1.1284 CC(C)CCN(C)C(=O)Cc1ccccn1 11a_100000742789_100000233486 [0,2,0,0,0,0|2,0,0]=4 27403 B16R1.1284 CC(C)CCN(C)C(=O)Cc1cccnc1 11a_100000742789_100000737805 [0,2,0,0,0,0|2,0,0]=4 27404 B16R1.1284 CC(C)CCN(C)C(=O)Cc1cccnc1 240690a_100000742789_100000737805 [0,2,0,0,0,0|2,0,0]=4 27405 B16R1.1284 CC(C)CCN(C)C(=O)Cc1cccnc1 527a_100000742789_100000737805 [0,2,0,0,0,0|2,0,0]=4 27406 B16R1.1284 CC(C)CCN(C)C(=O)Cc1ccncc1 11a_100000742789_100011201483 [0,2,0,0,0,0|2,0,0]=4 27407 B16R1.1284 CC(C)CCN(C)C(=O)Cc1ccncc1 240690a_100000742789_100011201483 [0,2,0,0,0,0|2,0,0]=4 27408 B16R1.1284 CC(C)CCN(C)C(=O)Nc1ccccc1 2430a_100000106764_100000742789 [0,2,0,0,0,0|2,0,0]=4 27409 B16R1.1284 CC(C)CNC(=O)C(=O)Cc1ccccc1 1458a_200011297155_100015291786 [0,2,0,0,0,0|2,0,0]=4 27410 B16R1.1284 CC(O)CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100012276601 [0,2,0,0,0,0|2,0,0]=4 27411 B16R1.1793 CCCCN(C)S(=O)(=O)Cc1ccccc1 270084a_100000207549_100000211737 [0,2,0,0,0,0|2,0,0]=4 27412 B16R1.1793 CCCCN(C)S(=O)(=O)Cc1ccccc1 274078a_100000207549_100000211737 [0,2,0,0,0,0|2,0,0]=4 27413 B16R1.1793 CCCCN(C)S(=O)(=O)Cc1ccccc1 40a_100000207549_100000235865 [0,2,0,0,0,0|2,0,0]=4 27414 B16R1.4510 CCCCC(CC)C(=O)C[n+]1ccccc1 1458a_200000086051_200011216223 [0,2,0,0,0,0|2,0,0]=4 27415 B16R1.4510 CCCCC(CC)C(=O)Cc1ccccc1 1458a_100000211130_100015291786 [0,2,0,0,0,0|1,0,0]=3 27416 B16R1.4510 CCCCC(CC)C(=O)Cc1ccccn1 1458a_100000211130_100000721315 [0,2,0,0,0,0|2,0,0]=4 27417 B16R1.4510 CCCCC(CC)C(=O)Cc1ccccn1 1458a_100000233486_200011216223 [0,2,0,0,0,0|2,0,0]=4 27418 B16R1.4510 CCCCC(CC)C(=O)Cc1cccnc1 1458a_100000211130_100000733263 [0,2,0,0,0,0|2,0,0]=4 27419 B16R1.4510 CCCCC(CC)C(=O)Cc1cccnc1 1458a_100000737805_200011216223 [0,2,0,0,0,0|2,0,0]=4 27420 B16R1.4510 CCCCC(CC)C(=O)Cc1ccncc1 1458a_100000211130_100000705612 [0,2,0,0,0,0|2,0,0]=4 27421 B16R1.4510 CCCCC(CC)C(=O)Nc1ccccc1 11a_100000106764_100000211130 [0,2,0,0,0,0|2,0,0]=4 27422 B16R1.4510 CCCCC(CC)C(=O)Nc1ccccc1 1626a_100000106764_100000211130 [0,2,0,0,0,0|2,0,0]=4 27423 B16R1.4510 CCCCC(CC)C(=O)Nc1ccccc1 22a_100000106764_100000211130 [0,2,0,0,0,0|2,0,0]=4 27424 B16R1.4510 CCCCC(CC)C(=O)Nc1ccccc1 527a_100000106764_100000211130 [0,2,0,0,0,0|2,0,0]=4 27425 B16R1.4510 CCCCN(CC)C(=O)C[n+]1ccccc1 11a_100000207695_200000086051 [0,2,0,0,0,0|2,0,0]=4 27426 B16R1.4510 CCCCN(CC)C(=O)C[n+]1ccccc1 240690a_100000207695_200000086051 [0,2,0,0,0,0|2,0,0]=4 27427 B16R1.4510 CCCCN(CC)C(=O)C[n+]1ccccc1 527a_100000207695_200000086051 [0,2,0,0,0,0|2,0,0]=4 27428 B16R1.4510 CCCCN(CC)C(=O)Cc1ccccn1 11a_100000207695_100000233486 [0,2,0,0,0,0|2,0,0]=4 27429 B16R1.4510 CCCCN(CC)C(=O)Cc1cccnc1 11a_100000207695_100000737805 [0,2,0,0,0,0|2,0,0]=4 27430 B16R1.4510 CCCCN(CC)C(=O)Cc1cccnc1 240690a_100000207695_100000737805 [0,2,0,0,0,0|2,0,0]=4 27431 B16R1.4510 CCCCN(CC)C(=O)Cc1cccnc1 527a_100000207695_100000737805 [0,2,0,0,0,0|2,0,0]=4 27432 B16R1.4510 CCCCN(CC)C(=O)Cc1ccncc1 11a_100000207695_100011201483 [0,2,0,0,0,0|2,0,0]=4 27433 B16R1.4510 CCCCN(CC)C(=O)Cc1ccncc1 240690a_100000207695_100011201483 [0,2,0,0,0,0|2,0,0]=4 27434 B16R1.4510 CCCCN(CC)C(=O)Nc1ccccc1 2430a_100000106764_100000207695 [0,2,0,0,0,0|2,0,0]=4 27435 B16R1.7523 CCC/C=C(\C)/C(=O)Cc1ccccc1Br 1458a_200020648666_100000184730 [0,2,0,0,0,0|1,0,1]=4 27436 B16R1.7523 CCC/C=C(\C)/C(=O)Cc1ccccc1C 1458a_200020648666_100000211839 [0,2,0,0,0,0|1,0,1]=4 27437 B16R1.7523 CCC/C=C(\C)/C(=O)Cc1ccccc1Cl 1458a_200020648666_100000187162 [0,2,0,0,0,0|1,0,1]=4 27438 B16R1.7523 CCC/C=C(\C)/C(=O)Cc1ccccc1F 1458a_200020648666_100000187165 [0,2,0,0,0,0|1,0,1]=4 27439 B16R1.7523 CCC/C=C(\C)/C(=O)Cc1ccccc1I 1458a_200020648666_100011216222 [0,2,0,0,0,0|1,0,1]=4 27440 B16R1.7523 CCCCC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_100000210211 [0,2,0,0,0,0|2,0,0]=4 27441 B16R1.7523 CCCCC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_100000210211 [0,2,0,0,0,0|2,0,0]=4 27442 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Br 1458a_100000725509_100000184730 [0,2,0,0,0,0|1,0,0]=3 27443 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Br 1458a_100000751119_200011215066 [0,2,0,0,0,0|1,0,0]=3 27444 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1C 1458a_100000212180_200011215066 [0,2,0,0,0,0|1,0,0]=3 27445 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1C 1458a_100000725509_100000211839 [0,2,0,0,0,0|1,0,0]=3 27446 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Cl 1458a_100000183793_200011215066 [0,2,0,0,0,0|1,0,0]=3 27447 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1Cl 1458a_100000725509_100000187162 [0,2,0,0,0,0|1,0,0]=3 27448 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1F 1458a_100000212012_200011215066 [0,2,0,0,0,0|1,0,0]=3 27449 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1F 1458a_100000725509_100000187165 [0,2,0,0,0,0|1,0,0]=3 27450 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1I 1458a_100000036491_200011215066 [0,2,0,0,0,0|1,0,0]=3 27451 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1I 1458a_100000725509_100011216222 [0,2,0,0,0,0|1,0,0]=3 27452 B16R1.7523 CCCCC(C)C(=O)Cc1ccccc1O 1458a_100000743006_200011215066 [0,2,0,0,0,0|1,0,0]=3 27453 B16R1.7523 CCCCC(C)C(=O)Cc1cccnc1Br 1458a_100000725509_100010140945 [0,2,0,0,0,0|2,0,0]=4 27454 B16R1.7523 CCCCC(C)C(=O)Cc1cccnc1C 1458a_100000725509_100000732876 [0,2,0,0,0,0|2,0,0]=4 27455 B16R1.7523 CCCCC(C)C(=O)Cc1cccnc1Cl 1458a_100000093521_200011215066 [0,2,0,0,0,0|2,0,0]=4 27456 B16R1.7523 CCCCC(C)C(=O)Cc1cccnc1Cl 1458a_100000725509_100000045678 [0,2,0,0,0,0|2,0,0]=4 27457 B16R1.7523 CCCCC(C)C(=O)Cc1cccnc1F 1458a_100000725509_100000099810 [0,2,0,0,0,0|2,0,0]=4 27458 B16R1.7523 CCCCC(C)C(=O)Cc1ccncc1C 1458a_100000725509_100020672808 [0,2,0,0,0,0|2,0,0]=4 27459 B16R1.7523 CCCCC(C)C(=O)Cc1ccncc1Cl 1458a_100000725509_100000763264 [0,2,0,0,0,0|2,0,0]=4 27460 B16R1.7523 CCCCC(C)C(=O)Cc1cnccc1C 1458a_100000725509_100000690890 [0,2,0,0,0,0|2,0,0]=4 27461 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1Br 1458a_100000725509_100025702911 [0,2,0,0,0,0|2,0,0]=4 27462 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1Br 1458a_200012357574_200011215066 [0,2,0,0,0,0|2,0,0]=4 27463 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1C 1458a_100000725509_100000696600 [0,2,0,0,0,0|2,0,0]=4 27464 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1C 1458a_200000722269_200011215066 [0,2,0,0,0,0|2,0,0]=4 27465 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1Cl 1458a_100000725509_100000099807 [0,2,0,0,0,0|2,0,0]=4 27466 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1Cl 1458a_100011998755_200011215066 [0,2,0,0,0,0|2,0,0]=4 27467 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1F 1458a_100000725509_100000104219 [0,2,0,0,0,0|2,0,0]=4 27468 B16R1.7523 CCCCC(C)C(=O)Cc1ncccc1O 1458a_100000725509_200020655725 [0,2,0,0,0,0|2,0,0]=4 27469 B16R1.7523 CCCCC(C)C(=O)Cn1ccccc1=O 1458a_100000189665_200011215066 [0,2,0,0,0,0|2,0,0]=4 27470 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000725509 [0,2,0,0,0,0|2,0,0]=4 27471 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000725509 [0,2,0,0,0,0|2,0,0]=4 27472 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 11a_100015192222_100000725509 [0,2,0,0,0,0|2,0,0]=4 27473 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 1626a_100015192222_100000725509 [0,2,0,0,0,0|2,0,0]=4 27474 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 22a_100015192222_100000725509 [0,2,0,0,0,0|2,0,0]=4 27475 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1C 527a_100015192222_100000725509 [0,2,0,0,0,0|2,0,0]=4 27476 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000725509 [0,2,0,0,0,0|2,0,0]=4 27477 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000725509 [0,2,0,0,0,0|2,0,0]=4 27478 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000725509 [0,2,0,0,0,0|2,0,0]=4 27479 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1Cl 527a_100000185783_100000725509 [0,2,0,0,0,0|2,0,0]=4 27480 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 11a_100000210422_100000725509 [0,2,0,0,0,0|2,0,0]=4 27481 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000725509 [0,2,0,0,0,0|2,0,0]=4 27482 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 22a_100000210422_100000725509 [0,2,0,0,0,0|2,0,0]=4 27483 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1F 527a_100000210422_100000725509 [0,2,0,0,0,0|2,0,0]=4 27484 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1I 11a_100000210053_100000725509 [0,2,0,0,0,0|2,0,0]=4 27485 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000725509 [0,2,0,0,0,0|2,0,0]=4 27486 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1O 22a_100000185747_100000725509 [0,2,0,0,0,0|2,0,0]=4 27487 B16R1.7523 CCCCC(C)C(=O)Nc1ccccc1O 527a_100000185747_100000725509 [0,2,0,0,0,0|2,0,0]=4 27488 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1Br 1458a_100000720857_100000184730 [0,2,0,0,0,0|1,0,0]=3 27489 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1C 1458a_100000720857_100000211839 [0,2,0,0,0,0|1,0,0]=3 27490 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1Cl 1458a_100000720857_100000187162 [0,2,0,0,0,0|1,0,0]=3 27491 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1F 1458a_100000720857_100000187165 [0,2,0,0,0,0|1,0,0]=3 27492 B16R1.7523 CCCCC(O)C(=O)Cc1ccccc1I 1458a_100000720857_100011216222 [0,2,0,0,0,0|1,0,0]=3 27493 B16R1.7523 CCCCC(O)C(=O)Cc1cccnc1Br 1458a_100000720857_100010140945 [0,2,0,0,0,0|2,0,0]=4 27494 B16R1.7523 CCCCC(O)C(=O)Cc1cccnc1C 1458a_100000720857_100000732876 [0,2,0,0,0,0|2,0,0]=4 27495 B16R1.7523 CCCCC(O)C(=O)Cc1cccnc1Cl 1458a_100000720857_100000045678 [0,2,0,0,0,0|2,0,0]=4 27496 B16R1.7523 CCCCC(O)C(=O)Cc1cccnc1F 1458a_100000720857_100000099810 [0,2,0,0,0,0|2,0,0]=4 27497 B16R1.7523 CCCCC(O)C(=O)Cc1ccncc1C 1458a_100000720857_100020672808 [0,2,0,0,0,0|2,0,0]=4 27498 B16R1.7523 CCCCC(O)C(=O)Cc1ccncc1Cl 1458a_100000720857_100000763264 [0,2,0,0,0,0|2,0,0]=4 27499 B16R1.7523 CCCCC(O)C(=O)Cc1cnccc1C 1458a_100000720857_100000690890 [0,2,0,0,0,0|2,0,0]=4 27500 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1Br 1458a_100000720857_100025702911 [0,2,0,0,0,0|2,0,0]=4 27501 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1C 1458a_100000720857_100000696600 [0,2,0,0,0,0|2,0,0]=4 27502 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1Cl 1458a_100000720857_100000099807 [0,2,0,0,0,0|2,0,0]=4 27503 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1F 1458a_100000720857_100000104219 [0,2,0,0,0,0|2,0,0]=4 27504 B16R1.7523 CCCCC(O)C(=O)Cc1ncccc1O 1458a_100000720857_200020655725 [0,2,0,0,0,0|2,0,0]=4 27505 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C 22a_100015192222_100000720857 [0,2,0,0,0,0|2,0,0]=4 27506 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1C 527a_100015192222_100000720857 [0,2,0,0,0,0|2,0,0]=4 27507 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl 22a_100000185783_100000720857 [0,2,0,0,0,0|2,0,0]=4 27508 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1Cl 527a_100000185783_100000720857 [0,2,0,0,0,0|2,0,0]=4 27509 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1F 22a_100000210422_100000720857 [0,2,0,0,0,0|2,0,0]=4 27510 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1F 527a_100000210422_100000720857 [0,2,0,0,0,0|2,0,0]=4 27511 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1O 22a_100000185747_100000720857 [0,2,0,0,0,0|2,0,0]=4 27512 B16R1.7523 CCCCC(O)C(=O)Nc1ccccc1O 527a_100000185747_100000720857 [0,2,0,0,0,0|2,0,0]=4 27513 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 11a_100000207549_100000751119 [0,2,0,0,0,0|1,0,0]=3 27514 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 240690a_100000207549_100000751119 [0,2,0,0,0,0|1,0,0]=3 27515 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Br 527a_100000207549_100000751119 [0,2,0,0,0,0|1,0,0]=3 27516 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 11a_100000207549_100000212180 [0,2,0,0,0,0|1,0,0]=3 27517 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 1626a_100000207549_100000212180 [0,2,0,0,0,0|1,0,0]=3 27518 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 240690a_100000207549_100000212180 [0,2,0,0,0,0|1,0,0]=3 27519 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1C 527a_100000207549_100000212180 [0,2,0,0,0,0|1,0,0]=3 27520 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 11a_100000207549_100000183793 [0,2,0,0,0,0|1,0,0]=3 27521 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 1626a_100000207549_100000183793 [0,2,0,0,0,0|1,0,0]=3 27522 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 240690a_100000207549_100000183793 [0,2,0,0,0,0|1,0,0]=3 27523 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1Cl 527a_100000207549_100000183793 [0,2,0,0,0,0|1,0,0]=3 27524 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 11a_100000207549_100000212012 [0,2,0,0,0,0|1,0,0]=3 27525 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 1626a_100000207549_100000212012 [0,2,0,0,0,0|1,0,0]=3 27526 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 240690a_100000207549_100000212012 [0,2,0,0,0,0|1,0,0]=3 27527 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1F 527a_100000207549_100000212012 [0,2,0,0,0,0|1,0,0]=3 27528 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 11a_100000207549_100000036491 [0,2,0,0,0,0|1,0,0]=3 27529 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 1626a_100000207549_100000036491 [0,2,0,0,0,0|1,0,0]=3 27530 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 240690a_100000207549_100000036491 [0,2,0,0,0,0|1,0,0]=3 27531 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1I 527a_100000207549_100000036491 [0,2,0,0,0,0|1,0,0]=3 27532 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1O 240690a_100000207549_100000743006 [0,2,0,0,0,0|1,0,0]=3 27533 B16R1.7523 CCCCN(C)C(=O)Cc1ccccc1O 527a_100000207549_100000743006 [0,2,0,0,0,0|1,0,0]=3 27534 B16R1.7523 CCCCN(C)C(=O)Cc1cccnc1Cl 11a_100000207549_100000093521 [0,2,0,0,0,0|2,0,0]=4 27535 B16R1.7523 CCCCN(C)C(=O)Cc1cccnc1Cl 1626a_100000207549_100000093521 [0,2,0,0,0,0|2,0,0]=4 27536 B16R1.7523 CCCCN(C)C(=O)Cc1cccnc1Cl 240690a_100000207549_100000093521 [0,2,0,0,0,0|2,0,0]=4 27537 B16R1.7523 CCCCN(C)C(=O)Cc1cccnc1Cl 527a_100000207549_100000093521 [0,2,0,0,0,0|2,0,0]=4 27538 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1Br 11a_100000207549_200012357574 [0,2,0,0,0,0|2,0,0]=4 27539 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1Br 240690a_100000207549_200012357574 [0,2,0,0,0,0|2,0,0]=4 27540 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1C 11a_100000207549_200000722269 [0,2,0,0,0,0|2,0,0]=4 27541 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1C 1626a_100000207549_200000722269 [0,2,0,0,0,0|2,0,0]=4 27542 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1C 240690a_100000207549_200000722269 [0,2,0,0,0,0|2,0,0]=4 27543 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1Cl 11a_100000207549_100011998755 [0,2,0,0,0,0|2,0,0]=4 27544 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1Cl 240690a_100000207549_100011998755 [0,2,0,0,0,0|2,0,0]=4 27545 B16R1.7523 CCCCN(C)C(=O)Cc1ncccc1Cl 527a_100000207549_100011998755 [0,2,0,0,0,0|2,0,0]=4 27546 B16R1.7523 CCCCN(C)C(=O)Cn1ccccc1=O 1626a_100000207549_100000189665 [0,2,0,0,0,0|2,0,0]=4 27547 B16R1.7523 CCCCN(C)C(=O)Cn1ccccc1=O 240690a_100000207549_100000189665 [0,2,0,0,0,0|2,0,0]=4 27548 B16R1.7523 CCCCN(C)C(=O)Cn1ccccc1=O 527a_100000207549_100000189665 [0,2,0,0,0,0|2,0,0]=4 27549 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1Br 2430a_100000210017_100000207549 [0,2,0,0,0,0|2,0,0]=4 27550 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1C 2430a_100015192222_100000207549 [0,2,0,0,0,0|2,0,0]=4 27551 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1Cl 2430a_100000185783_100000207549 [0,2,0,0,0,0|2,0,0]=4 27552 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1F 2430a_100000210422_100000207549 [0,2,0,0,0,0|2,0,0]=4 27553 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1I 2430a_100000210053_100000207549 [0,2,0,0,0,0|2,0,0]=4 27554 B16R1.7523 CCCCN(C)C(=O)Nc1ccccc1O 2430a_100000185747_100000207549 [0,2,0,0,0,0|2,0,0]=4 27555 B16R1.7523 CCCNC(=O)C(=O)Cc1ccccc1Br 1458a_200011297150_100000184730 [0,2,0,0,0,0|2,0,0]=4 27556 B16R1.7523 CCCNC(=O)C(=O)Cc1ccccc1C 1458a_200011297150_100000211839 [0,2,0,0,0,0|2,0,0]=4 27557 B16R1.7523 CCCNC(=O)C(=O)Cc1ccccc1Cl 1458a_200011297150_100000187162 [0,2,0,0,0,0|2,0,0]=4 27558 B16R1.7523 CCCNC(=O)C(=O)Cc1ccccc1F 1458a_200011297150_100000187165 [0,2,0,0,0,0|2,0,0]=4 27559 B16R1.7523 CCCNC(=O)C(=O)Cc1ccccc1I 1458a_200011297150_100011216222 [0,2,0,0,0,0|2,0,0]=4 27560 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1Br 240690a_100000213112_100000751119 [0,2,0,0,0,0|2,0,0]=4 27561 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1Br 527a_100000213112_100000751119 [0,2,0,0,0,0|2,0,0]=4 27562 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1Cl 240690a_100000213112_100000183793 [0,2,0,0,0,0|2,0,0]=4 27563 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1Cl 527a_100000213112_100000183793 [0,2,0,0,0,0|2,0,0]=4 27564 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1F 240690a_100000213112_100000212012 [0,2,0,0,0,0|2,0,0]=4 27565 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1F 527a_100000213112_100000212012 [0,2,0,0,0,0|2,0,0]=4 27566 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1I 240690a_100000213112_100000036491 [0,2,0,0,0,0|2,0,0]=4 27567 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1I 527a_100000213112_100000036491 [0,2,0,0,0,0|2,0,0]=4 27568 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1O 240690a_100000213112_100000743006 [0,2,0,0,0,0|2,0,0]=4 27569 B16R1.7523 CN(CCCO)C(=O)Cc1ccccc1O 527a_100000213112_100000743006 [0,2,0,0,0,0|2,0,0]=4 27570 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Br 11a_100000743101_100000751119 [0,2,0,0,0,0|2,0,0]=4 27571 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Br 240690a_100000743101_100000751119 [0,2,0,0,0,0|2,0,0]=4 27572 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Br 527a_100000743101_100000751119 [0,2,0,0,0,0|2,0,0]=4 27573 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C 11a_100000743101_100000212180 [0,2,0,0,0,0|2,0,0]=4 27574 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C 1626a_100000743101_100000212180 [0,2,0,0,0,0|2,0,0]=4 27575 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C 240690a_100000743101_100000212180 [0,2,0,0,0,0|2,0,0]=4 27576 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1C 527a_100000743101_100000212180 [0,2,0,0,0,0|2,0,0]=4 27577 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl 11a_100000743101_100000183793 [0,2,0,0,0,0|2,0,0]=4 27578 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl 1626a_100000743101_100000183793 [0,2,0,0,0,0|2,0,0]=4 27579 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl 240690a_100000743101_100000183793 [0,2,0,0,0,0|2,0,0]=4 27580 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1Cl 527a_100000743101_100000183793 [0,2,0,0,0,0|2,0,0]=4 27581 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F 11a_100000743101_100000212012 [0,2,0,0,0,0|2,0,0]=4 27582 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F 1626a_100000743101_100000212012 [0,2,0,0,0,0|2,0,0]=4 27583 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F 240690a_100000743101_100000212012 [0,2,0,0,0,0|2,0,0]=4 27584 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1F 527a_100000743101_100000212012 [0,2,0,0,0,0|2,0,0]=4 27585 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I 11a_100000743101_100000036491 [0,2,0,0,0,0|2,0,0]=4 27586 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I 1626a_100000743101_100000036491 [0,2,0,0,0,0|2,0,0]=4 27587 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I 240690a_100000743101_100000036491 [0,2,0,0,0,0|2,0,0]=4 27588 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1I 527a_100000743101_100000036491 [0,2,0,0,0,0|2,0,0]=4 27589 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O 240690a_100000743101_100000743006 [0,2,0,0,0,0|2,0,0]=4 27590 B16R1.7523 COCCN(C)C(=O)Cc1ccccc1O 527a_100000743101_100000743006 [0,2,0,0,0,0|2,0,0]=4 27591 B16R1.7523 CSCCC(O)C(=O)Cc1ccccc1Br 1458a_100000685904_100000184730 [0,2,0,0,0,0|2,0,0]=4 27592 B16R1.7523 CSCCC(O)C(=O)Cc1ccccc1C 1458a_100000685904_100000211839 [0,2,0,0,0,0|2,0,0]=4 27593 B16R1.7523 CSCCC(O)C(=O)Cc1ccccc1Cl 1458a_100000685904_100000187162 [0,2,0,0,0,0|2,0,0]=4 27594 B16R1.7523 CSCCC(O)C(=O)Cc1ccccc1F 1458a_100000685904_100000187165 [0,2,0,0,0,0|2,0,0]=4 27595 B16R1.7523 CSCCC(O)C(=O)Cc1ccccc1I 1458a_100000685904_100011216222 [0,2,0,0,0,0|2,0,0]=4 27596 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Br 11a_100000686725_100000751119 [0,2,0,0,0,0|2,0,0]=4 27597 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Br 240690a_100000686725_100000751119 [0,2,0,0,0,0|2,0,0]=4 27598 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Br 527a_100000686725_100000751119 [0,2,0,0,0,0|2,0,0]=4 27599 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1C 11a_100000686725_100000212180 [0,2,0,0,0,0|2,0,0]=4 27600 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1C 1626a_100000686725_100000212180 [0,2,0,0,0,0|2,0,0]=4 27601 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1C 240690a_100000686725_100000212180 [0,2,0,0,0,0|2,0,0]=4 27602 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1C 527a_100000686725_100000212180 [0,2,0,0,0,0|2,0,0]=4 27603 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Cl 11a_100000686725_100000183793 [0,2,0,0,0,0|2,0,0]=4 27604 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Cl 1626a_100000686725_100000183793 [0,2,0,0,0,0|2,0,0]=4 27605 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Cl 240690a_100000686725_100000183793 [0,2,0,0,0,0|2,0,0]=4 27606 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1Cl 527a_100000686725_100000183793 [0,2,0,0,0,0|2,0,0]=4 27607 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1F 11a_100000686725_100000212012 [0,2,0,0,0,0|2,0,0]=4 27608 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1F 1626a_100000686725_100000212012 [0,2,0,0,0,0|2,0,0]=4 27609 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1F 240690a_100000686725_100000212012 [0,2,0,0,0,0|2,0,0]=4 27610 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1F 527a_100000686725_100000212012 [0,2,0,0,0,0|2,0,0]=4 27611 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1I 11a_100000686725_100000036491 [0,2,0,0,0,0|2,0,0]=4 27612 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1I 1626a_100000686725_100000036491 [0,2,0,0,0,0|2,0,0]=4 27613 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1I 240690a_100000686725_100000036491 [0,2,0,0,0,0|2,0,0]=4 27614 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1I 527a_100000686725_100000036491 [0,2,0,0,0,0|2,0,0]=4 27615 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1O 240690a_100000686725_100000743006 [0,2,0,0,0,0|2,0,0]=4 27616 B16R1.7523 CSCCN(C)C(=O)Cc1ccccc1O 527a_100000686725_100000743006 [0,2,0,0,0,0|2,0,0]=4 27617 B16R1.7523 Cc1ccccc1CC(=O)N(C)CCCO 240690a_100000213112_100000212180 [0,2,0,0,0,0|2,0,0]=4 27618 B16R1.7523 Cc1ccccc1CC(=O)N(C)CCCO 527a_100000213112_100000212180 [0,2,0,0,0,0|2,0,0]=4 27619 B16R1.7641 CCCCC(C)(C)C(=O)Cc1ccccc1 1458a_100011216040_100015291786 [0,2,0,0,0,0|1,0,0]=3 27620 B16R1.7641 CCCCC(C)(C)C(=O)Cc1ccccn1 1458a_100011216040_100000721315 [0,2,0,0,0,0|2,0,0]=4 27621 B16R1.7641 CCCCC(C)(C)C(=O)Cc1cccnc1 1458a_100011216040_100000733263 [0,2,0,0,0,0|2,0,0]=4 27622 B16R1.7641 CCCCC(C)(C)C(=O)Cc1ccncc1 1458a_100011216040_100000705612 [0,2,0,0,0,0|2,0,0]=4 27623 B16R1.7641 CCCCC(C)(C)C(=O)Nc1ccccc1 11a_100000106764_100011216040 [0,2,0,0,0,0|2,0,0]=4 27624 B16R1.7641 CCCCC(C)(C)C(=O)Nc1ccccc1 1626a_100000106764_100011216040 [0,2,0,0,0,0|2,0,0]=4 27625 B16R1.7641 CCCCC(C)(C)C(=O)Nc1ccccc1 22a_100000106764_100011216040 [0,2,0,0,0,0|2,0,0]=4 27626 B16R1.7641 CCCCC(C)(C)C(=O)Nc1ccccc1 527a_100000106764_100011216040 [0,2,0,0,0,0|2,0,0]=4 27627 B16R1.7641 CCCCC(C)(O)C(=O)Cc1ccccc1 1458a_100000137666_100015291786 [0,2,0,0,0,0|1,0,0]=3 27628 B16R1.7641 CCCCC(C)(O)C(=O)Cc1ccccn1 1458a_100000137666_100000721315 [0,2,0,0,0,0|2,0,0]=4 27629 B16R1.7641 CCCCC(C)(O)C(=O)Cc1cccnc1 1458a_100000137666_100000733263 [0,2,0,0,0,0|2,0,0]=4 27630 B16R1.7641 CCCCC(C)(O)C(=O)Cc1ccncc1 1458a_100000137666_100000705612 [0,2,0,0,0,0|2,0,0]=4 27631 B16R1.7641 CCCCC(C)(O)C(=O)Nc1ccccc1 22a_100000106764_100000137666 [0,2,0,0,0,0|2,0,0]=4 27632 B16R1.7641 CCCCC(F)(F)C(=O)Cc1ccccc1 1458a_100000100317_100015291786 [0,2,0,0,0,0|1,0,0]=3 27633 B16R1.7641 CCCCC(F)(F)C(=O)Cc1ccccn1 1458a_100000100317_100000721315 [0,2,0,0,0,0|2,0,0]=4 27634 B16R1.7641 CCCCC(F)(F)C(=O)Cc1cccnc1 1458a_100000100317_100000733263 [0,2,0,0,0,0|2,0,0]=4 27635 B16R1.7641 CCCCC(F)(F)C(=O)Cc1ccncc1 1458a_100000100317_100000705612 [0,2,0,0,0,0|2,0,0]=4 27636 B16R1.7641 CCCCC(F)(F)C(=O)Nc1ccccc1 11a_100000106764_100000100317 [0,2,0,0,0,0|2,0,0]=4 27637 B16R1.7641 CCCCC(F)(F)C(=O)Nc1ccccc1 1626a_100000106764_100000100317 [0,2,0,0,0,0|2,0,0]=4 27638 B16R1.7641 CCCCC(F)(F)C(=O)Nc1ccccc1 22a_100000106764_100000100317 [0,2,0,0,0,0|2,0,0]=4 27639 B16R1.7641 CCCCC(F)(F)C(=O)Nc1ccccc1 527a_100000106764_100000100317 [0,2,0,0,0,0|2,0,0]=4 27640 B16R1.177 C#CC(CCC)OC(C)Cc1ccccc1 34a_200011217317_200011218536 [0,2,0,0,0,0|1,0,1]=4 27641 B16R1.177 C#CC(CCC)OC(C)Cc1ccccc1 7a_200011217317_200011218536 [0,2,0,0,0,0|1,0,1]=4 27642 B16R1.177 C=CC(CCC)OC(C)Cc1ccccc1 34a_100011216692_200011218536 [0,2,0,0,0,0|1,0,1]=4 27643 B16R1.177 C=CC(CCC)OC(C)Cc1ccccc1 7a_100011216692_200011218536 [0,2,0,0,0,0|1,0,1]=4 27644 B16R1.177 CCCC(C#N)OC(C)Cc1ccccc1 34a_100000686963_200011218536 [0,2,0,0,0,0|1,0,1]=4 27645 B16R1.177 CCCC(C#N)OC(C)Cc1ccccc1 7a_100000686963_200011218536 [0,2,0,0,0,0|1,0,1]=4 27646 B16R1.177 CCCC(CC)NC(=O)C[n+]1ccccc1 11a_100000747048_200000086051 [0,2,0,0,0,0|2,0,0]=4 27647 B16R1.177 CCCC(CC)NC(=O)C[n+]1ccccc1 240690a_100000747048_200000086051 [0,2,0,0,0,0|2,0,0]=4 27648 B16R1.177 CCCC(CC)NC(=O)C[n+]1ccccc1 527a_100000747048_200000086051 [0,2,0,0,0,0|2,0,0]=4 27649 B16R1.177 CCCC(CC)NC(=O)Cc1ccccn1 11a_100000747048_100000233486 [0,2,0,0,0,0|2,0,0]=4 27650 B16R1.177 CCCC(CC)NC(=O)Cc1cccnc1 11a_100000747048_100000737805 [0,2,0,0,0,0|2,0,0]=4 27651 B16R1.177 CCCC(CC)NC(=O)Cc1cccnc1 240690a_100000747048_100000737805 [0,2,0,0,0,0|2,0,0]=4 27652 B16R1.177 CCCC(CC)NC(=O)Cc1cccnc1 527a_100000747048_100000737805 [0,2,0,0,0,0|2,0,0]=4 27653 B16R1.177 CCCC(CC)NC(=O)Cc1ccncc1 11a_100000747048_100011201483 [0,2,0,0,0,0|2,0,0]=4 27654 B16R1.177 CCCC(CC)NC(=O)Cc1ccncc1 240690a_100000747048_100011201483 [0,2,0,0,0,0|2,0,0]=4 27655 B16R1.177 CCCC(CC)NC(=O)Nc1ccccc1 2430a_100000106764_100000747048 [0,2,0,0,0,0|2,0,0]=4 27656 B16R1.177 CCCC(CC)OC(C)Cc1ccccc1 34a_100000687864_200011218536 [0,2,0,0,0,0|1,0,1]=4 27657 B16R1.177 CCCC(CC)OC(C)Cc1ccccc1 7a_100000687864_200011218536 [0,2,0,0,0,0|1,0,1]=4 27658 B16R1.177 CCCC(CC)OC(C)Cc1ccccc1 7a_100000748627_100011219200 [0,2,0,0,0,0|1,0,1]=4 27659 B16R1.177 CCCN(CC)CC(=O)Cc1ccccc1 2230a_100000226822_100000233483 [0,2,0,0,0,0|2,0,0]=4 27660 B16R1.177 CCCN(CC)CC(=O)Cc1ccccc1 269982a_100000226822_100000233483 [0,2,0,0,0,0|2,0,0]=4 27661 B16R1.177 CCC[C@@H](CO)NC(=O)C[n+]1ccccc1 240690a_100000732646_200000086051 [0,2,0,0,0,0|2,0,0]=4 27662 B16R1.177 CCC[C@@H](CO)NC(=O)C[n+]1ccccc1 527a_100000732646_200000086051 [0,2,0,0,0,0|2,0,0]=4 27663 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 240690a_100000732646_100000737805 [0,2,0,0,0,0|2,0,0]=4 27664 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1cccnc1 527a_100000732646_100000737805 [0,2,0,0,0,0|2,0,0]=4 27665 B16R1.177 CCC[C@@H](CO)NC(=O)Cc1ccncc1 240690a_100000732646_100011201483 [0,2,0,0,0,0|2,0,0]=4 27666 B16R1.177 CCC[C@@H](CO)NC(=O)Nc1ccccc1 2430a_100000106764_100000732646 [0,2,0,0,0,0|2,0,0]=4 27667 B16R1.936 C#CC(Cc1ccccc1)OC(C)CCC 34a_100000685211_100000766640 [0,2,0,0,0,0|1,0,1]=4 27668 B16R1.936 C#CC(Cc1ccccc1)OC(C)CCC 7a_100000685211_100000766640 [0,2,0,0,0,0|1,0,1]=4 27669 B16R1.936 CCCC(C)OC(C#N)Cc1ccccc1 7a_100000764384_100000183401 [0,2,0,0,0,0|1,0,1]=4 27670 B16R1.936 CCCC(C)OC(CC)Cc1ccccc1 7a_100000760156_100000766640 [0,2,0,0,0,0|1,0,1]=4 27671 B16R1.936 CCCC(C)OC(CN)Cc1ccccc1 34a_100000752270_100000766640 [0,2,0,0,0,0|1,0,1]=4 27672 B16R1.936 CCCC(C)O[C@H](CCl)Cc1ccccc1 7a_100000729385_100000766640 [0,2,0,0,0,0|1,0,1]=4 27673 B16R1.1660 CCC(=O)C(C)OC(=O)Nc1ccccc1 1458a_100000032784_100000210202 [0,2,0,0,0,0|1,0,1]=4 27674 B16R1.1660 CCC(C)C(=O)CC(=O)Cc1ccccc1 1458a_100011192722_100000233483 [0,2,0,0,0,0|1,0,1]=4 27675 B16R1.1660 CCC(C)C(C)OC(C)Cc1ccccc1 7a_100011215189_200011218536 [0,2,0,0,0,0|1,0,1]=4 27676 B16R1.1660 CCC(C)N(C)CC(=O)Cc1ccccc1 2230a_100000741768_100000233483 [0,2,0,0,0,0|2,0,0]=4 27677 B16R1.1660 CCC(C)N(C)CC(=O)Cc1ccccc1 269982a_100000741768_100000233483 [0,2,0,0,0,0|2,0,0]=4 27678 B16R1.1660 CCC(O)C(=O)CC(=O)Cc1ccccc1 1458a_100011196387_100000233483 [0,2,0,0,0,0|1,0,1]=4 27679 B16R1.1660 CCN(C)C(C)CC(=O)Cc1ccccc1 1458a_200015187196_100015291786 [0,2,0,0,0,0|2,0,0]=4 27680 B16R1.2180 CCCC(C)NS(=O)(=O)Cc1ccccc1 270084a_100000741246_100000211737 [0,2,0,0,0,0|2,0,0]=4 27681 B16R1.2180 CCCC(C)NS(=O)(=O)Cc1ccccc1 274078a_100000741246_100000211737 [0,2,0,0,0,0|2,0,0]=4 27682 B16R1.2180 CCCC(C)NS(=O)(=O)Cc1ccccc1 40a_100000741246_100000235865 [0,2,0,0,0,0|2,0,0]=4 27683 B16R1.2180 CCCC(C)OC(C)(C)Cc1ccccc1 7a_100011215222_100000766640 [0,2,0,0,0,0|1,0,1]=4 27684 B16R1.3991 CCCC(C)(C)OC(C)Cc1ccccc1 7a_100000748436_200011218536 [0,2,0,0,0,0|1,0,1]=4 27685 B16R1.3991 CCCC(C)(O)CC(=O)Cc1ccccc1 1458a_100011667670_100015291786 [0,2,0,0,0,0|1,0,0]=3 27686 B16R1.3991 CCCC(C)(O)CC(=O)Cc1ccccn1 1458a_100011667670_100000721315 [0,2,0,0,0,0|2,0,0]=4 27687 B16R1.3991 CCCC(C)(O)CC(=O)Cc1cccnc1 1458a_100011667670_100000733263 [0,2,0,0,0,0|2,0,0]=4 27688 B16R1.3991 CCCC(C)(O)CC(=O)Cc1ccncc1 1458a_100011667670_100000705612 [0,2,0,0,0,0|2,0,0]=4 27689 B16R1.3991 CCCC(C)(O)CC(=O)Nc1ccccc1 22a_100000106764_100011667670 [0,2,0,0,0,0|2,0,0]=4 27690 B16R1.3991 CCCC(C)(O)CC(=O)Nc1ccccc1 527a_100000106764_100011667670 [0,2,0,0,0,0|2,0,0]=4 27691 B16R1.4235 C=C(CCC)CC(=O)Cc1ccccc1Br 1458a_100000138376_100000184730 [0,2,0,0,0,0|1,0,1]=4 27692 B16R1.4235 C=C(CCC)CC(=O)Cc1ccccc1C 1458a_100000138376_100000211839 [0,2,0,0,0,0|1,0,1]=4 27693 B16R1.4235 C=C(CCC)CC(=O)Cc1ccccc1Cl 1458a_100000138376_100000187162 [0,2,0,0,0,0|1,0,1]=4 27694 B16R1.4235 C=C(CCC)CC(=O)Cc1ccccc1F 1458a_100000138376_100000187165 [0,2,0,0,0,0|1,0,1]=4 27695 B16R1.4235 C=C(CCC)CC(=O)Cc1ccccc1I 1458a_100000138376_100011216222 [0,2,0,0,0,0|1,0,1]=4 27696 B16R1.4235 CCCC(=CC(=O)Cc1ccccc1Br)C 1458a_100020676950_100000184730 [0,2,0,0,0,0|1,0,1]=4 27697 B16R1.4235 CCCC(=CC(=O)Cc1ccccc1C)C 1458a_100020676950_100000211839 [0,2,0,0,0,0|1,0,1]=4 27698 B16R1.4235 CCCC(=CC(=O)Cc1ccccc1Cl)C 1458a_100020676950_100000187162 [0,2,0,0,0,0|1,0,1]=4 27699 B16R1.4235 CCCC(=CC(=O)Cc1ccccc1F)C 1458a_100020676950_100000187165 [0,2,0,0,0,0|1,0,1]=4 27700 B16R1.4235 CCCC(=CC(=O)Cc1ccccc1I)C 1458a_100020676950_100011216222 [0,2,0,0,0,0|1,0,1]=4 27701 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1Br 1458a_100000211992_100000700504 [0,2,0,0,0,0|1,0,1]=4 27702 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1Br 1458a_100000751119_100000747444 [0,2,0,0,0,0|1,0,1]=4 27703 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1C 1458a_100000211992_100011223134 [0,2,0,0,0,0|1,0,1]=4 27704 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1C 1458a_100000212180_100000747444 [0,2,0,0,0,0|1,0,1]=4 27705 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100000747444 [0,2,0,0,0,0|1,0,1]=4 27706 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1F 1458a_100000212012_100000747444 [0,2,0,0,0,0|1,0,1]=4 27707 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1I 1458a_100000036491_100000747444 [0,2,0,0,0,0|1,0,1]=4 27708 B16R1.4235 CCCC(=O)CC(=O)Cc1ccccc1O 1458a_100000743006_100000747444 [0,2,0,0,0,0|1,0,1]=4 27709 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Br 1458a_100000748435_100000184730 [0,2,0,0,0,0|1,0,0]=3 27710 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Br 1458a_100000751119_100011216630 [0,2,0,0,0,0|1,0,0]=3 27711 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1C 1458a_100000212180_100011216630 [0,2,0,0,0,0|1,0,0]=3 27712 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1C 1458a_100000748435_100000211839 [0,2,0,0,0,0|1,0,0]=3 27713 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Cl 1458a_100000183793_100011216630 [0,2,0,0,0,0|1,0,0]=3 27714 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1Cl 1458a_100000748435_100000187162 [0,2,0,0,0,0|1,0,0]=3 27715 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1F 1458a_100000212012_100011216630 [0,2,0,0,0,0|1,0,0]=3 27716 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1F 1458a_100000748435_100000187165 [0,2,0,0,0,0|1,0,0]=3 27717 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1I 1458a_100000036491_100011216630 [0,2,0,0,0,0|1,0,0]=3 27718 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1I 1458a_100000748435_100011216222 [0,2,0,0,0,0|1,0,0]=3 27719 B16R1.4235 CCCC(C)CC(=O)Cc1ccccc1O 1458a_100000743006_100011216630 [0,2,0,0,0,0|1,0,0]=3 27720 B16R1.4235 CCCC(C)CC(=O)Cc1cccnc1Br 1458a_100000748435_100010140945 [0,2,0,0,0,0|2,0,0]=4 27721 B16R1.4235 CCCC(C)CC(=O)Cc1cccnc1C 1458a_100000748435_100000732876 [0,2,0,0,0,0|2,0,0]=4 27722 B16R1.4235 CCCC(C)CC(=O)Cc1cccnc1Cl 1458a_100000093521_100011216630 [0,2,0,0,0,0|2,0,0]=4 27723 B16R1.4235 CCCC(C)CC(=O)Cc1cccnc1Cl 1458a_100000748435_100000045678 [0,2,0,0,0,0|2,0,0]=4 27724 B16R1.4235 CCCC(C)CC(=O)Cc1cccnc1F 1458a_100000748435_100000099810 [0,2,0,0,0,0|2,0,0]=4 27725 B16R1.4235 CCCC(C)CC(=O)Cc1ccncc1C 1458a_100000748435_100020672808 [0,2,0,0,0,0|2,0,0]=4 27726 B16R1.4235 CCCC(C)CC(=O)Cc1ccncc1Cl 1458a_100000748435_100000763264 [0,2,0,0,0,0|2,0,0]=4 27727 B16R1.4235 CCCC(C)CC(=O)Cc1cnccc1C 1458a_100000748435_100000690890 [0,2,0,0,0,0|2,0,0]=4 27728 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1Br 1458a_100000748435_100025702911 [0,2,0,0,0,0|2,0,0]=4 27729 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1Br 1458a_200012357574_100011216630 [0,2,0,0,0,0|2,0,0]=4 27730 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1C 1458a_100000748435_100000696600 [0,2,0,0,0,0|2,0,0]=4 27731 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1C 1458a_200000722269_100011216630 [0,2,0,0,0,0|2,0,0]=4 27732 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1Cl 1458a_100000748435_100000099807 [0,2,0,0,0,0|2,0,0]=4 27733 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1Cl 1458a_100011998755_100011216630 [0,2,0,0,0,0|2,0,0]=4 27734 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1F 1458a_100000748435_100000104219 [0,2,0,0,0,0|2,0,0]=4 27735 B16R1.4235 CCCC(C)CC(=O)Cc1ncccc1O 1458a_100000748435_200020655725 [0,2,0,0,0,0|2,0,0]=4 27736 B16R1.4235 CCCC(C)CC(=O)Cn1ccccc1=O 1458a_100000189665_100011216630 [0,2,0,0,0,0|2,0,0]=4 27737 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Br 11a_100000210017_100000748435 [0,2,0,0,0,0|2,0,0]=4 27738 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Br 1626a_100000210017_100000748435 [0,2,0,0,0,0|2,0,0]=4 27739 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 11a_100015192222_100000748435 [0,2,0,0,0,0|2,0,0]=4 27740 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 1626a_100015192222_100000748435 [0,2,0,0,0,0|2,0,0]=4 27741 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 22a_100015192222_100000748435 [0,2,0,0,0,0|2,0,0]=4 27742 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1C 527a_100015192222_100000748435 [0,2,0,0,0,0|2,0,0]=4 27743 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 11a_100000185783_100000748435 [0,2,0,0,0,0|2,0,0]=4 27744 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000748435 [0,2,0,0,0,0|2,0,0]=4 27745 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 22a_100000185783_100000748435 [0,2,0,0,0,0|2,0,0]=4 27746 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1Cl 527a_100000185783_100000748435 [0,2,0,0,0,0|2,0,0]=4 27747 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 11a_100000210422_100000748435 [0,2,0,0,0,0|2,0,0]=4 27748 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 1626a_100000210422_100000748435 [0,2,0,0,0,0|2,0,0]=4 27749 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 22a_100000210422_100000748435 [0,2,0,0,0,0|2,0,0]=4 27750 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1F 527a_100000210422_100000748435 [0,2,0,0,0,0|2,0,0]=4 27751 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1I 11a_100000210053_100000748435 [0,2,0,0,0,0|2,0,0]=4 27752 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1I 1626a_100000210053_100000748435 [0,2,0,0,0,0|2,0,0]=4 27753 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1O 22a_100000185747_100000748435 [0,2,0,0,0,0|2,0,0]=4 27754 B16R1.4235 CCCC(C)CC(=O)Nc1ccccc1O 527a_100000185747_100000748435 [0,2,0,0,0,0|2,0,0]=4 27755 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 11a_100000741246_100000751119 [0,2,0,0,0,0|1,0,0]=3 27756 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 240690a_100000741246_100000751119 [0,2,0,0,0,0|1,0,0]=3 27757 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Br 527a_100000741246_100000751119 [0,2,0,0,0,0|1,0,0]=3 27758 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 11a_100000741246_100000212180 [0,2,0,0,0,0|1,0,0]=3 27759 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 1626a_100000741246_100000212180 [0,2,0,0,0,0|1,0,0]=3 27760 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 240690a_100000741246_100000212180 [0,2,0,0,0,0|1,0,0]=3 27761 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1C 527a_100000741246_100000212180 [0,2,0,0,0,0|1,0,0]=3 27762 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 11a_100000741246_100000183793 [0,2,0,0,0,0|1,0,0]=3 27763 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 1626a_100000741246_100000183793 [0,2,0,0,0,0|1,0,0]=3 27764 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 240690a_100000741246_100000183793 [0,2,0,0,0,0|1,0,0]=3 27765 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1Cl 527a_100000741246_100000183793 [0,2,0,0,0,0|1,0,0]=3 27766 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 11a_100000741246_100000212012 [0,2,0,0,0,0|1,0,0]=3 27767 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 1626a_100000741246_100000212012 [0,2,0,0,0,0|1,0,0]=3 27768 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 240690a_100000741246_100000212012 [0,2,0,0,0,0|1,0,0]=3 27769 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1F 527a_100000741246_100000212012 [0,2,0,0,0,0|1,0,0]=3 27770 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 11a_100000741246_100000036491 [0,2,0,0,0,0|1,0,0]=3 27771 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 1626a_100000741246_100000036491 [0,2,0,0,0,0|1,0,0]=3 27772 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 240690a_100000741246_100000036491 [0,2,0,0,0,0|1,0,0]=3 27773 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1I 527a_100000741246_100000036491 [0,2,0,0,0,0|1,0,0]=3 27774 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1O 240690a_100000741246_100000743006 [0,2,0,0,0,0|1,0,0]=3 27775 B16R1.4235 CCCC(C)NC(=O)Cc1ccccc1O 527a_100000741246_100000743006 [0,2,0,0,0,0|1,0,0]=3 27776 B16R1.4235 CCCC(C)NC(=O)Cc1cccnc1Cl 11a_100000741246_100000093521 [0,2,0,0,0,0|2,0,0]=4 27777 B16R1.4235 CCCC(C)NC(=O)Cc1cccnc1Cl 1626a_100000741246_100000093521 [0,2,0,0,0,0|2,0,0]=4 27778 B16R1.4235 CCCC(C)NC(=O)Cc1cccnc1Cl 240690a_100000741246_100000093521 [0,2,0,0,0,0|2,0,0]=4 27779 B16R1.4235 CCCC(C)NC(=O)Cc1cccnc1Cl 527a_100000741246_100000093521 [0,2,0,0,0,0|2,0,0]=4 27780 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1Br 11a_100000741246_200012357574 [0,2,0,0,0,0|2,0,0]=4 27781 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1Br 240690a_100000741246_200012357574 [0,2,0,0,0,0|2,0,0]=4 27782 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1C 11a_100000741246_200000722269 [0,2,0,0,0,0|2,0,0]=4 27783 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1C 1626a_100000741246_200000722269 [0,2,0,0,0,0|2,0,0]=4 27784 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1C 240690a_100000741246_200000722269 [0,2,0,0,0,0|2,0,0]=4 27785 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1Cl 11a_100000741246_100011998755 [0,2,0,0,0,0|2,0,0]=4 27786 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1Cl 240690a_100000741246_100011998755 [0,2,0,0,0,0|2,0,0]=4 27787 B16R1.4235 CCCC(C)NC(=O)Cc1ncccc1Cl 527a_100000741246_100011998755 [0,2,0,0,0,0|2,0,0]=4 27788 B16R1.4235 CCCC(C)NC(=O)Cn1ccccc1=O 1626a_100000741246_100000189665 [0,2,0,0,0,0|2,0,0]=4 27789 B16R1.4235 CCCC(C)NC(=O)Cn1ccccc1=O 240690a_100000741246_100000189665 [0,2,0,0,0,0|2,0,0]=4 27790 B16R1.4235 CCCC(C)NC(=O)Cn1ccccc1=O 527a_100000741246_100000189665 [0,2,0,0,0,0|2,0,0]=4 27791 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1Br 2430a_100000210017_100000741246 [0,2,0,0,0,0|2,0,0]=4 27792 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1C 2430a_100015192222_100000741246 [0,2,0,0,0,0|2,0,0]=4 27793 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1Cl 2430a_100000185783_100000741246 [0,2,0,0,0,0|2,0,0]=4 27794 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1F 2430a_100000210422_100000741246 [0,2,0,0,0,0|2,0,0]=4 27795 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1I 2430a_100000210053_100000741246 [0,2,0,0,0,0|2,0,0]=4 27796 B16R1.4235 CCCC(C)NC(=O)Nc1ccccc1O 2430a_100000185747_100000741246 [0,2,0,0,0,0|2,0,0]=4 27797 B16R1.4235 CCCN(C)CC(=O)Cc1ccccc1Br 2230a_100000747261_100000700504 [0,2,0,0,0,0|2,0,0]=4 27798 B16R1.4235 CCCN(C)CC(=O)Cc1ccccc1Br 269982a_100000747261_100000700504 [0,2,0,0,0,0|2,0,0]=4 27799 B16R1.4235 CCCN(C)CC(=O)Cc1ccccc1C 2230a_100000747261_100011223134 [0,2,0,0,0,0|2,0,0]=4 27800 B16R1.4235 CCCN(C)CC(=O)Cc1ccccc1C 269982a_100000747261_100011223134 [0,2,0,0,0,0|2,0,0]=4 27801 B16R1.4235 CCCS(=O)CC(=O)Cc1ccccc1Br 1458a_100011387404_100000184730 [0,2,0,0,0,0|2,0,0]=4 27802 B16R1.4235 CCCS(=O)CC(=O)Cc1ccccc1C 1458a_100011387404_100000211839 [0,2,0,0,0,0|2,0,0]=4 27803 B16R1.4235 CCCS(=O)CC(=O)Cc1ccccc1Cl 1458a_100011387404_100000187162 [0,2,0,0,0,0|2,0,0]=4 27804 B16R1.4235 CCCS(=O)CC(=O)Cc1ccccc1F 1458a_100011387404_100000187165 [0,2,0,0,0,0|2,0,0]=4 27805 B16R1.4235 CCCS(=O)CC(=O)Cc1ccccc1I 1458a_100011387404_100011216222 [0,2,0,0,0,0|2,0,0]=4 27806 B16R1.4235 CCSC(C)CC(=O)Cc1ccccc1Br 1458a_200011311441_100000184730 [0,2,0,0,0,0|2,0,0]=4 27807 B16R1.4235 CCSC(C)CC(=O)Cc1ccccc1C 1458a_200011311441_100000211839 [0,2,0,0,0,0|2,0,0]=4 27808 B16R1.4235 CCSC(C)CC(=O)Cc1ccccc1Cl 1458a_200011311441_100000187162 [0,2,0,0,0,0|2,0,0]=4 27809 B16R1.4235 CCSC(C)CC(=O)Cc1ccccc1F 1458a_200011311441_100000187165 [0,2,0,0,0,0|2,0,0]=4 27810 B16R1.4235 CCSC(C)CC(=O)Cc1ccccc1I 1458a_200011311441_100011216222 [0,2,0,0,0,0|2,0,0]=4 27811 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Br 11a_100000764878_100000751119 [0,2,0,0,0,0|2,0,0]=4 27812 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Br 240690a_100000764878_100000751119 [0,2,0,0,0,0|2,0,0]=4 27813 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Br 527a_100000764878_100000751119 [0,2,0,0,0,0|2,0,0]=4 27814 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C 11a_100000764878_100000212180 [0,2,0,0,0,0|2,0,0]=4 27815 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C 1626a_100000764878_100000212180 [0,2,0,0,0,0|2,0,0]=4 27816 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C 240690a_100000764878_100000212180 [0,2,0,0,0,0|2,0,0]=4 27817 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1C 527a_100000764878_100000212180 [0,2,0,0,0,0|2,0,0]=4 27818 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl 11a_100000764878_100000183793 [0,2,0,0,0,0|2,0,0]=4 27819 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl 1626a_100000764878_100000183793 [0,2,0,0,0,0|2,0,0]=4 27820 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl 240690a_100000764878_100000183793 [0,2,0,0,0,0|2,0,0]=4 27821 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1Cl 527a_100000764878_100000183793 [0,2,0,0,0,0|2,0,0]=4 27822 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F 11a_100000764878_100000212012 [0,2,0,0,0,0|2,0,0]=4 27823 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F 1626a_100000764878_100000212012 [0,2,0,0,0,0|2,0,0]=4 27824 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F 240690a_100000764878_100000212012 [0,2,0,0,0,0|2,0,0]=4 27825 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1F 527a_100000764878_100000212012 [0,2,0,0,0,0|2,0,0]=4 27826 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I 11a_100000764878_100000036491 [0,2,0,0,0,0|2,0,0]=4 27827 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I 1626a_100000764878_100000036491 [0,2,0,0,0,0|2,0,0]=4 27828 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I 240690a_100000764878_100000036491 [0,2,0,0,0,0|2,0,0]=4 27829 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1I 527a_100000764878_100000036491 [0,2,0,0,0,0|2,0,0]=4 27830 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O 240690a_100000764878_100000743006 [0,2,0,0,0,0|2,0,0]=4 27831 B16R1.4235 COC[C@@H](C)NC(=O)Cc1ccccc1O 527a_100000764878_100000743006 [0,2,0,0,0,0|2,0,0]=4 27832 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1Br 240690a_100000706166_100000751119 [0,2,0,0,0,0|2,0,0]=4 27833 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1Br 527a_100000706166_100000751119 [0,2,0,0,0,0|2,0,0]=4 27834 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1Cl 240690a_100000706166_100000183793 [0,2,0,0,0,0|2,0,0]=4 27835 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1Cl 527a_100000706166_100000183793 [0,2,0,0,0,0|2,0,0]=4 27836 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1F 240690a_100000706166_100000212012 [0,2,0,0,0,0|2,0,0]=4 27837 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1F 527a_100000706166_100000212012 [0,2,0,0,0,0|2,0,0]=4 27838 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1I 240690a_100000706166_100000036491 [0,2,0,0,0,0|2,0,0]=4 27839 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1I 527a_100000706166_100000036491 [0,2,0,0,0,0|2,0,0]=4 27840 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1O 240690a_100000706166_100000743006 [0,2,0,0,0,0|2,0,0]=4 27841 B16R1.4235 C[C@H](CCO)NC(=O)Cc1ccccc1O 527a_100000706166_100000743006 [0,2,0,0,0,0|2,0,0]=4 27842 B16R1.4235 Cc1ccccc1CC(=O)N[C@H](C)CCO 240690a_100000706166_100000212180 [0,2,0,0,0,0|2,0,0]=4 27843 B16R1.4235 Cc1ccccc1CC(=O)N[C@H](C)CCO 527a_100000706166_100000212180 [0,2,0,0,0,0|2,0,0]=4 27844 B16R1.6940 CC(C)CC(=O)CC(=O)Cc1ccccc1 1458a_100000210554_100000233483 [0,2,0,0,0,0|1,0,1]=4 27845 B16R1.6940 CC(C)CC(C)NC(=O)C[n+]1ccccc1 11a_100000692259_200000086051 [0,2,0,0,0,0|2,0,0]=4 27846 B16R1.6940 CC(C)CC(C)NC(=O)C[n+]1ccccc1 240690a_100000692259_200000086051 [0,2,0,0,0,0|2,0,0]=4 27847 B16R1.6940 CC(C)CC(C)NC(=O)C[n+]1ccccc1 527a_100000692259_200000086051 [0,2,0,0,0,0|2,0,0]=4 27848 B16R1.6940 CC(C)CC(C)NC(=O)Cc1ccccn1 11a_100000692259_100000233486 [0,2,0,0,0,0|2,0,0]=4 27849 B16R1.6940 CC(C)CC(C)NC(=O)Cc1cccnc1 11a_100000692259_100000737805 [0,2,0,0,0,0|2,0,0]=4 27850 B16R1.6940 CC(C)CC(C)NC(=O)Cc1cccnc1 240690a_100000692259_100000737805 [0,2,0,0,0,0|2,0,0]=4 27851 B16R1.6940 CC(C)CC(C)NC(=O)Cc1cccnc1 527a_100000692259_100000737805 [0,2,0,0,0,0|2,0,0]=4 27852 B16R1.6940 CC(C)CC(C)NC(=O)Cc1ccncc1 11a_100000692259_100011201483 [0,2,0,0,0,0|2,0,0]=4 27853 B16R1.6940 CC(C)CC(C)NC(=O)Cc1ccncc1 240690a_100000692259_100011201483 [0,2,0,0,0,0|2,0,0]=4 27854 B16R1.6940 CC(C)CC(C)NC(=O)Nc1ccccc1 2430a_100000106764_100000692259 [0,2,0,0,0,0|2,0,0]=4 27855 B16R1.6940 CC(C)CC(C)OC(C)Cc1ccccc1 34a_100000211805_200011218536 [0,2,0,0,0,0|1,0,1]=4 27856 B16R1.6940 CC(C)CC(C)OC(C)Cc1ccccc1 34a_100000748627_100000731052 [0,2,0,0,0,0|1,0,1]=4 27857 B16R1.6940 CC(C)CC(C)OC(C)Cc1ccccc1 7a_100000211805_200011218536 [0,2,0,0,0,0|1,0,1]=4 27858 B16R1.6940 CC(C)CC(C)OC(C)Cc1ccccc1 7a_100000748627_100000731052 [0,2,0,0,0,0|1,0,1]=4 27859 B16R1.6940 CC(C)CN(C)CC(=O)Cc1ccccc1 2230a_100000747067_100000233483 [0,2,0,0,0,0|2,0,0]=4 27860 B16R1.6940 CC(C)CN(C)CC(=O)Cc1ccccc1 269982a_100000747067_100000233483 [0,2,0,0,0,0|2,0,0]=4 27861 B16R1.6940 CC(O)CN(C)CC(=O)Cc1ccccc1 2230a_100000227577_100000233483 [0,2,0,0,0,0|2,0,0]=4 27862 B16R1.6940 CC(O)CN(C)CC(=O)Cc1ccccc1 269982a_100000227577_100000233483 [0,2,0,0,0,0|2,0,0]=4 27863 B16R1.6940 C[C@@H](O)CC(=O)CC(=O)Cc1ccccc1 1458a_100011933948_100000233483 [0,2,0,0,0,0|1,0,1]=4 27864 B16R1.360 CCC(C)(C)COC(C)Cc1ccccc1 7a_100000765029_200011218536 [0,2,0,0,0,0|1,0,1]=4 27865 B16R1.360 CCC(C)(C)NCC(=O)Cc1ccccc1 2230a_100000211385_100000233483 [0,2,0,0,0,0|2,0,0]=4 27866 B16R1.360 CCC(C)(C)OCC(=O)Cc1ccccc1 7a_100000210230_100000233483 [0,2,0,0,0,0|2,0,0]=4 27867 B16R1.360 CCC(C)(C)SCC(=O)Cc1ccccc1 62a_100000032637_100000233483 [0,2,0,0,0,0|2,0,0]=4 27868 B16R1.360 CCC(C)(C)SCC(=O)Cc1ccccc1 62a_100000233483_100000032637 [0,2,0,0,0,0|2,0,0]=4 27869 B16R1.560 C#CC(CC)OCC(=O)Cc1ccccc1 7a_100000758843_100000233483 [0,2,0,0,0,0|2,0,0]=4 27870 B16R1.560 C=CC(CC)OCC(=O)Cc1ccccc1 7a_100000766422_100000233483 [0,2,0,0,0,0|2,0,0]=4 27871 B16R1.560 CCC(CC)CNC(=O)C[n+]1ccccc1 11a_100102946423_200000086051 [0,2,0,0,0,0|2,0,0]=4 27872 B16R1.560 CCC(CC)CNC(=O)C[n+]1ccccc1 240690a_100102946423_200000086051 [0,2,0,0,0,0|2,0,0]=4 27873 B16R1.560 CCC(CC)CNC(=O)C[n+]1ccccc1 527a_100102946423_200000086051 [0,2,0,0,0,0|2,0,0]=4 27874 B16R1.560 CCC(CC)CNC(=O)Cc1ccccn1 11a_100102946423_100000233486 [0,2,0,0,0,0|2,0,0]=4 27875 B16R1.560 CCC(CC)CNC(=O)Cc1cccnc1 11a_100102946423_100000737805 [0,2,0,0,0,0|2,0,0]=4 27876 B16R1.560 CCC(CC)CNC(=O)Cc1cccnc1 240690a_100102946423_100000737805 [0,2,0,0,0,0|2,0,0]=4 27877 B16R1.560 CCC(CC)CNC(=O)Cc1cccnc1 527a_100102946423_100000737805 [0,2,0,0,0,0|2,0,0]=4 27878 B16R1.560 CCC(CC)CNC(=O)Cc1ccncc1 11a_100102946423_100011201483 [0,2,0,0,0,0|2,0,0]=4 27879 B16R1.560 CCC(CC)CNC(=O)Cc1ccncc1 240690a_100102946423_100011201483 [0,2,0,0,0,0|2,0,0]=4 27880 B16R1.560 CCC(CC)CNC(=O)Nc1ccccc1 2430a_100000106764_100102946423 [0,2,0,0,0,0|2,0,0]=4 27881 B16R1.560 CCC(CC)COC(C)Cc1ccccc1 34a_100000748627_100011215472 [0,2,0,0,0,0|1,0,1]=4 27882 B16R1.560 CCC(CC)COC(C)Cc1ccccc1 7a_100000703878_200011218536 [0,2,0,0,0,0|1,0,1]=4 27883 B16R1.560 CCC(CC)COC(C)Cc1ccccc1 7a_100000748627_100011215472 [0,2,0,0,0,0|1,0,1]=4 27884 B16R1.560 CCC(CC)NCC(=O)Cc1ccccc1 2230a_100000199018_100000233483 [0,2,0,0,0,0|2,0,0]=4 27885 B16R1.560 CCC(CC)OCC(=O)Cc1ccccc1 1458a_100012002705_100015291786 [0,2,0,0,0,0|2,0,0]=4 27886 B16R1.560 CCC(CC)OCC(=O)Cc1ccccc1 7a_100000688536_100000233483 [0,2,0,0,0,0|2,0,0]=4 27887 B16R1.560 CCC(CC)SCC(=O)Cc1ccccc1 62a_100000210505_100000233483 [0,2,0,0,0,0|2,0,0]=4 27888 B16R1.560 CCC(CC)SCC(=O)Cc1ccccc1 62a_100000233483_100000210505 [0,2,0,0,0,0|2,0,0]=4 27889 B16R1.560 CCC(CNC(=O)C[n+]1ccccc1)OC 11a_100000731041_200000086051 [0,2,0,0,0,0|2,0,0]=4 27890 B16R1.560 CCC(CNC(=O)C[n+]1ccccc1)OC 240690a_100000731041_200000086051 [0,2,0,0,0,0|2,0,0]=4 27891 B16R1.560 CCC(CNC(=O)C[n+]1ccccc1)OC 527a_100000731041_200000086051 [0,2,0,0,0,0|2,0,0]=4 27892 B16R1.560 CCC(CNC(=O)Cc1ccccn1)OC 11a_100000731041_100000233486 [0,2,0,0,0,0|2,0,0]=4 27893 B16R1.560 CCC(CNC(=O)Cc1cccnc1)OC 11a_100000731041_100000737805 [0,2,0,0,0,0|2,0,0]=4 27894 B16R1.560 CCC(CNC(=O)Cc1cccnc1)OC 240690a_100000731041_100000737805 [0,2,0,0,0,0|2,0,0]=4 27895 B16R1.560 CCC(CNC(=O)Cc1cccnc1)OC 527a_100000731041_100000737805 [0,2,0,0,0,0|2,0,0]=4 27896 B16R1.560 CCC(CNC(=O)Cc1ccncc1)OC 11a_100000731041_100011201483 [0,2,0,0,0,0|2,0,0]=4 27897 B16R1.560 CCC(CNC(=O)Cc1ccncc1)OC 240690a_100000731041_100011201483 [0,2,0,0,0,0|2,0,0]=4 27898 B16R1.560 CCC(CNC(=O)Nc1ccccc1)OC 2430a_100000106764_100000731041 [0,2,0,0,0,0|2,0,0]=4 27899 B16R1.560 CCC(COC(C)Cc1ccccc1)OC 34a_100011934954_200011218536 [0,2,0,0,0,0|1,0,1]=4 27900 B16R1.560 CCC(COC(C)Cc1ccccc1)OC 7a_100011934954_200011218536 [0,2,0,0,0,0|1,0,1]=4 27901 B16R1.560 CCN(CC)CCC(=O)Cc1ccccc1 1458a_100000750416_100015291786 [0,2,0,0,0,0|2,0,0]=4 27902 B16R1.560 CC[C@@H](CO)NCC(=O)Cc1ccccc1 2230a_100000709445_100000233483 [0,2,0,0,0,0|2,0,0]=4 27903 B16R1.560 COC(CCC(=O)Cc1ccccc1)OC 1458a_200000082759_100015291786 [0,2,0,0,0,0|2,0,0]=4 27904 B16R1.4132 CC(C)C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_100000210206 [0,2,0,0,0,0|1,0,1]=4 27905 B16R1.4132 CC(C)C(C)NCC(=O)Cc1ccccc1 2230a_100000211541_100000233483 [0,2,0,0,0,0|2,0,0]=4 27906 B16R1.4132 CC(C)C(C)OCC(=O)Cc1ccccc1 7a_100000748068_100000233483 [0,2,0,0,0,0|2,0,0]=4 27907 B16R1.4132 CC(C)C(O)CNC(=O)C[n+]1ccccc1 11a_100000759067_200000086051 [0,2,0,0,0,0|2,0,0]=4 27908 B16R1.4132 CC(C)C(O)CNC(=O)C[n+]1ccccc1 240690a_100000759067_200000086051 [0,2,0,0,0,0|2,0,0]=4 27909 B16R1.4132 CC(C)C(O)CNC(=O)C[n+]1ccccc1 527a_100000759067_200000086051 [0,2,0,0,0,0|2,0,0]=4 27910 B16R1.4132 CC(C)C(O)CNC(=O)Cc1ccccn1 11a_100000759067_100000233486 [0,2,0,0,0,0|2,0,0]=4 27911 B16R1.4132 CC(C)C(O)CNC(=O)Cc1cccnc1 11a_100000759067_100000737805 [0,2,0,0,0,0|2,0,0]=4 27912 B16R1.4132 CC(C)C(O)CNC(=O)Cc1cccnc1 240690a_100000759067_100000737805 [0,2,0,0,0,0|2,0,0]=4 27913 B16R1.4132 CC(C)C(O)CNC(=O)Cc1cccnc1 527a_100000759067_100000737805 [0,2,0,0,0,0|2,0,0]=4 27914 B16R1.4132 CC(C)C(O)CNC(=O)Cc1ccncc1 11a_100000759067_100011201483 [0,2,0,0,0,0|2,0,0]=4 27915 B16R1.4132 CC(C)C(O)CNC(=O)Cc1ccncc1 240690a_100000759067_100011201483 [0,2,0,0,0,0|2,0,0]=4 27916 B16R1.4132 CC(C)C(O)CNC(=O)Nc1ccccc1 2430a_100000106764_100000759067 [0,2,0,0,0,0|2,0,0]=4 27917 B16R1.4132 CC(C)N(C)CCC(=O)Cc1ccccc1 1458a_100015184040_100015291786 [0,2,0,0,0,0|2,0,0]=4 27918 B16R1.4132 CC(Cc1ccccc1)OC[C@H](N)C(C)C 34a_100011830312_200011218536 [0,2,0,0,0,0|1,0,1]=4 27919 B16R1.4400 C#CC(Cc1ccccc1)OCC(C)CC 34a_100000685211_100000748023 [0,2,0,0,0,0|1,0,1]=4 27920 B16R1.4400 C#CC(Cc1ccccc1)OCC(C)CC 7a_100000685211_100000748023 [0,2,0,0,0,0|1,0,1]=4 27921 B16R1.4400 C#CC(Cc1ccccc1)OCC(O)CC 34a_100000685211_100011218378 [0,2,0,0,0,0|1,0,1]=4 27922 B16R1.4400 C#CC(Cc1ccccc1)OCC(O)CC 7a_100000685211_100011218378 [0,2,0,0,0,0|1,0,1]=4 27923 B16R1.4400 C#CC(Cc1ccccc1)OC[C@@H](C)CC 34a_100000685211_100009816398 [0,2,0,0,0,0|1,0,1]=4 27924 B16R1.4400 C#CC(Cc1ccccc1)OC[C@@H](C)CC 7a_100000685211_100009816398 [0,2,0,0,0,0|1,0,1]=4 27925 B16R1.4400 CCC(C)COC(CC)Cc1ccccc1 7a_100000760156_100000748023 [0,2,0,0,0,0|1,0,1]=4 27926 B16R1.4400 CCC(C)COC(CN)Cc1ccccc1 34a_100000752270_100000748023 [0,2,0,0,0,0|1,0,1]=4 27927 B16R1.4400 CCC(C)CO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000748023 [0,2,0,0,0,0|1,0,1]=4 27928 B16R1.4400 CCC(Cc1ccccc1)OC[C@@H](C)CC 7a_100000760156_100009816398 [0,2,0,0,0,0|1,0,1]=4 27929 B16R1.4400 CCC(O)COC(CC)Cc1ccccc1 7a_100000760156_100011218378 [0,2,0,0,0,0|1,0,1]=4 27930 B16R1.4400 CCC(O)COC(CN)Cc1ccccc1 34a_100000752270_100011218378 [0,2,0,0,0,0|1,0,1]=4 27931 B16R1.4400 CCC(O)CO[C@H](CCl)Cc1ccccc1 7a_100000729385_100011218378 [0,2,0,0,0,0|1,0,1]=4 27932 B16R1.4400 CC[C@H](C)COC(C#N)Cc1ccccc1 7a_100009816381_100000183401 [0,2,0,0,0,0|1,0,1]=4 27933 B16R1.4400 CC[C@H](C)COC(CN)Cc1ccccc1 34a_100000752270_100009816398 [0,2,0,0,0,0|1,0,1]=4 27934 B16R1.4400 CC[C@H](C)CO[C@H](CCl)Cc1ccccc1 7a_100000729385_100009816398 [0,2,0,0,0,0|1,0,1]=4 27935 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1Br 240690a_100000744482_100000751119 [0,2,0,0,0,0|2,0,0]=4 27936 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1Br 527a_100000744482_100000751119 [0,2,0,0,0,0|2,0,0]=4 27937 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1Cl 240690a_100000744482_100000183793 [0,2,0,0,0,0|2,0,0]=4 27938 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1Cl 527a_100000744482_100000183793 [0,2,0,0,0,0|2,0,0]=4 27939 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1F 240690a_100000744482_100000212012 [0,2,0,0,0,0|2,0,0]=4 27940 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1F 527a_100000744482_100000212012 [0,2,0,0,0,0|2,0,0]=4 27941 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1I 240690a_100000744482_100000036491 [0,2,0,0,0,0|2,0,0]=4 27942 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1I 527a_100000744482_100000036491 [0,2,0,0,0,0|2,0,0]=4 27943 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1O 240690a_100000744482_100000743006 [0,2,0,0,0,0|2,0,0]=4 27944 B16R1.7458 CC(CO)CNC(=O)Cc1ccccc1O 527a_100000744482_100000743006 [0,2,0,0,0,0|2,0,0]=4 27945 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1Br 1458a_100000701222_100000184730 [0,2,0,0,0,0|1,0,0]=3 27946 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1C 1458a_100000701222_100000211839 [0,2,0,0,0,0|1,0,0]=3 27947 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1Cl 1458a_100000701222_100000187162 [0,2,0,0,0,0|1,0,0]=3 27948 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1F 1458a_100000701222_100000187165 [0,2,0,0,0,0|1,0,0]=3 27949 B16R1.7458 CCC(C)CCC(=O)Cc1ccccc1I 1458a_100000701222_100011216222 [0,2,0,0,0,0|1,0,0]=3 27950 B16R1.7458 CCC(C)CCC(=O)Cc1cccnc1Br 1458a_100000701222_100010140945 [0,2,0,0,0,0|2,0,0]=4 27951 B16R1.7458 CCC(C)CCC(=O)Cc1cccnc1C 1458a_100000701222_100000732876 [0,2,0,0,0,0|2,0,0]=4 27952 B16R1.7458 CCC(C)CCC(=O)Cc1cccnc1Cl 1458a_100000701222_100000045678 [0,2,0,0,0,0|2,0,0]=4 27953 B16R1.7458 CCC(C)CCC(=O)Cc1cccnc1F 1458a_100000701222_100000099810 [0,2,0,0,0,0|2,0,0]=4 27954 B16R1.7458 CCC(C)CCC(=O)Cc1ccncc1C 1458a_100000701222_100020672808 [0,2,0,0,0,0|2,0,0]=4 27955 B16R1.7458 CCC(C)CCC(=O)Cc1ccncc1Cl 1458a_100000701222_100000763264 [0,2,0,0,0,0|2,0,0]=4 27956 B16R1.7458 CCC(C)CCC(=O)Cc1cnccc1C 1458a_100000701222_100000690890 [0,2,0,0,0,0|2,0,0]=4 27957 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1Br 1458a_100000701222_100025702911 [0,2,0,0,0,0|2,0,0]=4 27958 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1C 1458a_100000701222_100000696600 [0,2,0,0,0,0|2,0,0]=4 27959 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1Cl 1458a_100000701222_100000099807 [0,2,0,0,0,0|2,0,0]=4 27960 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1F 1458a_100000701222_100000104219 [0,2,0,0,0,0|2,0,0]=4 27961 B16R1.7458 CCC(C)CCC(=O)Cc1ncccc1O 1458a_100000701222_200020655725 [0,2,0,0,0,0|2,0,0]=4 27962 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Br 11a_100000210017_100000701222 [0,2,0,0,0,0|2,0,0]=4 27963 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Br 1626a_100000210017_100000701222 [0,2,0,0,0,0|2,0,0]=4 27964 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 11a_100015192222_100000701222 [0,2,0,0,0,0|2,0,0]=4 27965 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 1626a_100015192222_100000701222 [0,2,0,0,0,0|2,0,0]=4 27966 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 22a_100015192222_100000701222 [0,2,0,0,0,0|2,0,0]=4 27967 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1C 527a_100015192222_100000701222 [0,2,0,0,0,0|2,0,0]=4 27968 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 11a_100000185783_100000701222 [0,2,0,0,0,0|2,0,0]=4 27969 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000701222 [0,2,0,0,0,0|2,0,0]=4 27970 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 22a_100000185783_100000701222 [0,2,0,0,0,0|2,0,0]=4 27971 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1Cl 527a_100000185783_100000701222 [0,2,0,0,0,0|2,0,0]=4 27972 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 11a_100000210422_100000701222 [0,2,0,0,0,0|2,0,0]=4 27973 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 1626a_100000210422_100000701222 [0,2,0,0,0,0|2,0,0]=4 27974 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 22a_100000210422_100000701222 [0,2,0,0,0,0|2,0,0]=4 27975 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1F 527a_100000210422_100000701222 [0,2,0,0,0,0|2,0,0]=4 27976 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1I 11a_100000210053_100000701222 [0,2,0,0,0,0|2,0,0]=4 27977 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1I 1626a_100000210053_100000701222 [0,2,0,0,0,0|2,0,0]=4 27978 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1O 22a_100000185747_100000701222 [0,2,0,0,0,0|2,0,0]=4 27979 B16R1.7458 CCC(C)CCC(=O)Nc1ccccc1O 527a_100000185747_100000701222 [0,2,0,0,0,0|2,0,0]=4 27980 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 11a_100020588543_100000751119 [0,2,0,0,0,0|1,0,0]=3 27981 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 240690a_100020588543_100000751119 [0,2,0,0,0,0|1,0,0]=3 27982 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Br 527a_100020588543_100000751119 [0,2,0,0,0,0|1,0,0]=3 27983 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 11a_100020588543_100000212180 [0,2,0,0,0,0|1,0,0]=3 27984 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 1626a_100020588543_100000212180 [0,2,0,0,0,0|1,0,0]=3 27985 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 240690a_100020588543_100000212180 [0,2,0,0,0,0|1,0,0]=3 27986 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1C 527a_100020588543_100000212180 [0,2,0,0,0,0|1,0,0]=3 27987 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 11a_100020588543_100000183793 [0,2,0,0,0,0|1,0,0]=3 27988 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 1626a_100020588543_100000183793 [0,2,0,0,0,0|1,0,0]=3 27989 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 240690a_100020588543_100000183793 [0,2,0,0,0,0|1,0,0]=3 27990 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1Cl 527a_100020588543_100000183793 [0,2,0,0,0,0|1,0,0]=3 27991 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 11a_100020588543_100000212012 [0,2,0,0,0,0|1,0,0]=3 27992 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 1626a_100020588543_100000212012 [0,2,0,0,0,0|1,0,0]=3 27993 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 240690a_100020588543_100000212012 [0,2,0,0,0,0|1,0,0]=3 27994 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1F 527a_100020588543_100000212012 [0,2,0,0,0,0|1,0,0]=3 27995 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 11a_100020588543_100000036491 [0,2,0,0,0,0|1,0,0]=3 27996 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 1626a_100020588543_100000036491 [0,2,0,0,0,0|1,0,0]=3 27997 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 240690a_100020588543_100000036491 [0,2,0,0,0,0|1,0,0]=3 27998 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1I 527a_100020588543_100000036491 [0,2,0,0,0,0|1,0,0]=3 27999 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1O 240690a_100020588543_100000743006 [0,2,0,0,0,0|1,0,0]=3 28000 B16R1.7458 CCC(C)CNC(=O)Cc1ccccc1O 527a_100020588543_100000743006 [0,2,0,0,0,0|1,0,0]=3 28001 B16R1.7458 CCC(C)CNC(=O)Cc1cccnc1Cl 11a_100020588543_100000093521 [0,2,0,0,0,0|2,0,0]=4 28002 B16R1.7458 CCC(C)CNC(=O)Cc1cccnc1Cl 1626a_100020588543_100000093521 [0,2,0,0,0,0|2,0,0]=4 28003 B16R1.7458 CCC(C)CNC(=O)Cc1cccnc1Cl 240690a_100020588543_100000093521 [0,2,0,0,0,0|2,0,0]=4 28004 B16R1.7458 CCC(C)CNC(=O)Cc1cccnc1Cl 527a_100020588543_100000093521 [0,2,0,0,0,0|2,0,0]=4 28005 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1Br 11a_100020588543_200012357574 [0,2,0,0,0,0|2,0,0]=4 28006 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1Br 240690a_100020588543_200012357574 [0,2,0,0,0,0|2,0,0]=4 28007 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1C 11a_100020588543_200000722269 [0,2,0,0,0,0|2,0,0]=4 28008 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1C 1626a_100020588543_200000722269 [0,2,0,0,0,0|2,0,0]=4 28009 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1C 240690a_100020588543_200000722269 [0,2,0,0,0,0|2,0,0]=4 28010 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1Cl 11a_100020588543_100011998755 [0,2,0,0,0,0|2,0,0]=4 28011 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1Cl 240690a_100020588543_100011998755 [0,2,0,0,0,0|2,0,0]=4 28012 B16R1.7458 CCC(C)CNC(=O)Cc1ncccc1Cl 527a_100020588543_100011998755 [0,2,0,0,0,0|2,0,0]=4 28013 B16R1.7458 CCC(C)CNC(=O)Cn1ccccc1=O 1626a_100020588543_100000189665 [0,2,0,0,0,0|2,0,0]=4 28014 B16R1.7458 CCC(C)CNC(=O)Cn1ccccc1=O 240690a_100020588543_100000189665 [0,2,0,0,0,0|2,0,0]=4 28015 B16R1.7458 CCC(C)CNC(=O)Cn1ccccc1=O 527a_100020588543_100000189665 [0,2,0,0,0,0|2,0,0]=4 28016 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100020588543 [0,2,0,0,0,0|2,0,0]=4 28017 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1C 2430a_100015192222_100020588543 [0,2,0,0,0,0|2,0,0]=4 28018 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020588543 [0,2,0,0,0,0|2,0,0]=4 28019 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1F 2430a_100000210422_100020588543 [0,2,0,0,0,0|2,0,0]=4 28020 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1I 2430a_100000210053_100020588543 [0,2,0,0,0,0|2,0,0]=4 28021 B16R1.7458 CCC(C)CNC(=O)Nc1ccccc1O 2430a_100000185747_100020588543 [0,2,0,0,0,0|2,0,0]=4 28022 B16R1.7458 CCC(C)NCC(=O)Cc1ccccc1Br 2230a_100000209981_100000700504 [0,2,0,0,0,0|2,0,0]=4 28023 B16R1.7458 CCC(C)NCC(=O)Cc1ccccc1C 2230a_100000209981_100011223134 [0,2,0,0,0,0|2,0,0]=4 28024 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1Br 22a_100000718999_100000751119 [0,2,0,0,0,0|2,0,0]=4 28025 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1C 22a_100000718999_100000212180 [0,2,0,0,0,0|2,0,0]=4 28026 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1Cl 22a_100000718999_100000183793 [0,2,0,0,0,0|2,0,0]=4 28027 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1F 22a_100000718999_100000212012 [0,2,0,0,0,0|2,0,0]=4 28028 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1I 22a_100000718999_100000036491 [0,2,0,0,0,0|2,0,0]=4 28029 B16R1.7458 CCC(C)NNC(=O)Cc1ccccc1O 22a_100000718999_100000743006 [0,2,0,0,0,0|2,0,0]=4 28030 B16R1.7458 CCC(C)OCC(=O)Cc1ccccc1Br 7a_100000210228_100000700504 [0,2,0,0,0,0|2,0,0]=4 28031 B16R1.7458 CCC(C)OCC(=O)Cc1ccccc1C 7a_100000210228_100011223134 [0,2,0,0,0,0|2,0,0]=4 28032 B16R1.7458 CCC(C)SCC(=O)Cc1ccccc1Br 62a_100000700504_100000758301 [0,2,0,0,0,0|2,0,0]=4 28033 B16R1.7458 CCC(C)SCC(=O)Cc1ccccc1Br 62a_100000758301_100000700504 [0,2,0,0,0,0|2,0,0]=4 28034 B16R1.7458 CCC(C)SCC(=O)Cc1ccccc1C 62a_100000758301_100011223134 [0,2,0,0,0,0|2,0,0]=4 28035 B16R1.7458 CCC(C)SCC(=O)Cc1ccccc1C 62a_100011223134_100000758301 [0,2,0,0,0,0|2,0,0]=4 28036 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Br 1626a_100000210017_203496584001 [0,2,0,0,0,0|2,0,0]=4 28037 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1C 1626a_100015192222_203496584001 [0,2,0,0,0,0|2,0,0]=4 28038 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1C 22a_100015192222_203496584001 [0,2,0,0,0,0|2,0,0]=4 28039 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Cl 1626a_100000185783_203496584001 [0,2,0,0,0,0|2,0,0]=4 28040 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1Cl 22a_100000185783_203496584001 [0,2,0,0,0,0|2,0,0]=4 28041 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1F 