0 B16R1.1223 C#CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215417 [0,0,0,0,0,0|2,0,2]=4 1 B16R1.1223 C#CCCCSc1ccc(cc1)C(=O)C=O 62a_100011215417_100000725942 [0,0,0,0,0,0|2,0,2]=4 2 B16R1.1223 C=CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000757094 [0,0,0,0,0,0|2,0,2]=4 3 B16R1.1223 C=CCCCSc1ccc(cc1)C(=O)C=O 62a_100011713584_100000725942 [0,0,0,0,0,0|2,0,2]=4 4 B16R1.1223 CC/C=C\CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100103147603 [0,0,0,0,0,0|2,0,2]=4 5 B16R1.1223 CC/C=C\CSc1ccc(cc1)C(=O)C=O 62a_100103147603_100000725942 [0,0,0,0,0,0|2,0,2]=4 6 B16R1.1223 CCC#CCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100009813939 [0,0,0,0,0,0|2,0,2]=4 7 B16R1.1223 CCC#CCSc1ccc(cc1)C(=O)C=O 62a_100009813939_100000725942 [0,0,0,0,0,0|2,0,2]=4 8 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCCF 34a_100000212119_100000729493 [0,0,0,0,0,0|2,0,2]=4 9 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCCF 7a_100000212119_100000729493 [0,0,0,0,0,0|2,0,2]=4 10 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCCO 34a_100000212119_100011216708 [0,0,0,0,0,0|2,0,2]=4 11 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCCO 7a_100000212119_100000210776 [0,0,0,0,0,0|2,0,2]=4 12 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100000210202 [0,0,0,0,0,0|2,0,2]=4 13 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCOC 34a_100000212119_100000740836 [0,0,0,0,0,0|2,0,2]=4 14 B16R1.1223 CCC(=O)c1ccc(cc1)OCCCOC 7a_100000212119_100000740836 [0,0,0,0,0,0|2,0,2]=4 15 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCCF 62a_100000211647_100000729493 [0,0,0,0,0,0|2,0,2]=4 16 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000211647 [0,0,0,0,0,0|2,0,2]=4 17 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000211647 [0,0,0,0,0,0|2,0,2]=4 18 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCCO 62a_100000211647_100000210776 [0,0,0,0,0,0|2,0,2]=4 19 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCOC 62a_100000211647_100000709357 [0,0,0,0,0,0|2,0,2]=4 20 B16R1.1223 CCC(=O)c1ccc(cc1)SCCCOC 62a_100000709357_100000211647 [0,0,0,0,0,0|2,0,2]=4 21 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)C#N 271570a_100016275911_100009994572 [0,0,0,0,0,0|1,0,3]=4 22 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)C=O 271570a_100016275911_100000725942 [0,0,0,0,0,0|1,0,2]=3 23 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)CC 271570a_100016275911_100000211647 [0,0,0,0,0,0|0,0,4]=4 24 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)CN 271570a_100016275911_100000017248 [0,0,0,0,0,0|1,0,3]=4 25 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)CO 271570a_100016275911_100011219529 [0,0,0,0,0,0|1,0,3]=4 26 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)NC 271570a_100016275911_100000155074 [0,0,0,0,0,0|1,0,3]=4 27 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)NN 271570a_100016275911_100000183614 [0,0,0,0,0,0|2,0,2]=4 28 B16R1.1223 CCCCC=Cc1ccc(cc1)C(=O)OC 271570a_100016275911_100000150774 [0,0,0,0,0,0|1,0,3]=4 29 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)CC 1458a_100000032748_100000210202 [0,0,0,0,0,0|0,0,2]=2 30 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)CF 1458a_100000032748_100015361967 [0,0,0,0,0,0|1,0,1]=2 31 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000032748 [0,0,0,0,0,0|1,0,1]=2 32 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000032748 [0,0,0,0,0,0|1,0,1]=2 33 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000032748 [0,0,0,0,0,0|1,0,1]=2 34 B16R1.1223 CCCCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000032748 [0,0,0,0,0,0|1,0,1]=2 35 B16R1.1223 CCCCCCc1ccc(cc1)C(C)NC 269862a_106832991636_100000736480 [0,0,0,0,0,0|2,0,2]=4 36 B16R1.1223 CCCCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210326 [0,0,0,0,0,0|2,0,1]=3 37 B16R1.1223 CCCCCNc1ccc(cc1)C(=O)NC 27a_100000209983_100000155074 [0,0,0,0,0,0|2,0,1]=3 38 B16R1.1223 CCCCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000718602 [0,0,0,0,0,0|2,0,1]=3 39 B16R1.1223 CCCCCNc1ccc(cc1)C(=O)NN 27a_100000209983_100000183614 [0,0,0,0,0,0|3,0,0]=3 40 B16R1.1223 CCCCCNc1ccc(cn1)C(=O)NC 27a_100000209983_100000159860 [0,0,0,0,0,0|3,0,1]=4 41 B16R1.1223 CCCCCNc1ccc(cn1)C(=O)NN 27a_100000209983_100000189807 [0,0,0,0,0,0|4,0,0]=4 42 B16R1.1223 CCCCCNc1ccc(cn1)C(=O)OC 27a_100000209983_100000733799 [0,0,0,0,0,0|3,0,1]=4 43 B16R1.1223 CCCCCNc1ccc(nc1)C(=O)NC 27a_100000209983_100011781262 [0,0,0,0,0,0|3,0,1]=4 44 B16R1.1223 CCCCCOc1ccc(cc1)C(=NO)C 34a_100000164205_100000718602 [0,0,0,0,0,0|4,0,0]=4 45 B16R1.1223 CCCCCOc1ccc(cc1)C(=NO)N 34a_100000231063_100000718602 [0,0,0,0,0,0|4,0,0]=4 46 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210326 [0,0,0,0,0,0|2,0,1]=3 47 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CC 1458a_100000186157_100000210202 [0,0,0,0,0,0|1,0,2]=3 48 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000718602 [0,0,0,0,0,0|1,0,2]=3 49 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210326 [0,0,0,0,0,0|1,0,2]=3 50 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210326 [0,0,0,0,0,0|2,0,1]=3 51 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CF 1458a_100000186157_100015361967 [0,0,0,0,0,0|2,0,1]=3 52 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000718602 [0,0,0,0,0,0|2,0,1]=3 53 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000210326 [0,0,0,0,0,0|2,0,1]=3 54 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000186157 [0,0,0,0,0,0|2,0,1]=3 55 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000186157 [0,0,0,0,0,0|2,0,1]=3 56 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000186157 [0,0,0,0,0,0|2,0,1]=3 57 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000718602 [0,0,0,0,0,0|2,0,1]=3 58 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000186157 [0,0,0,0,0,0|2,0,1]=3 59 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210326 [0,0,0,0,0,0|2,0,1]=3 60 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000718602 [0,0,0,0,0,0|3,0,0]=3 61 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000718602 [0,0,0,0,0,0|2,0,1]=3 62 B16R1.1223 CCCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210326 [0,0,0,0,0,0|2,0,1]=3 63 B16R1.1223 CCCCCOc1ccc(nc1)C(=O)NC 34a_100009861314_100000718602 [0,0,0,0,0,0|3,0,1]=4 64 B16R1.1223 CCCCCOc1ccc(nc1)C(=O)NC 7a_100009861314_100000210326 [0,0,0,0,0,0|3,0,1]=4 65 B16R1.1223 CCCCCOc1ccc(nc1)C(=O)OC 34a_100011997255_100000718602 [0,0,0,0,0,0|3,0,1]=4 66 B16R1.1223 CCCCCOc1ccc(nc1)C(=O)OC 7a_100011997255_100000210326 [0,0,0,0,0,0|3,0,1]=4 67 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)C#N 62a_100000210326_100009994572 [0,0,0,0,0,0|2,0,1]=3 68 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000210326_100000725942 [0,0,0,0,0,0|2,0,0]=2 69 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210326 [0,0,0,0,0,0|2,0,0]=2 70 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CC 62a_100000210326_100000211647 [0,0,0,0,0,0|1,0,2]=3 71 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210326 [0,0,0,0,0,0|1,0,2]=3 72 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000210326 [0,0,0,0,0,0|2,0,1]=3 73 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CN 62a_100000210326_100000017248 [0,0,0,0,0,0|2,0,1]=3 74 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CO 62a_100000210326_100011219529 [0,0,0,0,0,0|2,0,1]=3 75 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000210326 [0,0,0,0,0,0|2,0,1]=3 76 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210326 [0,0,0,0,0,0|2,0,1]=3 77 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)NC 62a_100000210326_100000155074 [0,0,0,0,0,0|2,0,1]=3 78 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000210326 [0,0,0,0,0,0|3,0,0]=3 79 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)NN 62a_100000210326_100000183614 [0,0,0,0,0,0|3,0,0]=3 80 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210326 [0,0,0,0,0,0|2,0,1]=3 81 B16R1.1223 CCCCCSc1ccc(cc1)C(=O)OC 62a_100000210326_100000150774 [0,0,0,0,0,0|2,0,1]=3 82 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)NC 62a_100000159860_100000210326 [0,0,0,0,0,0|3,0,1]=4 83 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)NC 62a_100000210326_100000159860 [0,0,0,0,0,0|3,0,1]=4 84 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)NN 62a_100000189807_100000210326 [0,0,0,0,0,0|4,0,0]=4 85 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)NN 62a_100000210326_100000189807 [0,0,0,0,0,0|4,0,0]=4 86 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)OC 62a_100000210326_100000733799 [0,0,0,0,0,0|3,0,1]=4 87 B16R1.1223 CCCCCSc1ccc(cn1)C(=O)OC 62a_100000733799_100000210326 [0,0,0,0,0,0|3,0,1]=4 88 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)CC 62a_100000210326_100012351654 [0,0,0,0,0,0|2,0,2]=4 89 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)CC 62a_100012351654_100000210326 [0,0,0,0,0,0|2,0,2]=4 90 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)NC 62a_100000210326_100011781262 [0,0,0,0,0,0|3,0,1]=4 91 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)NC 62a_100011781262_100000210326 [0,0,0,0,0,0|3,0,1]=4 92 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)NN 62a_100000210326_100011781063 [0,0,0,0,0,0|4,0,0]=4 93 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)NN 62a_100011781063_100000210326 [0,0,0,0,0,0|4,0,0]=4 94 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)OC 62a_100000210326_100102712061 [0,0,0,0,0,0|3,0,1]=4 95 B16R1.1223 CCCCCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210326 [0,0,0,0,0,0|3,0,1]=4 96 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 207a_100000102301_100000043907 [0,0,0,0,0,0|2,0,1]=3 97 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 2230a_100000102301_100000753832 [0,0,0,0,0,0|2,0,1]=3 98 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000210211 [0,0,0,0,0,0|2,0,1]=3 99 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 270004a_100000102301_100000043907 [0,0,0,0,0,0|2,0,1]=3 100 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000210210 [0,0,0,0,0,0|2,0,1]=3 101 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)NC 7a_106832991798_100000753832 [0,0,0,0,0,0|2,0,1]=3 102 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)OC 2230a_100000102301_100000735637 [0,0,0,0,0,0|2,0,1]=3 103 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)OC 270004a_100000102301_100000148700 [0,0,0,0,0,0|2,0,1]=3 104 B16R1.1223 CCCCNCc1ccc(cc1)C(=O)OC 7a_106832991798_100000735637 [0,0,0,0,0,0|2,0,1]=3 105 B16R1.1223 CCCCNCc1ccc(cn1)C(=O)OC 2230a_100000102301_100000063545 [0,0,0,0,0,0|3,0,1]=4 106 B16R1.1223 CCCCNCc1ccc(cn1)C(=O)OC 270004a_100000102301_100000762506 [0,0,0,0,0,0|3,0,1]=4 107 B16R1.1223 CCCCNCc1ccc(cn1)C(=O)OC 7a_106832991798_100000063545 [0,0,0,0,0,0|3,0,1]=4 108 B16R1.1223 CCCCNCc1ccc(nc1)C(=O)OC 2230a_100000102301_100010177729 [0,0,0,0,0,0|3,0,1]=4 109 B16R1.1223 CCCCNCc1ccc(nc1)C(=O)OC 270004a_100000102301_102516457225 [0,0,0,0,0,0|3,0,1]=4 110 B16R1.1223 CCCCNCc1ccc(nc1)C(=O)OC 7a_106832991798_100010177729 [0,0,0,0,0,0|3,0,1]=4 111 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)NC 34a_100000210227_100000753832 [0,0,0,0,0,0|2,0,1]=3 112 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)NC 7a_100000210227_100000753832 [0,0,0,0,0,0|2,0,1]=3 113 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210210 [0,0,0,0,0,0|2,0,1]=3 114 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)OC 34a_100000210227_100000735637 [0,0,0,0,0,0|2,0,1]=3 115 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210211 [0,0,0,0,0,0|2,0,1]=3 116 B16R1.1223 CCCCOCc1ccc(cc1)C(=O)OC 7a_100000210227_100000735637 [0,0,0,0,0,0|2,0,1]=3 117 B16R1.1223 CCCCOCc1ccc(cn1)C(=O)OC 34a_100000210227_100010230174 [0,0,0,0,0,0|3,0,1]=4 118 B16R1.1223 CCCCOCc1ccc(cn1)C(=O)OC 34a_100000239634_100000210210 [0,0,0,0,0,0|3,0,1]=4 119 B16R1.1223 CCCCOCc1ccc(cn1)C(=O)OC 7a_100000210227_100000063545 [0,0,0,0,0,0|3,0,1]=4 120 B16R1.1223 CCCCOCc1ccc(nc1)C(=O)OC 34a_100000210227_100010177729 [0,0,0,0,0,0|3,0,1]=4 121 B16R1.1223 CCCCOCc1ccc(nc1)C(=O)OC 34a_100009873365_100000210210 [0,0,0,0,0,0|3,0,1]=4 122 B16R1.1223 CCCCOCc1ccc(nc1)C(=O)OC 