1626a_100000210422_203496584001 [0,2,0,0,0,0|2,0,0]=4 28042 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1F 22a_100000210422_203496584001 [0,2,0,0,0,0|2,0,0]=4 28043 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1I 1626a_100000210053_203496584001 [0,2,0,0,0,0|2,0,0]=4 28044 B16R1.7458 CCC(O)CCC(=O)Nc1ccccc1O 22a_100000185747_203496584001 [0,2,0,0,0,0|2,0,0]=4 28045 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 11a_100011218483_100000751119 [0,2,0,0,0,0|1,0,0]=3 28046 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 240690a_100011218483_100000751119 [0,2,0,0,0,0|1,0,0]=3 28047 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Br 527a_100011218483_100000751119 [0,2,0,0,0,0|1,0,0]=3 28048 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 11a_100011218483_100000212180 [0,2,0,0,0,0|1,0,0]=3 28049 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 240690a_100011218483_100000212180 [0,2,0,0,0,0|1,0,0]=3 28050 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1C 527a_100011218483_100000212180 [0,2,0,0,0,0|1,0,0]=3 28051 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 11a_100011218483_100000183793 [0,2,0,0,0,0|1,0,0]=3 28052 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 240690a_100011218483_100000183793 [0,2,0,0,0,0|1,0,0]=3 28053 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1Cl 527a_100011218483_100000183793 [0,2,0,0,0,0|1,0,0]=3 28054 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 11a_100011218483_100000212012 [0,2,0,0,0,0|1,0,0]=3 28055 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 240690a_100011218483_100000212012 [0,2,0,0,0,0|1,0,0]=3 28056 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1F 527a_100011218483_100000212012 [0,2,0,0,0,0|1,0,0]=3 28057 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 11a_100011218483_100000036491 [0,2,0,0,0,0|1,0,0]=3 28058 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 240690a_100011218483_100000036491 [0,2,0,0,0,0|1,0,0]=3 28059 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1I 527a_100011218483_100000036491 [0,2,0,0,0,0|1,0,0]=3 28060 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1O 240690a_100011218483_100000743006 [0,2,0,0,0,0|1,0,0]=3 28061 B16R1.7458 CCC(O)CNC(=O)Cc1ccccc1O 527a_100011218483_100000743006 [0,2,0,0,0,0|1,0,0]=3 28062 B16R1.7458 CCC(O)CNC(=O)Cc1cccnc1Cl 11a_100011218483_100000093521 [0,2,0,0,0,0|2,0,0]=4 28063 B16R1.7458 CCC(O)CNC(=O)Cc1cccnc1Cl 240690a_100011218483_100000093521 [0,2,0,0,0,0|2,0,0]=4 28064 B16R1.7458 CCC(O)CNC(=O)Cc1cccnc1Cl 527a_100011218483_100000093521 [0,2,0,0,0,0|2,0,0]=4 28065 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1Br 11a_100011218483_200012357574 [0,2,0,0,0,0|2,0,0]=4 28066 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1Br 240690a_100011218483_200012357574 [0,2,0,0,0,0|2,0,0]=4 28067 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1C 11a_100011218483_200000722269 [0,2,0,0,0,0|2,0,0]=4 28068 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1C 240690a_100011218483_200000722269 [0,2,0,0,0,0|2,0,0]=4 28069 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1Cl 11a_100011218483_100011998755 [0,2,0,0,0,0|2,0,0]=4 28070 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1Cl 240690a_100011218483_100011998755 [0,2,0,0,0,0|2,0,0]=4 28071 B16R1.7458 CCC(O)CNC(=O)Cc1ncccc1Cl 527a_100011218483_100011998755 [0,2,0,0,0,0|2,0,0]=4 28072 B16R1.7458 CCC(O)CNC(=O)Cn1ccccc1=O 240690a_100011218483_100000189665 [0,2,0,0,0,0|2,0,0]=4 28073 B16R1.7458 CCC(O)CNC(=O)Cn1ccccc1=O 527a_100011218483_100000189665 [0,2,0,0,0,0|2,0,0]=4 28074 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1Br 2430a_100000210017_100011218483 [0,2,0,0,0,0|2,0,0]=4 28075 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1C 2430a_100015192222_100011218483 [0,2,0,0,0,0|2,0,0]=4 28076 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1Cl 2430a_100000185783_100011218483 [0,2,0,0,0,0|2,0,0]=4 28077 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1F 2430a_100000210422_100011218483 [0,2,0,0,0,0|2,0,0]=4 28078 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1I 2430a_100000210053_100011218483 [0,2,0,0,0,0|2,0,0]=4 28079 B16R1.7458 CCC(O)CNC(=O)Nc1ccccc1O 2430a_100000185747_100011218483 [0,2,0,0,0,0|2,0,0]=4 28080 B16R1.7458 CCN(C)CCC(=O)Cc1ccccc1Br 1458a_100000755305_100000184730 [0,2,0,0,0,0|2,0,0]=4 28081 B16R1.7458 CCN(C)CCC(=O)Cc1ccccc1C 1458a_100000755305_100000211839 [0,2,0,0,0,0|2,0,0]=4 28082 B16R1.7458 CCN(C)CCC(=O)Cc1ccccc1Cl 1458a_100000755305_100000187162 [0,2,0,0,0,0|2,0,0]=4 28083 B16R1.7458 CCN(C)CCC(=O)Cc1ccccc1F 1458a_100000755305_100000187165 [0,2,0,0,0,0|2,0,0]=4 28084 B16R1.7458 CCN(C)CCC(=O)Cc1ccccc1I 1458a_100000755305_100011216222 [0,2,0,0,0,0|2,0,0]=4 28085 B16R1.7458 CCS(=O)CCC(=O)Cc1ccccc1Br 1458a_100011387550_100000184730 [0,2,0,0,0,0|2,0,0]=4 28086 B16R1.7458 CCS(=O)CCC(=O)Cc1ccccc1C 1458a_100011387550_100000211839 [0,2,0,0,0,0|2,0,0]=4 28087 B16R1.7458 CCS(=O)CCC(=O)Cc1ccccc1Cl 1458a_100011387550_100000187162 [0,2,0,0,0,0|2,0,0]=4 28088 B16R1.7458 CCS(=O)CCC(=O)Cc1ccccc1F 1458a_100011387550_100000187165 [0,2,0,0,0,0|2,0,0]=4 28089 B16R1.7458 CCS(=O)CCC(=O)Cc1ccccc1I 1458a_100011387550_100011216222 [0,2,0,0,0,0|2,0,0]=4 28090 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Br 11a_100020591295_100000751119 [0,2,0,0,0,0|2,0,0]=4 28091 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Br 240690a_100020591295_100000751119 [0,2,0,0,0,0|2,0,0]=4 28092 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Br 527a_100020591295_100000751119 [0,2,0,0,0,0|2,0,0]=4 28093 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C 11a_100020591295_100000212180 [0,2,0,0,0,0|2,0,0]=4 28094 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C 1626a_100020591295_100000212180 [0,2,0,0,0,0|2,0,0]=4 28095 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C 240690a_100020591295_100000212180 [0,2,0,0,0,0|2,0,0]=4 28096 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1C 527a_100020591295_100000212180 [0,2,0,0,0,0|2,0,0]=4 28097 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl 11a_100020591295_100000183793 [0,2,0,0,0,0|2,0,0]=4 28098 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl 1626a_100020591295_100000183793 [0,2,0,0,0,0|2,0,0]=4 28099 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl 240690a_100020591295_100000183793 [0,2,0,0,0,0|2,0,0]=4 28100 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1Cl 527a_100020591295_100000183793 [0,2,0,0,0,0|2,0,0]=4 28101 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F 11a_100020591295_100000212012 [0,2,0,0,0,0|2,0,0]=4 28102 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F 1626a_100020591295_100000212012 [0,2,0,0,0,0|2,0,0]=4 28103 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F 240690a_100020591295_100000212012 [0,2,0,0,0,0|2,0,0]=4 28104 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1F 527a_100020591295_100000212012 [0,2,0,0,0,0|2,0,0]=4 28105 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I 11a_100020591295_100000036491 [0,2,0,0,0,0|2,0,0]=4 28106 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I 1626a_100020591295_100000036491 [0,2,0,0,0,0|2,0,0]=4 28107 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I 240690a_100020591295_100000036491 [0,2,0,0,0,0|2,0,0]=4 28108 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1I 527a_100020591295_100000036491 [0,2,0,0,0,0|2,0,0]=4 28109 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O 240690a_100020591295_100000743006 [0,2,0,0,0,0|2,0,0]=4 28110 B16R1.7458 CO[C@H](C)CNC(=O)Cc1ccccc1O 527a_100020591295_100000743006 [0,2,0,0,0,0|2,0,0]=4 28111 B16R1.7458 Cc1ccccc1CC(=O)NCC(C)CO 240690a_100000744482_100000212180 [0,2,0,0,0,0|2,0,0]=4 28112 B16R1.7458 Cc1ccccc1CC(=O)NCC(C)CO 527a_100000744482_100000212180 [0,2,0,0,0,0|2,0,0]=4 28113 B16R1.7458 Cc1ccccc1CC(=O)NC[C@@H](F)CO 240690a_100015665980_100000212180 [0,2,0,0,0,0|2,0,0]=4 28114 B16R1.7458 Cc1ccccc1CC(=O)NC[C@@H](F)CO 527a_100015665980_100000212180 [0,2,0,0,0,0|2,0,0]=4 28115 B16R1.7458 Cc1ccccc1CC(=O)NC[C@H](O)CO 240690a_100020644852_100000212180 [0,2,0,0,0,0|2,0,0]=4 28116 B16R1.7458 Cc1ccccc1CC(=O)NC[C@H](O)CO 527a_100020644852_100000212180 [0,2,0,0,0,0|2,0,0]=4 28117 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@@H](F)CO 240690a_100015665980_100000751119 [0,2,0,0,0,0|2,0,0]=4 28118 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@@H](F)CO 527a_100015665980_100000751119 [0,2,0,0,0,0|2,0,0]=4 28119 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@H](O)CO 240690a_100020644852_100000751119 [0,2,0,0,0,0|2,0,0]=4 28120 B16R1.7458 O=C(Cc1ccccc1Br)NC[C@H](O)CO 527a_100020644852_100000751119 [0,2,0,0,0,0|2,0,0]=4 28121 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@@H](F)CO 240690a_100015665980_100000183793 [0,2,0,0,0,0|2,0,0]=4 28122 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@@H](F)CO 527a_100015665980_100000183793 [0,2,0,0,0,0|2,0,0]=4 28123 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@H](O)CO 240690a_100020644852_100000183793 [0,2,0,0,0,0|2,0,0]=4 28124 B16R1.7458 O=C(Cc1ccccc1Cl)NC[C@H](O)CO 527a_100020644852_100000183793 [0,2,0,0,0,0|2,0,0]=4 28125 B16R1.7458 O=C(Cc1ccccc1F)NC[C@@H](F)CO 240690a_100015665980_100000212012 [0,2,0,0,0,0|2,0,0]=4 28126 B16R1.7458 O=C(Cc1ccccc1F)NC[C@@H](F)CO 527a_100015665980_100000212012 [0,2,0,0,0,0|2,0,0]=4 28127 B16R1.7458 O=C(Cc1ccccc1F)NC[C@H](O)CO 240690a_100020644852_100000212012 [0,2,0,0,0,0|2,0,0]=4 28128 B16R1.7458 O=C(Cc1ccccc1F)NC[C@H](O)CO 527a_100020644852_100000212012 [0,2,0,0,0,0|2,0,0]=4 28129 B16R1.7458 O=C(Cc1ccccc1I)NC[C@@H](F)CO 240690a_100015665980_100000036491 [0,2,0,0,0,0|2,0,0]=4 28130 B16R1.7458 O=C(Cc1ccccc1I)NC[C@@H](F)CO 527a_100015665980_100000036491 [0,2,0,0,0,0|2,0,0]=4 28131 B16R1.7458 O=C(Cc1ccccc1I)NC[C@H](O)CO 240690a_100020644852_100000036491 [0,2,0,0,0,0|2,0,0]=4 28132 B16R1.7458 O=C(Cc1ccccc1I)NC[C@H](O)CO 527a_100020644852_100000036491 [0,2,0,0,0,0|2,0,0]=4 28133 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO 240690a_100015665980_100000743006 [0,2,0,0,0,0|2,0,0]=4 28134 B16R1.7458 O=C(Cc1ccccc1O)NC[C@@H](F)CO 527a_100015665980_100000743006 [0,2,0,0,0,0|2,0,0]=4 28135 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO 240690a_100020644852_100000743006 [0,2,0,0,0,0|2,0,0]=4 28136 B16R1.7458 O=C(Cc1ccccc1O)NC[C@H](O)CO 527a_100020644852_100000743006 [0,2,0,0,0,0|2,0,0]=4 28137 B16R1.18389 CCC(C)CNS(=O)(=O)Cc1ccccc1 270084a_100020588543_100000211737 [0,2,0,0,0,0|2,0,0]=4 28138 B16R1.18389 CCC(C)CNS(=O)(=O)Cc1ccccc1 274078a_100020588543_100000211737 [0,2,0,0,0,0|2,0,0]=4 28139 B16R1.18389 CCC(C)CNS(=O)(=O)Cc1ccccc1 40a_100020588543_100000235865 [0,2,0,0,0,0|2,0,0]=4 28140 B16R1.18389 CCC(C)COC(C)(C)Cc1ccccc1 7a_100011215222_100000748023 [0,2,0,0,0,0|1,0,1]=4 28141 B16R1.18389 CCC(O)CNS(=O)(=O)Cc1ccccc1 270084a_100011218483_100000211737 [0,2,0,0,0,0|2,0,0]=4 28142 B16R1.18389 CCC(O)CNS(=O)(=O)Cc1ccccc1 274078a_100011218483_100000211737 [0,2,0,0,0,0|2,0,0]=4 28143 B16R1.18389 CCC(O)CNS(=O)(=O)Cc1ccccc1 40a_100011218483_100000235865 [0,2,0,0,0,0|2,0,0]=4 28144 B16R1.18389 CCC(O)COC(C)(C)Cc1ccccc1 7a_100011215222_100011218378 [0,2,0,0,0,0|1,0,1]=4 28145 B16R1.18389 CC[C@H](C)COC(C)(C)Cc1ccccc1 7a_100011215222_100009816398 [0,2,0,0,0,0|1,0,1]=4 28146 B16R1.1759 CCCCNC(Cc1ccccc1)C(=O)N 2230a_100000745710_100000210211 [0,2,0,0,0,0|1,0,1]=4 28147 B16R1.1759 CCCCNC(Cc1ccccc1)C(=O)N 34a_100000745710_100000210210 [0,2,0,0,0,0|1,0,1]=4 28148 B16R1.3379 C#CC(Cc1ccccc1)OCCC(C)C 34a_100000685211_100000210312 [0,2,0,0,0,0|1,0,1]=4 28149 B16R1.3379 C#CC(Cc1ccccc1)OCCC(C)C 7a_100000685211_100000210626 [0,2,0,0,0,0|1,0,1]=4 28150 B16R1.3379 C#CC(Cc1ccccc1)OCCC(C)O 34a_100000685211_100012276601 [0,2,0,0,0,0|1,0,1]=4 28151 B16R1.3379 C#CC(Cc1ccccc1)OCCC(C)O 7a_100000685211_100012276601 [0,2,0,0,0,0|1,0,1]=4 28152 B16R1.3379 CC(C)CCOC(C#N)Cc1ccccc1 7a_100000210254_100000183401 [0,2,0,0,0,0|1,0,1]=4 28153 B16R1.3379 CC(C)CCOC(CN)Cc1ccccc1 34a_100000752270_100000210312 [0,2,0,0,0,0|1,0,1]=4 28154 B16R1.3379 CC(C)CCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000210626 [0,2,0,0,0,0|1,0,1]=4 28155 B16R1.3379 CC(O)CCOC(CN)Cc1ccccc1 34a_100000752270_100012276601 [0,2,0,0,0,0|1,0,1]=4 28156 B16R1.3379 CC(O)CCO[C@H](CCl)Cc1ccccc1 7a_100000729385_100012276601 [0,2,0,0,0,0|1,0,1]=4 28157 B16R1.3379 CCC(Cc1ccccc1)OCCC(C)C 7a_100000760156_100000210626 [0,2,0,0,0,0|1,0,1]=4 28158 B16R1.3379 CCC(Cc1ccccc1)OCCC(C)O 7a_100000760156_100012276601 [0,2,0,0,0,0|1,0,1]=4 28159 B16R1.20514 CCCCOC(C)(CC)Cc1ccccc1 7a_100011346069_100000210211 [0,2,0,0,0,0|1,0,1]=4 28160 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011215641 [0,2,0,0,0,0|1,0,1]=4 28161 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1C 1458a_100000212180_100011215641 [0,2,0,0,0,0|1,0,1]=4 28162 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215641 [0,2,0,0,0,0|1,0,1]=4 28163 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100011215641 [0,2,0,0,0,0|1,0,1]=4 28164 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100011215641 [0,2,0,0,0,0|1,0,1]=4 28165 B16R1.7414 CC(=O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011215641 [0,2,0,0,0,0|1,0,1]=4 28166 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Br 1458a_100000070787_100020589338 [0,2,0,0,0,0|1,0,1]=4 28167 B16R1.7414 CC(=O)CCOC(=O)Nc1ccccc1Cl 1458a_100000070787_200000178450 [0,2,0,0,0,0|1,0,1]=4 28168 B16R1.7414 CC(Br)COCC(=O)Cc1ccccc1Br 34a_100012180447_100000700504 [0,2,0,0,0,0|2,0,0]=4 28169 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100011214892 [0,2,0,0,0,0|1,0,0]=3 28170 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Br 1458a_100011216857_100000184730 [0,2,0,0,0,0|1,0,0]=3 28171 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011214892 [0,2,0,0,0,0|1,0,0]=3 28172 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1Cl 1458a_100011216857_100000187162 [0,2,0,0,0,0|1,0,0]=3 28173 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100011214892 [0,2,0,0,0,0|1,0,0]=3 28174 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1F 1458a_100011216857_100000187165 [0,2,0,0,0,0|1,0,0]=3 28175 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100011214892 [0,2,0,0,0,0|1,0,0]=3 28176 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1I 1458a_100011216857_100011216222 [0,2,0,0,0,0|1,0,0]=3 28177 B16R1.7414 CC(C)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100011214892 [0,2,0,0,0,0|1,0,0]=3 28178 B16R1.7414 CC(C)CCCC(=O)Cc1cccnc1Br 1458a_100011216857_100010140945 [0,2,0,0,0,0|2,0,0]=4 28179 B16R1.7414 CC(C)CCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100011214892 [0,2,0,0,0,0|2,0,0]=4 28180 B16R1.7414 CC(C)CCCC(=O)Cc1cccnc1Cl 1458a_100011216857_100000045678 [0,2,0,0,0,0|2,0,0]=4 28181 B16R1.7414 CC(C)CCCC(=O)Cc1cccnc1F 1458a_100011216857_100000099810 [0,2,0,0,0,0|2,0,0]=4 28182 B16R1.7414 CC(C)CCCC(=O)Cc1ccncc1Cl 1458a_100011216857_100000763264 [0,2,0,0,0,0|2,0,0]=4 28183 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1Br 1458a_100011216857_100025702911 [0,2,0,0,0,0|2,0,0]=4 28184 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1Br 1458a_200012357574_100011214892 [0,2,0,0,0,0|2,0,0]=4 28185 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1Cl 1458a_100011216857_100000099807 [0,2,0,0,0,0|2,0,0]=4 28186 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100011214892 [0,2,0,0,0,0|2,0,0]=4 28187 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1F 1458a_100011216857_100000104219 [0,2,0,0,0,0|2,0,0]=4 28188 B16R1.7414 CC(C)CCCC(=O)Cc1ncccc1O 1458a_100011216857_200020655725 [0,2,0,0,0,0|2,0,0]=4 28189 B16R1.7414 CC(C)CCCC(=O)Cn1ccccc1=O 1458a_100000189665_100011214892 [0,2,0,0,0,0|2,0,0]=4 28190 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br 11a_100000210017_100011216857 [0,2,0,0,0,0|2,0,0]=4 28191 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100011216857 [0,2,0,0,0,0|2,0,0]=4 28192 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100011216857 [0,2,0,0,0,0|2,0,0]=4 28193 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100011216857 [0,2,0,0,0,0|2,0,0]=4 28194 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100011216857 [0,2,0,0,0,0|2,0,0]=4 28195 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100011216857 [0,2,0,0,0,0|2,0,0]=4 28196 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 11a_100000210422_100011216857 [0,2,0,0,0,0|2,0,0]=4 28197 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 1626a_100000210422_100011216857 [0,2,0,0,0,0|2,0,0]=4 28198 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 22a_100000210422_100011216857 [0,2,0,0,0,0|2,0,0]=4 28199 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1F 527a_100000210422_100011216857 [0,2,0,0,0,0|2,0,0]=4 28200 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I 11a_100000210053_100011216857 [0,2,0,0,0,0|2,0,0]=4 28201 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I 1626a_100000210053_100011216857 [0,2,0,0,0,0|2,0,0]=4 28202 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1O 22a_100000185747_100011216857 [0,2,0,0,0,0|2,0,0]=4 28203 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1O 527a_100000185747_100011216857 [0,2,0,0,0,0|2,0,0]=4 28204 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 11a_100000210545_100000751119 [0,2,0,0,0,0|1,0,0]=3 28205 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 240690a_100000210545_100000751119 [0,2,0,0,0,0|1,0,0]=3 28206 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Br 527a_100000210545_100000751119 [0,2,0,0,0,0|1,0,0]=3 28207 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 11a_100000210545_100000183793 [0,2,0,0,0,0|1,0,0]=3 28208 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 1626a_100000210545_100000183793 [0,2,0,0,0,0|1,0,0]=3 28209 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 240690a_100000210545_100000183793 [0,2,0,0,0,0|1,0,0]=3 28210 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1Cl 527a_100000210545_100000183793 [0,2,0,0,0,0|1,0,0]=3 28211 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 11a_100000210545_100000212012 [0,2,0,0,0,0|1,0,0]=3 28212 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 1626a_100000210545_100000212012 [0,2,0,0,0,0|1,0,0]=3 28213 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 240690a_100000210545_100000212012 [0,2,0,0,0,0|1,0,0]=3 28214 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F 527a_100000210545_100000212012 [0,2,0,0,0,0|1,0,0]=3 28215 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 11a_100000210545_100000036491 [0,2,0,0,0,0|1,0,0]=3 28216 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 1626a_100000210545_100000036491 [0,2,0,0,0,0|1,0,0]=3 28217 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 240690a_100000210545_100000036491 [0,2,0,0,0,0|1,0,0]=3 28218 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I 527a_100000210545_100000036491 [0,2,0,0,0,0|1,0,0]=3 28219 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O 240690a_100000210545_100000743006 [0,2,0,0,0,0|1,0,0]=3 28220 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1O 527a_100000210545_100000743006 [0,2,0,0,0,0|1,0,0]=3 28221 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl 11a_100000210545_100000093521 [0,2,0,0,0,0|2,0,0]=4 28222 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl 1626a_100000210545_100000093521 [0,2,0,0,0,0|2,0,0]=4 28223 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl 240690a_100000210545_100000093521 [0,2,0,0,0,0|2,0,0]=4 28224 B16R1.7414 CC(C)CCNC(=O)Cc1cccnc1Cl 527a_100000210545_100000093521 [0,2,0,0,0,0|2,0,0]=4 28225 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Br 11a_100000210545_200012357574 [0,2,0,0,0,0|2,0,0]=4 28226 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Br 240690a_100000210545_200012357574 [0,2,0,0,0,0|2,0,0]=4 28227 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Cl 11a_100000210545_100011998755 [0,2,0,0,0,0|2,0,0]=4 28228 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Cl 240690a_100000210545_100011998755 [0,2,0,0,0,0|2,0,0]=4 28229 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Cl 527a_100000210545_100011998755 [0,2,0,0,0,0|2,0,0]=4 28230 B16R1.7414 CC(C)CCNC(=O)Cn1ccccc1=O 1626a_100000210545_100000189665 [0,2,0,0,0,0|2,0,0]=4 28231 B16R1.7414 CC(C)CCNC(=O)Cn1ccccc1=O 240690a_100000210545_100000189665 [0,2,0,0,0,0|2,0,0]=4 28232 B16R1.7414 CC(C)CCNC(=O)Cn1ccccc1=O 527a_100000210545_100000189665 [0,2,0,0,0,0|2,0,0]=4 28233 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100000210545 [0,2,0,0,0,0|2,0,0]=4 28234 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100000210545 [0,2,0,0,0,0|2,0,0]=4 28235 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1F 2430a_100000210422_100000210545 [0,2,0,0,0,0|2,0,0]=4 28236 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1I 2430a_100000210053_100000210545 [0,2,0,0,0,0|2,0,0]=4 28237 B16R1.7414 CC(C)CCNC(=O)Nc1ccccc1O 2430a_100000185747_100000210545 [0,2,0,0,0,0|2,0,0]=4 28238 B16R1.7414 CC(C)CNCC(=O)Cc1ccccc1Br 2230a_100000210953_100000700504 [0,2,0,0,0,0|2,0,0]=4 28239 B16R1.7414 CC(C)CNCC(=O)Cc1ccccc1Br 34a_100000210953_100000700504 [0,2,0,0,0,0|2,0,0]=4 28240 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1Br 22a_100000696102_100000751119 [0,2,0,0,0,0|2,0,0]=4 28241 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1Cl 22a_100000696102_100000183793 [0,2,0,0,0,0|2,0,0]=4 28242 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1F 22a_100000696102_100000212012 [0,2,0,0,0,0|2,0,0]=4 28243 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1I 22a_100000696102_100000036491 [0,2,0,0,0,0|2,0,0]=4 28244 B16R1.7414 CC(C)CNNC(=O)Cc1ccccc1O 22a_100000696102_100000743006 [0,2,0,0,0,0|2,0,0]=4 28245 B16R1.7414 CC(C)COCC(=O)Cc1ccccc1Br 1458a_100011223364_100000184730 [0,2,0,0,0,0|2,0,0]=4 28246 B16R1.7414 CC(C)COCC(=O)Cc1ccccc1Br 34a_100000210257_100000700504 [0,2,0,0,0,0|2,0,0]=4 28247 B16R1.7414 CC(C)COCC(=O)Cc1ccccc1Cl 1458a_100011223364_100000187162 [0,2,0,0,0,0|2,0,0]=4 28248 B16R1.7414 CC(C)COCC(=O)Cc1ccccc1F 1458a_100011223364_100000187165 [0,2,0,0,0,0|2,0,0]=4 28249 B16R1.7414 CC(C)COCC(=O)Cc1ccccc1I 1458a_100011223364_100011216222 [0,2,0,0,0,0|2,0,0]=4 28250 B16R1.7414 CC(C)CSCC(=O)Cc1ccccc1Br 62a_100000210624_100000700504 [0,2,0,0,0,0|2,0,0]=4 28251 B16R1.7414 CC(C)CSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210760 [0,2,0,0,0,0|2,0,0]=4 28252 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000211751 [0,2,0,0,0,0|2,0,0]=4 28253 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000211751 [0,2,0,0,0,0|2,0,0]=4 28254 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1F 1458a_100000212012_100000211751 [0,2,0,0,0,0|2,0,0]=4 28255 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1I 1458a_100000036491_100000211751 [0,2,0,0,0,0|2,0,0]=4 28256 B16R1.7414 CC(C)OCCC(=O)Cc1ccccc1O 1458a_100000743006_100000211751 [0,2,0,0,0,0|2,0,0]=4 28257 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000730970 [0,2,0,0,0,0|2,0,0]=4 28258 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000730970 [0,2,0,0,0,0|2,0,0]=4 28259 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1F 1458a_100000212012_100000730970 [0,2,0,0,0,0|2,0,0]=4 28260 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1I 1458a_100000036491_100000730970 [0,2,0,0,0,0|2,0,0]=4 28261 B16R1.7414 CC(C)SCCC(=O)Cc1ccccc1O 1458a_100000743006_100000730970 [0,2,0,0,0,0|2,0,0]=4 28262 B16R1.7414 CC(F)COCC(=O)Cc1ccccc1Br 34a_100015925927_100000700504 [0,2,0,0,0,0|2,0,0]=4 28263 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_200000718107 [0,2,0,0,0,0|1,0,0]=3 28264 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_200000718107 [0,2,0,0,0,0|1,0,0]=3 28265 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1F 1458a_100000212012_200000718107 [0,2,0,0,0,0|1,0,0]=3 28266 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1I 1458a_100000036491_200000718107 [0,2,0,0,0,0|1,0,0]=3 28267 B16R1.7414 CC(O)CCCC(=O)Cc1ccccc1O 1458a_100000743006_200000718107 [0,2,0,0,0,0|1,0,0]=3 28268 B16R1.7414 CC(O)CCCC(=O)Cc1cccnc1Cl 1458a_100000093521_200000718107 [0,2,0,0,0,0|2,0,0]=4 28269 B16R1.7414 CC(O)CCCC(=O)Cc1ncccc1Br 1458a_200012357574_200000718107 [0,2,0,0,0,0|2,0,0]=4 28270 B16R1.7414 CC(O)CCCC(=O)Cc1ncccc1Cl 1458a_100011998755_200000718107 [0,2,0,0,0,0|2,0,0]=4 28271 B16R1.7414 CC(O)CCCC(=O)Cn1ccccc1=O 1458a_100000189665_200000718107 [0,2,0,0,0,0|2,0,0]=4 28272 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000761597 [0,2,0,0,0,0|2,0,0]=4 28273 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000761597 [0,2,0,0,0,0|2,0,0]=4 28274 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000761597 [0,2,0,0,0,0|2,0,0]=4 28275 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000761597 [0,2,0,0,0,0|2,0,0]=4 28276 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 1626a_100000210422_100000761597 [0,2,0,0,0,0|2,0,0]=4 28277 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 22a_100000210422_100000761597 [0,2,0,0,0,0|2,0,0]=4 28278 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1F 527a_100000210422_100000761597 [0,2,0,0,0,0|2,0,0]=4 28279 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1I 1626a_100000210053_100000761597 [0,2,0,0,0,0|2,0,0]=4 28280 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 22a_100000185747_100000761597 [0,2,0,0,0,0|2,0,0]=4 28281 B16R1.7414 CC(O)CCCC(=O)Nc1ccccc1O 527a_100000185747_100000761597 [0,2,0,0,0,0|2,0,0]=4 28282 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Br 240690a_200000755665_100000751119 [0,2,0,0,0,0|1,0,0]=3 28283 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Br 527a_200000755665_100000751119 [0,2,0,0,0,0|1,0,0]=3 28284 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Cl 240690a_200000755665_100000183793 [0,2,0,0,0,0|1,0,0]=3 28285 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1Cl 527a_200000755665_100000183793 [0,2,0,0,0,0|1,0,0]=3 28286 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1F 240690a_200000755665_100000212012 [0,2,0,0,0,0|1,0,0]=3 28287 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1F 527a_200000755665_100000212012 [0,2,0,0,0,0|1,0,0]=3 28288 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1I 240690a_200000755665_100000036491 [0,2,0,0,0,0|1,0,0]=3 28289 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1I 527a_200000755665_100000036491 [0,2,0,0,0,0|1,0,0]=3 28290 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 240690a_200000755665_100000743006 [0,2,0,0,0,0|1,0,0]=3 28291 B16R1.7414 CC(O)CCNC(=O)Cc1ccccc1O 527a_200000755665_100000743006 [0,2,0,0,0,0|1,0,0]=3 28292 B16R1.7414 CC(O)CCNC(=O)Cc1cccnc1Cl 240690a_200000755665_100000093521 [0,2,0,0,0,0|2,0,0]=4 28293 B16R1.7414 CC(O)CCNC(=O)Cc1cccnc1Cl 527a_200000755665_100000093521 [0,2,0,0,0,0|2,0,0]=4 28294 B16R1.7414 CC(O)CCNC(=O)Cc1ncccc1Br 240690a_200000755665_200012357574 [0,2,0,0,0,0|2,0,0]=4 28295 B16R1.7414 CC(O)CCNC(=O)Cc1ncccc1Cl 240690a_200000755665_100011998755 [0,2,0,0,0,0|2,0,0]=4 28296 B16R1.7414 CC(O)CCNC(=O)Cc1ncccc1Cl 527a_200000755665_100011998755 [0,2,0,0,0,0|2,0,0]=4 28297 B16R1.7414 CC(O)CCNC(=O)Cn1ccccc1=O 240690a_200000755665_100000189665 [0,2,0,0,0,0|2,0,0]=4 28298 B16R1.7414 CC(O)CCNC(=O)Cn1ccccc1=O 527a_200000755665_100000189665 [0,2,0,0,0,0|2,0,0]=4 28299 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1Br 2430a_100000210017_200000755665 [0,2,0,0,0,0|2,0,0]=4 28300 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_200000755665 [0,2,0,0,0,0|2,0,0]=4 28301 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1F 2430a_100000210422_200000755665 [0,2,0,0,0,0|2,0,0]=4 28302 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1I 2430a_100000210053_200000755665 [0,2,0,0,0,0|2,0,0]=4 28303 B16R1.7414 CC(O)CCNC(=O)Nc1ccccc1O 2430a_100000185747_200000755665 [0,2,0,0,0,0|2,0,0]=4 28304 B16R1.7414 CC(O)CNCC(=O)Cc1ccccc1Br 2230a_100000210904_100000700504 [0,2,0,0,0,0|2,0,0]=4 28305 B16R1.7414 CC(O)CNCC(=O)Cc1ccccc1Br 34a_100000210904_100000700504 [0,2,0,0,0,0|2,0,0]=4 28306 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1Br 22a_200000730056_100000751119 [0,2,0,0,0,0|2,0,0]=4 28307 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1Cl 22a_200000730056_100000183793 [0,2,0,0,0,0|2,0,0]=4 28308 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1F 22a_200000730056_100000212012 [0,2,0,0,0,0|2,0,0]=4 28309 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1I 22a_200000730056_100000036491 [0,2,0,0,0,0|2,0,0]=4 28310 B16R1.7414 CC(O)CNNC(=O)Cc1ccccc1O 22a_200000730056_100000743006 [0,2,0,0,0,0|2,0,0]=4 28311 B16R1.7414 CC(O)CSCC(=O)Cc1ccccc1Br 62a_100000700504_100011218427 [0,2,0,0,0,0|2,0,0]=4 28312 B16R1.7414 CC(O)CSCC(=O)Cc1ccccc1Br 62a_100011218427_100000700504 [0,2,0,0,0,0|2,0,0]=4 28313 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000695564 [0,2,0,0,0,0|2,0,0]=4 28314 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000695564 [0,2,0,0,0,0|2,0,0]=4 28315 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1F 1458a_100000212012_100000695564 [0,2,0,0,0,0|2,0,0]=4 28316 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1I 1458a_100000036491_100000695564 [0,2,0,0,0,0|2,0,0]=4 28317 B16R1.7414 CN(C)CCCC(=O)Cc1ccccc1O 1458a_100000743006_100000695564 [0,2,0,0,0,0|2,0,0]=4 28318 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Br 240690a_100000210585_100000751119 [0,2,0,0,0,0|2,0,0]=4 28319 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Br 527a_100000210585_100000751119 [0,2,0,0,0,0|2,0,0]=4 28320 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl 240690a_100000210585_100000183793 [0,2,0,0,0,0|2,0,0]=4 28321 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl 527a_100000210585_100000183793 [0,2,0,0,0,0|2,0,0]=4 28322 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F 240690a_100000210585_100000212012 [0,2,0,0,0,0|2,0,0]=4 28323 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F 527a_100000210585_100000212012 [0,2,0,0,0,0|2,0,0]=4 28324 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1I 240690a_100000210585_100000036491 [0,2,0,0,0,0|2,0,0]=4 28325 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1I 527a_100000210585_100000036491 [0,2,0,0,0,0|2,0,0]=4 28326 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O 240690a_100000210585_100000743006 [0,2,0,0,0,0|2,0,0]=4 28327 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O 527a_100000210585_100000743006 [0,2,0,0,0,0|2,0,0]=4 28328 B16R1.7414 CN(C)CCOC(=O)Nc1ccccc1Br 269982a_100102631434_100020589338 [0,2,0,0,0,0|2,0,0]=4 28329 B16R1.7414 CN(C)CCOC(=O)Nc1ccccc1Cl 269982a_100102631434_200000178450 [0,2,0,0,0,0|2,0,0]=4 28330 B16R1.7414 C[C@@H](Cl)COCC(=O)Cc1ccccc1Br 34a_100016084084_100000700504 [0,2,0,0,0,0|2,0,0]=4 28331 B16R1.7414 C[C@@H](N)COCC(=O)Cc1ccccc1Br 34a_100000737577_100000700504 [0,2,0,0,0,0|2,0,0]=4 28332 B16R1.7414 C[C@@H](O)CSCC(=O)Cc1ccccc1Br 62a_100000700504_100009817552 [0,2,0,0,0,0|2,0,0]=4 28333 B16R1.7414 C[C@@H](O)CSCC(=O)Cc1ccccc1Br 62a_100009817552_100000700504 [0,2,0,0,0,0|2,0,0]=4 28334 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)C 1458a_100000212180_100011214892 [0,2,0,0,0,0|1,0,0]=3 28335 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)C 1458a_100011216857_100000211839 [0,2,0,0,0,0|1,0,0]=3 28336 B16R1.7414 Cc1ccccc1CC(=O)CCCC(C)O 1458a_100000212180_200000718107 [0,2,0,0,0,0|1,0,0]=3 28337 B16R1.7414 Cc1ccccc1CC(=O)CCCN(C)C 1458a_100000212180_100000695564 [0,2,0,0,0,0|2,0,0]=4 28338 B16R1.7414 Cc1ccccc1CC(=O)CCOC(C)C 1458a_100000212180_100000211751 [0,2,0,0,0,0|2,0,0]=4 28339 B16R1.7414 Cc1ccccc1CC(=O)CCSC(C)C 1458a_100000212180_100000730970 [0,2,0,0,0,0|2,0,0]=4 28340 B16R1.7414 Cc1ccccc1CC(=O)CNCC(C)C 2230a_100000210953_100011223134 [0,2,0,0,0,0|2,0,0]=4 28341 B16R1.7414 Cc1ccccc1CC(=O)CNCC(C)O 2230a_100000210904_100011223134 [0,2,0,0,0,0|2,0,0]=4 28342 B16R1.7414 Cc1ccccc1CC(=O)COCC(C)C 1458a_100011223364_100000211839 [0,2,0,0,0,0|2,0,0]=4 28343 B16R1.7414 Cc1ccccc1CC(=O)CSCC(C)C 62a_100000210624_100011223134 [0,2,0,0,0,0|2,0,0]=4 28344 B16R1.7414 Cc1ccccc1CC(=O)CSCC(C)C 62a_100011223134_100000210760 [0,2,0,0,0,0|2,0,0]=4 28345 B16R1.7414 Cc1ccccc1CC(=O)CSCC(C)O 62a_100011218427_100011223134 [0,2,0,0,0,0|2,0,0]=4 28346 B16R1.7414 Cc1ccccc1CC(=O)CSCC(C)O 62a_100011223134_100011218427 [0,2,0,0,0,0|2,0,0]=4 28347 B16R1.7414 Cc1ccccc1CC(=O)CSC[C@@H](C)O 62a_100009817552_100011223134 [0,2,0,0,0,0|2,0,0]=4 28348 B16R1.7414 Cc1ccccc1CC(=O)CSC[C@@H](C)O 62a_100011223134_100009817552 [0,2,0,0,0,0|2,0,0]=4 28349 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 11a_100000210545_100000212180 [0,2,0,0,0,0|1,0,0]=3 28350 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 1626a_100000210545_100000212180 [0,2,0,0,0,0|1,0,0]=3 28351 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 240690a_100000210545_100000212180 [0,2,0,0,0,0|1,0,0]=3 28352 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)C 527a_100000210545_100000212180 [0,2,0,0,0,0|1,0,0]=3 28353 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)O 240690a_200000755665_100000212180 [0,2,0,0,0,0|1,0,0]=3 28354 B16R1.7414 Cc1ccccc1CC(=O)NCCC(C)O 527a_200000755665_100000212180 [0,2,0,0,0,0|1,0,0]=3 28355 B16R1.7414 Cc1ccccc1CC(=O)NCCN(C)C 240690a_100000210585_100000212180 [0,2,0,0,0,0|2,0,0]=4 28356 B16R1.7414 Cc1ccccc1CC(=O)NCCN(C)C 527a_100000210585_100000212180 [0,2,0,0,0,0|2,0,0]=4 28357 B16R1.7414 Cc1ccccc1CC(=O)NNCC(C)C 22a_100000696102_100000212180 [0,2,0,0,0,0|2,0,0]=4 28358 B16R1.7414 Cc1ccccc1CC(=O)NNCC(C)O 22a_200000730056_100000212180 [0,2,0,0,0,0|2,0,0]=4 28359 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 11a_100015192222_100011216857 [0,2,0,0,0,0|2,0,0]=4 28360 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 1626a_100015192222_100011216857 [0,2,0,0,0,0|2,0,0]=4 28361 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 22a_100015192222_100011216857 [0,2,0,0,0,0|2,0,0]=4 28362 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C 527a_100015192222_100011216857 [0,2,0,0,0,0|2,0,0]=4 28363 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 1626a_100015192222_100000761597 [0,2,0,0,0,0|2,0,0]=4 28364 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 22a_100015192222_100000761597 [0,2,0,0,0,0|2,0,0]=4 28365 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)O 527a_100015192222_100000761597 [0,2,0,0,0,0|2,0,0]=4 28366 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)C 2430a_100015192222_100000210545 [0,2,0,0,0,0|2,0,0]=4 28367 B16R1.7414 Cc1ccccc1NC(=O)NCCC(C)O 2430a_100015192222_200000755665 [0,2,0,0,0,0|2,0,0]=4 28368 B16R1.7414 Cc1cccnc1CC(=O)CCCC(C)C 1458a_100011216857_100000696600 [0,2,0,0,0,0|2,0,0]=4 28369 B16R1.7414 Cc1cccnc1CC(=O)CCCC(C)C 1458a_200000722269_100011214892 [0,2,0,0,0,0|2,0,0]=4 28370 B16R1.7414 Cc1cccnc1CC(=O)CCCC(C)O 1458a_200000722269_200000718107 [0,2,0,0,0,0|2,0,0]=4 28371 B16R1.7414 Cc1cccnc1CC(=O)NCCC(C)C 11a_100000210545_200000722269 [0,2,0,0,0,0|2,0,0]=4 28372 B16R1.7414 Cc1cccnc1CC(=O)NCCC(C)C 1626a_100000210545_200000722269 [0,2,0,0,0,0|2,0,0]=4 28373 B16R1.7414 Cc1cccnc1CC(=O)NCCC(C)C 240690a_100000210545_200000722269 [0,2,0,0,0,0|2,0,0]=4 28374 B16R1.7414 Cc1cccnc1CC(=O)NCCC(C)O 240690a_200000755665_200000722269 [0,2,0,0,0,0|2,0,0]=4 28375 B16R1.7414 Cc1ccncc1CC(=O)CCCC(C)C 1458a_100011216857_100000690890 [0,2,0,0,0,0|2,0,0]=4 28376 B16R1.7414 Cc1cnccc1CC(=O)CCCC(C)C 1458a_100011216857_100020672808 [0,2,0,0,0,0|2,0,0]=4 28377 B16R1.7414 Cc1ncccc1CC(=O)CCCC(C)C 1458a_100011216857_100000732876 [0,2,0,0,0,0|2,0,0]=4 28378 B16R1.12285 CC(C)CCNS(=O)(=O)Cc1ccccc1 270084a_100000210545_100000211737 [0,2,0,0,0,0|2,0,0]=4 28379 B16R1.12285 CC(C)CCNS(=O)(=O)Cc1ccccc1 274078a_100000210545_100000211737 [0,2,0,0,0,0|2,0,0]=4 28380 B16R1.12285 CC(C)CCNS(=O)(=O)Cc1ccccc1 40a_100000210545_100000235865 [0,2,0,0,0,0|2,0,0]=4 28381 B16R1.12285 CC(C)CCOC(C)(C)Cc1ccccc1 7a_100011215222_100000210626 [0,2,0,0,0,0|1,0,1]=4 28382 B16R1.12285 CC(O)CCNS(=O)(=O)Cc1ccccc1 270084a_200000755665_100000211737 [0,2,0,0,0,0|2,0,0]=4 28383 B16R1.12285 CC(O)CCNS(=O)(=O)Cc1ccccc1 274078a_200000755665_100000211737 [0,2,0,0,0,0|2,0,0]=4 28384 B16R1.12285 CC(O)CCNS(=O)(=O)Cc1ccccc1 40a_200000755665_100000235865 [0,2,0,0,0,0|2,0,0]=4 28385 B16R1.12285 CC(O)CCOC(C)(C)Cc1ccccc1 7a_100011215222_100012276601 [0,2,0,0,0,0|1,0,1]=4 28386 B16R1.59031 CC(C)(C)CCNC(=O)C[n+]1ccccc1 11a_100000738805_200000086051 [0,2,0,0,0,0|2,0,0]=4 28387 B16R1.59031 CC(C)(C)CCNC(=O)C[n+]1ccccc1 240690a_100000738805_200000086051 [0,2,0,0,0,0|2,0,0]=4 28388 B16R1.59031 CC(C)(C)CCNC(=O)C[n+]1ccccc1 527a_100000738805_200000086051 [0,2,0,0,0,0|2,0,0]=4 28389 B16R1.59031 CC(C)(C)CCNC(=O)Cc1ccccn1 11a_100000738805_100000233486 [0,2,0,0,0,0|2,0,0]=4 28390 B16R1.59031 CC(C)(C)CCNC(=O)Cc1cccnc1 11a_100000738805_100000737805 [0,2,0,0,0,0|2,0,0]=4 28391 B16R1.59031 CC(C)(C)CCNC(=O)Cc1cccnc1 240690a_100000738805_100000737805 [0,2,0,0,0,0|2,0,0]=4 28392 B16R1.59031 CC(C)(C)CCNC(=O)Cc1cccnc1 527a_100000738805_100000737805 [0,2,0,0,0,0|2,0,0]=4 28393 B16R1.59031 CC(C)(C)CCNC(=O)Cc1ccncc1 11a_100000738805_100011201483 [0,2,0,0,0,0|2,0,0]=4 28394 B16R1.59031 CC(C)(C)CCNC(=O)Cc1ccncc1 240690a_100000738805_100011201483 [0,2,0,0,0,0|2,0,0]=4 28395 B16R1.59031 CC(C)(C)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000738805 [0,2,0,0,0,0|2,0,0]=4 28396 B16R1.59031 CC(C)(C)CNCC(=O)Cc1ccccc1 2230a_100000743828_100000233483 [0,2,0,0,0,0|2,0,0]=4 28397 B16R1.59031 CC(C)(C)CSCC(=O)Cc1ccccc1 62a_100000233483_100011219605 [0,2,0,0,0,0|2,0,0]=4 28398 B16R1.59031 CC(C)(C)CSCC(=O)Cc1ccccc1 62a_100011219605_100000233483 [0,2,0,0,0,0|2,0,0]=4 28399 B16R1.59031 CC(C)(F)CCNC(=O)C[n+]1ccccc1 11a_100016253952_200000086051 [0,2,0,0,0,0|2,0,0]=4 28400 B16R1.59031 CC(C)(F)CCNC(=O)C[n+]1ccccc1 240690a_100016253952_200000086051 [0,2,0,0,0,0|2,0,0]=4 28401 B16R1.59031 CC(C)(F)CCNC(=O)C[n+]1ccccc1 527a_100016253952_200000086051 [0,2,0,0,0,0|2,0,0]=4 28402 B16R1.59031 CC(C)(F)CCNC(=O)Cc1ccccn1 11a_100016253952_100000233486 [0,2,0,0,0,0|2,0,0]=4 28403 B16R1.59031 CC(C)(F)CCNC(=O)Cc1cccnc1 11a_100016253952_100000737805 [0,2,0,0,0,0|2,0,0]=4 28404 B16R1.59031 CC(C)(F)CCNC(=O)Cc1cccnc1 240690a_100016253952_100000737805 [0,2,0,0,0,0|2,0,0]=4 28405 B16R1.59031 CC(C)(F)CCNC(=O)Cc1cccnc1 527a_100016253952_100000737805 [0,2,0,0,0,0|2,0,0]=4 28406 B16R1.59031 CC(C)(F)CCNC(=O)Cc1ccncc1 11a_100016253952_100011201483 [0,2,0,0,0,0|2,0,0]=4 28407 B16R1.59031 CC(C)(F)CCNC(=O)Cc1ccncc1 240690a_100016253952_100011201483 [0,2,0,0,0,0|2,0,0]=4 28408 B16R1.59031 CC(C)(F)CCNC(=O)Nc1ccccc1 2430a_100000106764_100016253952 [0,2,0,0,0,0|2,0,0]=4 28409 B16R1.59031 CC(C)(F)CNCC(=O)Cc1ccccc1 2230a_100020643315_100000233483 [0,2,0,0,0,0|2,0,0]=4 28410 B16R1.59031 CC(C)(F)CSCC(=O)Cc1ccccc1 62a_100000233483_100011997219 [0,2,0,0,0,0|2,0,0]=4 28411 B16R1.59031 CC(C)(F)CSCC(=O)Cc1ccccc1 62a_100011997219_100000233483 [0,2,0,0,0,0|2,0,0]=4 28412 B16R1.59031 CC(C)(O)CCNC(=O)C[n+]1ccccc1 527a_100000707701_200000086051 [0,2,0,0,0,0|2,0,0]=4 28413 B16R1.59031 CC(C)(O)CCNC(=O)Cc1cccnc1 527a_100000707701_100000737805 [0,2,0,0,0,0|2,0,0]=4 28414 B16R1.59031 CC(C)(O)CCNC(=O)Nc1ccccc1 2430a_100000106764_100000707701 [0,2,0,0,0,0|2,0,0]=4 28415 B16R1.59031 CC(C)(O)CNCC(=O)Cc1ccccc1 2230a_100000751335_100000233483 [0,2,0,0,0,0|2,0,0]=4 28416 B16R1.59031 CC(C)(O)CSCC(=O)Cc1ccccc1 62a_100000233483_100000764493 [0,2,0,0,0,0|2,0,0]=4 28417 B16R1.59031 CC(C)(O)CSCC(=O)Cc1ccccc1 62a_100000764493_100000233483 [0,2,0,0,0,0|2,0,0]=4 28418 B16R1.59031 CC(Cc1ccccc1)OCCC(C)(C)C 34a_100000748627_100000755188 [0,2,0,0,0,0|1,0,1]=4 28419 B16R1.59031 CC(Cc1ccccc1)OCCC(C)(C)C 7a_100000748627_100000755188 [0,2,0,0,0,0|1,0,1]=4 28420 B16R1.59031 CC(Cc1ccccc1)OCCC(C)(C)C 7a_100000765024_200011218536 [0,2,0,0,0,0|1,0,1]=4 28421 B16R1.59031 CC(Cc1ccccc1)OCCC(C)(C)O 34a_100000748627_100000702414 [0,2,0,0,0,0|1,0,1]=4 28422 B16R1.59031 CC(Cc1ccccc1)OCCC(C)(C)O 7a_100000748627_100000702414 [0,2,0,0,0,0|1,0,1]=4 28423 B16R1.59031 C[N+](C)(C)CCCC(=O)Cc1ccccc1 1458a_100000085584_100015291786 [0,2,0,0,0,0|2,0,0]=4 28424 B16R1.59031 O=C(CCCC(F)(F)F)Cc1ccccc1 1458a_100000764234_100015291786 [0,2,0,0,0,0|2,0,0]=4 28425 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1Br 270084a_100000102301_100000765529 [0,2,0,0,0,0|2,0,0]=4 28426 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1Br 274078a_100000102301_100000765529 [0,2,0,0,0,0|2,0,0]=4 28427 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1C 270084a_100000102301_100000750338 [0,2,0,0,0,0|2,0,0]=4 28428 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1C 274078a_100000102301_100000750338 [0,2,0,0,0,0|2,0,0]=4 28429 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1Cl 270084a_100000102301_100000750118 [0,2,0,0,0,0|2,0,0]=4 28430 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1Cl 274078a_100000102301_100000750118 [0,2,0,0,0,0|2,0,0]=4 28431 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1F 270084a_100000102301_100000739656 [0,2,0,0,0,0|2,0,0]=4 28432 B16R1.4818 CCCCNS(=O)(=O)Cc1ccccc1F 274078a_100000102301_100000739656 [0,2,0,0,0,0|2,0,0]=4 28433 B16R1.4818 CCCCOC(C)(C)Cc1ccccc1Cl 7a_100000751322_100000210211 [0,2,0,0,0,0|1,0,1]=4 28434 B16R1.4818 CCCCOC(C)(C)Cc1ccccc1F 34a_100011350413_100000210210 [0,2,0,0,0,0|1,0,1]=4 28435 B16R1.4818 CCCCOC(C)(C)Cc1ccccc1F 7a_100011350413_100000210211 [0,2,0,0,0,0|1,0,1]=4 28436 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 11a_100011470550_100000212188 [0,2,0,0,0,0|2,0,0]=4 28437 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 1626a_100011470550_100000212188 [0,2,0,0,0,0|2,0,0]=4 28438 B16R1.7391 C#Cc1ccccc1NC(=O)CCCCC 22a_100011470550_100000212188 [0,2,0,0,0,0|2,0,0]=4 28439 B16R1.7391 C#Cc1ccccc1NC(=O)NCCCC 2430a_100011470550_100000102301 [0,2,0,0,0,0|2,0,0]=4 28440 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 11a_100012022501_100000212188 [0,2,0,0,0,0|2,0,0]=4 28441 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 1626a_100012022501_100000212188 [0,2,0,0,0,0|2,0,0]=4 28442 B16R1.7391 C=Cc1ccccc1NC(=O)CCCCC 22a_100012022501_100000212188 [0,2,0,0,0,0|2,0,0]=4 28443 B16R1.7391 C=Cc1ccccc1NC(=O)NCCCC 2430a_100012022501_100000102301 [0,2,0,0,0,0|2,0,0]=4 28444 B16R1.7391 CCCC#CC(=O)Cc1ccccc1C#N 1458a_200011218047_100000181865 [0,2,0,0,0,0|1,0,1]=4 28445 B16R1.7391 CCCC#CC(=O)Cc1ccccc1C=O 1458a_200011218047_200009853537 [0,2,0,0,0,0|1,0,1]=4 28446 B16R1.7391 CCCC#CC(=O)Cc1ccccc1CO 1458a_200011218047_100009816955 [0,2,0,0,0,0|1,0,1]=4 28447 B16R1.7391 CCCC#CC(=O)Cc1ccccc1OC 1458a_200011218047_100000210004 [0,2,0,0,0,0|1,0,1]=4 28448 B16R1.7391 CCCC#CC(=O)Cc1ccccc1SC 1458a_200011218047_100000699184 [0,2,0,0,0,0|1,0,1]=4 28449 B16R1.7391 CCCC=CC(=O)Cc1ccccc1C#N 1458a_100000212230_100000181865 [0,2,0,0,0,0|1,0,1]=4 28450 B16R1.7391 CCCC=CC(=O)Cc1ccccc1C=O 1458a_100000212230_200009853537 [0,2,0,0,0,0|1,0,1]=4 28451 B16R1.7391 CCCC=CC(=O)Cc1ccccc1CO 1458a_100000212230_100009816955 [0,2,0,0,0,0|1,0,1]=4 28452 B16R1.7391 CCCC=CC(=O)Cc1ccccc1OC 1458a_100000212230_100000210004 [0,2,0,0,0,0|1,0,1]=4 28453 B16R1.7391 CCCC=CC(=O)Cc1ccccc1SC 1458a_100000212230_100000699184 [0,2,0,0,0,0|1,0,1]=4 28454 B16R1.7391 CCCCCC(=O)Cc1ccccc1C#N 1458a_100000212188_100000181865 [0,2,0,0,0,0|1,0,0]=3 28455 B16R1.7391 CCCCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210326 [0,2,0,0,0,0|1,0,0]=3 28456 B16R1.7391 CCCCCC(=O)Cc1ccccc1C=O 1458a_100000212188_200009853537 [0,2,0,0,0,0|1,0,0]=3 28457 B16R1.7391 CCCCCC(=O)Cc1ccccc1CO 1458a_100000212188_100009816955 [0,2,0,0,0,0|1,0,0]=3 28458 B16R1.7391 CCCCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210326 [0,2,0,0,0,0|1,0,0]=3 28459 B16R1.7391 CCCCCC(=O)Cc1ccccc1OC 1458a_100000212188_100000210004 [0,2,0,0,0,0|1,0,0]=3 28460 B16R1.7391 CCCCCC(=O)Cc1ccccc1SC 1458a_100000212188_100000699184 [0,2,0,0,0,0|1,0,0]=3 28461 B16R1.7391 CCCCCC(=O)Cc1cccnc1C#N 1458a_100000212188_100011768898 [0,2,0,0,0,0|2,0,0]=4 28462 B16R1.7391 CCCCCC(=O)Cc1cccnc1OC 1458a_100000212188_100020631285 [0,2,0,0,0,0|2,0,0]=4 28463 B16R1.7391 CCCCCC(=O)Cc1ccncc1OC 1458a_100000212188_100020635607 [0,2,0,0,0,0|2,0,0]=4 28464 B16R1.7391 CCCCCC(=O)Cc1ncccc1C#N 1458a_100000212188_100000099805 [0,2,0,0,0,0|2,0,0]=4 28465 B16R1.7391 CCCCCC(=O)Nc1ccccc1C#N 11a_100000211148_100000212188 [0,2,0,0,0,0|2,0,0]=4 28466 B16R1.7391 CCCCCC(=O)Nc1ccccc1C#N 1626a_100000211148_100000212188 [0,2,0,0,0,0|2,0,0]=4 28467 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 11a_100000212081_100000212188 [0,2,0,0,0,0|2,0,0]=4 28468 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 1626a_100000212081_100000212188 [0,2,0,0,0,0|2,0,0]=4 28469 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 22a_100000212081_100000212188 [0,2,0,0,0,0|2,0,0]=4 28470 B16R1.7391 CCCCCC(=O)Nc1ccccc1CC 527a_100000212081_100000212188 [0,2,0,0,0,0|2,0,0]=4 28471 B16R1.7391 CCCCCC(=O)Nc1ccccc1CO 22a_100000212039_100000212188 [0,2,0,0,0,0|2,0,0]=4 28472 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 11a_100000210025_100000212188 [0,2,0,0,0,0|2,0,0]=4 28473 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000212188 [0,2,0,0,0,0|2,0,0]=4 28474 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 22a_100000210025_100000212188 [0,2,0,0,0,0|2,0,0]=4 28475 B16R1.7391 CCCCCC(=O)Nc1ccccc1OC 527a_100000210025_100000212188 [0,2,0,0,0,0|2,0,0]=4 28476 B16R1.7391 CCCCCC(=O)Nc1ccccc1SC 11a_100000211160_100000212188 [0,2,0,0,0,0|2,0,0]=4 28477 B16R1.7391 CCCCCC(=O)Nc1ccccc1SC 22a_100000211160_100000212188 [0,2,0,0,0,0|2,0,0]=4 28478 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N 11a_100000102301_100000238613 [0,2,0,0,0,0|1,0,0]=3 28479 B16R1.7391 CCCCNC(=O)Cc1ccccc1C#N 527a_100000102301_100000238613 [0,2,0,0,0,0|1,0,0]=3 28480 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 11a_100000102301_100000211604 [0,2,0,0,0,0|1,0,0]=3 28481 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 1626a_100000102301_100000211604 [0,2,0,0,0,0|1,0,0]=3 28482 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 240690a_100000102301_100000211604 [0,2,0,0,0,0|1,0,0]=3 28483 B16R1.7391 CCCCNC(=O)Cc1ccccc1OC 527a_100000102301_100000211604 [0,2,0,0,0,0|1,0,0]=3 28484 B16R1.7391 CCCCNC(=O)Nc1ccccc1C#N 2430a_100000211148_100000102301 [0,2,0,0,0,0|2,0,0]=4 28485 B16R1.7391 CCCCNC(=O)Nc1ccccc1CC 2430a_100000212081_100000102301 [0,2,0,0,0,0|2,0,0]=4 28486 B16R1.7391 CCCCNC(=O)Nc1ccccc1OC 2430a_100000210025_100000102301 [0,2,0,0,0,0|2,0,0]=4 28487 B16R1.7391 CCCCNC(=O)Nc1ccccc1SC 2430a_100000211160_100000102301 [0,2,0,0,0,0|2,0,0]=4 28488 B16R1.7391 CCCCNC(=O)Nc1ccccc1SC 512a_100000211160_100000102301 [0,2,0,0,0,0|2,0,0]=4 28489 B16R1.7391 CCCCOC(C)Cc1ccccc1OC 7a_100000691916_100000210211 [0,2,0,0,0,0|1,0,1]=4 28490 B16R1.7391 CCCNNC(=O)Cc1ccccc1OC 22a_100000740057_100000211604 [0,2,0,0,0,0|2,0,0]=4 28491 B16R1.7391 CCCOCC(=O)Cc1ccccc1C#N 1458a_100000745993_100000181865 [0,2,0,0,0,0|2,0,0]=4 28492 B16R1.7391 CCCOCC(=O)Cc1ccccc1C=O 1458a_100000745993_200009853537 [0,2,0,0,0,0|2,0,0]=4 28493 B16R1.7391 CCCOCC(=O)Cc1ccccc1CO 1458a_100000745993_100009816955 [0,2,0,0,0,0|2,0,0]=4 28494 B16R1.7391 CCCOCC(=O)Cc1ccccc1OC 1458a_100000745993_100000210004 [0,2,0,0,0,0|2,0,0]=4 28495 B16R1.7391 CCCOCC(=O)Cc1ccccc1SC 1458a_100000745993_100000699184 [0,2,0,0,0,0|2,0,0]=4 28496 B16R1.7391 CCCSCC(=O)Cc1ccccc1C#N 1458a_100000217233_100000181865 [0,2,0,0,0,0|2,0,0]=4 28497 B16R1.7391 CCCSCC(=O)Cc1ccccc1C=O 1458a_100000217233_200009853537 [0,2,0,0,0,0|2,0,0]=4 28498 B16R1.7391 CCCSCC(=O)Cc1ccccc1CO 1458a_100000217233_100009816955 [0,2,0,0,0,0|2,0,0]=4 28499 B16R1.7391 CCCSCC(=O)Cc1ccccc1OC 1458a_100000217233_100000210004 [0,2,0,0,0,0|2,0,0]=4 28500 B16R1.7391 CCCSCC(=O)Cc1ccccc1SC 1458a_100000217233_100000699184 [0,2,0,0,0,0|2,0,0]=4 28501 B16R1.7391 CCOCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100011215890 [0,2,0,0,0,0|2,0,0]=4 28502 B16R1.7391 CCOCCC(=O)Cc1ccccc1C#N 1458a_100000749530_100000181865 [0,2,0,0,0,0|2,0,0]=4 28503 B16R1.7391 CCOCCC(=O)Cc1ccccc1C=O 1458a_100000749530_200009853537 [0,2,0,0,0,0|2,0,0]=4 28504 B16R1.7391 CCOCCC(=O)Cc1ccccc1CO 1458a_100000749530_100009816955 [0,2,0,0,0,0|2,0,0]=4 28505 B16R1.7391 CCOCCC(=O)Cc1ccccc1OC 1458a_100000211604_100011215890 [0,2,0,0,0,0|2,0,0]=4 28506 B16R1.7391 CCOCCC(=O)Cc1ccccc1OC 1458a_100000749530_100000210004 [0,2,0,0,0,0|2,0,0]=4 28507 B16R1.7391 CCOCCC(=O)Cc1ccccc1SC 1458a_100000749530_100000699184 [0,2,0,0,0,0|2,0,0]=4 28508 B16R1.7391 CCSCCC(=O)Cc1ccccc1C#N 1458a_100000230768_100000181865 [0,2,0,0,0,0|2,0,0]=4 28509 B16R1.7391 CCSCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000757381 [0,2,0,0,0,0|2,0,0]=4 28510 B16R1.7391 CCSCCC(=O)Cc1ccccc1C=O 1458a_100000230768_200009853537 [0,2,0,0,0,0|2,0,0]=4 28511 B16R1.7391 CCSCCC(=O)Cc1ccccc1CO 1458a_100000230768_100009816955 [0,2,0,0,0,0|2,0,0]=4 28512 B16R1.7391 CCSCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000757381 [0,2,0,0,0,0|2,0,0]=4 28513 B16R1.7391 CCSCCC(=O)Cc1ccccc1OC 1458a_100000230768_100000210004 [0,2,0,0,0,0|2,0,0]=4 28514 B16R1.7391 CCSCCC(=O)Cc1ccccc1SC 1458a_100000230768_100000699184 [0,2,0,0,0,0|2,0,0]=4 28515 B16R1.7391 COCCCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000740836 [0,2,0,0,0,0|2,0,0]=4 28516 B16R1.7391 COCCCC(=O)Cc1ccccc1C#N 1458a_100000741012_100000181865 [0,2,0,0,0,0|2,0,0]=4 28517 B16R1.7391 COCCCC(=O)Cc1ccccc1C=O 1458a_100000741012_200009853537 [0,2,0,0,0,0|2,0,0]=4 28518 B16R1.7391 COCCCC(=O)Cc1ccccc1CO 1458a_100000741012_100009816955 [0,2,0,0,0,0|2,0,0]=4 28519 B16R1.7391 COCCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000740836 [0,2,0,0,0,0|2,0,0]=4 28520 B16R1.7391 COCCCC(=O)Cc1ccccc1OC 1458a_100000741012_100000210004 [0,2,0,0,0,0|2,0,0]=4 28521 B16R1.7391 COCCCC(=O)Cc1ccccc1SC 1458a_100000741012_100000699184 [0,2,0,0,0,0|2,0,0]=4 28522 B16R1.7391 COCCNC(=O)Cc1ccccc1C#N 527a_100000209980_100000238613 [0,2,0,0,0,0|2,0,0]=4 28523 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 1626a_100000209980_100000211604 [0,2,0,0,0,0|2,0,0]=4 28524 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 240690a_100000209980_100000211604 [0,2,0,0,0,0|2,0,0]=4 28525 B16R1.7391 COCCNC(=O)Cc1ccccc1OC 527a_100000209980_100000211604 [0,2,0,0,0,0|2,0,0]=4 28526 B16R1.7391 COc1ccccc1CC(=O)CCCCF 1458a_100000211604_100000729493 [0,2,0,0,0,0|2,0,0]=4 28527 B16R1.7391 COc1ccccc1CC(=O)CCCCO 1458a_100000211604_100000210776 [0,2,0,0,0,0|2,0,0]=4 28528 B16R1.7391 COc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000210004 [0,2,0,0,0,0|2,0,0]=4 28529 B16R1.7391 COc1ccccc1CC(=O)CCCSC 1458a_100000173376_100000210004 [0,2,0,0,0,0|2,0,0]=4 28530 B16R1.7391 COc1ccccc1CC(=O)NCCCF 11a_100015189416_100000211604 [0,2,0,0,0,0|2,0,0]=4 28531 B16R1.7391 COc1ccccc1CC(=O)NCCCF 1626a_100015189416_100000211604 [0,2,0,0,0,0|2,0,0]=4 28532 B16R1.7391 COc1ccccc1CC(=O)NCCCF 240690a_100015189416_100000211604 [0,2,0,0,0,0|2,0,0]=4 28533 B16R1.7391 COc1ccccc1CC(=O)NCCCF 527a_100015189416_100000211604 [0,2,0,0,0,0|2,0,0]=4 28534 B16R1.7391 COc1ccccc1CC(=O)NCCCO 240690a_100000182051_100000211604 [0,2,0,0,0,0|2,0,0]=4 28535 B16R1.7391 COc1ccccc1CC(=O)NCCCO 527a_100000182051_100000211604 [0,2,0,0,0,0|2,0,0]=4 28536 B16R1.7391 COc1ccccc1CC(=O)NCCSC 11a_100020590264_100000211604 [0,2,0,0,0,0|2,0,0]=4 28537 B16R1.7391 COc1ccccc1CC(=O)NCCSC 1626a_100020590264_100000211604 [0,2,0,0,0,0|2,0,0]=4 28538 B16R1.7391 COc1ccccc1CC(=O)NCCSC 240690a_100020590264_100000211604 [0,2,0,0,0,0|2,0,0]=4 28539 B16R1.7391 COc1ccccc1CC(=O)NCCSC 527a_100020590264_100000211604 [0,2,0,0,0,0|2,0,0]=4 28540 B16R1.7391 CSCCCC(=O)Cc1ccccc1C#N 1458a_100000173376_100000181865 [0,2,0,0,0,0|2,0,0]=4 28541 B16R1.7391 CSCCCC(=O)Cc1ccccc1C=O 1458a_100000173376_200009853537 [0,2,0,0,0,0|2,0,0]=4 28542 B16R1.7391 CSCCCC(=O)Cc1ccccc1CO 1458a_100000173376_100009816955 [0,2,0,0,0,0|2,0,0]=4 28543 B16R1.7391 CSCCCC(=O)Cc1ccccc1SC 1458a_100000173376_100000699184 [0,2,0,0,0,0|2,0,0]=4 28544 B16R1.7391 CSCCNC(=O)Cc1ccccc1C#N 11a_100020590264_100000238613 [0,2,0,0,0,0|2,0,0]=4 28545 B16R1.7391 CSCCNC(=O)Cc1ccccc1C#N 527a_100020590264_100000238613 [0,2,0,0,0,0|2,0,0]=4 28546 B16R1.7391 CSc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000699184 [0,2,0,0,0,0|2,0,0]=4 28547 B16R1.7391 N#Cc1ccccc1CC(=O)CCCCF 1458a_100000238613_100000729493 [0,2,0,0,0,0|2,0,0]=4 28548 B16R1.7391 N#Cc1ccccc1CC(=O)CCCCO 1458a_100000238613_100000210776 [0,2,0,0,0,0|2,0,0]=4 28549 B16R1.7391 N#Cc1ccccc1CC(=O)CCCCO 1458a_100000695505_100000181865 [0,2,0,0,0,0|2,0,0]=4 28550 B16R1.7391 N#Cc1ccccc1CC(=O)NCCCF 11a_100015189416_100000238613 [0,2,0,0,0,0|2,0,0]=4 28551 B16R1.7391 N#Cc1ccccc1CC(=O)NCCCF 527a_100015189416_100000238613 [0,2,0,0,0,0|2,0,0]=4 28552 B16R1.7391 N#Cc1ccccc1CC(=O)NCCCO 527a_100000182051_100000238613 [0,2,0,0,0,0|2,0,0]=4 28553 B16R1.7391 O=C(CCCCO)Cc1ccccc1CO 1458a_100000695505_100009816955 [0,2,0,0,0,0|2,0,0]=4 28554 B16R1.7391 O=Cc1ccccc1CC(=O)CCCCO 1458a_100000695505_200009853537 [0,2,0,0,0,0|2,0,0]=4 28555 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1Br)C 1458a_200011218047_100010146847 [0,2,0,0,0,0|1,0,1]=4 28556 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1Br)Cl 1458a_200011218047_100010138402 [0,2,0,0,0,0|1,0,1]=4 28557 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1Br)F 1458a_200011218047_100000696636 [0,2,0,0,0,0|1,0,1]=4 28558 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1C)C 1458a_200011218047_100000758300 [0,2,0,0,0,0|1,0,1]=4 28559 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1Cl)Cl 1458a_200011218047_100000187851 [0,2,0,0,0,0|1,0,1]=4 28560 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1Cl)F 1458a_200011218047_100000187852 [0,2,0,0,0,0|1,0,1]=4 28561 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1F)C 1458a_200011218047_100009814554 [0,2,0,0,0,0|1,0,1]=4 28562 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1F)F 1458a_200011218047_100000698325 [0,2,0,0,0,0|1,0,1]=4 28563 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1I)Br 1458a_200011218047_100010146611 [0,2,0,0,0,0|1,0,1]=4 28564 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1I)C 1458a_200011218047_100010150146 [0,2,0,0,0,0|1,0,1]=4 28565 B16R1.22096 CCCC#CC(=O)Cc1c(cccc1I)F 1458a_200011218047_100010149602 [0,2,0,0,0,0|1,0,1]=4 28566 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1Br)C 1458a_100000212230_100010146847 [0,2,0,0,0,0|1,0,1]=4 28567 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1Br)Cl 1458a_100000212230_100010138402 [0,2,0,0,0,0|1,0,1]=4 28568 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1Br)F 1458a_100000212230_100000696636 [0,2,0,0,0,0|1,0,1]=4 28569 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1C)C 1458a_100000212230_100000758300 [0,2,0,0,0,0|1,0,1]=4 28570 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1Cl)Cl 1458a_100000212230_100000187851 [0,2,0,0,0,0|1,0,1]=4 28571 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1Cl)F 1458a_100000212230_100000187852 [0,2,0,0,0,0|1,0,1]=4 28572 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1F)C 1458a_100000212230_100009814554 [0,2,0,0,0,0|1,0,1]=4 28573 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1F)F 1458a_100000212230_100000698325 [0,2,0,0,0,0|1,0,1]=4 28574 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1I)Br 1458a_100000212230_100010146611 [0,2,0,0,0,0|1,0,1]=4 28575 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1I)C 1458a_100000212230_100010150146 [0,2,0,0,0,0|1,0,1]=4 28576 B16R1.22096 CCCC=CC(=O)Cc1c(cccc1I)F 1458a_100000212230_100010149602 [0,2,0,0,0,0|1,0,1]=4 28577 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000210326 [0,2,0,0,0,0|1,0,0]=3 28578 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)C 1458a_100000212188_100010146847 [0,2,0,0,0,0|1,0,0]=3 28579 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000210326 [0,2,0,0,0,0|1,0,0]=3 28580 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000212188_100010138402 [0,2,0,0,0,0|1,0,0]=3 28581 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210326 [0,2,0,0,0,0|1,0,0]=3 28582 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)F 1458a_100000212188_100000696636 [0,2,0,0,0,0|1,0,0]=3 28583 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000210326 [0,2,0,0,0,0|1,0,0]=3 28584 B16R1.22096 CCCCCC(=O)Cc1c(cccc1C)C 1458a_100000212188_100000758300 [0,2,0,0,0,0|1,0,0]=3 28585 B16R1.22096 CCCCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210326 [0,2,0,0,0,0|1,0,0]=3 28586 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210326 [0,2,0,0,0,0|1,0,0]=3 28587 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000212188_100000187851 [0,2,0,0,0,0|1,0,0]=3 28588 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000210326 [0,2,0,0,0,0|1,0,0]=3 28589 B16R1.22096 CCCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000212188_100000187852 [0,2,0,0,0,0|1,0,0]=3 28590 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)C 1458a_100000212188_100009814554 [0,2,0,0,0,0|1,0,0]=3 28591 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)F 1458a_100000212188_100000698325 [0,2,0,0,0,0|1,0,0]=3 28592 B16R1.22096 CCCCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000210326 [0,2,0,0,0,0|1,0,0]=3 28593 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)Br 1458a_100000212188_100010146611 [0,2,0,0,0,0|1,0,0]=3 28594 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)C 1458a_100000212188_100010150146 [0,2,0,0,0,0|1,0,0]=3 28595 B16R1.22096 CCCCCC(=O)Cc1c(cccc1I)F 1458a_100000212188_100010149602 [0,2,0,0,0,0|1,0,0]=3 28596 B16R1.22096 CCCCCC(=O)Cc1c(cncc1Cl)Cl 1458a_100000212188_200009872113 [0,2,0,0,0,0|2,0,0]=4 28597 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Br 1626a_100000690995_100000212188 [0,2,0,0,0,0|2,0,0]=4 28598 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)C 11a_100011834072_100000212188 [0,2,0,0,0,0|2,0,0]=4 28599 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)C 1626a_100011834072_100000212188 [0,2,0,0,0,0|2,0,0]=4 28600 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Cl 11a_100102946385_100000212188 [0,2,0,0,0,0|2,0,0]=4 28601 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)Cl 1626a_100102946385_100000212188 [0,2,0,0,0,0|2,0,0]=4 28602 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)F 11a_100000684712_100000212188 [0,2,0,0,0,0|2,0,0]=4 28603 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)F 1626a_100000684712_100000212188 [0,2,0,0,0,0|2,0,0]=4 28604 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Br)O 527a_100011934926_100000212188 [0,2,0,0,0,0|2,0,0]=4 28605 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 11a_100000185769_100000212188 [0,2,0,0,0,0|2,0,0]=4 28606 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 1626a_100000185769_100000212188 [0,2,0,0,0,0|2,0,0]=4 28607 B16R1.22096 CCCCCC(=O)Nc1c(cccc1C)C 22a_100000185769_100000212188 [0,2,0,0,0,0|2,0,0]=4 28608 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)C 11a_100000756524_100000212188 [0,2,0,0,0,0|2,0,0]=4 28609 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)C 1626a_100000756524_100000212188 [0,2,0,0,0,0|2,0,0]=4 28610 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)Cl 11a_100000210028_100000212188 [0,2,0,0,0,0|2,0,0]=4 28611 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)Cl 1626a_100000210028_100000212188 [0,2,0,0,0,0|2,0,0]=4 28612 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)F 11a_100000760031_100000212188 [0,2,0,0,0,0|2,0,0]=4 28613 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)F 1626a_100000760031_100000212188 [0,2,0,0,0,0|2,0,0]=4 28614 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)O 22a_100012022510_100000212188 [0,2,0,0,0,0|2,0,0]=4 28615 B16R1.22096 CCCCCC(=O)Nc1c(cccc1Cl)O 527a_100012022510_100000212188 [0,2,0,0,0,0|2,0,0]=4 28616 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 11a_100000766463_100000212188 [0,2,0,0,0,0|2,0,0]=4 28617 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 1626a_100000766463_100000212188 [0,2,0,0,0,0|2,0,0]=4 28618 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)C 22a_100000766463_100000212188 [0,2,0,0,0,0|2,0,0]=4 28619 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)F 11a_100000210704_100000212188 [0,2,0,0,0,0|2,0,0]=4 28620 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)F 1626a_100000210704_100000212188 [0,2,0,0,0,0|2,0,0]=4 28621 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)O 22a_100020591140_100000212188 [0,2,0,0,0,0|2,0,0]=4 28622 B16R1.22096 CCCCCC(=O)Nc1c(cccc1F)O 527a_100020591140_100000212188 [0,2,0,0,0,0|2,0,0]=4 28623 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Br 11a_100010146558_100000212188 [0,2,0,0,0,0|2,0,0]=4 28624 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Br 1626a_100010146558_100000212188 [0,2,0,0,0,0|2,0,0]=4 28625 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Cl 11a_100010190421_100000212188 [0,2,0,0,0,0|2,0,0]=4 28626 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)Cl 1626a_100010190421_100000212188 [0,2,0,0,0,0|2,0,0]=4 28627 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)F 11a_100000042321_100000212188 [0,2,0,0,0,0|2,0,0]=4 28628 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)F 1626a_100000042321_100000212188 [0,2,0,0,0,0|2,0,0]=4 28629 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)O 22a_200000049512_100000212188 [0,2,0,0,0,0|2,0,0]=4 28630 B16R1.22096 CCCCCC(=O)Nc1c(cccc1I)O 527a_200000049512_100000212188 [0,2,0,0,0,0|2,0,0]=4 28631 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)C 22a_100000743429_100000212188 [0,2,0,0,0,0|2,0,0]=4 28632 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)C 527a_100000743429_100000212188 [0,2,0,0,0,0|2,0,0]=4 28633 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)O 22a_100011995820_100000212188 [0,2,0,0,0,0|2,0,0]=4 28634 B16R1.22096 CCCCCC(=O)Nc1c(cccc1O)O 527a_100011995820_100000212188 [0,2,0,0,0,0|2,0,0]=4 28635 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 11a_100000102301_100010209379 [0,2,0,0,0,0|1,0,0]=3 28636 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 240690a_100000102301_100010209379 [0,2,0,0,0,0|1,0,0]=3 28637 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Br 527a_100000102301_100010209379 [0,2,0,0,0,0|1,0,0]=3 28638 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 11a_100000102301_100010147022 [0,2,0,0,0,0|1,0,0]=3 28639 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 1626a_100000102301_100010147022 [0,2,0,0,0,0|1,0,0]=3 28640 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 240690a_100000102301_100010147022 [0,2,0,0,0,0|1,0,0]=3 28641 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)C 527a_100000102301_100010147022 [0,2,0,0,0,0|1,0,0]=3 28642 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 11a_100000102301_100013084675 [0,2,0,0,0,0|1,0,0]=3 28643 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 1626a_100000102301_100013084675 [0,2,0,0,0,0|1,0,0]=3 28644 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 240690a_100000102301_100013084675 [0,2,0,0,0,0|1,0,0]=3 28645 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)Cl 527a_100000102301_100013084675 [0,2,0,0,0,0|1,0,0]=3 28646 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 11a_100000102301_100010172741 [0,2,0,0,0,0|1,0,0]=3 28647 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 1626a_100000102301_100010172741 [0,2,0,0,0,0|1,0,0]=3 28648 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 240690a_100000102301_100010172741 [0,2,0,0,0,0|1,0,0]=3 28649 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Br)F 527a_100000102301_100010172741 [0,2,0,0,0,0|1,0,0]=3 28650 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 11a_100000102301_100000689862 [0,2,0,0,0,0|1,0,0]=3 28651 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 1626a_100000102301_100000689862 [0,2,0,0,0,0|1,0,0]=3 28652 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 240690a_100000102301_100000689862 [0,2,0,0,0,0|1,0,0]=3 28653 B16R1.22096 CCCCNC(=O)Cc1c(cccc1C)C 527a_100000102301_100000689862 [0,2,0,0,0,0|1,0,0]=3 28654 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 11a_100000102301_100000211232 [0,2,0,0,0,0|1,0,0]=3 28655 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100000102301_100000211232 [0,2,0,0,0,0|1,0,0]=3 28656 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100000102301_100000211232 [0,2,0,0,0,0|1,0,0]=3 28657 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)Cl 527a_100000102301_100000211232 [0,2,0,0,0,0|1,0,0]=3 28658 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 11a_100000102301_100000185183 [0,2,0,0,0,0|1,0,0]=3 28659 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 1626a_100000102301_100000185183 [0,2,0,0,0,0|1,0,0]=3 28660 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 240690a_100000102301_100000185183 [0,2,0,0,0,0|1,0,0]=3 28661 B16R1.22096 CCCCNC(=O)Cc1c(cccc1Cl)F 527a_100000102301_100000185183 [0,2,0,0,0,0|1,0,0]=3 28662 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 11a_100000102301_100000684726 [0,2,0,0,0,0|1,0,0]=3 28663 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 1626a_100000102301_100000684726 [0,2,0,0,0,0|1,0,0]=3 28664 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 240690a_100000102301_100000684726 [0,2,0,0,0,0|1,0,0]=3 28665 B16R1.22096 CCCCNC(=O)Cc1c(cccc1F)F 527a_100000102301_100000684726 [0,2,0,0,0,0|1,0,0]=3 28666 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Br)C 2430a_100011834072_100000102301 [0,2,0,0,0,0|2,0,0]=4 28667 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Br)Cl 2430a_100102946385_100000102301 [0,2,0,0,0,0|2,0,0]=4 28668 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C 2430a_100000185769_100000102301 [0,2,0,0,0,0|2,0,0]=4 28669 B16R1.22096 CCCCNC(=O)Nc1c(cccc1C)C 512a_100000102301_100000185769 [0,2,0,0,0,0|2,0,0]=4 28670 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)C 2430a_100000756524_100000102301 [0,2,0,0,0,0|2,0,0]=4 28671 B16R1.22096 CCCCNC(=O)Nc1c(cccc1Cl)F 2430a_100000760031_100000102301 [0,2,0,0,0,0|2,0,0]=4 28672 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)C 2430a_100000766463_100000102301 [0,2,0,0,0,0|2,0,0]=4 28673 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)F 2430a_100000210704_100000102301 [0,2,0,0,0,0|2,0,0]=4 28674 B16R1.22096 CCCCNC(=O)Nc1c(cccc1F)O 2430a_100020591140_100000102301 [0,2,0,0,0,0|2,0,0]=4 28675 B16R1.22096 CCCCNC(=O)Nc1c(cccc1I)Br 512a_100010146558_100000102301 [0,2,0,0,0,0|2,0,0]=4 28676 B16R1.22096 CCCCNC(=O)Nc1c(cccc1I)F 2430a_100000042321_100000102301 [0,2,0,0,0,0|2,0,0]=4 28677 B16R1.22096 CCCCNC(=O)Nc1c(cccc1O)C 2430a_100000743429_100000102301 [0,2,0,0,0,0|2,0,0]=4 28678 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Br)Br 22a_100000740057_100010209379 [0,2,0,0,0,0|2,0,0]=4 28679 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Br)C 22a_100000740057_100010147022 [0,2,0,0,0,0|2,0,0]=4 28680 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Br)Cl 22a_100000740057_100013084675 [0,2,0,0,0,0|2,0,0]=4 28681 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Br)F 22a_100000740057_100010172741 [0,2,0,0,0,0|2,0,0]=4 28682 B16R1.22096 CCCNNC(=O)Cc1c(cccc1C)C 22a_100000740057_100000689862 [0,2,0,0,0,0|2,0,0]=4 28683 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Cl)Cl 22a_100000740057_100000211232 [0,2,0,0,0,0|2,0,0]=4 28684 B16R1.22096 CCCNNC(=O)Cc1c(cccc1Cl)F 22a_100000740057_100000185183 [0,2,0,0,0,0|2,0,0]=4 28685 B16R1.22096 CCCNNC(=O)Cc1c(cccc1F)F 22a_100000740057_100000684726 [0,2,0,0,0,0|2,0,0]=4 28686 B16R1.22096 CCCOCC(=O)Cc1c(cccc1Br)C 1458a_100000745993_100010146847 [0,2,0,0,0,0|2,0,0]=4 28687 B16R1.22096 CCCOCC(=O)Cc1c(cccc1Br)Cl 1458a_100000745993_100010138402 [0,2,0,0,0,0|2,0,0]=4 28688 B16R1.22096 CCCOCC(=O)Cc1c(cccc1Br)F 1458a_100000745993_100000696636 [0,2,0,0,0,0|2,0,0]=4 28689 B16R1.22096 CCCOCC(=O)Cc1c(cccc1C)C 1458a_100000745993_100000758300 [0,2,0,0,0,0|2,0,0]=4 28690 B16R1.22096 CCCOCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000745993_100000187851 [0,2,0,0,0,0|2,0,0]=4 28691 B16R1.22096 CCCOCC(=O)Cc1c(cccc1Cl)F 1458a_100000745993_100000187852 [0,2,0,0,0,0|2,0,0]=4 28692 B16R1.22096 CCCOCC(=O)Cc1c(cccc1F)C 1458a_100000745993_100009814554 [0,2,0,0,0,0|2,0,0]=4 28693 B16R1.22096 CCCOCC(=O)Cc1c(cccc1F)F 1458a_100000745993_100000698325 [0,2,0,0,0,0|2,0,0]=4 28694 B16R1.22096 CCCOCC(=O)Cc1c(cccc1I)Br 1458a_100000745993_100010146611 [0,2,0,0,0,0|2,0,0]=4 28695 B16R1.22096 CCCOCC(=O)Cc1c(cccc1I)C 1458a_100000745993_100010150146 [0,2,0,0,0,0|2,0,0]=4 28696 B16R1.22096 CCCOCC(=O)Cc1c(cccc1I)F 1458a_100000745993_100010149602 [0,2,0,0,0,0|2,0,0]=4 28697 B16R1.22096 CCCSCC(=O)Cc1c(cccc1Br)C 1458a_100000217233_100010146847 [0,2,0,0,0,0|2,0,0]=4 28698 B16R1.22096 CCCSCC(=O)Cc1c(cccc1Br)Cl 1458a_100000217233_100010138402 [0,2,0,0,0,0|2,0,0]=4 28699 B16R1.22096 CCCSCC(=O)Cc1c(cccc1Br)F 1458a_100000217233_100000696636 [0,2,0,0,0,0|2,0,0]=4 28700 B16R1.22096 CCCSCC(=O)Cc1c(cccc1C)C 1458a_100000217233_100000758300 [0,2,0,0,0,0|2,0,0]=4 28701 B16R1.22096 CCCSCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000217233_100000187851 [0,2,0,0,0,0|2,0,0]=4 28702 B16R1.22096 CCCSCC(=O)Cc1c(cccc1Cl)F 1458a_100000217233_100000187852 [0,2,0,0,0,0|2,0,0]=4 28703 B16R1.22096 CCCSCC(=O)Cc1c(cccc1F)C 1458a_100000217233_100009814554 [0,2,0,0,0,0|2,0,0]=4 28704 B16R1.22096 CCCSCC(=O)Cc1c(cccc1F)F 1458a_100000217233_100000698325 [0,2,0,0,0,0|2,0,0]=4 28705 B16R1.22096 CCCSCC(=O)Cc1c(cccc1I)Br 1458a_100000217233_100010146611 [0,2,0,0,0,0|2,0,0]=4 28706 B16R1.22096 CCCSCC(=O)Cc1c(cccc1I)C 1458a_100000217233_100010150146 [0,2,0,0,0,0|2,0,0]=4 28707 B16R1.22096 CCCSCC(=O)Cc1c(cccc1I)F 1458a_100000217233_100010149602 [0,2,0,0,0,0|2,0,0]=4 28708 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100011215890 [0,2,0,0,0,0|2,0,0]=4 28709 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)C 1458a_100000749530_100010146847 [0,2,0,0,0,0|2,0,0]=4 28710 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100011215890 [0,2,0,0,0,0|2,0,0]=4 28711 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000749530_100010138402 [0,2,0,0,0,0|2,0,0]=4 28712 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100011215890 [0,2,0,0,0,0|2,0,0]=4 28713 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)F 1458a_100000749530_100000696636 [0,2,0,0,0,0|2,0,0]=4 28714 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100011215890 [0,2,0,0,0,0|2,0,0]=4 28715 B16R1.22096 CCOCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100011215890 [0,2,0,0,0,0|2,0,0]=4 28716 B16R1.22096 CCOCCC(=O)Cc1c(cccc1C)C 1458a_100000749530_100000758300 [0,2,0,0,0,0|2,0,0]=4 28717 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100011215890 [0,2,0,0,0,0|2,0,0]=4 28718 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000749530_100000187851 [0,2,0,0,0,0|2,0,0]=4 28719 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100011215890 [0,2,0,0,0,0|2,0,0]=4 28720 B16R1.22096 CCOCCC(=O)Cc1c(cccc1Cl)F 1458a_100000749530_100000187852 [0,2,0,0,0,0|2,0,0]=4 28721 B16R1.22096 CCOCCC(=O)Cc1c(cccc1F)C 1458a_100000749530_100009814554 [0,2,0,0,0,0|2,0,0]=4 28722 B16R1.22096 CCOCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100011215890 [0,2,0,0,0,0|2,0,0]=4 28723 B16R1.22096 CCOCCC(=O)Cc1c(cccc1F)F 1458a_100000749530_100000698325 [0,2,0,0,0,0|2,0,0]=4 28724 B16R1.22096 CCOCCC(=O)Cc1c(cccc1I)Br 1458a_100000749530_100010146611 [0,2,0,0,0,0|2,0,0]=4 28725 B16R1.22096 CCOCCC(=O)Cc1c(cccc1I)C 1458a_100000749530_100010150146 [0,2,0,0,0,0|2,0,0]=4 28726 B16R1.22096 CCOCCC(=O)Cc1c(cccc1I)F 1458a_100000749530_100010149602 [0,2,0,0,0,0|2,0,0]=4 28727 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000757381 [0,2,0,0,0,0|2,0,0]=4 28728 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)C 1458a_100000230768_100010146847 [0,2,0,0,0,0|2,0,0]=4 28729 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000757381 [0,2,0,0,0,0|2,0,0]=4 28730 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000230768_100010138402 [0,2,0,0,0,0|2,0,0]=4 28731 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000757381 [0,2,0,0,0,0|2,0,0]=4 28732 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)F 1458a_100000230768_100000696636 [0,2,0,0,0,0|2,0,0]=4 28733 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000757381 [0,2,0,0,0,0|2,0,0]=4 28734 B16R1.22096 CCSCCC(=O)Cc1c(cccc1C)C 1458a_100000230768_100000758300 [0,2,0,0,0,0|2,0,0]=4 28735 B16R1.22096 CCSCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000757381 [0,2,0,0,0,0|2,0,0]=4 28736 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000757381 [0,2,0,0,0,0|2,0,0]=4 28737 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000230768_100000187851 [0,2,0,0,0,0|2,0,0]=4 28738 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000757381 [0,2,0,0,0,0|2,0,0]=4 28739 B16R1.22096 CCSCCC(=O)Cc1c(cccc1Cl)F 1458a_100000230768_100000187852 [0,2,0,0,0,0|2,0,0]=4 28740 B16R1.22096 CCSCCC(=O)Cc1c(cccc1F)C 1458a_100000230768_100009814554 [0,2,0,0,0,0|2,0,0]=4 28741 B16R1.22096 CCSCCC(=O)Cc1c(cccc1F)F 1458a_100000230768_100000698325 [0,2,0,0,0,0|2,0,0]=4 28742 B16R1.22096 CCSCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000757381 [0,2,0,0,0,0|2,0,0]=4 28743 B16R1.22096 CCSCCC(=O)Cc1c(cccc1I)Br 1458a_100000230768_100010146611 [0,2,0,0,0,0|2,0,0]=4 28744 B16R1.22096 CCSCCC(=O)Cc1c(cccc1I)C 1458a_100000230768_100010150146 [0,2,0,0,0,0|2,0,0]=4 28745 B16R1.22096 CCSCCC(=O)Cc1c(cccc1I)F 1458a_100000230768_100010149602 [0,2,0,0,0,0|2,0,0]=4 28746 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 2230a_106832991635_200009990517 [0,2,0,0,0,0|2,0,0]=4 28747 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 34a_100102657272_200009990517 [0,2,0,0,0,0|2,0,0]=4 28748 B16R1.22096 CNCCOC(=O)Nc1c(cccc1C)C 7a_106832991635_200009990517 [0,2,0,0,0,0|2,0,0]=4 28749 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)Br 1458a_100010209379_100000740836 [0,2,0,0,0,0|2,0,0]=4 28750 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)C 1458a_100000741012_100010146847 [0,2,0,0,0,0|2,0,0]=4 28751 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)C 1458a_100010147022_100000740836 [0,2,0,0,0,0|2,0,0]=4 28752 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000741012_100010138402 [0,2,0,0,0,0|2,0,0]=4 28753 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100013084675_100000740836 [0,2,0,0,0,0|2,0,0]=4 28754 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)F 1458a_100000741012_100000696636 [0,2,0,0,0,0|2,0,0]=4 28755 B16R1.22096 COCCCC(=O)Cc1c(cccc1Br)F 1458a_100010172741_100000740836 [0,2,0,0,0,0|2,0,0]=4 28756 B16R1.22096 COCCCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000740836 [0,2,0,0,0,0|2,0,0]=4 28757 B16R1.22096 COCCCC(=O)Cc1c(cccc1C)C 1458a_100000741012_100000758300 [0,2,0,0,0,0|2,0,0]=4 28758 B16R1.22096 COCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000740836 [0,2,0,0,0,0|2,0,0]=4 28759 B16R1.22096 COCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000741012_100000187851 [0,2,0,0,0,0|2,0,0]=4 28760 B16R1.22096 COCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000185183_100000740836 [0,2,0,0,0,0|2,0,0]=4 28761 B16R1.22096 COCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000741012_100000187852 [0,2,0,0,0,0|2,0,0]=4 28762 B16R1.22096 COCCCC(=O)Cc1c(cccc1F)C 1458a_100000741012_100009814554 [0,2,0,0,0,0|2,0,0]=4 28763 B16R1.22096 COCCCC(=O)Cc1c(cccc1F)F 1458a_100000684726_100000740836 [0,2,0,0,0,0|2,0,0]=4 28764 B16R1.22096 COCCCC(=O)Cc1c(cccc1F)F 1458a_100000741012_100000698325 [0,2,0,0,0,0|2,0,0]=4 28765 B16R1.22096 COCCCC(=O)Cc1c(cccc1I)Br 1458a_100000741012_100010146611 [0,2,0,0,0,0|2,0,0]=4 28766 B16R1.22096 COCCCC(=O)Cc1c(cccc1I)C 1458a_100000741012_100010150146 [0,2,0,0,0,0|2,0,0]=4 28767 B16R1.22096 COCCCC(=O)Cc1c(cccc1I)F 1458a_100000741012_100010149602 [0,2,0,0,0,0|2,0,0]=4 28768 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)Br 240690a_100000209980_100010209379 [0,2,0,0,0,0|2,0,0]=4 28769 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)Br 527a_100000209980_100010209379 [0,2,0,0,0,0|2,0,0]=4 28770 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)C 1626a_100000209980_100010147022 [0,2,0,0,0,0|2,0,0]=4 28771 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)C 240690a_100000209980_100010147022 [0,2,0,0,0,0|2,0,0]=4 28772 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)C 527a_100000209980_100010147022 [0,2,0,0,0,0|2,0,0]=4 28773 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)Cl 1626a_100000209980_100013084675 [0,2,0,0,0,0|2,0,0]=4 28774 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)Cl 240690a_100000209980_100013084675 [0,2,0,0,0,0|2,0,0]=4 28775 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)Cl 527a_100000209980_100013084675 [0,2,0,0,0,0|2,0,0]=4 28776 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)F 1626a_100000209980_100010172741 [0,2,0,0,0,0|2,0,0]=4 28777 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)F 240690a_100000209980_100010172741 [0,2,0,0,0,0|2,0,0]=4 28778 B16R1.22096 COCCNC(=O)Cc1c(cccc1Br)F 527a_100000209980_100010172741 [0,2,0,0,0,0|2,0,0]=4 28779 B16R1.22096 COCCNC(=O)Cc1c(cccc1C)C 1626a_100000209980_100000689862 [0,2,0,0,0,0|2,0,0]=4 28780 B16R1.22096 COCCNC(=O)Cc1c(cccc1C)C 240690a_100000209980_100000689862 [0,2,0,0,0,0|2,0,0]=4 28781 B16R1.22096 COCCNC(=O)Cc1c(cccc1C)C 527a_100000209980_100000689862 [0,2,0,0,0,0|2,0,0]=4 28782 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100000209980_100000211232 [0,2,0,0,0,0|2,0,0]=4 28783 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100000209980_100000211232 [0,2,0,0,0,0|2,0,0]=4 28784 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)Cl 527a_100000209980_100000211232 [0,2,0,0,0,0|2,0,0]=4 28785 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)F 1626a_100000209980_100000185183 [0,2,0,0,0,0|2,0,0]=4 28786 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)F 240690a_100000209980_100000185183 [0,2,0,0,0,0|2,0,0]=4 28787 B16R1.22096 COCCNC(=O)Cc1c(cccc1Cl)F 527a_100000209980_100000185183 [0,2,0,0,0,0|2,0,0]=4 28788 B16R1.22096 COCCNC(=O)Cc1c(cccc1F)F 1626a_100000209980_100000684726 [0,2,0,0,0,0|2,0,0]=4 28789 B16R1.22096 COCCNC(=O)Cc1c(cccc1F)F 240690a_100000209980_100000684726 [0,2,0,0,0,0|2,0,0]=4 28790 B16R1.22096 COCCNC(=O)Cc1c(cccc1F)F 527a_100000209980_100000684726 [0,2,0,0,0,0|2,0,0]=4 28791 B16R1.22096 COCCOC(=O)Nc1c(cccc1C)C 34a_100138415774_200009990517 [0,2,0,0,0,0|2,0,0]=4 28792 B16R1.22096 CSCCCC(=O)Cc1c(cccc1Br)C 1458a_100000173376_100010146847 [0,2,0,0,0,0|2,0,0]=4 28793 B16R1.22096 CSCCCC(=O)Cc1c(cccc1Br)Cl 1458a_100000173376_100010138402 [0,2,0,0,0,0|2,0,0]=4 28794 B16R1.22096 CSCCCC(=O)Cc1c(cccc1Br)F 1458a_100000173376_100000696636 [0,2,0,0,0,0|2,0,0]=4 28795 B16R1.22096 CSCCCC(=O)Cc1c(cccc1C)C 1458a_100000173376_100000758300 [0,2,0,0,0,0|2,0,0]=4 28796 B16R1.22096 CSCCCC(=O)Cc1c(cccc1Cl)Cl 1458a_100000173376_100000187851 [0,2,0,0,0,0|2,0,0]=4 28797 B16R1.22096 CSCCCC(=O)Cc1c(cccc1Cl)F 1458a_100000173376_100000187852 [0,2,0,0,0,0|2,0,0]=4 28798 B16R1.22096 CSCCCC(=O)Cc1c(cccc1F)C 1458a_100000173376_100009814554 [0,2,0,0,0,0|2,0,0]=4 28799 B16R1.22096 CSCCCC(=O)Cc1c(cccc1F)F 1458a_100000173376_100000698325 [0,2,0,0,0,0|2,0,0]=4 28800 B16R1.22096 CSCCCC(=O)Cc1c(cccc1I)Br 1458a_100000173376_100010146611 [0,2,0,0,0,0|2,0,0]=4 28801 B16R1.22096 CSCCCC(=O)Cc1c(cccc1I)C 1458a_100000173376_100010150146 [0,2,0,0,0,0|2,0,0]=4 28802 B16R1.22096 CSCCCC(=O)Cc1c(cccc1I)F 1458a_100000173376_100010149602 [0,2,0,0,0,0|2,0,0]=4 28803 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Br 11a_100020590264_100010209379 [0,2,0,0,0,0|2,0,0]=4 28804 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Br 240690a_100020590264_100010209379 [0,2,0,0,0,0|2,0,0]=4 28805 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Br 527a_100020590264_100010209379 [0,2,0,0,0,0|2,0,0]=4 28806 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)C 11a_100020590264_100010147022 [0,2,0,0,0,0|2,0,0]=4 28807 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)C 1626a_100020590264_100010147022 [0,2,0,0,0,0|2,0,0]=4 28808 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)C 240690a_100020590264_100010147022 [0,2,0,0,0,0|2,0,0]=4 28809 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)C 527a_100020590264_100010147022 [0,2,0,0,0,0|2,0,0]=4 28810 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Cl 11a_100020590264_100013084675 [0,2,0,0,0,0|2,0,0]=4 28811 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Cl 1626a_100020590264_100013084675 [0,2,0,0,0,0|2,0,0]=4 28812 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Cl 240690a_100020590264_100013084675 [0,2,0,0,0,0|2,0,0]=4 28813 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)Cl 527a_100020590264_100013084675 [0,2,0,0,0,0|2,0,0]=4 28814 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)F 11a_100020590264_100010172741 [0,2,0,0,0,0|2,0,0]=4 28815 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)F 1626a_100020590264_100010172741 [0,2,0,0,0,0|2,0,0]=4 28816 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)F 240690a_100020590264_100010172741 [0,2,0,0,0,0|2,0,0]=4 28817 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Br)F 527a_100020590264_100010172741 [0,2,0,0,0,0|2,0,0]=4 28818 B16R1.22096 CSCCNC(=O)Cc1c(cccc1C)C 11a_100020590264_100000689862 [0,2,0,0,0,0|2,0,0]=4 28819 B16R1.22096 CSCCNC(=O)Cc1c(cccc1C)C 1626a_100020590264_100000689862 [0,2,0,0,0,0|2,0,0]=4 28820 B16R1.22096 CSCCNC(=O)Cc1c(cccc1C)C 240690a_100020590264_100000689862 [0,2,0,0,0,0|2,0,0]=4 28821 B16R1.22096 CSCCNC(=O)Cc1c(cccc1C)C 527a_100020590264_100000689862 [0,2,0,0,0,0|2,0,0]=4 28822 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl 11a_100020590264_100000211232 [0,2,0,0,0,0|2,0,0]=4 28823 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl 1626a_100020590264_100000211232 [0,2,0,0,0,0|2,0,0]=4 28824 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl 240690a_100020590264_100000211232 [0,2,0,0,0,0|2,0,0]=4 28825 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)Cl 527a_100020590264_100000211232 [0,2,0,0,0,0|2,0,0]=4 28826 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F 11a_100020590264_100000185183 [0,2,0,0,0,0|2,0,0]=4 28827 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F 1626a_100020590264_100000185183 [0,2,0,0,0,0|2,0,0]=4 28828 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F 240690a_100020590264_100000185183 [0,2,0,0,0,0|2,0,0]=4 28829 B16R1.22096 CSCCNC(=O)Cc1c(cccc1Cl)F 527a_100020590264_100000185183 [0,2,0,0,0,0|2,0,0]=4 28830 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F 11a_100020590264_100000684726 [0,2,0,0,0,0|2,0,0]=4 28831 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F 1626a_100020590264_100000684726 [0,2,0,0,0,0|2,0,0]=4 28832 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F 240690a_100020590264_100000684726 [0,2,0,0,0,0|2,0,0]=4 28833 B16R1.22096 CSCCNC(=O)Cc1c(cccc1F)F 527a_100020590264_100000684726 [0,2,0,0,0,0|2,0,0]=4 28834 B16R1.22096 CSCCOC(=O)Nc1c(cccc1C)C 62a_200000210301_200009990517 [0,2,0,0,0,0|2,0,0]=4 28835 B16R1.22096 Cc1cccc(c1CC(=O)CCCCF)Br 1458a_100010147022_100000729493 [0,2,0,0,0,0|2,0,0]=4 28836 B16R1.22096 Cc1cccc(c1CC(=O)CCCCF)C 1458a_100000689862_100000729493 [0,2,0,0,0,0|2,0,0]=4 28837 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)Br 1458a_100000695505_100010146847 [0,2,0,0,0,0|2,0,0]=4 28838 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)Br 1458a_100010147022_100000210776 [0,2,0,0,0,0|2,0,0]=4 28839 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)C 1458a_100000689862_100000210776 [0,2,0,0,0,0|2,0,0]=4 28840 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)C 1458a_100000695505_100000758300 [0,2,0,0,0,0|2,0,0]=4 28841 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)F 1458a_100000695505_100009814554 [0,2,0,0,0,0|2,0,0]=4 28842 B16R1.22096 Cc1cccc(c1CC(=O)CCCCO)I 1458a_100000695505_100010150146 [0,2,0,0,0,0|2,0,0]=4 28843 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)Br 11a_100015189416_100010147022 [0,2,0,0,0,0|2,0,0]=4 28844 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)Br 1626a_100015189416_100010147022 [0,2,0,0,0,0|2,0,0]=4 28845 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)Br 240690a_100015189416_100010147022 [0,2,0,0,0,0|2,0,0]=4 28846 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)Br 527a_100015189416_100010147022 [0,2,0,0,0,0|2,0,0]=4 28847 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)C 11a_100015189416_100000689862 [0,2,0,0,0,0|2,0,0]=4 28848 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)C 1626a_100015189416_100000689862 [0,2,0,0,0,0|2,0,0]=4 28849 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)C 240690a_100015189416_100000689862 [0,2,0,0,0,0|2,0,0]=4 28850 B16R1.22096 Cc1cccc(c1CC(=O)NCCCF)C 527a_100015189416_100000689862 [0,2,0,0,0,0|2,0,0]=4 28851 B16R1.22096 Cc1cccc(c1CC(=O)NCCCO)Br 240690a_100000182051_100010147022 [0,2,0,0,0,0|2,0,0]=4 28852 B16R1.22096 Cc1cccc(c1CC(=O)NCCCO)Br 527a_100000182051_100010147022 [0,2,0,0,0,0|2,0,0]=4 28853 B16R1.22096 Cc1cccc(c1CC(=O)NCCCO)C 240690a_100000182051_100000689862 [0,2,0,0,0,0|2,0,0]=4 28854 B16R1.22096 Cc1cccc(c1CC(=O)NCCCO)C 527a_100000182051_100000689862 [0,2,0,0,0,0|2,0,0]=4 28855 B16R1.22096 Cc1cccc(c1NC(=O)OCCS[13CH3])C 62a_200025704644_200009990517 [0,2,0,0,0,0|2,0,0]=4 28856 B16R1.22096 O=C(CCCCF)Cc1c(cccc1Br)Br 1458a_100010209379_100000729493 [0,2,0,0,0,0|2,0,0]=4 28857 B16R1.22096 O=C(CCCCF)Cc1c(cccc1Br)Cl 1458a_100013084675_100000729493 [0,2,0,0,0,0|2,0,0]=4 28858 B16R1.22096 O=C(CCCCF)Cc1c(cccc1Br)F 1458a_100010172741_100000729493 [0,2,0,0,0,0|2,0,0]=4 28859 B16R1.22096 O=C(CCCCF)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000729493 [0,2,0,0,0,0|2,0,0]=4 28860 B16R1.22096 O=C(CCCCF)Cc1c(cccc1Cl)F 1458a_100000185183_100000729493 [0,2,0,0,0,0|2,0,0]=4 28861 B16R1.22096 O=C(CCCCF)Cc1c(cccc1F)F 1458a_100000684726_100000729493 [0,2,0,0,0,0|2,0,0]=4 28862 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Br)Br 1458a_100010209379_100000210776 [0,2,0,0,0,0|2,0,0]=4 28863 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Br)Cl 1458a_100000695505_100010138402 [0,2,0,0,0,0|2,0,0]=4 28864 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Br)Cl 1458a_100013084675_100000210776 [0,2,0,0,0,0|2,0,0]=4 28865 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Br)F 1458a_100000695505_100000696636 [0,2,0,0,0,0|2,0,0]=4 28866 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Br)F 1458a_100010172741_100000210776 [0,2,0,0,0,0|2,0,0]=4 28867 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Cl)Cl 1458a_100000211232_100000210776 [0,2,0,0,0,0|2,0,0]=4 28868 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Cl)Cl 1458a_100000695505_100000187851 [0,2,0,0,0,0|2,0,0]=4 28869 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Cl)F 1458a_100000185183_100000210776 [0,2,0,0,0,0|2,0,0]=4 28870 B16R1.22096 O=C(CCCCO)Cc1c(cccc1Cl)F 1458a_100000695505_100000187852 [0,2,0,0,0,0|2,0,0]=4 28871 B16R1.22096 O=C(CCCCO)Cc1c(cccc1F)F 1458a_100000684726_100000210776 [0,2,0,0,0,0|2,0,0]=4 28872 B16R1.22096 O=C(CCCCO)Cc1c(cccc1F)F 1458a_100000695505_100000698325 [0,2,0,0,0,0|2,0,0]=4 28873 B16R1.22096 O=C(CCCCO)Cc1c(cccc1I)Br 1458a_100000695505_100010146611 [0,2,0,0,0,0|2,0,0]=4 28874 B16R1.22096 O=C(CCCCO)Cc1c(cccc1I)F 1458a_100000695505_100010149602 [0,2,0,0,0,0|2,0,0]=4 28875 B16R1.22096 O=C(Cc1c(cccc1Br)Br)NCCCF 11a_100015189416_100010209379 [0,2,0,0,0,0|2,0,0]=4 28876 B16R1.22096 O=C(Cc1c(cccc1Br)Br)NCCCF 240690a_100015189416_100010209379 [0,2,0,0,0,0|2,0,0]=4 28877 B16R1.22096 O=C(Cc1c(cccc1Br)Br)NCCCF 527a_100015189416_100010209379 [0,2,0,0,0,0|2,0,0]=4 28878 B16R1.22096 O=C(Cc1c(cccc1Br)Br)NCCCO 240690a_100000182051_100010209379 [0,2,0,0,0,0|2,0,0]=4 28879 B16R1.22096 O=C(Cc1c(cccc1Br)Br)NCCCO 527a_100000182051_100010209379 [0,2,0,0,0,0|2,0,0]=4 28880 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCF 11a_100015189416_100013084675 [0,2,0,0,0,0|2,0,0]=4 28881 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCF 1626a_100015189416_100013084675 [0,2,0,0,0,0|2,0,0]=4 28882 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCF 240690a_100015189416_100013084675 [0,2,0,0,0,0|2,0,0]=4 28883 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCF 527a_100015189416_100013084675 [0,2,0,0,0,0|2,0,0]=4 28884 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCO 240690a_100000182051_100013084675 [0,2,0,0,0,0|2,0,0]=4 28885 B16R1.22096 O=C(Cc1c(cccc1Br)Cl)NCCCO 527a_100000182051_100013084675 [0,2,0,0,0,0|2,0,0]=4 28886 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCF 11a_100015189416_100010172741 [0,2,0,0,0,0|2,0,0]=4 28887 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCF 1626a_100015189416_100010172741 [0,2,0,0,0,0|2,0,0]=4 28888 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCF 240690a_100015189416_100010172741 [0,2,0,0,0,0|2,0,0]=4 28889 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCF 527a_100015189416_100010172741 [0,2,0,0,0,0|2,0,0]=4 28890 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCO 240690a_100000182051_100010172741 [0,2,0,0,0,0|2,0,0]=4 28891 B16R1.22096 O=C(Cc1c(cccc1Br)F)NCCCO 527a_100000182051_100010172741 [0,2,0,0,0,0|2,0,0]=4 28892 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCF 11a_100015189416_100000211232 [0,2,0,0,0,0|2,0,0]=4 28893 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCF 1626a_100015189416_100000211232 [0,2,0,0,0,0|2,0,0]=4 28894 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCF 240690a_100015189416_100000211232 [0,2,0,0,0,0|2,0,0]=4 28895 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCF 527a_100015189416_100000211232 [0,2,0,0,0,0|2,0,0]=4 28896 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCO 240690a_100000182051_100000211232 [0,2,0,0,0,0|2,0,0]=4 28897 B16R1.22096 O=C(Cc1c(cccc1Cl)Cl)NCCCO 527a_100000182051_100000211232 [0,2,0,0,0,0|2,0,0]=4 28898 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCF 11a_100015189416_100000185183 [0,2,0,0,0,0|2,0,0]=4 28899 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCF 1626a_100015189416_100000185183 [0,2,0,0,0,0|2,0,0]=4 28900 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCF 240690a_100015189416_100000185183 [0,2,0,0,0,0|2,0,0]=4 28901 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCF 527a_100015189416_100000185183 [0,2,0,0,0,0|2,0,0]=4 28902 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCO 240690a_100000182051_100000185183 [0,2,0,0,0,0|2,0,0]=4 28903 B16R1.22096 O=C(Cc1c(cccc1Cl)F)NCCCO 527a_100000182051_100000185183 [0,2,0,0,0,0|2,0,0]=4 28904 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCF 11a_100015189416_100000684726 [0,2,0,0,0,0|2,0,0]=4 28905 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCF 1626a_100015189416_100000684726 [0,2,0,0,0,0|2,0,0]=4 28906 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCF 240690a_100015189416_100000684726 [0,2,0,0,0,0|2,0,0]=4 28907 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCF 527a_100015189416_100000684726 [0,2,0,0,0,0|2,0,0]=4 28908 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCO 240690a_100000182051_100000684726 [0,2,0,0,0,0|2,0,0]=4 28909 B16R1.22096 O=C(Cc1c(cccc1F)F)NCCCO 527a_100000182051_100000684726 [0,2,0,0,0,0|2,0,0]=4 28910 B14R1.137 C=CC=CC(=O)CC(=O)N1CCCC1 1458a_100016291481_100000183516 [0,0,1,1,0,0|2,0,0]=4 28911 B14R1.938 C=CC=CC(=O)C1CCCCCC1=O 1458a_100016291481_100000243696 [0,0,1,1,0,0|2,0,0]=4 28912 B14R1.938 C=CC=CC(=O)C1CCCCNC1=O 1458a_100016291481_100000735217 [0,0,1,1,0,0|2,0,0]=4 28913 B14R1.86 CCCCOC(=O)COc1ccsc1 34a_100000106738_100000211628 [0,0,1,1,0,0|2,0,0]=4 28914 B14R1.86 CCCCOC(=O)COc1ccsc1 7a_100000106738_100000211628 [0,0,1,1,0,0|2,0,0]=4 28915 B14R1.86 CCCCOC(=O)CSc1ccco1 62a_100000211628_100009814098 [0,0,1,1,0,0|2,0,0]=4 28916 B14R1.86 CCCCOC(=O)CSc1ccco1 62a_100009814098_100000211628 [0,0,1,1,0,0|2,0,0]=4 28917 B14R1.86 CCCCOC(=O)CSc1cccs1 62a_100000211628_100011215356 [0,0,1,1,0,0|2,0,0]=4 28918 B14R1.86 CCCCOC(=O)CSc1cccs1 62a_100011215356_100000211628 [0,0,1,1,0,0|2,0,0]=4 28919 B14R1.86 CCCCOC(=O)CSc1ccoc1 62a_100000211628_100011215275 [0,0,1,1,0,0|2,0,0]=4 28920 B14R1.86 CCCCOC(=O)CSc1ccoc1 62a_100011215275_100000211628 [0,0,1,1,0,0|2,0,0]=4 28921 B14R1.86 CCCCOC(=O)CSc1ccsc1 62a_100000211628_100000738268 [0,0,1,1,0,0|2,0,0]=4 28922 B14R1.86 CCCCOC(=O)CSc1ccsc1 62a_100000738268_100000211628 [0,0,1,1,0,0|2,0,0]=4 28923 B14R2.3 CCCCc1coc2c1cccc2 271570a_100020621405_100009812202 [1,0,0,1,0,0|2,0,0]=4 28924 B14R2.3 CCCCc1csc2c1cccc2 271570a_100020621405_100009813928 [1,0,0,1,0,0|2,0,0]=4 28925 B14R2.14 COC1COCC1c2ccccc2 34a_100010739164_200000210301 [1,0,0,1,0,0|1,0,1]=4 28926 B14R2.14 COC1COCC1c2ccccc2 7a_100010739164_200000210301 [1,0,0,1,0,0|1,0,1]=4 28927 B14R2.14 [13CH3]OC1COCC1c2ccccc2 34a_100010739164_200025704644 [1,0,0,1,0,0|1,0,1]=4 28928 B14R2.14 [13CH3]OC1COCC1c2ccccc2 7a_100010739164_200025704644 [1,0,0,1,0,0|1,0,1]=4 28929 B14R2.24 CN1CCOCC1c2ccccc2 2230a_100000765270_200000210301 [1,0,0,1,0,0|1,0,1]=4 28930 B14R2.24 CN1CCOCC1c2ccccc2 269982a_100000765270_200000210301 [1,0,0,1,0,0|1,0,1]=4 28931 B14R2.24 CN1CCOCC1c2ccccc2 34a_100000765270_200000210301 [1,0,0,1,0,0|1,0,1]=4 28932 B14R2.24 [13CH3]N1CCOCC1c2ccccc2 2230a_100000765270_200025704644 [1,0,0,1,0,0|1,0,1]=4 28933 B14R2.24 [13CH3]N1CCOCC1c2ccccc2 269982a_100000765270_200025704644 [1,0,0,1,0,0|1,0,1]=4 28934 B14R2.24 [13CH3]N1CCOCC1c2ccccc2 34a_100000765270_200025704644 [1,0,0,1,0,0|1,0,1]=4 28935 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 2230a_100015189458_100015291786 [1,0,0,1,0,0|2,0,0]=4 28936 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 269982a_100015189458_100000211182 [1,0,0,1,0,0|2,0,0]=4 28937 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 270004a_100015189458_100015611070 [1,0,0,1,0,0|2,0,0]=4 28938 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 34a_100015189458_100015291786 [1,0,0,1,0,0|2,0,0]=4 28939 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 2230a_100020605311_100015291786 [1,0,0,1,0,0|2,0,0]=4 28940 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 269982a_100020605311_100000211182 [1,0,0,1,0,0|2,0,0]=4 28941 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 270004a_100020605311_100015611070 [1,0,0,1,0,0|2,0,0]=4 28942 B14R2.31 CC1CCN1CCc2ccccc2 269982a_100000755817_100000765856 [1,0,0,1,0,0|1,0,1]=4 28943 B14R2.31 CC1CCN1CCc2ccccc2 34a_100000755817_100000765856 [1,0,0,1,0,0|1,0,1]=4 28944 B14R2.49 CC1CC1COCc2ccccc2 34a_100000744939_100015291786 [1,0,0,1,0,0|2,0,0]=4 28945 B14R2.49 CC1CC1COCc2ccccc2 7a_100000744939_100000211182 [1,0,0,1,0,0|2,0,0]=4 28946 B14R2.101 c1ccc(cc1)CCN2CCCC2 2230a_100000188435_100000765856 [1,0,0,1,0,0|1,0,1]=4 28947 B14R2.101 c1ccc(cc1)CCN2CCCC2 269982a_100000188435_100000765856 [1,0,0,1,0,0|1,0,1]=4 28948 B14R2.101 c1ccc(cc1)CNC2CCCC2 207a_100000211070_100015611070 [1,0,0,1,0,0|2,0,0]=4 28949 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100000211070_100015291786 [1,0,0,1,0,0|2,0,0]=4 28950 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100015324214_100000179811 [1,0,0,1,0,0|2,0,0]=4 28951 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100000211070_100015611070 [1,0,0,1,0,0|2,0,0]=4 28952 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100015324214_100000210133 [1,0,0,1,0,0|2,0,0]=4 28953 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100000211070_100015291786 [1,0,0,1,0,0|2,0,0]=4 28954 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100015324214_100000179811 [1,0,0,1,0,0|2,0,0]=4 28955 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210269_100015291786 [1,0,0,1,0,0|2,0,0]=4 28956 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210790_100000179811 [1,0,0,1,0,0|2,0,0]=4 28957 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210269_100000211182 [1,0,0,1,0,0|2,0,0]=4 28958 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210790_100000179811 [1,0,0,1,0,0|2,0,0]=4 28959 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100000211182_100000179811 [1,0,0,1,0,0|2,0,0]=4 28960 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100011217020_100015291786 [1,0,0,1,0,0|2,0,0]=4 28961 B14R2.1253 C1=C(CCCCC1)c2ccccc2 271570a_200009888920_100000210277 [1,0,0,1,0,0|1,0,1]=4 28962 B14R2.3018 C(=NNC1CC1)Cc2ccccc2 4a_100000701032_100000209964 [1,0,0,1,0,0|2,0,0]=4 28963 B14R2.3018 c1cc(ccn1)CCOCC2CC2 34a_100011216225_100000742324 [1,0,0,1,0,0|1,0,1]=4 28964 B14R2.3018 c1ccc(cc1)CCNCC2CC2 2230a_100000106460_100000742324 [1,0,0,1,0,0|1,0,1]=4 28965 B14R2.3018 c1ccc(cc1)CCNCC2CC2 2230a_100000735609_100000765856 [1,0,0,1,0,0|1,0,1]=4 28966 B14R2.3018 c1ccc(cc1)CCNCC2CC2 269862a_100000106460_100000741477 [1,0,0,1,0,0|1,0,1]=4 28967 B14R2.3018 c1ccc(cc1)CCNCC2CC2 34a_100000106460_100000742324 [1,0,0,1,0,0|1,0,1]=4 28968 B14R2.3018 c1ccc(cc1)CCNCC2CC2 34a_100000735609_100000765856 [1,0,0,1,0,0|1,0,1]=4 28969 B14R2.3018 c1ccc(cc1)CCOCC2CC2 34a_100000210268_100000742324 [1,0,0,1,0,0|0,0,1]=3 28970 B14R2.3018 c1ccc(cc1)CCOCC2CC2 34a_100000211283_100000765856 [1,0,0,1,0,0|0,0,1]=3 28971 B14R2.3018 c1ccc(cc1)CCOCC2CC2 7a_100000210268_100000742324 [1,0,0,1,0,0|0,0,1]=3 28972 B14R2.3018 c1ccc(cc1)CCOCC2CO2 34a_100000210268_102125554688 [1,0,0,1,0,0|1,0,1]=4 28973 B14R2.3018 c1ccc(cc1)CCOCC2CO2 7a_100000210268_102125554688 [1,0,0,1,0,0|1,0,1]=4 28974 B14R2.3018 c1ccc(cc1)CCOCC2CS2 7a_100000210268_100000031435 [1,0,0,1,0,0|1,0,1]=4 28975 B14R2.3018 c1ccc(cc1)CCOC[C@@H]2CO2 34a_100000757423_100000765856 [1,0,0,1,0,0|1,0,1]=4 28976 B14R2.3018 c1ccc(cc1)CCOC[C@@H]2CO2 7a_100000210268_100000745022 [1,0,0,1,0,0|1,0,1]=4 28977 B14R2.3018 c1ccc(cc1)CCSCC2CC2 62a_100000756562_100011218657 [1,0,0,1,0,0|0,1,1]=4 28978 B14R2.3018 c1ccc(cc1)CCSCC2CC2 62a_100000765856_100000742324 [1,0,0,1,0,0|0,1,1]=4 28979 B14R2.3018 c1ccc(cc1)CNCCC2CC2 207a_100000764129_100015611070 [1,0,0,1,0,0|2,0,0]=4 28980 B14R2.3018 c1ccc(cc1)CNCCC2CC2 2230a_100015324214_100000694398 [1,0,0,1,0,0|2,0,0]=4 28981 B14R2.3018 c1ccc(cc1)CNCCC2CC2 270004a_100000764129_100015611070 [1,0,0,1,0,0|2,0,0]=4 28982 B14R2.3018 c1ccc(cc1)CNCCC2CC2 34a_100000764129_100015291786 [1,0,0,1,0,0|2,0,0]=4 28983 B14R2.3018 c1ccc(cc1)CNCCC2CC2 34a_100015324214_100000694398 [1,0,0,1,0,0|2,0,0]=4 28984 B14R2.3018 c1ccc(cc1)COCCC2CC2 34a_100000210790_100000694398 [1,0,0,1,0,0|2,0,0]=4 28985 B14R2.3018 c1ccc(cc1)COCCC2CC2 34a_100000754188_100015291786 [1,0,0,1,0,0|2,0,0]=4 28986 B14R2.3018 c1ccc(cc1)COCCC2CC2 7a_100000210790_100000764125 [1,0,0,1,0,0|2,0,0]=4 28987 B14R2.3018 c1ccc(cc1)COCCC2CC2 7a_100000754188_100000211182 [1,0,0,1,0,0|2,0,0]=4 28988 B14R2.3018 c1ccc(cc1)CSCCC2CC2 62a_100000211182_100000764125 [1,0,0,1,0,0|2,0,0]=4 28989 B14R2.3018 c1ccc(cc1)CSCCC2CC2 62a_100000764125_100015291786 [1,0,0,1,0,0|2,0,0]=4 28990 B14R2.3018 c1ccc(nc1)CCOCC2CC2 34a_100000210271_100000742324 [1,0,0,1,0,0|1,0,1]=4 28991 B14R2.3018 c1cncc(c1)CCOCC2CC2 34a_100011217484_100000742324 [1,0,0,1,0,0|1,0,1]=4 28992 B14R2.3019 c1cc(ccn1)CCOC2CCC2 34a_100011216225_100000749161 [1,0,0,1,0,0|1,0,1]=4 28993 B14R2.3019 c1ccc(cc1)CCNC2CCC2 2230a_100000749019_100000765856 [1,0,0,1,0,0|1,0,1]=4 28994 B14R2.3019 c1ccc(cc1)CCNC2CCC2 270004a_100000106460_100000241760 [1,0,0,1,0,0|1,0,1]=4 28995 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000106460_100000749161 [1,0,0,1,0,0|1,0,1]=4 28996 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000749019_100000765856 [1,0,0,1,0,0|1,0,1]=4 28997 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000210268_100000749161 [1,0,0,1,0,0|0,0,1]=3 28998 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000748187_100000765856 [1,0,0,1,0,0|0,0,1]=3 28999 B14R2.3019 c1ccc(cc1)CCOC2COC2 34a_100000210268_100009818527 [1,0,0,1,0,0|1,0,1]=4 29000 B14R2.3019 c1ccc(cc1)CCOC2COC2 7a_100000210268_100009818527 [1,0,0,1,0,0|1,0,1]=4 29001 B14R2.3019 c1ccc(cc1)CCOC2CSC2 7a_100000072292_100000765856 [1,0,0,1,0,0|1,0,1]=4 29002 B14R2.3019 c1ccc(cc1)CCSC2CCC2 62a_100000765856_100000749161 [1,0,0,1,0,0|0,1,1]=4 29003 B14R2.3019 c1ccc(cc1)CNCC2CCC2 207a_100000738700_100015611070 [1,0,0,1,0,0|2,0,0]=4 29004 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100000738700_100015291786 [1,0,0,1,0,0|2,0,0]=4 29005 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100015324214_100000763275 [1,0,0,1,0,0|2,0,0]=4 29006 B14R2.3019 c1ccc(cc1)CNCC2CCC2 269862a_100015324214_100000753134 [1,0,0,1,0,0|2,0,0]=4 29007 B14R2.3019 c1ccc(cc1)CNCC2CCC2 270004a_100000738700_100015611070 [1,0,0,1,0,0|2,0,0]=4 29008 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100000738700_100015291786 [1,0,0,1,0,0|2,0,0]=4 29009 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100015324214_100000763275 [1,0,0,1,0,0|2,0,0]=4 29010 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000210790_100000763275 [1,0,0,1,0,0|2,0,0]=4 29011 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000760304_100015291786 [1,0,0,1,0,0|2,0,0]=4 29012 B14R2.3019 c1ccc(cc1)COCC2CCC2 7a_100000210790_100000763275 [1,0,0,1,0,0|2,0,0]=4 29013 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000211182_100000763275 [1,0,0,1,0,0|2,0,0]=4 29014 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000763275_100015291786 [1,0,0,1,0,0|2,0,0]=4 29015 B14R2.3019 c1ccc(nc1)CCOC2CCC2 34a_100000210271_100000749161 [1,0,0,1,0,0|1,0,1]=4 29016 B14R2.3019 c1cncc(c1)CCOC2CCC2 34a_100011217484_100000749161 [1,0,0,1,0,0|1,0,1]=4 29017 B14R2.7150 CNCC1OCCc2c1cccc2 2230a_100000755408_200000210301 [1,0,0,1,0,0|1,0,1]=4 29018 B14R2.7150 CNCC1OCCc2c1cccc2 34a_100000755408_200000210301 [1,0,0,1,0,0|1,0,1]=4 29019 B14R2.7150 [13CH3]NCC1OCCc2c1cccc2 2230a_100000755408_200025704644 [1,0,0,1,0,0|1,0,1]=4 29020 B14R2.7150 [13CH3]NCC1OCCc2c1cccc2 34a_100000755408_200025704644 [1,0,0,1,0,0|1,0,1]=4 29021 B14R2.16538 CCCCNC1Cc2c1cccc2 7a_106832991798_100009813401 [1,0,0,1,0,0|1,0,1]=4 29022 B14R2.16538 CCCCOC1Cc2c1cccc2 7a_100000210227_100009813401 [1,0,0,1,0,0|0,0,1]=3 29023 B14R2.16538 CCCCSC1Cc2c1cccc2 62a_100000210211_100009813401 [1,0,0,1,0,0|0,1,1]=4 29024 B14R2.16538 CCCCSC1Cc2c1cccc2 62a_100009813401_100000210210 [1,0,0,1,0,0|0,1,1]=4 29025 B14R2.16538 CCCNN=C1Cc2c1cccc2 4a_100000740057_100000051409 [1,0,0,1,0,0|2,0,0]=4 29026 B14R2.16538 CSCCOC1Cc2c1cccc2 7a_100000230434_100009813401 [1,0,0,1,0,0|1,0,1]=4 29027 B14R2.19 C[C@@H]1CCN(C1)Cc2ccccc2 2230a_100016987628_100015291786 [1,0,0,1,0,0|2,0,0]=4 29028 B14R2.19 C[C@@H]1CCN(C1)Cc2ccccc2 269982a_100016987628_100000211182 [1,0,0,1,0,0|2,0,0]=4 29029 B14R2.19 C[C@@H]1CCN(C1)Cc2ccccc2 270004a_100016987628_100015611070 [1,0,0,1,0,0|2,0,0]=4 29030 B14R2.19 C[C@@H]1CCN(C1)Cc2ccccc2 34a_100016987628_100015291786 [1,0,0,1,0,0|2,0,0]=4 29031 B14R2.67 CCCCN1Cc2ccccc2C1 2230a_100000752595_100000210211 [1,0,0,1,0,0|2,0,0]=4 29032 B14R2.67 CCCCN1Cc2ccccc2C1 269982a_100000752595_100000210211 [1,0,0,1,0,0|2,0,0]=4 29033 B14R2.67 CCCCN1Cc2ccccc2C1 34a_100000752595_100000210210 [1,0,0,1,0,0|2,0,0]=4 29034 B14R2.67 CCCCc1cc2ccccc2[nH]1 271570a_100020621405_100010232065 [1,0,0,1,0,0|1,0,1]=4 29035 B14R2.67 CCCCc1cc2ccccc2o1 271570a_100020621405_100010159458 [1,0,0,1,0,0|0,0,2]=4 29036 B14R2.67 CCCCc1cc2ccccc2s1 271570a_100020621405_100009816949 [1,0,0,1,0,0|0,1,1]=4 29037 B14R2.67 CCCCc1nc2ccccc2[nH]1 271570a_100020621405_100009814255 [1,0,0,1,0,0|2,0,0]=4 29038 B14R2.67 CCCCc1nc2ccccc2s1 271570a_100020621405_100000751744 [1,0,0,1,0,0|1,1,0]=4 29039 B14R2.67 CCCOC1Cc2ccccc2C1 34a_100000210258_100000753484 [1,0,0,1,0,0|1,0,1]=4 29040 B14R2.67 CCCOC1Cc2ccccc2C1 34a_100011215286_100000210303 [1,0,0,1,0,0|1,0,1]=4 29041 B14R2.90 CCC1CN(C1)Cc2ccccc2 2230a_100015205115_100015291786 [1,0,0,1,0,0|2,0,0]=4 29042 B14R2.90 CCC1CN(C1)Cc2ccccc2 269982a_100015205115_100000211182 [1,0,0,1,0,0|2,0,0]=4 29043 B14R2.90 CCC1CN(C1)Cc2ccccc2 270004a_100015205115_100015611070 [1,0,0,1,0,0|2,0,0]=4 29044 B14R2.343 CC1CC1C(=O)Cc2ccccc2 1458a_100000211227_100015291786 [1,0,0,1,0,0|0,0,0]=2 29045 B14R2.343 CC1CC1C(=O)Cc2ccccn2 1458a_100000211227_100000721315 [1,0,0,1,0,0|1,0,0]=3 29046 B14R2.343 CC1CC1C(=O)Cc2cccnc2 1458a_100000211227_100000733263 [1,0,0,1,0,0|1,0,0]=3 29047 B14R2.343 CC1CC1C(=O)Cc2cccnn2 1458a_100000211227_100016990269 [1,0,0,1,0,0|2,0,0]=4 29048 B14R2.343 CC1CC1C(=O)Cc2ccncc2 1458a_100000211227_100000705612 [1,0,0,1,0,0|1,0,0]=3 29049 B14R2.343 CC1CC1C(=O)Cc2cnccn2 1458a_100000211227_100016995436 [1,0,0,1,0,0|2,0,0]=4 29050 B14R2.343 CC1CC1C(=O)Cc2cncnc2 1458a_100000211227_100015196519 [1,0,0,1,0,0|2,0,0]=4 29051 B14R2.343 CC1CC1C(=O)Cc2ncccn2 1458a_100000211227_100000703007 [1,0,0,1,0,0|2,0,0]=4 29052 B14R2.343 CC1CC1C(=O)Nc2ccccc2 11a_100000106764_100000211227 [1,0,0,1,0,0|1,0,0]=3 29053 B14R2.343 CC1CC1C(=O)Nc2ccccc2 1626a_100000106764_100000211227 [1,0,0,1,0,0|1,0,0]=3 29054 B14R2.343 CC1CC1C(=O)Nc2ccccc2 22a_100000106764_100000211227 [1,0,0,1,0,0|1,0,0]=3 29055 B14R2.343 CC1CC1C(=O)Nc2ccccc2 527a_100000106764_100000211227 [1,0,0,1,0,0|1,0,0]=3 29056 B14R2.343 O=C(Cc1ccccc1)[C@@H]2C[C@@H]2F 1458a_100015396687_100015291786 [1,0,0,1,0,0|1,0,0]=3 29057 B14R2.343 O=C(Cc1ccccn1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000721315 [1,0,0,1,0,0|2,0,0]=4 29058 B14R2.343 O=C(Cc1cccnc1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000733263 [1,0,0,1,0,0|2,0,0]=4 29059 B14R2.343 O=C(Cc1ccncc1)[C@@H]2C[C@@H]2F 1458a_100015396687_100000705612 [1,0,0,1,0,0|2,0,0]=4 29060 B14R2.343 O=C(Nc1ccccc1)[C@@H]2C[C@@H]2F 11a_100000106764_100015396687 [1,0,0,1,0,0|2,0,0]=4 29061 B14R2.343 O=C(Nc1ccccc1)[C@@H]2C[C@@H]2F 22a_100000106764_100015396687 [1,0,0,1,0,0|2,0,0]=4 29062 B14R2.343 O=C(Nc1ccccc1)[C@@H]2C[C@@H]2F 527a_100000106764_100015396687 [1,0,0,1,0,0|2,0,0]=4 29063 B14R2.517 CCSC1C(=O)Nc2c1cccc2 62a_100000210202_200009996675 [1,0,0,1,0,0|2,0,0]=4 29064 B14R2.9589 CN(Cc1ccccc1)C2CCC2 2230a_100000758072_100015291786 [1,0,0,1,0,0|2,0,0]=4 29065 B14R2.9589 CN(Cc1ccccc1)C2CCC2 2230a_100025768344_200000210301 [1,0,0,1,0,0|2,0,0]=4 29066 B14R2.9589 CN(Cc1ccccc1)C2CCC2 269982a_100000186898_100000749161 [1,0,0,1,0,0|2,0,0]=4 29067 B14R2.9589 CN(Cc1ccccc1)C2CCC2 269982a_100000758072_100000211182 [1,0,0,1,0,0|2,0,0]=4 29068 B14R2.9589 CN(Cc1ccccc1)C2CCC2 269982a_100025768344_200000210301 [1,0,0,1,0,0|2,0,0]=4 29069 B14R2.9589 CN(Cc1ccccc1)C2CCC2 270004a_100000186898_100000241760 [1,0,0,1,0,0|2,0,0]=4 29070 B14R2.9589 CN(Cc1ccccc1)C2CCC2 270004a_100000758072_100015611070 [1,0,0,1,0,0|2,0,0]=4 29071 B14R2.9589 CN(Cc1ccccc1)C2CCC2 34a_100000758072_100015291786 [1,0,0,1,0,0|2,0,0]=4 29072 B14R2.9589 CN(Cc1ccccc1)C2CCC2 34a_100025768344_200000210301 [1,0,0,1,0,0|2,0,0]=4 29073 B14R2.9589 O=C(C[n+]1ccccc1)C2CCC2 1458a_200000086051_100000749161 [1,0,0,1,0,0|1,0,0]=3 29074 B14R2.9589 O=C(C[n+]1ccccc1)C2COC2 1458a_200000086051_100000687716 [1,0,0,1,0,0|2,0,0]=4 29075 B14R2.9589 O=C(C[n+]1ccccc1)N2CCC2 11a_100000754969_200000086051 [1,0,0,1,0,0|2,0,0]=4 29076 B14R2.9589 O=C(C[n+]1ccccc1)N2CCC2 240690a_100000754969_200000086051 [1,0,0,1,0,0|2,0,0]=4 29077 B14R2.9589 O=C(C[n+]1ccccc1)N2CCC2 527a_100000754969_200000086051 [1,0,0,1,0,0|2,0,0]=4 29078 B14R2.9589 O=C(Cc1ccccc1)C2CCC2 1458a_100000209988_100015291786 [1,0,0,1,0,0|0,0,0]=2 29079 B14R2.9589 O=C(Cc1ccccc1)C2CCO2 1458a_100000089072_100015291786 [1,0,0,1,0,0|1,0,0]=3 29080 B14R2.9589 O=C(Cc1ccccc1)C2COC2 1458a_100000758290_100015291786 [1,0,0,1,0,0|1,0,0]=3 29081 B14R2.9589 O=C(Cc1ccccn1)C2CCC2 1458a_100000209988_100000721315 [1,0,0,1,0,0|1,0,0]=3 29082 B14R2.9589 O=C(Cc1ccccn1)C2CCC2 1458a_100000233486_100000749161 [1,0,0,1,0,0|1,0,0]=3 29083 B14R2.9589 O=C(Cc1ccccn1)C2CCO2 1458a_100000089072_100000721315 [1,0,0,1,0,0|2,0,0]=4 29084 B14R2.9589 O=C(Cc1ccccn1)C2COC2 1458a_100000233486_100000687716 [1,0,0,1,0,0|2,0,0]=4 29085 B14R2.9589 O=C(Cc1ccccn1)C2COC2 1458a_100000758290_100000721315 [1,0,0,1,0,0|2,0,0]=4 29086 B14R2.9589 O=C(Cc1ccccn1)N2CCC2 11a_100000754969_100000233486 [1,0,0,1,0,0|2,0,0]=4 29087 B14R2.9589 O=C(Cc1cccnc1)C2CCC2 1458a_100000209988_100000733263 [1,0,0,1,0,0|1,0,0]=3 29088 B14R2.9589 O=C(Cc1cccnc1)C2CCC2 1458a_100000737805_100000749161 [1,0,0,1,0,0|1,0,0]=3 29089 B14R2.9589 O=C(Cc1cccnc1)C2CCO2 1458a_100000089072_100000733263 [1,0,0,1,0,0|2,0,0]=4 29090 B14R2.9589 O=C(Cc1cccnc1)C2COC2 1458a_100000737805_100000687716 [1,0,0,1,0,0|2,0,0]=4 29091 B14R2.9589 O=C(Cc1cccnc1)C2COC2 1458a_100000758290_100000733263 [1,0,0,1,0,0|2,0,0]=4 29092 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 11a_100000754969_100000737805 [1,0,0,1,0,0|2,0,0]=4 29093 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 240690a_100000754969_100000737805 [1,0,0,1,0,0|2,0,0]=4 29094 B14R2.9589 O=C(Cc1cccnc1)N2CCC2 527a_100000754969_100000737805 [1,0,0,1,0,0|2,0,0]=4 29095 B14R2.9589 O=C(Cc1cccnn1)C2CCC2 1458a_100000209988_100016990269 [1,0,0,1,0,0|2,0,0]=4 29096 B14R2.9589 O=C(Cc1ccncc1)C2CCC2 1458a_100000209988_100000705612 [1,0,0,1,0,0|1,0,0]=3 29097 B14R2.9589 O=C(Cc1ccncc1)C2CCO2 1458a_100000089072_100000705612 [1,0,0,1,0,0|2,0,0]=4 29098 B14R2.9589 O=C(Cc1ccncc1)C2COC2 1458a_100000758290_100000705612 [1,0,0,1,0,0|2,0,0]=4 29099 B14R2.9589 O=C(Cc1ccncc1)N2CCC2 11a_100000754969_100011201483 [1,0,0,1,0,0|2,0,0]=4 29100 B14R2.9589 O=C(Cc1ccncc1)N2CCC2 240690a_100000754969_100011201483 [1,0,0,1,0,0|2,0,0]=4 29101 B14R2.9589 O=C(Cc1cnccn1)C2CCC2 1458a_100000209988_100016995436 [1,0,0,1,0,0|2,0,0]=4 29102 B14R2.9589 O=C(Cc1cncnc1)C2CCC2 1458a_100000209988_100015196519 [1,0,0,1,0,0|2,0,0]=4 29103 B14R2.9589 O=C(Cc1cncnc1)C2CCC2 1458a_100000721575_100000749161 [1,0,0,1,0,0|2,0,0]=4 29104 B14R2.9589 O=C(Cc1ncccn1)C2CCC2 1458a_100000209988_100000703007 [1,0,0,1,0,0|2,0,0]=4 29105 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 11a_100000106764_100000209988 [1,0,0,1,0,0|1,0,0]=3 29106 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 1626a_100000106764_100000209988 [1,0,0,1,0,0|1,0,0]=3 29107 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 22a_100000106764_100000209988 [1,0,0,1,0,0|1,0,0]=3 29108 B14R2.9589 O=C(Nc1ccccc1)C2CCC2 527a_100000106764_100000209988 [1,0,0,1,0,0|1,0,0]=3 29109 B14R2.9589 O=C(Nc1ccccc1)C2CCO2 11a_100000106764_100000089072 [1,0,0,1,0,0|2,0,0]=4 29110 B14R2.9589 O=C(Nc1ccccc1)C2CCO2 1626a_100000106764_100000089072 [1,0,0,1,0,0|2,0,0]=4 29111 B14R2.9589 O=C(Nc1ccccc1)C2CCO2 22a_100000106764_100000089072 [1,0,0,1,0,0|2,0,0]=4 29112 B14R2.9589 O=C(Nc1ccccc1)C2CCO2 527a_100000106764_100000089072 [1,0,0,1,0,0|2,0,0]=4 29113 B14R2.9589 O=C(Nc1ccccc1)C2COC2 11a_100000106764_100000758290 [1,0,0,1,0,0|2,0,0]=4 29114 B14R2.9589 O=C(Nc1ccccc1)C2COC2 1626a_100000106764_100000758290 [1,0,0,1,0,0|2,0,0]=4 29115 B14R2.9589 O=C(Nc1ccccc1)C2COC2 22a_100000106764_100000758290 [1,0,0,1,0,0|2,0,0]=4 29116 B14R2.9589 O=C(Nc1ccccc1)C2COC2 527a_100000106764_100000758290 [1,0,0,1,0,0|2,0,0]=4 29117 B14R2.9589 O=C(Nc1ccccc1)N2CCC2 2430a_100000106764_100000754969 [1,0,0,1,0,0|2,0,0]=4 29118 B14R2.9589 [13CH3]N(Cc1ccccc1)C2CCC2 2230a_100025768344_200025704644 [1,0,0,1,0,0|2,0,0]=4 29119 B14R2.9589 [13CH3]N(Cc1ccccc1)C2CCC2 269982a_100025768344_200025704644 [1,0,0,1,0,0|2,0,0]=4 29120 B14R2.9589 [13CH3]N(Cc1ccccc1)C2CCC2 34a_100025768344_200025704644 [1,0,0,1,0,0|2,0,0]=4 29121 B14R2.9593 CC(Cc1ccccc1)OC2CC2 34a_100000748627_100000211595 [1,0,0,1,0,0|1,0,1]=4 29122 B14R2.9593 CN(Cc1ccccc1)CC2CC2 2230a_100000186374_200000210301 [1,0,0,1,0,0|2,0,0]=4 29123 B14R2.9593 CN(Cc1ccccc1)CC2CC2 2230a_100000186898_100000742324 [1,0,0,1,0,0|2,0,0]=4 29124 B14R2.9593 CN(Cc1ccccc1)CC2CC2 2230a_100000741881_100015291786 [1,0,0,1,0,0|2,0,0]=4 29125 B14R2.9593 CN(Cc1ccccc1)CC2CC2 269982a_100000186374_200000210301 [1,0,0,1,0,0|2,0,0]=4 29126 B14R2.9593 CN(Cc1ccccc1)CC2CC2 269982a_100000186898_100000756562 [1,0,0,1,0,0|2,0,0]=4 29127 B14R2.9593 CN(Cc1ccccc1)CC2CC2 269982a_100000741881_100000211182 [1,0,0,1,0,0|2,0,0]=4 29128 B14R2.9593 CN(Cc1ccccc1)CC2CC2 270004a_100000741881_100015611070 [1,0,0,1,0,0|2,0,0]=4 29129 B14R2.9593 CN(Cc1ccccc1)CC2CC2 34a_100000186374_200000210301 [1,0,0,1,0,0|2,0,0]=4 29130 B14R2.9593 O=C(CC1CC1)C[n+]2ccccc2 1458a_200000086051_100000742324 [1,0,0,1,0,0|1,0,0]=3 29131 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 11a_100000106764_100000738066 [1,0,0,1,0,0|1,0,0]=3 29132 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 1626a_100000106764_100000738066 [1,0,0,1,0,0|1,0,0]=3 29133 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 22a_100000106764_100000738066 [1,0,0,1,0,0|1,0,0]=3 29134 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 527a_100000106764_100000738066 [1,0,0,1,0,0|1,0,0]=3 29135 B14R2.9593 O=C(CC1CO1)C[n+]2ccccc2 1458a_200000086051_100011216344 [1,0,0,1,0,0|2,0,0]=4 29136 B14R2.9593 O=C(CC1CS1)C[n+]2ccccc2 1458a_200000086051_100000031435 [1,0,0,1,0,0|2,0,0]=4 29137 B14R2.9593 O=C(C[C@@H]1CO1)C[n+]2ccccc2 1458a_200000086051_100000745022 [1,0,0,1,0,0|2,0,0]=4 29138 B14R2.9593 O=C(C[n+]1ccccc1)NC2CC2 240690a_100000212008_200000086051 [1,0,0,1,0,0|2,0,0]=4 29139 B14R2.9593 O=C(C[n+]1ccccc1)NC2CC2 527a_100000212008_200000086051 [1,0,0,1,0,0|2,0,0]=4 29140 B14R2.9593 O=C(Cc1ccccc1)CC2CC2 1458a_100000738066_100015291786 [1,0,0,1,0,0|0,0,0]=2 29141 B14R2.9593 O=C(Cc1ccccn1)CC2CC2 1458a_100000233486_100000742324 [1,0,0,1,0,0|1,0,0]=3 29142 B14R2.9593 O=C(Cc1ccccn1)CC2CC2 1458a_100000738066_100000721315 [1,0,0,1,0,0|1,0,0]=3 29143 B14R2.9593 O=C(Cc1ccccn1)CC2CO2 1458a_100000233486_100011216344 [1,0,0,1,0,0|2,0,0]=4 29144 B14R2.9593 O=C(Cc1ccccn1)CC2CS2 1458a_100000233486_100000031435 [1,0,0,1,0,0|2,0,0]=4 29145 B14R2.9593 O=C(Cc1ccccn1)C[C@@H]2CO2 1458a_100000233486_100000745022 [1,0,0,1,0,0|2,0,0]=4 29146 B14R2.9593 O=C(Cc1cccnc1)CC2CC2 1458a_100000737805_100000742324 [1,0,0,1,0,0|1,0,0]=3 29147 B14R2.9593 O=C(Cc1cccnc1)CC2CC2 1458a_100000738066_100000733263 [1,0,0,1,0,0|1,0,0]=3 29148 B14R2.9593 O=C(Cc1cccnc1)CC2CO2 1458a_100000737805_100011216344 [1,0,0,1,0,0|2,0,0]=4 29149 B14R2.9593 O=C(Cc1cccnc1)CC2CS2 1458a_100000737805_100000031435 [1,0,0,1,0,0|2,0,0]=4 29150 B14R2.9593 O=C(Cc1cccnc1)C[C@@H]2CO2 1458a_100000737805_100000745022 [1,0,0,1,0,0|2,0,0]=4 29151 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 240690a_100000212008_100000737805 [1,0,0,1,0,0|2,0,0]=4 29152 B14R2.9593 O=C(Cc1cccnc1)NC2CC2 527a_100000212008_100000737805 [1,0,0,1,0,0|2,0,0]=4 29153 B14R2.9593 O=C(Cc1cccnn1)CC2CC2 1458a_100000738066_100016990269 [1,0,0,1,0,0|2,0,0]=4 29154 B14R2.9593 O=C(Cc1ccncc1)CC2CC2 1458a_100000738066_100000705612 [1,0,0,1,0,0|1,0,0]=3 29155 B14R2.9593 O=C(Cc1ccncc1)NC2CC2 240690a_100000212008_100011201483 [1,0,0,1,0,0|2,0,0]=4 29156 B14R2.9593 O=C(Cc1cnccn1)CC2CC2 1458a_100000738066_100016995436 [1,0,0,1,0,0|2,0,0]=4 29157 B14R2.9593 O=C(Cc1cncnc1)CC2CC2 1458a_100000721575_100000742324 [1,0,0,1,0,0|2,0,0]=4 29158 B14R2.9593 O=C(Cc1cncnc1)CC2CC2 1458a_100000738066_100015196519 [1,0,0,1,0,0|2,0,0]=4 29159 B14R2.9593 O=C(Cc1ncccn1)CC2CC2 1458a_100000738066_100000703007 [1,0,0,1,0,0|2,0,0]=4 29160 B14R2.9593 O=C(Nc1ccccc1)NC2CC2 2430a_100000106764_100000212008 [1,0,0,1,0,0|2,0,0]=4 29161 B14R2.9593 [13CH3]N(Cc1ccccc1)CC2CC2 2230a_100000186374_200025704644 [1,0,0,1,0,0|2,0,0]=4 29162 B14R2.9593 [13CH3]N(Cc1ccccc1)CC2CC2 269982a_100000186374_200025704644 [1,0,0,1,0,0|2,0,0]=4 29163 B14R2.9593 [13CH3]N(Cc1ccccc1)CC2CC2 34a_100000186374_200025704644 [1,0,0,1,0,0|2,0,0]=4 29164 B14R2.114 O=C(c1ccccc1)C2CCCC2 1458a_100000185807_100000179811 [0,0,0,1,1,0|1,0,0]=3 29165 B14R2.114 O=C(c1ccccc1)C2CCOC2 1458a_100000185807_100000690089 [0,0,0,1,1,0|2,0,0]=4 29166 B14R2.114 O=C(c1ccccc1)N2CCCC2 240690a_100000188435_100000185807 [0,0,0,1,1,0|1,0,0]=3 29167 B14R2.114 O=C(c1ccccc1)N2CCCC2 527a_100000188435_100000185807 [0,0,0,1,1,0|1,0,0]=3 29168 B14R2.114 O=C(c1ccccc1)N2CCSC2 11a_100011215254_100000185807 [0,0,0,1,1,0|2,0,0]=4 29169 B14R2.114 O=C(c1ccccc1)N2CCSC2 240690a_100011215254_100000185807 [0,0,0,1,1,0|2,0,0]=4 29170 B14R2.114 O=C(c1ccccc1)N2CCSC2 527a_100011215254_100000185807 [0,0,0,1,1,0|2,0,0]=4 29171 B14R2.335 CC1CCN1C(=O)c2ccccc2 11a_100000755817_100000185807 [0,0,0,1,1,0|1,0,0]=3 29172 B14R2.335 CC1CCN1C(=O)c2ccccc2 240690a_100000755817_100000185807 [0,0,0,1,1,0|1,0,0]=3 29173 B14R2.335 CC1CCN1C(=O)c2ccccc2 527a_100000755817_100000185807 [0,0,0,1,1,0|1,0,0]=3 29174 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 240690a_100015190264_100000185807 [0,0,0,1,1,0|2,0,0]=4 29175 B14R2.352 O=C(N[C@@H]1C[C@@H]1F)c2ccccc2 527a_100015190264_100000185807 [0,0,0,1,1,0|2,0,0]=4 29176 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 11a_100025746932_100000185807 [0,0,0,1,1,0|2,0,0]=4 29177 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 1626a_100025746932_100000185807 [0,0,0,1,1,0|2,0,0]=4 29178 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 240690a_100025746932_100000185807 [0,0,0,1,1,0|2,0,0]=4 29179 B14R2.352 O=C(N[C@@H]1C[C@H]1F)c2ccccc2 527a_100025746932_100000185807 [0,0,0,1,1,0|2,0,0]=4 29180 B14R2.510 CCNC1CC(=O)c2c1cccc2 2230a_100015525214_100010208147 [0,0,0,1,1,0|2,0,0]=4 29181 B14R2.510 CCNC1OC(=O)c2c1cccc2 2230a_100015525214_100009813457 [0,0,0,1,1,0|1,0,0]=3 29182 B14R2.510 CCSC1CC(=O)c2c1cccc2 62a_100000210202_100010208147 [0,0,0,1,1,0|2,0,0]=4 29183 B14R2.510 CCSC1CC(=O)c2c1cccc2 62a_100010208147_100000210202 [0,0,0,1,1,0|2,0,0]=4 29184 B14R2.510 CCSC1OC(=O)c2c1cccc2 62a_100000210202_100009813457 [0,0,0,1,1,0|1,0,0]=3 29185 B14R2.510 O=C1OC(c2c1cccc2)SCF 62a_100015361967_100009813457 [0,0,0,1,1,0|2,0,0]=4 29186 B14R2.792 CC(OCC1CC1)c2ccccc2 34a_100000211283_100000211855 [0,0,0,1,1,0|1,0,1]=4 29187 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 34a_100000761318_100000742324 [0,0,0,1,1,0|1,0,1]=4 29188 B14R2.792 C[C@@H](OCC1CC1)c2ccccc2 7a_100000761318_100000742324 [0,0,0,1,1,0|1,0,1]=4 29189 B14R2.792 O=C(CCC1CC1)c2ccccc2 1458a_100000185807_100000694398 [0,0,0,1,1,0|1,0,0]=3 29190 B14R2.792 O=C(CCC1CO1)c2ccccc2 1458a_100000185807_100000732470 [0,0,0,1,1,0|2,0,0]=4 29191 B14R2.792 O=C(CSC1CC1)c2ccccc2 62a_100000211460_100000211595 [0,0,0,1,1,0|2,0,0]=4 29192 B14R2.792 O=C(NCC1CC1)c2ccccc2 11a_100000735609_100000185807 [0,0,0,1,1,0|1,0,0]=3 29193 B14R2.792 O=C(NCC1CC1)c2ccccc2 1626a_100000735609_100000185807 [0,0,0,1,1,0|1,0,0]=3 29194 B14R2.792 O=C(NCC1CC1)c2ccccc2 240690a_100000735609_100000185807 [0,0,0,1,1,0|1,0,0]=3 29195 B14R2.792 O=C(NCC1CC1)c2ccccc2 527a_100000735609_100000185807 [0,0,0,1,1,0|1,0,0]=3 29196 B14R2.792 O=C(NNC1CC1)c2ccccc2 22a_100000701032_100000185807 [0,0,0,1,1,0|2,0,0]=4 29197 B14R2.794 CC(OC1CCC1)c2ccccc2 34a_100000748187_100000211855 [0,0,0,1,1,0|1,0,1]=4 29198 B14R2.794 C[C@@H](OC1CCC1)c2ccccc2 34a_100000761318_100000749161 [0,0,0,1,1,0|1,0,1]=4 29199 B14R2.794 O=C(CC1CCC1)c2ccccc2 1458a_100000185807_100000763275 [0,0,0,1,1,0|1,0,0]=3 29200 B14R2.794 O=C(CC1CCO1)c2ccccc2 1458a_100000185807_100000103362 [0,0,0,1,1,0|2,0,0]=4 29201 B14R2.794 O=C(CC1COC1)c2ccccc2 1458a_100000185807_100010264016 [0,0,0,1,1,0|2,0,0]=4 29202 B14R2.794 O=C(CN1CCC1)c2ccccc2 269982a_100000754969_100000211460 [0,0,0,1,1,0|2,0,0]=4 29203 B14R2.794 O=C(NC1CCC1)c2ccccc2 11a_100000749019_100000185807 [0,0,0,1,1,0|1,0,0]=3 29204 B14R2.794 O=C(NC1CCC1)c2ccccc2 1626a_100000749019_100000185807 [0,0,0,1,1,0|1,0,0]=3 29205 B14R2.794 O=C(NC1CCC1)c2ccccc2 240690a_100000749019_100000185807 [0,0,0,1,1,0|1,0,0]=3 29206 B14R2.794 O=C(NC1CCC1)c2ccccc2 527a_100000749019_100000185807 [0,0,0,1,1,0|1,0,0]=3 29207 B14R2.794 O=C(NC1COC1)c2ccccc2 11a_100016991112_100000185807 [0,0,0,1,1,0|2,0,0]=4 29208 B14R2.794 O=C(NC1COC1)c2ccccc2 1626a_100016991112_100000185807 [0,0,0,1,1,0|2,0,0]=4 29209 B14R2.794 O=C(NC1COC1)c2ccccc2 240690a_100016991112_100000185807 [0,0,0,1,1,0|2,0,0]=4 29210 B14R2.794 O=C(NC1COC1)c2ccccc2 527a_100016991112_100000185807 [0,0,0,1,1,0|2,0,0]=4 29211 B14R2.794 O=C(NC1CSC1)c2ccccc2 11a_100016994217_100000185807 [0,0,0,1,1,0|2,0,0]=4 29212 B14R2.794 O=C(NC1CSC1)c2ccccc2 1626a_100016994217_100000185807 [0,0,0,1,1,0|2,0,0]=4 29213 B14R2.794 O=C(NC1CSC1)c2ccccc2 240690a_100016994217_100000185807 [0,0,0,1,1,0|2,0,0]=4 29214 B14R2.794 O=C(NC1CSC1)c2ccccc2 527a_100016994217_100000185807 [0,0,0,1,1,0|2,0,0]=4 29215 B14R2.1131 COC1CCC(=O)c2c1cccc2 7a_100000100557_200000210301 [0,0,0,1,1,0|2,0,0]=4 29216 B14R2.1131 [13CH3]OC1CCC(=O)c2c1cccc2 7a_100000100557_200025704644 [0,0,0,1,1,0|2,0,0]=4 29217 B14R2.731 CC1CCN1C(=O)Cc2ccc[nH]2 11a_100000755817_100000238377 [0,0,0,1,1,0|2,0,0]=4 29218 B14R2.731 CC1CCN1C(=O)Cc2ccc[nH]2 240690a_100000755817_100000238377 [0,0,0,1,1,0|2,0,0]=4 29219 B14R2.731 CC1CCN1C(=O)Cc2ccc[nH]2 527a_100000755817_100000238377 [0,0,0,1,1,0|2,0,0]=4 29220 B14R2.731 CC1CCN1C(=O)Cc2ccco2 11a_100000755817_100011217309 [0,0,0,1,1,0|2,0,0]=4 29221 B14R2.731 CC1CCN1C(=O)Cc2ccco2 527a_100000755817_100011217309 [0,0,0,1,1,0|2,0,0]=4 29222 B14R2.731 CC1CCN1C(=O)Cc2cccs2 11a_100000755817_100000210189 [0,0,0,1,1,0|2,0,0]=4 29223 B14R2.731 CC1CCN1C(=O)Cc2cccs2 240690a_100000755817_100000210189 [0,0,0,1,1,0|2,0,0]=4 29224 B14R2.731 CC1CCN1C(=O)Cc2ccoc2 11a_100000755817_100000684892 [0,0,0,1,1,0|2,0,0]=4 29225 B14R2.731 CC1CCN1C(=O)Cc2ccoc2 240690a_100000755817_100000684892 [0,0,0,1,1,0|2,0,0]=4 29226 B14R2.731 CC1CCN1C(=O)Cc2ccoc2 527a_100000755817_100000684892 [0,0,0,1,1,0|2,0,0]=4 29227 B14R2.731 CC1CCN1C(=O)Cc2ccsc2 11a_100000755817_100000184062 [0,0,0,1,1,0|2,0,0]=4 29228 B14R2.731 CC1CCN1C(=O)Cc2ccsc2 240690a_100000755817_100000184062 [0,0,0,1,1,0|2,0,0]=4 29229 B14R2.731 CC1CCN1C(=O)Cc2ccsc2 527a_100000755817_100000184062 [0,0,0,1,1,0|2,0,0]=4 29230 B14R2.731 CC1CCN1C(=O)Cn2cccc2 11a_100000755817_100011196272 [0,0,0,1,1,0|2,0,0]=4 29231 B14R2.731 CC1CCN1C(=O)Cn2cccc2 527a_100000755817_100011196272 [0,0,0,1,1,0|2,0,0]=4 29232 B14R2.793 O=C(Cc1ccc[nH]1)C2CCCC2 1458a_100000238377_100000179811 [0,0,0,1,1,0|2,0,0]=4 29233 B14R2.793 O=C(Cc1ccc[nH]1)N2CCCC2 240690a_100000188435_100000238377 [0,0,0,1,1,0|2,0,0]=4 29234 B14R2.793 O=C(Cc1ccc[nH]1)N2CCCC2 527a_100000188435_100000238377 [0,0,0,1,1,0|2,0,0]=4 29235 B14R2.793 O=C(Cc1ccco1)C2CCCC2 1458a_100011217309_100000179811 [0,0,0,1,1,0|2,0,0]=4 29236 B14R2.793 O=C(Cc1ccco1)N2CCCC2 527a_100000188435_100011217309 [0,0,0,1,1,0|2,0,0]=4 29237 B14R2.793 O=C(Cc1cccs1)C2CCCC2 1458a_100000210189_100000179811 [0,0,0,1,1,0|2,0,0]=4 29238 B14R2.793 O=C(Cc1cccs1)N2CCCC2 240690a_100000188435_100000210189 [0,0,0,1,1,0|2,0,0]=4 29239 B14R2.793 O=C(Cc1ccoc1)C2CCCC2 1458a_100000684892_100000179811 [0,0,0,1,1,0|2,0,0]=4 29240 B14R2.793 O=C(Cc1ccoc1)N2CCCC2 240690a_100000188435_100000684892 [0,0,0,1,1,0|2,0,0]=4 29241 B14R2.793 O=C(Cc1ccoc1)N2CCCC2 527a_100000188435_100000684892 [0,0,0,1,1,0|2,0,0]=4 29242 B14R2.793 O=C(Cc1ccsc1)C2CCCC2 1458a_100000184062_100000179811 [0,0,0,1,1,0|2,0,0]=4 29243 B14R2.793 O=C(Cc1ccsc1)C2CCCC2 1458a_100000210718_100011233845 [0,0,0,1,1,0|2,0,0]=4 29244 B14R2.793 O=C(Cc1ccsc1)N2CCCC2 240690a_100000188435_100000184062 [0,0,0,1,1,0|2,0,0]=4 29245 B14R2.793 O=C(Cc1ccsc1)N2CCCC2 527a_100000188435_100000184062 [0,0,0,1,1,0|2,0,0]=4 29246 B14R2.793 O=C(Cn1cccc1)C2CCCC2 1458a_100011196272_100000179811 [0,0,0,1,1,0|2,0,0]=4 29247 B14R2.793 O=C(Cn1cccc1)N2CCCC2 527a_100000188435_100011196272 [0,0,0,1,1,0|2,0,0]=4 29248 B14R2.1046 CCC1CC1C(=O)Cc2ccsc2 1458a_200011661523_100011233845 [0,0,0,1,1,0|2,0,0]=4 29249 B14R2.9599 O=C(CCC1CC1)Cc2ccc[nH]2 1458a_100000238377_100000694398 [0,0,0,1,1,0|2,0,0]=4 29250 B14R2.9599 O=C(CCC1CC1)Cc2ccco2 1458a_100011217309_100000694398 [0,0,0,1,1,0|2,0,0]=4 29251 B14R2.9599 O=C(CCC1CC1)Cc2cccs2 1458a_100000210189_100000694398 [0,0,0,1,1,0|2,0,0]=4 29252 B14R2.9599 O=C(CCC1CC1)Cc2ccoc2 1458a_100000684892_100000694398 [0,0,0,1,1,0|2,0,0]=4 29253 B14R2.9599 O=C(CCC1CC1)Cc2ccsc2 1458a_100000184062_100000694398 [0,0,0,1,1,0|2,0,0]=4 29254 B14R2.9599 O=C(CCC1CC1)Cc2ccsc2 1458a_100000756386_100011233845 [0,0,0,1,1,0|2,0,0]=4 29255 B14R2.9599 O=C(CCC1CC1)Cn2cccc2 1458a_100011196272_100000694398 [0,0,0,1,1,0|2,0,0]=4 29256 B14R2.9599 O=C(Cc1ccc[nH]1)NCC2CC2 11a_100000735609_100000238377 [0,0,0,1,1,0|2,0,0]=4 29257 B14R2.9599 O=C(Cc1ccc[nH]1)NCC2CC2 240690a_100000735609_100000238377 [0,0,0,1,1,0|2,0,0]=4 29258 B14R2.9599 O=C(Cc1ccc[nH]1)NCC2CC2 527a_100000735609_100000238377 [0,0,0,1,1,0|2,0,0]=4 29259 B14R2.9599 O=C(Cc1ccco1)NCC2CC2 11a_100000735609_100011217309 [0,0,0,1,1,0|2,0,0]=4 29260 B14R2.9599 O=C(Cc1ccco1)NCC2CC2 527a_100000735609_100011217309 [0,0,0,1,1,0|2,0,0]=4 29261 B14R2.9599 O=C(Cc1cccs1)NCC2CC2 11a_100000735609_100000210189 [0,0,0,1,1,0|2,0,0]=4 29262 B14R2.9599 O=C(Cc1cccs1)NCC2CC2 1626a_100000735609_100000210189 [0,0,0,1,1,0|2,0,0]=4 29263 B14R2.9599 O=C(Cc1cccs1)NCC2CC2 240690a_100000735609_100000210189 [0,0,0,1,1,0|2,0,0]=4 29264 B14R2.9599 O=C(Cc1ccoc1)NCC2CC2 11a_100000735609_100000684892 [0,0,0,1,1,0|2,0,0]=4 29265 B14R2.9599 O=C(Cc1ccoc1)NCC2CC2 1626a_100000735609_100000684892 [0,0,0,1,1,0|2,0,0]=4 29266 B14R2.9599 O=C(Cc1ccoc1)NCC2CC2 240690a_100000735609_100000684892 [0,0,0,1,1,0|2,0,0]=4 29267 B14R2.9599 O=C(Cc1ccoc1)NCC2CC2 527a_100000735609_100000684892 [0,0,0,1,1,0|2,0,0]=4 29268 B14R2.9599 O=C(Cc1ccsc1)NCC2CC2 11a_100000735609_100000184062 [0,0,0,1,1,0|2,0,0]=4 29269 B14R2.9599 O=C(Cc1ccsc1)NCC2CC2 1626a_100000735609_100000184062 [0,0,0,1,1,0|2,0,0]=4 29270 B14R2.9599 O=C(Cc1ccsc1)NCC2CC2 240690a_100000735609_100000184062 [0,0,0,1,1,0|2,0,0]=4 29271 B14R2.9599 O=C(Cc1ccsc1)NCC2CC2 527a_100000735609_100000184062 [0,0,0,1,1,0|2,0,0]=4 29272 B14R2.9599 O=C(Cn1cccc1)NCC2CC2 11a_100000735609_100011196272 [0,0,0,1,1,0|2,0,0]=4 29273 B14R2.9599 O=C(Cn1cccc1)NCC2CC2 1626a_100000735609_100011196272 [0,0,0,1,1,0|2,0,0]=4 29274 B14R2.9599 O=C(Cn1cccc1)NCC2CC2 527a_100000735609_100011196272 [0,0,0,1,1,0|2,0,0]=4 29275 B14R2.31918 O=C(CC1CCC1)Cn2cccc2 1458a_100011196272_100000763275 [0,0,0,1,1,0|2,0,0]=4 29276 B14R2.31918 O=C(Cc1ccc[nH]1)CC2CCC2 1458a_100000238377_100000763275 [0,0,0,1,1,0|2,0,0]=4 29277 B14R2.31918 O=C(Cc1ccc[nH]1)NC2CCC2 11a_100000749019_100000238377 [0,0,0,1,1,0|2,0,0]=4 29278 B14R2.31918 O=C(Cc1ccc[nH]1)NC2CCC2 240690a_100000749019_100000238377 [0,0,0,1,1,0|2,0,0]=4 29279 B14R2.31918 O=C(Cc1ccc[nH]1)NC2CCC2 527a_100000749019_100000238377 [0,0,0,1,1,0|2,0,0]=4 29280 B14R2.31918 O=C(Cc1ccco1)CC2CCC2 1458a_100011217309_100000763275 [0,0,0,1,1,0|2,0,0]=4 29281 B14R2.31918 O=C(Cc1ccco1)NC2CCC2 11a_100000749019_100011217309 [0,0,0,1,1,0|2,0,0]=4 29282 B14R2.31918 O=C(Cc1ccco1)NC2CCC2 527a_100000749019_100011217309 [0,0,0,1,1,0|2,0,0]=4 29283 B14R2.31918 O=C(Cc1cccs1)CC2CCC2 1458a_100000210189_100000763275 [0,0,0,1,1,0|2,0,0]=4 29284 B14R2.31918 O=C(Cc1cccs1)NC2CCC2 11a_100000749019_100000210189 [0,0,0,1,1,0|2,0,0]=4 29285 B14R2.31918 O=C(Cc1cccs1)NC2CCC2 1626a_100000749019_100000210189 [0,0,0,1,1,0|2,0,0]=4 29286 B14R2.31918 O=C(Cc1cccs1)NC2CCC2 240690a_100000749019_100000210189 [0,0,0,1,1,0|2,0,0]=4 29287 B14R2.31918 O=C(Cc1ccoc1)CC2CCC2 1458a_100000684892_100000763275 [0,0,0,1,1,0|2,0,0]=4 29288 B14R2.31918 O=C(Cc1ccoc1)NC2CCC2 11a_100000749019_100000684892 [0,0,0,1,1,0|2,0,0]=4 29289 B14R2.31918 O=C(Cc1ccoc1)NC2CCC2 1626a_100000749019_100000684892 [0,0,0,1,1,0|2,0,0]=4 29290 B14R2.31918 O=C(Cc1ccoc1)NC2CCC2 240690a_100000749019_100000684892 [0,0,0,1,1,0|2,0,0]=4 29291 B14R2.31918 O=C(Cc1ccoc1)NC2CCC2 527a_100000749019_100000684892 [0,0,0,1,1,0|2,0,0]=4 29292 B14R2.31918 O=C(Cc1ccsc1)CC2CCC2 1458a_100000184062_100000763275 [0,0,0,1,1,0|2,0,0]=4 29293 B14R2.31918 O=C(Cc1ccsc1)CC2CCC2 1458a_100000763092_100011233845 [0,0,0,1,1,0|2,0,0]=4 29294 B14R2.31918 O=C(Cc1ccsc1)NC2CCC2 11a_100000749019_100000184062 [0,0,0,1,1,0|2,0,0]=4 29295 B14R2.31918 O=C(Cc1ccsc1)NC2CCC2 1626a_100000749019_100000184062 [0,0,0,1,1,0|2,0,0]=4 29296 B14R2.31918 O=C(Cc1ccsc1)NC2CCC2 240690a_100000749019_100000184062 [0,0,0,1,1,0|2,0,0]=4 29297 B14R2.31918 O=C(Cc1ccsc1)NC2CCC2 527a_100000749019_100000184062 [0,0,0,1,1,0|2,0,0]=4 29298 B14R2.31918 O=C(Cn1cccc1)NC2CCC2 11a_100000749019_100011196272 [0,0,0,1,1,0|2,0,0]=4 29299 B14R2.31918 O=C(Cn1cccc1)NC2CCC2 1626a_100000749019_100011196272 [0,0,0,1,1,0|2,0,0]=4 29300 B14R2.31918 O=C(Cn1cccc1)NC2CCC2 527a_100000749019_100011196272 [0,0,0,1,1,0|2,0,0]=4 29301 B16R2.69 O=C1CCCCCC1Oc2ccccc2 7a_100000210340_100000243696 [0,0,0,1,0,1|1,0,0]=3 29302 B16R2.69 O=C1CCCCCC1Oc2cccnc2 7a_100000210849_100000243696 [0,0,0,1,0,1|2,0,0]=4 29303 B16R2.69 O=C1CCCCCC1Sc2ccccc2 62a_100000243696_100000041952 [0,0,0,1,0,1|1,0,0]=3 29304 B16R2.69 O=C1CCCCCC1Sc2ccccc2 62a_100000719477_100000243696 [0,0,0,1,0,1|1,0,0]=3 29305 B16R2.69 O=C1CCCCCC1Sc2ccccn2 62a_100000243696_100011216584 [0,0,0,1,0,1|2,0,0]=4 29306 B16R2.69 O=C1CCCCCC1Sc2ccccn2 62a_100011216584_100000243696 [0,0,0,1,0,1|2,0,0]=4 29307 B16R2.69 O=C1CCCCCC1Sc2cccnc2 62a_100000210063_100000243696 [0,0,0,1,0,1|2,0,0]=4 29308 B16R2.69 O=C1CCCCCC1Sc2cccnc2 62a_100000243696_100000210063 [0,0,0,1,0,1|2,0,0]=4 29309 B16R2.69 O=C1CCCCCC1Sc2ccncc2 62a_100000243696_100000728582 [0,0,0,1,0,1|2,0,0]=4 29310 B16R2.69 O=C1CCCCCC1Sc2ccncc2 62a_100000728582_100000243696 [0,0,0,1,0,1|2,0,0]=4 29311 B16R2.69 O=C1NCCCCC1Oc2ccccc2 7a_100000210340_100000735217 [0,0,0,1,0,1|1,0,0]=3 29312 B16R2.69 O=C1NCCCCC1Oc2cccnc2 7a_100000210849_100000735217 [0,0,0,1,0,1|2,0,0]=4 29313 B16R2.69 O=C1NCCCCC1Sc2ccccc2 62a_100000719477_100000735217 [0,0,0,1,0,1|1,0,0]=3 29314 B16R2.69 O=C1NCCCCC1Sc2ccccc2 62a_100000735217_100000041952 [0,0,0,1,0,1|1,0,0]=3 29315 B16R2.69 O=C1NCCCCC1Sc2ccccn2 62a_100000735217_100011216584 [0,0,0,1,0,1|2,0,0]=4 29316 B16R2.69 O=C1NCCCCC1Sc2ccccn2 62a_100011216584_100000735217 [0,0,0,1,0,1|2,0,0]=4 29317 B16R2.69 O=C1NCCCCC1Sc2cccnc2 62a_100000210063_100000735217 [0,0,0,1,0,1|2,0,0]=4 29318 B16R2.69 O=C1NCCCCC1Sc2cccnc2 62a_100000735217_100000210063 [0,0,0,1,0,1|2,0,0]=4 29319 B16R2.69 O=C1NCCCCC1Sc2ccncc2 62a_100000728582_100000735217 [0,0,0,1,0,1|2,0,0]=4 29320 B16R2.69 O=C1NCCCCC1Sc2ccncc2 62a_100000735217_100000728582 [0,0,0,1,0,1|2,0,0]=4 29321 B16R2.296 CC1CCN1C(=O)C#Cc2ccccc2 240690a_100000755817_100000736102 [0,0,0,1,0,1|1,0,1]=4 29322 B16R2.296 CC1CCN1C(=O)C=Cc2ccccc2 11a_100000755817_100000210462 [0,0,0,1,0,1|1,0,1]=4 29323 B16R2.296 CC1CCN1C(=O)CCc2ccccc2 11a_100000755817_100000185753 [0,0,0,1,0,1|1,0,0]=3 29324 B16R2.296 CC1CCN1C(=O)CCc2ccccc2 240690a_100000755817_100000185753 [0,0,0,1,0,1|1,0,0]=3 29325 B16R2.296 CC1CCN1C(=O)CCc2ccccc2 527a_100000755817_100000185753 [0,0,0,1,0,1|1,0,0]=3 29326 B16R2.296 CC1CCN1C(=O)CCc2ccccn2 11a_100000755817_100015195070 [0,0,0,1,0,1|2,0,0]=4 29327 B16R2.296 CC1CCN1C(=O)CCc2ccccn2 240690a_100000755817_100015195070 [0,0,0,1,0,1|2,0,0]=4 29328 B16R2.296 CC1CCN1C(=O)CCc2ccccn2 527a_100000755817_100015195070 [0,0,0,1,0,1|2,0,0]=4 29329 B16R2.296 CC1CCN1C(=O)CCc2cccnc2 11a_100000755817_100000198484 [0,0,0,1,0,1|2,0,0]=4 29330 B16R2.296 CC1CCN1C(=O)CCc2cccnc2 240690a_100000755817_100000198484 [0,0,0,1,0,1|2,0,0]=4 29331 B16R2.296 CC1CCN1C(=O)CCc2cccnc2 527a_100000755817_100000198484 [0,0,0,1,0,1|2,0,0]=4 29332 B16R2.296 CC1CCN1C(=O)CCc2ccncc2 11a_100000755817_100011225043 [0,0,0,1,0,1|2,0,0]=4 29333 B16R2.296 CC1CCN1C(=O)CCc2ccncc2 240690a_100000755817_100011225043 [0,0,0,1,0,1|2,0,0]=4 29334 B16R2.296 CC1CCN1C(=O)CCc2ccncc2 527a_100000755817_100011225043 [0,0,0,1,0,1|2,0,0]=4 29335 B16R2.296 CC1CCN1C(=O)COc2ccccc2 11a_100000755817_100000186222 [0,0,0,1,0,1|1,0,0]=3 29336 B16R2.296 CC1CCN1C(=O)COc2ccccc2 240690a_100000755817_100000186222 [0,0,0,1,0,1|1,0,0]=3 29337 B16R2.296 CC1CCN1C(=O)COc2ccccc2 527a_100000755817_100000186222 [0,0,0,1,0,1|1,0,0]=3 29338 B16R2.296 CC1CCN1C(=O)COc2ccccn2 240690a_100000755817_100102699861 [0,0,0,1,0,1|2,0,0]=4 29339 B16R2.296 CC1CCN1C(=O)COc2ccccn2 527a_100000755817_100102699861 [0,0,0,1,0,1|2,0,0]=4 29340 B16R2.296 CC1CCN1C(=O)COc2cccnc2 11a_100000755817_100015207166 [0,0,0,1,0,1|2,0,0]=4 29341 B16R2.296 CC1CCN1C(=O)COc2cccnc2 240690a_100000755817_100015207166 [0,0,0,1,0,1|2,0,0]=4 29342 B16R2.296 CC1CCN1C(=O)COc2cccnc2 527a_100000755817_100015207166 [0,0,0,1,0,1|2,0,0]=4 29343 B16R2.296 CC1CCN1C(=O)CSc2ccccc2 11a_100000755817_100000211596 [0,0,0,1,0,1|1,0,0]=3 29344 B16R2.296 CC1CCN1C(=O)CSc2ccccc2 240690a_100000755817_100000211596 [0,0,0,1,0,1|1,0,0]=3 29345 B16R2.296 CC1CCN1C(=O)CSc2ccccc2 527a_100000755817_100000211596 [0,0,0,1,0,1|1,0,0]=3 29346 B16R2.296 CC1CCN1C(=O)CSc2ccccn2 11a_100000755817_100000156281 [0,0,0,1,0,1|2,0,0]=4 29347 B16R2.296 CC1CCN1C(=O)CSc2ccccn2 240690a_100000755817_100000156281 [0,0,0,1,0,1|2,0,0]=4 29348 B16R2.296 CC1CCN1C(=O)CSc2ccccn2 527a_100000755817_100000156281 [0,0,0,1,0,1|2,0,0]=4 29349 B16R2.296 CC1CCN1C(=O)CSc2ccncc2 11a_100000755817_100000211328 [0,0,0,1,0,1|2,0,0]=4 29350 B16R2.296 CC1CCN1C(=O)CSc2ccncc2 240690a_100000755817_100000211328 [0,0,0,1,0,1|2,0,0]=4 29351 B16R2.296 CC1CCN1C(=O)CSc2ccncc2 527a_100000755817_100000211328 [0,0,0,1,0,1|2,0,0]=4 29352 B16R2.296 CC1CCN1C(=O)NCc2ccccc2 2708a_100015324214_100000755817 [0,0,0,1,0,1|1,0,0]=3 29353 B16R2.296 CC1CCN1C(=O)NCc2ccccc2 273464a_100015324214_100000755817 [0,0,0,1,0,1|1,0,0]=3 29354 B16R2.296 CC1CCN1C(=O)NCc2ccccn2 2708a_100000210449_100000755817 [0,0,0,1,0,1|2,0,0]=4 29355 B16R2.296 CC1CCN1C(=O)NCc2ccccn2 273464a_100000210449_100000755817 [0,0,0,1,0,1|2,0,0]=4 29356 B16R2.296 CC1CCN1C(=O)NCc2cccnc2 2708a_100000210453_100000755817 [0,0,0,1,0,1|2,0,0]=4 29357 B16R2.296 CC1CCN1C(=O)NCc2cccnc2 273464a_100000210453_100000755817 [0,0,0,1,0,1|2,0,0]=4 29358 B16R2.296 CC1CCN1C(=O)NCc2ccncc2 2708a_100000210450_100000755817 [0,0,0,1,0,1|2,0,0]=4 29359 B16R2.296 CC1CCN1C(=O)NCc2ccncc2 273464a_100000210450_100000755817 [0,0,0,1,0,1|2,0,0]=4 29360 B16R2.1443 CCC1CC1C(=O)CCc2ccccc2 1458a_200011661523_100000765856 [0,0,0,1,0,1|1,0,0]=3 29361 B16R2.1443 CCC1CC1C(=O)CCc2ccccn2 1458a_200011661523_100015183660 [0,0,0,1,0,1|2,0,0]=4 29362 B16R2.1443 CCC1CC1C(=O)CCc2cccnc2 1458a_200011661523_200011713674 [0,0,0,1,0,1|2,0,0]=4 29363 B16R2.1443 CCC1CC1C(=O)CCc2ccncc2 1458a_200011661523_100000723409 [0,0,0,1,0,1|2,0,0]=4 29364 B16R2.1443 CCC1CC1C(=O)NCc2ccccc2 11a_100015324214_200011661523 [0,0,0,1,0,1|1,0,0]=3 29365 B16R2.1443 CCC1CC1C(=O)NCc2ccccc2 1626a_100015324214_200011661523 [0,0,0,1,0,1|1,0,0]=3 29366 B16R2.1443 CCC1CC1C(=O)NCc2ccccc2 240690a_100015324214_200011661523 [0,0,0,1,0,1|1,0,0]=3 29367 B16R2.1443 CCC1CC1C(=O)NCc2ccccc2 527a_100015324214_200011661523 [0,0,0,1,0,1|1,0,0]=3 29368 B16R2.1443 CCC1CC1C(=O)NCc2ccccn2 11a_100000210449_200011661523 [0,0,0,1,0,1|2,0,0]=4 29369 B16R2.1443 CCC1CC1C(=O)NCc2ccccn2 1626a_100000210449_200011661523 [0,0,0,1,0,1|2,0,0]=4 29370 B16R2.1443 CCC1CC1C(=O)NCc2ccccn2 240690a_100000210449_200011661523 [0,0,0,1,0,1|2,0,0]=4 29371 B16R2.1443 CCC1CC1C(=O)NCc2ccccn2 527a_100000210449_200011661523 [0,0,0,1,0,1|2,0,0]=4 29372 