7a_100000210227_100010177729 [0,0,0,0,0,0|3,0,1]=4 123 B16R1.1223 CCCCOCc1ccc(nc1)C(=O)OC 7a_100009873365_100000210211 [0,0,0,0,0,0|3,0,1]=4 124 B16R1.1223 CCCCSCc1ccc(cc1)C(=O)NC 62a_100000210211_100000753832 [0,0,0,0,0,0|2,0,1]=3 125 B16R1.1223 CCCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000210210 [0,0,0,0,0,0|2,0,1]=3 126 B16R1.1223 CCCCSCc1ccc(cc1)C(=O)OC 62a_100000210211_100000187170 [0,0,0,0,0,0|2,0,1]=3 127 B16R1.1223 CCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210210 [0,0,0,0,0,0|2,0,1]=3 128 B16R1.1223 CCCCSCc1ccc(cn1)C(=O)OC 62a_100000210211_100010230174 [0,0,0,0,0,0|3,0,1]=4 129 B16R1.1223 CCCCSCc1ccc(cn1)C(=O)OC 62a_100010230174_100000210210 [0,0,0,0,0,0|3,0,1]=4 130 B16R1.1223 CCCCSCc1ccc(nc1)C(=O)OC 62a_100000210211_100010177729 [0,0,0,0,0,0|3,0,1]=4 131 B16R1.1223 CCCCSCc1ccc(nc1)C(=O)OC 62a_100010177729_100000210210 [0,0,0,0,0,0|3,0,1]=4 132 B16R1.1223 CCCOCCc1ccc(cc1)C(=O)OC 34a_100000210258_100010192280 [0,0,0,0,0,0|2,0,1]=3 133 B16R1.1223 CCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000210303 [0,0,0,0,0,0|2,0,1]=3 134 B16R1.1223 CCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000210303 [0,0,0,0,0,0|2,0,1]=3 135 B16R1.1223 CCCSCCc1ccc(cc1)C(=O)OC 62a_100000210303_100010192280 [0,0,0,0,0,0|2,0,1]=3 136 B16R1.1223 CCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000210303 [0,0,0,0,0,0|2,0,1]=3 137 B16R1.1223 CCNCCCc1ccc(cc1)C(=O)OC 2230a_100015525214_100010192279 [0,0,0,0,0,0|2,0,1]=3 138 B16R1.1223 CCNCCOc1ccc(cc1)C(=O)OC 2230a_100015525214_100000742590 [0,0,0,0,0,0|3,0,1]=4 139 B16R1.1223 CCOCCCc1ccc(cc1)C(=O)OC 34a_100121572206_100010192279 [0,0,0,0,0,0|2,0,1]=3 140 B16R1.1223 CCOCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100011215890 [0,0,0,0,0,0|3,0,1]=4 141 B16R1.1223 CCOCCNc1ccc(cc1)C(=O)NC 27a_100011200944_100000155074 [0,0,0,0,0,0|3,0,1]=4 142 B16R1.1223 CCOCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210147 [0,0,0,0,0,0|3,0,1]=4 143 B16R1.1223 CCOCCNc1ccc(cc1)C(=O)NN 27a_100011200944_100000183614 [0,0,0,0,0,0|4,0,0]=4 144 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100011215890 [0,0,0,0,0,0|3,0,1]=4 145 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CC 1458a_200000217202_100000210202 [0,0,0,0,0,0|2,0,2]=4 146 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210147 [0,0,0,0,0,0|2,0,2]=4 147 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100011215890 [0,0,0,0,0,0|2,0,2]=4 148 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100011215890 [0,0,0,0,0,0|3,0,1]=4 149 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CF 1458a_200000217202_100015361967 [0,0,0,0,0,0|3,0,1]=4 150 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000210147 [0,0,0,0,0,0|3,0,1]=4 151 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100011215890 [0,0,0,0,0,0|3,0,1]=4 152 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 11a_106832991635_200000217202 [0,0,0,0,0,0|3,0,1]=4 153 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_200000217202 [0,0,0,0,0,0|3,0,1]=4 154 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_200000217202 [0,0,0,0,0,0|3,0,1]=4 155 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210147 [0,0,0,0,0,0|3,0,1]=4 156 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 527a_100102657272_200000217202 [0,0,0,0,0,0|3,0,1]=4 157 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100011215890 [0,0,0,0,0,0|3,0,1]=4 158 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210147 [0,0,0,0,0,0|4,0,0]=4 159 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210147 [0,0,0,0,0,0|3,0,1]=4 160 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)OC 34a_100011216607_100000210202 [0,0,0,0,0,0|3,0,1]=4 161 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)OC 34a_100121572206_100000742590 [0,0,0,0,0,0|3,0,1]=4 162 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100011215890 [0,0,0,0,0,0|3,0,1]=4 163 B16R1.1223 CCOCCOc1ccc(cc1)C(=O)OC 7a_100011216607_100000210202 [0,0,0,0,0,0|3,0,1]=4 164 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)C#N 