B16R2.1443 CCC1CC1C(=O)NCc2cccnc2 11a_100000210453_200011661523 [0,0,0,1,0,1|2,0,0]=4 29373 B16R2.1443 CCC1CC1C(=O)NCc2cccnc2 240690a_100000210453_200011661523 [0,0,0,1,0,1|2,0,0]=4 29374 B16R2.1443 CCC1CC1C(=O)NCc2cccnc2 527a_100000210453_200011661523 [0,0,0,1,0,1|2,0,0]=4 29375 B16R2.1443 CCC1CC1C(=O)NCc2ccncc2 11a_100000210450_200011661523 [0,0,0,1,0,1|2,0,0]=4 29376 B16R2.1443 CCC1CC1C(=O)NCc2ccncc2 1626a_100000210450_200011661523 [0,0,0,1,0,1|2,0,0]=4 29377 B16R2.1443 CCC1CC1C(=O)NCc2ccncc2 240690a_100000210450_200011661523 [0,0,0,1,0,1|2,0,0]=4 29378 B16R2.1443 CCC1CC1C(=O)NCc2ccncc2 527a_100000210450_200011661523 [0,0,0,1,0,1|2,0,0]=4 29379 B16R2.1443 CCC1CC1C(=O)NNc2ccccc2 22a_100015195140_200011661523 [0,0,0,1,0,1|2,0,0]=4 29380 B16R2.2238 O=C(C#Cc1ccccc1)C2CCCC2 1458a_100000736102_100000179811 [0,0,0,1,0,1|1,0,1]=4 29381 B16R2.2238 O=C(C#Cc1ccccc1)N2CCCC2 240690a_100000188435_100000736102 [0,0,0,1,0,1|1,0,1]=4 29382 B16R2.2238 O=C(C=Cc1ccccc1)C2CCCC2 1458a_100000210462_100000179811 [0,0,0,1,0,1|1,0,1]=4 29383 B16R2.2238 O=C(CCc1ccccc1)C2=CCCC2 1458a_100000038896_100000765856 [0,0,0,1,0,1|1,0,1]=4 29384 B16R2.2238 O=C(CCc1ccccc1)C2CCCC2 1458a_100000185753_100000179811 [0,0,0,1,0,1|1,0,0]=3 29385 B16R2.2238 O=C(CCc1ccccc1)C2CCCC2 1458a_100000210718_100000765856 [0,0,0,1,0,1|1,0,0]=3 29386 B16R2.2238 O=C(CCc1ccccc1)C2CCCS2 1458a_100012002731_100000765856 [0,0,0,1,0,1|2,0,0]=4 29387 B16R2.2238 O=C(CCc1ccccc1)C2CCOC2 1458a_100000185753_100000690089 [0,0,0,1,0,1|2,0,0]=4 29388 B16R2.2238 O=C(CCc1ccccc1)C2CCOC2 1458a_100011219752_100000765856 [0,0,0,1,0,1|2,0,0]=4 29389 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 240690a_100000188435_100000185753 [0,0,0,1,0,1|1,0,0]=3 29390 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 527a_100000188435_100000185753 [0,0,0,1,0,1|1,0,0]=3 29391 B16R2.2238 O=C(CCc1ccccc1)N2CCSC2 11a_100011215254_100000185753 [0,0,0,1,0,1|2,0,0]=4 29392 B16R2.2238 O=C(CCc1ccccc1)N2CCSC2 240690a_100011215254_100000185753 [0,0,0,1,0,1|2,0,0]=4 29393 B16R2.2238 O=C(CCc1ccccc1)N2CCSC2 527a_100011215254_100000185753 [0,0,0,1,0,1|2,0,0]=4 29394 B16R2.2238 O=C(CCc1ccccc1)[C@@H]2CCCO2 1458a_100000686382_100000765856 [0,0,0,1,0,1|2,0,0]=4 29395 B16R2.2238 O=C(CCc1ccccn1)C2CCCC2 1458a_100000210718_100015183660 [0,0,0,1,0,1|2,0,0]=4 29396 B16R2.2238 O=C(CCc1ccccn1)C2CCCC2 1458a_100015195070_100000179811 [0,0,0,1,0,1|2,0,0]=4 29397 B16R2.2238 O=C(CCc1ccccn1)N2CCCC2 240690a_100000188435_100015195070 [0,0,0,1,0,1|2,0,0]=4 29398 B16R2.2238 O=C(CCc1ccccn1)N2CCCC2 527a_100000188435_100015195070 [0,0,0,1,0,1|2,0,0]=4 29399 B16R2.2238 O=C(CCc1cccnc1)C2CCCC2 1458a_100000198484_100000179811 [0,0,0,1,0,1|2,0,0]=4 29400 B16R2.2238 O=C(CCc1cccnc1)C2CCCC2 1458a_100000210718_200011713674 [0,0,0,1,0,1|2,0,0]=4 29401 B16R2.2238 O=C(CCc1cccnc1)N2CCCC2 240690a_100000188435_100000198484 [0,0,0,1,0,1|2,0,0]=4 29402 B16R2.2238 O=C(CCc1cccnc1)N2CCCC2 527a_100000188435_100000198484 [0,0,0,1,0,1|2,0,0]=4 29403 B16R2.2238 O=C(CCc1ccncc1)C2CCCC2 1458a_100000210718_100000723409 [0,0,0,1,0,1|2,0,0]=4 29404 B16R2.2238 O=C(CCc1ccncc1)C2CCCC2 1458a_100011225043_100000179811 [0,0,0,1,0,1|2,0,0]=4 29405 B16R2.2238 O=C(CCc1ccncc1)N2CCCC2 240690a_100000188435_100011225043 [0,0,0,1,0,1|2,0,0]=4 29406 B16R2.2238 O=C(CCc1ccncc1)N2CCCC2 527a_100000188435_100011225043 [0,0,0,1,0,1|2,0,0]=4 29407 B16R2.2238 O=C(CNc1ccccc1)N2CCCC2 34a_100000106764_100000183516 [0,0,0,1,0,1|1,0,0]=3 29408 B16R2.2238 O=C(COc1ccccc1)C2CCCC2 1458a_100000186222_100000179811 [0,0,0,1,0,1|1,0,0]=3 29409 B16R2.2238 O=C(COc1ccccc1)C2CCOC2 1458a_100000186222_100000690089 [0,0,0,1,0,1|2,0,0]=4 29410 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 240690a_100000188435_100000186222 [0,0,0,1,0,1|1,0,0]=3 29411 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 34a_100000210340_100000183516 [0,0,0,1,0,1|1,0,0]=3 29412 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 527a_100000188435_100000186222 [0,0,0,1,0,1|1,0,0]=3 29413 B16R2.2238 O=C(COc1ccccc1)N2CCCC2 7a_100000210340_100000183516 [0,0,0,1,0,1|1,0,0]=3 29414 B16R2.2238 O=C(COc1ccccc1)N2CCSC2 11a_100011215254_100000186222 [0,0,0,1,0,1|2,0,0]=4 29415 B16R2.2238 O=C(COc1ccccc1)N2CCSC2 240690a_100011215254_100000186222 [0,0,0,1,0,1|2,0,0]=4 29416 B16R2.2238 O=C(COc1ccccc1)N2CCSC2 527a_100011215254_100000186222 [0,0,0,1,0,1|2,0,0]=4 29417 B16R2.2238 O=C(COc1ccccn1)C2CCCC2 1458a_100102699861_100000179811 [0,0,0,1,0,1|2,0,0]=4 29418 B16R2.2238 O=C(COc1ccccn1)N2CCCC2 240690a_100000188435_100102699861 [0,0,0,1,0,1|2,0,0]=4 29419 B16R2.2238 O=C(COc1ccccn1)N2CCCC2 527a_100000188435_100102699861 [0,0,0,1,0,1|2,0,0]=4 29420 B16R2.2238 O=C(COc1cccnc1)C2CCCC2 1458a_100015207166_100000179811 [0,0,0,1,0,1|2,0,0]=4 29421 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 240690a_100000188435_100015207166 [0,0,0,1,0,1|2,0,0]=4 29422 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 34a_100000210849_100000183516 [0,0,0,1,0,1|2,0,0]=4 29423 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 527a_100000188435_100015207166 [0,0,0,1,0,1|2,0,0]=4 29424 B16R2.2238 O=C(COc1cccnc1)N2CCCC2 7a_100000210849_100000183516 [0,0,0,1,0,1|2,0,0]=4 29425 B16R2.2238 O=C(COc1ccncc1)N2CCCC2 34a_100000212176_100000183516 [0,0,0,1,0,1|2,0,0]=4 29426 B16R2.2238 O=C(CSc1ccccc1)C2CCCC2 1458a_100000211596_100000179811 [0,0,0,1,0,1|1,0,0]=3 29427 B16R2.2238 O=C(CSc1ccccc1)C2CCOC2 1458a_100000211596_100000690089 [0,0,0,1,0,1|2,0,0]=4 29428 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 240690a_100000188435_100000211596 [0,0,0,1,0,1|1,0,0]=3 29429 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 527a_100000188435_100000211596 [0,0,0,1,0,1|1,0,0]=3 29430 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 62a_100000183516_100000041952 [0,0,0,1,0,1|1,0,0]=3 29431 B16R2.2238 O=C(CSc1ccccc1)N2CCCC2 62a_100000719477_100000183516 [0,0,0,1,0,1|1,0,0]=3 29432 B16R2.2238 O=C(CSc1ccccc1)N2CCSC2 11a_100011215254_100000211596 [0,0,0,1,0,1|2,0,0]=4 29433 B16R2.2238 O=C(CSc1ccccc1)N2CCSC2 240690a_100011215254_100000211596 [0,0,0,1,0,1|2,0,0]=4 29434 B16R2.2238 O=C(CSc1ccccc1)N2CCSC2 527a_100011215254_100000211596 [0,0,0,1,0,1|2,0,0]=4 29435 B16R2.2238 O=C(CSc1ccccn1)C2CCCC2 1458a_100000156281_100000179811 [0,0,0,1,0,1|2,0,0]=4 29436 B16R2.2238 O=C(CSc1ccccn1)N2CCCC2 240690a_100000188435_100000156281 [0,0,0,1,0,1|2,0,0]=4 29437 B16R2.2238 O=C(CSc1ccccn1)N2CCCC2 527a_100000188435_100000156281 [0,0,0,1,0,1|2,0,0]=4 29438 B16R2.2238 O=C(CSc1ccccn1)N2CCCC2 62a_100000183516_100011216584 [0,0,0,1,0,1|2,0,0]=4 29439 B16R2.2238 O=C(CSc1ccccn1)N2CCCC2 62a_100011216584_100000183516 [0,0,0,1,0,1|2,0,0]=4 29440 B16R2.2238 O=C(CSc1cccnc1)N2CCCC2 62a_100000183516_100000210063 [0,0,0,1,0,1|2,0,0]=4 29441 B16R2.2238 O=C(CSc1cccnc1)N2CCCC2 62a_100000210063_100000183516 [0,0,0,1,0,1|2,0,0]=4 29442 B16R2.2238 O=C(CSc1ccncc1)C2CCCC2 1458a_100000211328_100000179811 [0,0,0,1,0,1|2,0,0]=4 29443 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 240690a_100000188435_100000211328 [0,0,0,1,0,1|2,0,0]=4 29444 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 527a_100000188435_100000211328 [0,0,0,1,0,1|2,0,0]=4 29445 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 62a_100000183516_100000728582 [0,0,0,1,0,1|2,0,0]=4 29446 B16R2.2238 O=C(CSc1ccncc1)N2CCCC2 62a_100000728582_100000183516 [0,0,0,1,0,1|2,0,0]=4 29447 B16R2.2238 O=C(NCc1ccccc1)C2=CCCC2 11a_100015324214_100000038896 [0,0,0,1,0,1|1,0,1]=4 29448 B16R2.2238 O=C(NCc1ccccc1)C2=CCCC2 1626a_100015324214_100000038896 [0,0,0,1,0,1|1,0,1]=4 29449 B16R2.2238 O=C(NCc1ccccc1)C2=CCCC2 240690a_100015324214_100000038896 [0,0,0,1,0,1|1,0,1]=4 29450 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 11a_100015324214_100000210718 [0,0,0,1,0,1|1,0,0]=3 29451 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 1626a_100015324214_100000210718 [0,0,0,1,0,1|1,0,0]=3 29452 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 240690a_100015324214_100000210718 [0,0,0,1,0,1|1,0,0]=3 29453 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 527a_100015324214_100000210718 [0,0,0,1,0,1|1,0,0]=3 29454 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 11a_100015324214_100012002731 [0,0,0,1,0,1|2,0,0]=4 29455 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 1626a_100015324214_100012002731 [0,0,0,1,0,1|2,0,0]=4 29456 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 240690a_100015324214_100012002731 [0,0,0,1,0,1|2,0,0]=4 29457 B16R2.2238 O=C(NCc1ccccc1)C2CCCS2 527a_100015324214_100012002731 [0,0,0,1,0,1|2,0,0]=4 29458 B16R2.2238 O=C(NCc1ccccc1)C2CCOC2 11a_100015324214_100011219752 [0,0,0,1,0,1|2,0,0]=4 29459 B16R2.2238 O=C(NCc1ccccc1)C2CCOC2 1626a_100015324214_100011219752 [0,0,0,1,0,1|2,0,0]=4 29460 B16R2.2238 O=C(NCc1ccccc1)C2CCOC2 240690a_100015324214_100011219752 [0,0,0,1,0,1|2,0,0]=4 29461 B16R2.2238 O=C(NCc1ccccc1)C2CCOC2 527a_100015324214_100011219752 [0,0,0,1,0,1|2,0,0]=4 29462 B16R2.2238 O=C(NCc1ccccc1)N2CCCC2 2708a_100015324214_100000188435 [0,0,0,1,0,1|1,0,0]=3 29463 B16R2.2238 O=C(NCc1ccccc1)N2CCCC2 273464a_100015324214_100000188435 [0,0,0,1,0,1|1,0,0]=3 29464 B16R2.2238 O=C(NCc1ccccc1)N2CCSC2 2708a_100015324214_100011215254 [0,0,0,1,0,1|2,0,0]=4 29465 B16R2.2238 O=C(NCc1ccccc1)N2CCSC2 273464a_100015324214_100011215254 [0,0,0,1,0,1|2,0,0]=4 29466 B16R2.2238 O=C(NCc1ccccc1)[C@@H]2CCCO2 11a_100015324214_100000686382 [0,0,0,1,0,1|2,0,0]=4 29467 B16R2.2238 O=C(NCc1ccccc1)[C@@H]2CCCO2 1626a_100015324214_100000686382 [0,0,0,1,0,1|2,0,0]=4 29468 B16R2.2238 O=C(NCc1ccccc1)[C@@H]2CCCO2 240690a_100015324214_100000686382 [0,0,0,1,0,1|2,0,0]=4 29469 B16R2.2238 O=C(NCc1ccccc1)[C@@H]2CCCO2 527a_100015324214_100000686382 [0,0,0,1,0,1|2,0,0]=4 29470 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 11a_100000210449_100000210718 [0,0,0,1,0,1|2,0,0]=4 29471 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 1626a_100000210449_100000210718 [0,0,0,1,0,1|2,0,0]=4 29472 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 240690a_100000210449_100000210718 [0,0,0,1,0,1|2,0,0]=4 29473 B16R2.2238 O=C(NCc1ccccn1)C2CCCC2 527a_100000210449_100000210718 [0,0,0,1,0,1|2,0,0]=4 29474 B16R2.2238 O=C(NCc1ccccn1)N2CCCC2 2708a_100000210449_100000188435 [0,0,0,1,0,1|2,0,0]=4 29475 B16R2.2238 O=C(NCc1ccccn1)N2CCCC2 273464a_100000210449_100000188435 [0,0,0,1,0,1|2,0,0]=4 29476 B16R2.2238 O=C(NCc1cccnc1)C2CCCC2 11a_100000210453_100000210718 [0,0,0,1,0,1|2,0,0]=4 29477 B16R2.2238 O=C(NCc1cccnc1)C2CCCC2 240690a_100000210453_100000210718 [0,0,0,1,0,1|2,0,0]=4 29478 B16R2.2238 O=C(NCc1cccnc1)C2CCCC2 527a_100000210453_100000210718 [0,0,0,1,0,1|2,0,0]=4 29479 B16R2.2238 O=C(NCc1cccnc1)N2CCCC2 2708a_100000210453_100000188435 [0,0,0,1,0,1|2,0,0]=4 29480 B16R2.2238 O=C(NCc1cccnc1)N2CCCC2 273464a_100000210453_100000188435 [0,0,0,1,0,1|2,0,0]=4 29481 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 11a_100000210450_100000210718 [0,0,0,1,0,1|2,0,0]=4 29482 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 1626a_100000210450_100000210718 [0,0,0,1,0,1|2,0,0]=4 29483 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 240690a_100000210450_100000210718 [0,0,0,1,0,1|2,0,0]=4 29484 B16R2.2238 O=C(NCc1ccncc1)C2CCCC2 527a_100000210450_100000210718 [0,0,0,1,0,1|2,0,0]=4 29485 B16R2.2238 O=C(NCc1ccncc1)N2CCCC2 2708a_100000210450_100000188435 [0,0,0,1,0,1|2,0,0]=4 29486 B16R2.2238 O=C(NCc1ccncc1)N2CCCC2 273464a_100000210450_100000188435 [0,0,0,1,0,1|2,0,0]=4 29487 B16R2.2238 O=C(NNc1ccccc1)C2CCCC2 22a_100015195140_100000210718 [0,0,0,1,0,1|2,0,0]=4 29488 B16R2.2441 CCCCOC1CCc2ccccc2C1 34a_100011216300_100000210210 [0,0,0,1,0,1|1,0,1]=4 29489 B16R2.2441 CCCCOC1CCc2ccccc2C1 7a_100011216300_100000210211 [0,0,0,1,0,1|1,0,1]=4 29490 B16R2.2441 CCCCOC1Cc2ccccc2CO1 34a_200000095866_100000210210 [0,0,0,1,0,1|1,0,1]=4 29491 B16R2.2441 CCCCOc1ccc2ccccc2c1 34a_100000185828_100000210210 [0,0,0,1,0,1|1,0,1]=4 29492 B16R2.2441 CCCCOc1ccc2ccccc2c1 7a_100000185828_100000210211 [0,0,0,1,0,1|1,0,1]=4 29493 B16R2.2441 CCCCOc1cnc2ccccc2c1 34a_100011934006_100000210210 [0,0,0,1,0,1|1,0,1]=4 29494 B16R2.2441 CCCCOc1cnc2ccccc2c1 7a_100011934006_100000210211 [0,0,0,1,0,1|1,0,1]=4 29495 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000185753 [0,0,0,1,0,1|2,0,0]=4 29496 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@@H]2F 527a_100015190264_100000185753 [0,0,0,1,0,1|2,0,0]=4 29497 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@H]2F 11a_100025746932_100000185753 [0,0,0,1,0,1|2,0,0]=4 29498 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@H]2F 1626a_100025746932_100000185753 [0,0,0,1,0,1|2,0,0]=4 29499 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@H]2F 240690a_100025746932_100000185753 [0,0,0,1,0,1|2,0,0]=4 29500 B16R2.3193 O=C(CCc1ccccc1)N[C@@H]2C[C@H]2F 527a_100025746932_100000185753 [0,0,0,1,0,1|2,0,0]=4 29501 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000186222 [0,0,0,1,0,1|2,0,0]=4 29502 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@@H]2F 527a_100015190264_100000186222 [0,0,0,1,0,1|2,0,0]=4 29503 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@H]2F 11a_100025746932_100000186222 [0,0,0,1,0,1|2,0,0]=4 29504 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@H]2F 1626a_100025746932_100000186222 [0,0,0,1,0,1|2,0,0]=4 29505 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@H]2F 240690a_100025746932_100000186222 [0,0,0,1,0,1|2,0,0]=4 29506 B16R2.3193 O=C(COc1ccccc1)N[C@@H]2C[C@H]2F 527a_100025746932_100000186222 [0,0,0,1,0,1|2,0,0]=4 29507 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000211596 [0,0,0,1,0,1|2,0,0]=4 29508 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@@H]2F 527a_100015190264_100000211596 [0,0,0,1,0,1|2,0,0]=4 29509 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@H]2F 11a_100025746932_100000211596 [0,0,0,1,0,1|2,0,0]=4 29510 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@H]2F 1626a_100025746932_100000211596 [0,0,0,1,0,1|2,0,0]=4 29511 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@H]2F 240690a_100025746932_100000211596 [0,0,0,1,0,1|2,0,0]=4 29512 B16R2.3193 O=C(CSc1ccccc1)N[C@@H]2C[C@H]2F 527a_100025746932_100000211596 [0,0,0,1,0,1|2,0,0]=4 29513 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@@H]2F 2708a_100015324214_100015190264 [0,0,0,1,0,1|2,0,0]=4 29514 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@@H]2F 273464a_100015190264_100015324214 [0,0,0,1,0,1|2,0,0]=4 29515 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@@H]2F 273464a_100015324214_100015190264 [0,0,0,1,0,1|2,0,0]=4 29516 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@@H]2F 512a_100015324214_100015190264 [0,0,0,1,0,1|2,0,0]=4 29517 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@H]2F 2708a_100015324214_100025746932 [0,0,0,1,0,1|2,0,0]=4 29518 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@H]2F 273464a_100015324214_100025746932 [0,0,0,1,0,1|2,0,0]=4 29519 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@H]2F 512a_100015324214_100025746932 [0,0,0,1,0,1|2,0,0]=4 29520 B16R2.3193 O=C(NCc1ccccc1)N[C@@H]2C[C@H]2F 512a_100025746932_100015324214 [0,0,0,1,0,1|2,0,0]=4 29521 B16R2.3260 CN1CCNC(=O)CC1c2ccccc2 2230a_100000047999_200000210301 [0,0,0,1,0,1|2,0,0]=4 29522 B16R2.3260 CN1CCNC(=O)CC1c2ccccc2 269982a_100000047999_200000210301 [0,0,0,1,0,1|2,0,0]=4 29523 B16R2.3260 CN1CCNC(=O)CC1c2ccccc2 34a_100000047999_200000210301 [0,0,0,1,0,1|2,0,0]=4 29524 B16R2.3260 [13CH3]N1CCNC(=O)CC1c2ccccc2 2230a_100000047999_200025704644 [0,0,0,1,0,1|2,0,0]=4 29525 B16R2.3260 [13CH3]N1CCNC(=O)CC1c2ccccc2 269982a_100000047999_200025704644 [0,0,0,1,0,1|2,0,0]=4 29526 B16R2.3260 [13CH3]N1CCNC(=O)CC1c2ccccc2 34a_100000047999_200025704644 [0,0,0,1,0,1|2,0,0]=4 29527 B16R2.4347 CCCCOC1(CCc2c1cccc2)C 34a_100000685031_100000210210 [0,0,0,1,0,1|1,0,1]=4 29528 B16R2.4347 CCCCOC1(CCc2c1cccc2)C 7a_100000685031_100000210211 [0,0,0,1,0,1|1,0,1]=4 29529 B16R2.43746 CCCCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000210326 [0,0,0,1,0,1|1,0,0]=3 29530 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 11a_100000102301_200000238571 [0,0,0,1,0,1|1,0,0]=3 29531 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 1626a_100000102301_200000238571 [0,0,0,1,0,1|1,0,0]=3 29532 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 240690a_100000102301_200000238571 [0,0,0,1,0,1|1,0,0]=3 29533 B16R2.43746 CCCCNC(=O)C1Cc2c1cccc2 527a_100000102301_200000238571 [0,0,0,1,0,1|1,0,0]=3 29534 B16R2.43746 CCCNNC(=O)C1Cc2c1cccc2 22a_100000740057_200000238571 [0,0,0,1,0,1|2,0,0]=4 29535 B16R2.43746 CCOCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100011215890 [0,0,0,1,0,1|2,0,0]=4 29536 B16R2.43746 CCSCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000757381 [0,0,0,1,0,1|2,0,0]=4 29537 B16R2.43746 COCCCC(=O)C1Cc2c1cccc2 1458a_200000238571_100000740836 [0,0,0,1,0,1|2,0,0]=4 29538 B16R2.43746 COCCNC(=O)C1Cc2c1cccc2 1626a_100000209980_200000238571 [0,0,0,1,0,1|2,0,0]=4 29539 B16R2.43746 COCCNC(=O)C1Cc2c1cccc2 240690a_100000209980_200000238571 [0,0,0,1,0,1|2,0,0]=4 29540 B16R2.43746 COCCNC(=O)C1Cc2c1cccc2 527a_100000209980_200000238571 [0,0,0,1,0,1|2,0,0]=4 29541 B16R2.43746 CSCCNC(=O)C1Cc2c1cccc2 11a_100020590264_200000238571 [0,0,0,1,0,1|2,0,0]=4 29542 B16R2.43746 CSCCNC(=O)C1Cc2c1cccc2 1626a_100020590264_200000238571 [0,0,0,1,0,1|2,0,0]=4 29543 B16R2.43746 CSCCNC(=O)C1Cc2c1cccc2 240690a_100020590264_200000238571 [0,0,0,1,0,1|2,0,0]=4 29544 B16R2.43746 CSCCNC(=O)C1Cc2c1cccc2 527a_100020590264_200000238571 [0,0,0,1,0,1|2,0,0]=4 29545 B16R2.43746 O=C(CCCCF)C1Cc2c1cccc2 1458a_200000238571_100000729493 [0,0,0,1,0,1|2,0,0]=4 29546 B16R2.43746 O=C(CCCCO)C1Cc2c1cccc2 1458a_200000238571_100000210776 [0,0,0,1,0,1|2,0,0]=4 29547 B16R2.43746 O=C(NCCCF)C1Cc2c1cccc2 11a_100015189416_200000238571 [0,0,0,1,0,1|2,0,0]=4 29548 B16R2.43746 O=C(NCCCF)C1Cc2c1cccc2 1626a_100015189416_200000238571 [0,0,0,1,0,1|2,0,0]=4 29549 B16R2.43746 O=C(NCCCF)C1Cc2c1cccc2 240690a_100015189416_200000238571 [0,0,0,1,0,1|2,0,0]=4 29550 B16R2.43746 O=C(NCCCF)C1Cc2c1cccc2 527a_100015189416_200000238571 [0,0,0,1,0,1|2,0,0]=4 29551 B16R2.43746 O=C(NCCCO)C1Cc2c1cccc2 240690a_100000182051_200000238571 [0,0,0,1,0,1|2,0,0]=4 29552 B16R2.43746 O=C(NCCCO)C1Cc2c1cccc2 527a_100000182051_200000238571 [0,0,0,1,0,1|2,0,0]=4 29553 B16R2.44148 CC(COc1ccccc1)OC2CCC2 34a_100000210911_100000749161 [0,0,0,1,0,1|1,0,1]=4 29554 B16R2.44148 C[C@@H](CCc1ccccc1)OC2CCC2 34a_100009815974_100000749161 [0,0,0,1,0,1|1,0,1]=4 29555 B16R2.44148 O=C(C#Cc1ccccc1)CC2CCC2 1458a_100000736102_100000763275 [0,0,0,1,0,1|1,0,1]=4 29556 B16R2.44148 O=C(C#Cc1ccccc1)NC2CCC2 240690a_100000749019_100000736102 [0,0,0,1,0,1|1,0,1]=4 29557 B16R2.44148 O=C(C=C1CCC1)CCc2ccccc2 1458a_100000686340_100000765856 [0,0,0,1,0,1|1,0,1]=4 29558 B16R2.44148 O=C(C=C1CCC1)NCc2ccccc2 11a_100015324214_100000686340 [0,0,0,1,0,1|1,0,1]=4 29559 B16R2.44148 O=C(C=C1CCC1)NCc2ccccc2 240690a_100015324214_100000686340 [0,0,0,1,0,1|1,0,1]=4 29560 B16R2.44148 O=C(C=Cc1ccccc1)CC2CCC2 1458a_100000210462_100000763275 [0,0,0,1,0,1|1,0,1]=4 29561 B16R2.44148 O=C(C=Cc1ccccc1)NC2CCC2 11a_100000749019_100000210462 [0,0,0,1,0,1|1,0,1]=4 29562 B16R2.44148 O=C(C=Cc1ccccc1)NC2CCC2 1626a_100000749019_100000210462 [0,0,0,1,0,1|1,0,1]=4 29563 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 11a_100015324214_100000763092 [0,0,0,1,0,1|1,0,0]=3 29564 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 1626a_100015324214_100000763092 [0,0,0,1,0,1|1,0,0]=3 29565 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 240690a_100015324214_100000763092 [0,0,0,1,0,1|1,0,0]=3 29566 B16R2.44148 O=C(CC1CCC1)NCc2ccccc2 527a_100015324214_100000763092 [0,0,0,1,0,1|1,0,0]=3 29567 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 11a_100000210449_100000763092 [0,0,0,1,0,1|2,0,0]=4 29568 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 1626a_100000210449_100000763092 [0,0,0,1,0,1|2,0,0]=4 29569 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 240690a_100000210449_100000763092 [0,0,0,1,0,1|2,0,0]=4 29570 B16R2.44148 O=C(CC1CCC1)NCc2ccccn2 527a_100000210449_100000763092 [0,0,0,1,0,1|2,0,0]=4 29571 B16R2.44148 O=C(CC1CCC1)NCc2cccnc2 11a_100000210453_100000763092 [0,0,0,1,0,1|2,0,0]=4 29572 B16R2.44148 O=C(CC1CCC1)NCc2cccnc2 240690a_100000210453_100000763092 [0,0,0,1,0,1|2,0,0]=4 29573 B16R2.44148 O=C(CC1CCC1)NCc2cccnc2 527a_100000210453_100000763092 [0,0,0,1,0,1|2,0,0]=4 29574 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 11a_100000210450_100000763092 [0,0,0,1,0,1|2,0,0]=4 29575 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 1626a_100000210450_100000763092 [0,0,0,1,0,1|2,0,0]=4 29576 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 240690a_100000210450_100000763092 [0,0,0,1,0,1|2,0,0]=4 29577 B16R2.44148 O=C(CC1CCC1)NCc2ccncc2 527a_100000210450_100000763092 [0,0,0,1,0,1|2,0,0]=4 29578 B16R2.44148 O=C(CC1CCC1)NNc2ccccc2 22a_100015195140_100000763092 [0,0,0,1,0,1|2,0,0]=4 29579 B16R2.44148 O=C(CC1COC1)NCc2ccccc2 11a_100015324214_100000687760 [0,0,0,1,0,1|2,0,0]=4 29580 B16R2.44148 O=C(CC1COC1)NCc2ccccc2 1626a_100015324214_100000687760 [0,0,0,1,0,1|2,0,0]=4 29581 B16R2.44148 O=C(CCc1ccccc1)CC2CCC2 1458a_100000185753_100000763275 [0,0,0,1,0,1|1,0,0]=3 29582 B16R2.44148 O=C(CCc1ccccc1)CC2CCC2 1458a_100000763092_100000765856 [0,0,0,1,0,1|1,0,0]=3 29583 B16R2.44148 O=C(CCc1ccccc1)CC2CCO2 1458a_100000185753_100000103362 [0,0,0,1,0,1|2,0,0]=4 29584 B16R2.44148 O=C(CCc1ccccc1)CC2COC2 1458a_100000185753_100010264016 [0,0,0,1,0,1|2,0,0]=4 29585 B16R2.44148 O=C(CCc1ccccc1)CC2COC2 1458a_100000687760_100000765856 [0,0,0,1,0,1|2,0,0]=4 29586 B16R2.44148 O=C(CCc1ccccc1)CN2CCC2 269982a_100000754969_100012361361 [0,0,0,1,0,1|2,0,0]=4 29587 B16R2.44148 O=C(CCc1ccccc1)NC2CCC2 11a_100000749019_100000185753 [0,0,0,1,0,1|1,0,0]=3 29588 B16R2.44148 O=C(CCc1ccccc1)NC2CCC2 1626a_100000749019_100000185753 [0,0,0,1,0,1|1,0,0]=3 29589 B16R2.44148 O=C(CCc1ccccc1)NC2CCC2 240690a_100000749019_100000185753 [0,0,0,1,0,1|1,0,0]=3 29590 B16R2.44148 O=C(CCc1ccccc1)NC2CCC2 527a_100000749019_100000185753 [0,0,0,1,0,1|1,0,0]=3 29591 B16R2.44148 O=C(CCc1ccccc1)NC2COC2 11a_100016991112_100000185753 [0,0,0,1,0,1|2,0,0]=4 29592 B16R2.44148 O=C(CCc1ccccc1)NC2COC2 1626a_100016991112_100000185753 [0,0,0,1,0,1|2,0,0]=4 29593 B16R2.44148 O=C(CCc1ccccc1)NC2COC2 240690a_100016991112_100000185753 [0,0,0,1,0,1|2,0,0]=4 29594 B16R2.44148 O=C(CCc1ccccc1)NC2COC2 527a_100016991112_100000185753 [0,0,0,1,0,1|2,0,0]=4 29595 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 11a_100016994217_100000185753 [0,0,0,1,0,1|2,0,0]=4 29596 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 1626a_100016994217_100000185753 [0,0,0,1,0,1|2,0,0]=4 29597 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 240690a_100016994217_100000185753 [0,0,0,1,0,1|2,0,0]=4 29598 B16R2.44148 O=C(CCc1ccccc1)NC2CSC2 527a_100016994217_100000185753 [0,0,0,1,0,1|2,0,0]=4 29599 B16R2.44148 O=C(CCc1ccccn1)CC2CCC2 1458a_100000763092_100015183660 [0,0,0,1,0,1|2,0,0]=4 29600 B16R2.44148 O=C(CCc1ccccn1)CC2CCC2 1458a_100015195070_100000763275 [0,0,0,1,0,1|2,0,0]=4 29601 B16R2.44148 O=C(CCc1ccccn1)NC2CCC2 11a_100000749019_100015195070 [0,0,0,1,0,1|2,0,0]=4 29602 B16R2.44148 O=C(CCc1ccccn1)NC2CCC2 240690a_100000749019_100015195070 [0,0,0,1,0,1|2,0,0]=4 29603 B16R2.44148 O=C(CCc1ccccn1)NC2CCC2 527a_100000749019_100015195070 [0,0,0,1,0,1|2,0,0]=4 29604 B16R2.44148 O=C(CCc1cccnc1)CC2CCC2 1458a_100000198484_100000763275 [0,0,0,1,0,1|2,0,0]=4 29605 B16R2.44148 O=C(CCc1cccnc1)CC2CCC2 1458a_100000763092_200011713674 [0,0,0,1,0,1|2,0,0]=4 29606 B16R2.44148 O=C(CCc1cccnc1)NC2CCC2 11a_100000749019_100000198484 [0,0,0,1,0,1|2,0,0]=4 29607 B16R2.44148 O=C(CCc1cccnc1)NC2CCC2 1626a_100000749019_100000198484 [0,0,0,1,0,1|2,0,0]=4 29608 B16R2.44148 O=C(CCc1cccnc1)NC2CCC2 240690a_100000749019_100000198484 [0,0,0,1,0,1|2,0,0]=4 29609 B16R2.44148 O=C(CCc1cccnc1)NC2CCC2 527a_100000749019_100000198484 [0,0,0,1,0,1|2,0,0]=4 29610 B16R2.44148 O=C(CCc1ccncc1)CC2CCC2 1458a_100000763092_100000723409 [0,0,0,1,0,1|2,0,0]=4 29611 B16R2.44148 O=C(CCc1ccncc1)CC2CCC2 1458a_100011225043_100000763275 [0,0,0,1,0,1|2,0,0]=4 29612 B16R2.44148 O=C(CCc1ccncc1)NC2CCC2 11a_100000749019_100011225043 [0,0,0,1,0,1|2,0,0]=4 29613 B16R2.44148 O=C(CCc1ccncc1)NC2CCC2 240690a_100000749019_100011225043 [0,0,0,1,0,1|2,0,0]=4 29614 B16R2.44148 O=C(CCc1ccncc1)NC2CCC2 527a_100000749019_100011225043 [0,0,0,1,0,1|2,0,0]=4 29615 B16R2.44148 O=C(CN1CCC1)NCc2ccccc2 269982a_100000754969_100000183539 [0,0,0,1,0,1|2,0,0]=4 29616 B16R2.44148 O=C(CN1CCC1)OCc2ccccc2 269982a_100000754969_100000753625 [0,0,0,1,0,1|2,0,0]=4 29617 B16R2.44148 O=C(COc1ccccc1)CC2CCC2 1458a_100000186222_100000763275 [0,0,0,1,0,1|1,0,0]=3 29618 B16R2.44148 O=C(COc1ccccc1)CC2CCO2 1458a_100000186222_100000103362 [0,0,0,1,0,1|2,0,0]=4 29619 B16R2.44148 O=C(COc1ccccc1)CC2COC2 1458a_100000186222_100010264016 [0,0,0,1,0,1|2,0,0]=4 29620 B16R2.44148 O=C(COc1ccccc1)NC2CCC2 11a_100000749019_100000186222 [0,0,0,1,0,1|1,0,0]=3 29621 B16R2.44148 O=C(COc1ccccc1)NC2CCC2 1626a_100000749019_100000186222 [0,0,0,1,0,1|1,0,0]=3 29622 B16R2.44148 O=C(COc1ccccc1)NC2CCC2 240690a_100000749019_100000186222 [0,0,0,1,0,1|1,0,0]=3 29623 B16R2.44148 O=C(COc1ccccc1)NC2CCC2 527a_100000749019_100000186222 [0,0,0,1,0,1|1,0,0]=3 29624 B16R2.44148 O=C(COc1ccccc1)NC2COC2 11a_100016991112_100000186222 [0,0,0,1,0,1|2,0,0]=4 29625 B16R2.44148 O=C(COc1ccccc1)NC2COC2 1626a_100016991112_100000186222 [0,0,0,1,0,1|2,0,0]=4 29626 B16R2.44148 O=C(COc1ccccc1)NC2COC2 240690a_100016991112_100000186222 [0,0,0,1,0,1|2,0,0]=4 29627 B16R2.44148 O=C(COc1ccccc1)NC2COC2 527a_100016991112_100000186222 [0,0,0,1,0,1|2,0,0]=4 29628 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 11a_100016994217_100000186222 [0,0,0,1,0,1|2,0,0]=4 29629 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 1626a_100016994217_100000186222 [0,0,0,1,0,1|2,0,0]=4 29630 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 240690a_100016994217_100000186222 [0,0,0,1,0,1|2,0,0]=4 29631 B16R2.44148 O=C(COc1ccccc1)NC2CSC2 527a_100016994217_100000186222 [0,0,0,1,0,1|2,0,0]=4 29632 B16R2.44148 O=C(COc1ccccn1)CC2CCC2 1458a_100102699861_100000763275 [0,0,0,1,0,1|2,0,0]=4 29633 B16R2.44148 O=C(COc1ccccn1)NC2CCC2 1626a_100000749019_100102699861 [0,0,0,1,0,1|2,0,0]=4 29634 B16R2.44148 O=C(COc1ccccn1)NC2CCC2 240690a_100000749019_100102699861 [0,0,0,1,0,1|2,0,0]=4 29635 B16R2.44148 O=C(COc1ccccn1)NC2CCC2 527a_100000749019_100102699861 [0,0,0,1,0,1|2,0,0]=4 29636 B16R2.44148 O=C(COc1cccnc1)CC2CCC2 1458a_100015207166_100000763275 [0,0,0,1,0,1|2,0,0]=4 29637 B16R2.44148 O=C(COc1cccnc1)NC2CCC2 11a_100000749019_100015207166 [0,0,0,1,0,1|2,0,0]=4 29638 B16R2.44148 O=C(COc1cccnc1)NC2CCC2 1626a_100000749019_100015207166 [0,0,0,1,0,1|2,0,0]=4 29639 B16R2.44148 O=C(COc1cccnc1)NC2CCC2 240690a_100000749019_100015207166 [0,0,0,1,0,1|2,0,0]=4 29640 B16R2.44148 O=C(COc1cccnc1)NC2CCC2 527a_100000749019_100015207166 [0,0,0,1,0,1|2,0,0]=4 29641 B16R2.44148 O=C(CSc1ccccc1)CC2CCC2 1458a_100000211596_100000763275 [0,0,0,1,0,1|1,0,0]=3 29642 B16R2.44148 O=C(CSc1ccccc1)CC2CCO2 1458a_100000211596_100000103362 [0,0,0,1,0,1|2,0,0]=4 29643 B16R2.44148 O=C(CSc1ccccc1)CC2COC2 1458a_100000211596_100010264016 [0,0,0,1,0,1|2,0,0]=4 29644 B16R2.44148 O=C(CSc1ccccc1)NC2CCC2 11a_100000749019_100000211596 [0,0,0,1,0,1|1,0,0]=3 29645 B16R2.44148 O=C(CSc1ccccc1)NC2CCC2 1626a_100000749019_100000211596 [0,0,0,1,0,1|1,0,0]=3 29646 B16R2.44148 O=C(CSc1ccccc1)NC2CCC2 240690a_100000749019_100000211596 [0,0,0,1,0,1|1,0,0]=3 29647 B16R2.44148 O=C(CSc1ccccc1)NC2CCC2 527a_100000749019_100000211596 [0,0,0,1,0,1|1,0,0]=3 29648 B16R2.44148 O=C(CSc1ccccc1)NC2COC2 11a_100016991112_100000211596 [0,0,0,1,0,1|2,0,0]=4 29649 B16R2.44148 O=C(CSc1ccccc1)NC2COC2 1626a_100016991112_100000211596 [0,0,0,1,0,1|2,0,0]=4 29650 B16R2.44148 O=C(CSc1ccccc1)NC2COC2 240690a_100016991112_100000211596 [0,0,0,1,0,1|2,0,0]=4 29651 B16R2.44148 O=C(CSc1ccccc1)NC2COC2 527a_100016991112_100000211596 [0,0,0,1,0,1|2,0,0]=4 29652 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 11a_100016994217_100000211596 [0,0,0,1,0,1|2,0,0]=4 29653 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 1626a_100016994217_100000211596 [0,0,0,1,0,1|2,0,0]=4 29654 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 240690a_100016994217_100000211596 [0,0,0,1,0,1|2,0,0]=4 29655 B16R2.44148 O=C(CSc1ccccc1)NC2CSC2 527a_100016994217_100000211596 [0,0,0,1,0,1|2,0,0]=4 29656 B16R2.44148 O=C(CSc1ccccn1)CC2CCC2 1458a_100000156281_100000763275 [0,0,0,1,0,1|2,0,0]=4 29657 B16R2.44148 O=C(CSc1ccccn1)NC2CCC2 11a_100000749019_100000156281 [0,0,0,1,0,1|2,0,0]=4 29658 B16R2.44148 O=C(CSc1ccccn1)NC2CCC2 240690a_100000749019_100000156281 [0,0,0,1,0,1|2,0,0]=4 29659 B16R2.44148 O=C(CSc1ccccn1)NC2CCC2 527a_100000749019_100000156281 [0,0,0,1,0,1|2,0,0]=4 29660 B16R2.44148 O=C(CSc1ccncc1)CC2CCC2 1458a_100000211328_100000763275 [0,0,0,1,0,1|2,0,0]=4 29661 B16R2.44148 O=C(CSc1ccncc1)NC2CCC2 11a_100000749019_100000211328 [0,0,0,1,0,1|2,0,0]=4 29662 B16R2.44148 O=C(CSc1ccncc1)NC2CCC2 1626a_100000749019_100000211328 [0,0,0,1,0,1|2,0,0]=4 29663 B16R2.44148 O=C(CSc1ccncc1)NC2CCC2 240690a_100000749019_100000211328 [0,0,0,1,0,1|2,0,0]=4 29664 B16R2.44148 O=C(CSc1ccncc1)NC2CCC2 527a_100000749019_100000211328 [0,0,0,1,0,1|2,0,0]=4 29665 B16R2.44148 O=C(NCc1ccccc1)NC2CCC2 2708a_100015324214_100000749019 [0,0,0,1,0,1|1,0,0]=3 29666 B16R2.44148 O=C(NCc1ccccc1)NC2CCC2 273464a_100000749019_100015324214 [0,0,0,1,0,1|1,0,0]=3 29667 B16R2.44148 O=C(NCc1ccccc1)NC2CCC2 273464a_100015324214_100000749019 [0,0,0,1,0,1|1,0,0]=3 29668 B16R2.44148 O=C(NCc1ccccc1)NC2CCC2 512a_100000749019_100015324214 [0,0,0,1,0,1|1,0,0]=3 29669 B16R2.44148 O=C(NCc1ccccc1)NC2CCC2 512a_100015324214_100000749019 [0,0,0,1,0,1|1,0,0]=3 29670 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 2708a_100015324214_100016991112 [0,0,0,1,0,1|2,0,0]=4 29671 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 2708a_100016991112_100015324214 [0,0,0,1,0,1|2,0,0]=4 29672 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 273464a_100015324214_100016991112 [0,0,0,1,0,1|2,0,0]=4 29673 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 273464a_100016991112_100015324214 [0,0,0,1,0,1|2,0,0]=4 29674 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 512a_100015324214_100016991112 [0,0,0,1,0,1|2,0,0]=4 29675 B16R2.44148 O=C(NCc1ccccc1)NC2COC2 512a_100016991112_100015324214 [0,0,0,1,0,1|2,0,0]=4 29676 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 2708a_100015324214_100016994217 [0,0,0,1,0,1|2,0,0]=4 29677 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 2708a_100016994217_100015324214 [0,0,0,1,0,1|2,0,0]=4 29678 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 273464a_100015324214_100016994217 [0,0,0,1,0,1|2,0,0]=4 29679 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 273464a_100016994217_100015324214 [0,0,0,1,0,1|2,0,0]=4 29680 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 512a_100015324214_100016994217 [0,0,0,1,0,1|2,0,0]=4 29681 B16R2.44148 O=C(NCc1ccccc1)NC2CSC2 512a_100016994217_100015324214 [0,0,0,1,0,1|2,0,0]=4 29682 B16R2.44148 O=C(NCc1ccccn1)NC2CCC2 2708a_100000210449_100000749019 [0,0,0,1,0,1|2,0,0]=4 29683 B16R2.44148 O=C(NCc1ccccn1)NC2CCC2 273464a_100000210449_100000749019 [0,0,0,1,0,1|2,0,0]=4 29684 B16R2.44148 O=C(NCc1ccccn1)NC2CCC2 273464a_100000749019_100000210449 [0,0,0,1,0,1|2,0,0]=4 29685 B16R2.44148 O=C(NCc1ccccn1)NC2CCC2 512a_100000749019_100000210449 [0,0,0,1,0,1|2,0,0]=4 29686 B16R2.44148 O=C(NCc1cccnc1)NC2CCC2 2708a_100000210453_100000749019 [0,0,0,1,0,1|2,0,0]=4 29687 B16R2.44148 O=C(NCc1cccnc1)NC2CCC2 273464a_100000210453_100000749019 [0,0,0,1,0,1|2,0,0]=4 29688 B16R2.44148 O=C(NCc1cccnc1)NC2CCC2 273464a_100000749019_100000210453 [0,0,0,1,0,1|2,0,0]=4 29689 B16R2.44148 O=C(NCc1cccnc1)NC2CCC2 512a_100000210453_100000749019 [0,0,0,1,0,1|2,0,0]=4 29690 B16R2.44148 O=C(NCc1cccnc1)NC2CCC2 512a_100000749019_100000210453 [0,0,0,1,0,1|2,0,0]=4 29691 B16R2.44148 O=C(NCc1ccncc1)NC2CCC2 2708a_100000210450_100000749019 [0,0,0,1,0,1|2,0,0]=4 29692 B16R2.44148 O=C(NCc1ccncc1)NC2CCC2 273464a_100000210450_100000749019 [0,0,0,1,0,1|2,0,0]=4 29693 B16R2.44148 O=C(NCc1ccncc1)NC2CCC2 273464a_100000749019_100000210450 [0,0,0,1,0,1|2,0,0]=4 29694 B16R2.44148 O=C(NCc1ccncc1)NC2CCC2 512a_100000749019_100000210450 [0,0,0,1,0,1|2,0,0]=4 29695 B16R2.44148 O=C(NNc1ccccc1)NC2CCC2 273464a_100000749019_100015195140 [0,0,0,1,0,1|2,0,0]=4 29696 B16R2.44148 O=C(NNc1ccccc1)NC2CCC2 512a_100000749019_100015195140 [0,0,0,1,0,1|2,0,0]=4 29697 B16R2.44153 CC(COc1ccccc1)OCC2CC2 34a_100000210911_100000742324 [0,0,0,1,0,1|1,0,1]=4 29698 B16R2.44153 CC(COc1ccccc1)OCC2CC2 7a_100000210911_100000742324 [0,0,0,1,0,1|1,0,1]=4 29699 B16R2.44153 C[C@@H](CCc1ccccc1)OCC2CC2 34a_100009815974_100000742324 [0,0,0,1,0,1|1,0,1]=4 29700 B16R2.44153 C[C@@H](CCc1ccccc1)OCC2CC2 7a_100009815974_100000742324 [0,0,0,1,0,1|1,0,1]=4 29701 B16R2.44153 O=C(C#Cc1ccccc1)CCC2CC2 1458a_100000736102_100000694398 [0,0,0,1,0,1|1,0,1]=4 29702 B16R2.44153 O=C(C#Cc1ccccc1)NCC2CC2 240690a_100000735609_100000736102 [0,0,0,1,0,1|1,0,1]=4 29703 B16R2.44153 O=C(C=CC1CC1)CCc2ccccc2 1458a_100102529529_100000765856 [0,0,0,1,0,1|1,0,1]=4 29704 B16R2.44153 O=C(C=CC1CC1)NCc2ccccc2 11a_100015324214_100102529529 [0,0,0,1,0,1|1,0,1]=4 29705 B16R2.44153 O=C(C=CC1CC1)NCc2ccccc2 1626a_100015324214_100102529529 [0,0,0,1,0,1|1,0,1]=4 29706 B16R2.44153 O=C(C=CC1CC1)NCc2ccccc2 240690a_100015324214_100102529529 [0,0,0,1,0,1|1,0,1]=4 29707 B16R2.44153 O=C(C=Cc1ccccc1)CCC2CC2 1458a_100000210462_100000694398 [0,0,0,1,0,1|1,0,1]=4 29708 B16R2.44153 O=C(C=Cc1ccccc1)NCC2CC2 11a_100000735609_100000210462 [0,0,0,1,0,1|1,0,1]=4 29709 B16R2.44153 O=C(C=Cc1ccccc1)NCC2CC2 1626a_100000735609_100000210462 [0,0,0,1,0,1|1,0,1]=4 29710 B16R2.44153 O=C(CCC1CC1)COc2ccccc2 1458a_100000186222_100000694398 [0,0,0,1,0,1|1,0,0]=3 29711 B16R2.44153 O=C(CCC1CC1)COc2ccccn2 1458a_100102699861_100000694398 [0,0,0,1,0,1|2,0,0]=4 29712 B16R2.44153 O=C(CCC1CC1)COc2cccnc2 1458a_100015207166_100000694398 [0,0,0,1,0,1|2,0,0]=4 29713 B16R2.44153 O=C(CCC1CC1)CSc2ccccc2 1458a_100000211596_100000694398 [0,0,0,1,0,1|1,0,0]=3 29714 B16R2.44153 O=C(CCC1CC1)CSc2ccccn2 1458a_100000156281_100000694398 [0,0,0,1,0,1|2,0,0]=4 29715 B16R2.44153 O=C(CCC1CC1)CSc2ccncc2 1458a_100000211328_100000694398 [0,0,0,1,0,1|2,0,0]=4 29716 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 11a_100015324214_100000756386 [0,0,0,1,0,1|1,0,0]=3 29717 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 1626a_100015324214_100000756386 [0,0,0,1,0,1|1,0,0]=3 29718 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 240690a_100015324214_100000756386 [0,0,0,1,0,1|1,0,0]=3 29719 B16R2.44153 O=C(CCC1CC1)NCc2ccccc2 527a_100015324214_100000756386 [0,0,0,1,0,1|1,0,0]=3 29720 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 11a_100000210449_100000756386 [0,0,0,1,0,1|2,0,0]=4 29721 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 1626a_100000210449_100000756386 [0,0,0,1,0,1|2,0,0]=4 29722 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 240690a_100000210449_100000756386 [0,0,0,1,0,1|2,0,0]=4 29723 B16R2.44153 O=C(CCC1CC1)NCc2ccccn2 527a_100000210449_100000756386 [0,0,0,1,0,1|2,0,0]=4 29724 B16R2.44153 O=C(CCC1CC1)NCc2cccnc2 11a_100000210453_100000756386 [0,0,0,1,0,1|2,0,0]=4 29725 B16R2.44153 O=C(CCC1CC1)NCc2cccnc2 240690a_100000210453_100000756386 [0,0,0,1,0,1|2,0,0]=4 29726 B16R2.44153 O=C(CCC1CC1)NCc2cccnc2 527a_100000210453_100000756386 [0,0,0,1,0,1|2,0,0]=4 29727 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 11a_100000210450_100000756386 [0,0,0,1,0,1|2,0,0]=4 29728 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 1626a_100000210450_100000756386 [0,0,0,1,0,1|2,0,0]=4 29729 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 240690a_100000210450_100000756386 [0,0,0,1,0,1|2,0,0]=4 29730 B16R2.44153 O=C(CCC1CC1)NCc2ccncc2 527a_100000210450_100000756386 [0,0,0,1,0,1|2,0,0]=4 29731 B16R2.44153 O=C(CCC1CC1)NNc2ccccc2 22a_100015195140_100000756386 [0,0,0,1,0,1|2,0,0]=4 29732 B16R2.44153 O=C(CCC1CO1)COc2ccccc2 1458a_100000186222_100000732470 [0,0,0,1,0,1|2,0,0]=4 29733 B16R2.44153 O=C(CCC1CO1)CSc2ccccc2 1458a_100000211596_100000732470 [0,0,0,1,0,1|2,0,0]=4 29734 B16R2.44153 O=C(CCc1ccccc1)CCC2CC2 1458a_100000185753_100000694398 [0,0,0,1,0,1|1,0,0]=3 29735 B16R2.44153 O=C(CCc1ccccc1)CCC2CC2 1458a_100000756386_100000765856 [0,0,0,1,0,1|1,0,0]=3 29736 B16R2.44153 O=C(CCc1ccccc1)CCC2CO2 1458a_100000185753_100000732470 [0,0,0,1,0,1|2,0,0]=4 29737 B16R2.44153 O=C(CCc1ccccc1)CNC2CC2 34a_100000212008_100012361361 [0,0,0,1,0,1|2,0,0]=4 29738 B16R2.44153 O=C(CCc1ccccc1)CSC2CC2 62a_100012361361_100000211595 [0,0,0,1,0,1|2,0,0]=4 29739 B16R2.44153 O=C(CCc1ccccc1)NCC2CC2 11a_100000735609_100000185753 [0,0,0,1,0,1|1,0,0]=3 29740 B16R2.44153 O=C(CCc1ccccc1)NCC2CC2 1626a_100000735609_100000185753 [0,0,0,1,0,1|1,0,0]=3 29741 B16R2.44153 O=C(CCc1ccccc1)NCC2CC2 240690a_100000735609_100000185753 [0,0,0,1,0,1|1,0,0]=3 29742 B16R2.44153 O=C(CCc1ccccc1)NCC2CC2 527a_100000735609_100000185753 [0,0,0,1,0,1|1,0,0]=3 29743 B16R2.44153 O=C(CCc1ccccc1)NNC2CC2 22a_100000701032_100000185753 [0,0,0,1,0,1|2,0,0]=4 29744 B16R2.44153 O=C(CCc1ccccn1)CCC2CC2 1458a_100000756386_100015183660 [0,0,0,1,0,1|2,0,0]=4 29745 B16R2.44153 O=C(CCc1ccccn1)CCC2CC2 1458a_100015195070_100000694398 [0,0,0,1,0,1|2,0,0]=4 29746 B16R2.44153 O=C(CCc1ccccn1)NCC2CC2 11a_100000735609_100015195070 [0,0,0,1,0,1|2,0,0]=4 29747 B16R2.44153 O=C(CCc1ccccn1)NCC2CC2 240690a_100000735609_100015195070 [0,0,0,1,0,1|2,0,0]=4 29748 B16R2.44153 O=C(CCc1ccccn1)NCC2CC2 527a_100000735609_100015195070 [0,0,0,1,0,1|2,0,0]=4 29749 B16R2.44153 O=C(CCc1cccnc1)CCC2CC2 1458a_100000198484_100000694398 [0,0,0,1,0,1|2,0,0]=4 29750 B16R2.44153 O=C(CCc1cccnc1)CCC2CC2 1458a_100000756386_200011713674 [0,0,0,1,0,1|2,0,0]=4 29751 B16R2.44153 O=C(CCc1cccnc1)NCC2CC2 11a_100000735609_100000198484 [0,0,0,1,0,1|2,0,0]=4 29752 B16R2.44153 O=C(CCc1cccnc1)NCC2CC2 1626a_100000735609_100000198484 [0,0,0,1,0,1|2,0,0]=4 29753 B16R2.44153 O=C(CCc1cccnc1)NCC2CC2 240690a_100000735609_100000198484 [0,0,0,1,0,1|2,0,0]=4 29754 B16R2.44153 O=C(CCc1cccnc1)NCC2CC2 527a_100000735609_100000198484 [0,0,0,1,0,1|2,0,0]=4 29755 B16R2.44153 O=C(CCc1ccncc1)CCC2CC2 1458a_100000756386_100000723409 [0,0,0,1,0,1|2,0,0]=4 29756 B16R2.44153 O=C(CCc1ccncc1)CCC2CC2 1458a_100011225043_100000694398 [0,0,0,1,0,1|2,0,0]=4 29757 B16R2.44153 O=C(CCc1ccncc1)NCC2CC2 11a_100000735609_100011225043 [0,0,0,1,0,1|2,0,0]=4 29758 B16R2.44153 O=C(CCc1ccncc1)NCC2CC2 240690a_100000735609_100011225043 [0,0,0,1,0,1|2,0,0]=4 29759 B16R2.44153 O=C(CCc1ccncc1)NCC2CC2 527a_100000735609_100011225043 [0,0,0,1,0,1|2,0,0]=4 29760 B16R2.44153 O=C(CNC1CC1)NCc2ccccc2 34a_100000212008_100000183539 [0,0,0,1,0,1|2,0,0]=4 29761 B16R2.44153 O=C(CNC1CC1)OCc2ccccc2 34a_100000212008_100000753625 [0,0,0,1,0,1|2,0,0]=4 29762 B16R2.44153 O=C(COc1ccccc1)NCC2CC2 11a_100000735609_100000186222 [0,0,0,1,0,1|1,0,0]=3 29763 B16R2.44153 O=C(COc1ccccc1)NCC2CC2 1626a_100000735609_100000186222 [0,0,0,1,0,1|1,0,0]=3 29764 B16R2.44153 O=C(COc1ccccc1)NCC2CC2 240690a_100000735609_100000186222 [0,0,0,1,0,1|1,0,0]=3 29765 B16R2.44153 O=C(COc1ccccc1)NCC2CC2 527a_100000735609_100000186222 [0,0,0,1,0,1|1,0,0]=3 29766 B16R2.44153 O=C(COc1ccccc1)NNC2CC2 22a_100000701032_100000186222 [0,0,0,1,0,1|2,0,0]=4 29767 B16R2.44153 O=C(COc1ccccn1)NCC2CC2 1626a_100000735609_100102699861 [0,0,0,1,0,1|2,0,0]=4 29768 B16R2.44153 O=C(COc1ccccn1)NCC2CC2 240690a_100000735609_100102699861 [0,0,0,1,0,1|2,0,0]=4 29769 B16R2.44153 O=C(COc1ccccn1)NCC2CC2 527a_100000735609_100102699861 [0,0,0,1,0,1|2,0,0]=4 29770 B16R2.44153 O=C(COc1cccnc1)NCC2CC2 11a_100000735609_100015207166 [0,0,0,1,0,1|2,0,0]=4 29771 B16R2.44153 O=C(COc1cccnc1)NCC2CC2 1626a_100000735609_100015207166 [0,0,0,1,0,1|2,0,0]=4 29772 B16R2.44153 O=C(COc1cccnc1)NCC2CC2 240690a_100000735609_100015207166 [0,0,0,1,0,1|2,0,0]=4 29773 B16R2.44153 O=C(COc1cccnc1)NCC2CC2 527a_100000735609_100015207166 [0,0,0,1,0,1|2,0,0]=4 29774 B16R2.44153 O=C(CSC1CC1)NCc2ccccc2 62a_100000183539_100000211595 [0,0,0,1,0,1|2,0,0]=4 29775 B16R2.44153 O=C(CSC1CC1)OCc2ccccc2 62a_100000753625_100000211595 [0,0,0,1,0,1|2,0,0]=4 29776 B16R2.44153 O=C(CSc1ccccc1)NCC2CC2 11a_100000735609_100000211596 [0,0,0,1,0,1|1,0,0]=3 29777 B16R2.44153 O=C(CSc1ccccc1)NCC2CC2 1626a_100000735609_100000211596 [0,0,0,1,0,1|1,0,0]=3 29778 B16R2.44153 O=C(CSc1ccccc1)NCC2CC2 240690a_100000735609_100000211596 [0,0,0,1,0,1|1,0,0]=3 29779 B16R2.44153 O=C(CSc1ccccc1)NCC2CC2 527a_100000735609_100000211596 [0,0,0,1,0,1|1,0,0]=3 29780 B16R2.44153 O=C(CSc1ccccc1)NNC2CC2 22a_100000701032_100000211596 [0,0,0,1,0,1|2,0,0]=4 29781 B16R2.44153 O=C(CSc1ccccn1)NCC2CC2 11a_100000735609_100000156281 [0,0,0,1,0,1|2,0,0]=4 29782 B16R2.44153 O=C(CSc1ccccn1)NCC2CC2 240690a_100000735609_100000156281 [0,0,0,1,0,1|2,0,0]=4 29783 B16R2.44153 O=C(CSc1ccccn1)NCC2CC2 527a_100000735609_100000156281 [0,0,0,1,0,1|2,0,0]=4 29784 B16R2.44153 O=C(CSc1ccncc1)NCC2CC2 11a_100000735609_100000211328 [0,0,0,1,0,1|2,0,0]=4 29785 B16R2.44153 O=C(CSc1ccncc1)NCC2CC2 1626a_100000735609_100000211328 [0,0,0,1,0,1|2,0,0]=4 29786 B16R2.44153 O=C(CSc1ccncc1)NCC2CC2 240690a_100000735609_100000211328 [0,0,0,1,0,1|2,0,0]=4 29787 B16R2.44153 O=C(CSc1ccncc1)NCC2CC2 527a_100000735609_100000211328 [0,0,0,1,0,1|2,0,0]=4 29788 B16R2.44153 O=C(NCC1CC1)NNc2ccccc2 273464a_100000735609_100015195140 [0,0,0,1,0,1|2,0,0]=4 29789 B16R2.44153 O=C(NCC1CC1)NNc2ccccc2 512a_100000735609_100015195140 [0,0,0,1,0,1|2,0,0]=4 29790 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 2708a_100000735609_100015324214 [0,0,0,1,0,1|1,0,0]=3 29791 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 2708a_100015324214_100000735609 [0,0,0,1,0,1|1,0,0]=3 29792 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 273464a_100000735609_100015324214 [0,0,0,1,0,1|1,0,0]=3 29793 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 273464a_100015324214_100000735609 [0,0,0,1,0,1|1,0,0]=3 29794 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 512a_100000735609_100015324214 [0,0,0,1,0,1|1,0,0]=3 29795 B16R2.44153 O=C(NCc1ccccc1)NCC2CC2 512a_100015324214_100000735609 [0,0,0,1,0,1|1,0,0]=3 29796 B16R2.44153 O=C(NCc1ccccc1)NNC2CC2 273464a_100015324214_100000701032 [0,0,0,1,0,1|2,0,0]=4 29797 B16R2.44153 O=C(NCc1ccccc1)NNC2CC2 512a_100000701032_100015324214 [0,0,0,1,0,1|2,0,0]=4 29798 B16R2.44153 O=C(NCc1ccccc1)NNC2CC2 512a_100015324214_100000701032 [0,0,0,1,0,1|2,0,0]=4 29799 B16R2.44153 O=C(NCc1ccccn1)NCC2CC2 2708a_100000210449_100000735609 [0,0,0,1,0,1|2,0,0]=4 29800 B16R2.44153 O=C(NCc1ccccn1)NCC2CC2 2708a_100000735609_100000210449 [0,0,0,1,0,1|2,0,0]=4 29801 B16R2.44153 O=C(NCc1ccccn1)NCC2CC2 273464a_100000210449_100000735609 [0,0,0,1,0,1|2,0,0]=4 29802 B16R2.44153 O=C(NCc1ccccn1)NCC2CC2 273464a_100000735609_100000210449 [0,0,0,1,0,1|2,0,0]=4 29803 B16R2.44153 O=C(NCc1ccccn1)NCC2CC2 512a_100000735609_100000210449 [0,0,0,1,0,1|2,0,0]=4 29804 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 2708a_100000210453_100000735609 [0,0,0,1,0,1|2,0,0]=4 29805 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 2708a_100000735609_100000210453 [0,0,0,1,0,1|2,0,0]=4 29806 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 273464a_100000210453_100000735609 [0,0,0,1,0,1|2,0,0]=4 29807 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 273464a_100000735609_100000210453 [0,0,0,1,0,1|2,0,0]=4 29808 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 512a_100000210453_100000735609 [0,0,0,1,0,1|2,0,0]=4 29809 B16R2.44153 O=C(NCc1cccnc1)NCC2CC2 512a_100000735609_100000210453 [0,0,0,1,0,1|2,0,0]=4 29810 B16R2.44153 O=C(NCc1ccncc1)NCC2CC2 2708a_100000210450_100000735609 [0,0,0,1,0,1|2,0,0]=4 29811 B16R2.44153 O=C(NCc1ccncc1)NCC2CC2 2708a_100000735609_100000210450 [0,0,0,1,0,1|2,0,0]=4 29812 B16R2.44153 O=C(NCc1ccncc1)NCC2CC2 273464a_100000210450_100000735609 [0,0,0,1,0,1|2,0,0]=4 29813 B16R2.44153 O=C(NCc1ccncc1)NCC2CC2 273464a_100000735609_100000210450 [0,0,0,1,0,1|2,0,0]=4 29814 B16R2.44153 O=C(NCc1ccncc1)NCC2CC2 512a_100000735609_100000210450 [0,0,0,1,0,1|2,0,0]=4 29815 B16R2.23 CCN1CCOC(C1)Cc2ccccc2 2230a_100000697294_100000210202 [0,1,0,1,0,0|1,0,1]=4 29816 B16R2.23 CCN1CCOC(C1)Cc2ccccc2 269982a_100000697294_100000204670 [0,1,0,1,0,0|1,0,1]=4 29817 B16R2.23 CCN1CCOC(C1)Cc2ccccc2 34a_100000697294_100000210202 [0,1,0,1,0,0|1,0,1]=4 29818 B16R2.88 O=C(C[n+]1ccccc1)C2CCCCC2 1458a_200000086051_100000210327 [0,1,0,1,0,0|2,0,0]=4 29819 B16R2.88 O=C(C[n+]1ccccc1)C2CCCOC2 1458a_200000086051_100000693364 [0,1,0,1,0,0|2,0,0]=4 29820 B16R2.88 O=C(C[n+]1ccccc1)C2CCOCC2 1458a_200000086051_100011324220 [0,1,0,1,0,0|2,0,0]=4 29821 B16R2.88 O=C(C[n+]1ccccc1)N2CCCOC2 11a_100000131196_200000086051 [0,1,0,1,0,0|2,0,0]=4 29822 B16R2.88 O=C(C[n+]1ccccc1)N2CCCOC2 240690a_100000131196_200000086051 [0,1,0,1,0,0|2,0,0]=4 29823 B16R2.88 O=C(C[n+]1ccccc1)N2CCOCC2 11a_100015191051_200000086051 [0,1,0,1,0,0|2,0,0]=4 29824 B16R2.88 O=C(C[n+]1ccccc1)N2CCOCC2 240690a_100015191051_200000086051 [0,1,0,1,0,0|2,0,0]=4 29825 B16R2.88 O=C(C[n+]1ccccc1)N2CCOCC2 527a_100015191051_200000086051 [0,1,0,1,0,0|2,0,0]=4 29826 B16R2.88 O=C(C[n+]1ccccc1)N2CCSCC2 11a_100000737611_200000086051 [0,1,0,1,0,0|2,0,0]=4 29827 B16R2.88 O=C(C[n+]1ccccc1)N2CCSCC2 240690a_100000737611_200000086051 [0,1,0,1,0,0|2,0,0]=4 29828 B16R2.88 O=C(C[n+]1ccccc1)N2CCSCC2 527a_100000737611_200000086051 [0,1,0,1,0,0|2,0,0]=4 29829 B16R2.88 O=C(Cc1ccccc1)C2=CCCCC2 1458a_100000765259_100015291786 [0,1,0,1,0,0|1,0,0]=3 29830 B16R2.88 O=C(Cc1ccccc1)C2=CCCCO2 1458a_100000764163_100015291786 [0,1,0,1,0,0|0,0,1]=3 29831 B16R2.88 O=C(Cc1ccccc1)C2=COCCC2 1458a_100000749935_100015291786 [0,1,0,1,0,0|1,0,1]=4 29832 B16R2.88 O=C(Cc1ccccc1)C2=COCCO2 1458a_100000008702_100015291786 [0,1,0,1,0,0|1,0,1]=4 29833 B16R2.88 O=C(Cc1ccccc1)C2CCCCC2 1458a_100000210647_100015291786 [0,1,0,1,0,0|1,0,0]=3 29834 B16R2.88 O=C(Cc1ccccc1)C2CCCCO2 1458a_100000748299_100015291786 [0,1,0,1,0,0|0,0,0]=2 29835 B16R2.88 O=C(Cc1ccccc1)C2CCCOC2 1458a_100000741522_100015291786 [0,1,0,1,0,0|1,0,0]=3 29836 B16R2.88 O=C(Cc1ccccc1)C2CCOCC2 1458a_100000195482_100015291786 [0,1,0,1,0,0|1,0,0]=3 29837 B16R2.88 O=C(Cc1ccccc1)C2CCSCC2 1458a_100000755232_100015291786 [0,1,0,1,0,0|1,0,0]=3 29838 B16R2.88 O=C(Cc1ccccc1)C2COCCO2 1458a_100000045528_100015291786 [0,1,0,1,0,0|1,0,0]=3 29839 B16R2.88 O=C(Cc1ccccc1)C2SCCCS2 1458a_100000028545_100015291786 [0,1,0,1,0,0|1,1,0]=4 29840 B16R2.88 O=C(Cc1ccccc1)[C@H]2CC=CCC2 1458a_100009820709_100015291786 [0,1,0,1,0,0|1,0,1]=4 29841 B16R2.88 O=C(Cc1ccccn1)C2=CCCCC2 1458a_100000765259_100000721315 [0,1,0,1,0,0|2,0,0]=4 29842 B16R2.88 O=C(Cc1ccccn1)C2=CCCCO2 1458a_100000764163_100000721315 [0,1,0,1,0,0|1,0,1]=4 29843 B16R2.88 O=C(Cc1ccccn1)C2CCCCC2 1458a_100000210647_100000721315 [0,1,0,1,0,0|2,0,0]=4 29844 B16R2.88 O=C(Cc1ccccn1)C2CCCCC2 1458a_100000233486_100000210327 [0,1,0,1,0,0|2,0,0]=4 29845 B16R2.88 O=C(Cc1ccccn1)C2CCCCO2 1458a_100000748299_100000721315 [0,1,0,1,0,0|1,0,0]=3 29846 B16R2.88 O=C(Cc1ccccn1)C2CCCOC2 1458a_100000233486_100000693364 [0,1,0,1,0,0|2,0,0]=4 29847 B16R2.88 O=C(Cc1ccccn1)C2CCCOC2 1458a_100000741522_100000721315 [0,1,0,1,0,0|2,0,0]=4 29848 B16R2.88 O=C(Cc1ccccn1)C2CCOCC2 1458a_100000195482_100000721315 [0,1,0,1,0,0|2,0,0]=4 29849 B16R2.88 O=C(Cc1ccccn1)C2CCOCC2 1458a_100000233486_100011324220 [0,1,0,1,0,0|2,0,0]=4 29850 B16R2.88 O=C(Cc1ccccn1)C2CCSCC2 1458a_100000755232_100000721315 [0,1,0,1,0,0|2,0,0]=4 29851 B16R2.88 O=C(Cc1ccccn1)C2COCCO2 1458a_100000045528_100000721315 [0,1,0,1,0,0|2,0,0]=4 29852 B16R2.88 O=C(Cc1ccccn1)N2CCCOC2 11a_100000131196_100000233486 [0,1,0,1,0,0|2,0,0]=4 29853 B16R2.88 O=C(Cc1ccccn1)N2CCOCC2 11a_100015191051_100000233486 [0,1,0,1,0,0|2,0,0]=4 29854 B16R2.88 O=C(Cc1ccccn1)N2CCSCC2 11a_100000737611_100000233486 [0,1,0,1,0,0|2,0,0]=4 29855 B16R2.88 O=C(Cc1cccnc1)C2=CCCCC2 1458a_100000765259_100000733263 [0,1,0,1,0,0|2,0,0]=4 29856 B16R2.88 O=C(Cc1cccnc1)C2=CCCCO2 1458a_100000764163_100000733263 [0,1,0,1,0,0|1,0,1]=4 29857 B16R2.88 O=C(Cc1cccnc1)C2CCCCC2 1458a_100000210647_100000733263 [0,1,0,1,0,0|2,0,0]=4 29858 B16R2.88 O=C(Cc1cccnc1)C2CCCCC2 1458a_100000737805_100000210327 [0,1,0,1,0,0|2,0,0]=4 29859 B16R2.88 O=C(Cc1cccnc1)C2CCCCO2 1458a_100000748299_100000733263 [0,1,0,1,0,0|1,0,0]=3 29860 B16R2.88 O=C(Cc1cccnc1)C2CCCOC2 1458a_100000737805_100000693364 [0,1,0,1,0,0|2,0,0]=4 29861 B16R2.88 O=C(Cc1cccnc1)C2CCCOC2 1458a_100000741522_100000733263 [0,1,0,1,0,0|2,0,0]=4 29862 B16R2.88 O=C(Cc1cccnc1)C2CCOCC2 1458a_100000195482_100000733263 [0,1,0,1,0,0|2,0,0]=4 29863 B16R2.88 O=C(Cc1cccnc1)C2CCOCC2 1458a_100000737805_100011324220 [0,1,0,1,0,0|2,0,0]=4 29864 B16R2.88 O=C(Cc1cccnc1)C2CCSCC2 1458a_100000755232_100000733263 [0,1,0,1,0,0|2,0,0]=4 29865 B16R2.88 O=C(Cc1cccnc1)C2COCCO2 1458a_100000045528_100000733263 [0,1,0,1,0,0|2,0,0]=4 29866 B16R2.88 O=C(Cc1cccnc1)N2CCCOC2 11a_100000131196_100000737805 [0,1,0,1,0,0|2,0,0]=4 29867 B16R2.88 O=C(Cc1cccnc1)N2CCCOC2 240690a_100000131196_100000737805 [0,1,0,1,0,0|2,0,0]=4 29868 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 11a_100015191051_100000737805 [0,1,0,1,0,0|2,0,0]=4 29869 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 240690a_100015191051_100000737805 [0,1,0,1,0,0|2,0,0]=4 29870 B16R2.88 O=C(Cc1cccnc1)N2CCOCC2 527a_100015191051_100000737805 [0,1,0,1,0,0|2,0,0]=4 29871 B16R2.88 O=C(Cc1cccnc1)N2CCSCC2 11a_100000737611_100000737805 [0,1,0,1,0,0|2,0,0]=4 29872 B16R2.88 O=C(Cc1cccnc1)N2CCSCC2 240690a_100000737611_100000737805 [0,1,0,1,0,0|2,0,0]=4 29873 B16R2.88 O=C(Cc1cccnc1)N2CCSCC2 527a_100000737611_100000737805 [0,1,0,1,0,0|2,0,0]=4 29874 B16R2.88 O=C(Cc1cccnn1)C2CCCCO2 1458a_100000748299_100016990269 [0,1,0,1,0,0|2,0,0]=4 29875 B16R2.88 O=C(Cc1ccncc1)C2=CCCCC2 1458a_100000765259_100000705612 [0,1,0,1,0,0|2,0,0]=4 29876 B16R2.88 O=C(Cc1ccncc1)C2=CCCCO2 1458a_100000764163_100000705612 [0,1,0,1,0,0|1,0,1]=4 29877 B16R2.88 O=C(Cc1ccncc1)C2CCCCC2 1458a_100000210647_100000705612 [0,1,0,1,0,0|2,0,0]=4 29878 B16R2.88 O=C(Cc1ccncc1)C2CCCCO2 1458a_100000748299_100000705612 [0,1,0,1,0,0|1,0,0]=3 29879 B16R2.88 O=C(Cc1ccncc1)C2CCCOC2 1458a_100000741522_100000705612 [0,1,0,1,0,0|2,0,0]=4 29880 B16R2.88 O=C(Cc1ccncc1)C2CCOCC2 1458a_100000195482_100000705612 [0,1,0,1,0,0|2,0,0]=4 29881 B16R2.88 O=C(Cc1ccncc1)C2CCSCC2 1458a_100000755232_100000705612 [0,1,0,1,0,0|2,0,0]=4 29882 B16R2.88 O=C(Cc1ccncc1)C2COCCO2 1458a_100000045528_100000705612 [0,1,0,1,0,0|2,0,0]=4 29883 B16R2.88 O=C(Cc1ccncc1)N2CCCOC2 11a_100000131196_100011201483 [0,1,0,1,0,0|2,0,0]=4 29884 B16R2.88 O=C(Cc1ccncc1)N2CCCOC2 240690a_100000131196_100011201483 [0,1,0,1,0,0|2,0,0]=4 29885 B16R2.88 O=C(Cc1ccncc1)N2CCOCC2 11a_100015191051_100011201483 [0,1,0,1,0,0|2,0,0]=4 29886 B16R2.88 O=C(Cc1ccncc1)N2CCOCC2 240690a_100015191051_100011201483 [0,1,0,1,0,0|2,0,0]=4 29887 B16R2.88 O=C(Cc1ccncc1)N2CCSCC2 11a_100000737611_100011201483 [0,1,0,1,0,0|2,0,0]=4 29888 B16R2.88 O=C(Cc1ccncc1)N2CCSCC2 240690a_100000737611_100011201483 [0,1,0,1,0,0|2,0,0]=4 29889 B16R2.88 O=C(Cc1cnccn1)C2CCCCO2 1458a_100000748299_100016995436 [0,1,0,1,0,0|2,0,0]=4 29890 B16R2.88 O=C(Cc1cncnc1)C2CCCCO2 1458a_100000748299_100015196519 [0,1,0,1,0,0|2,0,0]=4 29891 B16R2.88 O=C(Cc1ncccn1)C2CCCCO2 1458a_100000748299_100000703007 [0,1,0,1,0,0|2,0,0]=4 29892 B16R2.88 O=C(Nc1ccccc1)C2=CCCCC2 11a_100000106764_100000765259 [0,1,0,1,0,0|2,0,0]=4 29893 B16R2.88 O=C(Nc1ccccc1)C2=CCCCC2 1626a_100000106764_100000765259 [0,1,0,1,0,0|2,0,0]=4 29894 B16R2.88 O=C(Nc1ccccc1)C2=CCCCC2 22a_100000106764_100000765259 [0,1,0,1,0,0|2,0,0]=4 29895 B16R2.88 O=C(Nc1ccccc1)C2=CCCCC2 527a_100000106764_100000765259 [0,1,0,1,0,0|2,0,0]=4 29896 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 11a_100000106764_100000764163 [0,1,0,1,0,0|1,0,1]=4 29897 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 1626a_100000106764_100000764163 [0,1,0,1,0,0|1,0,1]=4 29898 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 22a_100000106764_100000764163 [0,1,0,1,0,0|1,0,1]=4 29899 B16R2.88 O=C(Nc1ccccc1)C2=CCCCO2 527a_100000106764_100000764163 [0,1,0,1,0,0|1,0,1]=4 29900 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 11a_100000106764_100000210647 [0,1,0,1,0,0|2,0,0]=4 29901 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 1626a_100000106764_100000210647 [0,1,0,1,0,0|2,0,0]=4 29902 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 22a_100000106764_100000210647 [0,1,0,1,0,0|2,0,0]=4 29903 B16R2.88 O=C(Nc1ccccc1)C2CCCCC2 527a_100000106764_100000210647 [0,1,0,1,0,0|2,0,0]=4 29904 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 11a_100000106764_100000748299 [0,1,0,1,0,0|1,0,0]=3 29905 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 1626a_100000106764_100000748299 [0,1,0,1,0,0|1,0,0]=3 29906 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 22a_100000106764_100000748299 [0,1,0,1,0,0|1,0,0]=3 29907 B16R2.88 O=C(Nc1ccccc1)C2CCCCO2 527a_100000106764_100000748299 [0,1,0,1,0,0|1,0,0]=3 29908 B16R2.88 O=C(Nc1ccccc1)C2CCCOC2 11a_100000106764_100000741522 [0,1,0,1,0,0|2,0,0]=4 29909 B16R2.88 O=C(Nc1ccccc1)C2CCCOC2 1626a_100000106764_100000741522 [0,1,0,1,0,0|2,0,0]=4 29910 B16R2.88 O=C(Nc1ccccc1)C2CCCOC2 22a_100000106764_100000741522 [0,1,0,1,0,0|2,0,0]=4 29911 B16R2.88 O=C(Nc1ccccc1)C2CCCOC2 527a_100000106764_100000741522 [0,1,0,1,0,0|2,0,0]=4 29912 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 11a_100000106764_100000195482 [0,1,0,1,0,0|2,0,0]=4 29913 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 1626a_100000106764_100000195482 [0,1,0,1,0,0|2,0,0]=4 29914 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 22a_100000106764_100000195482 [0,1,0,1,0,0|2,0,0]=4 29915 B16R2.88 O=C(Nc1ccccc1)C2CCOCC2 527a_100000106764_100000195482 [0,1,0,1,0,0|2,0,0]=4 29916 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 11a_100000106764_100000755232 [0,1,0,1,0,0|2,0,0]=4 29917 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 1626a_100000106764_100000755232 [0,1,0,1,0,0|2,0,0]=4 29918 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 22a_100000106764_100000755232 [0,1,0,1,0,0|2,0,0]=4 29919 B16R2.88 O=C(Nc1ccccc1)C2CCSCC2 527a_100000106764_100000755232 [0,1,0,1,0,0|2,0,0]=4 29920 B16R2.88 O=C(Nc1ccccc1)C2COCCO2 11a_100000106764_100000045528 [0,1,0,1,0,0|2,0,0]=4 29921 B16R2.88 O=C(Nc1ccccc1)C2COCCO2 1626a_100000106764_100000045528 [0,1,0,1,0,0|2,0,0]=4 29922 B16R2.88 O=C(Nc1ccccc1)C2COCCO2 22a_100000106764_100000045528 [0,1,0,1,0,0|2,0,0]=4 29923 B16R2.88 O=C(Nc1ccccc1)C2COCCO2 527a_100000106764_100000045528 [0,1,0,1,0,0|2,0,0]=4 29924 B16R2.88 O=C(Nc1ccccc1)N2CCOCC2 2430a_100000106764_100015191051 [0,1,0,1,0,0|2,0,0]=4 29925 B16R2.88 O=C(Nc1ccccc1)N2CCSCC2 2430a_100000106764_100000737611 [0,1,0,1,0,0|2,0,0]=4 29926 B16R2.278 CC1CCN1CC(=O)Cc2ccccc2 269982a_100000755817_100000233483 [0,1,0,1,0,0|1,0,0]=3 29927 B16R2.278 CC1CCN1CC(=O)Nc2ccccc2 269982a_100000755817_100000182850 [0,1,0,1,0,0|2,0,0]=4 29928 B16R2.278 CC1CCN1CC(=O)Nc2ccccc2 34a_100000755817_100000182850 [0,1,0,1,0,0|2,0,0]=4 29929 B16R2.278 CC1CCN1CC(=O)Oc2ccccc2 269982a_100000755817_100009813826 [0,1,0,1,0,0|2,0,0]=4 29930 B16R2.278 CC1CCN1CC(=O)Oc2ccccc2 34a_100000755817_100009813826 [0,1,0,1,0,0|2,0,0]=4 29931 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 34a_100000210269_200011218536 [0,1,0,1,0,0|1,0,1]=4 29932 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 34a_100000748627_100000179811 [0,1,0,1,0,0|1,0,1]=4 29933 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 7a_100000210269_200011218536 [0,1,0,1,0,0|1,0,1]=4 29934 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 7a_100000748627_100000179811 [0,1,0,1,0,0|1,0,1]=4 29935 B16R2.524 CC(Cc1ccccc1)OC2CCCO2 34a_100000085407_200011218536 [0,1,0,1,0,0|1,0,1]=4 29936 B16R2.524 CC(Cc1ccccc1)OC2CCOC2 34a_100000748627_100000690089 [0,1,0,1,0,0|1,0,1]=4 29937 B16R2.524 CC(Cc1ccccc1)OC2CCOC2 7a_100000748627_100000731011 [0,1,0,1,0,0|1,0,1]=4 29938 B16R2.524 CC(Cc1ccccc1)OC2CCSC2 7a_100011232664_200011218536 [0,1,0,1,0,0|1,0,1]=4 29939 B16R2.524 CC(Cc1ccccc1)O[C@H]2CCOC2 34a_100000717292_200011218536 [0,1,0,1,0,0|1,0,1]=4 29940 B16R2.524 O=C(C=C1CCCC1)Cc2ccccc2 1458a_100000743260_100015291786 [0,1,0,1,0,0|1,0,0]=3 29941 B16R2.524 O=C(C=C1CCCC1)Cc2ccccn2 1458a_100000743260_100000721315 [0,1,0,1,0,0|2,0,0]=4 29942 B16R2.524 O=C(C=C1CCCC1)Cc2cccnc2 1458a_100000743260_100000733263 [0,1,0,1,0,0|2,0,0]=4 29943 B16R2.524 O=C(C=C1CCCC1)Cc2ccncc2 1458a_100000743260_100000705612 [0,1,0,1,0,0|2,0,0]=4 29944 B16R2.524 O=C(C=C1CCCC1)Nc2ccccc2 11a_100000106764_100000743260 [0,1,0,1,0,0|2,0,0]=4 29945 B16R2.524 O=C(C=C1CCCC1)Nc2ccccc2 1626a_100000106764_100000743260 [0,1,0,1,0,0|2,0,0]=4 29946 B16R2.524 O=C(C=C1CCCC1)Nc2ccccc2 22a_100000106764_100000743260 [0,1,0,1,0,0|2,0,0]=4 29947 B16R2.524 O=C(C=C1CCCC1)Nc2ccccc2 527a_100000106764_100000743260 [0,1,0,1,0,0|2,0,0]=4 29948 B16R2.524 O=C(CC1=CCCC1)Cc2ccccc2 1458a_100000050221_100015291786 [0,1,0,1,0,0|1,0,1]=4 29949 B16R2.524 O=C(CC1CCCC1)C[n+]2ccccc2 1458a_200000086051_100000740388 [0,1,0,1,0,0|2,0,0]=4 29950 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 11a_100000106764_100000210891 [0,1,0,1,0,0|2,0,0]=4 29951 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 1626a_100000106764_100000210891 [0,1,0,1,0,0|2,0,0]=4 29952 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 22a_100000106764_100000210891 [0,1,0,1,0,0|2,0,0]=4 29953 B16R2.524 O=C(CC1CCCC1)Nc2ccccc2 527a_100000106764_100000210891 [0,1,0,1,0,0|2,0,0]=4 29954 B16R2.524 O=C(CC1CCCO1)C[n+]2ccccc2 1458a_200000086051_100000203698 [0,1,0,1,0,0|2,0,0]=4 29955 B16R2.524 O=C(CC1CCOC1)C[n+]2ccccc2 1458a_200000086051_100000702531 [0,1,0,1,0,0|2,0,0]=4 29956 B16R2.524 O=C(CC1CCOC1)Nc2ccccc2 11a_100000106764_100011218419 [0,1,0,1,0,0|2,0,0]=4 29957 B16R2.524 O=C(CC1CCOC1)Nc2ccccc2 1626a_100000106764_100011218419 [0,1,0,1,0,0|2,0,0]=4 29958 B16R2.524 O=C(CC1CCOC1)Nc2ccccc2 22a_100000106764_100011218419 [0,1,0,1,0,0|2,0,0]=4 29959 B16R2.524 O=C(CC1CCOC1)Nc2ccccc2 527a_100000106764_100011218419 [0,1,0,1,0,0|2,0,0]=4 29960 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 2230a_100000188435_100000182850 [0,1,0,1,0,0|2,0,0]=4 29961 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 22a_100000106764_100000740243 [0,1,0,1,0,0|2,0,0]=4 29962 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 269982a_100000188435_100000182850 [0,1,0,1,0,0|2,0,0]=4 29963 B16R2.524 O=C(CN1CCCC1)Nc2ccccc2 527a_100000106764_100000740243 [0,1,0,1,0,0|2,0,0]=4 29964 B16R2.524 O=C(CN1CCCC1)Oc2ccccc2 2230a_100000188435_100009813826 [0,1,0,1,0,0|2,0,0]=4 29965 B16R2.524 O=C(CN1CCCC1)Oc2ccccc2 269982a_100000188435_100009813826 [0,1,0,1,0,0|2,0,0]=4 29966 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 11a_100000211070_200000086051 [0,1,0,1,0,0|2,0,0]=4 29967 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 240690a_100000211070_200000086051 [0,1,0,1,0,0|2,0,0]=4 29968 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 527a_100000211070_200000086051 [0,1,0,1,0,0|2,0,0]=4 29969 B16R2.524 O=C(C[n+]1ccccc1)N[C@@H]2CCOC2 240690a_200015188469_200000086051 [0,1,0,1,0,0|2,0,0]=4 29970 B16R2.524 O=C(C[n+]1ccccc1)N[C@@H]2CCOC2 527a_200015188469_200000086051 [0,1,0,1,0,0|2,0,0]=4 29971 B16R2.524 O=C(C[n+]1ccccc1)N[C@H]2CCOC2 11a_100015188467_200000086051 [0,1,0,1,0,0|2,0,0]=4 29972 B16R2.524 O=C(C[n+]1ccccc1)N[C@H]2CCOC2 240690a_100015188467_200000086051 [0,1,0,1,0,0|2,0,0]=4 29973 B16R2.524 O=C(C[n+]1ccccc1)N[C@H]2CCOC2 527a_100015188467_200000086051 [0,1,0,1,0,0|2,0,0]=4 29974 B16R2.524 O=C(Cc1ccccc1)CC2C=CCC2 1458a_100000212241_100015291786 [0,1,0,1,0,0|1,0,1]=4 29975 B16R2.524 O=C(Cc1ccccc1)CC2CC=CC2 1458a_200000137526_100015291786 [0,1,0,1,0,0|1,0,1]=4 29976 B16R2.524 O=C(Cc1ccccc1)CC2CCCC2 1458a_100000210891_100015291786 [0,1,0,1,0,0|1,0,0]=3 29977 B16R2.524 O=C(Cc1ccccc1)CC2CCOC2 1458a_100011218419_100015291786 [0,1,0,1,0,0|1,0,0]=3 29978 B16R2.524 O=C(Cc1ccccc1)CN2CCCC2 1458a_100000740243_100015291786 [0,1,0,1,0,0|1,0,0]=3 29979 B16R2.524 O=C(Cc1ccccc1)CN2CCCC2 2230a_100000188435_100000233483 [0,1,0,1,0,0|1,0,0]=3 29980 B16R2.524 O=C(Cc1ccccc1)CN2CCCC2 269982a_100000188435_100000233483 [0,1,0,1,0,0|1,0,0]=3 29981 B16R2.524 O=C(Cc1ccccc1)CN2CCSC2 2230a_100011215254_100000233483 [0,1,0,1,0,0|2,0,0]=4 29982 B16R2.524 O=C(Cc1ccccc1)CN2CCSC2 269982a_100011215254_100000233483 [0,1,0,1,0,0|2,0,0]=4 29983 B16R2.524 O=C(Cc1ccccn1)CC2CCCC2 1458a_100000210891_100000721315 [0,1,0,1,0,0|2,0,0]=4 29984 B16R2.524 O=C(Cc1ccccn1)CC2CCCC2 1458a_100000233486_100000740388 [0,1,0,1,0,0|2,0,0]=4 29985 B16R2.524 O=C(Cc1ccccn1)CC2CCCO2 1458a_100000233486_100000203698 [0,1,0,1,0,0|2,0,0]=4 29986 B16R2.524 O=C(Cc1ccccn1)CC2CCOC2 1458a_100000233486_100000702531 [0,1,0,1,0,0|2,0,0]=4 29987 B16R2.524 O=C(Cc1ccccn1)CC2CCOC2 1458a_100011218419_100000721315 [0,1,0,1,0,0|2,0,0]=4 29988 B16R2.524 O=C(Cc1ccccn1)CN2CCCC2 1458a_100000740243_100000721315 [0,1,0,1,0,0|2,0,0]=4 29989 B16R2.524 O=C(Cc1ccccn1)NC2CCCC2 11a_100000211070_100000233486 [0,1,0,1,0,0|2,0,0]=4 29990 B16R2.524 O=C(Cc1ccccn1)N[C@H]2CCOC2 11a_100015188467_100000233486 [0,1,0,1,0,0|2,0,0]=4 29991 B16R2.524 O=C(Cc1cccnc1)CC2CCCC2 1458a_100000210891_100000733263 [0,1,0,1,0,0|2,0,0]=4 29992 B16R2.524 O=C(Cc1cccnc1)CC2CCCC2 1458a_100000737805_100000740388 [0,1,0,1,0,0|2,0,0]=4 29993 B16R2.524 O=C(Cc1cccnc1)CC2CCCO2 1458a_100000737805_100000203698 [0,1,0,1,0,0|2,0,0]=4 29994 B16R2.524 O=C(Cc1cccnc1)CC2CCOC2 1458a_100000737805_100000702531 [0,1,0,1,0,0|2,0,0]=4 29995 B16R2.524 O=C(Cc1cccnc1)CC2CCOC2 1458a_100011218419_100000733263 [0,1,0,1,0,0|2,0,0]=4 29996 B16R2.524 O=C(Cc1cccnc1)CN2CCCC2 1458a_100000740243_100000733263 [0,1,0,1,0,0|2,0,0]=4 29997 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 11a_100000211070_100000737805 [0,1,0,1,0,0|2,0,0]=4 29998 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 240690a_100000211070_100000737805 [0,1,0,1,0,0|2,0,0]=4 29999 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 527a_100000211070_100000737805 [0,1,0,1,0,0|2,0,0]=4 30000 B16R2.524 O=C(Cc1cccnc1)N[C@@H]2CCOC2 240690a_200015188469_100000737805 [0,1,0,1,0,0|2,0,0]=4 30001 B16R2.524 O=C(Cc1cccnc1)N[C@@H]2CCOC2 527a_200015188469_100000737805 [0,1,0,1,0,0|2,0,0]=4 30002 B16R2.524 O=C(Cc1cccnc1)N[C@H]2CCOC2 11a_100015188467_100000737805 [0,1,0,1,0,0|2,0,0]=4 30003 B16R2.524 O=C(Cc1cccnc1)N[C@H]2CCOC2 240690a_100015188467_100000737805 [0,1,0,1,0,0|2,0,0]=4 30004 B16R2.524 O=C(Cc1cccnc1)N[C@H]2CCOC2 527a_100015188467_100000737805 [0,1,0,1,0,0|2,0,0]=4 30005 B16R2.524 O=C(Cc1ccncc1)CC2CCCC2 1458a_100000210891_100000705612 [0,1,0,1,0,0|2,0,0]=4 30006 B16R2.524 O=C(Cc1ccncc1)CC2CCOC2 1458a_100011218419_100000705612 [0,1,0,1,0,0|2,0,0]=4 30007 B16R2.524 O=C(Cc1ccncc1)CN2CCCC2 1458a_100000740243_100000705612 [0,1,0,1,0,0|2,0,0]=4 30008 B16R2.524 O=C(Cc1ccncc1)NC2CCCC2 11a_100000211070_100011201483 [0,1,0,1,0,0|2,0,0]=4 30009 B16R2.524 O=C(Cc1ccncc1)NC2CCCC2 240690a_100000211070_100011201483 [0,1,0,1,0,0|2,0,0]=4 30010 B16R2.524 O=C(Cc1ccncc1)N[C@@H]2CCOC2 240690a_200015188469_100011201483 [0,1,0,1,0,0|2,0,0]=4 30011 B16R2.524 O=C(Cc1ccncc1)N[C@H]2CCOC2 11a_100015188467_100011201483 [0,1,0,1,0,0|2,0,0]=4 30012 B16R2.524 O=C(Cc1ccncc1)N[C@H]2CCOC2 240690a_100015188467_100011201483 [0,1,0,1,0,0|2,0,0]=4 30013 B16R2.524 O=C(Nc1ccccc1)NC2CCCC2 2430a_100000106764_100000211070 [0,1,0,1,0,0|2,0,0]=4 30014 B16R2.524 O=C(Nc1ccccc1)N[C@@H]2CCOC2 2430a_100000106764_200015188469 [0,1,0,1,0,0|2,0,0]=4 30015 B16R2.524 O=C(Nc1ccccc1)N[C@H]2CCOC2 2430a_100000106764_100015188467 [0,1,0,1,0,0|2,0,0]=4 30016 B16R2.1265 CCCCOCC1CC1c2ccccc2 34a_100011997005_100000210210 [0,1,0,1,0,0|1,0,1]=4 30017 B16R2.1265 CCCCOCC1CC1c2ccccc2 7a_100011997005_100000210211 [0,1,0,1,0,0|1,0,1]=4 30018 B16R2.1265 CCCCOCC1OC1c2ccccc2 34a_100000032844_100000210210 [0,1,0,1,0,0|0,0,2]=4 30019 B16R2.1265 CCCCOCC1OC1c2ccccc2 7a_100000032844_100000210211 [0,1,0,1,0,0|0,0,2]=4 30020 B16R2.1512 CCN1CCNC(=O)C1c2ccccc2 2230a_100102954019_100000210202 [0,1,0,1,0,0|1,0,0]=3 30021 B16R2.1512 CCN1CCNC(=O)C1c2ccccc2 269982a_100102954019_100000204670 [0,1,0,1,0,0|1,0,0]=3 30022 B16R2.1512 O=C1NCCN(C1c2ccccc2)CF 269982a_100102954019_100015361967 [0,1,0,1,0,0|2,0,0]=4 30023 B16R2.2875 BrCCCCOC1Cc2ccccc2C1 34a_100011216708_100000753484 [0,1,0,1,0,0|1,0,1]=4 30024 B16R2.2875 CCCCCOC1Cc2ccccc2C1 34a_100000210253_100000753484 [0,1,0,1,0,0|1,0,1]=4 30025 B16R2.2875 CCCCCOC1Cc2ccccc2C1 34a_100011215286_100000718602 [0,1,0,1,0,0|1,0,1]=4 30026 B16R2.2875 CCCCCOC1Cc2ccccc2C1 7a_100000210253_100000753484 [0,1,0,1,0,0|1,0,1]=4 30027 B16R2.2875 CCCCNN=C1Cc2ccccc2C1 4a_100025702795_100000211675 [0,1,0,1,0,0|2,0,0]=4 30028 B16R2.2875 CCCCOCC1Cc2ccccc2C1 34a_100000720471_100000210210 [0,1,0,1,0,0|1,0,1]=4 30029 B16R2.2875 CCCCOCC1Cc2ccccc2O1 34a_100011273944_100000210210 [0,1,0,1,0,0|0,0,2]=4 30030 B16R2.2875 CCCCOCN1Cc2ccccc2C1 2230a_100000752595_100011995733 [0,1,0,1,0,0|2,0,0]=4 30031 B16R2.2875 CCCCOCN1Cc2ccccc2C1 269982a_100000752595_100011995733 [0,1,0,1,0,0|2,0,0]=4 30032 B16R2.2875 CCCCOCN1Cc2ccccc2C1 34a_100000752595_100011995733 [0,1,0,1,0,0|2,0,0]=4 30033 B16R2.2875 CCCCOC[C@@H]1Cc2ccccc2N1 34a_100011830367_100000210210 [0,1,0,1,0,0|1,0,1]=4 30034 B16R2.2875 CCCCOCc1cc2ccccc2o1 34a_100000233474_100000210210 [0,1,0,1,0,0|0,0,2]=4 30035 B16R2.2875 CCCCOCc1cc2ccccc2o1 7a_100000233474_100000210211 [0,1,0,1,0,0|0,0,2]=4 30036 B16R2.2875 CCCCOCc1nc2ccccc2[nH]1 7a_100000210227_100000737899 [0,1,0,1,0,0|2,0,0]=4 30037 B16R2.2875 CCCCOCc1nc2ccccc2o1 34a_100000210227_200012361514 [0,1,0,1,0,0|1,0,1]=4 30038 B16R2.2875 CCCCOCc1nc2ccccc2o1 7a_100000210227_100000195508 [0,1,0,1,0,0|1,0,1]=4 30039 B16R2.2875 CCCCOCc1nc2ccccc2s1 34a_100000210227_100011217541 [0,1,0,1,0,0|1,1,0]=4 30040 B16R2.2875 CCCCOCc1nc2ccccc2s1 7a_100000210227_100011217541 [0,1,0,1,0,0|1,1,0]=4 30041 B16R2.2875 CCOCCOC1Cc2ccccc2C1 34a_100000210136_100000753484 [0,1,0,1,0,0|1,0,1]=4 30042 B16R2.2875 CCOCCOC1Cc2ccccc2C1 34a_100011215286_100000210147 [0,1,0,1,0,0|1,0,1]=4 30043 B16R2.2875 CCOCCOC1Cc2ccccc2C1 7a_100000210136_100000753484 [0,1,0,1,0,0|1,0,1]=4 30044 B16R2.2875 CCSCCOC1Cc2ccccc2C1 34a_100000212035_100000753484 [0,1,0,1,0,0|1,0,1]=4 30045 B16R2.2875 CCSCCOC1Cc2ccccc2C1 34a_100011215286_100000757381 [0,1,0,1,0,0|1,0,1]=4 30046 B16R2.2875 CCSCCOC1Cc2ccccc2C1 7a_100000212035_100000753484 [0,1,0,1,0,0|1,0,1]=4 30047 B16R2.2875 CNCCCOC1Cc2ccccc2C1 34a_100000213112_100000753484 [0,1,0,1,0,0|1,0,1]=4 30048 B16R2.2875 COCCCOC1Cc2ccccc2C1 34a_100000740835_100000753484 [0,1,0,1,0,0|1,0,1]=4 30049 B16R2.2875 COCCCOC1Cc2ccccc2C1 34a_100011215286_100000740836 [0,1,0,1,0,0|1,0,1]=4 30050 B16R2.2875 CSCCCOC1Cc2ccccc2C1 34a_100000690336_100000753484 [0,1,0,1,0,0|1,0,1]=4 30051 B16R2.2875 CSCCCOC1Cc2ccccc2C1 7a_100000690336_100000753484 [0,1,0,1,0,0|1,0,1]=4 30052 B16R2.2875 ClCCCCOC1Cc2ccccc2C1 34a_100000210776_100000753484 [0,1,0,1,0,0|1,0,1]=4 30053 B16R2.2875 ClCCCCOC1Cc2ccccc2C1 7a_100000210776_100000753484 [0,1,0,1,0,0|1,0,1]=4 30054 B16R2.2875 FCCCCOC1Cc2ccccc2C1 34a_100011215286_100000729493 [0,1,0,1,0,0|1,0,1]=4 30055 B16R2.2875 FCCCCOC1Cc2ccccc2C1 34a_100011995726_100000753484 [0,1,0,1,0,0|1,0,1]=4 30056 B16R2.2875 FCCCCOC1Cc2ccccc2C1 7a_100011995726_100000753484 [0,1,0,1,0,0|1,0,1]=4 30057 B16R2.2875 ICCCCOC1Cc2ccccc2C1 34a_200012148704_100000753484 [0,1,0,1,0,0|1,0,1]=4 30058 B16R2.2875 NCCCCOC1Cc2ccccc2C1 34a_100000750430_100000753484 [0,1,0,1,0,0|1,0,1]=4 30059 B16R2.2875 OCCCCOC1Cc2ccccc2C1 34a_100011215286_100011216708 [0,1,0,1,0,0|1,0,1]=4 30060 B16R2.3005 CC1CCCC1C(=O)Cc2ccccc2 1458a_100000690547_100015291786 [0,1,0,1,0,0|1,0,0]=3 30061 B16R2.3005 CC1CCCC1C(=O)Cc2ccccn2 1458a_100000690547_100000721315 [0,1,0,1,0,0|2,0,0]=4 30062 B16R2.3005 CC1CCCC1C(=O)Cc2cccnc2 1458a_100000690547_100000733263 [0,1,0,1,0,0|2,0,0]=4 30063 B16R2.3005 CC1CCCC1C(=O)Cc2ccncc2 1458a_100000690547_100000705612 [0,1,0,1,0,0|2,0,0]=4 30064 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 11a_100000106764_100000690547 [0,1,0,1,0,0|2,0,0]=4 30065 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 1626a_100000106764_100000690547 [0,1,0,1,0,0|2,0,0]=4 30066 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 22a_100000106764_100000690547 [0,1,0,1,0,0|2,0,0]=4 30067 B16R2.3005 CC1CCCC1C(=O)Nc2ccccc2 527a_100000106764_100000690547 [0,1,0,1,0,0|2,0,0]=4 30068 B16R2.3005 CC1SCCN1C(=O)C[n+]2ccccc2 11a_200011216479_200000086051 [0,1,0,1,0,0|2,0,0]=4 30069 B16R2.3005 CC1SCCN1C(=O)C[n+]2ccccc2 240690a_200011216479_200000086051 [0,1,0,1,0,0|2,0,0]=4 30070 B16R2.3005 CC1SCCN1C(=O)C[n+]2ccccc2 527a_200011216479_200000086051 [0,1,0,1,0,0|2,0,0]=4 30071 B16R2.3005 CC1SCCN1C(=O)Cc2ccccn2 11a_200011216479_100000233486 [0,1,0,1,0,0|2,0,0]=4 30072 B16R2.3005 CC1SCCN1C(=O)Cc2cccnc2 11a_200011216479_100000737805 [0,1,0,1,0,0|2,0,0]=4 30073 B16R2.3005 CC1SCCN1C(=O)Cc2cccnc2 240690a_200011216479_100000737805 [0,1,0,1,0,0|2,0,0]=4 30074 B16R2.3005 CC1SCCN1C(=O)Cc2cccnc2 527a_200011216479_100000737805 [0,1,0,1,0,0|2,0,0]=4 30075 B16R2.3005 CC1SCCN1C(=O)Cc2ccncc2 11a_200011216479_100011201483 [0,1,0,1,0,0|2,0,0]=4 30076 B16R2.3005 CC1SCCN1C(=O)Cc2ccncc2 240690a_200011216479_100011201483 [0,1,0,1,0,0|2,0,0]=4 30077 B16R2.3005 CC1SCCN1C(=O)Nc2ccccc2 2430a_100000106764_200011216479 [0,1,0,1,0,0|2,0,0]=4 30078 B16R2.3005 CN1CCC[C@H]1C(=O)Cc2ccccc2 1458a_100009816429_100015291786 [0,1,0,1,0,0|1,0,0]=3 30079 B16R2.3005 CN1CCC[C@H]1C(=O)Cc2ccccn2 1458a_100009816429_100000721315 [0,1,0,1,0,0|2,0,0]=4 30080 B16R2.3005 CN1CCC[C@H]1C(=O)Cc2cccnc2 1458a_100009816429_100000733263 [0,1,0,1,0,0|2,0,0]=4 30081 B16R2.3005 CN1CCC[C@H]1C(=O)Cc2ccncc2 1458a_100009816429_100000705612 [0,1,0,1,0,0|2,0,0]=4 30082 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 11a_100000106764_100009816429 [0,1,0,1,0,0|2,0,0]=4 30083 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 2230a_100102887412_200000210301 [0,1,0,1,0,0|2,0,0]=4 30084 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 22a_100000106764_100009816429 [0,1,0,1,0,0|2,0,0]=4 30085 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 269982a_100102887412_200000210301 [0,1,0,1,0,0|2,0,0]=4 30086 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 34a_100102887412_200000210301 [0,1,0,1,0,0|2,0,0]=4 30087 B16R2.3005 CN1CCC[C@H]1C(=O)Nc2ccccc2 527a_100000106764_100009816429 [0,1,0,1,0,0|2,0,0]=4 30088 B16R2.3005 C[C@@H]1CCCN1C(=O)C[n+]2ccccc2 11a_100015189458_200000086051 [0,1,0,1,0,0|2,0,0]=4 30089 B16R2.3005 C[C@@H]1CCCN1C(=O)C[n+]2ccccc2 240690a_100015189458_200000086051 [0,1,0,1,0,0|2,0,0]=4 30090 B16R2.3005 C[C@@H]1CCCN1C(=O)C[n+]2ccccc2 527a_100015189458_200000086051 [0,1,0,1,0,0|2,0,0]=4 30091 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccccn2 11a_100015189458_100000233486 [0,1,0,1,0,0|2,0,0]=4 30092 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2cccnc2 11a_100015189458_100000737805 [0,1,0,1,0,0|2,0,0]=4 30093 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2cccnc2 240690a_100015189458_100000737805 [0,1,0,1,0,0|2,0,0]=4 30094 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2cccnc2 527a_100015189458_100000737805 [0,1,0,1,0,0|2,0,0]=4 30095 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccncc2 11a_100015189458_100011201483 [0,1,0,1,0,0|2,0,0]=4 30096 B16R2.3005 C[C@@H]1CCCN1C(=O)Cc2ccncc2 240690a_100015189458_100011201483 [0,1,0,1,0,0|2,0,0]=4 30097 B16R2.3005 C[C@@H]1CCCN1C(=O)Nc2ccccc2 2430a_100000106764_100015189458 [0,1,0,1,0,0|2,0,0]=4 30098 B16R2.3005 C[C@H]1CCCN1C(=O)C[n+]2ccccc2 240690a_100020605311_200000086051 [0,1,0,1,0,0|2,0,0]=4 30099 B16R2.3005 C[C@H]1CCCN1C(=O)C[n+]2ccccc2 527a_100020605311_200000086051 [0,1,0,1,0,0|2,0,0]=4 30100 B16R2.3005 C[C@H]1CCCN1C(=O)Cc2cccnc2 240690a_100020605311_100000737805 [0,1,0,1,0,0|2,0,0]=4 30101 B16R2.3005 C[C@H]1CCCN1C(=O)Cc2cccnc2 527a_100020605311_100000737805 [0,1,0,1,0,0|2,0,0]=4 30102 B16R2.3005 C[C@H]1CCCN1C(=O)Cc2ccncc2 240690a_100020605311_100011201483 [0,1,0,1,0,0|2,0,0]=4 30103 B16R2.3005 C[C@H]1CCCN1C(=O)Nc2ccccc2 2430a_100000106764_100020605311 [0,1,0,1,0,0|2,0,0]=4 30104 B16R2.3005 [13CH3]N1CCC[C@H]1C(=O)Nc2ccccc2 2230a_100102887412_200025704644 [0,1,0,1,0,0|2,0,0]=4 30105 B16R2.3005 [13CH3]N1CCC[C@H]1C(=O)Nc2ccccc2 269982a_100102887412_200025704644 [0,1,0,1,0,0|2,0,0]=4 30106 B16R2.3005 [13CH3]N1CCC[C@H]1C(=O)Nc2ccccc2 34a_100102887412_200025704644 [0,1,0,1,0,0|2,0,0]=4 30107 B16R2.3190 CC(Cc1ccccc1)OCC2CC2C 34a_100000744939_200011218536 [0,1,0,1,0,0|1,0,1]=4 30108 B16R2.3190 CC(Cc1ccccc1)OCC2CC2C 7a_100000744939_200011218536 [0,1,0,1,0,0|1,0,1]=4 30109 B16R2.3190 O=C(CN[C@@H]1C[C@@H]1F)Cc2ccccc2 2230a_100015190264_100000233483 [0,1,0,1,0,0|2,0,0]=4 30110 B16R2.3190 O=C(CN[C@@H]1C[C@H]1F)Cc2ccccc2 2230a_100025746932_100000233483 [0,1,0,1,0,0|2,0,0]=4 30111 B16R2.6335 CCCCSC1C(=O)Nc2c1cccc2 62a_100000210211_200009996675 [0,1,0,1,0,0|1,1,0]=4 30112 B16R2.6335 CCNCCn1c(=O)[nH]c2c1cccc2 2230a_100015525214_203549783246 [0,1,0,1,0,0|2,0,0]=4 30113 B16R2.6335 CNCCCn1c(=O)[nH]c2c1cccc2 2230a_106832991635_100000184716 [0,1,0,1,0,0|2,0,0]=4 30114 B16R2.6335 CNCCCn1c(=O)[nH]c2c1cccc2 7a_106832991635_100000184716 [0,1,0,1,0,0|2,0,0]=4 30115 B16R2.6335 CSCCCn1c(=O)[nH]c2c1cccc2 62a_200000210301_100000184716 [0,1,0,1,0,0|2,0,0]=4 30116 B16R2.6335 [13CH3]SCCCn1c(=O)[nH]c2c1cccc2 62a_200025704644_100000184716 [0,1,0,1,0,0|2,0,0]=4 30117 B16R2.10947 C/C(=C\c1ccccc1)/COCC2CC2 34a_200025717232_100000742324 [0,1,0,1,0,0|1,0,1]=4 30118 B16R2.10947 C/C(=C\c1ccccc1)/COCC2CC2 7a_200025717232_100000742324 [0,1,0,1,0,0|1,0,1]=4 30119 B16R2.10947 CC(COCC1CC1)Cc2ccccc2 34a_100012125295_100000742324 [0,1,0,1,0,0|1,0,1]=4 30120 B16R2.10947 CC(COCC1CC1)Cc2ccccc2 7a_100012125295_100000742324 [0,1,0,1,0,0|1,0,1]=4 30121 B16R2.10947 CC(Cc1ccccc1)OCCC2CC2 34a_100000748627_100000694398 [0,1,0,1,0,0|1,0,1]=4 30122 B16R2.10947 CC(Cc1ccccc1)OCCC2CC2 34a_100000754188_200011218536 [0,1,0,1,0,0|1,0,1]=4 30123 B16R2.10947 CC(Cc1ccccc1)OCCC2CC2 7a_100000748627_100000764125 [0,1,0,1,0,0|1,0,1]=4 30124 B16R2.10947 CC(Cc1ccccc1)OCCC2CC2 7a_100000754188_200011218536 [0,1,0,1,0,0|1,0,1]=4 30125 B16R2.10947 CC(Cc1ccccc1)OCCC2CO2 34a_100000748627_100000732470 [0,1,0,1,0,0|1,0,1]=4 30126 B16R2.10947 CC(Cc1ccccc1)OCCC2CO2 7a_100000748627_100000732470 [0,1,0,1,0,0|1,0,1]=4 30127 B16R2.10947 CC(Cc1ccccc1)OCC[C@@H]2CO2 34a_100009820653_200011218536 [0,1,0,1,0,0|1,0,1]=4 30128 B16R2.10947 NC(COCC1CC1)Cc2ccccc2 34a_100000739027_100000742324 [0,1,0,1,0,0|1,0,1]=4 30129 B16R2.10947 O=C(CCCC1CO1)C[n+]2ccccc2 1458a_200000086051_100000733510 [0,1,0,1,0,0|2,0,0]=4 30130 B16R2.10947 O=C(CCCC1CO1)Cc2ccccn2 1458a_100000233486_100000733510 [0,1,0,1,0,0|2,0,0]=4 30131 B16R2.10947 O=C(CCCC1CO1)Cc2cccnc2 1458a_100000737805_100000733510 [0,1,0,1,0,0|2,0,0]=4 30132 B16R2.10947 O=C(CCNC1CC1)Nc2ccccc2 34a_100000212008_100000242058 [0,1,0,1,0,0|2,0,0]=4 30133 B16R2.10947 O=C(CNCC1CC1)Cc2ccccc2 2230a_100000735609_100000233483 [0,1,0,1,0,0|1,0,0]=3 30134 B16R2.10947 O=C(CNCC1CC1)Nc2ccccc2 2230a_100000735609_100000182850 [0,1,0,1,0,0|2,0,0]=4 30135 B16R2.10947 O=C(CNCC1CC1)Nc2ccccc2 34a_100000735609_100000182850 [0,1,0,1,0,0|2,0,0]=4 30136 B16R2.10947 O=C(CNCC1CC1)Oc2ccccc2 2230a_100000735609_100009813826 [0,1,0,1,0,0|2,0,0]=4 30137 B16R2.10947 O=C(CNCC1CC1)Oc2ccccc2 34a_100000735609_100009813826 [0,1,0,1,0,0|2,0,0]=4 30138 B16R2.10947 O=C(COCC1CC1)Nc2ccccc2 34a_100000211283_100000182850 [0,1,0,1,0,0|1,0,0]=3 30139 B16R2.10947 O=C(COCC1CC1)Nc2ccccc2 34a_100000246334_100000742324 [0,1,0,1,0,0|1,0,0]=3 30140 B16R2.10947 O=C(COCC1CC1)Oc2ccccc2 34a_100000211283_100009813826 [0,1,0,1,0,0|1,0,0]=3 30141 B16R2.10947 O=C(COCC1CO1)Nc2ccccc2 34a_100000246334_102125554688 [0,1,0,1,0,0|2,0,0]=4 30142 B16R2.10947 O=C(COC[C@@H]1CO1)Nc2ccccc2 34a_100000757423_100000182850 [0,1,0,1,0,0|2,0,0]=4 30143 B16R2.10947 O=C(COC[C@@H]1CO1)Oc2ccccc2 34a_100000757423_100009813826 [0,1,0,1,0,0|2,0,0]=4 30144 B16R2.10947 O=C(CSCC1CC1)Cc2ccccc2 1458a_200011316215_100015291786 [0,1,0,1,0,0|0,1,0]=3 30145 B16R2.10947 O=C(CSCC1CC1)Cc2ccccc2 62a_100000233483_100000742324 [0,1,0,1,0,0|0,1,0]=3 30146 B16R2.10947 O=C(CSCC1CC1)Cc2ccccc2 62a_100000756562_100000233483 [0,1,0,1,0,0|0,1,0]=3 30147 B16R2.10947 O=C(CSCC1CC1)Cc2ccccn2 1458a_200011316215_100000721315 [0,1,0,1,0,0|1,1,0]=4 30148 B16R2.10947 O=C(CSCC1CC1)Cc2cccnc2 1458a_200011316215_100000733263 [0,1,0,1,0,0|1,1,0]=4 30149 B16R2.10947 O=C(CSCC1CC1)Cc2ccncc2 1458a_200011316215_100000705612 [0,1,0,1,0,0|1,1,0]=4 30150 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 11a_100000106764_200011316215 [0,1,0,1,0,0|1,1,0]=4 30151 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 1626a_100000106764_200011316215 [0,1,0,1,0,0|1,1,0]=4 30152 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 22a_100000106764_200011316215 [0,1,0,1,0,0|1,1,0]=4 30153 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 527a_100000106764_200011316215 [0,1,0,1,0,0|1,1,0]=4 30154 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 62a_100000756562_100000182850 [0,1,0,1,0,0|1,1,0]=4 30155 B16R2.10947 O=C(CSCC1CC1)Nc2ccccc2 62a_100012148978_100000742324 [0,1,0,1,0,0|1,1,0]=4 30156 B16R2.10947 O=C(CSCC1CC1)Oc2ccccc2 62a_100000756562_100009813826 [0,1,0,1,0,0|1,1,0]=4 30157 B16R2.10947 O=C(CSCC1CC1)Oc2ccccc2 62a_100009813826_100000742324 [0,1,0,1,0,0|1,1,0]=4 30158 B16R2.10947 O=C(CSCC1CO1)Cc2ccccc2 62a_100000233483_102125554688 [0,1,0,1,0,0|1,1,0]=4 30159 B16R2.10947 O=C(CSCC1CO1)Cc2ccccc2 62a_102125554688_100000233483 [0,1,0,1,0,0|1,1,0]=4 30160 B16R2.10947 O=C(CSCC1CS1)Cc2ccccc2 62a_100000031435_100000233483 [0,1,0,1,0,0|1,1,0]=4 30161 B16R2.10947 O=C(CSCC1CS1)Cc2ccccc2 62a_100000233483_100000031435 [0,1,0,1,0,0|1,1,0]=4 30162 B16R2.10947 O=C(CSC[C@@H]1CO1)Cc2ccccc2 62a_100000233483_100000745022 [0,1,0,1,0,0|1,1,0]=4 30163 B16R2.10947 O=C(CSC[C@@H]1CO1)Cc2ccccc2 62a_100000745022_100000233483 [0,1,0,1,0,0|1,1,0]=4 30164 B16R2.10947 O=C(C[n+]1ccccc1)NCCC2CC2 240690a_100000764129_200000086051 [0,1,0,1,0,0|2,0,0]=4 30165 B16R2.10947 O=C(C[n+]1ccccc1)NCCC2CC2 527a_100000764129_200000086051 [0,1,0,1,0,0|2,0,0]=4 30166 B16R2.10947 O=C(C[n+]1ccccc1)NNCC2CC2 22a_100000736359_200000086051 [0,1,0,1,0,0|2,0,0]=4 30167 B16R2.10947 O=C(Cc1ccccc1)NN=CC2CC2 4a_100000182964_100000741477 [0,1,0,1,0,0|1,0,1]=4 30168 B16R2.10947 O=C(Cc1ccccn1)NNCC2CC2 22a_100000736359_100000233486 [0,1,0,1,0,0|2,0,0]=4 30169 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 240690a_100000764129_100000737805 [0,1,0,1,0,0|2,0,0]=4 30170 B16R2.10947 O=C(Cc1cccnc1)NCCC2CC2 527a_100000764129_100000737805 [0,1,0,1,0,0|2,0,0]=4 30171 B16R2.10947 O=C(Cc1cccnc1)NNCC2CC2 22a_100000736359_100000737805 [0,1,0,1,0,0|2,0,0]=4 30172 B16R2.10947 O=C(Cc1ccncc1)NCCC2CC2 240690a_100000764129_100011201483 [0,1,0,1,0,0|2,0,0]=4 30173 B16R2.10947 O=C(Cc1ccncc1)NNCC2CC2 22a_100000736359_100011201483 [0,1,0,1,0,0|2,0,0]=4 30174 B16R2.10947 O=C(NCCC1CC1)Nc2ccccc2 2430a_100000106764_100000764129 [0,1,0,1,0,0|2,0,0]=4 30175 B16R2.10947 O[C@H](COCC1CC1)Cc2ccccc2 34a_100000211283_100000729385 [0,1,0,1,0,0|0,0,2]=4 30176 B16R2.10948 C/C(=C\c1ccccc1)/COC2CCC2 34a_200025717232_100000749161 [0,1,0,1,0,0|1,0,1]=4 30177 B16R2.10948 CC(COC1CCC1)Cc2ccccc2 34a_100012125295_100000749161 [0,1,0,1,0,0|1,0,1]=4 30178 B16R2.10948 CC(Cc1ccccc1)OCC2CCC2 34a_100000748627_100000763275 [0,1,0,1,0,0|1,0,1]=4 30179 B16R2.10948 CC(Cc1ccccc1)OCC2CCC2 34a_100000760304_200011218536 [0,1,0,1,0,0|1,0,1]=4 30180 B16R2.10948 CC(Cc1ccccc1)OCC2CCC2 7a_100000748627_100000763275 [0,1,0,1,0,0|1,0,1]=4 30181 B16R2.10948 CC(Cc1ccccc1)OCC2CCO2 34a_100000039022_200011218536 [0,1,0,1,0,0|1,0,1]=4 30182 B16R2.10948 CC(Cc1ccccc1)OCC2CCO2 34a_100000748627_100000103362 [0,1,0,1,0,0|1,0,1]=4 30183 B16R2.10948 CC(Cc1ccccc1)OCC2CCO2 7a_100000748627_100000103362 [0,1,0,1,0,0|1,0,1]=4 30184 B16R2.10948 CC(Cc1ccccc1)OCC2CNC2 34a_100016987283_200011218536 [0,1,0,1,0,0|1,0,1]=4 30185 B16R2.10948 CC(Cc1ccccc1)OCC2COC2 34a_100000060846_200011218536 [0,1,0,1,0,0|1,0,1]=4 30186 B16R2.10948 CC(Cc1ccccc1)OCC2COC2 34a_100000748627_100010264016 [0,1,0,1,0,0|1,0,1]=4 30187 B16R2.10948 CC(Cc1ccccc1)OCC2COC2 7a_100000748627_100010264016 [0,1,0,1,0,0|1,0,1]=4 30188 B16R2.10948 NC(COC1CCC1)Cc2ccccc2 34a_100000739027_100000749161 [0,1,0,1,0,0|1,0,1]=4 30189 B16R2.10948 O=C(CCN1CCC1)Nc2ccccc2 269982a_100000754969_100000242058 [0,1,0,1,0,0|2,0,0]=4 30190 B16R2.10948 O=C(CCN1CCC1)Oc2ccccc2 269982a_100000754969_200000035796 [0,1,0,1,0,0|2,0,0]=4 30191 B16R2.10948 O=C(CNC1CCC1)Cc2ccccc2 2230a_100000749019_100000233483 [0,1,0,1,0,0|1,0,0]=3 30192 B16R2.10948 O=C(CNC1CCC1)Nc2ccccc2 2230a_100000749019_100000182850 [0,1,0,1,0,0|2,0,0]=4 30193 B16R2.10948 O=C(CNC1CCC1)Nc2ccccc2 270004a_100000742222_100000241760 [0,1,0,1,0,0|2,0,0]=4 30194 B16R2.10948 O=C(CNC1CCC1)Nc2ccccc2 34a_100000749019_100000182850 [0,1,0,1,0,0|2,0,0]=4 30195 B16R2.10948 O=C(CNC1CCC1)Oc2ccccc2 2230a_100000749019_100009813826 [0,1,0,1,0,0|2,0,0]=4 30196 B16R2.10948 O=C(CNC1CCC1)Oc2ccccc2 34a_100000749019_100009813826 [0,1,0,1,0,0|2,0,0]=4 30197 B16R2.10948 O=C(CNC1COC1)Cc2ccccc2 2230a_100016991112_100000233483 [0,1,0,1,0,0|2,0,0]=4 30198 B16R2.10948 O=C(COC1CCC1)Nc2ccccc2 34a_100000246334_100000749161 [0,1,0,1,0,0|1,0,0]=3 30199 B16R2.10948 O=C(COC1CCC1)Nc2ccccc2 34a_100000748187_100000182850 [0,1,0,1,0,0|1,0,0]=3 30200 B16R2.10948 O=C(COC1CCC1)Oc2ccccc2 34a_100000748187_100009813826 [0,1,0,1,0,0|1,0,0]=3 30201 B16R2.10948 O=C(COC1COC1)Nc2ccccc2 34a_100000246334_100009818527 [0,1,0,1,0,0|2,0,0]=4 30202 B16R2.10948 O=C(COC1CSC1)Cc2ccccc2 7a_100000072292_100000233483 [0,1,0,1,0,0|1,0,0]=3 30203 B16R2.10948 O=C(COC1CSC1)Nc2ccccc2 7a_100000072292_100000182850 [0,1,0,1,0,0|2,0,0]=4 30204 B16R2.10948 O=C(COC1CSC1)Oc2ccccc2 7a_100000072292_100009813826 [0,1,0,1,0,0|2,0,0]=4 30205 B16R2.10948 O=C(CSC1CCC1)Cc2ccccc2 62a_100000233483_100000749161 [0,1,0,1,0,0|0,1,0]=3 30206 B16R2.10948 O=C(CSC1CCC1)Nc2ccccc2 62a_100012148978_100000749161 [0,1,0,1,0,0|1,1,0]=4 30207 B16R2.10948 O=C(CSC1CCC1)Oc2ccccc2 62a_100009813826_100000749161 [0,1,0,1,0,0|1,1,0]=4 30208 B16R2.10948 O=C(CSC1COC1)Cc2ccccc2 62a_100000233483_100009818527 [0,1,0,1,0,0|1,1,0]=4 30209 B16R2.10948 O=C(C[n+]1ccccc1)NCC2CCC2 11a_100000738700_200000086051 [0,1,0,1,0,0|2,0,0]=4 30210 B16R2.10948 O=C(C[n+]1ccccc1)NCC2CCC2 240690a_100000738700_200000086051 [0,1,0,1,0,0|2,0,0]=4 30211 B16R2.10948 O=C(C[n+]1ccccc1)NCC2CCC2 527a_100000738700_200000086051 [0,1,0,1,0,0|2,0,0]=4 30212 B16R2.10948 O=C(C[n+]1ccccc1)NCC2COC2 11a_100015281925_200000086051 [0,1,0,1,0,0|2,0,0]=4 30213 B16R2.10948 O=C(C[n+]1ccccc1)NCC2COC2 240690a_100015281925_200000086051 [0,1,0,1,0,0|2,0,0]=4 30214 B16R2.10948 O=C(C[n+]1ccccc1)NCC2COC2 527a_100015281925_200000086051 [0,1,0,1,0,0|2,0,0]=4 30215 B16R2.10948 O=C(C[n+]1ccccc1)NC[C@@H]2CCO2 11a_100020831831_200000086051 [0,1,0,1,0,0|2,0,0]=4 30216 B16R2.10948 O=C(C[n+]1ccccc1)NC[C@@H]2CCO2 240690a_100020831831_200000086051 [0,1,0,1,0,0|2,0,0]=4 30217 B16R2.10948 O=C(C[n+]1ccccc1)NC[C@@H]2CCO2 527a_100020831831_200000086051 [0,1,0,1,0,0|2,0,0]=4 30218 B16R2.10948 O=C(C[n+]1ccccc1)NNC2CCC2 22a_100000736358_200000086051 [0,1,0,1,0,0|2,0,0]=4 30219 B16R2.10948 O=C(Cc1ccccc1)NN=C2CCC2 4a_100000182964_100000241760 [0,1,0,1,0,0|1,0,1]=4 30220 B16R2.10948 O=C(Cc1ccccn1)NCC2CCC2 11a_100000738700_100000233486 [0,1,0,1,0,0|2,0,0]=4 30221 B16R2.10948 O=C(Cc1ccccn1)NCC2COC2 11a_100015281925_100000233486 [0,1,0,1,0,0|2,0,0]=4 30222 B16R2.10948 O=C(Cc1ccccn1)NC[C@@H]2CCO2 11a_100020831831_100000233486 [0,1,0,1,0,0|2,0,0]=4 30223 B16R2.10948 O=C(Cc1ccccn1)NNC2CCC2 22a_100000736358_100000233486 [0,1,0,1,0,0|2,0,0]=4 30224 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 11a_100000738700_100000737805 [0,1,0,1,0,0|2,0,0]=4 30225 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 240690a_100000738700_100000737805 [0,1,0,1,0,0|2,0,0]=4 30226 B16R2.10948 O=C(Cc1cccnc1)NCC2CCC2 527a_100000738700_100000737805 [0,1,0,1,0,0|2,0,0]=4 30227 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 11a_100015281925_100000737805 [0,1,0,1,0,0|2,0,0]=4 30228 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 240690a_100015281925_100000737805 [0,1,0,1,0,0|2,0,0]=4 30229 B16R2.10948 O=C(Cc1cccnc1)NCC2COC2 527a_100015281925_100000737805 [0,1,0,1,0,0|2,0,0]=4 30230 B16R2.10948 O=C(Cc1cccnc1)NC[C@@H]2CCO2 11a_100020831831_100000737805 [0,1,0,1,0,0|2,0,0]=4 30231 B16R2.10948 O=C(Cc1cccnc1)NC[C@@H]2CCO2 240690a_100020831831_100000737805 [0,1,0,1,0,0|2,0,0]=4 30232 B16R2.10948 O=C(Cc1cccnc1)NC[C@@H]2CCO2 527a_100020831831_100000737805 [0,1,0,1,0,0|2,0,0]=4 30233 B16R2.10948 O=C(Cc1cccnc1)NNC2CCC2 22a_100000736358_100000737805 [0,1,0,1,0,0|2,0,0]=4 30234 B16R2.10948 O=C(Cc1ccncc1)NCC2CCC2 11a_100000738700_100011201483 [0,1,0,1,0,0|2,0,0]=4 30235 B16R2.10948 O=C(Cc1ccncc1)NCC2CCC2 240690a_100000738700_100011201483 [0,1,0,1,0,0|2,0,0]=4 30236 B16R2.10948 O=C(Cc1ccncc1)NCC2COC2 11a_100015281925_100011201483 [0,1,0,1,0,0|2,0,0]=4 30237 B16R2.10948 O=C(Cc1ccncc1)NCC2COC2 240690a_100015281925_100011201483 [0,1,0,1,0,0|2,0,0]=4 30238 B16R2.10948 O=C(Cc1ccncc1)NC[C@@H]2CCO2 11a_100020831831_100011201483 [0,1,0,1,0,0|2,0,0]=4 30239 B16R2.10948 O=C(Cc1ccncc1)NC[C@@H]2CCO2 240690a_100020831831_100011201483 [0,1,0,1,0,0|2,0,0]=4 30240 B16R2.10948 O=C(Cc1ccncc1)NNC2CCC2 22a_100000736358_100011201483 [0,1,0,1,0,0|2,0,0]=4 30241 B16R2.10948 O=C(NCC1CCC1)Nc2ccccc2 2430a_100000106764_100000738700 [0,1,0,1,0,0|2,0,0]=4 30242 B16R2.10948 O=C(NCC1COC1)Nc2ccccc2 2430a_100000106764_100015281925 [0,1,0,1,0,0|2,0,0]=4 30243 B16R2.10948 O=C(NC[C@@H]1CCO1)Nc2ccccc2 2430a_100000106764_100020831831 [0,1,0,1,0,0|2,0,0]=4 30244 B16R2.10948 O[C@H](COC1CCC1)Cc2ccccc2 34a_100000748187_100000729385 [0,1,0,1,0,0|0,0,2]=4 30245 B16R2.12202 CCCCc1cc(=O)[nH]c2c1cccc2 271570a_100020621405_100000075698 [0,1,0,1,0,0|2,0,0]=4 30246 B16R2.283 CC(C(=O)N1CCC1C)c2ccccn2 11a_100000755817_100000722050 [0,1,0,1,0,0|2,0,0]=4 30247 B16R2.283 CC(C(=O)N1CCC1C)c2ccccn2 240690a_100000755817_100000722050 [0,1,0,1,0,0|2,0,0]=4 30248 B16R2.283 CC(C(=O)N1CCC1C)c2ccccn2 527a_100000755817_100000722050 [0,1,0,1,0,0|2,0,0]=4 30249 B16R2.283 CC1CCN1C(=O)C(F)c2ccccc2 11a_100000755817_100000698975 [0,1,0,1,0,0|1,0,0]=3 30250 B16R2.283 CC1CCN1C(=O)C(F)c2ccccc2 240690a_100000755817_100000698975 [0,1,0,1,0,0|1,0,0]=3 30251 B16R2.283 CC1CCN1C(=O)C(F)c2ccccc2 527a_100000755817_100000698975 [0,1,0,1,0,0|1,0,0]=3 30252 B16R2.283 CC1CCN1C(=O)[C@@H](C)c2ccccc2 11a_100000755817_100000751047 [0,1,0,1,0,0|1,0,0]=3 30253 B16R2.283 CC1CCN1C(=O)[C@@H](C)c2ccccc2 240690a_100000755817_100000751047 [0,1,0,1,0,0|1,0,0]=3 30254 B16R2.283 CC1CCN1C(=O)[C@@H](C)c2ccccc2 527a_100000755817_100000751047 [0,1,0,1,0,0|1,0,0]=3 30255 B16R2.283 CC1CCN1C(=O)[C@H](O)c2ccccc2 240690a_100000755817_100000684486 [0,1,0,1,0,0|1,0,0]=3 30256 B16R2.1417 CCC1CC1C(=O)C(C)c2ccccc2 1458a_200011661523_100000230085 [0,1,0,1,0,0|1,0,0]=3 30257 B16R2.1417 CCC1CC1C(=O)N(C)c2ccccc2 11a_100000210012_200011661523 [0,1,0,1,0,0|2,0,0]=4 30258 B16R2.1417 CCC1CC1C(=O)N(C)c2ccccc2 1626a_100000210012_200011661523 [0,1,0,1,0,0|2,0,0]=4 30259 B16R2.1417 CCC1CC1C(=O)N(C)c2ccccc2 22a_100000210012_200011661523 [0,1,0,1,0,0|2,0,0]=4 30260 B16R2.2272 CCCCOC1Cc2ccccc2C1O 34a_100000210227_100000211646 [0,1,0,1,0,0|0,0,2]=4 30261 B16R2.2272 CCCCOc1cc2ccccc2n1C 34a_100000066695_100000210210 [0,1,0,1,0,0|1,0,1]=4 30262 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100000210211_100011218503 [0,1,0,1,0,0|0,1,1]=4 30263 B16R2.2272 CCCCSC1Cc2ccccc2C1=O 62a_100011218503_100000210210 [0,1,0,1,0,0|0,1,1]=4 30264 B16R2.3806 CNCC1CN(C(=O)O1)c2ccccc2 2230a_106832991635_100000700024 [0,1,0,1,0,0|2,0,0]=4 30265 B16R2.3806 CNCC1CN(C(=O)O1)c2ccccc2 34a_100102657272_100000700024 [0,1,0,1,0,0|2,0,0]=4 30266 B16R2.3806 CNCC1CN(C(=O)O1)c2ccccc2 7a_106832991635_100000700024 [0,1,0,1,0,0|2,0,0]=4 30267 B16R2.3806 COCC1CN(C(=O)O1)c2ccccc2 34a_100138415774_100000700024 [0,1,0,1,0,0|2,0,0]=4 30268 B16R2.3806 CSCC1CN(C(=O)O1)c2ccccc2 62a_100000700024_200000210301 [0,1,0,1,0,0|2,0,0]=4 30269 B16R2.3806 CSCC1CN(C(=O)O1)c2ccccc2 62a_200000210301_100000700024 [0,1,0,1,0,0|2,0,0]=4 30270 B16R2.3806 [13CH3]SCC1CN(C(=O)O1)c2ccccc2 62a_100000700024_200025704644 [0,1,0,1,0,0|2,0,0]=4 30271 B16R2.3806 [13CH3]SCC1CN(C(=O)O1)c2ccccc2 62a_200025704644_100000700024 [0,1,0,1,0,0|2,0,0]=4 30272 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@@H]1F)c2ccccc2 240690a_100015190264_100000751047 [0,1,0,1,0,0|2,0,0]=4 30273 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@@H]1F)c2ccccc2 527a_100015190264_100000751047 [0,1,0,1,0,0|2,0,0]=4 30274 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@H]1F)c2ccccc2 11a_100025746932_100000751047 [0,1,0,1,0,0|2,0,0]=4 30275 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@H]1F)c2ccccc2 1626a_100025746932_100000751047 [0,1,0,1,0,0|2,0,0]=4 30276 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@H]1F)c2ccccc2 240690a_100025746932_100000751047 [0,1,0,1,0,0|2,0,0]=4 30277 B16R2.5858 C[C@H](C(=O)N[C@@H]1C[C@H]1F)c2ccccc2 527a_100025746932_100000751047 [0,1,0,1,0,0|2,0,0]=4 30278 B16R2.5858 O=C(N[C@@H]1C[C@@H]1F)C(F)c2ccccc2 240690a_100015190264_100000698975 [0,1,0,1,0,0|2,0,0]=4 30279 B16R2.5858 O=C(N[C@@H]1C[C@@H]1F)C(F)c2ccccc2 527a_100015190264_100000698975 [0,1,0,1,0,0|2,0,0]=4 30280 B16R2.5858 O=C(N[C@@H]1C[C@@H]1F)[C@H](O)c2ccccc2 240690a_100015190264_100000684486 [0,1,0,1,0,0|2,0,0]=4 30281 B16R2.5858 O=C(N[C@@H]1C[C@H]1F)C(F)c2ccccc2 11a_100025746932_100000698975 [0,1,0,1,0,0|2,0,0]=4 30282 B16R2.5858 O=C(N[C@@H]1C[C@H]1F)C(F)c2ccccc2 1626a_100025746932_100000698975 [0,1,0,1,0,0|2,0,0]=4 30283 B16R2.5858 O=C(N[C@@H]1C[C@H]1F)C(F)c2ccccc2 240690a_100025746932_100000698975 [0,1,0,1,0,0|2,0,0]=4 30284 B16R2.5858 O=C(N[C@@H]1C[C@H]1F)C(F)c2ccccc2 527a_100025746932_100000698975 [0,1,0,1,0,0|2,0,0]=4 30285 B16R2.5858 O=C(N[C@@H]1C[C@H]1F)[C@H](O)c2ccccc2 240690a_100025746932_100000684486 [0,1,0,1,0,0|2,0,0]=4 30286 B16R2.6780 C=C(C(=O)C1CCCC1)c2ccccc2 1458a_100000065200_100000179811 [0,1,0,1,0,0|1,0,1]=4 30287 B16R2.6780 CC(C(=O)C1=CCCC1)c2ccccc2 1458a_100000038896_100000230085 [0,1,0,1,0,0|1,0,1]=4 30288 B16R2.6780 CC(C(=O)C1CCCC1)c2ccccc2 1458a_100000210718_100000230085 [0,1,0,1,0,0|1,0,0]=3 30289 B16R2.6780 CC(C(=O)C1CCCC1)c2ccccn2 1458a_100000722050_100000179811 [0,1,0,1,0,0|2,0,0]=4 30290 B16R2.6780 CC(C(=O)C1CCCS1)c2ccccc2 1458a_100012002731_100000230085 [0,1,0,1,0,0|2,0,0]=4 30291 B16R2.6780 CC(C(=O)C1CCOC1)c2ccccc2 1458a_100011219752_100000230085 [0,1,0,1,0,0|2,0,0]=4 30292 B16R2.6780 CC(C(=O)N1CCCC1)c2ccccn2 240690a_100000188435_100000722050 [0,1,0,1,0,0|2,0,0]=4 30293 B16R2.6780 CC(C(=O)N1CCCC1)c2ccccn2 527a_100000188435_100000722050 [0,1,0,1,0,0|2,0,0]=4 30294 B16R2.6780 CC(C(=O)[C@@H]1CCCO1)c2ccccc2 1458a_100000686382_100000230085 [0,1,0,1,0,0|2,0,0]=4 30295 B16R2.6780 CN(C(=O)C1CCCC1)c2ccccc2 11a_100000210012_100000210718 [0,1,0,1,0,0|2,0,0]=4 30296 B16R2.6780 CN(C(=O)C1CCCC1)c2ccccc2 1626a_100000210012_100000210718 [0,1,0,1,0,0|2,0,0]=4 30297 B16R2.6780 CN(C(=O)C1CCCC1)c2ccccc2 22a_100000210012_100000210718 [0,1,0,1,0,0|2,0,0]=4 30298 B16R2.6780 C[C@H](C(=O)C1CCCC1)c2ccccc2 1458a_100000751047_100000179811 [0,1,0,1,0,0|1,0,0]=3 30299 B16R2.6780 C[C@H](C(=O)C1CCOC1)c2ccccc2 1458a_100000751047_100000690089 [0,1,0,1,0,0|2,0,0]=4 30300 B16R2.6780 C[C@H](C(=O)N1CCCC1)c2ccccc2 240690a_100000188435_100000751047 [0,1,0,1,0,0|1,0,0]=3 30301 B16R2.6780 C[C@H](C(=O)N1CCCC1)c2ccccc2 527a_100000188435_100000751047 [0,1,0,1,0,0|1,0,0]=3 30302 B16R2.6780 C[C@H](C(=O)N1CCSC1)c2ccccc2 11a_100011215254_100000751047 [0,1,0,1,0,0|2,0,0]=4 30303 B16R2.6780 C[C@H](C(=O)N1CCSC1)c2ccccc2 240690a_100011215254_100000751047 [0,1,0,1,0,0|2,0,0]=4 30304 B16R2.6780 C[C@H](C(=O)N1CCSC1)c2ccccc2 527a_100011215254_100000751047 [0,1,0,1,0,0|2,0,0]=4 30305 B16R2.6780 O=C(C(F)c1ccccc1)N2CCCC2 240690a_100000188435_100000698975 [0,1,0,1,0,0|1,0,0]=3 30306 B16R2.6780 O=C(C(F)c1ccccc1)N2CCCC2 527a_100000188435_100000698975 [0,1,0,1,0,0|1,0,0]=3 30307 B16R2.6780 O=C(C(F)c1ccccc1)N2CCSC2 11a_100011215254_100000698975 [0,1,0,1,0,0|2,0,0]=4 30308 B16R2.6780 O=C(C(F)c1ccccc1)N2CCSC2 240690a_100011215254_100000698975 [0,1,0,1,0,0|2,0,0]=4 30309 B16R2.6780 O=C(C(F)c1ccccc1)N2CCSC2 527a_100011215254_100000698975 [0,1,0,1,0,0|2,0,0]=4 30310 B16R2.6780 O=C(C1CCCC1)C(F)c2ccccc2 1458a_100000698975_100000179811 [0,1,0,1,0,0|1,0,0]=3 30311 B16R2.6780 O=C(C1CCCC1)[C@H](O)c2ccccc2 1458a_100000684486_100000179811 [0,1,0,1,0,0|1,0,0]=3 30312 B16R2.6780 O=C(C1CCOC1)C(F)c2ccccc2 1458a_100000698975_100000690089 [0,1,0,1,0,0|2,0,0]=4 30313 B16R2.6780 O=C(C1CCOC1)[C@H](O)c2ccccc2 1458a_100000684486_100000690089 [0,1,0,1,0,0|2,0,0]=4 30314 B16R2.6780 O=C([C@H](O)c1ccccc1)N2CCCC2 240690a_100000188435_100000684486 [0,1,0,1,0,0|1,0,0]=3 30315 B16R2.6780 O=C([C@H](O)c1ccccc1)N2CCSC2 240690a_100011215254_100000684486 [0,1,0,1,0,0|2,0,0]=4 30316 B16R2.27760 C=C(C(=O)CC1CCC1)c2ccccc2 1458a_100000065200_100000763275 [0,1,0,1,0,0|1,0,1]=4 30317 B16R2.27760 C=C(C(=O)NC1CCC1)c2ccccc2 1626a_100000749019_100000065200 [0,1,0,1,0,0|1,0,1]=4 30318 B16R2.27760 CC(C(=O)C=C1CCC1)c2ccccc2 1458a_100000686340_100000230085 [0,1,0,1,0,0|1,0,1]=4 30319 B16R2.27760 CC(C(=O)CC1CCC1)c2ccccc2 1458a_100000763092_100000230085 [0,1,0,1,0,0|1,0,0]=3 30320 B16R2.27760 CC(C(=O)CC1CCC1)c2ccccn2 1458a_100000722050_100000763275 [0,1,0,1,0,0|2,0,0]=4 30321 B16R2.27760 CC(C(=O)CC1COC1)c2ccccc2 1458a_100000687760_100000230085 [0,1,0,1,0,0|2,0,0]=4 30322 B16R2.27760 CC(C(=O)NC1CCC1)c2ccccn2 11a_100000749019_100000722050 [0,1,0,1,0,0|2,0,0]=4 30323 B16R2.27760 CC(C(=O)NC1CCC1)c2ccccn2 1626a_100000749019_100000722050 [0,1,0,1,0,0|2,0,0]=4 30324 B16R2.27760 CC(C(=O)NC1CCC1)c2ccccn2 240690a_100000749019_100000722050 [0,1,0,1,0,0|2,0,0]=4 30325 B16R2.27760 CC(C(=O)NC1CCC1)c2ccccn2 527a_100000749019_100000722050 [0,1,0,1,0,0|2,0,0]=4 30326 B16R2.27760 CN(C(=O)CC1CCC1)c2ccccc2 11a_100000210012_100000763092 [0,1,0,1,0,0|2,0,0]=4 30327 B16R2.27760 CN(C(=O)CC1CCC1)c2ccccc2 1626a_100000210012_100000763092 [0,1,0,1,0,0|2,0,0]=4 30328 B16R2.27760 CN(C(=O)CC1CCC1)c2ccccc2 22a_100000210012_100000763092 [0,1,0,1,0,0|2,0,0]=4 30329 B16R2.27760 CN(C(=O)NC1CCC1)c2ccccc2 512a_100000749019_100000210012 [0,1,0,1,0,0|2,0,0]=4 30330 B16R2.27760 C[C@H](C(=O)CC1CCC1)c2ccccc2 1458a_100000751047_100000763275 [0,1,0,1,0,0|1,0,0]=3 30331 B16R2.27760 C[C@H](C(=O)CC1CCO1)c2ccccc2 1458a_100000751047_100000103362 [0,1,0,1,0,0|2,0,0]=4 30332 B16R2.27760 C[C@H](C(=O)CC1COC1)c2ccccc2 1458a_100000751047_100010264016 [0,1,0,1,0,0|2,0,0]=4 30333 B16R2.27760 C[C@H](C(=O)NC1CCC1)c2ccccc2 11a_100000749019_100000751047 [0,1,0,1,0,0|1,0,0]=3 30334 B16R2.27760 C[C@H](C(=O)NC1CCC1)c2ccccc2 1626a_100000749019_100000751047 [0,1,0,1,0,0|1,0,0]=3 30335 B16R2.27760 C[C@H](C(=O)NC1CCC1)c2ccccc2 240690a_100000749019_100000751047 [0,1,0,1,0,0|1,0,0]=3 30336 B16R2.27760 C[C@H](C(=O)NC1CCC1)c2ccccc2 527a_100000749019_100000751047 [0,1,0,1,0,0|1,0,0]=3 30337 B16R2.27760 C[C@H](C(=O)NC1COC1)c2ccccc2 11a_100016991112_100000751047 [0,1,0,1,0,0|2,0,0]=4 30338 B16R2.27760 C[C@H](C(=O)NC1COC1)c2ccccc2 1626a_100016991112_100000751047 [0,1,0,1,0,0|2,0,0]=4 30339 B16R2.27760 C[C@H](C(=O)NC1COC1)c2ccccc2 240690a_100016991112_100000751047 [0,1,0,1,0,0|2,0,0]=4 30340 B16R2.27760 C[C@H](C(=O)NC1COC1)c2ccccc2 527a_100016991112_100000751047 [0,1,0,1,0,0|2,0,0]=4 30341 B16R2.27760 C[C@H](C(=O)NC1CSC1)c2ccccc2 11a_100016994217_100000751047 [0,1,0,1,0,0|2,0,0]=4 30342 B16R2.27760 C[C@H](C(=O)NC1CSC1)c2ccccc2 1626a_100016994217_100000751047 [0,1,0,1,0,0|2,0,0]=4 30343 B16R2.27760 C[C@H](C(=O)NC1CSC1)c2ccccc2 240690a_100016994217_100000751047 [0,1,0,1,0,0|2,0,0]=4 30344 B16R2.27760 C[C@H](C(=O)NC1CSC1)c2ccccc2 527a_100016994217_100000751047 [0,1,0,1,0,0|2,0,0]=4 30345 B16R2.27760 C[C@H](OC1CCC1)[C@@H](N)c2ccccc2 34a_100134616770_100000749161 [0,1,0,1,0,0|1,0,1]=4 30346 B16R2.27760 O=C(CC1CCC1)C(F)c2ccccc2 1458a_100000698975_100000763275 [0,1,0,1,0,0|1,0,0]=3 30347 B16R2.27760 O=C(CC1CCC1)[C@H](O)c2ccccc2 1458a_100000684486_100000763275 [0,1,0,1,0,0|1,0,0]=3 30348 B16R2.27760 O=C(CC1CCO1)C(F)c2ccccc2 1458a_100000698975_100000103362 [0,1,0,1,0,0|2,0,0]=4 30349 B16R2.27760 O=C(CC1CCO1)[C@H](O)c2ccccc2 1458a_100000684486_100000103362 [0,1,0,1,0,0|2,0,0]=4 30350 B16R2.27760 O=C(CC1COC1)C(F)c2ccccc2 1458a_100000698975_100010264016 [0,1,0,1,0,0|2,0,0]=4 30351 B16R2.27760 O=C(CC1COC1)[C@H](O)c2ccccc2 1458a_100000684486_100010264016 [0,1,0,1,0,0|2,0,0]=4 30352 B16R2.27760 O=C(NC1CCC1)C(F)c2ccccc2 11a_100000749019_100000698975 [0,1,0,1,0,0|1,0,0]=3 30353 B16R2.27760 O=C(NC1CCC1)C(F)c2ccccc2 1626a_100000749019_100000698975 [0,1,0,1,0,0|1,0,0]=3 30354 B16R2.27760 O=C(NC1CCC1)C(F)c2ccccc2 240690a_100000749019_100000698975 [0,1,0,1,0,0|1,0,0]=3 30355 B16R2.27760 O=C(NC1CCC1)C(F)c2ccccc2 527a_100000749019_100000698975 [0,1,0,1,0,0|1,0,0]=3 30356 B16R2.27760 O=C(NC1CCC1)[C@H](O)c2ccccc2 240690a_100000749019_100000684486 [0,1,0,1,0,0|1,0,0]=3 30357 B16R2.27760 O=C(NC1COC1)C(F)c2ccccc2 11a_100016991112_100000698975 [0,1,0,1,0,0|2,0,0]=4 30358 B16R2.27760 O=C(NC1COC1)C(F)c2ccccc2 1626a_100016991112_100000698975 [0,1,0,1,0,0|2,0,0]=4 30359 B16R2.27760 O=C(NC1COC1)C(F)c2ccccc2 240690a_100016991112_100000698975 [0,1,0,1,0,0|2,0,0]=4 30360 B16R2.27760 O=C(NC1COC1)C(F)c2ccccc2 527a_100016991112_100000698975 [0,1,0,1,0,0|2,0,0]=4 30361 B16R2.27760 O=C(NC1COC1)[C@H](O)c2ccccc2 240690a_100016991112_100000684486 [0,1,0,1,0,0|2,0,0]=4 30362 B16R2.27760 O=C(NC1CSC1)C(F)c2ccccc2 11a_100016994217_100000698975 [0,1,0,1,0,0|2,0,0]=4 30363 B16R2.27760 O=C(NC1CSC1)C(F)c2ccccc2 1626a_100016994217_100000698975 [0,1,0,1,0,0|2,0,0]=4 30364 B16R2.27760 O=C(NC1CSC1)C(F)c2ccccc2 240690a_100016994217_100000698975 [0,1,0,1,0,0|2,0,0]=4 30365 B16R2.27760 O=C(NC1CSC1)C(F)c2ccccc2 527a_100016994217_100000698975 [0,1,0,1,0,0|2,0,0]=4 30366 B16R2.27760 O=C(NC1CSC1)[C@H](O)c2ccccc2 240690a_100016994217_100000684486 [0,1,0,1,0,0|2,0,0]=4 30367 B16R2.27783 C=C(C(=O)CCC1CC1)c2ccccc2 1458a_100000065200_100000694398 [0,1,0,1,0,0|1,0,1]=4 30368 B16R2.27783 C=C(C(=O)NCC1CC1)c2ccccc2 1626a_100000735609_100000065200 [0,1,0,1,0,0|1,0,1]=4 30369 B16R2.27783 CC(C(=O)C=CC1CC1)c2ccccc2 1458a_100102529529_100000230085 [0,1,0,1,0,0|1,0,1]=4 30370 B16R2.27783 CC(C(=O)CCC1CC1)c2ccccc2 1458a_100000756386_100000230085 [0,1,0,1,0,0|1,0,0]=3 30371 B16R2.27783 CC(C(=O)CCC1CC1)c2ccccn2 1458a_100000722050_100000694398 [0,1,0,1,0,0|2,0,0]=4 30372 B16R2.27783 CC(C(=O)NCC1CC1)c2ccccn2 11a_100000735609_100000722050 [0,1,0,1,0,0|2,0,0]=4 30373 B16R2.27783 CC(C(=O)NCC1CC1)c2ccccn2 1626a_100000735609_100000722050 [0,1,0,1,0,0|2,0,0]=4 30374 B16R2.27783 CC(C(=O)NCC1CC1)c2ccccn2 240690a_100000735609_100000722050 [0,1,0,1,0,0|2,0,0]=4 30375 B16R2.27783 CC(C(=O)NCC1CC1)c2ccccn2 527a_100000735609_100000722050 [0,1,0,1,0,0|2,0,0]=4 30376 B16R2.27783 CN(C(=O)CCC1CC1)c2ccccc2 11a_100000210012_100000756386 [0,1,0,1,0,0|2,0,0]=4 30377 B16R2.27783 CN(C(=O)CCC1CC1)c2ccccc2 1626a_100000210012_100000756386 [0,1,0,1,0,0|2,0,0]=4 30378 B16R2.27783 CN(C(=O)CCC1CC1)c2ccccc2 22a_100000210012_100000756386 [0,1,0,1,0,0|2,0,0]=4 30379 B16R2.27783 CN(C(=O)NCC1CC1)c2ccccc2 512a_100000735609_100000210012 [0,1,0,1,0,0|2,0,0]=4 30380 B16R2.27783 C[C@H](C(=O)CCC1CC1)c2ccccc2 1458a_100000751047_100000694398 [0,1,0,1,0,0|1,0,0]=3 30381 B16R2.27783 C[C@H](C(=O)CCC1CO1)c2ccccc2 1458a_100000751047_100000732470 [0,1,0,1,0,0|2,0,0]=4 30382 B16R2.27783 C[C@H](C(=O)NCC1CC1)c2ccccc2 11a_100000735609_100000751047 [0,1,0,1,0,0|1,0,0]=3 30383 B16R2.27783 C[C@H](C(=O)NCC1CC1)c2ccccc2 1626a_100000735609_100000751047 [0,1,0,1,0,0|1,0,0]=3 30384 B16R2.27783 C[C@H](C(=O)NCC1CC1)c2ccccc2 240690a_100000735609_100000751047 [0,1,0,1,0,0|1,0,0]=3 30385 B16R2.27783 C[C@H](C(=O)NCC1CC1)c2ccccc2 527a_100000735609_100000751047 [0,1,0,1,0,0|1,0,0]=3 30386 B16R2.27783 C[C@H](C(=O)NNC1CC1)c2ccccc2 22a_100000701032_100000751047 [0,1,0,1,0,0|2,0,0]=4 30387 B16R2.27783 C[C@H](OCC1CC1)[C@@H](N)c2ccccc2 34a_100134616770_100000742324 [0,1,0,1,0,0|1,0,1]=4 30388 B16R2.27783 O=C(CCC1CC1)C(F)c2ccccc2 1458a_100000698975_100000694398 [0,1,0,1,0,0|1,0,0]=3 30389 B16R2.27783 O=C(CCC1CC1)[C@H](O)c2ccccc2 1458a_100000684486_100000694398 [0,1,0,1,0,0|1,0,0]=3 30390 B16R2.27783 O=C(CCC1CO1)C(F)c2ccccc2 1458a_100000698975_100000732470 [0,1,0,1,0,0|2,0,0]=4 30391 B16R2.27783 O=C(CCC1CO1)[C@H](O)c2ccccc2 1458a_100000684486_100000732470 [0,1,0,1,0,0|2,0,0]=4 30392 B16R2.27783 O=C(NCC1CC1)C(F)c2ccccc2 11a_100000735609_100000698975 [0,1,0,1,0,0|1,0,0]=3 30393 B16R2.27783 O=C(NCC1CC1)C(F)c2ccccc2 1626a_100000735609_100000698975 [0,1,0,1,0,0|1,0,0]=3 30394 B16R2.27783 O=C(NCC1CC1)C(F)c2ccccc2 240690a_100000735609_100000698975 [0,1,0,1,0,0|1,0,0]=3 30395 B16R2.27783 O=C(NCC1CC1)C(F)c2ccccc2 527a_100000735609_100000698975 [0,1,0,1,0,0|1,0,0]=3 30396 B16R2.27783 O=C(NCC1CC1)[C@H](O)c2ccccc2 240690a_100000735609_100000684486 [0,1,0,1,0,0|1,0,0]=3 30397 B16R2.27783 O=C(NNC1CC1)C(F)c2ccccc2 22a_100000701032_100000698975 [0,1,0,1,0,0|2,0,0]=4 30398 B16R2.27783 O=C(NNC1CC1)[C@H](O)c2ccccc2 22a_100000701032_100000684486 [0,1,0,1,0,0|2,0,0]=4 30399 B16R2.133 Cc1ccc(cc1)CC(=O)C2=CCCC2 1458a_100000038896_100000210814 [0,1,0,1,0,0|1,0,1]=4 30400 B16R2.133 Cc1ccc(cc1)CC(=O)C2CCCC2 1458a_100000210718_100000210814 [0,1,0,1,0,0|1,0,0]=3 30401 B16R2.133 Cc1ccc(cc1)CC(=O)C2CCCC2 1458a_100000212244_100000179811 [0,1,0,1,0,0|1,0,0]=3 30402 B16R2.133 Cc1ccc(cc1)CC(=O)C2CCCS2 1458a_100012002731_100000210814 [0,1,0,1,0,0|2,0,0]=4 30403 B16R2.133 Cc1ccc(cc1)CC(=O)C2CCOC2 1458a_100000212244_100000690089 [0,1,0,1,0,0|2,0,0]=4 30404 B16R2.133 Cc1ccc(cc1)CC(=O)C2CCOC2 1458a_100011219752_100000210814 [0,1,0,1,0,0|2,0,0]=4 30405 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCCC2 240690a_100000188435_100000212244 [0,1,0,1,0,0|1,0,0]=3 30406 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCCC2 527a_100000188435_100000212244 [0,1,0,1,0,0|1,0,0]=3 30407 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCSC2 11a_100011215254_100000212244 [0,1,0,1,0,0|2,0,0]=4 30408 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCSC2 240690a_100011215254_100000212244 [0,1,0,1,0,0|2,0,0]=4 30409 B16R2.133 Cc1ccc(cc1)CC(=O)N2CCSC2 527a_100011215254_100000212244 [0,1,0,1,0,0|2,0,0]=4 30410 B16R2.133 Cc1ccc(cc1)CC(=O)[C@@H]2CCCO2 1458a_100000686382_100000210814 [0,1,0,1,0,0|2,0,0]=4 30411 B16R2.133 Cc1ccc(cc1)NC(=O)C2CCCC2 11a_100000124888_100000210718 [0,1,0,1,0,0|2,0,0]=4 30412 B16R2.133 Cc1ccc(cc1)NC(=O)C2CCCC2 1626a_100000124888_100000210718 [0,1,0,1,0,0|2,0,0]=4 30413 B16R2.133 Cc1ccc(cc1)NC(=O)C2CCCC2 22a_100000124888_100000210718 [0,1,0,1,0,0|2,0,0]=4 30414 B16R2.133 Cc1ccc(cc1)NC(=O)C2CCCC2 527a_100000124888_100000210718 [0,1,0,1,0,0|2,0,0]=4 30415 B16R2.133 Cc1ccc(cc1)NC(=O)N2CCCC2 2430a_100000124888_100000188435 [0,1,0,1,0,0|2,0,0]=4 30416 B16R2.133 Cc1ccc(cn1)CC(=O)C2CCCC2 1458a_100000210718_100016987292 [0,1,0,1,0,0|2,0,0]=4 30417 B16R2.133 Cc1ccc(cn1)CC(=O)C2CCCC2 1458a_100000740413_100000179811 [0,1,0,1,0,0|2,0,0]=4 30418 B16R2.133 Cc1ccc(cn1)CC(=O)N2CCCC2 240690a_100000188435_100000740413 [0,1,0,1,0,0|2,0,0]=4 30419 B16R2.133 Cc1ccc(cn1)CC(=O)N2CCCC2 527a_100000188435_100000740413 [0,1,0,1,0,0|2,0,0]=4 30420 B16R2.133 Cc1ccc(nc1)CC(=O)C2CCCC2 1458a_100000210718_100000691093 [0,1,0,1,0,0|2,0,0]=4 30421 B16R2.133 Cc1ccc(nc1)CC(=O)C2CCCC2 1458a_100025705728_100000179811 [0,1,0,1,0,0|2,0,0]=4 30422 B16R2.133 Cc1ccc(nc1)CC(=O)N2CCCC2 240690a_100000188435_100025705728 [0,1,0,1,0,0|2,0,0]=4 30423 B16R2.133 O=C(Cc1ccc(cc1)Br)C2=CCCC2 1458a_100000038896_100000189115 [0,1,0,1,0,0|1,0,1]=4 30424 B16R2.133 O=C(Cc1ccc(cc1)Br)C2CCCC2 1458a_100000198978_100000179811 [0,1,0,1,0,0|1,0,0]=3 30425 B16R2.133 O=C(Cc1ccc(cc1)Br)C2CCCC2 1458a_100000210718_100000189115 [0,1,0,1,0,0|1,0,0]=3 30426 B16R2.133 O=C(Cc1ccc(cc1)Br)C2CCCS2 1458a_100012002731_100000189115 [0,1,0,1,0,0|2,0,0]=4 30427 B16R2.133 O=C(Cc1ccc(cc1)Br)C2CCOC2 1458a_100000198978_100000690089 [0,1,0,1,0,0|2,0,0]=4 30428 B16R2.133 O=C(Cc1ccc(cc1)Br)C2CCOC2 1458a_100011219752_100000189115 [0,1,0,1,0,0|2,0,0]=4 30429 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCCC2 240690a_100000188435_100000198978 [0,1,0,1,0,0|1,0,0]=3 30430 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCCC2 527a_100000188435_100000198978 [0,1,0,1,0,0|1,0,0]=3 30431 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCSC2 11a_100011215254_100000198978 [0,1,0,1,0,0|2,0,0]=4 30432 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCSC2 240690a_100011215254_100000198978 [0,1,0,1,0,0|2,0,0]=4 30433 B16R2.133 O=C(Cc1ccc(cc1)Br)N2CCSC2 527a_100011215254_100000198978 [0,1,0,1,0,0|2,0,0]=4 30434 B16R2.133 O=C(Cc1ccc(cc1)Br)[C@@H]2CCCO2 1458a_100000686382_100000189115 [0,1,0,1,0,0|2,0,0]=4 30435 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2=CCCC2 1458a_100000038896_100000694040 [0,1,0,1,0,0|1,0,1]=4 30436 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2CCCC2 1458a_100000210718_100000694040 [0,1,0,1,0,0|1,0,0]=3 30437 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2CCCC2 1458a_100000211027_100000179811 [0,1,0,1,0,0|1,0,0]=3 30438 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2CCCS2 1458a_100012002731_100000694040 [0,1,0,1,0,0|2,0,0]=4 30439 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2CCOC2 1458a_100000211027_100000690089 [0,1,0,1,0,0|2,0,0]=4 30440 B16R2.133 O=C(Cc1ccc(cc1)Cl)C2CCOC2 1458a_100011219752_100000694040 [0,1,0,1,0,0|2,0,0]=4 30441 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCCC2 240690a_100000188435_100000211027 [0,1,0,1,0,0|1,0,0]=3 30442 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCCC2 527a_100000188435_100000211027 [0,1,0,1,0,0|1,0,0]=3 30443 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCSC2 11a_100011215254_100000211027 [0,1,0,1,0,0|2,0,0]=4 30444 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCSC2 240690a_100011215254_100000211027 [0,1,0,1,0,0|2,0,0]=4 30445 B16R2.133 O=C(Cc1ccc(cc1)Cl)N2CCSC2 527a_100011215254_100000211027 [0,1,0,1,0,0|2,0,0]=4 30446 B16R2.133 O=C(Cc1ccc(cc1)Cl)[C@@H]2CCCO2 1458a_100000686382_100000694040 [0,1,0,1,0,0|2,0,0]=4 30447 B16R2.133 O=C(Cc1ccc(cc1)F)C2=CCCC2 1458a_100000038896_100000198546 [0,1,0,1,0,0|1,0,1]=4 30448 B16R2.133 O=C(Cc1ccc(cc1)F)C2CCCC2 1458a_100000210718_100000198546 [0,1,0,1,0,0|1,0,0]=3 30449 B16R2.133 O=C(Cc1ccc(cc1)F)C2CCCC2 1458a_100000210951_100000179811 [0,1,0,1,0,0|1,0,0]=3 30450 B16R2.133 O=C(Cc1ccc(cc1)F)C2CCCS2 1458a_100012002731_100000198546 [0,1,0,1,0,0|2,0,0]=4 30451 B16R2.133 O=C(Cc1ccc(cc1)F)C2CCOC2 1458a_100000210951_100000690089 [0,1,0,1,0,0|2,0,0]=4 30452 B16R2.133 O=C(Cc1ccc(cc1)F)C2CCOC2 1458a_100011219752_100000198546 [0,1,0,1,0,0|2,0,0]=4 30453 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCCC2 240690a_100000188435_100000210951 [0,1,0,1,0,0|1,0,0]=3 30454 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCCC2 527a_100000188435_100000210951 [0,1,0,1,0,0|1,0,0]=3 30455 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCSC2 11a_100011215254_100000210951 [0,1,0,1,0,0|2,0,0]=4 30456 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCSC2 240690a_100011215254_100000210951 [0,1,0,1,0,0|2,0,0]=4 30457 B16R2.133 O=C(Cc1ccc(cc1)F)N2CCSC2 527a_100011215254_100000210951 [0,1,0,1,0,0|2,0,0]=4 30458 B16R2.133 O=C(Cc1ccc(cc1)F)[C@@H]2CCCO2 1458a_100000686382_100000198546 [0,1,0,1,0,0|2,0,0]=4 30459 B16R2.133 O=C(Cc1ccc(cc1)I)C2=CCCC2 1458a_100000038896_100000189116 [0,1,0,1,0,0|1,0,1]=4 30460 B16R2.133 O=C(Cc1ccc(cc1)I)C2CCCC2 1458a_100000210718_100000189116 [0,1,0,1,0,0|1,0,0]=3 30461 B16R2.133 O=C(Cc1ccc(cc1)I)C2CCCC2 1458a_100000688869_100000179811 [0,1,0,1,0,0|1,0,0]=3 30462 B16R2.133 O=C(Cc1ccc(cc1)I)C2CCCS2 1458a_100012002731_100000189116 [0,1,0,1,0,0|2,0,0]=4 30463 B16R2.133 O=C(Cc1ccc(cc1)I)C2CCOC2 1458a_100000688869_100000690089 [0,1,0,1,0,0|2,0,0]=4 30464 B16R2.133 O=C(Cc1ccc(cc1)I)C2CCOC2 1458a_100011219752_100000189116 [0,1,0,1,0,0|2,0,0]=4 30465 B16R2.133 O=C(Cc1ccc(cc1)I)N2CCCC2 240690a_100000188435_100000688869 [0,1,0,1,0,0|1,0,0]=3 30466 B16R2.133 O=C(Cc1ccc(cc1)I)N2CCCC2 527a_100000188435_100000688869 [0,1,0,1,0,0|1,0,0]=3 30467 B16R2.133 O=C(Cc1ccc(cc1)I)N2CCSC2 11a_100011215254_100000688869 [0,1,0,1,0,0|2,0,0]=4 30468 B16R2.133 O=C(Cc1ccc(cc1)I)N2CCSC2 240690a_100011215254_100000688869 [0,1,0,1,0,0|2,0,0]=4 30469 B16R2.133 O=C(Cc1ccc(cc1)I)N2CCSC2 527a_100011215254_100000688869 [0,1,0,1,0,0|2,0,0]=4 30470 B16R2.133 O=C(Cc1ccc(cc1)I)[C@@H]2CCCO2 1458a_100000686382_100000189116 [0,1,0,1,0,0|2,0,0]=4 30471 B16R2.133 O=C(Cc1ccc(cc1)O)C2CCCC2 1458a_100000198540_100000179811 [0,1,0,1,0,0|1,0,0]=3 30472 B16R2.133 O=C(Cc1ccc(cc1)O)C2CCOC2 1458a_100000198540_100000690089 [0,1,0,1,0,0|2,0,0]=4 30473 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCCC2 240690a_100000188435_100000198540 [0,1,0,1,0,0|1,0,0]=3 30474 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCCC2 527a_100000188435_100000198540 [0,1,0,1,0,0|1,0,0]=3 30475 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCSC2 240690a_100011215254_100000198540 [0,1,0,1,0,0|2,0,0]=4 30476 B16R2.133 O=C(Cc1ccc(cc1)O)N2CCSC2 527a_100011215254_100000198540 [0,1,0,1,0,0|2,0,0]=4 30477 B16R2.133 O=C(Cc1ccc(cn1)Br)C2CCCC2 1458a_100000210718_100000702658 [0,1,0,1,0,0|2,0,0]=4 30478 B16R2.133 O=C(Cc1ccc(cn1)Br)C2CCCC2 1458a_100020629044_100000179811 [0,1,0,1,0,0|2,0,0]=4 30479 B16R2.133 O=C(Cc1ccc(cn1)Br)N2CCCC2 240690a_100000188435_100020629044 [0,1,0,1,0,0|2,0,0]=4 30480 B16R2.133 O=C(Cc1ccc(cn1)Cl)C2CCCC2 1458a_100000210718_100012066911 [0,1,0,1,0,0|2,0,0]=4 30481 B16R2.133 O=C(Cc1ccc(cn1)Cl)C2CCCC2 1458a_100000728320_100000179811 [0,1,0,1,0,0|2,0,0]=4 30482 B16R2.133 O=C(Cc1ccc(cn1)Cl)N2CCCC2 240690a_100000188435_100000728320 [0,1,0,1,0,0|2,0,0]=4 30483 B16R2.133 O=C(Cc1ccc(cn1)Cl)N2CCCC2 527a_100000188435_100000728320 [0,1,0,1,0,0|2,0,0]=4 30484 B16R2.133 O=C(Cc1ccc(cn1)F)C2CCCC2 1458a_100000210718_100000703193 [0,1,0,1,0,0|2,0,0]=4 30485 B16R2.133 O=C(Cc1ccc(nc1)Br)C2CCCC2 1458a_100000210718_100009831999 [0,1,0,1,0,0|2,0,0]=4 30486 B16R2.133 O=C(Cc1ccc(nc1)Br)C2CCCC2 1458a_100010067268_100000179811 [0,1,0,1,0,0|2,0,0]=4 30487 B16R2.133 O=C(Cc1ccc(nc1)Br)N2CCCC2 240690a_100000188435_100010067268 [0,1,0,1,0,0|2,0,0]=4 30488 B16R2.133 O=C(Cc1ccc(nc1)Br)N2CCCC2 527a_100000188435_100010067268 [0,1,0,1,0,0|2,0,0]=4 30489 B16R2.133 O=C(Cc1ccc(nc1)Cl)C2CCCC2 1458a_100000061944_100000179811 [0,1,0,1,0,0|2,0,0]=4 30490 B16R2.133 O=C(Cc1ccc(nc1)Cl)C2CCCC2 1458a_100000210718_100000735431 [0,1,0,1,0,0|2,0,0]=4 30491 B16R2.133 O=C(Cc1ccc(nc1)Cl)N2CCCC2 240690a_100000188435_100000061944 [0,1,0,1,0,0|2,0,0]=4 30492 B16R2.133 O=C(Cc1ccc(nc1)Cl)N2CCCC2 527a_100000188435_100000061944 [0,1,0,1,0,0|2,0,0]=4 30493 B16R2.133 O=C(Cc1ccc(nc1)F)C2CCCC2 1458a_100000210718_100009820150 [0,1,0,1,0,0|2,0,0]=4 30494 B16R2.133 O=C(Cn1ccc(=O)cc1)C2CCCC2 1458a_200000238563_100000179811 [0,1,0,1,0,0|2,0,0]=4 30495 B16R2.133 O=C(Cn1ccc(=O)cc1)N2CCCC2 240690a_100000188435_200000238563 [0,1,0,1,0,0|2,0,0]=4 30496 B16R2.133 O=C(Cn1ccc(=O)cc1)N2CCCC2 527a_100000188435_200000238563 [0,1,0,1,0,0|2,0,0]=4 30497 B16R2.133 O=C(Nc1ccc(cc1)Br)C2CCCC2 11a_100000210018_100000210718 [0,1,0,1,0,0|2,0,0]=4 30498 B16R2.133 O=C(Nc1ccc(cc1)Br)C2CCCC2 1626a_100000210018_100000210718 [0,1,0,1,0,0|2,0,0]=4 30499 B16R2.133 O=C(Nc1ccc(cc1)Br)C2CCCC2 22a_100000210018_100000210718 [0,1,0,1,0,0|2,0,0]=4 30500 B16R2.133 O=C(Nc1ccc(cc1)Br)C2CCCC2 527a_100000210018_100000210718 [0,1,0,1,0,0|2,0,0]=4 30501 B16R2.133 O=C(Nc1ccc(cc1)Br)N2CCCC2 2430a_100000210018_100000188435 [0,1,0,1,0,0|2,0,0]=4 30502 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 11a_100000210052_100000210718 [0,1,0,1,0,0|2,0,0]=4 30503 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 1626a_100000210052_100000210718 [0,1,0,1,0,0|2,0,0]=4 30504 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 22a_100000210052_100000210718 [0,1,0,1,0,0|2,0,0]=4 30505 B16R2.133 O=C(Nc1ccc(cc1)Cl)C2CCCC2 527a_100000210052_100000210718 [0,1,0,1,0,0|2,0,0]=4 30506 B16R2.133 O=C(Nc1ccc(cc1)Cl)N2CCCC2 2430a_100000210052_100000188435 [0,1,0,1,0,0|2,0,0]=4 30507 B16R2.133 O=C(Nc1ccc(cc1)F)C2CCCC2 11a_100000185862_100000210718 [0,1,0,1,0,0|2,0,0]=4 30508 B16R2.133 O=C(Nc1ccc(cc1)F)C2CCCC2 1626a_100000185862_100000210718 [0,1,0,1,0,0|2,0,0]=4 30509 B16R2.133 O=C(Nc1ccc(cc1)F)C2CCCC2 22a_100000185862_100000210718 [0,1,0,1,0,0|2,0,0]=4 30510 B16R2.133 O=C(Nc1ccc(cc1)F)C2CCCC2 527a_100000185862_100000210718 [0,1,0,1,0,0|2,0,0]=4 30511 B16R2.133 O=C(Nc1ccc(cc1)F)N2CCCC2 2430a_100000185862_100000188435 [0,1,0,1,0,0|2,0,0]=4 30512 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 11a_100000185761_100000210718 [0,1,0,1,0,0|2,0,0]=4 30513 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 1626a_100000185761_100000210718 [0,1,0,1,0,0|2,0,0]=4 30514 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 22a_100000185761_100000210718 [0,1,0,1,0,0|2,0,0]=4 30515 B16R2.133 O=C(Nc1ccc(cc1)I)C2CCCC2 527a_100000185761_100000210718 [0,1,0,1,0,0|2,0,0]=4 30516 B16R2.133 O=C(Nc1ccc(cc1)I)N2CCCC2 2430a_100000185761_100000188435 [0,1,0,1,0,0|2,0,0]=4 30517 B16R2.133 O=C(Nc1ccc(cc1)O)C2CCCC2 22a_100000185829_100000210718 [0,1,0,1,0,0|2,0,0]=4 30518 B16R2.133 O=C(Nc1ccc(cc1)O)N2CCCC2 2430a_100000185829_100000188435 [0,1,0,1,0,0|2,0,0]=4 30519 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Br 11a_100000755817_100000198978 [0,1,0,1,0,0|1,0,0]=3 30520 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Br 240690a_100000755817_100000198978 [0,1,0,1,0,0|1,0,0]=3 30521 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Br 527a_100000755817_100000198978 [0,1,0,1,0,0|1,0,0]=3 30522 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Cl 11a_100000755817_100000211027 [0,1,0,1,0,0|1,0,0]=3 30523 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Cl 240690a_100000755817_100000211027 [0,1,0,1,0,0|1,0,0]=3 30524 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)Cl 527a_100000755817_100000211027 [0,1,0,1,0,0|1,0,0]=3 30525 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)F 11a_100000755817_100000210951 [0,1,0,1,0,0|1,0,0]=3 30526 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)F 240690a_100000755817_100000210951 [0,1,0,1,0,0|1,0,0]=3 30527 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)F 527a_100000755817_100000210951 [0,1,0,1,0,0|1,0,0]=3 30528 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)I 11a_100000755817_100000688869 [0,1,0,1,0,0|1,0,0]=3 30529 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)I 240690a_100000755817_100000688869 [0,1,0,1,0,0|1,0,0]=3 30530 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)I 527a_100000755817_100000688869 [0,1,0,1,0,0|1,0,0]=3 30531 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)O 240690a_100000755817_100000198540 [0,1,0,1,0,0|1,0,0]=3 30532 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cc2)O 527a_100000755817_100000198540 [0,1,0,1,0,0|1,0,0]=3 30533 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cn2)Br 11a_100000755817_100020629044 [0,1,0,1,0,0|2,0,0]=4 30534 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cn2)Br 240690a_100000755817_100020629044 [0,1,0,1,0,0|2,0,0]=4 30535 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cn2)Cl 11a_100000755817_100000728320 [0,1,0,1,0,0|2,0,0]=4 30536 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cn2)Cl 240690a_100000755817_100000728320 [0,1,0,1,0,0|2,0,0]=4 30537 B16R2.1133 CC1CCN1C(=O)Cc2ccc(cn2)Cl 527a_100000755817_100000728320 [0,1,0,1,0,0|2,0,0]=4 30538 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Br 11a_100000755817_100010067268 [0,1,0,1,0,0|2,0,0]=4 30539 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Br 240690a_100000755817_100010067268 [0,1,0,1,0,0|2,0,0]=4 30540 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Br 527a_100000755817_100010067268 [0,1,0,1,0,0|2,0,0]=4 30541 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Cl 11a_100000755817_100000061944 [0,1,0,1,0,0|2,0,0]=4 30542 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Cl 240690a_100000755817_100000061944 [0,1,0,1,0,0|2,0,0]=4 30543 B16R2.1133 CC1CCN1C(=O)Cc2ccc(nc2)Cl 527a_100000755817_100000061944 [0,1,0,1,0,0|2,0,0]=4 30544 B16R2.1133 CC1CCN1C(=O)Cn2ccc(=O)cc2 11a_100000755817_200000238563 [0,1,0,1,0,0|2,0,0]=4 30545 B16R2.1133 CC1CCN1C(=O)Cn2ccc(=O)cc2 240690a_100000755817_200000238563 [0,1,0,1,0,0|2,0,0]=4 30546 B16R2.1133 CC1CCN1C(=O)Cn2ccc(=O)cc2 527a_100000755817_200000238563 [0,1,0,1,0,0|2,0,0]=4 30547 B16R2.1133 CC1CCN1C(=O)Nc2ccc(cc2)Br 2430a_100000210018_100000755817 [0,1,0,1,0,0|2,0,0]=4 30548 B16R2.1133 CC1CCN1C(=O)Nc2ccc(cc2)Cl 2430a_100000210052_100000755817 [0,1,0,1,0,0|2,0,0]=4 30549 B16R2.1133 CC1CCN1C(=O)Nc2ccc(cc2)F 2430a_100000185862_100000755817 [0,1,0,1,0,0|2,0,0]=4 30550 B16R2.1133 CC1CCN1C(=O)Nc2ccc(cc2)I 2430a_100000185761_100000755817 [0,1,0,1,0,0|2,0,0]=4 30551 B16R2.1133 CC1CCN1C(=O)Nc2ccc(cc2)O 2430a_100000185829_100000755817 [0,1,0,1,0,0|2,0,0]=4 30552 B16R2.1133 Cc1ccc(cc1)CC(=O)N2CCC2C 11a_100000755817_100000212244 [0,1,0,1,0,0|1,0,0]=3 30553 B16R2.1133 Cc1ccc(cc1)CC(=O)N2CCC2C 240690a_100000755817_100000212244 [0,1,0,1,0,0|1,0,0]=3 30554 B16R2.1133 Cc1ccc(cc1)CC(=O)N2CCC2C 527a_100000755817_100000212244 [0,1,0,1,0,0|1,0,0]=3 30555 B16R2.1133 Cc1ccc(cc1)NC(=O)N2CCC2C 2430a_100000124888_100000755817 [0,1,0,1,0,0|2,0,0]=4 30556 B16R2.1133 Cc1ccc(cn1)CC(=O)N2CCC2C 11a_100000755817_100000740413 [0,1,0,1,0,0|2,0,0]=4 30557 B16R2.1133 Cc1ccc(cn1)CC(=O)N2CCC2C 240690a_100000755817_100000740413 [0,1,0,1,0,0|2,0,0]=4 30558 B16R2.1133 Cc1ccc(cn1)CC(=O)N2CCC2C 527a_100000755817_100000740413 [0,1,0,1,0,0|2,0,0]=4 30559 B16R2.1133 Cc1ccc(nc1)CC(=O)N2CCC2C 11a_100000755817_100025705728 [0,1,0,1,0,0|2,0,0]=4 30560 B16R2.1133 Cc1ccc(nc1)CC(=O)N2CCC2C 240690a_100000755817_100025705728 [0,1,0,1,0,0|2,0,0]=4 30561 B16R2.1136 Cc1ccc(cc1)CC(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212244 [0,1,0,1,0,0|2,0,0]=4 30562 B16R2.1136 Cc1ccc(cc1)CC(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212244 [0,1,0,1,0,0|2,0,0]=4 30563 B16R2.1136 Cc1ccc(cc1)CC(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000212244 [0,1,0,1,0,0|2,0,0]=4 30564 B16R2.1136 Cc1ccc(cc1)CC(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212244 [0,1,0,1,0,0|2,0,0]=4 30565 B16R2.1136 Cc1ccc(cc1)CC(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212244 [0,1,0,1,0,0|2,0,0]=4 30566 B16R2.1136 O=C(Cc1ccc(cc1)Br)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000198978 [0,1,0,1,0,0|2,0,0]=4 30567 B16R2.1136 O=C(Cc1ccc(cc1)Br)N[C@@H]2C[C@@H]2F 527a_100015190264_100000198978 [0,1,0,1,0,0|2,0,0]=4 30568 B16R2.1136 O=C(Cc1ccc(cc1)Br)N[C@@H]2C[C@H]2F 11a_100025746932_100000198978 [0,1,0,1,0,0|2,0,0]=4 30569 B16R2.1136 O=C(Cc1ccc(cc1)Br)N[C@@H]2C[C@H]2F 240690a_100025746932_100000198978 [0,1,0,1,0,0|2,0,0]=4 30570 B16R2.1136 O=C(Cc1ccc(cc1)Br)N[C@@H]2C[C@H]2F 527a_100025746932_100000198978 [0,1,0,1,0,0|2,0,0]=4 30571 B16R2.1136 O=C(Cc1ccc(cc1)Cl)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000211027 [0,1,0,1,0,0|2,0,0]=4 30572 B16R2.1136 O=C(Cc1ccc(cc1)Cl)N[C@@H]2C[C@@H]2F 527a_100015190264_100000211027 [0,1,0,1,0,0|2,0,0]=4 30573 B16R2.1136 O=C(Cc1ccc(cc1)Cl)N[C@@H]2C[C@H]2F 11a_100025746932_100000211027 [0,1,0,1,0,0|2,0,0]=4 30574 B16R2.1136 O=C(Cc1ccc(cc1)Cl)N[C@@H]2C[C@H]2F 240690a_100025746932_100000211027 [0,1,0,1,0,0|2,0,0]=4 30575 B16R2.1136 O=C(Cc1ccc(cc1)Cl)N[C@@H]2C[C@H]2F 527a_100025746932_100000211027 [0,1,0,1,0,0|2,0,0]=4 30576 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000210951 [0,1,0,1,0,0|2,0,0]=4 30577 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@@H]2F 527a_100015190264_100000210951 [0,1,0,1,0,0|2,0,0]=4 30578 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@H]2F 11a_100025746932_100000210951 [0,1,0,1,0,0|2,0,0]=4 30579 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@H]2F 1626a_100025746932_100000210951 [0,1,0,1,0,0|2,0,0]=4 30580 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@H]2F 240690a_100025746932_100000210951 [0,1,0,1,0,0|2,0,0]=4 30581 B16R2.1136 O=C(Cc1ccc(cc1)F)N[C@@H]2C[C@H]2F 527a_100025746932_100000210951 [0,1,0,1,0,0|2,0,0]=4 30582 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000688869 [0,1,0,1,0,0|2,0,0]=4 30583 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@@H]2F 527a_100015190264_100000688869 [0,1,0,1,0,0|2,0,0]=4 30584 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@H]2F 11a_100025746932_100000688869 [0,1,0,1,0,0|2,0,0]=4 30585 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@H]2F 1626a_100025746932_100000688869 [0,1,0,1,0,0|2,0,0]=4 30586 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@H]2F 240690a_100025746932_100000688869 [0,1,0,1,0,0|2,0,0]=4 30587 B16R2.1136 O=C(Cc1ccc(cc1)I)N[C@@H]2C[C@H]2F 527a_100025746932_100000688869 [0,1,0,1,0,0|2,0,0]=4 30588 B16R2.1136 O=C(Cc1ccc(cc1)O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000198540 [0,1,0,1,0,0|2,0,0]=4 30589 B16R2.1136 O=C(Cc1ccc(cc1)O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000198540 [0,1,0,1,0,0|2,0,0]=4 30590 B16R2.1136 O=C(Cc1ccc(cc1)O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000198540 [0,1,0,1,0,0|2,0,0]=4 30591 B16R2.1136 O=C(Cc1ccc(cc1)O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000198540 [0,1,0,1,0,0|2,0,0]=4 30592 B16R2.1136 O=C(Cc1ccc(cc1)O)N[C@@H]2C[C@H]2F 527a_100025746932_100000198540 [0,1,0,1,0,0|2,0,0]=4 30593 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cc2)Br 1458a_200011661523_100000189115 [0,1,0,1,0,0|1,0,0]=3 30594 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cc2)C 1458a_200011661523_100000210814 [0,1,0,1,0,0|1,0,0]=3 30595 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cc2)Cl 1458a_200011661523_100000694040 [0,1,0,1,0,0|1,0,0]=3 30596 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cc2)F 1458a_200011661523_100000198546 [0,1,0,1,0,0|1,0,0]=3 30597 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cc2)I 1458a_200011661523_100000189116 [0,1,0,1,0,0|1,0,0]=3 30598 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cn2)Br 1458a_200011661523_100000702658 [0,1,0,1,0,0|2,0,0]=4 30599 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cn2)C 1458a_200011661523_100000691093 [0,1,0,1,0,0|2,0,0]=4 30600 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cn2)Cl 1458a_200011661523_100012066911 [0,1,0,1,0,0|2,0,0]=4 30601 B16R2.1378 CCC1CC1C(=O)Cc2ccc(cn2)F 1458a_200011661523_100000703193 [0,1,0,1,0,0|2,0,0]=4 30602 B16R2.1378 CCC1CC1C(=O)Cc2ccc(nc2)Br 1458a_200011661523_100009831999 [0,1,0,1,0,0|2,0,0]=4 30603 B16R2.1378 CCC1CC1C(=O)Cc2ccc(nc2)C 1458a_200011661523_100016987292 [0,1,0,1,0,0|2,0,0]=4 30604 B16R2.1378 CCC1CC1C(=O)Cc2ccc(nc2)Cl 1458a_200011661523_100000735431 [0,1,0,1,0,0|2,0,0]=4 30605 B16R2.1378 CCC1CC1C(=O)Cc2ccc(nc2)F 1458a_200011661523_100009820150 [0,1,0,1,0,0|2,0,0]=4 30606 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Br 11a_100000210018_200011661523 [0,1,0,1,0,0|2,0,0]=4 30607 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Br 1626a_100000210018_200011661523 [0,1,0,1,0,0|2,0,0]=4 30608 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Br 22a_100000210018_200011661523 [0,1,0,1,0,0|2,0,0]=4 30609 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Br 527a_100000210018_200011661523 [0,1,0,1,0,0|2,0,0]=4 30610 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)C 11a_100000124888_200011661523 [0,1,0,1,0,0|2,0,0]=4 30611 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)C 1626a_100000124888_200011661523 [0,1,0,1,0,0|2,0,0]=4 30612 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)C 22a_100000124888_200011661523 [0,1,0,1,0,0|2,0,0]=4 30613 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)C 527a_100000124888_200011661523 [0,1,0,1,0,0|2,0,0]=4 30614 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Cl 11a_100000210052_200011661523 [0,1,0,1,0,0|2,0,0]=4 30615 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_200011661523 [0,1,0,1,0,0|2,0,0]=4 30616 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Cl 22a_100000210052_200011661523 [0,1,0,1,0,0|2,0,0]=4 30617 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)Cl 527a_100000210052_200011661523 [0,1,0,1,0,0|2,0,0]=4 30618 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)F 11a_100000185862_200011661523 [0,1,0,1,0,0|2,0,0]=4 30619 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)F 1626a_100000185862_200011661523 [0,1,0,1,0,0|2,0,0]=4 30620 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)F 22a_100000185862_200011661523 [0,1,0,1,0,0|2,0,0]=4 30621 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)F 527a_100000185862_200011661523 [0,1,0,1,0,0|2,0,0]=4 30622 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)I 11a_100000185761_200011661523 [0,1,0,1,0,0|2,0,0]=4 30623 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)I 1626a_100000185761_200011661523 [0,1,0,1,0,0|2,0,0]=4 30624 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)I 22a_100000185761_200011661523 [0,1,0,1,0,0|2,0,0]=4 30625 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)I 527a_100000185761_200011661523 [0,1,0,1,0,0|2,0,0]=4 30626 B16R2.1378 CCC1CC1C(=O)Nc2ccc(cc2)O 22a_100000185829_200011661523 [0,1,0,1,0,0|2,0,0]=4 30627 B16R2.2435 CCCCOC1Cc2ccc(cc2C1)Br 34a_100010161096_100000210210 [0,1,0,1,0,0|1,0,1]=4 30628 B16R2.33107 CN1CCNC(=O)C1c2ccc(cc2)Cl 2230a_100011653928_200000210301 [0,1,0,1,0,0|2,0,0]=4 30629 B16R2.33107 CN1CCNC(=O)C1c2ccc(cc2)Cl 269982a_100011653928_200000210301 [0,1,0,1,0,0|2,0,0]=4 30630 B16R2.33107 CN1CCNC(=O)C1c2ccc(cc2)Cl 34a_100011653928_200000210301 [0,1,0,1,0,0|2,0,0]=4 30631 B16R2.33107 [13CH3]N1CCNC(=O)C1c2ccc(cc2)Cl 2230a_100011653928_200025704644 [0,1,0,1,0,0|2,0,0]=4 30632 B16R2.33107 [13CH3]N1CCNC(=O)C1c2ccc(cc2)Cl 269982a_100011653928_200025704644 [0,1,0,1,0,0|2,0,0]=4 30633 B16R2.33107 [13CH3]N1CCNC(=O)C1c2ccc(cc2)Cl 34a_100011653928_200025704644 [0,1,0,1,0,0|2,0,0]=4 30634 B16R2.33345 CC(Cc1ccc(cc1)F)OCC2CC2 34a_100011351027_100000742324 [0,1,0,1,0,0|1,0,1]=4 30635 B16R2.33345 CC(Cc1ccc(cc1)F)OCC2CC2 7a_100011351027_100000742324 [0,1,0,1,0,0|1,0,1]=4 30636 B16R2.33345 Cc1ccc(cc1)CC(=O)C=CC2CC2 1458a_100102529529_100000210814 [0,1,0,1,0,0|1,0,1]=4 30637 B16R2.33345 Cc1ccc(cc1)CC(=O)CCC2CC2 1458a_100000212244_100000694398 [0,1,0,1,0,0|1,0,0]=3 30638 B16R2.33345 Cc1ccc(cc1)CC(=O)CCC2CC2 1458a_100000756386_100000210814 [0,1,0,1,0,0|1,0,0]=3 30639 B16R2.33345 Cc1ccc(cc1)CC(=O)CCC2CO2 1458a_100000212244_100000732470 [0,1,0,1,0,0|2,0,0]=4 30640 B16R2.33345 Cc1ccc(cc1)CC(=O)NCC2CC2 11a_100000735609_100000212244 [0,1,0,1,0,0|1,0,0]=3 30641 B16R2.33345 Cc1ccc(cc1)CC(=O)NCC2CC2 240690a_100000735609_100000212244 [0,1,0,1,0,0|1,0,0]=3 30642 B16R2.33345 Cc1ccc(cc1)CC(=O)NCC2CC2 527a_100000735609_100000212244 [0,1,0,1,0,0|1,0,0]=3 30643 B16R2.33345 Cc1ccc(cc1)CC(=O)NNC2CC2 22a_100000701032_100000212244 [0,1,0,1,0,0|2,0,0]=4 30644 B16R2.33345 Cc1ccc(cc1)NC(=O)CCC2CC2 11a_100000124888_100000756386 [0,1,0,1,0,0|2,0,0]=4 30645 B16R2.33345 Cc1ccc(cc1)NC(=O)CCC2CC2 1626a_100000124888_100000756386 [0,1,0,1,0,0|2,0,0]=4 30646 B16R2.33345 Cc1ccc(cc1)NC(=O)CCC2CC2 22a_100000124888_100000756386 [0,1,0,1,0,0|2,0,0]=4 30647 B16R2.33345 Cc1ccc(cc1)NC(=O)CCC2CC2 527a_100000124888_100000756386 [0,1,0,1,0,0|2,0,0]=4 30648 B16R2.33345 Cc1ccc(cc1)NC(=O)NCC2CC2 2430a_100000124888_100000735609 [0,1,0,1,0,0|2,0,0]=4 30649 B16R2.33345 Cc1ccc(cn1)CC(=O)CCC2CC2 1458a_100000740413_100000694398 [0,1,0,1,0,0|2,0,0]=4 30650 B16R2.33345 Cc1ccc(cn1)CC(=O)CCC2CC2 1458a_100000756386_100016987292 [0,1,0,1,0,0|2,0,0]=4 30651 B16R2.33345 Cc1ccc(cn1)CC(=O)NCC2CC2 11a_100000735609_100000740413 [0,1,0,1,0,0|2,0,0]=4 30652 B16R2.33345 Cc1ccc(cn1)CC(=O)NCC2CC2 1626a_100000735609_100000740413 [0,1,0,1,0,0|2,0,0]=4 30653 B16R2.33345 Cc1ccc(cn1)CC(=O)NCC2CC2 240690a_100000735609_100000740413 [0,1,0,1,0,0|2,0,0]=4 30654 B16R2.33345 Cc1ccc(cn1)CC(=O)NCC2CC2 527a_100000735609_100000740413 [0,1,0,1,0,0|2,0,0]=4 30655 B16R2.33345 Cc1ccc(nc1)CC(=O)CCC2CC2 1458a_100000756386_100000691093 [0,1,0,1,0,0|2,0,0]=4 30656 B16R2.33345 Cc1ccc(nc1)CC(=O)CCC2CC2 1458a_100025705728_100000694398 [0,1,0,1,0,0|2,0,0]=4 30657 B16R2.33345 Cc1ccc(nc1)CC(=O)NCC2CC2 11a_100000735609_100025705728 [0,1,0,1,0,0|2,0,0]=4 30658 B16R2.33345 Cc1ccc(nc1)CC(=O)NCC2CC2 1626a_100000735609_100025705728 [0,1,0,1,0,0|2,0,0]=4 30659 B16R2.33345 Cc1ccc(nc1)CC(=O)NCC2CC2 240690a_100000735609_100025705728 [0,1,0,1,0,0|2,0,0]=4 30660 B16R2.33345 O=C(C=CC1CC1)Cc2ccc(cc2)Br 1458a_100102529529_100000189115 [0,1,0,1,0,0|1,0,1]=4 30661 B16R2.33345 O=C(C=CC1CC1)Cc2ccc(cc2)Cl 1458a_100102529529_100000694040 [0,1,0,1,0,0|1,0,1]=4 30662 B16R2.33345 O=C(C=CC1CC1)Cc2ccc(cc2)F 1458a_100102529529_100000198546 [0,1,0,1,0,0|1,0,1]=4 30663 B16R2.33345 O=C(C=CC1CC1)Cc2ccc(cc2)I 1458a_100102529529_100000189116 [0,1,0,1,0,0|1,0,1]=4 30664 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)Br 1458a_100000198978_100000694398 [0,1,0,1,0,0|1,0,0]=3 30665 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)Br 1458a_100000756386_100000189115 [0,1,0,1,0,0|1,0,0]=3 30666 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)Cl 1458a_100000211027_100000694398 [0,1,0,1,0,0|1,0,0]=3 30667 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)Cl 1458a_100000756386_100000694040 [0,1,0,1,0,0|1,0,0]=3 30668 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)F 1458a_100000210951_100000694398 [0,1,0,1,0,0|1,0,0]=3 30669 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)F 1458a_100000756386_100000198546 [0,1,0,1,0,0|1,0,0]=3 30670 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)I 1458a_100000688869_100000694398 [0,1,0,1,0,0|1,0,0]=3 30671 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)I 1458a_100000756386_100000189116 [0,1,0,1,0,0|1,0,0]=3 30672 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cc2)O 1458a_100000198540_100000694398 [0,1,0,1,0,0|1,0,0]=3 30673 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cn2)Br 1458a_100000756386_100000702658 [0,1,0,1,0,0|2,0,0]=4 30674 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cn2)Br 1458a_100020629044_100000694398 [0,1,0,1,0,0|2,0,0]=4 30675 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cn2)Cl 1458a_100000728320_100000694398 [0,1,0,1,0,0|2,0,0]=4 30676 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cn2)Cl 1458a_100000756386_100012066911 [0,1,0,1,0,0|2,0,0]=4 30677 B16R2.33345 O=C(CCC1CC1)Cc2ccc(cn2)F 1458a_100000756386_100000703193 [0,1,0,1,0,0|2,0,0]=4 30678 B16R2.33345 O=C(CCC1CC1)Cc2ccc(nc2)Br 1458a_100000756386_100009831999 [0,1,0,1,0,0|2,0,0]=4 30679 B16R2.33345 O=C(CCC1CC1)Cc2ccc(nc2)Br 1458a_100010067268_100000694398 [0,1,0,1,0,0|2,0,0]=4 30680 B16R2.33345 O=C(CCC1CC1)Cc2ccc(nc2)Cl 1458a_100000061944_100000694398 [0,1,0,1,0,0|2,0,0]=4 30681 B16R2.33345 O=C(CCC1CC1)Cc2ccc(nc2)Cl 1458a_100000756386_100000735431 [0,1,0,1,0,0|2,0,0]=4 30682 B16R2.33345 O=C(CCC1CC1)Cc2ccc(nc2)F 1458a_100000756386_100009820150 [0,1,0,1,0,0|2,0,0]=4 30683 B16R2.33345 O=C(CCC1CC1)Cn2ccc(=O)cc2 1458a_200000238563_100000694398 [0,1,0,1,0,0|2,0,0]=4 30684 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Br 11a_100000210018_100000756386 [0,1,0,1,0,0|2,0,0]=4 30685 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Br 1626a_100000210018_100000756386 [0,1,0,1,0,0|2,0,0]=4 30686 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Br 22a_100000210018_100000756386 [0,1,0,1,0,0|2,0,0]=4 30687 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Br 527a_100000210018_100000756386 [0,1,0,1,0,0|2,0,0]=4 30688 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl 11a_100000210052_100000756386 [0,1,0,1,0,0|2,0,0]=4 30689 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl 1626a_100000210052_100000756386 [0,1,0,1,0,0|2,0,0]=4 30690 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl 22a_100000210052_100000756386 [0,1,0,1,0,0|2,0,0]=4 30691 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)Cl 527a_100000210052_100000756386 [0,1,0,1,0,0|2,0,0]=4 30692 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)F 11a_100000185862_100000756386 [0,1,0,1,0,0|2,0,0]=4 30693 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)F 1626a_100000185862_100000756386 [0,1,0,1,0,0|2,0,0]=4 30694 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)F 22a_100000185862_100000756386 [0,1,0,1,0,0|2,0,0]=4 30695 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)F 527a_100000185862_100000756386 [0,1,0,1,0,0|2,0,0]=4 30696 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I 11a_100000185761_100000756386 [0,1,0,1,0,0|2,0,0]=4 30697 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I 1626a_100000185761_100000756386 [0,1,0,1,0,0|2,0,0]=4 30698 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I 22a_100000185761_100000756386 [0,1,0,1,0,0|2,0,0]=4 30699 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)I 527a_100000185761_100000756386 [0,1,0,1,0,0|2,0,0]=4 30700 B16R2.33345 O=C(CCC1CC1)Nc2ccc(cc2)O 22a_100000185829_100000756386 [0,1,0,1,0,0|2,0,0]=4 30701 B16R2.33345 O=C(CCC1CO1)Cc2ccc(cc2)Br 1458a_100000198978_100000732470 [0,1,0,1,0,0|2,0,0]=4 30702 B16R2.33345 O=C(CCC1CO1)Cc2ccc(cc2)Cl 1458a_100000211027_100000732470 [0,1,0,1,0,0|2,0,0]=4 30703 B16R2.33345 O=C(CCC1CO1)Cc2ccc(cc2)F 1458a_100000210951_100000732470 [0,1,0,1,0,0|2,0,0]=4 30704 B16R2.33345 O=C(CCC1CO1)Cc2ccc(cc2)I 1458a_100000688869_100000732470 [0,1,0,1,0,0|2,0,0]=4 30705 B16R2.33345 O=C(CCC1CO1)Cc2ccc(cc2)O 1458a_100000198540_100000732470 [0,1,0,1,0,0|2,0,0]=4 30706 B16R2.33345 O=C(Cc1ccc(cc1)Br)NCC2CC2 11a_100000735609_100000198978 [0,1,0,1,0,0|1,0,0]=3 30707 B16R2.33345 O=C(Cc1ccc(cc1)Br)NCC2CC2 240690a_100000735609_100000198978 [0,1,0,1,0,0|1,0,0]=3 30708 B16R2.33345 O=C(Cc1ccc(cc1)Br)NCC2CC2 527a_100000735609_100000198978 [0,1,0,1,0,0|1,0,0]=3 30709 B16R2.33345 O=C(Cc1ccc(cc1)Br)NNC2CC2 22a_100000701032_100000198978 [0,1,0,1,0,0|2,0,0]=4 30710 B16R2.33345 O=C(Cc1ccc(cc1)Cl)NCC2CC2 11a_100000735609_100000211027 [0,1,0,1,0,0|1,0,0]=3 30711 B16R2.33345 O=C(Cc1ccc(cc1)Cl)NCC2CC2 240690a_100000735609_100000211027 [0,1,0,1,0,0|1,0,0]=3 30712 B16R2.33345 O=C(Cc1ccc(cc1)Cl)NCC2CC2 527a_100000735609_100000211027 [0,1,0,1,0,0|1,0,0]=3 30713 B16R2.33345 O=C(Cc1ccc(cc1)Cl)NNC2CC2 22a_100000701032_100000211027 [0,1,0,1,0,0|2,0,0]=4 30714 B16R2.33345 O=C(Cc1ccc(cc1)F)NCC2CC2 11a_100000735609_100000210951 [0,1,0,1,0,0|1,0,0]=3 30715 B16R2.33345 O=C(Cc1ccc(cc1)F)NCC2CC2 1626a_100000735609_100000210951 [0,1,0,1,0,0|1,0,0]=3 30716 B16R2.33345 O=C(Cc1ccc(cc1)F)NCC2CC2 240690a_100000735609_100000210951 [0,1,0,1,0,0|1,0,0]=3 30717 B16R2.33345 O=C(Cc1ccc(cc1)F)NCC2CC2 527a_100000735609_100000210951 [0,1,0,1,0,0|1,0,0]=3 