62a_100000210147_100009994572 [0,0,0,0,0,0|3,0,1]=4 165 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)C=O 62a_100000210147_100000725942 [0,0,0,0,0,0|3,0,0]=3 166 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215890 [0,0,0,0,0,0|3,0,0]=3 167 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CC 62a_100000210147_100000211647 [0,0,0,0,0,0|2,0,2]=4 168 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100011215890 [0,0,0,0,0,0|2,0,2]=4 169 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100011215890 [0,0,0,0,0,0|3,0,1]=4 170 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CN 62a_100000210147_100000017248 [0,0,0,0,0,0|3,0,1]=4 171 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CO 62a_100000210147_100011219529 [0,0,0,0,0,0|3,0,1]=4 172 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100011215890 [0,0,0,0,0,0|3,0,1]=4 173 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100011215890 [0,0,0,0,0,0|3,0,1]=4 174 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)NC 62a_100000210147_100000155074 [0,0,0,0,0,0|3,0,1]=4 175 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100011215890 [0,0,0,0,0,0|4,0,0]=4 176 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)NN 62a_100000210147_100000183614 [0,0,0,0,0,0|4,0,0]=4 177 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100011215890 [0,0,0,0,0,0|3,0,1]=4 178 B16R1.1223 CCOCCSc1ccc(cc1)C(=O)OC 62a_100000210147_100000150774 [0,0,0,0,0,0|3,0,1]=4 179 B16R1.1223 CCOCSCc1ccc(cc1)C(=O)NC 62a_100000739092_100000753832 [0,0,0,0,0,0|3,0,1]=4 180 B16R1.1223 CCOCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000739092 [0,0,0,0,0,0|3,0,1]=4 181 B16R1.1223 CCOCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000739092 [0,0,0,0,0,0|3,0,1]=4 182 B16R1.1223 CCOCSCc1ccc(cc1)C(=O)OC 62a_100000739092_100000187170 [0,0,0,0,0,0|3,0,1]=4 183 B16R1.1223 CCSCCCc1ccc(cc1)C(=O)OC 62a_100000210202_100010192279 [0,0,0,0,0,0|2,0,1]=3 184 B16R1.1223 CCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000210202 [0,0,0,0,0,0|2,0,1]=3 185 B16R1.1223 CCSCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000757381 [0,0,0,0,0,0|3,0,1]=4 186 B16R1.1223 CCSCCNc1ccc(cc1)C(=O)NC 27a_100000106463_100000155074 [0,0,0,0,0,0|3,0,1]=4 187 B16R1.1223 CCSCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000757381 [0,0,0,0,0,0|3,0,1]=4 188 B16R1.1223 CCSCCNc1ccc(cc1)C(=O)NN 27a_100000106463_100000183614 [0,0,0,0,0,0|4,0,0]=4 189 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000757381 [0,0,0,0,0,0|3,0,1]=4 190 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000757381 [0,0,0,0,0,0|2,0,2]=4 191 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000757381 [0,0,0,0,0,0|2,0,2]=4 192 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000757381 [0,0,0,0,0,0|3,0,1]=4 193 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000757381 [0,0,0,0,0,0|3,0,1]=4 194 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000757381 [0,0,0,0,0,0|3,0,1]=4 195 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000757381 [0,0,0,0,0,0|3,0,1]=4 196 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000757381 [0,0,0,0,0,0|3,0,1]=4 197 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000757381 [0,0,0,0,0,0|4,0,0]=4 198 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000757381 [0,0,0,0,0,0|3,0,1]=4 199 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)OC 62a_100000210202_100000742590 [0,0,0,0,0,0|3,0,1]=4 200 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)OC 62a_100000742590_100000210202 [0,0,0,0,0,0|3,0,1]=4 201 B16R1.1223 CCSCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000757381 [0,0,0,0,0,0|3,0,1]=4 202 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)C#N 62a_100000757381_100009994572 [0,0,0,0,0,0|3,0,1]=4 203 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000757381 [0,0,0,0,0,0|3,0,0]=3 204 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)C=O 62a_100000757381_100000725942 [0,0,0,0,0,0|3,0,0]=3 205 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000757381 [0,0,0,0,0,0|2,0,2]=4 206 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CC 62a_100000757381_100000211647 [0,0,0,0,0,0|2,0,2]=4 207 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000757381 [0,0,0,0,0,0|3,0,1]=4 208 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CN 62a_100000757381_100000017248 [0,0,0,0,0,0|3,0,1]=4 209 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CO 62a_100000757381_100011219529 [0,0,0,0,0,0|3,0,1]=4 210 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000757381 [0,0,0,0,0,0|3,0,1]=4 211 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000757381 [0,0,0,0,0,0|3,0,1]=4 212 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)NC 62a_100000757381_100000155074 [0,0,0,0,0,0|3,0,1]=4 213 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000757381 [0,0,0,0,0,0|4,0,0]=4 214 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)NN 62a_100000757381_100000183614 [0,0,0,0,0,0|4,0,0]=4 215 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000757381 [0,0,0,0,0,0|3,0,1]=4 216 B16R1.1223 CCSCCSc1ccc(cc1)C(=O)OC 62a_100000757381_100000150774 [0,0,0,0,0,0|3,0,1]=4 217 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 207a_100015189416_100000043907 [0,0,0,0,0,0|3,0,1]=4 218 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 2230a_100000743749_100011934791 [0,0,0,0,0,0|3,0,1]=4 219 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 2230a_100015189416_100000753832 [0,0,0,0,0,0|3,0,1]=4 220 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 270004a_100015189416_100000043907 [0,0,0,0,0,0|3,0,1]=4 221 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 34a_100000743749_100011934791 [0,0,0,0,0,0|3,0,1]=4 222 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCF 34a_100015189416_100000753832 [0,0,0,0,0,0|3,0,1]=4 223 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCO 207a_100000182051_100000043907 [0,0,0,0,0,0|3,0,1]=4 224 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCO 2230a_100000743749_100000230001 [0,0,0,0,0,0|3,0,1]=4 225 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCO 270004a_100000182051_100000043907 [0,0,0,0,0,0|3,0,1]=4 226 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCCO 34a_100000743749_100000230001 [0,0,0,0,0,0|3,0,1]=4 227 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCOC 207a_100000209980_100000043907 [0,0,0,0,0,0|3,0,1]=4 228 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCOC 2230a_100000209980_100000753832 [0,0,0,0,0,0|3,0,1]=4 229 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCOC 2230a_100000743749_100011201679 [0,0,0,0,0,0|3,0,1]=4 230 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCOC 270004a_100000209980_100000043907 [0,0,0,0,0,0|3,0,1]=4 231 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCOC 34a_100000743749_100011201679 [0,0,0,0,0,0|3,0,1]=4 232 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCSC 207a_100020590264_100000043907 [0,0,0,0,0,0|3,0,1]=4 233 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCSC 2230a_100000743749_100000751147 [0,0,0,0,0,0|3,0,1]=4 234 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCSC 2230a_100020590264_100000753832 [0,0,0,0,0,0|3,0,1]=4 235 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCSC 270004a_100020590264_100000043907 [0,0,0,0,0,0|3,0,1]=4 236 B16R1.1223 CNC(=O)c1ccc(cc1)CNCCSC 34a_100000743749_100000212216 [0,0,0,0,0,0|3,0,1]=4 237 B16R1.1223 CNC(=O)c1ccc(cc1)COCCCBr 34a_100011217188_100000753832 [0,0,0,0,0,0|3,0,1]=4 238 B16R1.1223 CNC(=O)c1ccc(cc1)COCCCCl 34a_100000230001_100000753832 [0,0,0,0,0,0|3,0,1]=4 239 B16R1.1223 CNC(=O)c1ccc(cc1)COCCCF 34a_100000759539_100000753832 [0,0,0,0,0,0|3,0,1]=4 240 B16R1.1223 CNC(=O)c1ccc(cc1)COCCCN 34a_100000182051_100000753832 [0,0,0,0,0,0|3,0,1]=4 241 B16R1.1223 CNC(=O)c1ccc(cc1)COCCOC 34a_100000210237_100000753832 [0,0,0,0,0,0|3,0,1]=4 242 B16R1.1223 CNC(=O)c1ccc(cc1)COCCSC 34a_100000230434_100000753832 [0,0,0,0,0,0|3,0,1]=4 243 B16R1.1223 CNC(=O)c1ccc(cc1)COCCSC 7a_100000230434_100000753832 [0,0,0,0,0,0|3,0,1]=4 244 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCCF 62a_100000753832_100011934791 [0,0,0,0,0,0|3,0,1]=4 245 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCCF 62a_100011934791_100000753832 [0,0,0,0,0,0|3,0,1]=4 246 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCCO 62a_100000753832_100011215043 [0,0,0,0,0,0|3,0,1]=4 247 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCCO 62a_100011215043_100000753832 [0,0,0,0,0,0|3,0,1]=4 248 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCOC 62a_100000233755_100000753832 [0,0,0,0,0,0|3,0,1]=4 249 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCOC 62a_100000753832_100000233755 [0,0,0,0,0,0|3,0,1]=4 250 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCSC 62a_100000212216_100000753832 [0,0,0,0,0,0|3,0,1]=4 251 B16R1.1223 CNC(=O)c1ccc(cc1)CSCCSC 62a_100000753832_100000751147 [0,0,0,0,0,0|3,0,1]=4 252 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCCF 2230a_100000184841_100000729493 [0,0,0,0,0,0|3,0,1]=4 253 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCCF 34a_100000184841_100000729493 [0,0,0,0,0,0|3,0,1]=4 254 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCCO 2230a_100000184841_100000210776 [0,0,0,0,0,0|3,0,1]=4 255 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCCO 27a_100000750430_100000155074 [0,0,0,0,0,0|3,0,1]=4 256 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCCO 34a_100000184841_100011216708 [0,0,0,0,0,0|3,0,1]=4 257 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCOC 2230a_100000184841_100000740836 [0,0,0,0,0,0|3,0,1]=4 258 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCOC 27a_100150723488_100000155074 [0,0,0,0,0,0|3,0,1]=4 259 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCOC 34a_100000184841_100000740836 [0,0,0,0,0,0|3,0,1]=4 260 B16R1.1223 CNC(=O)c1ccc(cc1)NCCCSC 27a_100000749238_100000155074 [0,0,0,0,0,0|3,0,1]=4 261 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCCF 34a_100000192141_100000729493 [0,0,0,0,0,0|3,0,1]=4 262 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCCF 7a_100000192141_100000729493 [0,0,0,0,0,0|3,0,1]=4 263 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCCO 34a_100000192141_100011216708 [0,0,0,0,0,0|3,0,1]=4 264 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCCO 7a_100000192141_100000210776 [0,0,0,0,0,0|3,0,1]=4 265 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 11a_106832991635_100000684957 [0,0,0,0,0,0|3,0,1]=4 266 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 1626a_100102657272_100000684957 [0,0,0,0,0,0|3,0,1]=4 267 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 240690a_100102657272_100000684957 [0,0,0,0,0,0|3,0,1]=4 268 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 34a_100000192141_100000740836 [0,0,0,0,0,0|3,0,1]=4 269 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 527a_100102657272_100000684957 [0,0,0,0,0,0|3,0,1]=4 270 B16R1.1223 CNC(=O)c1ccc(cc1)OCCCOC 7a_100000192141_100000740836 [0,0,0,0,0,0|3,0,1]=4 271 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCCF 62a_100000155074_100000729493 [0,0,0,0,0,0|3,0,1]=4 272 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000155074 [0,0,0,0,0,0|3,0,1]=4 273 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCCO 62a_100000155074_100000210776 [0,0,0,0,0,0|3,0,1]=4 274 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000155074 [0,0,0,0,0,0|3,0,1]=4 275 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCOC 62a_100000155074_100000709357 [0,0,0,0,0,0|3,0,1]=4 276 B16R1.1223 CNC(=O)c1ccc(cc1)SCCCOC 62a_100000709357_100000155074 [0,0,0,0,0,0|3,0,1]=4 277 B16R1.1223 CNCCCOc1ccc(cc1)C(=O)OC 2230a_106832991635_100011310726 [0,0,0,0,0,0|3,0,1]=4 278 B16R1.1223 CNCCCOc1ccc(cc1)C(=O)OC 34a_100102657272_100011310726 [0,0,0,0,0,0|3,0,1]=4 279 B16R1.1223 CNCCCOc1ccc(cc1)C(=O)OC 7a_106832991635_100011310726 [0,0,0,0,0,0|3,0,1]=4 280 B16R1.1223 COC(=O)c1ccc(cc1)CCCCO[13CH3] 34a_100010141194_200025704644 [0,0,0,0,0,0|2,0,1]=3 281 B16R1.1223 COC(=O)c1ccc(cc1)CCCCO[13CH3] 7a_100010141194_200025704644 [0,0,0,0,0,0|2,0,1]=3 282 B16R1.1223 COC(=O)c1ccc(cc1)CCCSCF 