30718 B16R2.33345 O=C(Cc1ccc(cc1)F)NNC2CC2 22a_100000701032_100000210951 [0,1,0,1,0,0|2,0,0]=4 30719 B16R2.33345 O=C(Cc1ccc(cc1)I)NCC2CC2 11a_100000735609_100000688869 [0,1,0,1,0,0|1,0,0]=3 30720 B16R2.33345 O=C(Cc1ccc(cc1)I)NCC2CC2 1626a_100000735609_100000688869 [0,1,0,1,0,0|1,0,0]=3 30721 B16R2.33345 O=C(Cc1ccc(cc1)I)NCC2CC2 240690a_100000735609_100000688869 [0,1,0,1,0,0|1,0,0]=3 30722 B16R2.33345 O=C(Cc1ccc(cc1)I)NCC2CC2 527a_100000735609_100000688869 [0,1,0,1,0,0|1,0,0]=3 30723 B16R2.33345 O=C(Cc1ccc(cc1)I)NNC2CC2 22a_100000701032_100000688869 [0,1,0,1,0,0|2,0,0]=4 30724 B16R2.33345 O=C(Cc1ccc(cc1)O)NCC2CC2 1626a_100000735609_100000198540 [0,1,0,1,0,0|1,0,0]=3 30725 B16R2.33345 O=C(Cc1ccc(cc1)O)NCC2CC2 240690a_100000735609_100000198540 [0,1,0,1,0,0|1,0,0]=3 30726 B16R2.33345 O=C(Cc1ccc(cc1)O)NCC2CC2 527a_100000735609_100000198540 [0,1,0,1,0,0|1,0,0]=3 30727 B16R2.33345 O=C(Cc1ccc(cc1)O)NNC2CC2 22a_100000701032_100000198540 [0,1,0,1,0,0|2,0,0]=4 30728 B16R2.33345 O=C(Cc1ccc(cn1)Br)NCC2CC2 11a_100000735609_100020629044 [0,1,0,1,0,0|2,0,0]=4 30729 B16R2.33345 O=C(Cc1ccc(cn1)Br)NCC2CC2 240690a_100000735609_100020629044 [0,1,0,1,0,0|2,0,0]=4 30730 B16R2.33345 O=C(Cc1ccc(cn1)Cl)NCC2CC2 11a_100000735609_100000728320 [0,1,0,1,0,0|2,0,0]=4 30731 B16R2.33345 O=C(Cc1ccc(cn1)Cl)NCC2CC2 1626a_100000735609_100000728320 [0,1,0,1,0,0|2,0,0]=4 30732 B16R2.33345 O=C(Cc1ccc(cn1)Cl)NCC2CC2 240690a_100000735609_100000728320 [0,1,0,1,0,0|2,0,0]=4 30733 B16R2.33345 O=C(Cc1ccc(cn1)Cl)NCC2CC2 527a_100000735609_100000728320 [0,1,0,1,0,0|2,0,0]=4 30734 B16R2.33345 O=C(Cc1ccc(nc1)Br)NCC2CC2 11a_100000735609_100010067268 [0,1,0,1,0,0|2,0,0]=4 30735 B16R2.33345 O=C(Cc1ccc(nc1)Br)NCC2CC2 240690a_100000735609_100010067268 [0,1,0,1,0,0|2,0,0]=4 30736 B16R2.33345 O=C(Cc1ccc(nc1)Br)NCC2CC2 527a_100000735609_100010067268 [0,1,0,1,0,0|2,0,0]=4 30737 B16R2.33345 O=C(Cc1ccc(nc1)Cl)NCC2CC2 11a_100000735609_100000061944 [0,1,0,1,0,0|2,0,0]=4 30738 B16R2.33345 O=C(Cc1ccc(nc1)Cl)NCC2CC2 1626a_100000735609_100000061944 [0,1,0,1,0,0|2,0,0]=4 30739 B16R2.33345 O=C(Cc1ccc(nc1)Cl)NCC2CC2 240690a_100000735609_100000061944 [0,1,0,1,0,0|2,0,0]=4 30740 B16R2.33345 O=C(Cc1ccc(nc1)Cl)NCC2CC2 527a_100000735609_100000061944 [0,1,0,1,0,0|2,0,0]=4 30741 B16R2.33345 O=C(Cn1ccc(=O)cc1)NCC2CC2 11a_100000735609_200000238563 [0,1,0,1,0,0|2,0,0]=4 30742 B16R2.33345 O=C(Cn1ccc(=O)cc1)NCC2CC2 1626a_100000735609_200000238563 [0,1,0,1,0,0|2,0,0]=4 30743 B16R2.33345 O=C(Cn1ccc(=O)cc1)NCC2CC2 240690a_100000735609_200000238563 [0,1,0,1,0,0|2,0,0]=4 30744 B16R2.33345 O=C(Cn1ccc(=O)cc1)NCC2CC2 527a_100000735609_200000238563 [0,1,0,1,0,0|2,0,0]=4 30745 B16R2.33345 O=C(NCC1CC1)Nc2ccc(cc2)Br 2430a_100000210018_100000735609 [0,1,0,1,0,0|2,0,0]=4 30746 B16R2.33345 O=C(NCC1CC1)Nc2ccc(cc2)Cl 2430a_100000210052_100000735609 [0,1,0,1,0,0|2,0,0]=4 30747 B16R2.33345 O=C(NCC1CC1)Nc2ccc(cc2)F 2430a_100000185862_100000735609 [0,1,0,1,0,0|2,0,0]=4 30748 B16R2.33345 O=C(NCC1CC1)Nc2ccc(cc2)I 2430a_100000185761_100000735609 [0,1,0,1,0,0|2,0,0]=4 30749 B16R2.33345 O=C(NCC1CC1)Nc2ccc(cc2)O 2430a_100000185829_100000735609 [0,1,0,1,0,0|2,0,0]=4 30750 B16R2.33353 CC(Cc1ccc(cc1)F)OC2CCC2 34a_100011351027_100000749161 [0,1,0,1,0,0|1,0,1]=4 30751 B16R2.33353 Cc1ccc(cc1)CC(=O)C=C2CCC2 1458a_100000686340_100000210814 [0,1,0,1,0,0|1,0,1]=4 30752 B16R2.33353 Cc1ccc(cc1)CC(=O)CC2CCC2 1458a_100000212244_100000763275 [0,1,0,1,0,0|1,0,0]=3 30753 B16R2.33353 Cc1ccc(cc1)CC(=O)CC2CCC2 1458a_100000763092_100000210814 [0,1,0,1,0,0|1,0,0]=3 30754 B16R2.33353 Cc1ccc(cc1)CC(=O)CC2CCO2 1458a_100000212244_100000103362 [0,1,0,1,0,0|2,0,0]=4 30755 B16R2.33353 Cc1ccc(cc1)CC(=O)CC2COC2 1458a_100000212244_100010264016 [0,1,0,1,0,0|2,0,0]=4 30756 B16R2.33353 Cc1ccc(cc1)CC(=O)CC2COC2 1458a_100000687760_100000210814 [0,1,0,1,0,0|2,0,0]=4 30757 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CCC2 11a_100000749019_100000212244 [0,1,0,1,0,0|1,0,0]=3 30758 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CCC2 240690a_100000749019_100000212244 [0,1,0,1,0,0|1,0,0]=3 30759 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CCC2 527a_100000749019_100000212244 [0,1,0,1,0,0|1,0,0]=3 30760 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2COC2 11a_100016991112_100000212244 [0,1,0,1,0,0|2,0,0]=4 30761 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2COC2 240690a_100016991112_100000212244 [0,1,0,1,0,0|2,0,0]=4 30762 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2COC2 527a_100016991112_100000212244 [0,1,0,1,0,0|2,0,0]=4 30763 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CSC2 11a_100016994217_100000212244 [0,1,0,1,0,0|2,0,0]=4 30764 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CSC2 240690a_100016994217_100000212244 [0,1,0,1,0,0|2,0,0]=4 30765 B16R2.33353 Cc1ccc(cc1)CC(=O)NC2CSC2 527a_100016994217_100000212244 [0,1,0,1,0,0|2,0,0]=4 30766 B16R2.33353 Cc1ccc(cc1)NC(=O)CC2CCC2 11a_100000124888_100000763092 [0,1,0,1,0,0|2,0,0]=4 30767 B16R2.33353 Cc1ccc(cc1)NC(=O)CC2CCC2 1626a_100000124888_100000763092 [0,1,0,1,0,0|2,0,0]=4 30768 B16R2.33353 Cc1ccc(cc1)NC(=O)CC2CCC2 22a_100000124888_100000763092 [0,1,0,1,0,0|2,0,0]=4 30769 B16R2.33353 Cc1ccc(cc1)NC(=O)CC2CCC2 527a_100000124888_100000763092 [0,1,0,1,0,0|2,0,0]=4 30770 B16R2.33353 Cc1ccc(cc1)NC(=O)NC2CCC2 2430a_100000124888_100000749019 [0,1,0,1,0,0|2,0,0]=4 30771 B16R2.33353 Cc1ccc(cn1)CC(=O)CC2CCC2 1458a_100000740413_100000763275 [0,1,0,1,0,0|2,0,0]=4 30772 B16R2.33353 Cc1ccc(cn1)CC(=O)CC2CCC2 1458a_100000763092_100016987292 [0,1,0,1,0,0|2,0,0]=4 30773 B16R2.33353 Cc1ccc(cn1)CC(=O)NC2CCC2 11a_100000749019_100000740413 [0,1,0,1,0,0|2,0,0]=4 30774 B16R2.33353 Cc1ccc(cn1)CC(=O)NC2CCC2 1626a_100000749019_100000740413 [0,1,0,1,0,0|2,0,0]=4 30775 B16R2.33353 Cc1ccc(cn1)CC(=O)NC2CCC2 240690a_100000749019_100000740413 [0,1,0,1,0,0|2,0,0]=4 30776 B16R2.33353 Cc1ccc(cn1)CC(=O)NC2CCC2 527a_100000749019_100000740413 [0,1,0,1,0,0|2,0,0]=4 30777 B16R2.33353 Cc1ccc(nc1)CC(=O)CC2CCC2 1458a_100000763092_100000691093 [0,1,0,1,0,0|2,0,0]=4 30778 B16R2.33353 Cc1ccc(nc1)CC(=O)CC2CCC2 1458a_100025705728_100000763275 [0,1,0,1,0,0|2,0,0]=4 30779 B16R2.33353 Cc1ccc(nc1)CC(=O)NC2CCC2 11a_100000749019_100025705728 [0,1,0,1,0,0|2,0,0]=4 30780 B16R2.33353 Cc1ccc(nc1)CC(=O)NC2CCC2 1626a_100000749019_100025705728 [0,1,0,1,0,0|2,0,0]=4 30781 B16R2.33353 Cc1ccc(nc1)CC(=O)NC2CCC2 240690a_100000749019_100025705728 [0,1,0,1,0,0|2,0,0]=4 30782 B16R2.33353 O=C(C=C1CCC1)Cc2ccc(cc2)Br 1458a_100000686340_100000189115 [0,1,0,1,0,0|1,0,1]=4 30783 B16R2.33353 O=C(C=C1CCC1)Cc2ccc(cc2)Cl 1458a_100000686340_100000694040 [0,1,0,1,0,0|1,0,1]=4 30784 B16R2.33353 O=C(C=C1CCC1)Cc2ccc(cc2)F 1458a_100000686340_100000198546 [0,1,0,1,0,0|1,0,1]=4 30785 B16R2.33353 O=C(C=C1CCC1)Cc2ccc(cc2)I 1458a_100000686340_100000189116 [0,1,0,1,0,0|1,0,1]=4 30786 B16R2.33353 O=C(CC1CCC1)Cn2ccc(=O)cc2 1458a_200000238563_100000763275 [0,1,0,1,0,0|2,0,0]=4 30787 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Br 11a_100000210018_100000763092 [0,1,0,1,0,0|2,0,0]=4 30788 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Br 1626a_100000210018_100000763092 [0,1,0,1,0,0|2,0,0]=4 30789 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Br 22a_100000210018_100000763092 [0,1,0,1,0,0|2,0,0]=4 30790 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Br 527a_100000210018_100000763092 [0,1,0,1,0,0|2,0,0]=4 30791 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl 11a_100000210052_100000763092 [0,1,0,1,0,0|2,0,0]=4 30792 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl 1626a_100000210052_100000763092 [0,1,0,1,0,0|2,0,0]=4 30793 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl 22a_100000210052_100000763092 [0,1,0,1,0,0|2,0,0]=4 30794 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)Cl 527a_100000210052_100000763092 [0,1,0,1,0,0|2,0,0]=4 30795 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)F 11a_100000185862_100000763092 [0,1,0,1,0,0|2,0,0]=4 30796 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)F 1626a_100000185862_100000763092 [0,1,0,1,0,0|2,0,0]=4 30797 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)F 22a_100000185862_100000763092 [0,1,0,1,0,0|2,0,0]=4 30798 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)F 527a_100000185862_100000763092 [0,1,0,1,0,0|2,0,0]=4 30799 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I 11a_100000185761_100000763092 [0,1,0,1,0,0|2,0,0]=4 30800 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I 1626a_100000185761_100000763092 [0,1,0,1,0,0|2,0,0]=4 30801 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I 22a_100000185761_100000763092 [0,1,0,1,0,0|2,0,0]=4 30802 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)I 527a_100000185761_100000763092 [0,1,0,1,0,0|2,0,0]=4 30803 B16R2.33353 O=C(CC1CCC1)Nc2ccc(cc2)O 22a_100000185829_100000763092 [0,1,0,1,0,0|2,0,0]=4 30804 B16R2.33353 O=C(Cc1ccc(cc1)Br)CC2CCC2 1458a_100000198978_100000763275 [0,1,0,1,0,0|1,0,0]=3 30805 B16R2.33353 O=C(Cc1ccc(cc1)Br)CC2CCC2 1458a_100000763092_100000189115 [0,1,0,1,0,0|1,0,0]=3 30806 B16R2.33353 O=C(Cc1ccc(cc1)Br)CC2CCO2 1458a_100000198978_100000103362 [0,1,0,1,0,0|2,0,0]=4 30807 B16R2.33353 O=C(Cc1ccc(cc1)Br)CC2COC2 1458a_100000198978_100010264016 [0,1,0,1,0,0|2,0,0]=4 30808 B16R2.33353 O=C(Cc1ccc(cc1)Br)CC2COC2 1458a_100000687760_100000189115 [0,1,0,1,0,0|2,0,0]=4 30809 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CCC2 11a_100000749019_100000198978 [0,1,0,1,0,0|1,0,0]=3 30810 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CCC2 240690a_100000749019_100000198978 [0,1,0,1,0,0|1,0,0]=3 30811 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CCC2 527a_100000749019_100000198978 [0,1,0,1,0,0|1,0,0]=3 30812 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2COC2 11a_100016991112_100000198978 [0,1,0,1,0,0|2,0,0]=4 30813 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2COC2 240690a_100016991112_100000198978 [0,1,0,1,0,0|2,0,0]=4 30814 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2COC2 527a_100016991112_100000198978 [0,1,0,1,0,0|2,0,0]=4 30815 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CSC2 11a_100016994217_100000198978 [0,1,0,1,0,0|2,0,0]=4 30816 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CSC2 240690a_100016994217_100000198978 [0,1,0,1,0,0|2,0,0]=4 30817 B16R2.33353 O=C(Cc1ccc(cc1)Br)NC2CSC2 527a_100016994217_100000198978 [0,1,0,1,0,0|2,0,0]=4 30818 B16R2.33353 O=C(Cc1ccc(cc1)Cl)CC2CCC2 1458a_100000211027_100000763275 [0,1,0,1,0,0|1,0,0]=3 30819 B16R2.33353 O=C(Cc1ccc(cc1)Cl)CC2CCC2 1458a_100000763092_100000694040 [0,1,0,1,0,0|1,0,0]=3 30820 B16R2.33353 O=C(Cc1ccc(cc1)Cl)CC2CCO2 1458a_100000211027_100000103362 [0,1,0,1,0,0|2,0,0]=4 30821 B16R2.33353 O=C(Cc1ccc(cc1)Cl)CC2COC2 1458a_100000211027_100010264016 [0,1,0,1,0,0|2,0,0]=4 30822 B16R2.33353 O=C(Cc1ccc(cc1)Cl)CC2COC2 1458a_100000687760_100000694040 [0,1,0,1,0,0|2,0,0]=4 30823 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CCC2 11a_100000749019_100000211027 [0,1,0,1,0,0|1,0,0]=3 30824 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CCC2 240690a_100000749019_100000211027 [0,1,0,1,0,0|1,0,0]=3 30825 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CCC2 527a_100000749019_100000211027 [0,1,0,1,0,0|1,0,0]=3 30826 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2COC2 11a_100016991112_100000211027 [0,1,0,1,0,0|2,0,0]=4 30827 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2COC2 240690a_100016991112_100000211027 [0,1,0,1,0,0|2,0,0]=4 30828 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2COC2 527a_100016991112_100000211027 [0,1,0,1,0,0|2,0,0]=4 30829 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CSC2 11a_100016994217_100000211027 [0,1,0,1,0,0|2,0,0]=4 30830 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CSC2 240690a_100016994217_100000211027 [0,1,0,1,0,0|2,0,0]=4 30831 B16R2.33353 O=C(Cc1ccc(cc1)Cl)NC2CSC2 527a_100016994217_100000211027 [0,1,0,1,0,0|2,0,0]=4 30832 B16R2.33353 O=C(Cc1ccc(cc1)F)CC2CCC2 1458a_100000210951_100000763275 [0,1,0,1,0,0|1,0,0]=3 30833 B16R2.33353 O=C(Cc1ccc(cc1)F)CC2CCC2 1458a_100000763092_100000198546 [0,1,0,1,0,0|1,0,0]=3 30834 B16R2.33353 O=C(Cc1ccc(cc1)F)CC2CCO2 1458a_100000210951_100000103362 [0,1,0,1,0,0|2,0,0]=4 30835 B16R2.33353 O=C(Cc1ccc(cc1)F)CC2COC2 1458a_100000210951_100010264016 [0,1,0,1,0,0|2,0,0]=4 30836 B16R2.33353 O=C(Cc1ccc(cc1)F)CC2COC2 1458a_100000687760_100000198546 [0,1,0,1,0,0|2,0,0]=4 30837 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CCC2 11a_100000749019_100000210951 [0,1,0,1,0,0|1,0,0]=3 30838 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CCC2 1626a_100000749019_100000210951 [0,1,0,1,0,0|1,0,0]=3 30839 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CCC2 240690a_100000749019_100000210951 [0,1,0,1,0,0|1,0,0]=3 30840 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CCC2 527a_100000749019_100000210951 [0,1,0,1,0,0|1,0,0]=3 30841 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2COC2 11a_100016991112_100000210951 [0,1,0,1,0,0|2,0,0]=4 30842 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2COC2 1626a_100016991112_100000210951 [0,1,0,1,0,0|2,0,0]=4 30843 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2COC2 240690a_100016991112_100000210951 [0,1,0,1,0,0|2,0,0]=4 30844 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2COC2 527a_100016991112_100000210951 [0,1,0,1,0,0|2,0,0]=4 30845 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 11a_100016994217_100000210951 [0,1,0,1,0,0|2,0,0]=4 30846 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 1626a_100016994217_100000210951 [0,1,0,1,0,0|2,0,0]=4 30847 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 240690a_100016994217_100000210951 [0,1,0,1,0,0|2,0,0]=4 30848 B16R2.33353 O=C(Cc1ccc(cc1)F)NC2CSC2 527a_100016994217_100000210951 [0,1,0,1,0,0|2,0,0]=4 30849 B16R2.33353 O=C(Cc1ccc(cc1)I)CC2CCC2 1458a_100000688869_100000763275 [0,1,0,1,0,0|1,0,0]=3 30850 B16R2.33353 O=C(Cc1ccc(cc1)I)CC2CCC2 1458a_100000763092_100000189116 [0,1,0,1,0,0|1,0,0]=3 30851 B16R2.33353 O=C(Cc1ccc(cc1)I)CC2CCO2 1458a_100000688869_100000103362 [0,1,0,1,0,0|2,0,0]=4 30852 B16R2.33353 O=C(Cc1ccc(cc1)I)CC2COC2 1458a_100000687760_100000189116 [0,1,0,1,0,0|2,0,0]=4 30853 B16R2.33353 O=C(Cc1ccc(cc1)I)CC2COC2 1458a_100000688869_100010264016 [0,1,0,1,0,0|2,0,0]=4 30854 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CCC2 11a_100000749019_100000688869 [0,1,0,1,0,0|1,0,0]=3 30855 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CCC2 1626a_100000749019_100000688869 [0,1,0,1,0,0|1,0,0]=3 30856 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CCC2 240690a_100000749019_100000688869 [0,1,0,1,0,0|1,0,0]=3 30857 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CCC2 527a_100000749019_100000688869 [0,1,0,1,0,0|1,0,0]=3 30858 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2COC2 11a_100016991112_100000688869 [0,1,0,1,0,0|2,0,0]=4 30859 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2COC2 1626a_100016991112_100000688869 [0,1,0,1,0,0|2,0,0]=4 30860 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2COC2 240690a_100016991112_100000688869 [0,1,0,1,0,0|2,0,0]=4 30861 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2COC2 527a_100016991112_100000688869 [0,1,0,1,0,0|2,0,0]=4 30862 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CSC2 11a_100016994217_100000688869 [0,1,0,1,0,0|2,0,0]=4 30863 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CSC2 1626a_100016994217_100000688869 [0,1,0,1,0,0|2,0,0]=4 30864 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CSC2 240690a_100016994217_100000688869 [0,1,0,1,0,0|2,0,0]=4 30865 B16R2.33353 O=C(Cc1ccc(cc1)I)NC2CSC2 527a_100016994217_100000688869 [0,1,0,1,0,0|2,0,0]=4 30866 B16R2.33353 O=C(Cc1ccc(cc1)O)CC2CCC2 1458a_100000198540_100000763275 [0,1,0,1,0,0|1,0,0]=3 30867 B16R2.33353 O=C(Cc1ccc(cc1)O)CC2CCO2 1458a_100000198540_100000103362 [0,1,0,1,0,0|2,0,0]=4 30868 B16R2.33353 O=C(Cc1ccc(cc1)O)CC2COC2 1458a_100000198540_100010264016 [0,1,0,1,0,0|2,0,0]=4 30869 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CCC2 1626a_100000749019_100000198540 [0,1,0,1,0,0|1,0,0]=3 30870 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CCC2 240690a_100000749019_100000198540 [0,1,0,1,0,0|1,0,0]=3 30871 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CCC2 527a_100000749019_100000198540 [0,1,0,1,0,0|1,0,0]=3 30872 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2COC2 1626a_100016991112_100000198540 [0,1,0,1,0,0|2,0,0]=4 30873 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2COC2 240690a_100016991112_100000198540 [0,1,0,1,0,0|2,0,0]=4 30874 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2COC2 527a_100016991112_100000198540 [0,1,0,1,0,0|2,0,0]=4 30875 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CSC2 1626a_100016994217_100000198540 [0,1,0,1,0,0|2,0,0]=4 30876 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CSC2 240690a_100016994217_100000198540 [0,1,0,1,0,0|2,0,0]=4 30877 B16R2.33353 O=C(Cc1ccc(cc1)O)NC2CSC2 527a_100016994217_100000198540 [0,1,0,1,0,0|2,0,0]=4 30878 B16R2.33353 O=C(Cc1ccc(cn1)Br)CC2CCC2 1458a_100000763092_100000702658 [0,1,0,1,0,0|2,0,0]=4 30879 B16R2.33353 O=C(Cc1ccc(cn1)Br)CC2CCC2 1458a_100020629044_100000763275 [0,1,0,1,0,0|2,0,0]=4 30880 B16R2.33353 O=C(Cc1ccc(cn1)Br)NC2CCC2 11a_100000749019_100020629044 [0,1,0,1,0,0|2,0,0]=4 30881 B16R2.33353 O=C(Cc1ccc(cn1)Br)NC2CCC2 240690a_100000749019_100020629044 [0,1,0,1,0,0|2,0,0]=4 30882 B16R2.33353 O=C(Cc1ccc(cn1)Cl)CC2CCC2 1458a_100000728320_100000763275 [0,1,0,1,0,0|2,0,0]=4 30883 B16R2.33353 O=C(Cc1ccc(cn1)Cl)CC2CCC2 1458a_100000763092_100012066911 [0,1,0,1,0,0|2,0,0]=4 30884 B16R2.33353 O=C(Cc1ccc(cn1)Cl)NC2CCC2 11a_100000749019_100000728320 [0,1,0,1,0,0|2,0,0]=4 30885 B16R2.33353 O=C(Cc1ccc(cn1)Cl)NC2CCC2 1626a_100000749019_100000728320 [0,1,0,1,0,0|2,0,0]=4 30886 B16R2.33353 O=C(Cc1ccc(cn1)Cl)NC2CCC2 240690a_100000749019_100000728320 [0,1,0,1,0,0|2,0,0]=4 30887 B16R2.33353 O=C(Cc1ccc(cn1)Cl)NC2CCC2 527a_100000749019_100000728320 [0,1,0,1,0,0|2,0,0]=4 30888 B16R2.33353 O=C(Cc1ccc(cn1)F)CC2CCC2 1458a_100000763092_100000703193 [0,1,0,1,0,0|2,0,0]=4 30889 B16R2.33353 O=C(Cc1ccc(nc1)Br)CC2CCC2 1458a_100000763092_100009831999 [0,1,0,1,0,0|2,0,0]=4 30890 B16R2.33353 O=C(Cc1ccc(nc1)Br)CC2CCC2 1458a_100010067268_100000763275 [0,1,0,1,0,0|2,0,0]=4 30891 B16R2.33353 O=C(Cc1ccc(nc1)Br)NC2CCC2 11a_100000749019_100010067268 [0,1,0,1,0,0|2,0,0]=4 30892 B16R2.33353 O=C(Cc1ccc(nc1)Br)NC2CCC2 240690a_100000749019_100010067268 [0,1,0,1,0,0|2,0,0]=4 30893 B16R2.33353 O=C(Cc1ccc(nc1)Br)NC2CCC2 527a_100000749019_100010067268 [0,1,0,1,0,0|2,0,0]=4 30894 B16R2.33353 O=C(Cc1ccc(nc1)Cl)CC2CCC2 1458a_100000061944_100000763275 [0,1,0,1,0,0|2,0,0]=4 30895 B16R2.33353 O=C(Cc1ccc(nc1)Cl)CC2CCC2 1458a_100000763092_100000735431 [0,1,0,1,0,0|2,0,0]=4 30896 B16R2.33353 O=C(Cc1ccc(nc1)Cl)NC2CCC2 11a_100000749019_100000061944 [0,1,0,1,0,0|2,0,0]=4 30897 B16R2.33353 O=C(Cc1ccc(nc1)Cl)NC2CCC2 1626a_100000749019_100000061944 [0,1,0,1,0,0|2,0,0]=4 30898 B16R2.33353 O=C(Cc1ccc(nc1)Cl)NC2CCC2 240690a_100000749019_100000061944 [0,1,0,1,0,0|2,0,0]=4 30899 B16R2.33353 O=C(Cc1ccc(nc1)Cl)NC2CCC2 527a_100000749019_100000061944 [0,1,0,1,0,0|2,0,0]=4 30900 B16R2.33353 O=C(Cc1ccc(nc1)F)CC2CCC2 1458a_100000763092_100009820150 [0,1,0,1,0,0|2,0,0]=4 30901 B16R2.33353 O=C(Cn1ccc(=O)cc1)NC2CCC2 11a_100000749019_200000238563 [0,1,0,1,0,0|2,0,0]=4 30902 B16R2.33353 O=C(Cn1ccc(=O)cc1)NC2CCC2 1626a_100000749019_200000238563 [0,1,0,1,0,0|2,0,0]=4 30903 B16R2.33353 O=C(Cn1ccc(=O)cc1)NC2CCC2 240690a_100000749019_200000238563 [0,1,0,1,0,0|2,0,0]=4 30904 B16R2.33353 O=C(Cn1ccc(=O)cc1)NC2CCC2 527a_100000749019_200000238563 [0,1,0,1,0,0|2,0,0]=4 30905 B16R2.33353 O=C(Nc1ccc(cc1)Br)NC2CCC2 2430a_100000210018_100000749019 [0,1,0,1,0,0|2,0,0]=4 30906 B16R2.33353 O=C(Nc1ccc(cc1)Cl)NC2CCC2 2430a_100000210052_100000749019 [0,1,0,1,0,0|2,0,0]=4 30907 B16R2.33353 O=C(Nc1ccc(cc1)F)NC2CCC2 2430a_100000185862_100000749019 [0,1,0,1,0,0|2,0,0]=4 30908 B16R2.33353 O=C(Nc1ccc(cc1)I)NC2CCC2 2430a_100000185761_100000749019 [0,1,0,1,0,0|2,0,0]=4 30909 B16R2.33353 O=C(Nc1ccc(cc1)O)NC2CCC2 2430a_100000185829_100000749019 [0,1,0,1,0,0|2,0,0]=4 30910 B16R2.253 Cc1cc(ccn1)CC(=O)C2CCCC2 1458a_100000210718_200020672517 [0,1,0,1,0,0|2,0,0]=4 30911 B16R2.253 Cc1cccc(c1)CC(=O)C2=CCCC2 1458a_100000038896_100000211840 [0,1,0,1,0,0|1,0,1]=4 30912 B16R2.253 Cc1cccc(c1)CC(=O)C2CCCC2 1458a_100000210718_100000211840 [0,1,0,1,0,0|1,0,0]=3 30913 B16R2.253 Cc1cccc(c1)CC(=O)C2CCCC2 1458a_100011206899_100000179811 [0,1,0,1,0,0|1,0,0]=3 30914 B16R2.253 Cc1cccc(c1)CC(=O)C2CCCS2 1458a_100012002731_100000211840 [0,1,0,1,0,0|2,0,0]=4 30915 B16R2.253 Cc1cccc(c1)CC(=O)C2CCOC2 1458a_100011206899_100000690089 [0,1,0,1,0,0|2,0,0]=4 30916 B16R2.253 Cc1cccc(c1)CC(=O)C2CCOC2 1458a_100011219752_100000211840 [0,1,0,1,0,0|2,0,0]=4 30917 B16R2.253 Cc1cccc(c1)CC(=O)N2CCCC2 240690a_100000188435_100011206899 [0,1,0,1,0,0|1,0,0]=3 30918 B16R2.253 Cc1cccc(c1)CC(=O)N2CCCC2 527a_100000188435_100011206899 [0,1,0,1,0,0|1,0,0]=3 30919 B16R2.253 Cc1cccc(c1)CC(=O)N2CCSC2 11a_100011215254_100011206899 [0,1,0,1,0,0|2,0,0]=4 30920 B16R2.253 Cc1cccc(c1)CC(=O)N2CCSC2 240690a_100011215254_100011206899 [0,1,0,1,0,0|2,0,0]=4 30921 B16R2.253 Cc1cccc(c1)CC(=O)N2CCSC2 527a_100011215254_100011206899 [0,1,0,1,0,0|2,0,0]=4 30922 B16R2.253 Cc1cccc(c1)CC(=O)[C@@H]2CCCO2 1458a_100000686382_100000211840 [0,1,0,1,0,0|2,0,0]=4 30923 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 11a_100000188690_100000210718 [0,1,0,1,0,0|2,0,0]=4 30924 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 1626a_100000188690_100000210718 [0,1,0,1,0,0|2,0,0]=4 30925 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 22a_100000188690_100000210718 [0,1,0,1,0,0|2,0,0]=4 30926 B16R2.253 Cc1cccc(c1)NC(=O)C2CCCC2 527a_100000188690_100000210718 [0,1,0,1,0,0|2,0,0]=4 30927 B16R2.253 Cc1cccc(c1)NC(=O)N2CCCC2 2430a_100000188690_100000188435 [0,1,0,1,0,0|2,0,0]=4 30928 B16R2.253 Cc1cccc(n1)CC(=O)C2CCCC2 1458a_100000210718_100000757606 [0,1,0,1,0,0|2,0,0]=4 30929 B16R2.253 Cc1cccc(n1)CC(=O)C2CCCC2 1458a_100012001110_100000179811 [0,1,0,1,0,0|2,0,0]=4 30930 B16R2.253 Cc1cccc(n1)CC(=O)N2CCCC2 240690a_100000188435_100012001110 [0,1,0,1,0,0|2,0,0]=4 30931 B16R2.253 Cc1cccc(n1)CC(=O)N2CCCC2 527a_100000188435_100012001110 [0,1,0,1,0,0|2,0,0]=4 30932 B16R2.253 Cc1ccnc(c1)CC(=O)C2CCCC2 1458a_100000210718_100000718516 [0,1,0,1,0,0|2,0,0]=4 30933 B16R2.253 Cc1cncc(c1)CC(=O)C2CCCC2 1458a_100000210718_100000716715 [0,1,0,1,0,0|2,0,0]=4 30934 B16R2.253 O=C(Cc1cc(ccn1)Br)C2CCCC2 1458a_100000210718_100010173614 [0,1,0,1,0,0|2,0,0]=4 30935 B16R2.253 O=C(Cc1cc(ccn1)Cl)C2CCCC2 1458a_100000210718_100016988179 [0,1,0,1,0,0|2,0,0]=4 30936 B16R2.253 O=C(Cc1cccc(c1)Br)C2=CCCC2 1458a_100000038896_100000211773 [0,1,0,1,0,0|1,0,1]=4 30937 B16R2.253 O=C(Cc1cccc(c1)Br)C2CCCC2 1458a_100000210718_100000211773 [0,1,0,1,0,0|1,0,0]=3 30938 B16R2.253 O=C(Cc1cccc(c1)Br)C2CCCC2 1458a_100000747190_100000179811 [0,1,0,1,0,0|1,0,0]=3 30939 B16R2.253 O=C(Cc1cccc(c1)Br)C2CCCS2 1458a_100012002731_100000211773 [0,1,0,1,0,0|2,0,0]=4 30940 B16R2.253 O=C(Cc1cccc(c1)Br)C2CCOC2 1458a_100000747190_100000690089 [0,1,0,1,0,0|2,0,0]=4 30941 B16R2.253 O=C(Cc1cccc(c1)Br)C2CCOC2 1458a_100011219752_100000211773 [0,1,0,1,0,0|2,0,0]=4 30942 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCCC2 240690a_100000188435_100000747190 [0,1,0,1,0,0|1,0,0]=3 30943 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCCC2 527a_100000188435_100000747190 [0,1,0,1,0,0|1,0,0]=3 30944 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCSC2 11a_100011215254_100000747190 [0,1,0,1,0,0|2,0,0]=4 30945 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCSC2 240690a_100011215254_100000747190 [0,1,0,1,0,0|2,0,0]=4 30946 B16R2.253 O=C(Cc1cccc(c1)Br)N2CCSC2 527a_100011215254_100000747190 [0,1,0,1,0,0|2,0,0]=4 30947 B16R2.253 O=C(Cc1cccc(c1)Br)[C@@H]2CCCO2 1458a_100000686382_100000211773 [0,1,0,1,0,0|2,0,0]=4 30948 B16R2.253 O=C(Cc1cccc(c1)Cl)C2=CCCC2 1458a_100000038896_100000181238 [0,1,0,1,0,0|1,0,1]=4 30949 B16R2.253 O=C(Cc1cccc(c1)Cl)C2CCCC2 1458a_100000210718_100000181238 [0,1,0,1,0,0|1,0,0]=3 30950 B16R2.253 O=C(Cc1cccc(c1)Cl)C2CCCC2 1458a_100000749307_100000179811 [0,1,0,1,0,0|1,0,0]=3 30951 B16R2.253 O=C(Cc1cccc(c1)Cl)C2CCCS2 1458a_100012002731_100000181238 [0,1,0,1,0,0|2,0,0]=4 30952 B16R2.253 O=C(Cc1cccc(c1)Cl)C2CCOC2 1458a_100000749307_100000690089 [0,1,0,1,0,0|2,0,0]=4 30953 B16R2.253 O=C(Cc1cccc(c1)Cl)C2CCOC2 1458a_100011219752_100000181238 [0,1,0,1,0,0|2,0,0]=4 30954 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCCC2 240690a_100000188435_100000749307 [0,1,0,1,0,0|1,0,0]=3 30955 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCCC2 527a_100000188435_100000749307 [0,1,0,1,0,0|1,0,0]=3 30956 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCSC2 11a_100011215254_100000749307 [0,1,0,1,0,0|2,0,0]=4 30957 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCSC2 240690a_100011215254_100000749307 [0,1,0,1,0,0|2,0,0]=4 30958 B16R2.253 O=C(Cc1cccc(c1)Cl)N2CCSC2 527a_100011215254_100000749307 [0,1,0,1,0,0|2,0,0]=4 30959 B16R2.253 O=C(Cc1cccc(c1)Cl)[C@@H]2CCCO2 1458a_100000686382_100000181238 [0,1,0,1,0,0|2,0,0]=4 30960 B16R2.253 O=C(Cc1cccc(c1)F)C2=CCCC2 1458a_100000038896_100000230114 [0,1,0,1,0,0|1,0,1]=4 30961 B16R2.253 O=C(Cc1cccc(c1)F)C2CCCC2 1458a_100000210718_100000230114 [0,1,0,1,0,0|1,0,0]=3 30962 B16R2.253 O=C(Cc1cccc(c1)F)C2CCCC2 1458a_100000211661_100000179811 [0,1,0,1,0,0|1,0,0]=3 30963 B16R2.253 O=C(Cc1cccc(c1)F)C2CCCS2 1458a_100012002731_100000230114 [0,1,0,1,0,0|2,0,0]=4 30964 B16R2.253 O=C(Cc1cccc(c1)F)C2CCOC2 1458a_100000211661_100000690089 [0,1,0,1,0,0|2,0,0]=4 30965 B16R2.253 O=C(Cc1cccc(c1)F)C2CCOC2 1458a_100011219752_100000230114 [0,1,0,1,0,0|2,0,0]=4 30966 B16R2.253 O=C(Cc1cccc(c1)F)N2CCCC2 240690a_100000188435_100000211661 [0,1,0,1,0,0|1,0,0]=3 30967 B16R2.253 O=C(Cc1cccc(c1)F)N2CCCC2 527a_100000188435_100000211661 [0,1,0,1,0,0|1,0,0]=3 30968 B16R2.253 O=C(Cc1cccc(c1)F)N2CCSC2 11a_100011215254_100000211661 [0,1,0,1,0,0|2,0,0]=4 30969 B16R2.253 O=C(Cc1cccc(c1)F)N2CCSC2 240690a_100011215254_100000211661 [0,1,0,1,0,0|2,0,0]=4 30970 B16R2.253 O=C(Cc1cccc(c1)F)N2CCSC2 527a_100011215254_100000211661 [0,1,0,1,0,0|2,0,0]=4 30971 B16R2.253 O=C(Cc1cccc(c1)F)[C@@H]2CCCO2 1458a_100000686382_100000230114 [0,1,0,1,0,0|2,0,0]=4 30972 B16R2.253 O=C(Cc1cccc(c1)I)C2=CCCC2 1458a_100000038896_100011218688 [0,1,0,1,0,0|1,0,1]=4 30973 B16R2.253 O=C(Cc1cccc(c1)I)C2CCCC2 1458a_100000210718_100011218688 [0,1,0,1,0,0|1,0,0]=3 30974 B16R2.253 O=C(Cc1cccc(c1)I)C2CCCC2 1458a_100000238430_100000179811 [0,1,0,1,0,0|1,0,0]=3 30975 B16R2.253 O=C(Cc1cccc(c1)I)C2CCCS2 1458a_100012002731_100011218688 [0,1,0,1,0,0|2,0,0]=4 30976 B16R2.253 O=C(Cc1cccc(c1)I)C2CCOC2 1458a_100000238430_100000690089 [0,1,0,1,0,0|2,0,0]=4 30977 B16R2.253 O=C(Cc1cccc(c1)I)C2CCOC2 1458a_100011219752_100011218688 [0,1,0,1,0,0|2,0,0]=4 30978 B16R2.253 O=C(Cc1cccc(c1)I)N2CCCC2 240690a_100000188435_100000238430 [0,1,0,1,0,0|1,0,0]=3 30979 B16R2.253 O=C(Cc1cccc(c1)I)N2CCCC2 527a_100000188435_100000238430 [0,1,0,1,0,0|1,0,0]=3 30980 B16R2.253 O=C(Cc1cccc(c1)I)N2CCSC2 11a_100011215254_100000238430 [0,1,0,1,0,0|2,0,0]=4 30981 B16R2.253 O=C(Cc1cccc(c1)I)N2CCSC2 240690a_100011215254_100000238430 [0,1,0,1,0,0|2,0,0]=4 30982 B16R2.253 O=C(Cc1cccc(c1)I)N2CCSC2 527a_100011215254_100000238430 [0,1,0,1,0,0|2,0,0]=4 30983 B16R2.253 O=C(Cc1cccc(c1)I)[C@@H]2CCCO2 1458a_100000686382_100011218688 [0,1,0,1,0,0|2,0,0]=4 30984 B16R2.253 O=C(Cc1cccc(c1)O)C2=CCCC2 1458a_100000038896_100011660834 [0,1,0,1,0,0|1,0,1]=4 30985 B16R2.253 O=C(Cc1cccc(c1)O)C2CCCC2 1458a_100000210718_100011660834 [0,1,0,1,0,0|1,0,0]=3 30986 B16R2.253 O=C(Cc1cccc(c1)O)C2CCCC2 1458a_100000745134_100000179811 [0,1,0,1,0,0|1,0,0]=3 30987 B16R2.253 O=C(Cc1cccc(c1)O)C2CCCS2 1458a_100012002731_100011660834 [0,1,0,1,0,0|2,0,0]=4 30988 B16R2.253 O=C(Cc1cccc(c1)O)C2CCOC2 1458a_100000745134_100000690089 [0,1,0,1,0,0|2,0,0]=4 30989 B16R2.253 O=C(Cc1cccc(c1)O)C2CCOC2 1458a_100011219752_100011660834 [0,1,0,1,0,0|2,0,0]=4 30990 B16R2.253 O=C(Cc1cccc(c1)O)N2CCCC2 240690a_100000188435_100000745134 [0,1,0,1,0,0|1,0,0]=3 30991 B16R2.253 O=C(Cc1cccc(c1)O)N2CCCC2 271570a_203496583355_100011713797 [0,1,0,1,0,0|1,0,0]=3 30992 B16R2.253 O=C(Cc1cccc(c1)O)N2CCCC2 527a_100000188435_100000745134 [0,1,0,1,0,0|1,0,0]=3 30993 B16R2.253 O=C(Cc1cccc(c1)O)N2CCSC2 240690a_100011215254_100000745134 [0,1,0,1,0,0|2,0,0]=4 30994 B16R2.253 O=C(Cc1cccc(c1)O)N2CCSC2 527a_100011215254_100000745134 [0,1,0,1,0,0|2,0,0]=4 30995 B16R2.253 O=C(Cc1cccc(c1)O)[C@@H]2CCCO2 1458a_100000686382_100011660834 [0,1,0,1,0,0|2,0,0]=4 30996 B16R2.253 O=C(Cc1cccc(n1)Br)C2CCCC2 1458a_100000210718_100009889011 [0,1,0,1,0,0|2,0,0]=4 30997 B16R2.253 O=C(Cc1cccc(n1)Br)C2CCCC2 1458a_100010201708_100000179811 [0,1,0,1,0,0|2,0,0]=4 30998 B16R2.253 O=C(Cc1cccc(n1)Br)N2CCCC2 240690a_100000188435_100010201708 [0,1,0,1,0,0|2,0,0]=4 30999 B16R2.253 O=C(Cc1cccc(n1)Br)N2CCCC2 527a_100000188435_100010201708 [0,1,0,1,0,0|2,0,0]=4 31000 B16R2.253 O=C(Cc1cccc(n1)Cl)C2CCCC2 1458a_100000090259_100000179811 [0,1,0,1,0,0|2,0,0]=4 31001 B16R2.253 O=C(Cc1cccc(n1)Cl)C2CCCC2 1458a_100000210718_100000086093 [0,1,0,1,0,0|2,0,0]=4 31002 B16R2.253 O=C(Cc1cccc(n1)Cl)N2CCCC2 240690a_100000188435_100000090259 [0,1,0,1,0,0|2,0,0]=4 31003 B16R2.253 O=C(Cc1cccc(n1)F)C2CCCC2 1458a_100000096803_100000179811 [0,1,0,1,0,0|2,0,0]=4 31004 B16R2.253 O=C(Cc1cccc(n1)F)C2CCCC2 1458a_100000210718_100009819644 [0,1,0,1,0,0|2,0,0]=4 31005 B16R2.253 O=C(Cc1cccc(n1)F)N2CCCC2 240690a_100000188435_100000096803 [0,1,0,1,0,0|2,0,0]=4 31006 B16R2.253 O=C(Cc1ccnc(c1)Br)C2CCCC2 1458a_100000210718_100010243470 [0,1,0,1,0,0|2,0,0]=4 31007 B16R2.253 O=C(Cc1ccnc(c1)Br)C2CCCC2 1458a_100010126891_100000179811 [0,1,0,1,0,0|2,0,0]=4 31008 B16R2.253 O=C(Cc1ccnc(c1)Br)N2CCCC2 240690a_100000188435_100010126891 [0,1,0,1,0,0|2,0,0]=4 31009 B16R2.253 O=C(Cc1ccnc(c1)Br)N2CCCC2 527a_100000188435_100010126891 [0,1,0,1,0,0|2,0,0]=4 31010 B16R2.253 O=C(Cc1ccnc(c1)Cl)C2CCCC2 1458a_100000210718_100000764220 [0,1,0,1,0,0|2,0,0]=4 31011 B16R2.253 O=C(Cc1ccnc(c1)Cl)N2CCCC2 240690a_100000188435_100000085289 [0,1,0,1,0,0|2,0,0]=4 31012 B16R2.253 O=C(Cc1ccnc(c1)Cl)N2CCCC2 527a_100000188435_100000085289 [0,1,0,1,0,0|2,0,0]=4 31013 B16R2.253 O=C(Cc1cncc(c1)Br)C2CCCC2 1458a_100000210718_100011740620 [0,1,0,1,0,0|2,0,0]=4 31014 B16R2.253 O=C(Cc1cncc(c1)Br)C2CCCC2 1458a_100000239331_100000179811 [0,1,0,1,0,0|2,0,0]=4 31015 B16R2.253 O=C(Cc1cncc(c1)Br)N2CCCC2 240690a_100000188435_100000239331 [0,1,0,1,0,0|2,0,0]=4 31016 B16R2.253 O=C(Cc1cncc(c1)Br)N2CCCC2 527a_100000188435_100000239331 [0,1,0,1,0,0|2,0,0]=4 31017 B16R2.253 O=C(Cc1cncc(c1)Cl)C2CCCC2 1458a_100000210718_100016992070 [0,1,0,1,0,0|2,0,0]=4 31018 B16R2.253 O=C(Cc1cncc(c1)F)C2CCCC2 1458a_100000210718_100000725299 [0,1,0,1,0,0|2,0,0]=4 31019 B16R2.253 O=C(Cc1cncc(c1)F)C2CCCC2 1458a_100011667516_100000179811 [0,1,0,1,0,0|2,0,0]=4 31020 B16R2.253 O=C(Cc1cncc(c1)F)N2CCCC2 240690a_100000188435_100011667516 [0,1,0,1,0,0|2,0,0]=4 31021 B16R2.253 O=C(Cc1cncc(c1)F)N2CCCC2 527a_100000188435_100011667516 [0,1,0,1,0,0|2,0,0]=4 31022 B16R2.253 O=C(Nc1cccc(c1)Br)C2CCCC2 11a_100000210019_100000210718 [0,1,0,1,0,0|2,0,0]=4 31023 B16R2.253 O=C(Nc1cccc(c1)Br)C2CCCC2 1626a_100000210019_100000210718 [0,1,0,1,0,0|2,0,0]=4 31024 B16R2.253 O=C(Nc1cccc(c1)Br)C2CCCC2 22a_100000210019_100000210718 [0,1,0,1,0,0|2,0,0]=4 31025 B16R2.253 O=C(Nc1cccc(c1)Br)C2CCCC2 527a_100000210019_100000210718 [0,1,0,1,0,0|2,0,0]=4 31026 B16R2.253 O=C(Nc1cccc(c1)Br)N2CCCC2 2430a_100000210019_100000188435 [0,1,0,1,0,0|2,0,0]=4 31027 B16R2.253 O=C(Nc1cccc(c1)Cl)C2CCCC2 11a_100000185859_100000210718 [0,1,0,1,0,0|2,0,0]=4 31028 B16R2.253 O=C(Nc1cccc(c1)Cl)C2CCCC2 1626a_100000185859_100000210718 [0,1,0,1,0,0|2,0,0]=4 31029 B16R2.253 O=C(Nc1cccc(c1)Cl)C2CCCC2 22a_100000185859_100000210718 [0,1,0,1,0,0|2,0,0]=4 31030 B16R2.253 O=C(Nc1cccc(c1)Cl)N2CCCC2 2430a_100000185859_100000188435 [0,1,0,1,0,0|2,0,0]=4 31031 B16R2.253 O=C(Nc1cccc(c1)F)C2CCCC2 11a_100000210047_100000210718 [0,1,0,1,0,0|2,0,0]=4 31032 B16R2.253 O=C(Nc1cccc(c1)F)C2CCCC2 1626a_100000210047_100000210718 [0,1,0,1,0,0|2,0,0]=4 31033 B16R2.253 O=C(Nc1cccc(c1)F)C2CCCC2 22a_100000210047_100000210718 [0,1,0,1,0,0|2,0,0]=4 31034 B16R2.253 O=C(Nc1cccc(c1)F)C2CCCC2 527a_100000210047_100000210718 [0,1,0,1,0,0|2,0,0]=4 31035 B16R2.253 O=C(Nc1cccc(c1)F)N2CCCC2 2430a_100000210047_100000188435 [0,1,0,1,0,0|2,0,0]=4 31036 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 11a_100000211102_100000210718 [0,1,0,1,0,0|2,0,0]=4 31037 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 1626a_100000211102_100000210718 [0,1,0,1,0,0|2,0,0]=4 31038 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 22a_100000211102_100000210718 [0,1,0,1,0,0|2,0,0]=4 31039 B16R2.253 O=C(Nc1cccc(c1)I)C2CCCC2 527a_100000211102_100000210718 [0,1,0,1,0,0|2,0,0]=4 31040 B16R2.253 O=C(Nc1cccc(c1)I)N2CCCC2 2430a_100000211102_100000188435 [0,1,0,1,0,0|2,0,0]=4 31041 B16R2.253 O=C(Nc1cccc(c1)O)C2CCCC2 1626a_100000210217_100000210718 [0,1,0,1,0,0|2,0,0]=4 31042 B16R2.253 O=C(Nc1cccc(c1)O)C2CCCC2 22a_100000210217_100000210718 [0,1,0,1,0,0|2,0,0]=4 31043 B16R2.253 O=C(Nc1cccc(c1)O)C2CCCC2 527a_100000210217_100000210718 [0,1,0,1,0,0|2,0,0]=4 31044 B16R2.253 O=C(Nc1cccc(c1)O)N2CCCC2 2430a_100000210217_100000188435 [0,1,0,1,0,0|2,0,0]=4 31045 B16R2.1442 CCC1CC1C(=O)Cc2cc(ccn2)Br 1458a_200011661523_100010173614 [0,1,0,1,0,0|2,0,0]=4 31046 B16R2.1442 CCC1CC1C(=O)Cc2cc(ccn2)C 1458a_200011661523_100000718516 [0,1,0,1,0,0|2,0,0]=4 31047 B16R2.1442 CCC1CC1C(=O)Cc2cc(ccn2)Cl 1458a_200011661523_100016988179 [0,1,0,1,0,0|2,0,0]=4 31048 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)Br 1458a_200011661523_100000211773 [0,1,0,1,0,0|1,0,0]=3 31049 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)C 1458a_200011661523_100000211840 [0,1,0,1,0,0|1,0,0]=3 31050 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)Cl 1458a_200011661523_100000181238 [0,1,0,1,0,0|1,0,0]=3 31051 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)F 1458a_200011661523_100000230114 [0,1,0,1,0,0|1,0,0]=3 31052 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)I 1458a_200011661523_100011218688 [0,1,0,1,0,0|1,0,0]=3 31053 B16R2.1442 CCC1CC1C(=O)Cc2cccc(c2)O 1458a_200011661523_100011660834 [0,1,0,1,0,0|1,0,0]=3 31054 B16R2.1442 CCC1CC1C(=O)Cc2cccc(n2)Br 1458a_200011661523_100009889011 [0,1,0,1,0,0|2,0,0]=4 31055 B16R2.1442 CCC1CC1C(=O)Cc2cccc(n2)C 1458a_200011661523_100000757606 [0,1,0,1,0,0|2,0,0]=4 31056 B16R2.1442 CCC1CC1C(=O)Cc2cccc(n2)Cl 1458a_200011661523_100000086093 [0,1,0,1,0,0|2,0,0]=4 31057 B16R2.1442 CCC1CC1C(=O)Cc2cccc(n2)F 1458a_200011661523_100009819644 [0,1,0,1,0,0|2,0,0]=4 31058 B16R2.1442 CCC1CC1C(=O)Cc2ccnc(c2)Br 1458a_200011661523_100010243470 [0,1,0,1,0,0|2,0,0]=4 31059 B16R2.1442 CCC1CC1C(=O)Cc2ccnc(c2)C 1458a_200011661523_200020672517 [0,1,0,1,0,0|2,0,0]=4 31060 B16R2.1442 CCC1CC1C(=O)Cc2ccnc(c2)Cl 1458a_200011661523_100000764220 [0,1,0,1,0,0|2,0,0]=4 31061 B16R2.1442 CCC1CC1C(=O)Cc2cncc(c2)Br 1458a_200011661523_100011740620 [0,1,0,1,0,0|2,0,0]=4 31062 B16R2.1442 CCC1CC1C(=O)Cc2cncc(c2)C 1458a_200011661523_100000716715 [0,1,0,1,0,0|2,0,0]=4 31063 B16R2.1442 CCC1CC1C(=O)Cc2cncc(c2)Cl 1458a_200011661523_100016992070 [0,1,0,1,0,0|2,0,0]=4 31064 B16R2.1442 CCC1CC1C(=O)Cc2cncc(c2)F 1458a_200011661523_100000725299 [0,1,0,1,0,0|2,0,0]=4 31065 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Br 11a_100000210019_200011661523 [0,1,0,1,0,0|2,0,0]=4 31066 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Br 1626a_100000210019_200011661523 [0,1,0,1,0,0|2,0,0]=4 31067 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Br 22a_100000210019_200011661523 [0,1,0,1,0,0|2,0,0]=4 31068 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Br 527a_100000210019_200011661523 [0,1,0,1,0,0|2,0,0]=4 31069 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)C 11a_100000188690_200011661523 [0,1,0,1,0,0|2,0,0]=4 31070 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)C 1626a_100000188690_200011661523 [0,1,0,1,0,0|2,0,0]=4 31071 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)C 22a_100000188690_200011661523 [0,1,0,1,0,0|2,0,0]=4 31072 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)C 527a_100000188690_200011661523 [0,1,0,1,0,0|2,0,0]=4 31073 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Cl 11a_100000185859_200011661523 [0,1,0,1,0,0|2,0,0]=4 31074 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Cl 1626a_100000185859_200011661523 [0,1,0,1,0,0|2,0,0]=4 31075 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)Cl 22a_100000185859_200011661523 [0,1,0,1,0,0|2,0,0]=4 31076 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)F 11a_100000210047_200011661523 [0,1,0,1,0,0|2,0,0]=4 31077 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)F 1626a_100000210047_200011661523 [0,1,0,1,0,0|2,0,0]=4 31078 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)F 22a_100000210047_200011661523 [0,1,0,1,0,0|2,0,0]=4 31079 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)F 527a_100000210047_200011661523 [0,1,0,1,0,0|2,0,0]=4 31080 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)I 11a_100000211102_200011661523 [0,1,0,1,0,0|2,0,0]=4 31081 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)I 1626a_100000211102_200011661523 [0,1,0,1,0,0|2,0,0]=4 31082 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)I 22a_100000211102_200011661523 [0,1,0,1,0,0|2,0,0]=4 31083 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)I 527a_100000211102_200011661523 [0,1,0,1,0,0|2,0,0]=4 31084 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)O 1626a_100000210217_200011661523 [0,1,0,1,0,0|2,0,0]=4 31085 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)O 22a_100000210217_200011661523 [0,1,0,1,0,0|2,0,0]=4 31086 B16R2.1442 CCC1CC1C(=O)Nc2cccc(c2)O 527a_100000210217_200011661523 [0,1,0,1,0,0|2,0,0]=4 31087 B16R2.2440 CCCCOC1Cc2cccc(c2C1)Br 34a_100010752598_100000210210 [0,1,0,1,0,0|1,0,1]=4 31088 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100011206899 [0,1,0,1,0,0|2,0,0]=4 31089 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100011206899 [0,1,0,1,0,0|2,0,0]=4 31090 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100011206899 [0,1,0,1,0,0|2,0,0]=4 31091 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100011206899 [0,1,0,1,0,0|2,0,0]=4 31092 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100011206899 [0,1,0,1,0,0|2,0,0]=4 31093 B16R2.11918 Cc1cccc(c1)CC(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100011206899 [0,1,0,1,0,0|2,0,0]=4 31094 B16R2.11918 O=C(Cc1cccc(c1)Br)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000747190 [0,1,0,1,0,0|2,0,0]=4 31095 B16R2.11918 O=C(Cc1cccc(c1)Br)N[C@@H]2C[C@@H]2F 527a_100015190264_100000747190 [0,1,0,1,0,0|2,0,0]=4 31096 B16R2.11918 O=C(Cc1cccc(c1)Br)N[C@@H]2C[C@H]2F 11a_100025746932_100000747190 [0,1,0,1,0,0|2,0,0]=4 31097 B16R2.11918 O=C(Cc1cccc(c1)Br)N[C@@H]2C[C@H]2F 240690a_100025746932_100000747190 [0,1,0,1,0,0|2,0,0]=4 31098 B16R2.11918 O=C(Cc1cccc(c1)Br)N[C@@H]2C[C@H]2F 527a_100025746932_100000747190 [0,1,0,1,0,0|2,0,0]=4 31099 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000749307 [0,1,0,1,0,0|2,0,0]=4 31100 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@@H]2F 527a_100015190264_100000749307 [0,1,0,1,0,0|2,0,0]=4 31101 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@H]2F 11a_100025746932_100000749307 [0,1,0,1,0,0|2,0,0]=4 31102 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@H]2F 1626a_100025746932_100000749307 [0,1,0,1,0,0|2,0,0]=4 31103 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@H]2F 240690a_100025746932_100000749307 [0,1,0,1,0,0|2,0,0]=4 31104 B16R2.11918 O=C(Cc1cccc(c1)Cl)N[C@@H]2C[C@H]2F 527a_100025746932_100000749307 [0,1,0,1,0,0|2,0,0]=4 31105 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000211661 [0,1,0,1,0,0|2,0,0]=4 31106 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@@H]2F 527a_100015190264_100000211661 [0,1,0,1,0,0|2,0,0]=4 31107 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@H]2F 11a_100025746932_100000211661 [0,1,0,1,0,0|2,0,0]=4 31108 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@H]2F 1626a_100025746932_100000211661 [0,1,0,1,0,0|2,0,0]=4 31109 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@H]2F 240690a_100025746932_100000211661 [0,1,0,1,0,0|2,0,0]=4 31110 B16R2.11918 O=C(Cc1cccc(c1)F)N[C@@H]2C[C@H]2F 527a_100025746932_100000211661 [0,1,0,1,0,0|2,0,0]=4 31111 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000238430 [0,1,0,1,0,0|2,0,0]=4 31112 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@@H]2F 527a_100015190264_100000238430 [0,1,0,1,0,0|2,0,0]=4 31113 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@H]2F 11a_100025746932_100000238430 [0,1,0,1,0,0|2,0,0]=4 31114 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@H]2F 1626a_100025746932_100000238430 [0,1,0,1,0,0|2,0,0]=4 31115 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@H]2F 240690a_100025746932_100000238430 [0,1,0,1,0,0|2,0,0]=4 31116 B16R2.11918 O=C(Cc1cccc(c1)I)N[C@@H]2C[C@H]2F 527a_100025746932_100000238430 [0,1,0,1,0,0|2,0,0]=4 31117 B16R2.11918 O=C(Cc1cccc(c1)O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000745134 [0,1,0,1,0,0|2,0,0]=4 31118 B16R2.11918 O=C(Cc1cccc(c1)O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000745134 [0,1,0,1,0,0|2,0,0]=4 31119 B16R2.11918 O=C(Cc1cccc(c1)O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000745134 [0,1,0,1,0,0|2,0,0]=4 31120 B16R2.11918 O=C(Cc1cccc(c1)O)N[C@@H]2C[C@H]2F 527a_100025746932_100000745134 [0,1,0,1,0,0|2,0,0]=4 31121 B16R2.11922 CN1CCNC(=O)C1c2cccc(c2)F 2230a_100011653916_200000210301 [0,1,0,1,0,0|2,0,0]=4 31122 B16R2.11922 CN1CCNC(=O)C1c2cccc(c2)F 269982a_100011653916_200000210301 [0,1,0,1,0,0|2,0,0]=4 31123 B16R2.11922 CN1CCNC(=O)C1c2cccc(c2)F 34a_100011653916_200000210301 [0,1,0,1,0,0|2,0,0]=4 31124 B16R2.11922 [13CH3]N1CCNC(=O)C1c2cccc(c2)F 2230a_100011653916_200025704644 [0,1,0,1,0,0|2,0,0]=4 31125 B16R2.11922 [13CH3]N1CCNC(=O)C1c2cccc(c2)F 269982a_100011653916_200025704644 [0,1,0,1,0,0|2,0,0]=4 31126 B16R2.11922 [13CH3]N1CCNC(=O)C1c2cccc(c2)F 34a_100011653916_200025704644 [0,1,0,1,0,0|2,0,0]=4 31127 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Br 11a_100000755817_100000747190 [0,1,0,1,0,0|1,0,0]=3 31128 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Br 240690a_100000755817_100000747190 [0,1,0,1,0,0|1,0,0]=3 31129 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Br 527a_100000755817_100000747190 [0,1,0,1,0,0|1,0,0]=3 31130 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Cl 11a_100000755817_100000749307 [0,1,0,1,0,0|1,0,0]=3 31131 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Cl 240690a_100000755817_100000749307 [0,1,0,1,0,0|1,0,0]=3 31132 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)Cl 527a_100000755817_100000749307 [0,1,0,1,0,0|1,0,0]=3 31133 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)F 11a_100000755817_100000211661 [0,1,0,1,0,0|1,0,0]=3 31134 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)F 240690a_100000755817_100000211661 [0,1,0,1,0,0|1,0,0]=3 31135 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)F 527a_100000755817_100000211661 [0,1,0,1,0,0|1,0,0]=3 31136 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)I 11a_100000755817_100000238430 [0,1,0,1,0,0|1,0,0]=3 31137 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)I 240690a_100000755817_100000238430 [0,1,0,1,0,0|1,0,0]=3 31138 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)I 527a_100000755817_100000238430 [0,1,0,1,0,0|1,0,0]=3 31139 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)O 240690a_100000755817_100000745134 [0,1,0,1,0,0|1,0,0]=3 31140 B16R2.25764 CC1CCN1C(=O)Cc2cccc(c2)O 527a_100000755817_100000745134 [0,1,0,1,0,0|1,0,0]=3 31141 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)Br 11a_100000755817_100010201708 [0,1,0,1,0,0|2,0,0]=4 31142 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)Br 240690a_100000755817_100010201708 [0,1,0,1,0,0|2,0,0]=4 31143 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)Br 527a_100000755817_100010201708 [0,1,0,1,0,0|2,0,0]=4 31144 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)Cl 11a_100000755817_100000090259 [0,1,0,1,0,0|2,0,0]=4 31145 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)Cl 240690a_100000755817_100000090259 [0,1,0,1,0,0|2,0,0]=4 31146 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)F 11a_100000755817_100000096803 [0,1,0,1,0,0|2,0,0]=4 31147 B16R2.25764 CC1CCN1C(=O)Cc2cccc(n2)F 240690a_100000755817_100000096803 [0,1,0,1,0,0|2,0,0]=4 31148 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Br 11a_100000755817_100010126891 [0,1,0,1,0,0|2,0,0]=4 31149 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Br 240690a_100000755817_100010126891 [0,1,0,1,0,0|2,0,0]=4 31150 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Br 527a_100000755817_100010126891 [0,1,0,1,0,0|2,0,0]=4 31151 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Cl 11a_100000755817_100000085289 [0,1,0,1,0,0|2,0,0]=4 31152 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Cl 240690a_100000755817_100000085289 [0,1,0,1,0,0|2,0,0]=4 31153 B16R2.25764 CC1CCN1C(=O)Cc2ccnc(c2)Cl 527a_100000755817_100000085289 [0,1,0,1,0,0|2,0,0]=4 31154 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)Br 11a_100000755817_100000239331 [0,1,0,1,0,0|2,0,0]=4 31155 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)Br 240690a_100000755817_100000239331 [0,1,0,1,0,0|2,0,0]=4 31156 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)Br 527a_100000755817_100000239331 [0,1,0,1,0,0|2,0,0]=4 31157 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)F 11a_100000755817_100011667516 [0,1,0,1,0,0|2,0,0]=4 31158 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)F 240690a_100000755817_100011667516 [0,1,0,1,0,0|2,0,0]=4 31159 B16R2.25764 CC1CCN1C(=O)Cc2cncc(c2)F 527a_100000755817_100011667516 [0,1,0,1,0,0|2,0,0]=4 31160 B16R2.25764 CC1CCN1C(=O)Nc2cccc(c2)Br 2430a_100000210019_100000755817 [0,1,0,1,0,0|2,0,0]=4 31161 B16R2.25764 CC1CCN1C(=O)Nc2cccc(c2)Cl 2430a_100000185859_100000755817 [0,1,0,1,0,0|2,0,0]=4 31162 B16R2.25764 CC1CCN1C(=O)Nc2cccc(c2)F 2430a_100000210047_100000755817 [0,1,0,1,0,0|2,0,0]=4 31163 B16R2.25764 CC1CCN1C(=O)Nc2cccc(c2)I 2430a_100000211102_100000755817 [0,1,0,1,0,0|2,0,0]=4 31164 B16R2.25764 CC1CCN1C(=O)Nc2cccc(c2)O 2430a_100000210217_100000755817 [0,1,0,1,0,0|2,0,0]=4 31165 B16R2.25764 Cc1cccc(c1)CC(=O)N2CCC2C 11a_100000755817_100011206899 [0,1,0,1,0,0|1,0,0]=3 31166 B16R2.25764 Cc1cccc(c1)CC(=O)N2CCC2C 240690a_100000755817_100011206899 [0,1,0,1,0,0|1,0,0]=3 31167 B16R2.25764 Cc1cccc(c1)CC(=O)N2CCC2C 527a_100000755817_100011206899 [0,1,0,1,0,0|1,0,0]=3 31168 B16R2.25764 Cc1cccc(c1)NC(=O)N2CCC2C 2430a_100000188690_100000755817 [0,1,0,1,0,0|2,0,0]=4 31169 B16R2.25764 Cc1cccc(n1)CC(=O)N2CCC2C 11a_100000755817_100012001110 [0,1,0,1,0,0|2,0,0]=4 31170 B16R2.25764 Cc1cccc(n1)CC(=O)N2CCC2C 240690a_100000755817_100012001110 [0,1,0,1,0,0|2,0,0]=4 31171 B16R2.25764 Cc1cccc(n1)CC(=O)N2CCC2C 527a_100000755817_100012001110 [0,1,0,1,0,0|2,0,0]=4 31172 B16R2.80725 Cc1cc(ccn1)CC(=O)CC2CCC2 1458a_100000763092_200020672517 [0,1,0,1,0,0|2,0,0]=4 31173 B16R2.80725 Cc1cccc(c1)CC(=O)C=C2CCC2 1458a_100000686340_100000211840 [0,1,0,1,0,0|1,0,1]=4 31174 B16R2.80725 Cc1cccc(c1)CC(=O)CC2CCC2 1458a_100000763092_100000211840 [0,1,0,1,0,0|1,0,0]=3 31175 B16R2.80725 Cc1cccc(c1)CC(=O)CC2CCC2 1458a_100011206899_100000763275 [0,1,0,1,0,0|1,0,0]=3 31176 B16R2.80725 Cc1cccc(c1)CC(=O)CC2CCO2 1458a_100011206899_100000103362 [0,1,0,1,0,0|2,0,0]=4 31177 B16R2.80725 Cc1cccc(c1)CC(=O)CC2COC2 1458a_100000687760_100000211840 [0,1,0,1,0,0|2,0,0]=4 31178 B16R2.80725 Cc1cccc(c1)CC(=O)CC2COC2 1458a_100011206899_100010264016 [0,1,0,1,0,0|2,0,0]=4 31179 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CCC2 11a_100000749019_100011206899 [0,1,0,1,0,0|1,0,0]=3 31180 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CCC2 1626a_100000749019_100011206899 [0,1,0,1,0,0|1,0,0]=3 31181 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CCC2 240690a_100000749019_100011206899 [0,1,0,1,0,0|1,0,0]=3 31182 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CCC2 527a_100000749019_100011206899 [0,1,0,1,0,0|1,0,0]=3 31183 B16R2.80725 Cc1cccc(c1)CC(=O)NC2COC2 11a_100016991112_100011206899 [0,1,0,1,0,0|2,0,0]=4 31184 B16R2.80725 Cc1cccc(c1)CC(=O)NC2COC2 1626a_100016991112_100011206899 [0,1,0,1,0,0|2,0,0]=4 31185 B16R2.80725 Cc1cccc(c1)CC(=O)NC2COC2 240690a_100016991112_100011206899 [0,1,0,1,0,0|2,0,0]=4 31186 B16R2.80725 Cc1cccc(c1)CC(=O)NC2COC2 527a_100016991112_100011206899 [0,1,0,1,0,0|2,0,0]=4 31187 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 11a_100016994217_100011206899 [0,1,0,1,0,0|2,0,0]=4 31188 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 1626a_100016994217_100011206899 [0,1,0,1,0,0|2,0,0]=4 31189 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 240690a_100016994217_100011206899 [0,1,0,1,0,0|2,0,0]=4 31190 B16R2.80725 Cc1cccc(c1)CC(=O)NC2CSC2 527a_100016994217_100011206899 [0,1,0,1,0,0|2,0,0]=4 31191 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 11a_100000188690_100000763092 [0,1,0,1,0,0|2,0,0]=4 31192 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 1626a_100000188690_100000763092 [0,1,0,1,0,0|2,0,0]=4 31193 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 22a_100000188690_100000763092 [0,1,0,1,0,0|2,0,0]=4 31194 B16R2.80725 Cc1cccc(c1)NC(=O)CC2CCC2 527a_100000188690_100000763092 [0,1,0,1,0,0|2,0,0]=4 31195 B16R2.80725 Cc1cccc(c1)NC(=O)NC2CCC2 2430a_100000188690_100000749019 [0,1,0,1,0,0|2,0,0]=4 31196 B16R2.80725 Cc1cccc(c1)NC(=O)NC2CCC2 512a_100000188690_100000749019 [0,1,0,1,0,0|2,0,0]=4 31197 B16R2.80725 Cc1cccc(n1)CC(=O)CC2CCC2 1458a_100000763092_100000757606 [0,1,0,1,0,0|2,0,0]=4 31198 B16R2.80725 Cc1cccc(n1)CC(=O)CC2CCC2 1458a_100012001110_100000763275 [0,1,0,1,0,0|2,0,0]=4 31199 B16R2.80725 Cc1cccc(n1)CC(=O)NC2CCC2 11a_100000749019_100012001110 [0,1,0,1,0,0|2,0,0]=4 31200 B16R2.80725 Cc1cccc(n1)CC(=O)NC2CCC2 1626a_100000749019_100012001110 [0,1,0,1,0,0|2,0,0]=4 31201 B16R2.80725 Cc1cccc(n1)CC(=O)NC2CCC2 240690a_100000749019_100012001110 [0,1,0,1,0,0|2,0,0]=4 31202 B16R2.80725 Cc1cccc(n1)CC(=O)NC2CCC2 527a_100000749019_100012001110 [0,1,0,1,0,0|2,0,0]=4 31203 B16R2.80725 Cc1ccnc(c1)CC(=O)CC2CCC2 1458a_100000763092_100000718516 [0,1,0,1,0,0|2,0,0]=4 31204 B16R2.80725 Cc1cncc(c1)CC(=O)CC2CCC2 1458a_100000763092_100000716715 [0,1,0,1,0,0|2,0,0]=4 31205 B16R2.80725 O=C(C=C1CCC1)Cc2cccc(c2)Br 1458a_100000686340_100000211773 [0,1,0,1,0,0|1,0,1]=4 31206 B16R2.80725 O=C(C=C1CCC1)Cc2cccc(c2)Cl 1458a_100000686340_100000181238 [0,1,0,1,0,0|1,0,1]=4 31207 B16R2.80725 O=C(C=C1CCC1)Cc2cccc(c2)F 1458a_100000686340_100000230114 [0,1,0,1,0,0|1,0,1]=4 31208 B16R2.80725 O=C(C=C1CCC1)Cc2cccc(c2)I 1458a_100000686340_100011218688 [0,1,0,1,0,0|1,0,1]=4 31209 B16R2.80725 O=C(C=C1CCC1)Cc2cccc(c2)O 1458a_100000686340_100011660834 [0,1,0,1,0,0|1,0,1]=4 31210 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Br 11a_100000210019_100000763092 [0,1,0,1,0,0|2,0,0]=4 31211 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Br 1626a_100000210019_100000763092 [0,1,0,1,0,0|2,0,0]=4 31212 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Br 22a_100000210019_100000763092 [0,1,0,1,0,0|2,0,0]=4 31213 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Br 527a_100000210019_100000763092 [0,1,0,1,0,0|2,0,0]=4 31214 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Cl 11a_100000185859_100000763092 [0,1,0,1,0,0|2,0,0]=4 31215 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Cl 1626a_100000185859_100000763092 [0,1,0,1,0,0|2,0,0]=4 31216 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)Cl 22a_100000185859_100000763092 [0,1,0,1,0,0|2,0,0]=4 31217 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)F 11a_100000210047_100000763092 [0,1,0,1,0,0|2,0,0]=4 31218 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)F 1626a_100000210047_100000763092 [0,1,0,1,0,0|2,0,0]=4 31219 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)F 22a_100000210047_100000763092 [0,1,0,1,0,0|2,0,0]=4 31220 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)F 527a_100000210047_100000763092 [0,1,0,1,0,0|2,0,0]=4 31221 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I 11a_100000211102_100000763092 [0,1,0,1,0,0|2,0,0]=4 31222 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I 1626a_100000211102_100000763092 [0,1,0,1,0,0|2,0,0]=4 31223 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I 22a_100000211102_100000763092 [0,1,0,1,0,0|2,0,0]=4 31224 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)I 527a_100000211102_100000763092 [0,1,0,1,0,0|2,0,0]=4 31225 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)O 1626a_100000210217_100000763092 [0,1,0,1,0,0|2,0,0]=4 31226 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)O 22a_100000210217_100000763092 [0,1,0,1,0,0|2,0,0]=4 31227 B16R2.80725 O=C(CC1CCC1)Nc2cccc(c2)O 527a_100000210217_100000763092 [0,1,0,1,0,0|2,0,0]=4 31228 B16R2.80725 O=C(Cc1cc(ccn1)Br)CC2CCC2 1458a_100000763092_100010173614 [0,1,0,1,0,0|2,0,0]=4 31229 B16R2.80725 O=C(Cc1cc(ccn1)Cl)CC2CCC2 1458a_100000763092_100016988179 [0,1,0,1,0,0|2,0,0]=4 31230 B16R2.80725 O=C(Cc1cccc(c1)Br)CC2CCC2 1458a_100000747190_100000763275 [0,1,0,1,0,0|1,0,0]=3 31231 B16R2.80725 O=C(Cc1cccc(c1)Br)CC2CCC2 1458a_100000763092_100000211773 [0,1,0,1,0,0|1,0,0]=3 31232 B16R2.80725 O=C(Cc1cccc(c1)Br)CC2CCO2 1458a_100000747190_100000103362 [0,1,0,1,0,0|2,0,0]=4 31233 B16R2.80725 O=C(Cc1cccc(c1)Br)CC2COC2 1458a_100000687760_100000211773 [0,1,0,1,0,0|2,0,0]=4 31234 B16R2.80725 O=C(Cc1cccc(c1)Br)CC2COC2 1458a_100000747190_100010264016 [0,1,0,1,0,0|2,0,0]=4 31235 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CCC2 11a_100000749019_100000747190 [0,1,0,1,0,0|1,0,0]=3 31236 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CCC2 240690a_100000749019_100000747190 [0,1,0,1,0,0|1,0,0]=3 31237 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CCC2 527a_100000749019_100000747190 [0,1,0,1,0,0|1,0,0]=3 31238 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2COC2 11a_100016991112_100000747190 [0,1,0,1,0,0|2,0,0]=4 31239 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2COC2 240690a_100016991112_100000747190 [0,1,0,1,0,0|2,0,0]=4 31240 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2COC2 527a_100016991112_100000747190 [0,1,0,1,0,0|2,0,0]=4 31241 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CSC2 11a_100016994217_100000747190 [0,1,0,1,0,0|2,0,0]=4 31242 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CSC2 240690a_100016994217_100000747190 [0,1,0,1,0,0|2,0,0]=4 31243 B16R2.80725 O=C(Cc1cccc(c1)Br)NC2CSC2 527a_100016994217_100000747190 [0,1,0,1,0,0|2,0,0]=4 31244 B16R2.80725 O=C(Cc1cccc(c1)Cl)CC2CCC2 1458a_100000749307_100000763275 [0,1,0,1,0,0|1,0,0]=3 31245 B16R2.80725 O=C(Cc1cccc(c1)Cl)CC2CCC2 1458a_100000763092_100000181238 [0,1,0,1,0,0|1,0,0]=3 31246 B16R2.80725 O=C(Cc1cccc(c1)Cl)CC2CCO2 1458a_100000749307_100000103362 [0,1,0,1,0,0|2,0,0]=4 31247 B16R2.80725 O=C(Cc1cccc(c1)Cl)CC2COC2 1458a_100000687760_100000181238 [0,1,0,1,0,0|2,0,0]=4 31248 B16R2.80725 O=C(Cc1cccc(c1)Cl)CC2COC2 1458a_100000749307_100010264016 [0,1,0,1,0,0|2,0,0]=4 31249 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CCC2 11a_100000749019_100000749307 [0,1,0,1,0,0|1,0,0]=3 31250 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CCC2 1626a_100000749019_100000749307 [0,1,0,1,0,0|1,0,0]=3 31251 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CCC2 240690a_100000749019_100000749307 [0,1,0,1,0,0|1,0,0]=3 31252 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CCC2 527a_100000749019_100000749307 [0,1,0,1,0,0|1,0,0]=3 31253 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2COC2 11a_100016991112_100000749307 [0,1,0,1,0,0|2,0,0]=4 31254 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2COC2 1626a_100016991112_100000749307 [0,1,0,1,0,0|2,0,0]=4 31255 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2COC2 240690a_100016991112_100000749307 [0,1,0,1,0,0|2,0,0]=4 31256 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2COC2 527a_100016991112_100000749307 [0,1,0,1,0,0|2,0,0]=4 31257 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 11a_100016994217_100000749307 [0,1,0,1,0,0|2,0,0]=4 31258 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 1626a_100016994217_100000749307 [0,1,0,1,0,0|2,0,0]=4 31259 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 240690a_100016994217_100000749307 [0,1,0,1,0,0|2,0,0]=4 31260 B16R2.80725 O=C(Cc1cccc(c1)Cl)NC2CSC2 527a_100016994217_100000749307 [0,1,0,1,0,0|2,0,0]=4 31261 B16R2.80725 O=C(Cc1cccc(c1)F)CC2CCC2 1458a_100000211661_100000763275 [0,1,0,1,0,0|1,0,0]=3 31262 B16R2.80725 O=C(Cc1cccc(c1)F)CC2CCC2 1458a_100000763092_100000230114 [0,1,0,1,0,0|1,0,0]=3 31263 B16R2.80725 O=C(Cc1cccc(c1)F)CC2CCO2 1458a_100000211661_100000103362 [0,1,0,1,0,0|2,0,0]=4 31264 B16R2.80725 O=C(Cc1cccc(c1)F)CC2COC2 1458a_100000211661_100010264016 [0,1,0,1,0,0|2,0,0]=4 31265 B16R2.80725 O=C(Cc1cccc(c1)F)CC2COC2 1458a_100000687760_100000230114 [0,1,0,1,0,0|2,0,0]=4 31266 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CCC2 11a_100000749019_100000211661 [0,1,0,1,0,0|1,0,0]=3 31267 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CCC2 1626a_100000749019_100000211661 [0,1,0,1,0,0|1,0,0]=3 31268 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CCC2 240690a_100000749019_100000211661 [0,1,0,1,0,0|1,0,0]=3 31269 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CCC2 527a_100000749019_100000211661 [0,1,0,1,0,0|1,0,0]=3 31270 B16R2.80725 O=C(Cc1cccc(c1)F)NC2COC2 11a_100016991112_100000211661 [0,1,0,1,0,0|2,0,0]=4 31271 B16R2.80725 O=C(Cc1cccc(c1)F)NC2COC2 1626a_100016991112_100000211661 [0,1,0,1,0,0|2,0,0]=4 31272 B16R2.80725 O=C(Cc1cccc(c1)F)NC2COC2 240690a_100016991112_100000211661 [0,1,0,1,0,0|2,0,0]=4 31273 B16R2.80725 O=C(Cc1cccc(c1)F)NC2COC2 527a_100016991112_100000211661 [0,1,0,1,0,0|2,0,0]=4 31274 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 11a_100016994217_100000211661 [0,1,0,1,0,0|2,0,0]=4 31275 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 1626a_100016994217_100000211661 [0,1,0,1,0,0|2,0,0]=4 31276 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 240690a_100016994217_100000211661 [0,1,0,1,0,0|2,0,0]=4 31277 B16R2.80725 O=C(Cc1cccc(c1)F)NC2CSC2 527a_100016994217_100000211661 [0,1,0,1,0,0|2,0,0]=4 31278 B16R2.80725 O=C(Cc1cccc(c1)I)CC2CCC2 1458a_100000238430_100000763275 [0,1,0,1,0,0|1,0,0]=3 31279 B16R2.80725 O=C(Cc1cccc(c1)I)CC2CCC2 1458a_100000763092_100011218688 [0,1,0,1,0,0|1,0,0]=3 31280 B16R2.80725 O=C(Cc1cccc(c1)I)CC2CCO2 1458a_100000238430_100000103362 [0,1,0,1,0,0|2,0,0]=4 31281 B16R2.80725 O=C(Cc1cccc(c1)I)CC2COC2 1458a_100000238430_100010264016 [0,1,0,1,0,0|2,0,0]=4 31282 B16R2.80725 O=C(Cc1cccc(c1)I)CC2COC2 1458a_100000687760_100011218688 [0,1,0,1,0,0|2,0,0]=4 31283 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CCC2 11a_100000749019_100000238430 [0,1,0,1,0,0|1,0,0]=3 31284 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CCC2 1626a_100000749019_100000238430 [0,1,0,1,0,0|1,0,0]=3 31285 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CCC2 240690a_100000749019_100000238430 [0,1,0,1,0,0|1,0,0]=3 31286 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CCC2 527a_100000749019_100000238430 [0,1,0,1,0,0|1,0,0]=3 31287 B16R2.80725 O=C(Cc1cccc(c1)I)NC2COC2 11a_100016991112_100000238430 [0,1,0,1,0,0|2,0,0]=4 31288 B16R2.80725 O=C(Cc1cccc(c1)I)NC2COC2 1626a_100016991112_100000238430 [0,1,0,1,0,0|2,0,0]=4 31289 B16R2.80725 O=C(Cc1cccc(c1)I)NC2COC2 240690a_100016991112_100000238430 [0,1,0,1,0,0|2,0,0]=4 31290 B16R2.80725 O=C(Cc1cccc(c1)I)NC2COC2 527a_100016991112_100000238430 [0,1,0,1,0,0|2,0,0]=4 31291 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CSC2 11a_100016994217_100000238430 [0,1,0,1,0,0|2,0,0]=4 31292 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CSC2 1626a_100016994217_100000238430 [0,1,0,1,0,0|2,0,0]=4 31293 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CSC2 240690a_100016994217_100000238430 [0,1,0,1,0,0|2,0,0]=4 31294 B16R2.80725 O=C(Cc1cccc(c1)I)NC2CSC2 527a_100016994217_100000238430 [0,1,0,1,0,0|2,0,0]=4 31295 B16R2.80725 O=C(Cc1cccc(c1)O)CC2CCC2 1458a_100000745134_100000763275 [0,1,0,1,0,0|1,0,0]=3 31296 B16R2.80725 O=C(Cc1cccc(c1)O)CC2CCC2 1458a_100000763092_100011660834 [0,1,0,1,0,0|1,0,0]=3 31297 B16R2.80725 O=C(Cc1cccc(c1)O)CC2CCO2 1458a_100000745134_100000103362 [0,1,0,1,0,0|2,0,0]=4 31298 B16R2.80725 O=C(Cc1cccc(c1)O)CC2COC2 1458a_100000687760_100011660834 [0,1,0,1,0,0|2,0,0]=4 31299 B16R2.80725 O=C(Cc1cccc(c1)O)CC2COC2 1458a_100000745134_100010264016 [0,1,0,1,0,0|2,0,0]=4 31300 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CCC2 240690a_100000749019_100000745134 [0,1,0,1,0,0|1,0,0]=3 31301 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CCC2 527a_100000749019_100000745134 [0,1,0,1,0,0|1,0,0]=3 31302 B16R2.80725 O=C(Cc1cccc(c1)O)NC2COC2 240690a_100016991112_100000745134 [0,1,0,1,0,0|2,0,0]=4 31303 B16R2.80725 O=C(Cc1cccc(c1)O)NC2COC2 527a_100016991112_100000745134 [0,1,0,1,0,0|2,0,0]=4 31304 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CSC2 240690a_100016994217_100000745134 [0,1,0,1,0,0|2,0,0]=4 31305 B16R2.80725 O=C(Cc1cccc(c1)O)NC2CSC2 527a_100016994217_100000745134 [0,1,0,1,0,0|2,0,0]=4 31306 B16R2.80725 O=C(Cc1cccc(n1)Br)CC2CCC2 1458a_100000763092_100009889011 [0,1,0,1,0,0|2,0,0]=4 31307 B16R2.80725 O=C(Cc1cccc(n1)Br)CC2CCC2 1458a_100010201708_100000763275 [0,1,0,1,0,0|2,0,0]=4 31308 B16R2.80725 O=C(Cc1cccc(n1)Br)NC2CCC2 11a_100000749019_100010201708 [0,1,0,1,0,0|2,0,0]=4 31309 B16R2.80725 O=C(Cc1cccc(n1)Br)NC2CCC2 240690a_100000749019_100010201708 [0,1,0,1,0,0|2,0,0]=4 31310 B16R2.80725 O=C(Cc1cccc(n1)Br)NC2CCC2 527a_100000749019_100010201708 [0,1,0,1,0,0|2,0,0]=4 31311 B16R2.80725 O=C(Cc1cccc(n1)Cl)CC2CCC2 1458a_100000090259_100000763275 [0,1,0,1,0,0|2,0,0]=4 31312 B16R2.80725 O=C(Cc1cccc(n1)Cl)CC2CCC2 1458a_100000763092_100000086093 [0,1,0,1,0,0|2,0,0]=4 31313 B16R2.80725 O=C(Cc1cccc(n1)Cl)NC2CCC2 11a_100000749019_100000090259 [0,1,0,1,0,0|2,0,0]=4 31314 B16R2.80725 O=C(Cc1cccc(n1)Cl)NC2CCC2 1626a_100000749019_100000090259 [0,1,0,1,0,0|2,0,0]=4 31315 B16R2.80725 O=C(Cc1cccc(n1)Cl)NC2CCC2 240690a_100000749019_100000090259 [0,1,0,1,0,0|2,0,0]=4 31316 B16R2.80725 O=C(Cc1cccc(n1)F)CC2CCC2 1458a_100000096803_100000763275 [0,1,0,1,0,0|2,0,0]=4 31317 B16R2.80725 O=C(Cc1cccc(n1)F)CC2CCC2 1458a_100000763092_100009819644 [0,1,0,1,0,0|2,0,0]=4 31318 B16R2.80725 O=C(Cc1cccc(n1)F)NC2CCC2 11a_100000749019_100000096803 [0,1,0,1,0,0|2,0,0]=4 31319 B16R2.80725 O=C(Cc1cccc(n1)F)NC2CCC2 1626a_100000749019_100000096803 [0,1,0,1,0,0|2,0,0]=4 31320 B16R2.80725 O=C(Cc1cccc(n1)F)NC2CCC2 240690a_100000749019_100000096803 [0,1,0,1,0,0|2,0,0]=4 31321 B16R2.80725 O=C(Cc1ccnc(c1)Br)CC2CCC2 1458a_100000763092_100010243470 [0,1,0,1,0,0|2,0,0]=4 31322 B16R2.80725 O=C(Cc1ccnc(c1)Br)CC2CCC2 1458a_100010126891_100000763275 [0,1,0,1,0,0|2,0,0]=4 31323 B16R2.80725 O=C(Cc1ccnc(c1)Br)NC2CCC2 11a_100000749019_100010126891 [0,1,0,1,0,0|2,0,0]=4 31324 B16R2.80725 O=C(Cc1ccnc(c1)Br)NC2CCC2 240690a_100000749019_100010126891 [0,1,0,1,0,0|2,0,0]=4 31325 B16R2.80725 O=C(Cc1ccnc(c1)Br)NC2CCC2 527a_100000749019_100010126891 [0,1,0,1,0,0|2,0,0]=4 31326 B16R2.80725 O=C(Cc1ccnc(c1)Cl)CC2CCC2 1458a_100000763092_100000764220 [0,1,0,1,0,0|2,0,0]=4 31327 B16R2.80725 O=C(Cc1ccnc(c1)Cl)NC2CCC2 11a_100000749019_100000085289 [0,1,0,1,0,0|2,0,0]=4 31328 B16R2.80725 O=C(Cc1ccnc(c1)Cl)NC2CCC2 1626a_100000749019_100000085289 [0,1,0,1,0,0|2,0,0]=4 31329 B16R2.80725 O=C(Cc1ccnc(c1)Cl)NC2CCC2 240690a_100000749019_100000085289 [0,1,0,1,0,0|2,0,0]=4 31330 B16R2.80725 O=C(Cc1ccnc(c1)Cl)NC2CCC2 527a_100000749019_100000085289 [0,1,0,1,0,0|2,0,0]=4 31331 B16R2.80725 O=C(Cc1cncc(c1)Br)CC2CCC2 1458a_100000239331_100000763275 [0,1,0,1,0,0|2,0,0]=4 31332 B16R2.80725 O=C(Cc1cncc(c1)Br)CC2CCC2 1458a_100000763092_100011740620 [0,1,0,1,0,0|2,0,0]=4 31333 B16R2.80725 O=C(Cc1cncc(c1)Br)NC2CCC2 11a_100000749019_100000239331 [0,1,0,1,0,0|2,0,0]=4 31334 B16R2.80725 O=C(Cc1cncc(c1)Br)NC2CCC2 240690a_100000749019_100000239331 [0,1,0,1,0,0|2,0,0]=4 31335 B16R2.80725 O=C(Cc1cncc(c1)Br)NC2CCC2 527a_100000749019_100000239331 [0,1,0,1,0,0|2,0,0]=4 31336 B16R2.80725 O=C(Cc1cncc(c1)Cl)CC2CCC2 1458a_100000763092_100016992070 [0,1,0,1,0,0|2,0,0]=4 31337 B16R2.80725 O=C(Cc1cncc(c1)F)CC2CCC2 1458a_100000763092_100000725299 [0,1,0,1,0,0|2,0,0]=4 31338 B16R2.80725 O=C(Cc1cncc(c1)F)CC2CCC2 1458a_100011667516_100000763275 [0,1,0,1,0,0|2,0,0]=4 31339 B16R2.80725 O=C(Cc1cncc(c1)F)NC2CCC2 11a_100000749019_100011667516 [0,1,0,1,0,0|2,0,0]=4 31340 B16R2.80725 O=C(Cc1cncc(c1)F)NC2CCC2 240690a_100000749019_100011667516 [0,1,0,1,0,0|2,0,0]=4 31341 B16R2.80725 O=C(Cc1cncc(c1)F)NC2CCC2 527a_100000749019_100011667516 [0,1,0,1,0,0|2,0,0]=4 31342 B16R2.80725 O=C(Nc1cccc(c1)Br)NC2CCC2 2430a_100000210019_100000749019 [0,1,0,1,0,0|2,0,0]=4 31343 B16R2.80725 O=C(Nc1cccc(c1)Br)NC2CCC2 512a_100000210019_100000749019 [0,1,0,1,0,0|2,0,0]=4 31344 B16R2.80725 O=C(Nc1cccc(c1)Cl)NC2CCC2 2430a_100000185859_100000749019 [0,1,0,1,0,0|2,0,0]=4 31345 B16R2.80725 O=C(Nc1cccc(c1)F)NC2CCC2 2430a_100000210047_100000749019 [0,1,0,1,0,0|2,0,0]=4 31346 B16R2.80725 O=C(Nc1cccc(c1)F)NC2CCC2 512a_100000210047_100000749019 [0,1,0,1,0,0|2,0,0]=4 31347 B16R2.80725 O=C(Nc1cccc(c1)I)NC2CCC2 2430a_100000211102_100000749019 [0,1,0,1,0,0|2,0,0]=4 31348 B16R2.80725 O=C(Nc1cccc(c1)I)NC2CCC2 512a_100000211102_100000749019 [0,1,0,1,0,0|2,0,0]=4 31349 B16R2.80725 O=C(Nc1cccc(c1)O)NC2CCC2 2430a_100000210217_100000749019 [0,1,0,1,0,0|2,0,0]=4 31350 B16R2.80725 O=C(Nc1cccc(c1)O)NC2CCC2 512a_100000210217_100000749019 [0,1,0,1,0,0|2,0,0]=4 31351 B16R2.136607 Cc1cc(ccn1)CC(=O)CCC2CC2 1458a_100000756386_200020672517 [0,1,0,1,0,0|2,0,0]=4 31352 B16R2.136607 Cc1cccc(c1)CC(=O)C=CC2CC2 1458a_100102529529_100000211840 [0,1,0,1,0,0|1,0,1]=4 31353 B16R2.136607 Cc1cccc(c1)CC(=O)CCC2CC2 1458a_100000756386_100000211840 [0,1,0,1,0,0|1,0,0]=3 31354 B16R2.136607 Cc1cccc(c1)CC(=O)CCC2CC2 1458a_100011206899_100000694398 [0,1,0,1,0,0|1,0,0]=3 31355 B16R2.136607 Cc1cccc(c1)CC(=O)CCC2CO2 1458a_100011206899_100000732470 [0,1,0,1,0,0|2,0,0]=4 31356 B16R2.136607 Cc1cccc(c1)CC(=O)NCC2CC2 11a_100000735609_100011206899 [0,1,0,1,0,0|1,0,0]=3 31357 B16R2.136607 Cc1cccc(c1)CC(=O)NCC2CC2 1626a_100000735609_100011206899 [0,1,0,1,0,0|1,0,0]=3 31358 B16R2.136607 Cc1cccc(c1)CC(=O)NCC2CC2 240690a_100000735609_100011206899 [0,1,0,1,0,0|1,0,0]=3 31359 B16R2.136607 Cc1cccc(c1)CC(=O)NCC2CC2 527a_100000735609_100011206899 [0,1,0,1,0,0|1,0,0]=3 31360 B16R2.136607 Cc1cccc(c1)CC(=O)NNC2CC2 22a_100000701032_100011206899 [0,1,0,1,0,0|2,0,0]=4 31361 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 11a_100000188690_100000756386 [0,1,0,1,0,0|2,0,0]=4 31362 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 1626a_100000188690_100000756386 [0,1,0,1,0,0|2,0,0]=4 31363 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 22a_100000188690_100000756386 [0,1,0,1,0,0|2,0,0]=4 31364 B16R2.136607 Cc1cccc(c1)NC(=O)CCC2CC2 527a_100000188690_100000756386 [0,1,0,1,0,0|2,0,0]=4 31365 B16R2.136607 Cc1cccc(c1)NC(=O)NCC2CC2 2430a_100000188690_100000735609 [0,1,0,1,0,0|2,0,0]=4 31366 B16R2.136607 Cc1cccc(c1)NC(=O)NCC2CC2 512a_100000188690_100000735609 [0,1,0,1,0,0|2,0,0]=4 31367 B16R2.136607 Cc1cccc(n1)CC(=O)CCC2CC2 1458a_100000756386_100000757606 [0,1,0,1,0,0|2,0,0]=4 31368 B16R2.136607 Cc1cccc(n1)CC(=O)CCC2CC2 1458a_100012001110_100000694398 [0,1,0,1,0,0|2,0,0]=4 31369 B16R2.136607 Cc1cccc(n1)CC(=O)NCC2CC2 11a_100000735609_100012001110 [0,1,0,1,0,0|2,0,0]=4 31370 B16R2.136607 Cc1cccc(n1)CC(=O)NCC2CC2 1626a_100000735609_100012001110 [0,1,0,1,0,0|2,0,0]=4 31371 B16R2.136607 Cc1cccc(n1)CC(=O)NCC2CC2 240690a_100000735609_100012001110 [0,1,0,1,0,0|2,0,0]=4 31372 B16R2.136607 Cc1cccc(n1)CC(=O)NCC2CC2 527a_100000735609_100012001110 [0,1,0,1,0,0|2,0,0]=4 31373 B16R2.136607 Cc1ccnc(c1)CC(=O)CCC2CC2 1458a_100000756386_100000718516 [0,1,0,1,0,0|2,0,0]=4 31374 B16R2.136607 Cc1cncc(c1)CC(=O)CCC2CC2 1458a_100000756386_100000716715 [0,1,0,1,0,0|2,0,0]=4 31375 B16R2.136607 O=C(C=CC1CC1)Cc2cccc(c2)Br 1458a_100102529529_100000211773 [0,1,0,1,0,0|1,0,1]=4 31376 B16R2.136607 O=C(C=CC1CC1)Cc2cccc(c2)Cl 1458a_100102529529_100000181238 [0,1,0,1,0,0|1,0,1]=4 31377 B16R2.136607 O=C(C=CC1CC1)Cc2cccc(c2)F 1458a_100102529529_100000230114 [0,1,0,1,0,0|1,0,1]=4 31378 B16R2.136607 O=C(C=CC1CC1)Cc2cccc(c2)I 1458a_100102529529_100011218688 [0,1,0,1,0,0|1,0,1]=4 31379 B16R2.136607 O=C(C=CC1CC1)Cc2cccc(c2)O 1458a_100102529529_100011660834 [0,1,0,1,0,0|1,0,1]=4 31380 B16R2.136607 O=C(CCC1CC1)Cc2cc(ccn2)Br 1458a_100000756386_100010173614 [0,1,0,1,0,0|2,0,0]=4 31381 B16R2.136607 O=C(CCC1CC1)Cc2cc(ccn2)Cl 1458a_100000756386_100016988179 [0,1,0,1,0,0|2,0,0]=4 31382 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)Br 1458a_100000747190_100000694398 [0,1,0,1,0,0|1,0,0]=3 31383 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)Br 1458a_100000756386_100000211773 [0,1,0,1,0,0|1,0,0]=3 31384 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)Cl 1458a_100000749307_100000694398 [0,1,0,1,0,0|1,0,0]=3 31385 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)Cl 1458a_100000756386_100000181238 [0,1,0,1,0,0|1,0,0]=3 31386 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)F 1458a_100000211661_100000694398 [0,1,0,1,0,0|1,0,0]=3 31387 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)F 1458a_100000756386_100000230114 [0,1,0,1,0,0|1,0,0]=3 31388 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)I 1458a_100000238430_100000694398 [0,1,0,1,0,0|1,0,0]=3 31389 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)I 1458a_100000756386_100011218688 [0,1,0,1,0,0|1,0,0]=3 31390 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)O 1458a_100000745134_100000694398 [0,1,0,1,0,0|1,0,0]=3 31391 B16R2.136607 O=C(CCC1CC1)Cc2cccc(c2)O 1458a_100000756386_100011660834 [0,1,0,1,0,0|1,0,0]=3 31392 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)Br 1458a_100000756386_100009889011 [0,1,0,1,0,0|2,0,0]=4 31393 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)Br 1458a_100010201708_100000694398 [0,1,0,1,0,0|2,0,0]=4 31394 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)Cl 1458a_100000090259_100000694398 [0,1,0,1,0,0|2,0,0]=4 31395 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)Cl 1458a_100000756386_100000086093 [0,1,0,1,0,0|2,0,0]=4 31396 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)F 1458a_100000096803_100000694398 [0,1,0,1,0,0|2,0,0]=4 31397 B16R2.136607 O=C(CCC1CC1)Cc2cccc(n2)F 1458a_100000756386_100009819644 [0,1,0,1,0,0|2,0,0]=4 31398 B16R2.136607 O=C(CCC1CC1)Cc2ccnc(c2)Br 1458a_100000756386_100010243470 [0,1,0,1,0,0|2,0,0]=4 31399 B16R2.136607 O=C(CCC1CC1)Cc2ccnc(c2)Br 1458a_100010126891_100000694398 [0,1,0,1,0,0|2,0,0]=4 31400 B16R2.136607 O=C(CCC1CC1)Cc2ccnc(c2)Cl 1458a_100000756386_100000764220 [0,1,0,1,0,0|2,0,0]=4 31401 B16R2.136607 O=C(CCC1CC1)Cc2cncc(c2)Br 1458a_100000239331_100000694398 [0,1,0,1,0,0|2,0,0]=4 31402 B16R2.136607 O=C(CCC1CC1)Cc2cncc(c2)Br 1458a_100000756386_100011740620 [0,1,0,1,0,0|2,0,0]=4 31403 B16R2.136607 O=C(CCC1CC1)Cc2cncc(c2)Cl 1458a_100000756386_100016992070 [0,1,0,1,0,0|2,0,0]=4 31404 B16R2.136607 O=C(CCC1CC1)Cc2cncc(c2)F 1458a_100000756386_100000725299 [0,1,0,1,0,0|2,0,0]=4 31405 B16R2.136607 O=C(CCC1CC1)Cc2cncc(c2)F 1458a_100011667516_100000694398 [0,1,0,1,0,0|2,0,0]=4 31406 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Br 11a_100000210019_100000756386 [0,1,0,1,0,0|2,0,0]=4 31407 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Br 1626a_100000210019_100000756386 [0,1,0,1,0,0|2,0,0]=4 31408 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Br 22a_100000210019_100000756386 [0,1,0,1,0,0|2,0,0]=4 31409 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Br 527a_100000210019_100000756386 [0,1,0,1,0,0|2,0,0]=4 31410 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Cl 11a_100000185859_100000756386 [0,1,0,1,0,0|2,0,0]=4 31411 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Cl 1626a_100000185859_100000756386 [0,1,0,1,0,0|2,0,0]=4 31412 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)Cl 22a_100000185859_100000756386 [0,1,0,1,0,0|2,0,0]=4 31413 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)F 11a_100000210047_100000756386 [0,1,0,1,0,0|2,0,0]=4 31414 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)F 1626a_100000210047_100000756386 [0,1,0,1,0,0|2,0,0]=4 31415 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)F 22a_100000210047_100000756386 [0,1,0,1,0,0|2,0,0]=4 31416 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)F 527a_100000210047_100000756386 [0,1,0,1,0,0|2,0,0]=4 31417 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I 11a_100000211102_100000756386 [0,1,0,1,0,0|2,0,0]=4 31418 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I 1626a_100000211102_100000756386 [0,1,0,1,0,0|2,0,0]=4 31419 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I 22a_100000211102_100000756386 [0,1,0,1,0,0|2,0,0]=4 31420 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)I 527a_100000211102_100000756386 [0,1,0,1,0,0|2,0,0]=4 31421 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)O 1626a_100000210217_100000756386 [0,1,0,1,0,0|2,0,0]=4 31422 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)O 22a_100000210217_100000756386 [0,1,0,1,0,0|2,0,0]=4 31423 B16R2.136607 O=C(CCC1CC1)Nc2cccc(c2)O 527a_100000210217_100000756386 [0,1,0,1,0,0|2,0,0]=4 31424 B16R2.136607 O=C(CCC1CO1)Cc2cccc(c2)Br 1458a_100000747190_100000732470 [0,1,0,1,0,0|2,0,0]=4 31425 B16R2.136607 O=C(CCC1CO1)Cc2cccc(c2)Cl 1458a_100000749307_100000732470 [0,1,0,1,0,0|2,0,0]=4 31426 B16R2.136607 O=C(CCC1CO1)Cc2cccc(c2)F 1458a_100000211661_100000732470 [0,1,0,1,0,0|2,0,0]=4 31427 B16R2.136607 O=C(CCC1CO1)Cc2cccc(c2)I 1458a_100000238430_100000732470 [0,1,0,1,0,0|2,0,0]=4 31428 B16R2.136607 O=C(CCC1CO1)Cc2cccc(c2)O 1458a_100000745134_100000732470 [0,1,0,1,0,0|2,0,0]=4 31429 B16R2.136607 O=C(Cc1cccc(c1)Br)NCC2CC2 11a_100000735609_100000747190 [0,1,0,1,0,0|1,0,0]=3 31430 B16R2.136607 O=C(Cc1cccc(c1)Br)NCC2CC2 240690a_100000735609_100000747190 [0,1,0,1,0,0|1,0,0]=3 31431 B16R2.136607 O=C(Cc1cccc(c1)Br)NCC2CC2 527a_100000735609_100000747190 [0,1,0,1,0,0|1,0,0]=3 31432 B16R2.136607 O=C(Cc1cccc(c1)Br)NNC2CC2 22a_100000701032_100000747190 [0,1,0,1,0,0|2,0,0]=4 31433 B16R2.136607 O=C(Cc1cccc(c1)Cl)NCC2CC2 11a_100000735609_100000749307 [0,1,0,1,0,0|1,0,0]=3 31434 B16R2.136607 O=C(Cc1cccc(c1)Cl)NCC2CC2 1626a_100000735609_100000749307 [0,1,0,1,0,0|1,0,0]=3 31435 B16R2.136607 O=C(Cc1cccc(c1)Cl)NCC2CC2 240690a_100000735609_100000749307 [0,1,0,1,0,0|1,0,0]=3 31436 B16R2.136607 O=C(Cc1cccc(c1)Cl)NCC2CC2 527a_100000735609_100000749307 [0,1,0,1,0,0|1,0,0]=3 31437 B16R2.136607 O=C(Cc1cccc(c1)Cl)NNC2CC2 22a_100000701032_100000749307 [0,1,0,1,0,0|2,0,0]=4 31438 B16R2.136607 O=C(Cc1cccc(c1)F)NCC2CC2 11a_100000735609_100000211661 [0,1,0,1,0,0|1,0,0]=3 31439 B16R2.136607 O=C(Cc1cccc(c1)F)NCC2CC2 1626a_100000735609_100000211661 [0,1,0,1,0,0|1,0,0]=3 31440 B16R2.136607 O=C(Cc1cccc(c1)F)NCC2CC2 240690a_100000735609_100000211661 [0,1,0,1,0,0|1,0,0]=3 31441 B16R2.136607 O=C(Cc1cccc(c1)F)NCC2CC2 527a_100000735609_100000211661 [0,1,0,1,0,0|1,0,0]=3 31442 B16R2.136607 O=C(Cc1cccc(c1)F)NNC2CC2 22a_100000701032_100000211661 [0,1,0,1,0,0|2,0,0]=4 31443 B16R2.136607 O=C(Cc1cccc(c1)I)NCC2CC2 11a_100000735609_100000238430 [0,1,0,1,0,0|1,0,0]=3 31444 B16R2.136607 O=C(Cc1cccc(c1)I)NCC2CC2 1626a_100000735609_100000238430 [0,1,0,1,0,0|1,0,0]=3 31445 B16R2.136607 O=C(Cc1cccc(c1)I)NCC2CC2 240690a_100000735609_100000238430 [0,1,0,1,0,0|1,0,0]=3 31446 B16R2.136607 O=C(Cc1cccc(c1)I)NCC2CC2 527a_100000735609_100000238430 [0,1,0,1,0,0|1,0,0]=3 31447 B16R2.136607 O=C(Cc1cccc(c1)I)NNC2CC2 22a_100000701032_100000238430 [0,1,0,1,0,0|2,0,0]=4 31448 B16R2.136607 O=C(Cc1cccc(c1)O)NCC2CC2 240690a_100000735609_100000745134 [0,1,0,1,0,0|1,0,0]=3 31449 B16R2.136607 O=C(Cc1cccc(c1)O)NCC2CC2 527a_100000735609_100000745134 [0,1,0,1,0,0|1,0,0]=3 31450 B16R2.136607 O=C(Cc1cccc(c1)O)NNC2CC2 22a_100000701032_100000745134 [0,1,0,1,0,0|2,0,0]=4 31451 B16R2.136607 O=C(Cc1cccc(n1)Br)NCC2CC2 11a_100000735609_100010201708 [0,1,0,1,0,0|2,0,0]=4 31452 B16R2.136607 O=C(Cc1cccc(n1)Br)NCC2CC2 240690a_100000735609_100010201708 [0,1,0,1,0,0|2,0,0]=4 31453 B16R2.136607 O=C(Cc1cccc(n1)Br)NCC2CC2 527a_100000735609_100010201708 [0,1,0,1,0,0|2,0,0]=4 31454 B16R2.136607 O=C(Cc1cccc(n1)Cl)NCC2CC2 11a_100000735609_100000090259 [0,1,0,1,0,0|2,0,0]=4 31455 B16R2.136607 O=C(Cc1cccc(n1)Cl)NCC2CC2 1626a_100000735609_100000090259 [0,1,0,1,0,0|2,0,0]=4 31456 B16R2.136607 O=C(Cc1cccc(n1)Cl)NCC2CC2 240690a_100000735609_100000090259 [0,1,0,1,0,0|2,0,0]=4 31457 B16R2.136607 O=C(Cc1cccc(n1)F)NCC2CC2 11a_100000735609_100000096803 [0,1,0,1,0,0|2,0,0]=4 31458 B16R2.136607 O=C(Cc1cccc(n1)F)NCC2CC2 1626a_100000735609_100000096803 [0,1,0,1,0,0|2,0,0]=4 31459 B16R2.136607 O=C(Cc1cccc(n1)F)NCC2CC2 240690a_100000735609_100000096803 [0,1,0,1,0,0|2,0,0]=4 31460 B16R2.136607 O=C(Cc1ccnc(c1)Br)NCC2CC2 11a_100000735609_100010126891 [0,1,0,1,0,0|2,0,0]=4 31461 B16R2.136607 O=C(Cc1ccnc(c1)Br)NCC2CC2 240690a_100000735609_100010126891 [0,1,0,1,0,0|2,0,0]=4 31462 B16R2.136607 O=C(Cc1ccnc(c1)Br)NCC2CC2 527a_100000735609_100010126891 [0,1,0,1,0,0|2,0,0]=4 31463 B16R2.136607 O=C(Cc1ccnc(c1)Cl)NCC2CC2 11a_100000735609_100000085289 [0,1,0,1,0,0|2,0,0]=4 31464 B16R2.136607 O=C(Cc1ccnc(c1)Cl)NCC2CC2 1626a_100000735609_100000085289 [0,1,0,1,0,0|2,0,0]=4 31465 B16R2.136607 O=C(Cc1ccnc(c1)Cl)NCC2CC2 240690a_100000735609_100000085289 [0,1,0,1,0,0|2,0,0]=4 31466 B16R2.136607 O=C(Cc1ccnc(c1)Cl)NCC2CC2 527a_100000735609_100000085289 [0,1,0,1,0,0|2,0,0]=4 31467 B16R2.136607 O=C(Cc1cncc(c1)Br)NCC2CC2 11a_100000735609_100000239331 [0,1,0,1,0,0|2,0,0]=4 31468 B16R2.136607 O=C(Cc1cncc(c1)Br)NCC2CC2 240690a_100000735609_100000239331 [0,1,0,1,0,0|2,0,0]=4 31469 B16R2.136607 O=C(Cc1cncc(c1)Br)NCC2CC2 527a_100000735609_100000239331 [0,1,0,1,0,0|2,0,0]=4 31470 B16R2.136607 O=C(Cc1cncc(c1)F)NCC2CC2 11a_100000735609_100011667516 [0,1,0,1,0,0|2,0,0]=4 31471 B16R2.136607 O=C(Cc1cncc(c1)F)NCC2CC2 240690a_100000735609_100011667516 [0,1,0,1,0,0|2,0,0]=4 31472 B16R2.136607 O=C(Cc1cncc(c1)F)NCC2CC2 527a_100000735609_100011667516 [0,1,0,1,0,0|2,0,0]=4 31473 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)Br 2430a_100000210019_100000735609 [0,1,0,1,0,0|2,0,0]=4 31474 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)Br 512a_100000210019_100000735609 [0,1,0,1,0,0|2,0,0]=4 31475 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)Cl 2430a_100000185859_100000735609 [0,1,0,1,0,0|2,0,0]=4 31476 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)F 2430a_100000210047_100000735609 [0,1,0,1,0,0|2,0,0]=4 31477 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)F 512a_100000210047_100000735609 [0,1,0,1,0,0|2,0,0]=4 31478 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)I 2430a_100000211102_100000735609 [0,1,0,1,0,0|2,0,0]=4 31479 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)I 512a_100000211102_100000735609 [0,1,0,1,0,0|2,0,0]=4 31480 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)O 2430a_100000210217_100000735609 [0,1,0,1,0,0|2,0,0]=4 31481 B16R2.136607 O=C(NCC1CC1)Nc2cccc(c2)O 512a_100000210217_100000735609 [0,1,0,1,0,0|2,0,0]=4 31482 B16R2.1056 CCCCc1cc2ccccc2oc1=O 271570a_100020621405_200000187772 [0,1,0,1,0,0|2,0,0]=4 31483 B16R2.1895 CCC1CN(C1)C(=O)C[n+]2ccccc2 11a_100015205115_200000086051 [0,1,0,1,0,0|2,0,0]=4 31484 B16R2.1895 CCC1CN(C1)C(=O)C[n+]2ccccc2 240690a_100015205115_200000086051 [0,1,0,1,0,0|2,0,0]=4 31485 B16R2.1895 CCC1CN(C1)C(=O)C[n+]2ccccc2 527a_100015205115_200000086051 [0,1,0,1,0,0|2,0,0]=4 31486 B16R2.1895 CCC1CN(C1)C(=O)Cc2ccccn2 11a_100015205115_100000233486 [0,1,0,1,0,0|2,0,0]=4 31487 B16R2.1895 CCC1CN(C1)C(=O)Cc2cccnc2 11a_100015205115_100000737805 [0,1,0,1,0,0|2,0,0]=4 31488 B16R2.1895 CCC1CN(C1)C(=O)Cc2cccnc2 240690a_100015205115_100000737805 [0,1,0,1,0,0|2,0,0]=4 31489 B16R2.1895 CCC1CN(C1)C(=O)Cc2cccnc2 527a_100015205115_100000737805 [0,1,0,1,0,0|2,0,0]=4 31490 B16R2.1895 CCC1CN(C1)C(=O)Cc2ccncc2 11a_100015205115_100011201483 [0,1,0,1,0,0|2,0,0]=4 31491 B16R2.1895 CCC1CN(C1)C(=O)Cc2ccncc2 240690a_100015205115_100011201483 [0,1,0,1,0,0|2,0,0]=4 31492 B16R2.1895 CCC1CN(C1)C(=O)Nc2ccccc2 2430a_100000106764_100015205115 [0,1,0,1,0,0|2,0,0]=4 31493 B16R2.1895 COC1CC(C1)C(=O)Cc2ccccc2 1458a_100011999411_100015291786 [0,1,0,1,0,0|2,0,0]=4 31494 B16R2.1895 O=C(Cc1ccccc1)C2CC(C2)CO 1458a_206645079618_100015291786 [0,1,0,1,0,0|2,0,0]=4 31495 B16R2.2128 CCCCC(=O)C1=Cc2ccccc2C1 1458a_100009862756_100000210211 [0,1,0,1,0,0|2,0,0]=4 31496 B16R2.2843 CN1CCC(C1)C(=O)Cc2ccccc2 1458a_100000739633_100015291786 [0,1,0,1,0,0|2,0,0]=4 31497 B16R2.2843 C[C@@H]1CCN(C1)C(=O)C[n+]2ccccc2 11a_100016987628_200000086051 [0,1,0,1,0,0|2,0,0]=4 31498 B16R2.2843 C[C@@H]1CCN(C1)C(=O)C[n+]2ccccc2 240690a_100016987628_200000086051 [0,1,0,1,0,0|2,0,0]=4 31499 B16R2.2843 C[C@@H]1CCN(C1)C(=O)C[n+]2ccccc2 527a_100016987628_200000086051 [0,1,0,1,0,0|2,0,0]=4 31500 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccccn2 11a_100016987628_100000233486 [0,1,0,1,0,0|2,0,0]=4 31501 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 11a_100016987628_100000737805 [0,1,0,1,0,0|2,0,0]=4 31502 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 240690a_100016987628_100000737805 [0,1,0,1,0,0|2,0,0]=4 31503 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cccnc2 527a_100016987628_100000737805 [0,1,0,1,0,0|2,0,0]=4 31504 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccncc2 11a_100016987628_100011201483 [0,1,0,1,0,0|2,0,0]=4 31505 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccncc2 240690a_100016987628_100011201483 [0,1,0,1,0,0|2,0,0]=4 31506 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Nc2ccccc2 2430a_100000106764_100016987628 [0,1,0,1,0,0|2,0,0]=4 31507 B16R2.2843 O=C(C[n+]1ccccc1)N2CCC(C2)O 240690a_100011215560_200000086051 [0,1,0,1,0,0|2,0,0]=4 31508 B16R2.2843 O=C(C[n+]1ccccc1)N2CCC(C2)O 527a_100011215560_200000086051 [0,1,0,1,0,0|2,0,0]=4 31509 B16R2.2843 O=C(C[n+]1ccccc1)N2CC[C@@H](C2)F 11a_100015203821_200000086051 [0,1,0,1,0,0|2,0,0]=4 31510 B16R2.2843 O=C(C[n+]1ccccc1)N2CC[C@@H](C2)F 240690a_100015203821_200000086051 [0,1,0,1,0,0|2,0,0]=4 31511 B16R2.2843 O=C(C[n+]1ccccc1)N2CC[C@@H](C2)F 527a_100015203821_200000086051 [0,1,0,1,0,0|2,0,0]=4 31512 B16R2.2843 O=C(Cc1ccccc1)C2CCC(C2)O 1458a_100000688591_100015291786 [0,1,0,1,0,0|1,0,0]=3 31513 B16R2.2843 O=C(Cc1ccccn1)C2CCC(C2)O 1458a_100000688591_100000721315 [0,1,0,1,0,0|2,0,0]=4 31514 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@@H](C2)F 11a_100015203821_100000233486 [0,1,0,1,0,0|2,0,0]=4 31515 B16R2.2843 O=C(Cc1cccnc1)C2CCC(C2)O 1458a_100000688591_100000733263 [0,1,0,1,0,0|2,0,0]=4 31516 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O 240690a_100011215560_100000737805 [0,1,0,1,0,0|2,0,0]=4 31517 B16R2.2843 O=C(Cc1cccnc1)N2CCC(C2)O 527a_100011215560_100000737805 [0,1,0,1,0,0|2,0,0]=4 31518 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)F 11a_100015203821_100000737805 [0,1,0,1,0,0|2,0,0]=4 31519 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)F 240690a_100015203821_100000737805 [0,1,0,1,0,0|2,0,0]=4 31520 B16R2.2843 O=C(Cc1cccnc1)N2CC[C@@H](C2)F 527a_100015203821_100000737805 [0,1,0,1,0,0|2,0,0]=4 31521 B16R2.2843 O=C(Cc1ccncc1)C2CCC(C2)O 1458a_100000688591_100000705612 [0,1,0,1,0,0|2,0,0]=4 31522 B16R2.2843 O=C(Cc1ccncc1)N2CCC(C2)O 240690a_100011215560_100011201483 [0,1,0,1,0,0|2,0,0]=4 31523 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@@H](C2)F 11a_100015203821_100011201483 [0,1,0,1,0,0|2,0,0]=4 31524 B16R2.2843 O=C(Cc1ccncc1)N2CC[C@@H](C2)F 240690a_100015203821_100011201483 [0,1,0,1,0,0|2,0,0]=4 31525 B16R2.2843 O=C(Nc1ccccc1)C2CCC(C2)O 1626a_100000106764_100000688591 [0,1,0,1,0,0|2,0,0]=4 31526 B16R2.2843 O=C(Nc1ccccc1)C2CCC(C2)O 22a_100000106764_100000688591 [0,1,0,1,0,0|2,0,0]=4 31527 B16R2.2843 O=C(Nc1ccccc1)N2CCC(C2)O 2430a_100000106764_100011215560 [0,1,0,1,0,0|2,0,0]=4 31528 B16R2.2843 O=C(Nc1ccccc1)N2CC[C@@H](C2)F 2430a_100000106764_100015203821 [0,1,0,1,0,0|2,0,0]=4 31529 B16R2.27732 CC1(CCCC1)C(=O)Cc2ccccc2 1458a_100000239728_100015291786 [0,1,0,1,0,0|1,0,0]=3 31530 B16R2.27732 CC1(CCCC1)C(=O)Cc2ccccn2 1458a_100000239728_100000721315 [0,1,0,1,0,0|2,0,0]=4 31531 B16R2.27732 CC1(CCCC1)C(=O)Cc2cccnc2 1458a_100000239728_100000733263 [0,1,0,1,0,0|2,0,0]=4 31532 B16R2.27732 CC1(CCCC1)C(=O)Cc2ccncc2 1458a_100000239728_100000705612 [0,1,0,1,0,0|2,0,0]=4 31533 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 11a_100000106764_100000239728 [0,1,0,1,0,0|2,0,0]=4 31534 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 1626a_100000106764_100000239728 [0,1,0,1,0,0|2,0,0]=4 31535 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 22a_100000106764_100000239728 [0,1,0,1,0,0|2,0,0]=4 31536 B16R2.27732 CC1(CCCC1)C(=O)Nc2ccccc2 527a_100000106764_100000239728 [0,1,0,1,0,0|2,0,0]=4 31537 B16R2.27732 CC1(CCCO1)C(=O)Cc2ccccc2 1458a_100000684770_100015291786 [0,1,0,1,0,0|2,0,0]=4 31538 B16R2.27732 O=C(Cc1ccccc1)C2(CCCC2)O 1458a_100000242637_100015291786 [0,1,0,1,0,0|1,0,0]=3 31539 B16R2.27732 O=C(Cc1ccccn1)C2(CCCC2)O 1458a_100000242637_100000721315 [0,1,0,1,0,0|2,0,0]=4 31540 B16R2.27732 O=C(Cc1cccnc1)C2(CCCC2)O 1458a_100000242637_100000733263 [0,1,0,1,0,0|2,0,0]=4 31541 B16R2.27732 O=C(Cc1ccncc1)C2(CCCC2)O 1458a_100000242637_100000705612 [0,1,0,1,0,0|2,0,0]=4 31542 B16R2.27732 O=C(Nc1ccccc1)C2(CCCC2)O 22a_100000106764_100000242637 [0,1,0,1,0,0|2,0,0]=4 31543 B16R2.27732 O=C(Nc1ccccc1)C2(CCCC2)O 527a_100000106764_100000242637 [0,1,0,1,0,0|2,0,0]=4 31544 B16R2.27766 CN(CC1CC1)C(=O)C[n+]2ccccc2 11a_100000741881_200000086051 [0,1,0,1,0,0|2,0,0]=4 31545 B16R2.27766 CN(CC1CC1)C(=O)C[n+]2ccccc2 240690a_100000741881_200000086051 [0,1,0,1,0,0|2,0,0]=4 31546 B16R2.27766 CN(CC1CC1)C(=O)C[n+]2ccccc2 527a_100000741881_200000086051 [0,1,0,1,0,0|2,0,0]=4 31547 B16R2.27766 CN(CC1CC1)C(=O)Cc2ccccn2 11a_100000741881_100000233486 [0,1,0,1,0,0|2,0,0]=4 31548 B16R2.27766 CN(CC1CC1)C(=O)Cc2cccnc2 11a_100000741881_100000737805 [0,1,0,1,0,0|2,0,0]=4 31549 B16R2.27766 CN(CC1CC1)C(=O)Cc2cccnc2 240690a_100000741881_100000737805 [0,1,0,1,0,0|2,0,0]=4 31550 B16R2.27766 CN(CC1CC1)C(=O)Cc2cccnc2 527a_100000741881_100000737805 [0,1,0,1,0,0|2,0,0]=4 31551 B16R2.27766 CN(CC1CC1)C(=O)Cc2ccncc2 11a_100000741881_100011201483 [0,1,0,1,0,0|2,0,0]=4 31552 B16R2.27766 CN(CC1CC1)C(=O)Cc2ccncc2 240690a_100000741881_100011201483 [0,1,0,1,0,0|2,0,0]=4 31553 B16R2.27766 CN(CC1CC1)C(=O)Nc2ccccc2 2430a_100000106764_100000741881 [0,1,0,1,0,0|2,0,0]=4 31554 B16R2.27766 O=C(CC1CC1)C(=O)Nc2ccccc2 1458a_100000738435_100000742324 [0,1,0,1,0,0|2,0,0]=4 31555 B16R2.27766 O=C(Cc1ccccc1)C(=O)NC2CC2 1458a_100000756273_100015291786 [0,1,0,1,0,0|2,0,0]=4 31556 B16R2.147215 CN(C(=O)C[n+]1ccccc1)C2CCC2 11a_100000758072_200000086051 [0,1,0,1,0,0|2,0,0]=4 31557 B16R2.147215 CN(C(=O)C[n+]1ccccc1)C2CCC2 240690a_100000758072_200000086051 [0,1,0,1,0,0|2,0,0]=4 31558 B16R2.147215 CN(C(=O)C[n+]1ccccc1)C2CCC2 527a_100000758072_200000086051 [0,1,0,1,0,0|2,0,0]=4 31559 B16R2.147215 CN(C(=O)Cc1ccccn1)C2CCC2 11a_100000758072_100000233486 [0,1,0,1,0,0|2,0,0]=4 31560 B16R2.147215 CN(C(=O)Cc1cccnc1)C2CCC2 11a_100000758072_100000737805 [0,1,0,1,0,0|2,0,0]=4 31561 B16R2.147215 CN(C(=O)Cc1cccnc1)C2CCC2 240690a_100000758072_100000737805 [0,1,0,1,0,0|2,0,0]=4 31562 B16R2.147215 CN(C(=O)Cc1cccnc1)C2CCC2 527a_100000758072_100000737805 [0,1,0,1,0,0|2,0,0]=4 31563 B16R2.147215 CN(C(=O)Cc1ccncc1)C2CCC2 11a_100000758072_100011201483 [0,1,0,1,0,0|2,0,0]=4 31564 B16R2.147215 CN(C(=O)Cc1ccncc1)C2CCC2 240690a_100000758072_100011201483 [0,1,0,1,0,0|2,0,0]=4 31565 B16R2.147215 CN(C(=O)Nc1ccccc1)C2CCC2 2430a_100000106764_100000758072 [0,1,0,1,0,0|2,0,0]=4 31566 B16R2.147215 O=C(Nc1ccccc1)C(=O)C2CCC2 1458a_100000738435_100000749161 [0,1,0,1,0,0|2,0,0]=4 31567 B16R2.734 CCCC(C)OC1Cc2ccccc2C1 34a_100000764384_100000753484 [0,1,0,1,0,0|1,0,1]=4 31568 B16R2.734 CCCC(C)OC1Cc2ccccc2C1 34a_100011215286_100000766640 [0,1,0,1,0,0|1,0,1]=4 31569 B16R2.734 CCCC(C)OC1Cc2ccccc2C1 7a_100000764384_100000753484 [0,1,0,1,0,0|1,0,1]=4 31570 B16R2.3334 CC1CN(C1)CC(=O)Cc2ccccc2 2230a_100000702820_100000233483 [0,1,0,1,0,0|2,0,0]=4 31571 B16R2.3334 CC1CN(C1)CC(=O)Cc2ccccc2 269982a_100000702820_100000233483 [0,1,0,1,0,0|2,0,0]=4 31572 B16R2.3334 O=C(C[n+]1ccccc1)NC2CC(C2)F 11a_100016993743_200000086051 [0,1,0,1,0,0|2,0,0]=4 31573 B16R2.3334 O=C(C[n+]1ccccc1)NC2CC(C2)F 240690a_100016993743_200000086051 [0,1,0,1,0,0|2,0,0]=4 31574 B16R2.3334 O=C(C[n+]1ccccc1)NC2CC(C2)F 527a_100016993743_200000086051 [0,1,0,1,0,0|2,0,0]=4 31575 B16R2.3334 O=C(C[n+]1ccccc1)N[C@H]2C[C@@H](C2)O 11a_100020629032_200000086051 [0,1,0,1,0,0|2,0,0]=4 31576 B16R2.3334 O=C(C[n+]1ccccc1)N[C@H]2C[C@@H](C2)O 240690a_100020629032_200000086051 [0,1,0,1,0,0|2,0,0]=4 31577 B16R2.3334 O=C(C[n+]1ccccc1)N[C@H]2C[C@@H](C2)O 527a_100020629032_200000086051 [0,1,0,1,0,0|2,0,0]=4 31578 B16R2.3334 O=C(Cc1ccccc1)CN2CC(C2)F 2230a_100000690557_100000233483 [0,1,0,1,0,0|2,0,0]=4 31579 B16R2.3334 O=C(Cc1ccccc1)CN2CC(C2)F 269982a_100000690557_100000233483 [0,1,0,1,0,0|2,0,0]=4 31580 B16R2.3334 O=C(Cc1ccccc1)CN2CC(C2)O 269982a_100000749847_100000233483 [0,1,0,1,0,0|2,0,0]=4 31581 B16R2.3334 O=C(Cc1ccccn1)NC2CC(C2)F 11a_100016993743_100000233486 [0,1,0,1,0,0|2,0,0]=4 31582 B16R2.3334 O=C(Cc1ccccn1)N[C@H]2C[C@@H](C2)O 11a_100020629032_100000233486 [0,1,0,1,0,0|2,0,0]=4 31583 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F 11a_100016993743_100000737805 [0,1,0,1,0,0|2,0,0]=4 31584 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F 240690a_100016993743_100000737805 [0,1,0,1,0,0|2,0,0]=4 31585 B16R2.3334 O=C(Cc1cccnc1)NC2CC(C2)F 527a_100016993743_100000737805 [0,1,0,1,0,0|2,0,0]=4 31586 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@@H](C2)O 11a_100020629032_100000737805 [0,1,0,1,0,0|2,0,0]=4 31587 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@@H](C2)O 240690a_100020629032_100000737805 [0,1,0,1,0,0|2,0,0]=4 31588 B16R2.3334 O=C(Cc1cccnc1)N[C@H]2C[C@@H](C2)O 527a_100020629032_100000737805 [0,1,0,1,0,0|2,0,0]=4 31589 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)F 11a_100016993743_100011201483 [0,1,0,1,0,0|2,0,0]=4 31590 B16R2.3334 O=C(Cc1ccncc1)NC2CC(C2)F 240690a_100016993743_100011201483 [0,1,0,1,0,0|2,0,0]=4 31591 B16R2.3334 O=C(Cc1ccncc1)N[C@H]2C[C@@H](C2)O 11a_100020629032_100011201483 [0,1,0,1,0,0|2,0,0]=4 31592 B16R2.3334 O=C(Cc1ccncc1)N[C@H]2C[C@@H](C2)O 240690a_100020629032_100011201483 [0,1,0,1,0,0|2,0,0]=4 31593 B16R2.3334 O=C(Nc1ccccc1)NC2CC(C2)F 2430a_100000106764_100016993743 [0,1,0,1,0,0|2,0,0]=4 31594 B16R2.3334 O=C(Nc1ccccc1)N[C@H]2C[C@@H](C2)O 2430a_100000106764_100020629032 [0,1,0,1,0,0|2,0,0]=4 31595 B16R2.27736 CC(Cc1ccccc1)OC2(CCC2)C 34a_100000759064_200011218536 [0,1,0,1,0,0|1,0,1]=4 31596 B16R2.27736 CC(Cc1ccccc1)OC2(CCC2)C 7a_100000759064_200011218536 [0,1,0,1,0,0|1,0,1]=4 31597 B16R2.27736 CC1(CCC1)CC(=O)C[n+]2ccccc2 1458a_200000086051_100000726658 [0,1,0,1,0,0|2,0,0]=4 31598 B16R2.27736 CC1(CCC1)CC(=O)Cc2ccccn2 1458a_100000233486_100000726658 [0,1,0,1,0,0|2,0,0]=4 31599 B16R2.27736 CC1(CCC1)CC(=O)Cc2cccnc2 1458a_100000737805_100000726658 [0,1,0,1,0,0|2,0,0]=4 31600 B16R2.27736 CC1(CCC1)NC(=O)C[n+]2ccccc2 11a_100000692455_200000086051 [0,1,0,1,0,0|2,0,0]=4 31601 B16R2.27736 CC1(CCC1)NC(=O)C[n+]2ccccc2 240690a_100000692455_200000086051 [0,1,0,1,0,0|2,0,0]=4 31602 B16R2.27736 CC1(CCC1)NC(=O)C[n+]2ccccc2 527a_100000692455_200000086051 [0,1,0,1,0,0|2,0,0]=4 31603 B16R2.27736 CC1(CCC1)NC(=O)Cc2ccccn2 11a_100000692455_100000233486 [0,1,0,1,0,0|2,0,0]=4 31604 B16R2.27736 CC1(CCC1)NC(=O)Cc2cccnc2 11a_100000692455_100000737805 [0,1,0,1,0,0|2,0,0]=4 31605 B16R2.27736 CC1(CCC1)NC(=O)Cc2cccnc2 240690a_100000692455_100000737805 [0,1,0,1,0,0|2,0,0]=4 31606 B16R2.27736 CC1(CCC1)NC(=O)Cc2cccnc2 527a_100000692455_100000737805 [0,1,0,1,0,0|2,0,0]=4 31607 B16R2.27736 CC1(CCC1)NC(=O)Cc2ccncc2 11a_100000692455_100011201483 [0,1,0,1,0,0|2,0,0]=4 31608 B16R2.27736 CC1(CCC1)NC(=O)Cc2ccncc2 240690a_100000692455_100011201483 [0,1,0,1,0,0|2,0,0]=4 31609 B16R2.27736 CC1(CCC1)NC(=O)Nc2ccccc2 2430a_100000106764_100000692455 [0,1,0,1,0,0|2,0,0]=4 31610 B16R2.27769 CC(=CC(=O)Cc1ccccc1)C2CC2 1458a_100000742917_100015291786 [0,1,0,1,0,0|1,0,1]=4 31611 B16R2.27769 CC(Cc1ccccc1)OC(C)C2CC2 34a_100000744524_200011218536 [0,1,0,1,0,0|1,0,1]=4 31612 B16R2.27769 CC(Cc1ccccc1)OC(C)C2CC2 7a_100000744524_200011218536 [0,1,0,1,0,0|1,0,1]=4 31613 B16R2.27769 CC(NC(=O)C[n+]1ccccc1)C2CC2 11a_100000700016_200000086051 [0,1,0,1,0,0|2,0,0]=4 31614 B16R2.27769 CC(NC(=O)C[n+]1ccccc1)C2CC2 240690a_100000700016_200000086051 [0,1,0,1,0,0|2,0,0]=4 31615 B16R2.27769 CC(NC(=O)C[n+]1ccccc1)C2CC2 527a_100000700016_200000086051 [0,1,0,1,0,0|2,0,0]=4 31616 B16R2.27769 CC(NC(=O)Cc1ccccn1)C2CC2 11a_100000700016_100000233486 [0,1,0,1,0,0|2,0,0]=4 31617 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 11a_100000700016_100000737805 [0,1,0,1,0,0|2,0,0]=4 31618 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 240690a_100000700016_100000737805 [0,1,0,1,0,0|2,0,0]=4 31619 B16R2.27769 CC(NC(=O)Cc1cccnc1)C2CC2 527a_100000700016_100000737805 [0,1,0,1,0,0|2,0,0]=4 31620 B16R2.27769 CC(NC(=O)Cc1ccncc1)C2CC2 11a_100000700016_100011201483 [0,1,0,1,0,0|2,0,0]=4 31621 B16R2.27769 CC(NC(=O)Cc1ccncc1)C2CC2 240690a_100000700016_100011201483 [0,1,0,1,0,0|2,0,0]=4 31622 B16R2.27769 CC(NC(=O)Nc1ccccc1)C2CC2 2430a_100000106764_100000700016 [0,1,0,1,0,0|2,0,0]=4 31623 B16R2.27769 CN(CC(=O)Cc1ccccc1)C2CC2 2230a_100000226674_100000233483 [0,1,0,1,0,0|2,0,0]=4 31624 B16R2.27769 CN(CC(=O)Cc1ccccc1)C2CC2 269982a_100000226674_100000233483 [0,1,0,1,0,0|2,0,0]=4 31625 B16R2.27769 O=C(CC(=O)C1CC1)Cc2ccccc2 1458a_100000210395_100000233483 [0,1,0,1,0,0|1,0,1]=4 31626 B16R2.1181 CCC(C)COC1Cc2ccccc2C1 34a_100011215286_100000748023 [0,1,0,1,0,0|1,0,1]=4 31627 B16R2.1181 CCC(O)COC1Cc2ccccc2C1 34a_100011215286_100011218378 [0,1,0,1,0,0|1,0,1]=4 31628 B16R2.1181 CC[C@H](C)COC1Cc2ccccc2C1 34a_100011215286_100009816398 [0,1,0,1,0,0|1,0,1]=4 31629 B16R2.1181 CC[C@H](C)COC1Cc2ccccc2C1 7a_100009816381_100000753484 [0,1,0,1,0,0|1,0,1]=4 31630 B16R2.3341 C[C@H]1[C@H](CN1C(=O)C[n+]2ccccc2)O 11a_206633788156_200000086051 [0,1,0,1,0,0|2,0,0]=4 31631 B16R2.3341 C[C@H]1[C@H](CN1C(=O)C[n+]2ccccc2)O 240690a_206633788156_200000086051 [0,1,0,1,0,0|2,0,0]=4 31632 B16R2.3341 C[C@H]1[C@H](CN1C(=O)C[n+]2ccccc2)O 527a_206633788156_200000086051 [0,1,0,1,0,0|2,0,0]=4 31633 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2ccccn2)O 11a_206633788156_100000233486 [0,1,0,1,0,0|2,0,0]=4 31634 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2cccnc2)O 11a_206633788156_100000737805 [0,1,0,1,0,0|2,0,0]=4 31635 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2cccnc2)O 240690a_206633788156_100000737805 [0,1,0,1,0,0|2,0,0]=4 31636 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2cccnc2)O 527a_206633788156_100000737805 [0,1,0,1,0,0|2,0,0]=4 31637 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2ccncc2)O 11a_206633788156_100011201483 [0,1,0,1,0,0|2,0,0]=4 31638 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Cc2ccncc2)O 240690a_206633788156_100011201483 [0,1,0,1,0,0|2,0,0]=4 31639 B16R2.3341 C[C@H]1[C@H](CN1C(=O)Nc2ccccc2)O 2430a_100000106764_206633788156 [0,1,0,1,0,0|2,0,0]=4 31640 B16R2.147271 CC(Cc1ccccc1)OCC2(CC2)C 7a_100000698024_200011218536 [0,1,0,1,0,0|1,0,1]=4 31641 B16R2.147271 CC(Cc1ccccc1)OCC2(CC2)F 34a_200000703853_200011218536 [0,1,0,1,0,0|1,0,1]=4 31642 B16R2.147271 CC(Cc1ccccc1)OCC2(CC2)F 7a_200000703853_200011218536 [0,1,0,1,0,0|1,0,1]=4 31643 B16R2.147271 CC1(CC1)CNC(=O)C[n+]2ccccc2 11a_100000766693_200000086051 [0,1,0,1,0,0|2,0,0]=4 31644 B16R2.147271 CC1(CC1)CNC(=O)C[n+]2ccccc2 240690a_100000766693_200000086051 [0,1,0,1,0,0|2,0,0]=4 31645 B16R2.147271 CC1(CC1)CNC(=O)C[n+]2ccccc2 527a_100000766693_200000086051 [0,1,0,1,0,0|2,0,0]=4 31646 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccccn2 11a_100000766693_100000233486 [0,1,0,1,0,0|2,0,0]=4 31647 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 11a_100000766693_100000737805 [0,1,0,1,0,0|2,0,0]=4 31648 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 240690a_100000766693_100000737805 [0,1,0,1,0,0|2,0,0]=4 31649 B16R2.147271 CC1(CC1)CNC(=O)Cc2cccnc2 527a_100000766693_100000737805 [0,1,0,1,0,0|2,0,0]=4 31650 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccncc2 11a_100000766693_100011201483 [0,1,0,1,0,0|2,0,0]=4 31651 B16R2.147271 CC1(CC1)CNC(=O)Cc2ccncc2 240690a_100000766693_100011201483 [0,1,0,1,0,0|2,0,0]=4 31652 B16R2.147271 CC1(CC1)CNC(=O)Nc2ccccc2 2430a_100000106764_100000766693 [0,1,0,1,0,0|2,0,0]=4 31653 B16R2.147271 CC1(CC1)NCC(=O)Cc2ccccc2 2230a_100000757604_100000233483 [0,1,0,1,0,0|2,0,0]=4 31654 B16R2.147271 CC1(CC1)OCC(=O)Cc2ccccc2 7a_100011725673_100000233483 [0,1,0,1,0,0|2,0,0]=4 31655 B16R2.147271 O=C(C[n+]1ccccc1)NCC2(CC2)O 11a_100011936951_200000086051 [0,1,0,1,0,0|2,0,0]=4 31656 B16R2.147271 O=C(C[n+]1ccccc1)NCC2(CC2)O 240690a_100011936951_200000086051 [0,1,0,1,0,0|2,0,0]=4 31657 B16R2.147271 O=C(C[n+]1ccccc1)NCC2(CC2)O 527a_100011936951_200000086051 [0,1,0,1,0,0|2,0,0]=4 31658 B16R2.147271 O=C(Cc1ccccn1)NCC2(CC2)O 11a_100011936951_100000233486 [0,1,0,1,0,0|2,0,0]=4 31659 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O 11a_100011936951_100000737805 [0,1,0,1,0,0|2,0,0]=4 31660 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O 240690a_100011936951_100000737805 [0,1,0,1,0,0|2,0,0]=4 31661 B16R2.147271 O=C(Cc1cccnc1)NCC2(CC2)O 527a_100011936951_100000737805 [0,1,0,1,0,0|2,0,0]=4 31662 B16R2.147271 O=C(Cc1ccncc1)NCC2(CC2)O 11a_100011936951_100011201483 [0,1,0,1,0,0|2,0,0]=4 31663 B16R2.147271 O=C(Cc1ccncc1)NCC2(CC2)O 240690a_100011936951_100011201483 [0,1,0,1,0,0|2,0,0]=4 31664 B16R2.147271 O=C(NCC1(CC1)O)Nc2ccccc2 2430a_100000106764_100011936951 [0,1,0,1,0,0|2,0,0]=4 31665 B16R2.112 CCCCc1c(sc2c1cccc2)C=O 271570a_100020621405_100009816528 [0,1,0,1,0,0|2,0,0]=4 31666 B16R2.676 C#CC(Cc1ccccc1)OCC2CC2 34a_100000685211_100000742324 [0,1,0,1,0,0|1,0,1]=4 31667 B16R2.676 C#CC(Cc1ccccc1)OCC2CC2 7a_100000685211_100000742324 [0,1,0,1,0,0|1,0,1]=4 31668 B16R2.676 CCC(Cc1ccccc1)OCC2CC2 7a_100000760156_100000742324 [0,1,0,1,0,0|1,0,1]=4 31669 B16R2.676 ClC[C@H](Cc1ccccc1)OCC2CC2 7a_100000729385_100000742324 [0,1,0,1,0,0|1,0,1]=4 31670 B16R2.676 NCC(Cc1ccccc1)OCC2CC2 34a_100000752270_100000742324 [0,1,0,1,0,0|1,0,1]=4 31671 B16R2.29082 C#CC(Cc1ccccc1)OC2CCC2 34a_100000685211_100000749161 [0,1,0,1,0,0|1,0,1]=4 31672 B16R2.29082 NCC(Cc1ccccc1)OC2CCC2 34a_100000752270_100000749161 [0,1,0,1,0,0|1,0,1]=4 31673 B16R2.492 CC(Br)CCOC1Cc2ccccc2C1 34a_100009893172_100000753484 [0,1,0,1,0,0|1,0,1]=4 31674 B16R2.492 CC(C)CCOC1Cc2ccccc2C1 34a_100000210254_100000753484 [0,1,0,1,0,0|1,0,1]=4 31675 B16R2.492 CC(C)CCOC1Cc2ccccc2C1 34a_100011215286_100000210312 [0,1,0,1,0,0|1,0,1]=4 31676 B16R2.492 CC(C)CCOC1Cc2ccccc2C1 7a_100000210254_100000753484 [0,1,0,1,0,0|1,0,1]=4 31677 B16R2.492 CC(O)CCOC1Cc2ccccc2C1 34a_100011215286_100012276601 [0,1,0,1,0,0|1,0,1]=4 31678 B16R2.492 C[C@@H](N)CCOC1Cc2ccccc2C1 34a_100000706166_100000753484 [0,1,0,1,0,0|1,0,1]=4 31679 B16R2.27737 O=C(Cc1ccccc1)CC2CC2(F)F 1458a_100000138109_100015291786 [0,1,0,1,0,0|2,0,0]=4 31680 B16R2.2957 Cc1ccccc1CC(=O)C2=CCCC2 1458a_100000038896_100000211839 [0,1,0,1,0,0|1,0,1]=4 31681 B16R2.2957 Cc1ccccc1CC(=O)C2CCCC2 1458a_100000210718_100000211839 [0,1,0,1,0,0|1,0,0]=3 31682 B16R2.2957 Cc1ccccc1CC(=O)C2CCCC2 1458a_100000212180_100000179811 [0,1,0,1,0,0|1,0,0]=3 31683 B16R2.2957 Cc1ccccc1CC(=O)C2CCCS2 1458a_100012002731_100000211839 [0,1,0,1,0,0|2,0,0]=4 31684 B16R2.2957 Cc1ccccc1CC(=O)C2CCOC2 1458a_100000212180_100000690089 [0,1,0,1,0,0|2,0,0]=4 31685 B16R2.2957 Cc1ccccc1CC(=O)C2CCOC2 1458a_100011219752_100000211839 [0,1,0,1,0,0|2,0,0]=4 31686 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 240690a_100000188435_100000212180 [0,1,0,1,0,0|1,0,0]=3 31687 B16R2.2957 Cc1ccccc1CC(=O)N2CCCC2 527a_100000188435_100000212180 [0,1,0,1,0,0|1,0,0]=3 31688 B16R2.2957 Cc1ccccc1CC(=O)N2CCSC2 11a_100011215254_100000212180 [0,1,0,1,0,0|2,0,0]=4 31689 B16R2.2957 Cc1ccccc1CC(=O)N2CCSC2 240690a_100011215254_100000212180 [0,1,0,1,0,0|2,0,0]=4 31690 B16R2.2957 Cc1ccccc1CC(=O)N2CCSC2 527a_100011215254_100000212180 [0,1,0,1,0,0|2,0,0]=4 31691 B16R2.2957 Cc1ccccc1CC(=O)[C@@H]2CCCO2 1458a_100000686382_100000211839 [0,1,0,1,0,0|2,0,0]=4 31692 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 11a_100015192222_100000210718 [0,1,0,1,0,0|2,0,0]=4 31693 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 1626a_100015192222_100000210718 [0,1,0,1,0,0|2,0,0]=4 31694 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 22a_100015192222_100000210718 [0,1,0,1,0,0|2,0,0]=4 31695 B16R2.2957 Cc1ccccc1NC(=O)C2CCCC2 527a_100015192222_100000210718 [0,1,0,1,0,0|2,0,0]=4 31696 B16R2.2957 Cc1ccccc1NC(=O)N2CCCC2 2430a_100015192222_100000188435 [0,1,0,1,0,0|2,0,0]=4 31697 B16R2.2957 Cc1cccnc1CC(=O)C2CCCC2 1458a_100000210718_100000696600 [0,1,0,1,0,0|2,0,0]=4 31698 B16R2.2957 Cc1cccnc1CC(=O)C2CCCC2 1458a_200000722269_100000179811 [0,1,0,1,0,0|2,0,0]=4 31699 B16R2.2957 Cc1cccnc1CC(=O)N2CCCC2 240690a_100000188435_200000722269 [0,1,0,1,0,0|2,0,0]=4 31700 B16R2.2957 Cc1ccncc1CC(=O)C2CCCC2 1458a_100000210718_100000690890 [0,1,0,1,0,0|2,0,0]=4 31701 B16R2.2957 Cc1cnccc1CC(=O)C2CCCC2 1458a_100000210718_100020672808 [0,1,0,1,0,0|2,0,0]=4 31702 B16R2.2957 Cc1ncccc1CC(=O)C2CCCC2 1458a_100000210718_100000732876 [0,1,0,1,0,0|2,0,0]=4 31703 B16R2.2957 O=C(Cc1ccccc1Br)C2=CCCC2 1458a_100000038896_100000184730 [0,1,0,1,0,0|1,0,1]=4 31704 B16R2.2957 O=C(Cc1ccccc1Br)C2CCCC2 1458a_100000210718_100000184730 [0,1,0,1,0,0|1,0,0]=3 31705 B16R2.2957 O=C(Cc1ccccc1Br)C2CCCC2 1458a_100000751119_100000179811 [0,1,0,1,0,0|1,0,0]=3 31706 B16R2.2957 O=C(Cc1ccccc1Br)C2CCCS2 1458a_100012002731_100000184730 [0,1,0,1,0,0|2,0,0]=4 31707 B16R2.2957 O=C(Cc1ccccc1Br)C2CCOC2 1458a_100000751119_100000690089 [0,1,0,1,0,0|2,0,0]=4 31708 B16R2.2957 O=C(Cc1ccccc1Br)C2CCOC2 1458a_100011219752_100000184730 [0,1,0,1,0,0|2,0,0]=4 31709 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 240690a_100000188435_100000751119 [0,1,0,1,0,0|1,0,0]=3 31710 B16R2.2957 O=C(Cc1ccccc1Br)N2CCCC2 527a_100000188435_100000751119 [0,1,0,1,0,0|1,0,0]=3 31711 B16R2.2957 O=C(Cc1ccccc1Br)N2CCSC2 11a_100011215254_100000751119 [0,1,0,1,0,0|2,0,0]=4 31712 B16R2.2957 O=C(Cc1ccccc1Br)N2CCSC2 240690a_100011215254_100000751119 [0,1,0,1,0,0|2,0,0]=4 31713 B16R2.2957 O=C(Cc1ccccc1Br)N2CCSC2 527a_100011215254_100000751119 [0,1,0,1,0,0|2,0,0]=4 31714 B16R2.2957 O=C(Cc1ccccc1Br)[C@@H]2CCCO2 1458a_100000686382_100000184730 [0,1,0,1,0,0|2,0,0]=4 31715 B16R2.2957 O=C(Cc1ccccc1Cl)C2=CCCC2 1458a_100000038896_100000187162 [0,1,0,1,0,0|1,0,1]=4 31716 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCCC2 1458a_100000183793_100000179811 [0,1,0,1,0,0|1,0,0]=3 31717 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCCC2 1458a_100000210718_100000187162 [0,1,0,1,0,0|1,0,0]=3 31718 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCCS2 1458a_100012002731_100000187162 [0,1,0,1,0,0|2,0,0]=4 31719 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCOC2 1458a_100000183793_100000690089 [0,1,0,1,0,0|2,0,0]=4 31720 B16R2.2957 O=C(Cc1ccccc1Cl)C2CCOC2 1458a_100011219752_100000187162 [0,1,0,1,0,0|2,0,0]=4 31721 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 240690a_100000188435_100000183793 [0,1,0,1,0,0|1,0,0]=3 31722 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCCC2 527a_100000188435_100000183793 [0,1,0,1,0,0|1,0,0]=3 31723 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCSC2 11a_100011215254_100000183793 [0,1,0,1,0,0|2,0,0]=4 31724 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCSC2 240690a_100011215254_100000183793 [0,1,0,1,0,0|2,0,0]=4 31725 B16R2.2957 O=C(Cc1ccccc1Cl)N2CCSC2 527a_100011215254_100000183793 [0,1,0,1,0,0|2,0,0]=4 31726 B16R2.2957 O=C(Cc1ccccc1Cl)[C@@H]2CCCO2 1458a_100000686382_100000187162 [0,1,0,1,0,0|2,0,0]=4 31727 B16R2.2957 O=C(Cc1ccccc1F)C2=CCCC2 1458a_100000038896_100000187165 [0,1,0,1,0,0|1,0,1]=4 31728 B16R2.2957 O=C(Cc1ccccc1F)C2CCCC2 1458a_100000210718_100000187165 [0,1,0,1,0,0|1,0,0]=3 31729 B16R2.2957 O=C(Cc1ccccc1F)C2CCCC2 1458a_100000212012_100000179811 [0,1,0,1,0,0|1,0,0]=3 31730 B16R2.2957 O=C(Cc1ccccc1F)C2CCCS2 1458a_100012002731_100000187165 [0,1,0,1,0,0|2,0,0]=4 31731 B16R2.2957 O=C(Cc1ccccc1F)C2CCOC2 1458a_100000212012_100000690089 [0,1,0,1,0,0|2,0,0]=4 31732 B16R2.2957 O=C(Cc1ccccc1F)C2CCOC2 1458a_100011219752_100000187165 [0,1,0,1,0,0|2,0,0]=4 31733 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 240690a_100000188435_100000212012 [0,1,0,1,0,0|1,0,0]=3 31734 B16R2.2957 O=C(Cc1ccccc1F)N2CCCC2 527a_100000188435_100000212012 [0,1,0,1,0,0|1,0,0]=3 31735 B16R2.2957 O=C(Cc1ccccc1F)N2CCSC2 11a_100011215254_100000212012 [0,1,0,1,0,0|2,0,0]=4 31736 B16R2.2957 O=C(Cc1ccccc1F)N2CCSC2 240690a_100011215254_100000212012 [0,1,0,1,0,0|2,0,0]=4 31737 B16R2.2957 O=C(Cc1ccccc1F)N2CCSC2 527a_100011215254_100000212012 [0,1,0,1,0,0|2,0,0]=4 31738 B16R2.2957 O=C(Cc1ccccc1F)[C@@H]2CCCO2 1458a_100000686382_100000187165 [0,1,0,1,0,0|2,0,0]=4 31739 B16R2.2957 O=C(Cc1ccccc1I)C2=CCCC2 1458a_100000038896_100011216222 [0,1,0,1,0,0|1,0,1]=4 31740 B16R2.2957 O=C(Cc1ccccc1I)C2CCCC2 1458a_100000036491_100000179811 [0,1,0,1,0,0|1,0,0]=3 31741 B16R2.2957 O=C(Cc1ccccc1I)C2CCCC2 1458a_100000210718_100011216222 [0,1,0,1,0,0|1,0,0]=3 31742 B16R2.2957 O=C(Cc1ccccc1I)C2CCCS2 1458a_100012002731_100011216222 [0,1,0,1,0,0|2,0,0]=4 31743 B16R2.2957 O=C(Cc1ccccc1I)C2CCOC2 1458a_100000036491_100000690089 [0,1,0,1,0,0|2,0,0]=4 31744 B16R2.2957 O=C(Cc1ccccc1I)C2CCOC2 1458a_100011219752_100011216222 [0,1,0,1,0,0|2,0,0]=4 31745 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 240690a_100000188435_100000036491 [0,1,0,1,0,0|1,0,0]=3 31746 B16R2.2957 O=C(Cc1ccccc1I)N2CCCC2 527a_100000188435_100000036491 [0,1,0,1,0,0|1,0,0]=3 31747 B16R2.2957 O=C(Cc1ccccc1I)N2CCSC2 11a_100011215254_100000036491 [0,1,0,1,0,0|2,0,0]=4 31748 B16R2.2957 O=C(Cc1ccccc1I)N2CCSC2 240690a_100011215254_100000036491 [0,1,0,1,0,0|2,0,0]=4 31749 B16R2.2957 O=C(Cc1ccccc1I)N2CCSC2 527a_100011215254_100000036491 [0,1,0,1,0,0|2,0,0]=4 31750 B16R2.2957 O=C(Cc1ccccc1I)[C@@H]2CCCO2 1458a_100000686382_100011216222 [0,1,0,1,0,0|2,0,0]=4 31751 B16R2.2957 O=C(Cc1ccccc1O)C2CCCC2 1458a_100000743006_100000179811 [0,1,0,1,0,0|1,0,0]=3 31752 B16R2.2957 O=C(Cc1ccccc1O)C2CCOC2 1458a_100000743006_100000690089 [0,1,0,1,0,0|2,0,0]=4 31753 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 240690a_100000188435_100000743006 [0,1,0,1,0,0|1,0,0]=3 31754 B16R2.2957 O=C(Cc1ccccc1O)N2CCCC2 527a_100000188435_100000743006 [0,1,0,1,0,0|1,0,0]=3 31755 B16R2.2957 O=C(Cc1ccccc1O)N2CCSC2 240690a_100011215254_100000743006 [0,1,0,1,0,0|2,0,0]=4 31756 B16R2.2957 O=C(Cc1ccccc1O)N2CCSC2 527a_100011215254_100000743006 [0,1,0,1,0,0|2,0,0]=4 31757 B16R2.2957 O=C(Cc1cccnc1Br)C2CCCC2 1458a_100000210718_100010140945 [0,1,0,1,0,0|2,0,0]=4 31758 B16R2.2957 O=C(Cc1cccnc1Cl)C2CCCC2 1458a_100000093521_100000179811 [0,1,0,1,0,0|2,0,0]=4 31759 B16R2.2957 O=C(Cc1cccnc1Cl)C2CCCC2 1458a_100000210718_100000045678 [0,1,0,1,0,0|2,0,0]=4 31760 B16R2.2957 O=C(Cc1cccnc1Cl)N2CCCC2 240690a_100000188435_100000093521 [0,1,0,1,0,0|2,0,0]=4 31761 B16R2.2957 O=C(Cc1cccnc1Cl)N2CCCC2 527a_100000188435_100000093521 [0,1,0,1,0,0|2,0,0]=4 31762 B16R2.2957 O=C(Cc1cccnc1F)C2CCCC2 1458a_100000210718_100000099810 [0,1,0,1,0,0|2,0,0]=4 31763 B16R2.2957 O=C(Cc1ccncc1Cl)C2CCCC2 1458a_100000210718_100000763264 [0,1,0,1,0,0|2,0,0]=4 31764 B16R2.2957 O=C(Cc1ncccc1Br)C2CCCC2 1458a_100000210718_100025702911 [0,1,0,1,0,0|2,0,0]=4 31765 B16R2.2957 O=C(Cc1ncccc1Br)C2CCCC2 1458a_200012357574_100000179811 [0,1,0,1,0,0|2,0,0]=4 31766 B16R2.2957 O=C(Cc1ncccc1Br)N2CCCC2 240690a_100000188435_200012357574 [0,1,0,1,0,0|2,0,0]=4 31767 B16R2.2957 O=C(Cc1ncccc1Cl)C2CCCC2 1458a_100000210718_100000099807 [0,1,0,1,0,0|2,0,0]=4 31768 B16R2.2957 O=C(Cc1ncccc1Cl)C2CCCC2 1458a_100011998755_100000179811 [0,1,0,1,0,0|2,0,0]=4 31769 B16R2.2957 O=C(Cc1ncccc1Cl)N2CCCC2 240690a_100000188435_100011998755 [0,1,0,1,0,0|2,0,0]=4 31770 B16R2.2957 O=C(Cc1ncccc1Cl)N2CCCC2 527a_100000188435_100011998755 [0,1,0,1,0,0|2,0,0]=4 31771 B16R2.2957 O=C(Cc1ncccc1F)C2CCCC2 1458a_100000210718_100000104219 [0,1,0,1,0,0|2,0,0]=4 31772 B16R2.2957 O=C(Cc1ncccc1O)C2CCCC2 1458a_100000210718_200020655725 [0,1,0,1,0,0|2,0,0]=4 31773 B16R2.2957 O=C(Cn1ccccc1=O)C2CCCC2 1458a_100000189665_100000179811 [0,1,0,1,0,0|2,0,0]=4 31774 B16R2.2957 O=C(Cn1ccccc1=O)N2CCCC2 240690a_100000188435_100000189665 [0,1,0,1,0,0|2,0,0]=4 31775 B16R2.2957 O=C(Cn1ccccc1=O)N2CCCC2 527a_100000188435_100000189665 [0,1,0,1,0,0|2,0,0]=4 31776 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 11a_100000210017_100000210718 [0,1,0,1,0,0|2,0,0]=4 31777 B16R2.2957 O=C(Nc1ccccc1Br)C2CCCC2 1626a_100000210017_100000210718 [0,1,0,1,0,0|2,0,0]=4 31778 B16R2.2957 O=C(Nc1ccccc1Br)N2CCCC2 2430a_100000210017_100000188435 [0,1,0,1,0,0|2,0,0]=4 31779 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 11a_100000185783_100000210718 [0,1,0,1,0,0|2,0,0]=4 31780 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 1626a_100000185783_100000210718 [0,1,0,1,0,0|2,0,0]=4 31781 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 22a_100000185783_100000210718 [0,1,0,1,0,0|2,0,0]=4 31782 B16R2.2957 O=C(Nc1ccccc1Cl)C2CCCC2 527a_100000185783_100000210718 [0,1,0,1,0,0|2,0,0]=4 31783 B16R2.2957 O=C(Nc1ccccc1Cl)N2CCCC2 2430a_100000185783_100000188435 [0,1,0,1,0,0|2,0,0]=4 31784 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 11a_100000210422_100000210718 [0,1,0,1,0,0|2,0,0]=4 31785 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 1626a_100000210422_100000210718 [0,1,0,1,0,0|2,0,0]=4 31786 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 22a_100000210422_100000210718 [0,1,0,1,0,0|2,0,0]=4 31787 B16R2.2957 O=C(Nc1ccccc1F)C2CCCC2 527a_100000210422_100000210718 [0,1,0,1,0,0|2,0,0]=4 31788 B16R2.2957 O=C(Nc1ccccc1F)N2CCCC2 2430a_100000210422_100000188435 [0,1,0,1,0,0|2,0,0]=4 31789 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 11a_100000210053_100000210718 [0,1,0,1,0,0|2,0,0]=4 31790 B16R2.2957 O=C(Nc1ccccc1I)C2CCCC2 1626a_100000210053_100000210718 [0,1,0,1,0,0|2,0,0]=4 31791 B16R2.2957 O=C(Nc1ccccc1I)N2CCCC2 2430a_100000210053_100000188435 [0,1,0,1,0,0|2,0,0]=4 31792 B16R2.2957 O=C(Nc1ccccc1O)C2CCCC2 22a_100000185747_100000210718 [0,1,0,1,0,0|2,0,0]=4 31793 B16R2.2957 O=C(Nc1ccccc1O)C2CCCC2 527a_100000185747_100000210718 [0,1,0,1,0,0|2,0,0]=4 31794 B16R2.2957 O=C(Nc1ccccc1O)N2CCCC2 2430a_100000185747_100000188435 [0,1,0,1,0,0|2,0,0]=4 31795 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 11a_100000755817_100000751119 [0,1,0,1,0,0|1,0,0]=3 31796 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 240690a_100000755817_100000751119 [0,1,0,1,0,0|1,0,0]=3 31797 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Br 527a_100000755817_100000751119 [0,1,0,1,0,0|1,0,0]=3 31798 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 11a_100000755817_100000183793 [0,1,0,1,0,0|1,0,0]=3 31799 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 240690a_100000755817_100000183793 [0,1,0,1,0,0|1,0,0]=3 31800 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2Cl 527a_100000755817_100000183793 [0,1,0,1,0,0|1,0,0]=3 31801 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 11a_100000755817_100000212012 [0,1,0,1,0,0|1,0,0]=3 31802 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 240690a_100000755817_100000212012 [0,1,0,1,0,0|1,0,0]=3 31803 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2F 527a_100000755817_100000212012 [0,1,0,1,0,0|1,0,0]=3 31804 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 11a_100000755817_100000036491 [0,1,0,1,0,0|1,0,0]=3 31805 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 240690a_100000755817_100000036491 [0,1,0,1,0,0|1,0,0]=3 31806 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2I 527a_100000755817_100000036491 [0,1,0,1,0,0|1,0,0]=3 31807 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2O 240690a_100000755817_100000743006 [0,1,0,1,0,0|1,0,0]=3 31808 B16R2.12425 CC1CCN1C(=O)Cc2ccccc2O 527a_100000755817_100000743006 [0,1,0,1,0,0|1,0,0]=3 31809 B16R2.12425 CC1CCN1C(=O)Cc2cccnc2Cl 11a_100000755817_100000093521 [0,1,0,1,0,0|2,0,0]=4 31810 B16R2.12425 CC1CCN1C(=O)Cc2cccnc2Cl 240690a_100000755817_100000093521 [0,1,0,1,0,0|2,0,0]=4 31811 B16R2.12425 CC1CCN1C(=O)Cc2cccnc2Cl 527a_100000755817_100000093521 [0,1,0,1,0,0|2,0,0]=4 31812 B16R2.12425 CC1CCN1C(=O)Cc2ncccc2Br 11a_100000755817_200012357574 [0,1,0,1,0,0|2,0,0]=4 31813 B16R2.12425 CC1CCN1C(=O)Cc2ncccc2Br 240690a_100000755817_200012357574 [0,1,0,1,0,0|2,0,0]=4 31814 B16R2.12425 CC1CCN1C(=O)Cc2ncccc2Cl 11a_100000755817_100011998755 [0,1,0,1,0,0|2,0,0]=4 31815 B16R2.12425 CC1CCN1C(=O)Cc2ncccc2Cl 240690a_100000755817_100011998755 [0,1,0,1,0,0|2,0,0]=4 31816 B16R2.12425 CC1CCN1C(=O)Cc2ncccc2Cl 527a_100000755817_100011998755 [0,1,0,1,0,0|2,0,0]=4 31817 B16R2.12425 CC1CCN1C(=O)Cn2ccccc2=O 240690a_100000755817_100000189665 [0,1,0,1,0,0|2,0,0]=4 31818 B16R2.12425 CC1CCN1C(=O)Cn2ccccc2=O 527a_100000755817_100000189665 [0,1,0,1,0,0|2,0,0]=4 31819 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2Br 2430a_100000210017_100000755817 [0,1,0,1,0,0|2,0,0]=4 31820 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2Cl 2430a_100000185783_100000755817 [0,1,0,1,0,0|2,0,0]=4 31821 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2F 2430a_100000210422_100000755817 [0,1,0,1,0,0|2,0,0]=4 31822 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2I 2430a_100000210053_100000755817 [0,1,0,1,0,0|2,0,0]=4 31823 B16R2.12425 CC1CCN1C(=O)Nc2ccccc2O 2430a_100000185747_100000755817 [0,1,0,1,0,0|2,0,0]=4 31824 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 11a_100000755817_100000212180 [0,1,0,1,0,0|1,0,0]=3 31825 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 240690a_100000755817_100000212180 [0,1,0,1,0,0|1,0,0]=3 31826 B16R2.12425 Cc1ccccc1CC(=O)N2CCC2C 527a_100000755817_100000212180 [0,1,0,1,0,0|1,0,0]=3 31827 B16R2.12425 Cc1ccccc1NC(=O)N2CCC2C 2430a_100015192222_100000755817 [0,1,0,1,0,0|2,0,0]=4 31828 B16R2.12425 Cc1cccnc1CC(=O)N2CCC2C 11a_100000755817_200000722269 [0,1,0,1,0,0|2,0,0]=4 31829 B16R2.12425 Cc1cccnc1CC(=O)N2CCC2C 240690a_100000755817_200000722269 [0,1,0,1,0,0|2,0,0]=4 31830 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212180 [0,1,0,1,0,0|2,0,0]=4 31831 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212180 [0,1,0,1,0,0|2,0,0]=4 31832 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000212180 [0,1,0,1,0,0|2,0,0]=4 31833 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212180 [0,1,0,1,0,0|2,0,0]=4 31834 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212180 [0,1,0,1,0,0|2,0,0]=4 31835 B16R2.12471 Cc1ccccc1CC(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212180 [0,1,0,1,0,0|2,0,0]=4 31836 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000751119 [0,1,0,1,0,0|2,0,0]=4 31837 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@@H]2F 527a_100015190264_100000751119 [0,1,0,1,0,0|2,0,0]=4 31838 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@H]2F 11a_100025746932_100000751119 [0,1,0,1,0,0|2,0,0]=4 31839 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@H]2F 240690a_100025746932_100000751119 [0,1,0,1,0,0|2,0,0]=4 31840 B16R2.12471 O=C(Cc1ccccc1Br)N[C@@H]2C[C@H]2F 527a_100025746932_100000751119 [0,1,0,1,0,0|2,0,0]=4 31841 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000183793 [0,1,0,1,0,0|2,0,0]=4 31842 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@@H]2F 527a_100015190264_100000183793 [0,1,0,1,0,0|2,0,0]=4 31843 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@H]2F 11a_100025746932_100000183793 [0,1,0,1,0,0|2,0,0]=4 31844 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@H]2F 1626a_100025746932_100000183793 [0,1,0,1,0,0|2,0,0]=4 31845 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@H]2F 240690a_100025746932_100000183793 [0,1,0,1,0,0|2,0,0]=4 31846 B16R2.12471 O=C(Cc1ccccc1Cl)N[C@@H]2C[C@H]2F 527a_100025746932_100000183793 [0,1,0,1,0,0|2,0,0]=4 31847 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212012 [0,1,0,1,0,0|2,0,0]=4 31848 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212012 [0,1,0,1,0,0|2,0,0]=4 31849 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@H]2F 11a_100025746932_100000212012 [0,1,0,1,0,0|2,0,0]=4 31850 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212012 [0,1,0,1,0,0|2,0,0]=4 31851 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212012 [0,1,0,1,0,0|2,0,0]=4 31852 B16R2.12471 O=C(Cc1ccccc1F)N[C@@H]2C[C@H]2F 527a_100025746932_100000212012 [0,1,0,1,0,0|2,0,0]=4 31853 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000036491 [0,1,0,1,0,0|2,0,0]=4 31854 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@@H]2F 527a_100015190264_100000036491 [0,1,0,1,0,0|2,0,0]=4 31855 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@H]2F 11a_100025746932_100000036491 [0,1,0,1,0,0|2,0,0]=4 31856 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@H]2F 1626a_100025746932_100000036491 [0,1,0,1,0,0|2,0,0]=4 31857 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@H]2F 240690a_100025746932_100000036491 [0,1,0,1,0,0|2,0,0]=4 31858 B16R2.12471 O=C(Cc1ccccc1I)N[C@@H]2C[C@H]2F 527a_100025746932_100000036491 [0,1,0,1,0,0|2,0,0]=4 31859 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000743006 [0,1,0,1,0,0|2,0,0]=4 31860 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000743006 [0,1,0,1,0,0|2,0,0]=4 31861 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000743006 [0,1,0,1,0,0|2,0,0]=4 31862 B16R2.12471 O=C(Cc1ccccc1O)N[C@@H]2C[C@H]2F 527a_100025746932_100000743006 [0,1,0,1,0,0|2,0,0]=4 31863 B16R2.24867 Cc1ccccc1CC(=O)C=CC2CC2 1458a_100102529529_100000211839 [0,1,0,1,0,0|1,0,1]=4 31864 B16R2.24867 Cc1ccccc1CC(=O)CCC2CC2 1458a_100000212180_100000694398 [0,1,0,1,0,0|1,0,0]=3 31865 B16R2.24867 Cc1ccccc1CC(=O)CCC2CC2 1458a_100000756386_100000211839 [0,1,0,1,0,0|1,0,0]=3 31866 B16R2.24867 Cc1ccccc1CC(=O)CCC2CO2 1458a_100000212180_100000732470 [0,1,0,1,0,0|2,0,0]=4 31867 B16R2.24867 Cc1ccccc1CC(=O)CSC2CC2 62a_100011223134_100000211595 [0,1,0,1,0,0|2,0,0]=4 31868 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 11a_100000735609_100000212180 [0,1,0,1,0,0|1,0,0]=3 31869 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 1626a_100000735609_100000212180 [0,1,0,1,0,0|1,0,0]=3 31870 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 240690a_100000735609_100000212180 [0,1,0,1,0,0|1,0,0]=3 31871 B16R2.24867 Cc1ccccc1CC(=O)NCC2CC2 527a_100000735609_100000212180 [0,1,0,1,0,0|1,0,0]=3 31872 B16R2.24867 Cc1ccccc1CC(=O)NNC2CC2 22a_100000701032_100000212180 [0,1,0,1,0,0|2,0,0]=4 31873 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 11a_100015192222_100000756386 [0,1,0,1,0,0|2,0,0]=4 31874 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 1626a_100015192222_100000756386 [0,1,0,1,0,0|2,0,0]=4 31875 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 22a_100015192222_100000756386 [0,1,0,1,0,0|2,0,0]=4 31876 B16R2.24867 Cc1ccccc1NC(=O)CCC2CC2 527a_100015192222_100000756386 [0,1,0,1,0,0|2,0,0]=4 31877 B16R2.24867 Cc1ccccc1NC(=O)NCC2CC2 2430a_100015192222_100000735609 [0,1,0,1,0,0|2,0,0]=4 31878 B16R2.24867 Cc1cccnc1CC(=O)CCC2CC2 1458a_100000756386_100000696600 [0,1,0,1,0,0|2,0,0]=4 31879 B16R2.24867 Cc1cccnc1CC(=O)CCC2CC2 1458a_200000722269_100000694398 [0,1,0,1,0,0|2,0,0]=4 31880 B16R2.24867 Cc1cccnc1CC(=O)NCC2CC2 11a_100000735609_200000722269 [0,1,0,1,0,0|2,0,0]=4 31881 B16R2.24867 Cc1cccnc1CC(=O)NCC2CC2 1626a_100000735609_200000722269 [0,1,0,1,0,0|2,0,0]=4 31882 B16R2.24867 Cc1cccnc1CC(=O)NCC2CC2 240690a_100000735609_200000722269 [0,1,0,1,0,0|2,0,0]=4 31883 B16R2.24867 Cc1ccncc1CC(=O)CCC2CC2 1458a_100000756386_100000690890 [0,1,0,1,0,0|2,0,0]=4 31884 B16R2.24867 Cc1cnccc1CC(=O)CCC2CC2 1458a_100000756386_100020672808 [0,1,0,1,0,0|2,0,0]=4 31885 B16R2.24867 Cc1ncccc1CC(=O)CCC2CC2 1458a_100000756386_100000732876 [0,1,0,1,0,0|2,0,0]=4 31886 B16R2.24867 O=C(C=CC1CC1)Cc2ccccc2Br 1458a_100102529529_100000184730 [0,1,0,1,0,0|1,0,1]=4 31887 B16R2.24867 O=C(C=CC1CC1)Cc2ccccc2Cl 1458a_100102529529_100000187162 [0,1,0,1,0,0|1,0,1]=4 31888 B16R2.24867 O=C(C=CC1CC1)Cc2ccccc2F 1458a_100102529529_100000187165 [0,1,0,1,0,0|1,0,1]=4 31889 B16R2.24867 O=C(C=CC1CC1)Cc2ccccc2I 1458a_100102529529_100011216222 [0,1,0,1,0,0|1,0,1]=4 31890 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Br 1458a_100000751119_100000694398 [0,1,0,1,0,0|1,0,0]=3 31891 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Br 1458a_100000756386_100000184730 [0,1,0,1,0,0|1,0,0]=3 31892 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Cl 1458a_100000183793_100000694398 [0,1,0,1,0,0|1,0,0]=3 31893 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2Cl 1458a_100000756386_100000187162 [0,1,0,1,0,0|1,0,0]=3 31894 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2F 1458a_100000212012_100000694398 [0,1,0,1,0,0|1,0,0]=3 31895 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2F 1458a_100000756386_100000187165 [0,1,0,1,0,0|1,0,0]=3 31896 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2I 1458a_100000036491_100000694398 [0,1,0,1,0,0|1,0,0]=3 31897 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2I 1458a_100000756386_100011216222 [0,1,0,1,0,0|1,0,0]=3 31898 B16R2.24867 O=C(CCC1CC1)Cc2ccccc2O 1458a_100000743006_100000694398 [0,1,0,1,0,0|1,0,0]=3 31899 B16R2.24867 O=C(CCC1CC1)Cc2cccnc2Br 1458a_100000756386_100010140945 [0,1,0,1,0,0|2,0,0]=4 31900 B16R2.24867 O=C(CCC1CC1)Cc2cccnc2Cl 1458a_100000093521_100000694398 [0,1,0,1,0,0|2,0,0]=4 31901 B16R2.24867 O=C(CCC1CC1)Cc2cccnc2Cl 1458a_100000756386_100000045678 [0,1,0,1,0,0|2,0,0]=4 31902 B16R2.24867 O=C(CCC1CC1)Cc2cccnc2F 1458a_100000756386_100000099810 [0,1,0,1,0,0|2,0,0]=4 31903 B16R2.24867 O=C(CCC1CC1)Cc2ccncc2Cl 1458a_100000756386_100000763264 [0,1,0,1,0,0|2,0,0]=4 31904 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2Br 1458a_100000756386_100025702911 [0,1,0,1,0,0|2,0,0]=4 31905 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2Br 1458a_200012357574_100000694398 [0,1,0,1,0,0|2,0,0]=4 31906 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2Cl 1458a_100000756386_100000099807 [0,1,0,1,0,0|2,0,0]=4 31907 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2Cl 1458a_100011998755_100000694398 [0,1,0,1,0,0|2,0,0]=4 31908 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2F 1458a_100000756386_100000104219 [0,1,0,1,0,0|2,0,0]=4 31909 B16R2.24867 O=C(CCC1CC1)Cc2ncccc2O 1458a_100000756386_200020655725 [0,1,0,1,0,0|2,0,0]=4 31910 B16R2.24867 O=C(CCC1CC1)Cn2ccccc2=O 1458a_100000189665_100000694398 [0,1,0,1,0,0|2,0,0]=4 31911 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br 11a_100000210017_100000756386 [0,1,0,1,0,0|2,0,0]=4 31912 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Br 1626a_100000210017_100000756386 [0,1,0,1,0,0|2,0,0]=4 31913 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 11a_100000185783_100000756386 [0,1,0,1,0,0|2,0,0]=4 31914 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 1626a_100000185783_100000756386 [0,1,0,1,0,0|2,0,0]=4 31915 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 22a_100000185783_100000756386 [0,1,0,1,0,0|2,0,0]=4 31916 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2Cl 527a_100000185783_100000756386 [0,1,0,1,0,0|2,0,0]=4 31917 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 11a_100000210422_100000756386 [0,1,0,1,0,0|2,0,0]=4 31918 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 1626a_100000210422_100000756386 [0,1,0,1,0,0|2,0,0]=4 31919 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 22a_100000210422_100000756386 [0,1,0,1,0,0|2,0,0]=4 31920 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2F 527a_100000210422_100000756386 [0,1,0,1,0,0|2,0,0]=4 31921 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I 11a_100000210053_100000756386 [0,1,0,1,0,0|2,0,0]=4 31922 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2I 1626a_100000210053_100000756386 [0,1,0,1,0,0|2,0,0]=4 31923 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2O 22a_100000185747_100000756386 [0,1,0,1,0,0|2,0,0]=4 31924 B16R2.24867 O=C(CCC1CC1)Nc2ccccc2O 527a_100000185747_100000756386 [0,1,0,1,0,0|2,0,0]=4 31925 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2Br 1458a_100000751119_100000732470 [0,1,0,1,0,0|2,0,0]=4 31926 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2Cl 1458a_100000183793_100000732470 [0,1,0,1,0,0|2,0,0]=4 31927 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2F 1458a_100000212012_100000732470 [0,1,0,1,0,0|2,0,0]=4 31928 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2I 1458a_100000036491_100000732470 [0,1,0,1,0,0|2,0,0]=4 31929 B16R2.24867 O=C(CCC1CO1)Cc2ccccc2O 1458a_100000743006_100000732470 [0,1,0,1,0,0|2,0,0]=4 31930 B16R2.24867 O=C(CNC1CC1)Cc2ccccc2Br 34a_100000212008_100000700504 [0,1,0,1,0,0|2,0,0]=4 31931 B16R2.24867 O=C(CSC1CC1)Cc2ccccc2Br 62a_100000700504_100000211595 [0,1,0,1,0,0|2,0,0]=4 31932 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 11a_100000735609_100000751119 [0,1,0,1,0,0|1,0,0]=3 31933 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 240690a_100000735609_100000751119 [0,1,0,1,0,0|1,0,0]=3 31934 B16R2.24867 O=C(Cc1ccccc1Br)NCC2CC2 527a_100000735609_100000751119 [0,1,0,1,0,0|1,0,0]=3 31935 B16R2.24867 O=C(Cc1ccccc1Br)NNC2CC2 22a_100000701032_100000751119 [0,1,0,1,0,0|2,0,0]=4 31936 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 11a_100000735609_100000183793 [0,1,0,1,0,0|1,0,0]=3 31937 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 1626a_100000735609_100000183793 [0,1,0,1,0,0|1,0,0]=3 31938 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 240690a_100000735609_100000183793 [0,1,0,1,0,0|1,0,0]=3 31939 B16R2.24867 O=C(Cc1ccccc1Cl)NCC2CC2 527a_100000735609_100000183793 [0,1,0,1,0,0|1,0,0]=3 31940 B16R2.24867 O=C(Cc1ccccc1Cl)NNC2CC2 22a_100000701032_100000183793 [0,1,0,1,0,0|2,0,0]=4 31941 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 11a_100000735609_100000212012 [0,1,0,1,0,0|1,0,0]=3 31942 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 1626a_100000735609_100000212012 [0,1,0,1,0,0|1,0,0]=3 31943 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 240690a_100000735609_100000212012 [0,1,0,1,0,0|1,0,0]=3 31944 B16R2.24867 O=C(Cc1ccccc1F)NCC2CC2 527a_100000735609_100000212012 [0,1,0,1,0,0|1,0,0]=3 31945 B16R2.24867 O=C(Cc1ccccc1F)NNC2CC2 22a_100000701032_100000212012 [0,1,0,1,0,0|2,0,0]=4 31946 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 11a_100000735609_100000036491 [0,1,0,1,0,0|1,0,0]=3 31947 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 1626a_100000735609_100000036491 [0,1,0,1,0,0|1,0,0]=3 31948 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 240690a_100000735609_100000036491 [0,1,0,1,0,0|1,0,0]=3 31949 B16R2.24867 O=C(Cc1ccccc1I)NCC2CC2 527a_100000735609_100000036491 [0,1,0,1,0,0|1,0,0]=3 31950 B16R2.24867 O=C(Cc1ccccc1I)NNC2CC2 22a_100000701032_100000036491 [0,1,0,1,0,0|2,0,0]=4 31951 B16R2.24867 O=C(Cc1ccccc1O)NCC2CC2 240690a_100000735609_100000743006 [0,1,0,1,0,0|1,0,0]=3 31952 B16R2.24867 O=C(Cc1ccccc1O)NCC2CC2 527a_100000735609_100000743006 [0,1,0,1,0,0|1,0,0]=3 31953 B16R2.24867 O=C(Cc1ccccc1O)NNC2CC2 22a_100000701032_100000743006 [0,1,0,1,0,0|2,0,0]=4 31954 B16R2.24867 O=C(Cc1cccnc1Cl)NCC2CC2 11a_100000735609_100000093521 [0,1,0,1,0,0|2,0,0]=4 31955 B16R2.24867 O=C(Cc1cccnc1Cl)NCC2CC2 1626a_100000735609_100000093521 [0,1,0,1,0,0|2,0,0]=4 31956 B16R2.24867 O=C(Cc1cccnc1Cl)NCC2CC2 240690a_100000735609_100000093521 [0,1,0,1,0,0|2,0,0]=4 31957 B16R2.24867 O=C(Cc1cccnc1Cl)NCC2CC2 527a_100000735609_100000093521 [0,1,0,1,0,0|2,0,0]=4 31958 B16R2.24867 O=C(Cc1ncccc1Br)NCC2CC2 11a_100000735609_200012357574 [0,1,0,1,0,0|2,0,0]=4 31959 B16R2.24867 O=C(Cc1ncccc1Br)NCC2CC2 240690a_100000735609_200012357574 [0,1,0,1,0,0|2,0,0]=4 31960 B16R2.24867 O=C(Cc1ncccc1Cl)NCC2CC2 11a_100000735609_100011998755 [0,1,0,1,0,0|2,0,0]=4 31961 B16R2.24867 O=C(Cc1ncccc1Cl)NCC2CC2 240690a_100000735609_100011998755 [0,1,0,1,0,0|2,0,0]=4 31962 B16R2.24867 O=C(Cc1ncccc1Cl)NCC2CC2 527a_100000735609_100011998755 [0,1,0,1,0,0|2,0,0]=4 31963 B16R2.24867 O=C(Cn1ccccc1=O)NCC2CC2 1626a_100000735609_100000189665 [0,1,0,1,0,0|2,0,0]=4 31964 B16R2.24867 O=C(Cn1ccccc1=O)NCC2CC2 240690a_100000735609_100000189665 [0,1,0,1,0,0|2,0,0]=4 31965 B16R2.24867 O=C(Cn1ccccc1=O)NCC2CC2 527a_100000735609_100000189665 [0,1,0,1,0,0|2,0,0]=4 31966 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2Br 2430a_100000210017_100000735609 [0,1,0,1,0,0|2,0,0]=4 31967 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2Cl 2430a_100000185783_100000735609 [0,1,0,1,0,0|2,0,0]=4 31968 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2F 2430a_100000210422_100000735609 [0,1,0,1,0,0|2,0,0]=4 31969 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2I 2430a_100000210053_100000735609 [0,1,0,1,0,0|2,0,0]=4 31970 B16R2.24867 O=C(NCC1CC1)Nc2ccccc2O 2430a_100000185747_100000735609 [0,1,0,1,0,0|2,0,0]=4 31971 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2Br 1458a_200011661523_100000184730 [0,1,0,1,0,0|1,0,0]=3 31972 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2C 1458a_200011661523_100000211839 [0,1,0,1,0,0|1,0,0]=3 31973 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2Cl 1458a_200011661523_100000187162 [0,1,0,1,0,0|1,0,0]=3 31974 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2F 1458a_200011661523_100000187165 [0,1,0,1,0,0|1,0,0]=3 31975 B16R2.35800 CCC1CC1C(=O)Cc2ccccc2I 1458a_200011661523_100011216222 [0,1,0,1,0,0|1,0,0]=3 31976 B16R2.35800 CCC1CC1C(=O)Cc2cccnc2Br 1458a_200011661523_100010140945 [0,1,0,1,0,0|2,0,0]=4 31977 B16R2.35800 CCC1CC1C(=O)Cc2cccnc2C 1458a_200011661523_100000732876 [0,1,0,1,0,0|2,0,0]=4 31978 B16R2.35800 CCC1CC1C(=O)Cc2cccnc2Cl 1458a_200011661523_100000045678 [0,1,0,1,0,0|2,0,0]=4 31979 B16R2.35800 CCC1CC1C(=O)Cc2cccnc2F 1458a_200011661523_100000099810 [0,1,0,1,0,0|2,0,0]=4 31980 B16R2.35800 CCC1CC1C(=O)Cc2ccncc2C 1458a_200011661523_100020672808 [0,1,0,1,0,0|2,0,0]=4 31981 B16R2.35800 CCC1CC1C(=O)Cc2ccncc2Cl 1458a_200011661523_100000763264 [0,1,0,1,0,0|2,0,0]=4 31982 B16R2.35800 CCC1CC1C(=O)Cc2cnccc2C 1458a_200011661523_100000690890 [0,1,0,1,0,0|2,0,0]=4 31983 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2Br 1458a_200011661523_100025702911 [0,1,0,1,0,0|2,0,0]=4 31984 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2C 1458a_200011661523_100000696600 [0,1,0,1,0,0|2,0,0]=4 31985 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2Cl 1458a_200011661523_100000099807 [0,1,0,1,0,0|2,0,0]=4 31986 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2F 1458a_200011661523_100000104219 [0,1,0,1,0,0|2,0,0]=4 31987 B16R2.35800 CCC1CC1C(=O)Cc2ncccc2O 1458a_200011661523_200020655725 [0,1,0,1,0,0|2,0,0]=4 31988 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Br 11a_100000210017_200011661523 [0,1,0,1,0,0|2,0,0]=4 31989 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Br 1626a_100000210017_200011661523 [0,1,0,1,0,0|2,0,0]=4 31990 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 11a_100015192222_200011661523 [0,1,0,1,0,0|2,0,0]=4 31991 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 1626a_100015192222_200011661523 [0,1,0,1,0,0|2,0,0]=4 31992 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 22a_100015192222_200011661523 [0,1,0,1,0,0|2,0,0]=4 31993 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2C 527a_100015192222_200011661523 [0,1,0,1,0,0|2,0,0]=4 31994 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 11a_100000185783_200011661523 [0,1,0,1,0,0|2,0,0]=4 31995 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 1626a_100000185783_200011661523 [0,1,0,1,0,0|2,0,0]=4 31996 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 22a_100000185783_200011661523 [0,1,0,1,0,0|2,0,0]=4 31997 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2Cl 527a_100000185783_200011661523 [0,1,0,1,0,0|2,0,0]=4 31998 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 11a_100000210422_200011661523 [0,1,0,1,0,0|2,0,0]=4 31999 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 1626a_100000210422_200011661523 [0,1,0,1,0,0|2,0,0]=4 32000 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 22a_100000210422_200011661523 [0,1,0,1,0,0|2,0,0]=4 32001 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2F 527a_100000210422_200011661523 [0,1,0,1,0,0|2,0,0]=4 32002 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2I 11a_100000210053_200011661523 [0,1,0,1,0,0|2,0,0]=4 32003 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2I 1626a_100000210053_200011661523 [0,1,0,1,0,0|2,0,0]=4 32004 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2O 22a_100000185747_200011661523 [0,1,0,1,0,0|2,0,0]=4 32005 B16R2.35800 CCC1CC1C(=O)Nc2ccccc2O 527a_100000185747_200011661523 [0,1,0,1,0,0|2,0,0]=4 32006 B16R2.84031 Cc1ccccc1CC(=O)C=C2CCC2 1458a_100000686340_100000211839 [0,1,0,1,0,0|1,0,1]=4 32007 B16R2.84031 Cc1ccccc1CC(=O)CC2CCC2 1458a_100000212180_100000763275 [0,1,0,1,0,0|1,0,0]=3 32008 B16R2.84031 Cc1ccccc1CC(=O)CC2CCC2 1458a_100000763092_100000211839 [0,1,0,1,0,0|1,0,0]=3 32009 B16R2.84031 Cc1ccccc1CC(=O)CC2CCO2 1458a_100000212180_100000103362 [0,1,0,1,0,0|2,0,0]=4 32010 B16R2.84031 Cc1ccccc1CC(=O)CC2COC2 1458a_100000212180_100010264016 [0,1,0,1,0,0|2,0,0]=4 32011 B16R2.84031 Cc1ccccc1CC(=O)CC2COC2 1458a_100000687760_100000211839 [0,1,0,1,0,0|2,0,0]=4 32012 B16R2.84031 Cc1ccccc1CC(=O)CN2CCC2 269982a_100000754969_100011223134 [0,1,0,1,0,0|2,0,0]=4 32013 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 11a_100000749019_100000212180 [0,1,0,1,0,0|1,0,0]=3 32014 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 1626a_100000749019_100000212180 [0,1,0,1,0,0|1,0,0]=3 32015 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 240690a_100000749019_100000212180 [0,1,0,1,0,0|1,0,0]=3 32016 B16R2.84031 Cc1ccccc1CC(=O)NC2CCC2 527a_100000749019_100000212180 [0,1,0,1,0,0|1,0,0]=3 32017 B16R2.84031 Cc1ccccc1CC(=O)NC2COC2 11a_100016991112_100000212180 [0,1,0,1,0,0|2,0,0]=4 32018 B16R2.84031 Cc1ccccc1CC(=O)NC2COC2 1626a_100016991112_100000212180 [0,1,0,1,0,0|2,0,0]=4 32019 B16R2.84031 Cc1ccccc1CC(=O)NC2COC2 240690a_100016991112_100000212180 [0,1,0,1,0,0|2,0,0]=4 32020 B16R2.84031 Cc1ccccc1CC(=O)NC2COC2 527a_100016991112_100000212180 [0,1,0,1,0,0|2,0,0]=4 32021 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 11a_100016994217_100000212180 [0,1,0,1,0,0|2,0,0]=4 32022 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 1626a_100016994217_100000212180 [0,1,0,1,0,0|2,0,0]=4 32023 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 240690a_100016994217_100000212180 [0,1,0,1,0,0|2,0,0]=4 32024 B16R2.84031 Cc1ccccc1CC(=O)NC2CSC2 527a_100016994217_100000212180 [0,1,0,1,0,0|2,0,0]=4 32025 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 11a_100015192222_100000763092 [0,1,0,1,0,0|2,0,0]=4 32026 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 1626a_100015192222_100000763092 [0,1,0,1,0,0|2,0,0]=4 32027 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 22a_100015192222_100000763092 [0,1,0,1,0,0|2,0,0]=4 32028 B16R2.84031 Cc1ccccc1NC(=O)CC2CCC2 527a_100015192222_100000763092 [0,1,0,1,0,0|2,0,0]=4 32029 B16R2.84031 Cc1ccccc1NC(=O)NC2CCC2 2430a_100015192222_100000749019 [0,1,0,1,0,0|2,0,0]=4 32030 B16R2.84031 Cc1cccnc1CC(=O)CC2CCC2 1458a_100000763092_100000696600 [0,1,0,1,0,0|2,0,0]=4 32031 B16R2.84031 Cc1cccnc1CC(=O)CC2CCC2 1458a_200000722269_100000763275 [0,1,0,1,0,0|2,0,0]=4 32032 B16R2.84031 Cc1cccnc1CC(=O)NC2CCC2 11a_100000749019_200000722269 [0,1,0,1,0,0|2,0,0]=4 32033 B16R2.84031 Cc1cccnc1CC(=O)NC2CCC2 1626a_100000749019_200000722269 [0,1,0,1,0,0|2,0,0]=4 32034 B16R2.84031 Cc1cccnc1CC(=O)NC2CCC2 240690a_100000749019_200000722269 [0,1,0,1,0,0|2,0,0]=4 32035 B16R2.84031 Cc1ccncc1CC(=O)CC2CCC2 1458a_100000763092_100000690890 [0,1,0,1,0,0|2,0,0]=4 32036 B16R2.84031 Cc1cnccc1CC(=O)CC2CCC2 1458a_100000763092_100020672808 [0,1,0,1,0,0|2,0,0]=4 32037 B16R2.84031 Cc1ncccc1CC(=O)CC2CCC2 1458a_100000763092_100000732876 [0,1,0,1,0,0|2,0,0]=4 32038 B16R2.84031 O=C(C=C1CCC1)Cc2ccccc2Br 1458a_100000686340_100000184730 [0,1,0,1,0,0|1,0,1]=4 32039 B16R2.84031 O=C(C=C1CCC1)Cc2ccccc2Cl 1458a_100000686340_100000187162 [0,1,0,1,0,0|1,0,1]=4 32040 B16R2.84031 O=C(C=C1CCC1)Cc2ccccc2F 1458a_100000686340_100000187165 [0,1,0,1,0,0|1,0,1]=4 32041 B16R2.84031 O=C(C=C1CCC1)Cc2ccccc2I 1458a_100000686340_100011216222 [0,1,0,1,0,0|1,0,1]=4 32042 B16R2.84031 O=C(CC1CCC1)Cn2ccccc2=O 1458a_100000189665_100000763275 [0,1,0,1,0,0|2,0,0]=4 32043 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br 11a_100000210017_100000763092 [0,1,0,1,0,0|2,0,0]=4 32044 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Br 1626a_100000210017_100000763092 [0,1,0,1,0,0|2,0,0]=4 32045 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 11a_100000185783_100000763092 [0,1,0,1,0,0|2,0,0]=4 32046 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 1626a_100000185783_100000763092 [0,1,0,1,0,0|2,0,0]=4 32047 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 22a_100000185783_100000763092 [0,1,0,1,0,0|2,0,0]=4 32048 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2Cl 527a_100000185783_100000763092 [0,1,0,1,0,0|2,0,0]=4 32049 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 11a_100000210422_100000763092 [0,1,0,1,0,0|2,0,0]=4 32050 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 1626a_100000210422_100000763092 [0,1,0,1,0,0|2,0,0]=4 32051 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 22a_100000210422_100000763092 [0,1,0,1,0,0|2,0,0]=4 32052 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2F 527a_100000210422_100000763092 [0,1,0,1,0,0|2,0,0]=4 32053 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I 11a_100000210053_100000763092 [0,1,0,1,0,0|2,0,0]=4 32054 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2I 1626a_100000210053_100000763092 [0,1,0,1,0,0|2,0,0]=4 32055 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2O 22a_100000185747_100000763092 [0,1,0,1,0,0|2,0,0]=4 32056 B16R2.84031 O=C(CC1CCC1)Nc2ccccc2O 527a_100000185747_100000763092 [0,1,0,1,0,0|2,0,0]=4 32057 B16R2.84031 O=C(Cc1ccccc1Br)CC2CCC2 1458a_100000751119_100000763275 [0,1,0,1,0,0|1,0,0]=3 32058 B16R2.84031 O=C(Cc1ccccc1Br)CC2CCC2 1458a_100000763092_100000184730 [0,1,0,1,0,0|1,0,0]=3 32059 B16R2.84031 O=C(Cc1ccccc1Br)CC2CCO2 1458a_100000751119_100000103362 [0,1,0,1,0,0|2,0,0]=4 32060 B16R2.84031 O=C(Cc1ccccc1Br)CC2COC2 1458a_100000687760_100000184730 [0,1,0,1,0,0|2,0,0]=4 32061 B16R2.84031 O=C(Cc1ccccc1Br)CC2COC2 1458a_100000751119_100010264016 [0,1,0,1,0,0|2,0,0]=4 32062 B16R2.84031 O=C(Cc1ccccc1Br)CN2CCC2 269982a_100000754969_100000700504 [0,1,0,1,0,0|2,0,0]=4 32063 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 11a_100000749019_100000751119 [0,1,0,1,0,0|1,0,0]=3 32064 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 240690a_100000749019_100000751119 [0,1,0,1,0,0|1,0,0]=3 32065 B16R2.84031 O=C(Cc1ccccc1Br)NC2CCC2 527a_100000749019_100000751119 [0,1,0,1,0,0|1,0,0]=3 32066 B16R2.84031 O=C(Cc1ccccc1Br)NC2COC2 11a_100016991112_100000751119 [0,1,0,1,0,0|2,0,0]=4 32067 B16R2.84031 O=C(Cc1ccccc1Br)NC2COC2 240690a_100016991112_100000751119 [0,1,0,1,0,0|2,0,0]=4 32068 B16R2.84031 O=C(Cc1ccccc1Br)NC2COC2 527a_100016991112_100000751119 [0,1,0,1,0,0|2,0,0]=4 32069 B16R2.84031 O=C(Cc1ccccc1Br)NC2CSC2 11a_100016994217_100000751119 [0,1,0,1,0,0|2,0,0]=4 32070 B16R2.84031 O=C(Cc1ccccc1Br)NC2CSC2 240690a_100016994217_100000751119 [0,1,0,1,0,0|2,0,0]=4 32071 B16R2.84031 O=C(Cc1ccccc1Br)NC2CSC2 527a_100016994217_100000751119 [0,1,0,1,0,0|2,0,0]=4 32072 B16R2.84031 O=C(Cc1ccccc1Cl)CC2CCC2 1458a_100000183793_100000763275 [0,1,0,1,0,0|1,0,0]=3 32073 B16R2.84031 O=C(Cc1ccccc1Cl)CC2CCC2 1458a_100000763092_100000187162 [0,1,0,1,0,0|1,0,0]=3 32074 B16R2.84031 O=C(Cc1ccccc1Cl)CC2CCO2 1458a_100000183793_100000103362 [0,1,0,1,0,0|2,0,0]=4 32075 B16R2.84031 O=C(Cc1ccccc1Cl)CC2COC2 1458a_100000183793_100010264016 [0,1,0,1,0,0|2,0,0]=4 32076 B16R2.84031 O=C(Cc1ccccc1Cl)CC2COC2 1458a_100000687760_100000187162 [0,1,0,1,0,0|2,0,0]=4 32077 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 11a_100000749019_100000183793 [0,1,0,1,0,0|1,0,0]=3 32078 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 1626a_100000749019_100000183793 [0,1,0,1,0,0|1,0,0]=3 32079 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 240690a_100000749019_100000183793 [0,1,0,1,0,0|1,0,0]=3 32080 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CCC2 527a_100000749019_100000183793 [0,1,0,1,0,0|1,0,0]=3 32081 B16R2.84031 O=C(Cc1ccccc1Cl)NC2COC2 11a_100016991112_100000183793 [0,1,0,1,0,0|2,0,0]=4 32082 B16R2.84031 O=C(Cc1ccccc1Cl)NC2COC2 1626a_100016991112_100000183793 [0,1,0,1,0,0|2,0,0]=4 32083 B16R2.84031 O=C(Cc1ccccc1Cl)NC2COC2 240690a_100016991112_100000183793 [0,1,0,1,0,0|2,0,0]=4 32084 B16R2.84031 O=C(Cc1ccccc1Cl)NC2COC2 527a_100016991112_100000183793 [0,1,0,1,0,0|2,0,0]=4 32085 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 11a_100016994217_100000183793 [0,1,0,1,0,0|2,0,0]=4 32086 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 1626a_100016994217_100000183793 [0,1,0,1,0,0|2,0,0]=4 32087 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 240690a_100016994217_100000183793 [0,1,0,1,0,0|2,0,0]=4 32088 B16R2.84031 O=C(Cc1ccccc1Cl)NC2CSC2 527a_100016994217_100000183793 [0,1,0,1,0,0|2,0,0]=4 32089 B16R2.84031 O=C(Cc1ccccc1F)CC2CCC2 1458a_100000212012_100000763275 [0,1,0,1,0,0|1,0,0]=3 32090 B16R2.84031 O=C(Cc1ccccc1F)CC2CCC2 1458a_100000763092_100000187165 [0,1,0,1,0,0|1,0,0]=3 32091 B16R2.84031 O=C(Cc1ccccc1F)CC2CCO2 1458a_100000212012_100000103362 [0,1,0,1,0,0|2,0,0]=4 32092 B16R2.84031 O=C(Cc1ccccc1F)CC2COC2 1458a_100000212012_100010264016 [0,1,0,1,0,0|2,0,0]=4 32093 B16R2.84031 O=C(Cc1ccccc1F)CC2COC2 1458a_100000687760_100000187165 [0,1,0,1,0,0|2,0,0]=4 32094 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 11a_100000749019_100000212012 [0,1,0,1,0,0|1,0,0]=3 32095 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 1626a_100000749019_100000212012 [0,1,0,1,0,0|1,0,0]=3 32096 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 240690a_100000749019_100000212012 [0,1,0,1,0,0|1,0,0]=3 32097 B16R2.84031 O=C(Cc1ccccc1F)NC2CCC2 527a_100000749019_100000212012 [0,1,0,1,0,0|1,0,0]=3 32098 B16R2.84031 O=C(Cc1ccccc1F)NC2COC2 11a_100016991112_100000212012 [0,1,0,1,0,0|2,0,0]=4 32099 B16R2.84031 O=C(Cc1ccccc1F)NC2COC2 1626a_100016991112_100000212012 [0,1,0,1,0,0|2,0,0]=4 32100 B16R2.84031 O=C(Cc1ccccc1F)NC2COC2 240690a_100016991112_100000212012 [0,1,0,1,0,0|2,0,0]=4 32101 B16R2.84031 O=C(Cc1ccccc1F)NC2COC2 527a_100016991112_100000212012 [0,1,0,1,0,0|2,0,0]=4 32102 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 11a_100016994217_100000212012 [0,1,0,1,0,0|2,0,0]=4 32103 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 1626a_100016994217_100000212012 [0,1,0,1,0,0|2,0,0]=4 32104 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 240690a_100016994217_100000212012 [0,1,0,1,0,0|2,0,0]=4 32105 B16R2.84031 O=C(Cc1ccccc1F)NC2CSC2 527a_100016994217_100000212012 [0,1,0,1,0,0|2,0,0]=4 32106 B16R2.84031 O=C(Cc1ccccc1I)CC2CCC2 1458a_100000036491_100000763275 [0,1,0,1,0,0|1,0,0]=3 32107 B16R2.84031 O=C(Cc1ccccc1I)CC2CCC2 1458a_100000763092_100011216222 [0,1,0,1,0,0|1,0,0]=3 32108 B16R2.84031 O=C(Cc1ccccc1I)CC2CCO2 1458a_100000036491_100000103362 [0,1,0,1,0,0|2,0,0]=4 32109 B16R2.84031 O=C(Cc1ccccc1I)CC2COC2 1458a_100000036491_100010264016 [0,1,0,1,0,0|2,0,0]=4 32110 B16R2.84031 O=C(Cc1ccccc1I)CC2COC2 1458a_100000687760_100011216222 [0,1,0,1,0,0|2,0,0]=4 32111 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 11a_100000749019_100000036491 [0,1,0,1,0,0|1,0,0]=3 32112 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 1626a_100000749019_100000036491 [0,1,0,1,0,0|1,0,0]=3 32113 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 240690a_100000749019_100000036491 [0,1,0,1,0,0|1,0,0]=3 32114 B16R2.84031 O=C(Cc1ccccc1I)NC2CCC2 527a_100000749019_100000036491 [0,1,0,1,0,0|1,0,0]=3 32115 B16R2.84031 O=C(Cc1ccccc1I)NC2COC2 11a_100016991112_100000036491 [0,1,0,1,0,0|2,0,0]=4 32116 B16R2.84031 O=C(Cc1ccccc1I)NC2COC2 1626a_100016991112_100000036491 [0,1,0,1,0,0|2,0,0]=4 32117 B16R2.84031 O=C(Cc1ccccc1I)NC2COC2 240690a_100016991112_100000036491 [0,1,0,1,0,0|2,0,0]=4 32118 B16R2.84031 O=C(Cc1ccccc1I)NC2COC2 527a_100016991112_100000036491 [0,1,0,1,0,0|2,0,0]=4 32119 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 11a_100016994217_100000036491 [0,1,0,1,0,0|2,0,0]=4 32120 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 1626a_100016994217_100000036491 [0,1,0,1,0,0|2,0,0]=4 32121 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 240690a_100016994217_100000036491 [0,1,0,1,0,0|2,0,0]=4 32122 B16R2.84031 O=C(Cc1ccccc1I)NC2CSC2 527a_100016994217_100000036491 [0,1,0,1,0,0|2,0,0]=4 32123 B16R2.84031 O=C(Cc1ccccc1O)CC2CCC2 1458a_100000743006_100000763275 [0,1,0,1,0,0|1,0,0]=3 32124 B16R2.84031 O=C(Cc1ccccc1O)CC2CCO2 1458a_100000743006_100000103362 [0,1,0,1,0,0|2,0,0]=4 32125 B16R2.84031 O=C(Cc1ccccc1O)CC2COC2 1458a_100000743006_100010264016 [0,1,0,1,0,0|2,0,0]=4 32126 B16R2.84031 O=C(Cc1ccccc1O)NC2CCC2 240690a_100000749019_100000743006 [0,1,0,1,0,0|1,0,0]=3 32127 B16R2.84031 O=C(Cc1ccccc1O)NC2CCC2 527a_100000749019_100000743006 [0,1,0,1,0,0|1,0,0]=3 32128 B16R2.84031 O=C(Cc1ccccc1O)NC2COC2 240690a_100016991112_100000743006 [0,1,0,1,0,0|2,0,0]=4 32129 B16R2.84031 O=C(Cc1ccccc1O)NC2COC2 527a_100016991112_100000743006 [0,1,0,1,0,0|2,0,0]=4 32130 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 240690a_100016994217_100000743006 [0,1,0,1,0,0|2,0,0]=4 32131 B16R2.84031 O=C(Cc1ccccc1O)NC2CSC2 527a_100016994217_100000743006 [0,1,0,1,0,0|2,0,0]=4 32132 B16R2.84031 O=C(Cc1cccnc1Br)CC2CCC2 1458a_100000763092_100010140945 [0,1,0,1,0,0|2,0,0]=4 32133 B16R2.84031 O=C(Cc1cccnc1Cl)CC2CCC2 1458a_100000093521_100000763275 [0,1,0,1,0,0|2,0,0]=4 32134 B16R2.84031 O=C(Cc1cccnc1Cl)CC2CCC2 1458a_100000763092_100000045678 [0,1,0,1,0,0|2,0,0]=4 32135 B16R2.84031 O=C(Cc1cccnc1Cl)NC2CCC2 11a_100000749019_100000093521 [0,1,0,1,0,0|2,0,0]=4 32136 B16R2.84031 O=C(Cc1cccnc1Cl)NC2CCC2 1626a_100000749019_100000093521 [0,1,0,1,0,0|2,0,0]=4 32137 B16R2.84031 O=C(Cc1cccnc1Cl)NC2CCC2 240690a_100000749019_100000093521 [0,1,0,1,0,0|2,0,0]=4 32138 B16R2.84031 O=C(Cc1cccnc1Cl)NC2CCC2 527a_100000749019_100000093521 [0,1,0,1,0,0|2,0,0]=4 32139 B16R2.84031 O=C(Cc1cccnc1F)CC2CCC2 1458a_100000763092_100000099810 [0,1,0,1,0,0|2,0,0]=4 32140 B16R2.84031 O=C(Cc1ccncc1Cl)CC2CCC2 1458a_100000763092_100000763264 [0,1,0,1,0,0|2,0,0]=4 32141 B16R2.84031 O=C(Cc1ncccc1Br)CC2CCC2 1458a_100000763092_100025702911 [0,1,0,1,0,0|2,0,0]=4 32142 B16R2.84031 O=C(Cc1ncccc1Br)CC2CCC2 1458a_200012357574_100000763275 [0,1,0,1,0,0|2,0,0]=4 32143 B16R2.84031 O=C(Cc1ncccc1Br)NC2CCC2 11a_100000749019_200012357574 [0,1,0,1,0,0|2,0,0]=4 32144 B16R2.84031 O=C(Cc1ncccc1Br)NC2CCC2 240690a_100000749019_200012357574 [0,1,0,1,0,0|2,0,0]=4 32145 B16R2.84031 O=C(Cc1ncccc1Cl)CC2CCC2 1458a_100000763092_100000099807 [0,1,0,1,0,0|2,0,0]=4 32146 B16R2.84031 O=C(Cc1ncccc1Cl)CC2CCC2 1458a_100011998755_100000763275 [0,1,0,1,0,0|2,0,0]=4 32147 B16R2.84031 O=C(Cc1ncccc1Cl)NC2CCC2 11a_100000749019_100011998755 [0,1,0,1,0,0|2,0,0]=4 32148 B16R2.84031 O=C(Cc1ncccc1Cl)NC2CCC2 240690a_100000749019_100011998755 [0,1,0,1,0,0|2,0,0]=4 32149 B16R2.84031 O=C(Cc1ncccc1Cl)NC2CCC2 527a_100000749019_100011998755 [0,1,0,1,0,0|2,0,0]=4 32150 B16R2.84031 O=C(Cc1ncccc1F)CC2CCC2 1458a_100000763092_100000104219 [0,1,0,1,0,0|2,0,0]=4 32151 B16R2.84031 O=C(Cc1ncccc1O)CC2CCC2 1458a_100000763092_200020655725 [0,1,0,1,0,0|2,0,0]=4 32152 B16R2.84031 O=C(Cn1ccccc1=O)NC2CCC2 1626a_100000749019_100000189665 [0,1,0,1,0,0|2,0,0]=4 32153 B16R2.84031 O=C(Cn1ccccc1=O)NC2CCC2 240690a_100000749019_100000189665 [0,1,0,1,0,0|2,0,0]=4 32154 B16R2.84031 O=C(Cn1ccccc1=O)NC2CCC2 527a_100000749019_100000189665 [0,1,0,1,0,0|2,0,0]=4 32155 B16R2.84031 O=C(Nc1ccccc1Br)NC2CCC2 2430a_100000210017_100000749019 [0,1,0,1,0,0|2,0,0]=4 32156 B16R2.84031 O=C(Nc1ccccc1Cl)NC2CCC2 2430a_100000185783_100000749019 [0,1,0,1,0,0|2,0,0]=4 32157 B16R2.84031 O=C(Nc1ccccc1F)NC2CCC2 2430a_100000210422_100000749019 [0,1,0,1,0,0|2,0,0]=4 32158 B16R2.84031 O=C(Nc1ccccc1I)NC2CCC2 2430a_100000210053_100000749019 [0,1,0,1,0,0|2,0,0]=4 32159 B16R2.84031 O=C(Nc1ccccc1O)NC2CCC2 2430a_100000185747_100000749019 [0,1,0,1,0,0|2,0,0]=4 32160 B16R2.292 CC1CCN1S(=O)(=O)Cc2ccccc2 270084a_100000755817_100000211737 [0,1,0,1,0,0|2,0,0]=4 32161 B16R2.292 CC1CCN1S(=O)(=O)Cc2ccccc2 274078a_100000755817_100000211737 [0,1,0,1,0,0|2,0,0]=4 32162 B16R2.292 CC1CCN1S(=O)(=O)Cc2ccccc2 40a_100000755817_100000235865 [0,1,0,1,0,0|2,0,0]=4 32163 B16R2.12242 O=S(=O)(Cc1ccccc1)N2CCCC2 270084a_100000188435_100000211737 [0,1,0,1,0,0|2,0,0]=4 32164 B16R2.12242 O=S(=O)(Cc1ccccc1)N2CCCC2 274078a_100000188435_100000211737 [0,1,0,1,0,0|2,0,0]=4 32165 B16R2.12242 O=S(=O)(Cc1ccccc1)N2CCCC2 40a_100000188435_100000235865 [0,1,0,1,0,0|2,0,0]=4 32166 B16R2.82794 CC(C)(Cc1ccccc1)OCC2CC2 7a_100011215222_100000742324 [0,1,0,1,0,0|1,0,1]=4 32167 B16R2.82794 O=S(=O)(Cc1ccccc1)NCC2CC2 270084a_100000735609_100000211737 [0,1,0,1,0,0|2,0,0]=4 32168 B16R2.82794 O=S(=O)(Cc1ccccc1)NCC2CC2 274078a_100000735609_100000211737 [0,1,0,1,0,0|2,0,0]=4 32169 B16R2.82794 O=S(=O)(Cc1ccccc1)NCC2CC2 40a_100000735609_100000235865 [0,1,0,1,0,0|2,0,0]=4 32170 B16R2.322113 O=S(=O)(Cc1ccccc1)NC2CCC2 270084a_100000749019_100000211737 [0,1,0,1,0,0|2,0,0]=4 32171 B16R2.322113 O=S(=O)(Cc1ccccc1)NC2CCC2 274078a_100000749019_100000211737 [0,1,0,1,0,0|2,0,0]=4 32172 B16R2.322113 O=S(=O)(Cc1ccccc1)NC2CCC2 40a_100000749019_100000235865 [0,1,0,1,0,0|2,0,0]=4 32173 B16R3.275948 c1ccc2c(c1)CC(C2)OCC3CC3 34a_100000211283_100000753484 [0,0,0,2,0,0|1,0,1]=4 32174 B16R3.275948 c1ccc2c(c1)CC(C2)OCC3CC3 34a_100011215286_100000742324 [0,0,0,2,0,0|1,0,1]=4 32175 B16R3.63995 c1ccc2c(c1)CC(C2)OC3CCC3 34a_100000748187_100000753484 [0,0,0,2,0,0|1,0,1]=4 32176 B16R3.63995 c1ccc2c(c1)CC(C2)OC3CCC3 34a_100011215286_100000749161 [0,0,0,2,0,0|1,0,1]=4 32177 B12R1.37 CCCCOCCc1cccs1 34a_100000210227_100000748579 [1,0,0,0,1,0|1,0,1]=4 32178 B12R1.37 CCCCOCCc1cccs1 34a_100011216825_100000210210 [1,0,0,0,1,0|1,0,1]=4 32179 B12R1.37 CCCCOCCc1cccs1 7a_100000210227_100000748579 [1,0,0,0,1,0|1,0,1]=4 32180 B12R1.37 CCCCOCCc1cccs1 7a_100011216825_100000210211 [1,0,0,0,1,0|1,0,1]=4 32181 B12R1.37 CCCCOCCc1ccsc1 34a_100000748821_100000210210 [1,0,0,0,1,0|1,0,1]=4 32182 B12R1.37 CCCCOCCn1cccc1 34a_100000179382_100000210210 [1,0,0,0,1,0|1,0,1]=4 32183 B12R1.37 CCCCOCCn1cccc1 7a_100000210227_200000035178 [1,0,0,0,1,0|1,0,1]=4 32184 B12R1.30 C#CCCC(=O)c1ccccc1 1458a_100000185807_100000753159 [1,0,0,0,1,0|0,0,2]=4 32185 B12R1.30 C/C=C/CC(=O)c1ccccc1 1458a_100000185807_100102629194 [1,0,0,0,1,0|0,0,2]=4 32186 B12R1.30 C=CCCC(=O)c1ccccc1 1458a_100000185807_100000754431 [1,0,0,0,1,0|0,0,2]=4 32187 B12R1.30 CC#CCC(=O)c1ccccc1 1458a_100000185807_100000748600 [1,0,0,0,1,0|0,0,2]=4 32188 B12R1.30 CC=CCC(=O)c1ccccc1 1458a_100000185807_100000070051 [1,0,0,0,1,0|0,0,2]=4 32189 B12R1.30 CCCCC(=O)c1ccccc1 1458a_100000185807_100000210211 [1,0,0,0,1,0|0,0,0]=2 32190 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000210012_100000210211 [1,0,0,0,1,0|2,0,0]=4 32191 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000211623_200000210301 [1,0,0,0,1,0|2,0,0]=4 32192 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000210012_100000210211 [1,0,0,0,1,0|2,0,0]=4 32193 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000211623_200000210301 [1,0,0,0,1,0|2,0,0]=4 32194 B12R1.30 CCCCN(C)c1ccccc1 34a_100000210012_100000210210 [1,0,0,0,1,0|2,0,0]=4 32195 B12R1.30 CCCCN(C)c1ccccc1 34a_100000211623_200000210301 [1,0,0,0,1,0|2,0,0]=4 32196 B12R1.30 CCCCN([13CH3])c1ccccc1 2230a_100000211623_200025704644 [1,0,0,0,1,0|2,0,0]=4 32197 B12R1.30 CCCCN([13CH3])c1ccccc1 269982a_100000211623_200025704644 [1,0,0,0,1,0|2,0,0]=4 32198 B12R1.30 CCCCN([13CH3])c1ccccc1 34a_100000211623_200025704644 [1,0,0,0,1,0|2,0,0]=4 32199 B12R1.30 CCCNC(=O)c1ccccc1 11a_100020643023_100000185807 [1,0,0,0,1,0|1,0,0]=3 32200 B12R1.30 CCCNC(=O)c1ccccc1 1626a_100020643023_100000185807 [1,0,0,0,1,0|1,0,0]=3 32201 B12R1.30 CCCNC(=O)c1ccccc1 240690a_100020643023_100000185807 [1,0,0,0,1,0|1,0,0]=3 32202 B12R1.30 CCCNC(=O)c1ccccc1 527a_100020643023_100000185807 [1,0,0,0,1,0|1,0,0]=3 32203 B12R1.30 CCCOC(C)c1ccccc1 34a_100000210258_100000211855 [1,0,0,0,1,0|1,0,1]=4 32204 B12R1.30 CCCO[C@H](C)c1ccccc1 34a_100000761318_100000210303 [1,0,0,0,1,0|1,0,1]=4 32205 B12R1.30 CCCO[C@H](C)c1ccccc1 7a_100000761318_100000210303 [1,0,0,0,1,0|1,0,1]=4 32206 B12R1.30 CCNNC(=O)c1ccccc1 22a_100000756455_100000185807 [1,0,0,0,1,0|2,0,0]=4 32207 B12R1.30 CCOCC(=O)c1ccccn1 34a_100121572206_100000027445 [1,0,0,0,1,0|2,0,0]=4 32208 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000210202_100000211460 [1,0,0,0,1,0|1,0,0]=3 32209 B12R1.30 CCSCC(=O)c1ccccc1 62a_100000211460_100000210202 [1,0,0,0,1,0|1,0,0]=3 32210 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000027445_100000210202 [1,0,0,0,1,0|2,0,0]=4 32211 B12R1.30 CCSCC(=O)c1ccccn1 62a_100000210202_100000027445 [1,0,0,0,1,0|2,0,0]=4 32212 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000210202_100000757877 [1,0,0,0,1,0|2,0,0]=4 32213 B12R1.30 CCSCC(=O)c1cccnc1 62a_100000757877_100000210202 [1,0,0,0,1,0|2,0,0]=4 32214 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000027454_100000210202 [1,0,0,0,1,0|2,0,0]=4 32215 B12R1.30 CCSCC(=O)c1ccncc1 62a_100000210202_100000027454 [1,0,0,0,1,0|2,0,0]=4 32216 B12R1.30 CCSCS(=O)c1ccccc1 62a_100000210202_100000031784 [1,0,0,0,1,0|2,0,0]=4 32217 B12R1.30 CNCCC(=O)c1ccccc1 2230a_106832991635_100000750707 [1,0,0,0,1,0|1,0,0]=3 32218 B12R1.30 CNCCC(=O)c1ccccc1 7a_106832991635_100000750707 [1,0,0,0,1,0|1,0,0]=3 32219 B12R1.30 CNCCS(=O)c1ccccc1 2230a_106832991635_100000740319 [1,0,0,0,1,0|2,0,0]=4 32220 B12R1.30 CNCCS(=O)c1ccccc1 7a_106832991635_100000740319 [1,0,0,0,1,0|2,0,0]=4 32221 B12R1.30 CNCOC(=O)c1ccccc1 7a_106832991635_100000073877 [1,0,0,0,1,0|1,0,0]=3 32222 B12R1.30 COCCC(=O)c1ccccc1 1458a_100000185807_100000233755 [1,0,0,0,1,0|1,0,0]=3 32223 B12R1.30 CSCCC(=O)c1ccccc1 1458a_100000185807_100000751147 [1,0,0,0,1,0|1,0,0]=3 32224 B12R1.30 CSCCC(=O)c1ccccc1 62a_100000750707_200000210301 [1,0,0,0,1,0|1,0,0]=3 32225 B12R1.30 CSCCC(=O)c1ccccc1 62a_200000210301_100000750707 [1,0,0,0,1,0|1,0,0]=3 32226 B12R1.30 CSCCS(=O)c1ccccc1 62a_200000210301_100000740319 [1,0,0,0,1,0|2,0,0]=4 32227 B12R1.30 CSCOC(=O)c1ccccc1 62a_100000073877_200000210301 [1,0,0,0,1,0|1,0,0]=3 32228 B12R1.30 CSCOC(=O)c1ccccc1 62a_200000210301_100000073877 [1,0,0,0,1,0|1,0,0]=3 32229 B12R1.30 N#CCCC(=O)c1ccccc1 1458a_100000185807_100011215226 [1,0,0,0,1,0|1,0,1]=4 32230 B12R1.30 O=C(CCCF)c1ccccc1 1458a_100000185807_100011934791 [1,0,0,0,1,0|1,0,0]=3 32231 B12R1.30 O=C(CCCO)c1ccccc1 1458a_100000185807_100011215043 [1,0,0,0,1,0|1,0,0]=3 32232 B12R1.30 O=C(CSCF)c1ccccc1 62a_100000211460_100015361967 [1,0,0,0,1,0|2,0,0]=4 32233 B12R1.30 O=C(CSCF)c1ccccc1 62a_100015361967_100000211460 [1,0,0,0,1,0|2,0,0]=4 32234 B12R1.30 O=C(NCCF)c1ccccc1 11a_100000724931_100000185807 [1,0,0,0,1,0|2,0,0]=4 32235 B12R1.30 O=C(NCCF)c1ccccc1 1626a_100000724931_100000185807 [1,0,0,0,1,0|2,0,0]=4 32236 B12R1.30 O=C(NCCF)c1ccccc1 240690a_100000724931_100000185807 [1,0,0,0,1,0|2,0,0]=4 32237 B12R1.30 O=C(NCCF)c1ccccc1 527a_100000724931_100000185807 [1,0,0,0,1,0|2,0,0]=4 32238 B12R1.30 O=C(NCCO)c1ccccc1 240690a_100000210304_100000185807 [1,0,0,0,1,0|2,0,0]=4 32239 B12R1.30 O=C(NCCO)c1ccccc1 527a_100000210304_100000185807 [1,0,0,0,1,0|2,0,0]=4 32240 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_100000750707_200025704644 [1,0,0,0,1,0|1,0,0]=3 32241 B12R1.30 [13CH3]SCCC(=O)c1ccccc1 62a_200025704644_100000750707 [1,0,0,0,1,0|1,0,0]=3 32242 B12R1.30 [13CH3]SCCS(=O)c1ccccc1 62a_200025704644_100000740319 [1,0,0,0,1,0|2,0,0]=4 32243 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_100000073877_200025704644 [1,0,0,0,1,0|1,0,0]=3 32244 B12R1.30 [13CH3]SCOC(=O)c1ccccc1 62a_200025704644_100000073877 [1,0,0,0,1,0|1,0,0]=3 32245 B12R1.53 CCCCC(=O)Cc1c[nH]cn1 1458a_100000210183_100000707719 [1,0,0,0,1,0|2,0,0]=4 32246 B12R1.53 CCCCC(=O)Cc1c[nH]cn1 1458a_100015291406_100000210211 [1,0,0,0,1,0|2,0,0]=4 32247 B12R1.53 CCCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000210211 [1,0,0,0,1,0|1,0,0]=3 32248 B12R1.53 CCCCC(=O)Cc1ccco1 1458a_100011217309_100000210211 [1,0,0,0,1,0|1,0,0]=3 32249 B12R1.53 CCCCC(=O)Cc1cccs1 1458a_100000210189_100000210211 [1,0,0,0,1,0|1,0,0]=3 32250 B12R1.53 CCCCC(=O)Cc1ccn[nH]1 1458a_100000210183_100000728653 [1,0,0,0,1,0|2,0,0]=4 32251 B12R1.53 CCCCC(=O)Cc1ccn[nH]1 1458a_100000752941_100000210211 [1,0,0,0,1,0|2,0,0]=4 32252 B12R1.53 CCCCC(=O)Cc1ccoc1 1458a_100000684892_100000210211 [1,0,0,0,1,0|1,0,0]=3 32253 B12R1.53 CCCCC(=O)Cc1ccon1 1458a_100000210183_100000234950 [1,0,0,0,1,0|2,0,0]=4 32254 B12R1.53 CCCCC(=O)Cc1ccsc1 1458a_100000184062_100000210211 [1,0,0,0,1,0|1,0,0]=3 32255 B12R1.53 CCCCC(=O)Cc1ccsc1 1458a_100000210183_100011233845 [1,0,0,0,1,0|1,0,0]=3 32256 B12R1.53 CCCCC(=O)Cc1cncs1 1458a_100000210183_100015185245 [1,0,0,0,1,0|2,0,0]=4 32257 B12R1.53 CCCCC(=O)Cc1cscn1 1458a_100000210183_100000205941 [1,0,0,0,1,0|2,0,0]=4 32258 B12R1.53 CCCCC(=O)Cc1cscn1 1458a_100011438297_100000210211 [1,0,0,0,1,0|2,0,0]=4 32259 B12R1.53 CCCCC(=O)Cc1ncco1 1458a_100000210183_103436540062 [1,0,0,0,1,0|2,0,0]=4 32260 B12R1.53 CCCCC(=O)Cc1nccs1 1458a_100000210183_100015184050 [1,0,0,0,1,0|2,0,0]=4 32261 B12R1.53 CCCCC(=O)Cn1cccc1 1458a_100011196272_100000210211 [1,0,0,0,1,0|1,0,0]=3 32262 B12R1.53 CCCCC(=O)Cn1cccn1 1458a_100000233772_100000210211 [1,0,0,0,1,0|2,0,0]=4 32263 B12R1.53 CCCCC(=O)Cn1ccnc1 1458a_100000739072_100000210211 [1,0,0,0,1,0|2,0,0]=4 32264 B12R1.53 CCCNC(=O)Cc1ccc[nH]1 11a_100020643023_100000238377 [1,0,0,0,1,0|2,0,0]=4 32265 B12R1.53 CCCNC(=O)Cc1ccc[nH]1 240690a_100020643023_100000238377 [1,0,0,0,1,0|2,0,0]=4 32266 B12R1.53 CCCNC(=O)Cc1ccc[nH]1 527a_100020643023_100000238377 [1,0,0,0,1,0|2,0,0]=4 32267 B12R1.53 CCCNC(=O)Cc1ccco1 11a_100020643023_100011217309 [1,0,0,0,1,0|2,0,0]=4 32268 B12R1.53 CCCNC(=O)Cc1ccco1 527a_100020643023_100011217309 [1,0,0,0,1,0|2,0,0]=4 32269 B12R1.53 CCCNC(=O)Cc1cccs1 11a_100020643023_100000210189 [1,0,0,0,1,0|2,0,0]=4 32270 B12R1.53 CCCNC(=O)Cc1cccs1 1626a_100020643023_100000210189 [1,0,0,0,1,0|2,0,0]=4 32271 B12R1.53 CCCNC(=O)Cc1cccs1 240690a_100020643023_100000210189 [1,0,0,0,1,0|2,0,0]=4 32272 B12R1.53 CCCNC(=O)Cc1ccoc1 11a_100020643023_100000684892 [1,0,0,0,1,0|2,0,0]=4 32273 B12R1.53 CCCNC(=O)Cc1ccoc1 1626a_100020643023_100000684892 [1,0,0,0,1,0|2,0,0]=4 32274 B12R1.53 CCCNC(=O)Cc1ccoc1 240690a_100020643023_100000684892 [1,0,0,0,1,0|2,0,0]=4 32275 B12R1.53 CCCNC(=O)Cc1ccoc1 527a_100020643023_100000684892 [1,0,0,0,1,0|2,0,0]=4 32276 B12R1.53 CCCNC(=O)Cc1ccsc1 11a_100020643023_100000184062 [1,0,0,0,1,0|2,0,0]=4 32277 B12R1.53 CCCNC(=O)Cc1ccsc1 1626a_100020643023_100000184062 [1,0,0,0,1,0|2,0,0]=4 32278 B12R1.53 CCCNC(=O)Cc1ccsc1 240690a_100020643023_100000184062 [1,0,0,0,1,0|2,0,0]=4 32279 B12R1.53 CCCNC(=O)Cc1ccsc1 527a_100020643023_100000184062 [1,0,0,0,1,0|2,0,0]=4 32280 B12R1.53 CCCNC(=O)Cn1cccc1 11a_100020643023_100011196272 [1,0,0,0,1,0|2,0,0]=4 32281 B12R1.53 CCCNC(=O)Cn1cccc1 1626a_100020643023_100011196272 [1,0,0,0,1,0|2,0,0]=4 32282 B12R1.53 CCCNC(=O)Cn1cccc1 527a_100020643023_100011196272 [1,0,0,0,1,0|2,0,0]=4 32283 B12R1.53 CCOCC(=O)Cc1ccsc1 1458a_100000211967_100011233845 [1,0,0,0,1,0|2,0,0]=4 32284 B12R1.53 CCSCC(=O)Cc1ccsc1 1458a_100000230394_100011233845 [1,0,0,0,1,0|2,0,0]=4 32285 B12R1.53 COCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000233755 [1,0,0,0,1,0|2,0,0]=4 32286 B12R1.53 COCCC(=O)Cc1ccco1 1458a_100011217309_100000233755 [1,0,0,0,1,0|2,0,0]=4 32287 B12R1.53 COCCC(=O)Cc1cccs1 1458a_100000210189_100000233755 [1,0,0,0,1,0|2,0,0]=4 32288 B12R1.53 COCCC(=O)Cc1ccoc1 1458a_100000684892_100000233755 [1,0,0,0,1,0|2,0,0]=4 32289 B12R1.53 COCCC(=O)Cc1ccsc1 1458a_100000184062_100000233755 [1,0,0,0,1,0|2,0,0]=4 32290 B12R1.53 COCCC(=O)Cc1ccsc1 1458a_100000749529_100011233845 [1,0,0,0,1,0|2,0,0]=4 32291 B12R1.53 COCCC(=O)Cn1cccc1 1458a_100011196272_100000233755 [1,0,0,0,1,0|2,0,0]=4 32292 B12R1.53 CSCCC(=O)Cc1ccc[nH]1 1458a_100000238377_100000751147 [1,0,0,0,1,0|2,0,0]=4 32293 B12R1.53 CSCCC(=O)Cc1ccco1 1458a_100011217309_100000751147 [1,0,0,0,1,0|2,0,0]=4 32294 B12R1.53 CSCCC(=O)Cc1cccs1 1458a_100000210189_100000751147 [1,0,0,0,1,0|2,0,0]=4 32295 B12R1.53 CSCCC(=O)Cc1ccoc1 1458a_100000684892_100000751147 [1,0,0,0,1,0|2,0,0]=4 32296 B12R1.53 CSCCC(=O)Cc1ccsc1 1458a_100000174002_100011233845 [1,0,0,0,1,0|2,0,0]=4 32297 B12R1.53 CSCCC(=O)Cc1ccsc1 1458a_100000184062_100000751147 [1,0,0,0,1,0|2,0,0]=4 32298 B12R1.53 CSCCC(=O)Cn1cccc1 1458a_100011196272_100000751147 [1,0,0,0,1,0|2,0,0]=4 32299 B12R1.53 O=C(CCCF)Cc1ccc[nH]1 1458a_100000238377_100011934791 [1,0,0,0,1,0|2,0,0]=4 32300 B12R1.53 O=C(CCCF)Cc1ccco1 1458a_100011217309_100011934791 [1,0,0,0,1,0|2,0,0]=4 32301 B12R1.53 O=C(CCCF)Cc1cccs1 1458a_100000210189_100011934791 [1,0,0,0,1,0|2,0,0]=4 32302 B12R1.53 O=C(CCCF)Cc1ccoc1 1458a_100000684892_100011934791 [1,0,0,0,1,0|2,0,0]=4 32303 B12R1.53 O=C(CCCF)Cc1ccsc1 1458a_100000184062_100011934791 [1,0,0,0,1,0|2,0,0]=4 32304 B12R1.53 O=C(CCCF)Cn1cccc1 1458a_100011196272_100011934791 [1,0,0,0,1,0|2,0,0]=4 32305 B12R1.53 O=C(CCCO)Cc1ccc[nH]1 1458a_100000238377_100011215043 [1,0,0,0,1,0|2,0,0]=4 32306 B12R1.53 O=C(CCCO)Cc1ccco1 1458a_100011217309_100011215043 [1,0,0,0,1,0|2,0,0]=4 32307 B12R1.53 O=C(CCCO)Cc1cccs1 1458a_100000210189_100011215043 [1,0,0,0,1,0|2,0,0]=4 32308 B12R1.53 O=C(CCCO)Cc1ccoc1 1458a_100000684892_100011215043 [1,0,0,0,1,0|2,0,0]=4 32309 B12R1.53 O=C(CCCO)Cc1ccsc1 1458a_100000184062_100011215043 [1,0,0,0,1,0|2,0,0]=4 32310 B12R1.53 O=C(CCCO)Cn1cccc1 1458a_100011196272_100011215043 [1,0,0,0,1,0|2,0,0]=4 32311 B14R0.239 C=CCC(C=C)OCC(=O)OCCCC 34a_100000038011_100000211628 [0,0,1,0,0,1|0,0,2]=4 32312 B14R0.239 C=CCC(C=C)OCC(=O)OCCCC 7a_100000038011_100000211628 [0,0,1,0,0,1|0,0,2]=4 32313 B16R1.1694 CCCC#CC(=O)C/C=C/c1ccccc1 1458a_200011218047_100016265936 [0,0,0,0,0,2|1,0,1]=4 32314 B16R1.1694 CCCC#CC(=O)CC#Cc1ccccc1 1458a_200011218047_100011352542 [0,0,0,0,0,2|1,0,1]=4 32315 B16R1.1694 CCCC#CC(=O)CCCc1ccccc1 1458a_200011218047_100000211621 [0,0,0,0,0,2|1,0,1]=4 32316 B16R1.1694 CCCC#CC(=O)CCOc1ccccc1 1458a_200011218047_100000184471 [0,0,0,0,0,2|1,0,1]=4 32317 B16R1.1694 CCCC#CC(=O)CCSc1ccccc1 1458a_200011218047_100000246102 [0,0,0,0,0,2|1,0,1]=4 32318 B16R1.1694 CCCC#CC(=O)CSCc1ccccc1 1458a_200011218047_200011217039 [0,0,0,0,0,2|1,0,1]=4 32319 B16R1.1694 CCCC#CC(=O)NCCc1ccccc1 240690a_100000106460_200011218047 [0,0,0,0,0,2|1,0,1]=4 32320 B16R1.1694 CCCC#CC(=O)NNCc1ccccc1 22a_100000007032_200011218047 [0,0,0,0,0,2|1,0,1]=4 32321 B16R1.1694 CCCC=CC(=O)C/C=C/c1ccccc1 1458a_100000212230_100016265936 [0,0,0,0,0,2|1,0,1]=4 32322 B16R1.1694 CCCC=CC(=O)CC#Cc1ccccc1 1458a_100000212230_100011352542 [0,0,0,0,0,2|1,0,1]=4 32323 B16R1.1694 CCCC=CC(=O)CCCc1ccccc1 1458a_100000212230_100000211621 [0,0,0,0,0,2|1,0,1]=4 32324 B16R1.1694 CCCC=CC(=O)CCOc1ccccc1 1458a_100000212230_100000184471 [0,0,0,0,0,2|1,0,1]=4 32325 B16R1.1694 CCCC=CC(=O)CCSc1ccccc1 1458a_100000212230_100000246102 [0,0,0,0,0,2|1,0,1]=4 32326 B16R1.1694 CCCC=CC(=O)CSCc1ccccc1 1458a_100000212230_200011217039 [0,0,0,0,0,2|1,0,1]=4 32327 B16R1.1694 CCCC=CC(=O)NCCc1ccccc1 11a_100000106460_100000212230 [0,0,0,0,0,2|1,0,1]=4 32328 B16R1.1694 CCCC=CC(=O)NCCc1ccccc1 1626a_100000106460_100000212230 [0,0,0,0,0,2|1,0,1]=4 32329 B16R1.1694 CCCC=CC(=O)NCCc1ccccc1 240690a_100000106460_100000212230 [0,0,0,0,0,2|1,0,1]=4 32330 B16R1.1694 CCCC=CC(=O)NNCc1ccccc1 22a_100000007032_100000212230 [0,0,0,0,0,2|1,0,1]=4 32331 B16R1.1694 CCCCCC(=NNCc1ccccc1)C 4a_100000007032_100000211708 [0,0,0,0,0,2|2,0,0]=4 32332 B16R1.1694 CCCCCC(=O)C/C=C/c1ccccc1 1458a_100000212188_100016265936 [0,0,0,0,0,2|1,0,0]=3 32333 B16R1.1694 CCCCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000210326 [0,0,0,0,0,2|1,0,0]=3 32334 B16R1.1694 CCCCCC(=O)C=CSc1ccccc1 1458a_100016262050_100000210326 [0,0,0,0,0,2|1,0,1]=4 32335 B16R1.1694 CCCCCC(=O)CC#Cc1ccccc1 1458a_100000212188_100011352542 [0,0,0,0,0,2|1,0,0]=3 32336 B16R1.1694 CCCCCC(=O)CCCc1ccccc1 1458a_100000212188_100000211621 [0,0,0,0,0,2|1,0,0]=3 32337 B16R1.1694 CCCCCC(=O)CCCc1ccccc1 1458a_100011207963_100000210326 [0,0,0,0,0,2|1,0,0]=3 32338 B16R1.1694 CCCCCC(=O)CCCc1ccccn1 1458a_100000752327_100000210326 [0,0,0,0,0,2|2,0,0]=4 32339 B16R1.1694 CCCCCC(=O)CCCc1ccncc1 1458a_100020654287_100000210326 [0,0,0,0,0,2|2,0,0]=4 32340 B16R1.1694 CCCCCC(=O)CCOc1ccccc1 1458a_100000182761_100000210326 [0,0,0,0,0,2|1,0,0]=3 32341 B16R1.1694 CCCCCC(=O)CCOc1ccccc1 1458a_100000212188_100000184471 [0,0,0,0,0,2|1,0,0]=3 32342 B16R1.1694 CCCCCC(=O)CCSc1ccccc1 1458a_100000182436_100000210326 [0,0,0,0,0,2|1,0,0]=3 32343 B16R1.1694 CCCCCC(=O)CCSc1ccccc1 1458a_100000212188_100000246102 [0,0,0,0,0,2|1,0,0]=3 32344 B16R1.1694 CCCCCC(=O)CNCc1ccccc1 2230a_100015324214_200012276598 [0,0,0,0,0,2|1,0,0]=3 32345 B16R1.1694 CCCCCC(=O)CNCc1ccccc1 34a_100015324214_200012276598 [0,0,0,0,0,2|1,0,0]=3 32346 B16R1.1694 CCCCCC(=O)COCc1ccccc1 1458a_100000230186_100000210326 [0,0,0,0,0,2|1,0,0]=3 32347 B16R1.1694 CCCCCC(=O)COCc1ccccc1 34a_100000210790_200012276598 [0,0,0,0,0,2|1,0,0]=3 32348 B16R1.1694 CCCCCC(=O)COCc1ccccc1 7a_100000210790_200012276598 [0,0,0,0,0,2|1,0,0]=3 32349 B16R1.1694 CCCCCC(=O)CSCc1ccccc1 1458a_100000150264_100000210326 [0,0,0,0,0,2|1,0,0]=3 32350 B16R1.1694 CCCCCC(=O)CSCc1ccccc1 1458a_100000212188_200011217039 [0,0,0,0,0,2|1,0,0]=3 32351 B16R1.1694 CCCCCC(=O)CSCc1ccccc1 62a_100000211182_200012276598 [0,0,0,0,0,2|1,0,0]=3 32352 B16R1.1694 CCCCCC(=O)CSCc1ccccc1 62a_200012276598_100015291786 [0,0,0,0,0,2|1,0,0]=3 32353 B16R1.1694 CCCCCC(=O)CSCc1ccccn1 1458a_100000742634_100000210326 [0,0,0,0,0,2|2,0,0]=4 32354 B16R1.1694 CCCCCC(=O)CSCc1ccccn1 62a_100000721315_200012276598 [0,0,0,0,0,2|2,0,0]=4 32355 B16R1.1694 CCCCCC(=O)CSCc1ccccn1 62a_200012276598_100000721315 [0,0,0,0,0,2|2,0,0]=4 32356 B16R1.1694 CCCCCC(=O)CSCc1cccnc1 62a_100000741622_200012276598 [0,0,0,0,0,2|2,0,0]=4 32357 B16R1.1694 CCCCCC(=O)CSCc1cccnc1 62a_200012276598_100000741622 [0,0,0,0,0,2|2,0,0]=4 32358 B16R1.1694 CCCCCC(=O)CSCc1ccncc1 62a_100015193705_200012276598 [0,0,0,0,0,2|2,0,0]=4 32359 B16R1.1694 CCCCCC(=O)CSCc1ccncc1 62a_200012276598_100015193705 [0,0,0,0,0,2|2,0,0]=4 32360 B16R1.1694 CCCCCC(=O)NCCc1ccccc1 11a_100000106460_100000212188 [0,0,0,0,0,2|1,0,0]=3 32361 B16R1.1694 CCCCCC(=O)NCCc1ccccc1 1626a_100000106460_100000212188 [0,0,0,0,0,2|1,0,0]=3 32362 B16R1.1694 CCCCCC(=O)NCCc1ccccc1 240690a_100000106460_100000212188 [0,0,0,0,0,2|1,0,0]=3 32363 B16R1.1694 CCCCCC(=O)NCCc1ccccc1 527a_100000106460_100000212188 [0,0,0,0,0,2|1,0,0]=3 32364 B16R1.1694 CCCCCC(=O)NCCc1ccccn1 11a_100000211156_100000212188 [0,0,0,0,0,2|2,0,0]=4 32365 B16R1.1694 CCCCCC(=O)NCCc1ccccn1 1626a_100000211156_100000212188 [0,0,0,0,0,2|2,0,0]=4 32366 B16R1.1694 CCCCCC(=O)NCCc1ccccn1 240690a_100000211156_100000212188 [0,0,0,0,0,2|2,0,0]=4 32367 B16R1.1694 CCCCCC(=O)NCCc1ccccn1 527a_100000211156_100000212188 [0,0,0,0,0,2|2,0,0]=4 32368 B16R1.1694 CCCCCC(=O)NCCc1cccnc1 11a_100000736294_100000212188 [0,0,0,0,0,2|2,0,0]=4 32369 B16R1.1694 CCCCCC(=O)NCCc1cccnc1 1626a_100000736294_100000212188 [0,0,0,0,0,2|2,0,0]=4 32370 B16R1.1694 CCCCCC(=O)NCCc1cccnc1 240690a_100000736294_100000212188 [0,0,0,0,0,2|2,0,0]=4 32371 B16R1.1694 CCCCCC(=O)NCCc1cccnc1 527a_100000736294_100000212188 [0,0,0,0,0,2|2,0,0]=4 32372 B16R1.1694 CCCCCC(=O)NCCc1ccncc1 11a_100000742849_100000212188 [0,0,0,0,0,2|2,0,0]=4 32373 B16R1.1694 CCCCCC(=O)NCCc1ccncc1 1626a_100000742849_100000212188 [0,0,0,0,0,2|2,0,0]=4 32374 B16R1.1694 CCCCCC(=O)NCCc1ccncc1 240690a_100000742849_100000212188 [0,0,0,0,0,2|2,0,0]=4 32375 B16R1.1694 CCCCCC(=O)NCCc1ccncc1 527a_100000742849_100000212188 [0,0,0,0,0,2|2,0,0]=4 32376 B16R1.1694 CCCCCC(=O)NN=Cc1ccccc1 4a_100000189784_100015611070 [0,0,0,0,0,2|1,0,1]=4 32377 B16R1.1694 CCCCCC(=O)NNCc1ccccc1 22a_100000007032_100000212188 [0,0,0,0,0,2|1,0,0]=3 32378 B16R1.1694 CCCCCC(=O)NNCc1ccccn1 22a_100000736832_100000212188 [0,0,0,0,0,2|2,0,0]=4 32379 B16R1.1694 CCCCCC(=O)NNCc1cccnc1 22a_100000738295_100000212188 [0,0,0,0,0,2|2,0,0]=4 32380 B16R1.1694 CCCCCC(=O)NNCc1ccncc1 22a_100000736929_100000212188 [0,0,0,0,0,2|2,0,0]=4 32381 B16R1.1694 CCCCNC(=O)C/C=C/c1ccccc1 11a_100000102301_100011219626 [0,0,0,0,0,2|1,0,0]=3 32382 B16R1.1694 CCCCNC(=O)C/C=C/c1ccccc1 1626a_100000102301_100011219626 [0,0,0,0,0,2|1,0,0]=3 32383 B16R1.1694 CCCCNC(=O)C/C=C/c1ccccc1 240690a_100000102301_100011219626 [0,0,0,0,0,2|1,0,0]=3 32384 B16R1.1694 CCCCNC(=O)C=CSc1ccccc1 11a_100000102301_100016262050 [0,0,0,0,0,2|1,0,1]=4 32385 B16R1.1694 CCCCNC(=O)C=CSc1ccccc1 1626a_100000102301_100016262050 [0,0,0,0,0,2|1,0,1]=4 32386 B16R1.1694 CCCCNC(=O)C=CSc1ccccc1 240690a_100000102301_100016262050 [0,0,0,0,0,2|1,0,1]=4 32387 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 11a_100000102301_100011207963 [0,0,0,0,0,2|1,0,0]=3 32388 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 1626a_100000102301_100011207963 [0,0,0,0,0,2|1,0,0]=3 32389 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 240690a_100000102301_100011207963 [0,0,0,0,0,2|1,0,0]=3 32390 B16R1.1694 CCCCNC(=O)CCCc1ccccc1 527a_100000102301_100011207963 [0,0,0,0,0,2|1,0,0]=3 32391 B16R1.1694 CCCCNC(=O)CCCc1ccccn1 11a_100000102301_100000752327 [0,0,0,0,0,2|2,0,0]=4 32392 B16R1.1694 CCCCNC(=O)CCCc1ccccn1 1626a_100000102301_100000752327 [0,0,0,0,0,2|2,0,0]=4 32393 B16R1.1694 CCCCNC(=O)CCCc1ccccn1 240690a_100000102301_100000752327 [0,0,0,0,0,2|2,0,0]=4 32394 B16R1.1694 CCCCNC(=O)CCCc1ccccn1 527a_100000102301_100000752327 [0,0,0,0,0,2|2,0,0]=4 32395 B16R1.1694 CCCCNC(=O)CCCc1ccncc1 11a_100000102301_100020654287 [0,0,0,0,0,2|2,0,0]=4 32396 B16R1.1694 CCCCNC(=O)CCCc1ccncc1 1626a_100000102301_100020654287 [0,0,0,0,0,2|2,0,0]=4 32397 B16R1.1694 CCCCNC(=O)CCCc1ccncc1 240690a_100000102301_100020654287 [0,0,0,0,0,2|2,0,0]=4 32398 B16R1.1694 CCCCNC(=O)CCCc1ccncc1 527a_100000102301_100020654287 [0,0,0,0,0,2|2,0,0]=4 32399 B16R1.1694 CCCCNC(=O)CCOc1ccccc1 11a_100000102301_100000182761 [0,0,0,0,0,2|1,0,0]=3 32400 B16R1.1694 CCCCNC(=O)CCOc1ccccc1 1626a_100000102301_100000182761 [0,0,0,0,0,2|1,0,0]=3 32401 B16R1.1694 CCCCNC(=O)CCOc1ccccc1 240690a_100000102301_100000182761 [0,0,0,0,0,2|1,0,0]=3 32402 B16R1.1694 CCCCNC(=O)CCSc1ccccc1 11a_100000102301_100000182436 [0,0,0,0,0,2|1,0,0]=3 32403 B16R1.1694 CCCCNC(=O)CCSc1ccccc1 1626a_100000102301_100000182436 [0,0,0,0,0,2|1,0,0]=3 32404 B16R1.1694 CCCCNC(=O)CCSc1ccccc1 240690a_100000102301_100000182436 [0,0,0,0,0,2|1,0,0]=3 32405 B16R1.1694 CCCCNC(=O)CNCc1ccccc1 2230a_100015324214_100000182744 [0,0,0,0,0,2|1,0,0]=3 32406 B16R1.1694 CCCCNC(=O)CNCc1ccccc1 34a_100015324214_100000182744 [0,0,0,0,0,2|1,0,0]=3 32407 B16R1.1694 CCCCNC(=O)COCc1ccccc1 11a_100000102301_100000230186 [0,0,0,0,0,2|1,0,0]=3 32408 B16R1.1694 CCCCNC(=O)COCc1ccccc1 1626a_100000102301_100000230186 [0,0,0,0,0,2|1,0,0]=3 32409 B16R1.1694 CCCCNC(=O)COCc1ccccc1 240690a_100000102301_100000230186 [0,0,0,0,0,2|1,0,0]=3 32410 B16R1.1694 CCCCNC(=O)COCc1ccccc1 34a_100000210790_100000182744 [0,0,0,0,0,2|1,0,0]=3 32411 B16R1.1694 CCCCNC(=O)COCc1ccccc1 527a_100000102301_100000230186 [0,0,0,0,0,2|1,0,0]=3 32412 B16R1.1694 CCCCNC(=O)COCc1ccccc1 7a_100000210790_100000182744 [0,0,0,0,0,2|1,0,0]=3 32413 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 11a_100000102301_100000150264 [0,0,0,0,0,2|1,0,0]=3 32414 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 1626a_100000102301_100000150264 [0,0,0,0,0,2|1,0,0]=3 32415 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 240690a_100000102301_100000150264 [0,0,0,0,0,2|1,0,0]=3 32416 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 527a_100000102301_100000150264 [0,0,0,0,0,2|1,0,0]=3 32417 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 62a_100000182744_100015291786 [0,0,0,0,0,2|1,0,0]=3 32418 B16R1.1694 CCCCNC(=O)CSCc1ccccc1 62a_100000211182_100000182744 [0,0,0,0,0,2|1,0,0]=3 32419 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 11a_100000102301_100000742634 [0,0,0,0,0,2|2,0,0]=4 32420 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 1626a_100000102301_100000742634 [0,0,0,0,0,2|2,0,0]=4 32421 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 240690a_100000102301_100000742634 [0,0,0,0,0,2|2,0,0]=4 32422 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 527a_100000102301_100000742634 [0,0,0,0,0,2|2,0,0]=4 32423 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 62a_100000182744_100000721315 [0,0,0,0,0,2|2,0,0]=4 32424 B16R1.1694 CCCCNC(=O)CSCc1ccccn1 62a_100000721315_100000182744 [0,0,0,0,0,2|2,0,0]=4 32425 B16R1.1694 CCCCNC(=O)CSCc1cccnc1 62a_100000182744_100000741622 [0,0,0,0,0,2|2,0,0]=4 32426 B16R1.1694 CCCCNC(=O)CSCc1cccnc1 62a_100000741622_100000182744 [0,0,0,0,0,2|2,0,0]=4 32427 B16R1.1694 CCCCNC(=O)CSCc1ccncc1 1626a_100000102301_100000742635 [0,0,0,0,0,2|2,0,0]=4 32428 B16R1.1694 CCCCNC(=O)CSCc1ccncc1 240690a_100000102301_100000742635 [0,0,0,0,0,2|2,0,0]=4 32429 B16R1.1694 CCCCNC(=O)CSCc1ccncc1 527a_100000102301_100000742635 [0,0,0,0,0,2|2,0,0]=4 32430 B16R1.1694 CCCCNC(=O)CSCc1ccncc1 62a_100000182744_100015193705 [0,0,0,0,0,2|2,0,0]=4 32431 B16R1.1694 CCCCNC(=O)CSCc1ccncc1 62a_100015193705_100000182744 [0,0,0,0,0,2|2,0,0]=4 32432 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 2708a_100000102301_100000106460 [0,0,0,0,0,2|1,0,0]=3 32433 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 2708a_100000106460_100000102301 [0,0,0,0,0,2|1,0,0]=3 32434 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 273464a_100000102301_100000106460 [0,0,0,0,0,2|1,0,0]=3 32435 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 273464a_100000106460_100000102301 [0,0,0,0,0,2|1,0,0]=3 32436 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 512a_100000102301_100000106460 [0,0,0,0,0,2|1,0,0]=3 32437 B16R1.1694 CCCCNC(=O)NCCc1ccccc1 512a_100000106460_100000102301 [0,0,0,0,0,2|1,0,0]=3 32438 B16R1.1694 CCCCNC(=O)NCCc1ccccn1 2708a_100000102301_100000211156 [0,0,0,0,0,2|2,0,0]=4 32439 B16R1.1694 CCCCNC(=O)NCCc1ccccn1 2708a_100000211156_100000102301 [0,0,0,0,0,2|2,0,0]=4 32440 B16R1.1694 CCCCNC(=O)NCCc1ccccn1 273464a_100000102301_100000211156 [0,0,0,0,0,2|2,0,0]=4 32441 B16R1.1694 CCCCNC(=O)NCCc1ccccn1 273464a_100000211156_100000102301 [0,0,0,0,0,2|2,0,0]=4 32442 B16R1.1694 CCCCNC(=O)NCCc1ccccn1 512a_100000102301_100000211156 [0,0,0,0,0,2|2,0,0]=4 32443 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 2708a_100000102301_100000736294 [0,0,0,0,0,2|2,0,0]=4 32444 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 2708a_100000736294_100000102301 [0,0,0,0,0,2|2,0,0]=4 32445 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 273464a_100000102301_100000736294 [0,0,0,0,0,2|2,0,0]=4 32446 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 273464a_100000736294_100000102301 [0,0,0,0,0,2|2,0,0]=4 32447 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 512a_100000102301_100000736294 [0,0,0,0,0,2|2,0,0]=4 32448 B16R1.1694 CCCCNC(=O)NCCc1cccnc1 512a_100000736294_100000102301 [0,0,0,0,0,2|2,0,0]=4 32449 B16R1.1694 CCCCNC(=O)NCCc1ccncc1 2708a_100000102301_100000742849 [0,0,0,0,0,2|2,0,0]=4 32450 B16R1.1694 CCCCNC(=O)NCCc1ccncc1 2708a_100000742849_100000102301 [0,0,0,0,0,2|2,0,0]=4 32451 B16R1.1694 CCCCNC(=O)NCCc1ccncc1 273464a_100000102301_100000742849 [0,0,0,0,0,2|2,0,0]=4 32452 B16R1.1694 CCCCNC(=O)NCCc1ccncc1 273464a_100000742849_100000102301 [0,0,0,0,0,2|2,0,0]=4 32453 B16R1.1694 CCCCNC(=O)NCCc1ccncc1 512a_100000102301_100000742849 [0,0,0,0,0,2|2,0,0]=4 32454 B16R1.1694 CCCCNC(=O)NNCc1ccccc1 273464a_100000102301_100000007032 [0,0,0,0,0,2|1,0,0]=3 32455 B16R1.1694 CCCCNC(=O)NNCc1ccccc1 512a_100000102301_100000007032 [0,0,0,0,0,2|1,0,0]=3 32456 B16R1.1694 CCCCNC(=O)NNCc1ccccn1 273464a_100000102301_100000736832 [0,0,0,0,0,2|2,0,0]=4 32457 B16R1.1694 CCCCNC(=O)NNCc1ccccn1 512a_100000102301_100000736832 [0,0,0,0,0,2|2,0,0]=4 32458 B16R1.1694 CCCCNC(=O)NNCc1cccnc1 273464a_100000102301_100000738295 [0,0,0,0,0,2|2,0,0]=4 32459 B16R1.1694 CCCCNC(=O)NNCc1cccnc1 512a_100000102301_100000738295 [0,0,0,0,0,2|2,0,0]=4 32460 B16R1.1694 CCCCNC(=O)NNCc1cccnc1 512a_100000738295_100000102301 [0,0,0,0,0,2|2,0,0]=4 32461 B16R1.1694 CCCCNC(=O)NNCc1ccncc1 273464a_100000102301_100000736929 [0,0,0,0,0,2|2,0,0]=4 32462 B16R1.1694 CCCCNC(=O)NNCc1ccncc1 512a_100000102301_100000736929 [0,0,0,0,0,2|2,0,0]=4 32463 B16R1.1694 CCCCOC(=O)CNCc1ccccc1 2230a_100015324214_100000211628 [0,0,0,0,0,2|0,0,0]=2 32464 B16R1.1694 CCCCOC(=O)CNCc1ccccc1 34a_100015324214_100000211628 [0,0,0,0,0,2|0,0,0]=2 32465 B16R1.1694 CCCCOC(=O)CNCc1cccnn1 2230a_100159270163_100000211628 [0,0,0,0,0,2|2,0,0]=4 32466 B16R1.1694 CCCCOC(=O)CNCc1cncnc1 2230a_100011243677_100000211628 [0,0,0,0,0,2|2,0,0]=4 32467 B16R1.1694 CCCCOC(=O)COCc1ccccc1 34a_100000210790_100000211628 [0,0,0,0,0,2|0,0,0]=2 32468 B16R1.1694 CCCCOC(=O)COCc1ccccc1 7a_100000210790_100000211628 [0,0,0,0,0,2|0,0,0]=2 32469 B16R1.1694 CCCCOC(=O)CSCc1ccccc1 62a_100000211182_100000211628 [0,0,0,0,0,2|0,0,0]=2 32470 B16R1.1694 CCCCOC(=O)CSCc1ccccc1 62a_100000211628_100015291786 [0,0,0,0,0,2|0,0,0]=2 32471 B16R1.1694 CCCCOC(=O)CSCc1ccccn1 62a_100000211628_100000721315 [0,0,0,0,0,2|1,0,0]=3 32472 B16R1.1694 CCCCOC(=O)CSCc1ccccn1 62a_100000721315_100000211628 [0,0,0,0,0,2|1,0,0]=3 32473 B16R1.1694 CCCCOC(=O)CSCc1cccnc1 62a_100000211628_100000741622 [0,0,0,0,0,2|1,0,0]=3 32474 B16R1.1694 CCCCOC(=O)CSCc1cccnc1 62a_100000741622_100000211628 [0,0,0,0,0,2|1,0,0]=3 32475 B16R1.1694 CCCCOC(=O)CSCc1cccnn1 62a_100000211628_100016990269 [0,0,0,0,0,2|2,0,0]=4 32476 B16R1.1694 CCCCOC(=O)CSCc1cccnn1 62a_100016990269_100000211628 [0,0,0,0,0,2|2,0,0]=4 32477 B16R1.1694 CCCCOC(=O)CSCc1ccncc1 62a_100000211628_100015193705 [0,0,0,0,0,2|1,0,0]=3 32478 B16R1.1694 CCCCOC(=O)CSCc1ccncc1 62a_100015193705_100000211628 [0,0,0,0,0,2|1,0,0]=3 32479 B16R1.1694 CCCCOC(=O)CSCc1cnccn1 62a_100000211628_100016995436 [0,0,0,0,0,2|2,0,0]=4 32480 B16R1.1694 CCCCOC(=O)CSCc1cnccn1 62a_100016995436_100000211628 [0,0,0,0,0,2|2,0,0]=4 32481 B16R1.1694 CCCCOC(=O)CSCc1cncnc1 62a_100000211628_100015196519 [0,0,0,0,0,2|2,0,0]=4 32482 B16R1.1694 CCCCOC(=O)CSCc1cncnc1 62a_100015196519_100000211628 [0,0,0,0,0,2|2,0,0]=4 32483 B16R1.1694 CCCCOC(=O)CSCc1ncccn1 62a_100000211628_100000703007 [0,0,0,0,0,2|2,0,0]=4 32484 B16R1.1694 CCCCOC(=O)CSCc1ncccn1 62a_100000703007_100000211628 [0,0,0,0,0,2|2,0,0]=4 32485 B16R1.1694 CCCCOC(C)CCCc1ccccc1 34a_100000210227_200010759516 [0,0,0,0,0,2|1,0,1]=4 32486 B16R1.1694 CCCCOC(C)CCCc1ccccc1 7a_100000210227_200010759516 [0,0,0,0,0,2|1,0,1]=4 32487 B16R1.1694 CCCCOC(C)COCc1ccccc1 34a_100000764311_100000210210 [0,0,0,0,0,2|1,0,1]=4 32488 B16R1.1694 CCCCOC(C)COCc1ccccc1 7a_100000764311_100000210211 [0,0,0,0,0,2|1,0,1]=4 32489 B16R1.1694 CCCNCC(=O)NCCc1ccccc1 2230a_100000747479_100000210303 [0,0,0,0,0,2|2,0,0]=4 32490 B16R1.1694 CCCNCC(=O)NCCc1ccccc1 34a_100000747479_100000210303 [0,0,0,0,0,2|2,0,0]=4 32491 B16R1.1694 CCCNNC(=O)C/C=C/c1ccccc1 22a_100000740057_100011219626 [0,0,0,0,0,2|2,0,0]=4 32492 B16R1.1694 CCCNNC(=O)CCCc1ccccc1 22a_100000740057_100011207963 [0,0,0,0,0,2|2,0,0]=4 32493 B16R1.1694 CCCNNC(=O)CCOc1ccccc1 22a_100000740057_100000182761 [0,0,0,0,0,2|2,0,0]=4 32494 B16R1.1694 CCCNNC(=O)CCSc1ccccc1 22a_100000740057_100000182436 [0,0,0,0,0,2|2,0,0]=4 32495 B16R1.1694 CCCNNC(=O)COCc1ccccc1 22a_100000740057_100000230186 [0,0,0,0,0,2|2,0,0]=4 32496 B16R1.1694 CCCNNC(=O)CSCc1ccccc1 22a_100000740057_100000150264 [0,0,0,0,0,2|2,0,0]=4 32497 B16R1.1694 CCCNNC(=O)NCCc1ccccc1 273464a_100000106460_100000740057 [0,0,0,0,0,2|2,0,0]=4 32498 B16R1.1694 CCCNNC(=O)NCCc1ccccc1 512a_100000106460_100000740057 [0,0,0,0,0,2|2,0,0]=4 32499 B16R1.1694 CCCNNC(=O)NCCc1ccccc1 512a_100000740057_100000106460 [0,0,0,0,0,2|2,0,0]=4 32500 B16R1.1694 CCCNNC(=O)NNCc1ccccc1 512a_100000740057_100000007032 [0,0,0,0,0,2|2,0,0]=4 32501 B16R1.1694 CCCOCC(=O)C/C=C/c1ccccc1 1458a_100000745993_100016265936 [0,0,0,0,0,2|2,0,0]=4 32502 B16R1.1694 CCCOCC(=O)CC#Cc1ccccc1 1458a_100000745993_100011352542 [0,0,0,0,0,2|2,0,0]=4 32503 B16R1.1694 CCCOCC(=O)CCCc1ccccc1 1458a_100000745993_100000211621 [0,0,0,0,0,2|2,0,0]=4 32504 B16R1.1694 CCCOCC(=O)CCOc1ccccc1 1458a_100000745993_100000184471 [0,0,0,0,0,2|2,0,0]=4 32505 B16R1.1694 CCCOCC(=O)CCSc1ccccc1 1458a_100000745993_100000246102 [0,0,0,0,0,2|2,0,0]=4 32506 B16R1.1694 CCCOCC(=O)CSCc1ccccc1 1458a_100000745993_200011217039 [0,0,0,0,0,2|2,0,0]=4 32507 B16R1.1694 CCCOCC(=O)NCCc1ccccc1 11a_100000106460_100000745993 [0,0,0,0,0,2|2,0,0]=4 32508 B16R1.1694 CCCOCC(=O)NCCc1ccccc1 1626a_100000106460_100000745993 [0,0,0,0,0,2|2,0,0]=4 32509 B16R1.1694 CCCOCC(=O)NCCc1ccccc1 240690a_100000106460_100000745993 [0,0,0,0,0,2|2,0,0]=4 32510 B16R1.1694 CCCOCC(=O)NCCc1ccccc1 34a_100000210258_100000183012 [0,0,0,0,0,2|2,0,0]=4 32511 B16R1.1694 CCCOCC(=O)NCCc1ccccc1 527a_100000106460_100000745993 [0,0,0,0,0,2|2,0,0]=4 32512 B16R1.1694 CCCOCC(=O)NNCc1ccccc1 22a_100000007032_100000745993 [0,0,0,0,0,2|2,0,0]=4 32513 B16R1.1694 CCCOCC(=O)NOCc1ccccc1 34a_100000210258_100000230105 [0,0,0,0,0,2|2,0,0]=4 32514 B16R1.1694 CCCOCC(=O)OCCc1ccccc1 34a_100000210258_200000077782 [0,0,0,0,0,2|2,0,0]=4 32515 B16R1.1694 CCCSCC(=O)C/C=C/c1ccccc1 1458a_100000217233_100016265936 [0,0,0,0,0,2|2,0,0]=4 32516 B16R1.1694 CCCSCC(=O)CC#Cc1ccccc1 1458a_100000217233_100011352542 [0,0,0,0,0,2|2,0,0]=4 32517 B16R1.1694 CCCSCC(=O)CCCc1ccccc1 1458a_100000217233_100000211621 [0,0,0,0,0,2|2,0,0]=4 32518 B16R1.1694 CCCSCC(=O)CCOc1ccccc1 1458a_100000217233_100000184471 [0,0,0,0,0,2|2,0,0]=4 32519 B16R1.1694 CCCSCC(=O)CCSc1ccccc1 1458a_100000217233_100000246102 [0,0,0,0,0,2|2,0,0]=4 32520 B16R1.1694 CCCSCC(=O)CSCc1ccccc1 1458a_100000217233_200011217039 [0,0,0,0,0,2|2,0,0]=4 32521 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 11a_100000106460_100000217233 [0,0,0,0,0,2|2,0,0]=4 32522 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 1626a_100000106460_100000217233 [0,0,0,0,0,2|2,0,0]=4 32523 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 240690a_100000106460_100000217233 [0,0,0,0,0,2|2,0,0]=4 32524 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 527a_100000106460_100000217233 [0,0,0,0,0,2|2,0,0]=4 32525 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 62a_100000183012_100000210303 [0,0,0,0,0,2|2,0,0]=4 32526 B16R1.1694 CCCSCC(=O)NCCc1ccccc1 62a_100000210303_100000183012 [0,0,0,0,0,2|2,0,0]=4 32527 B16R1.1694 CCCSCC(=O)NNCc1ccccc1 22a_100000007032_100000217233 [0,0,0,0,0,2|2,0,0]=4 32528 B16R1.1694 CCCSCC(=O)NOCc1ccccc1 62a_100000210303_100000230105 [0,0,0,0,0,2|2,0,0]=4 32529 B16R1.1694 CCCSCC(=O)NOCc1ccccc1 62a_100000230105_100000210303 [0,0,0,0,0,2|2,0,0]=4 32530 B16R1.1694 CCCSCC(=O)OCCc1ccccc1 62a_100000210303_200000077782 [0,0,0,0,0,2|2,0,0]=4 32531 B16R1.1694 CCCSCC(=O)OCCc1ccccc1 62a_200000077782_100000210303 [0,0,0,0,0,2|2,0,0]=4 32532 B16R1.1694 CCOCCC(=O)C/C=C/c1ccccc1 1458a_100000749530_100016265936 [0,0,0,0,0,2|2,0,0]=4 32533 B16R1.1694 CCOCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100011215890 [0,0,0,0,0,2|2,0,0]=4 32534 B16R1.1694 CCOCCC(=O)CC#Cc1ccccc1 1458a_100000749530_100011352542 [0,0,0,0,0,2|2,0,0]=4 32535 B16R1.1694 CCOCCC(=O)CCCc1ccccc1 1458a_100000749530_100000211621 [0,0,0,0,0,2|2,0,0]=4 32536 B16R1.1694 CCOCCC(=O)CCCc1ccccc1 1458a_100011207963_100011215890 [0,0,0,0,0,2|2,0,0]=4 32537 B16R1.1694 CCOCCC(=O)CCOc1ccccc1 1458a_100000182761_100011215890 [0,0,0,0,0,2|2,0,0]=4 32538 B16R1.1694 CCOCCC(=O)CCOc1ccccc1 1458a_100000749530_100000184471 [0,0,0,0,0,2|2,0,0]=4 32539 B16R1.1694 CCOCCC(=O)CCSc1ccccc1 1458a_100000182436_100011215890 [0,0,0,0,0,2|2,0,0]=4 32540 B16R1.1694 CCOCCC(=O)CCSc1ccccc1 1458a_100000749530_100000246102 [0,0,0,0,0,2|2,0,0]=4 32541 B16R1.1694 CCOCCC(=O)COCc1ccccc1 1458a_100000230186_100011215890 [0,0,0,0,0,2|2,0,0]=4 32542 B16R1.1694 CCOCCC(=O)CSCc1ccccc1 1458a_100000150264_100011215890 [0,0,0,0,0,2|2,0,0]=4 32543 B16R1.1694 CCOCCC(=O)CSCc1ccccc1 1458a_100000749530_200011217039 [0,0,0,0,0,2|2,0,0]=4 32544 B16R1.1694 CCOCCC(=O)NCCc1ccccc1 11a_100000106460_100000749530 [0,0,0,0,0,2|2,0,0]=4 32545 B16R1.1694 CCOCCC(=O)NCCc1ccccc1 1626a_100000106460_100000749530 [0,0,0,0,0,2|2,0,0]=4 32546 B16R1.1694 CCOCCC(=O)NCCc1ccccc1 240690a_100000106460_100000749530 [0,0,0,0,0,2|2,0,0]=4 32547 B16R1.1694 CCOCCC(=O)NCCc1ccccc1 527a_100000106460_100000749530 [0,0,0,0,0,2|2,0,0]=4 32548 B16R1.1694 CCOCCC(=O)NNCc1ccccc1 22a_100000007032_100000749530 [0,0,0,0,0,2|2,0,0]=4 32549 B16R1.1694 CCSCCC(=O)C/C=C/c1ccccc1 1458a_100000230768_100016265936 [0,0,0,0,0,2|2,0,0]=4 32550 B16R1.1694 CCSCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000757381 [0,0,0,0,0,2|2,0,0]=4 32551 B16R1.1694 CCSCCC(=O)CC#Cc1ccccc1 1458a_100000230768_100011352542 [0,0,0,0,0,2|2,0,0]=4 32552 B16R1.1694 CCSCCC(=O)CCCc1ccccc1 1458a_100000230768_100000211621 [0,0,0,0,0,2|2,0,0]=4 32553 B16R1.1694 CCSCCC(=O)CCCc1ccccc1 1458a_100011207963_100000757381 [0,0,0,0,0,2|2,0,0]=4 32554 B16R1.1694 CCSCCC(=O)CCOc1ccccc1 1458a_100000182761_100000757381 [0,0,0,0,0,2|2,0,0]=4 32555 B16R1.1694 CCSCCC(=O)CCOc1ccccc1 1458a_100000230768_100000184471 [0,0,0,0,0,2|2,0,0]=4 32556 B16R1.1694 CCSCCC(=O)CCSc1ccccc1 1458a_100000182436_100000757381 [0,0,0,0,0,2|2,0,0]=4 32557 B16R1.1694 CCSCCC(=O)CCSc1ccccc1 1458a_100000230768_100000246102 [0,0,0,0,0,2|2,0,0]=4 32558 B16R1.1694 CCSCCC(=O)COCc1ccccc1 1458a_100000230186_100000757381 [0,0,0,0,0,2|2,0,0]=4 32559 B16R1.1694 CCSCCC(=O)CSCc1ccccc1 1458a_100000150264_100000757381 [0,0,0,0,0,2|2,0,0]=4 32560 B16R1.1694 CCSCCC(=O)CSCc1ccccc1 1458a_100000230768_200011217039 [0,0,0,0,0,2|2,0,0]=4 32561 B16R1.1694 CCSCCC(=O)NCCc1ccccc1 11a_100000106460_100000230768 [0,0,0,0,0,2|2,0,0]=4 32562 B16R1.1694 CCSCCC(=O)NCCc1ccccc1 1626a_100000106460_100000230768 [0,0,0,0,0,2|2,0,0]=4 32563 B16R1.1694 CCSCCC(=O)NCCc1ccccc1 240690a_100000106460_100000230768 [0,0,0,0,0,2|2,0,0]=4 32564 B16R1.1694 CCSCCC(=O)NCCc1ccccc1 527a_100000106460_100000230768 [0,0,0,0,0,2|2,0,0]=4 32565 B16R1.1694 CCSCCC(=O)NNCc1ccccc1 22a_100000007032_100000230768 [0,0,0,0,0,2|2,0,0]=4 32566 B16R1.1694 COCCCC(=O)C/C=C/c1ccccc1 1458a_100000741012_100016265936 [0,0,0,0,0,2|2,0,0]=4 32567 B16R1.1694 COCCCC(=O)C/C=C/c1ccccc1 1458a_100011219626_100000740836 [0,0,0,0,0,2|2,0,0]=4 32568 B16R1.1694 COCCCC(=O)CC#Cc1ccccc1 1458a_100000741012_100011352542 [0,0,0,0,0,2|2,0,0]=4 32569 B16R1.1694 COCCCC(=O)CCCc1ccccc1 1458a_100000741012_100000211621 [0,0,0,0,0,2|2,0,0]=4 32570 B16R1.1694 COCCCC(=O)CCCc1ccccc1 1458a_100011207963_100000740836 [0,0,0,0,0,2|2,0,0]=4 32571 B16R1.1694 COCCCC(=O)CCOc1ccccc1 1458a_100000182761_100000740836 [0,0,0,0,0,2|2,0,0]=4 32572 B16R1.1694 COCCCC(=O)CCOc1ccccc1 1458a_100000741012_100000184471 [0,0,0,0,0,2|2,0,0]=4 32573 B16R1.1694 COCCCC(=O)CCSc1ccccc1 1458a_100000182436_100000740836 [0,0,0,0,0,2|2,0,0]=4 32574 B16R1.1694 COCCCC(=O)CCSc1ccccc1 1458a_100000741012_100000246102 [0,0,0,0,0,2|2,0,0]=4 32575 B16R1.1694 COCCCC(=O)COCc1ccccc1 1458a_100000230186_100000740836 [0,0,0,0,0,2|2,0,0]=4 32576 B16R1.1694 COCCCC(=O)CSCc1ccccc1 1458a_100000150264_100000740836 [0,0,0,0,0,2|2,0,0]=4 32577 B16R1.1694 COCCCC(=O)CSCc1ccccc1 1458a_100000741012_200011217039 [0,0,0,0,0,2|2,0,0]=4 32578 B16R1.1694 COCCCC(=O)NCCc1ccccc1 11a_100000106460_100000741012 [0,0,0,0,0,2|2,0,0]=4 32579 B16R1.1694 COCCCC(=O)NCCc1ccccc1 1626a_100000106460_100000741012 [0,0,0,0,0,2|2,0,0]=4 32580 B16R1.1694 COCCCC(=O)NCCc1ccccc1 240690a_100000106460_100000741012 [0,0,0,0,0,2|2,0,0]=4 32581 B16R1.1694 COCCCC(=O)NCCc1ccccc1 527a_100000106460_100000741012 [0,0,0,0,0,2|2,0,0]=4 32582 B16R1.1694 COCCCC(=O)NNCc1ccccc1 22a_100000007032_100000741012 [0,0,0,0,0,2|2,0,0]=4 32583 B16R1.1694 COCCNC(=O)C/C=C/c1ccccc1 1626a_100000209980_100011219626 [0,0,0,0,0,2|2,0,0]=4 32584 B16R1.1694 COCCNC(=O)C/C=C/c1ccccc1 240690a_100000209980_100011219626 [0,0,0,0,0,2|2,0,0]=4 32585 B16R1.1694 COCCNC(=O)CCCc1ccccc1 1626a_100000209980_100011207963 [0,0,0,0,0,2|2,0,0]=4 32586 B16R1.1694 COCCNC(=O)CCCc1ccccc1 240690a_100000209980_100011207963 [0,0,0,0,0,2|2,0,0]=4 32587 B16R1.1694 COCCNC(=O)CCCc1ccccc1 527a_100000209980_100011207963 [0,0,0,0,0,2|2,0,0]=4 32588 B16R1.1694 COCCNC(=O)CCOc1ccccc1 1626a_100000209980_100000182761 [0,0,0,0,0,2|2,0,0]=4 32589 B16R1.1694 COCCNC(=O)CCOc1ccccc1 240690a_100000209980_100000182761 [0,0,0,0,0,2|2,0,0]=4 32590 B16R1.1694 COCCNC(=O)CCSc1ccccc1 1626a_100000209980_100000182436 [0,0,0,0,0,2|2,0,0]=4 32591 B16R1.1694 COCCNC(=O)CCSc1ccccc1 240690a_100000209980_100000182436 [0,0,0,0,0,2|2,0,0]=4 32592 B16R1.1694 COCCNC(=O)CNCc1ccccc1 207a_100000754632_100015611070 [0,0,0,0,0,2|2,0,0]=4 32593 B16R1.1694 COCCNC(=O)CNCc1ccccc1 2230a_100000754632_100015291786 [0,0,0,0,0,2|2,0,0]=4 32594 B16R1.1694 COCCNC(=O)CNCc1ccccc1 2230a_100015324214_100000183275 [0,0,0,0,0,2|2,0,0]=4 32595 B16R1.1694 COCCNC(=O)CNCc1ccccc1 34a_100015324214_100000183275 [0,0,0,0,0,2|2,0,0]=4 32596 B16R1.1694 COCCNC(=O)COCc1ccccc1 1626a_100000209980_100000230186 [0,0,0,0,0,2|2,0,0]=4 32597 B16R1.1694 COCCNC(=O)COCc1ccccc1 240690a_100000209980_100000230186 [0,0,0,0,0,2|2,0,0]=4 32598 B16R1.1694 COCCNC(=O)COCc1ccccc1 34a_100000210790_100000183275 [0,0,0,0,0,2|2,0,0]=4 32599 B16R1.1694 COCCNC(=O)COCc1ccccc1 527a_100000209980_100000230186 [0,0,0,0,0,2|2,0,0]=4 32600 B16R1.1694 COCCNC(=O)COCc1ccccc1 7a_100000210790_100000183275 [0,0,0,0,0,2|2,0,0]=4 32601 B16R1.1694 COCCNC(=O)CSCc1ccccc1 1626a_100000209980_100000150264 [0,0,0,0,0,2|2,0,0]=4 32602 B16R1.1694 COCCNC(=O)CSCc1ccccc1 240690a_100000209980_100000150264 [0,0,0,0,0,2|2,0,0]=4 32603 B16R1.1694 COCCNC(=O)CSCc1ccccc1 527a_100000209980_100000150264 [0,0,0,0,0,2|2,0,0]=4 32604 B16R1.1694 COCCNC(=O)CSCc1ccccc1 62a_100000183275_100015291786 [0,0,0,0,0,2|2,0,0]=4 32605 B16R1.1694 COCCNC(=O)CSCc1ccccc1 62a_100000211182_100000183275 [0,0,0,0,0,2|2,0,0]=4 32606 B16R1.1694 COCCNC(=O)NCCc1ccccc1 2708a_100000106460_100000209980 [0,0,0,0,0,2|2,0,0]=4 32607 B16R1.1694 COCCNC(=O)NCCc1ccccc1 273464a_100000106460_100000209980 [0,0,0,0,0,2|2,0,0]=4 32608 B16R1.1694 COCCNC(=O)NCCc1ccccc1 273464a_100000209980_100000106460 [0,0,0,0,0,2|2,0,0]=4 32609 B16R1.1694 COCCNC(=O)NNCc1ccccc1 273464a_100000209980_100000007032 [0,0,0,0,0,2|2,0,0]=4 32610 B16R1.1694 COCCOC(=O)CNCc1ccccc1 2230a_100015324214_200000040189 [0,0,0,0,0,2|1,0,0]=3 32611 B16R1.1694 COCCOC(=O)CNCc1ccccc1 34a_100015324214_200000040189 [0,0,0,0,0,2|1,0,0]=3 32612 B16R1.1694 COCCOC(=O)COCc1ccccc1 34a_100000210790_200000040189 [0,0,0,0,0,2|1,0,0]=3 32613 B16R1.1694 COCCOC(=O)COCc1ccccc1 7a_100000210790_200000040189 [0,0,0,0,0,2|1,0,0]=3 32614 B16R1.1694 COCCOC(=O)CSCc1ccccc1 62a_100000211182_200000040189 [0,0,0,0,0,2|1,0,0]=3 32615 B16R1.1694 COCCOC(=O)CSCc1ccccc1 62a_200000040189_100015291786 [0,0,0,0,0,2|1,0,0]=3 32616 B16R1.1694 COCCOC(=O)CSCc1ccccn1 62a_100000721315_200000040189 [0,0,0,0,0,2|2,0,0]=4 32617 B16R1.1694 COCCOC(=O)CSCc1ccccn1 62a_200000040189_100000721315 [0,0,0,0,0,2|2,0,0]=4 32618 B16R1.1694 COCCOC(=O)CSCc1cccnc1 62a_100000741622_200000040189 [0,0,0,0,0,2|2,0,0]=4 32619 B16R1.1694 COCCOC(=O)CSCc1cccnc1 62a_200000040189_100000741622 [0,0,0,0,0,2|2,0,0]=4 32620 B16R1.1694 COCCOC(=O)CSCc1ccncc1 62a_100015193705_200000040189 [0,0,0,0,0,2|2,0,0]=4 32621 B16R1.1694 COCCOC(=O)CSCc1ccncc1 62a_200000040189_100015193705 [0,0,0,0,0,2|2,0,0]=4 32622 B16R1.1694 CSCCCC(=O)C/C=C/c1ccccc1 1458a_100000173376_100016265936 [0,0,0,0,0,2|2,0,0]=4 32623 B16R1.1694 CSCCCC(=O)CC#Cc1ccccc1 1458a_100000173376_100011352542 [0,0,0,0,0,2|2,0,0]=4 32624 B16R1.1694 CSCCCC(=O)CCCc1ccccc1 1458a_100000173376_100000211621 [0,0,0,0,0,2|2,0,0]=4 32625 B16R1.1694 CSCCCC(=O)CCOc1ccccc1 1458a_100000173376_100000184471 [0,0,0,0,0,2|2,0,0]=4 32626 B16R1.1694 CSCCCC(=O)CCSc1ccccc1 1458a_100000173376_100000246102 [0,0,0,0,0,2|2,0,0]=4 32627 B16R1.1694 CSCCCC(=O)CSCc1ccccc1 1458a_100000173376_200011217039 [0,0,0,0,0,2|2,0,0]=4 32628 B16R1.1694 CSCCCC(=O)NCCc1ccccc1 11a_100000106460_100000173376 [0,0,0,0,0,2|2,0,0]=4 32629 B16R1.1694 CSCCCC(=O)NCCc1ccccc1 1626a_100000106460_100000173376 [0,0,0,0,0,2|2,0,0]=4 32630 B16R1.1694 CSCCCC(=O)NCCc1ccccc1 240690a_100000106460_100000173376 [0,0,0,0,0,2|2,0,0]=4 32631 B16R1.1694 CSCCCC(=O)NCCc1ccccc1 527a_100000106460_100000173376 [0,0,0,0,0,2|2,0,0]=4 32632 B16R1.1694 CSCCCC(=O)NNCc1ccccc1 22a_100000007032_100000173376 [0,0,0,0,0,2|2,0,0]=4 32633 B16R1.1694 CSCCNC(=O)C/C=C/c1ccccc1 11a_100020590264_100011219626 [0,0,0,0,0,2|2,0,0]=4 32634 B16R1.1694 CSCCNC(=O)C/C=C/c1ccccc1 1626a_100020590264_100011219626 [0,0,0,0,0,2|2,0,0]=4 32635 B16R1.1694 CSCCNC(=O)C/C=C/c1ccccc1 240690a_100020590264_100011219626 [0,0,0,0,0,2|2,0,0]=4 32636 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 11a_100020590264_100011207963 [0,0,0,0,0,2|2,0,0]=4 32637 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 1626a_100020590264_100011207963 [0,0,0,0,0,2|2,0,0]=4 32638 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 240690a_100020590264_100011207963 [0,0,0,0,0,2|2,0,0]=4 32639 B16R1.1694 CSCCNC(=O)CCCc1ccccc1 527a_100020590264_100011207963 [0,0,0,0,0,2|2,0,0]=4 32640 B16R1.1694 CSCCNC(=O)CCOc1ccccc1 11a_100020590264_100000182761 [0,0,0,0,0,2|2,0,0]=4 32641 B16R1.1694 CSCCNC(=O)CCOc1ccccc1 1626a_100020590264_100000182761 [0,0,0,0,0,2|2,0,0]=4 32642 B16R1.1694 CSCCNC(=O)CCOc1ccccc1 240690a_100020590264_100000182761 [0,0,0,0,0,2|2,0,0]=4 32643 B16R1.1694 CSCCNC(=O)CCSc1ccccc1 11a_100020590264_100000182436 [0,0,0,0,0,2|2,0,0]=4 32644 B16R1.1694 CSCCNC(=O)CCSc1ccccc1 1626a_100020590264_100000182436 [0,0,0,0,0,2|2,0,0]=4 32645 B16R1.1694 CSCCNC(=O)CCSc1ccccc1 240690a_100020590264_100000182436 [0,0,0,0,0,2|2,0,0]=4 32646 B16R1.1694 CSCCNC(=O)COCc1ccccc1 11a_100020590264_100000230186 [0,0,0,0,0,2|2,0,0]=4 32647 B16R1.1694 CSCCNC(=O)COCc1ccccc1 1626a_100020590264_100000230186 [0,0,0,0,0,2|2,0,0]=4 32648 B16R1.1694 CSCCNC(=O)COCc1ccccc1 240690a_100020590264_100000230186 [0,0,0,0,0,2|2,0,0]=4 32649 B16R1.1694 CSCCNC(=O)COCc1ccccc1 527a_100020590264_100000230186 [0,0,0,0,0,2|2,0,0]=4 32650 B16R1.1694 CSCCNC(=O)CSCc1ccccc1 11a_100020590264_100000150264 [0,0,0,0,0,2|2,0,0]=4 32651 B16R1.1694 CSCCNC(=O)CSCc1ccccc1 1626a_100020590264_100000150264 [0,0,0,0,0,2|2,0,0]=4 32652 B16R1.1694 CSCCNC(=O)CSCc1ccccc1 240690a_100020590264_100000150264 [0,0,0,0,0,2|2,0,0]=4 32653 B16R1.1694 CSCCNC(=O)CSCc1ccccc1 527a_100020590264_100000150264 [0,0,0,0,0,2|2,0,0]=4 32654 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 2708a_100000106460_100020590264 [0,0,0,0,0,2|2,0,0]=4 32655 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 2708a_100020590264_100000106460 [0,0,0,0,0,2|2,0,0]=4 32656 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 273464a_100000106460_100020590264 [0,0,0,0,0,2|2,0,0]=4 32657 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 273464a_100020590264_100000106460 [0,0,0,0,0,2|2,0,0]=4 32658 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 512a_100000106460_100020590264 [0,0,0,0,0,2|2,0,0]=4 32659 B16R1.1694 CSCCNC(=O)NCCc1ccccc1 512a_100020590264_100000106460 [0,0,0,0,0,2|2,0,0]=4 32660 B16R1.1694 CSCCNC(=O)NNCc1ccccc1 273464a_100020590264_100000007032 [0,0,0,0,0,2|2,0,0]=4 32661 B16R1.1694 CSCCNC(=O)NNCc1ccccc1 512a_100020590264_100000007032 [0,0,0,0,0,2|2,0,0]=4 32662 B16R1.1694 O=C(C/C=C/c1ccccc1)CCCCF 1458a_100011219626_100000729493 [0,0,0,0,0,2|2,0,0]=4 32663 B16R1.1694 O=C(C/C=C/c1ccccc1)CCCCO 1458a_100000695505_100016265936 [0,0,0,0,0,2|2,0,0]=4 32664 B16R1.1694 O=C(C/C=C/c1ccccc1)CCCCO 1458a_100011219626_100000210776 [0,0,0,0,0,2|2,0,0]=4 32665 B16R1.1694 O=C(C/C=C/c1ccccc1)NCCCF 11a_100015189416_100011219626 [0,0,0,0,0,2|2,0,0]=4 32666 B16R1.1694 O=C(C/C=C/c1ccccc1)NCCCF 1626a_100015189416_100011219626 [0,0,0,0,0,2|2,0,0]=4 32667 B16R1.1694 O=C(C/C=C/c1ccccc1)NCCCF 240690a_100015189416_100011219626 [0,0,0,0,0,2|2,0,0]=4 32668 B16R1.1694 O=C(C/C=C/c1ccccc1)NCCCO 240690a_100000182051_100011219626 [0,0,0,0,0,2|2,0,0]=4 32669 B16R1.1694 O=C(CC#Cc1ccccc1)CCCCO 1458a_100000695505_100011352542 [0,0,0,0,0,2|2,0,0]=4 32670 B16R1.1694 O=C(CCCCF)CCCc1ccccc1 1458a_100011207963_100000729493 [0,0,0,0,0,2|2,0,0]=4 32671 B16R1.1694 O=C(CCCCF)CCOc1ccccc1 1458a_100000182761_100000729493 [0,0,0,0,0,2|2,0,0]=4 32672 B16R1.1694 O=C(CCCCF)CCSc1ccccc1 1458a_100000182436_100000729493 [0,0,0,0,0,2|2,0,0]=4 32673 B16R1.1694 O=C(CCCCF)COCc1ccccc1 1458a_100000230186_100000729493 [0,0,0,0,0,2|2,0,0]=4 32674 B16R1.1694 O=C(CCCCF)CSCc1ccccc1 1458a_100000150264_100000729493 [0,0,0,0,0,2|2,0,0]=4 32675 B16R1.1694 O=C(CCCCO)CCCc1ccccc1 1458a_100000695505_100000211621 [0,0,0,0,0,2|2,0,0]=4 32676 B16R1.1694 O=C(CCCCO)CCCc1ccccc1 1458a_100011207963_100000210776 [0,0,0,0,0,2|2,0,0]=4 32677 B16R1.1694 O=C(CCCCO)CCOc1ccccc1 1458a_100000182761_100000210776 [0,0,0,0,0,2|2,0,0]=4 32678 B16R1.1694 O=C(CCCCO)CCOc1ccccc1 1458a_100000695505_100000184471 [0,0,0,0,0,2|2,0,0]=4 32679 B16R1.1694 O=C(CCCCO)CCSc1ccccc1 1458a_100000182436_100000210776 [0,0,0,0,0,2|2,0,0]=4 32680 B16R1.1694 O=C(CCCCO)CCSc1ccccc1 1458a_100000695505_100000246102 [0,0,0,0,0,2|2,0,0]=4 32681 B16R1.1694 O=C(CCCCO)COCc1ccccc1 1458a_100000230186_100000210776 [0,0,0,0,0,2|2,0,0]=4 32682 B16R1.1694 O=C(CCCCO)CSCc1ccccc1 1458a_100000150264_100000210776 [0,0,0,0,0,2|2,0,0]=4 32683 B16R1.1694 O=C(CCCCO)CSCc1ccccc1 1458a_100000695505_200011217039 [0,0,0,0,0,2|2,0,0]=4 32684 B16R1.1694 O=C(CCCCO)NCCc1ccccc1 1626a_100000106460_100000695505 [0,0,0,0,0,2|2,0,0]=4 32685 B16R1.1694 O=C(CCCc1ccccc1)NCCCF 11a_100015189416_100011207963 [0,0,0,0,0,2|2,0,0]=4 32686 B16R1.1694 O=C(CCCc1ccccc1)NCCCF 1626a_100015189416_100011207963 [0,0,0,0,0,2|2,0,0]=4 32687 B16R1.1694 O=C(CCCc1ccccc1)NCCCF 240690a_100015189416_100011207963 [0,0,0,0,0,2|2,0,0]=4 32688 B16R1.1694 O=C(CCCc1ccccc1)NCCCF 527a_100015189416_100011207963 [0,0,0,0,0,2|2,0,0]=4 32689 B16R1.1694 O=C(CCCc1ccccc1)NCCCO 240690a_100000182051_100011207963 [0,0,0,0,0,2|2,0,0]=4 32690 B16R1.1694 O=C(CCCc1ccccc1)NCCCO 527a_100000182051_100011207963 [0,0,0,0,0,2|2,0,0]=4 32691 B16R1.1694 O=C(CCOc1ccccc1)NCCCF 11a_100015189416_100000182761 [0,0,0,0,0,2|2,0,0]=4 32692 B16R1.1694 O=C(CCOc1ccccc1)NCCCF 1626a_100015189416_100000182761 [0,0,0,0,0,2|2,0,0]=4 32693 B16R1.1694 O=C(CCOc1ccccc1)NCCCF 240690a_100015189416_100000182761 [0,0,0,0,0,2|2,0,0]=4 32694 B16R1.1694 O=C(CCOc1ccccc1)NCCCO 240690a_100000182051_100000182761 [0,0,0,0,0,2|2,0,0]=4 32695 B16R1.1694 O=C(CCSc1ccccc1)NCCCF 11a_100015189416_100000182436 [0,0,0,0,0,2|2,0,0]=4 32696 B16R1.1694 O=C(CCSc1ccccc1)NCCCF 1626a_100015189416_100000182436 [0,0,0,0,0,2|2,0,0]=4 32697 B16R1.1694 O=C(CCSc1ccccc1)NCCCF 240690a_100015189416_100000182436 [0,0,0,0,0,2|2,0,0]=4 32698 B16R1.1694 O=C(CCSc1ccccc1)NCCCO 240690a_100000182051_100000182436 [0,0,0,0,0,2|2,0,0]=4 32699 B16R1.1694 O=C(COCc1ccccc1)NCCCF 11a_100015189416_100000230186 [0,0,0,0,0,2|2,0,0]=4 32700 B16R1.1694 O=C(COCc1ccccc1)NCCCF 1626a_100015189416_100000230186 [0,0,0,0,0,2|2,0,0]=4 32701 B16R1.1694 O=C(COCc1ccccc1)NCCCF 240690a_100015189416_100000230186 [0,0,0,0,0,2|2,0,0]=4 32702 B16R1.1694 O=C(COCc1ccccc1)NCCCF 527a_100015189416_100000230186 [0,0,0,0,0,2|2,0,0]=4 32703 B16R1.1694 O=C(COCc1ccccc1)NCCCO 240690a_100000182051_100000230186 [0,0,0,0,0,2|2,0,0]=4 32704 B16R1.1694 O=C(COCc1ccccc1)NCCCO 527a_100000182051_100000230186 [0,0,0,0,0,2|2,0,0]=4 32705 B16R1.1694 O=C(CSCc1ccccc1)NCCCF 11a_100015189416_100000150264 [0,0,0,0,0,2|2,0,0]=4 32706 B16R1.1694 O=C(CSCc1ccccc1)NCCCF 1626a_100015189416_100000150264 [0,0,0,0,0,2|2,0,0]=4 32707 B16R1.1694 O=C(CSCc1ccccc1)NCCCF 240690a_100015189416_100000150264 [0,0,0,0,0,2|2,0,0]=4 32708 B16R1.1694 O=C(CSCc1ccccc1)NCCCF 527a_100015189416_100000150264 [0,0,0,0,0,2|2,0,0]=4 32709 B16R1.1694 O=C(CSCc1ccccc1)NCCCO 240690a_100000182051_100000150264 [0,0,0,0,0,2|2,0,0]=4 32710 B16R1.1694 O=C(CSCc1ccccc1)NCCCO 527a_100000182051_100000150264 [0,0,0,0,0,2|2,0,0]=4 32711 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 2708a_100000106460_100015189416 [0,0,0,0,0,2|2,0,0]=4 32712 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 2708a_100015189416_100000106460 [0,0,0,0,0,2|2,0,0]=4 32713 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 273464a_100000106460_100015189416 [0,0,0,0,0,2|2,0,0]=4 32714 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 273464a_100015189416_100000106460 [0,0,0,0,0,2|2,0,0]=4 32715 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 512a_100000106460_100015189416 [0,0,0,0,0,2|2,0,0]=4 32716 B16R1.1694 O=C(NCCCF)NCCc1ccccc1 512a_100015189416_100000106460 [0,0,0,0,0,2|2,0,0]=4 32717 B16R1.1694 O=C(NCCCF)NNCc1ccccc1 273464a_100015189416_100000007032 [0,0,0,0,0,2|2,0,0]=4 32718 B16R1.1694 O=C(NCCCF)NNCc1ccccc1 512a_100015189416_100000007032 [0,0,0,0,0,2|2,0,0]=4 32719 B16R1.1694 O=C(NCCCO)NCCc1ccccc1 2708a_100000106460_100000182051 [0,0,0,0,0,2|2,0,0]=4 32720 B16R1.1694 O=C(NCCCO)NCCc1ccccc1 273464a_100000106460_100000182051 [0,0,0,0,0,2|2,0,0]=4 32721 B16R1.1694 O=C(NCCCO)NCCc1ccccc1 273464a_100000182051_100000106460 [0,0,0,0,0,2|2,0,0]=4 32722 B16R1.1694 O=C(NCCCO)NCCc1ccccc1 512a_100000106460_100000182051 [0,0,0,0,0,2|2,0,0]=4 32723 B16R1.1694 O=C(NCCCO)NNCc1ccccc1 273464a_100000182051_100000007032 [0,0,0,0,0,2|2,0,0]=4