62a_100010192279_100015361967 [0,0,0,0,0,0|3,0,1]=4 283 B16R1.1223 COC(=O)c1ccc(cc1)CCCSCF 62a_100015361967_100010192279 [0,0,0,0,0,0|3,0,1]=4 284 B16R1.1223 COC(=O)c1ccc(cc1)CCNCCF 34a_100000724931_100010192280 [0,0,0,0,0,0|3,0,1]=4 285 B16R1.1223 COC(=O)c1ccc(cc1)CCNCCO 2230a_100016997473_100010192280 [0,0,0,0,0,0|3,0,1]=4 286 B16R1.1223 COC(=O)c1ccc(cc1)CCNCCO 34a_100016990907_100010192280 [0,0,0,0,0,0|3,0,1]=4 287 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCBr 34a_100000211926_100010192280 [0,0,0,0,0,0|3,0,1]=4 288 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCF 34a_100010779965_100011217306 [0,0,0,0,0,0|3,0,1]=4 289 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCF 7a_100010779965_100011217306 [0,0,0,0,0,0|3,0,1]=4 290 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCN 34a_100000210304_100010192280 [0,0,0,0,0,0|3,0,1]=4 291 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCO 34a_100010779965_100000211926 [0,0,0,0,0,0|3,0,1]=4 292 B16R1.1223 COC(=O)c1ccc(cc1)CCOCCO 7a_100010779965_100000211926 [0,0,0,0,0,0|3,0,1]=4 293 B16R1.1223 COC(=O)c1ccc(cc1)CCOCSC 34a_100010779965_100011218213 [0,0,0,0,0,0|3,0,1]=4 294 B16R1.1223 COC(=O)c1ccc(cc1)CCSCCF 62a_100010192280_100011217306 [0,0,0,0,0,0|3,0,1]=4 295 B16R1.1223 COC(=O)c1ccc(cc1)CCSCCF 62a_100011217306_100010192280 [0,0,0,0,0,0|3,0,1]=4 296 B16R1.1223 COC(=O)c1ccc(cc1)CCSCCO 62a_100000211926_100010192280 [0,0,0,0,0,0|3,0,1]=4 297 B16R1.1223 COC(=O)c1ccc(cc1)CCSCCO 62a_100010192280_100000211926 [0,0,0,0,0,0|3,0,1]=4 298 B16R1.1223 COC(=O)c1ccc(cc1)CCSCSC 62a_100010192280_100011218213 [0,0,0,0,0,0|3,0,1]=4 299 B16R1.1223 COC(=O)c1ccc(cc1)CCSCSC 62a_100011218213_100010192280 [0,0,0,0,0,0|3,0,1]=4 300 B16R1.1223 COC(=O)c1ccc(cc1)CNCCCF 2230a_100015189416_100000735637 [0,0,0,0,0,0|3,0,1]=4 301 B16R1.1223 COC(=O)c1ccc(cc1)CNCCCF 270004a_100015189416_100000148700 [0,0,0,0,0,0|3,0,1]=4 302 B16R1.1223 COC(=O)c1ccc(cc1)CNCCCF 34a_100015189416_100000735637 [0,0,0,0,0,0|3,0,1]=4 303 B16R1.1223 COC(=O)c1ccc(cc1)CNCCCO 270004a_100000182051_100000148700 [0,0,0,0,0,0|3,0,1]=4 304 B16R1.1223 COC(=O)c1ccc(cc1)CNCCSC 2230a_100020590264_100000735637 [0,0,0,0,0,0|3,0,1]=4 305 B16R1.1223 COC(=O)c1ccc(cc1)CNCCSC 270004a_100020590264_100000148700 [0,0,0,0,0,0|3,0,1]=4 306 B16R1.1223 COC(=O)c1ccc(cc1)COCCCBr 34a_100011217188_100000735637 [0,0,0,0,0,0|3,0,1]=4 307 B16R1.1223 COC(=O)c1ccc(cc1)COCCCCl 34a_100000230001_100000735637 [0,0,0,0,0,0|3,0,1]=4 308 B16R1.1223 COC(=O)c1ccc(cc1)COCCCF 34a_100000151488_100011934791 [0,0,0,0,0,0|3,0,1]=4 309 B16R1.1223 COC(=O)c1ccc(cc1)COCCCF 34a_100000759539_100000735637 [0,0,0,0,0,0|3,0,1]=4 310 B16R1.1223 COC(=O)c1ccc(cc1)COCCCF 7a_100000151488_100011934791 [0,0,0,0,0,0|3,0,1]=4 311 B16R1.1223 COC(=O)c1ccc(cc1)COCCCN 34a_100000182051_100000735637 [0,0,0,0,0,0|3,0,1]=4 312 B16R1.1223 COC(=O)c1ccc(cc1)COCCCO 34a_100000151488_100000230001 [0,0,0,0,0,0|3,0,1]=4 313 B16R1.1223 COC(=O)c1ccc(cc1)COCCCO 7a_100000151488_100011215043 [0,0,0,0,0,0|3,0,1]=4 314 B16R1.1223 COC(=O)c1ccc(cc1)COCCSC 34a_100000151488_100000212216 [0,0,0,0,0,0|3,0,1]=4 315 B16R1.1223 COC(=O)c1ccc(cc1)COCCSC 34a_100000230434_100000735637 [0,0,0,0,0,0|3,0,1]=4 316 B16R1.1223 COC(=O)c1ccc(cc1)COCCSC 7a_100000151488_100000212216 [0,0,0,0,0,0|3,0,1]=4 317 B16R1.1223 COC(=O)c1ccc(cc1)COCCSC 7a_100000230434_100000735637 [0,0,0,0,0,0|3,0,1]=4 318 B16R1.1223 COC(=O)c1ccc(cc1)CSCCCF 62a_100000735637_100011934791 [0,0,0,0,0,0|3,0,1]=4 319 B16R1.1223 COC(=O)c1ccc(cc1)CSCCCF 62a_100011934791_100000187170 [0,0,0,0,0,0|3,0,1]=4 320 B16R1.1223 COC(=O)c1ccc(cc1)CSCCCO 62a_100000735637_100011215043 [0,0,0,0,0,0|3,0,1]=4 321 B16R1.1223 COC(=O)c1ccc(cc1)CSCCCO 62a_100011215043_100000187170 [0,0,0,0,0,0|3,0,1]=4 322 B16R1.1223 COC(=O)c1ccc(cc1)CSCCSC 62a_100000212216_100000187170 [0,0,0,0,0,0|3,0,1]=4 323 B16R1.1223 COC(=O)c1ccc(cc1)CSCCSC 62a_100000735637_100000751147 [0,0,0,0,0,0|3,0,1]=4 324 B16R1.1223 COC(=O)c1ccc(cc1)OCCCCF 34a_100000150123_100000729493 [0,0,0,0,0,0|3,0,1]=4 325 B16R1.1223 COC(=O)c1ccc(cc1)OCCCCF 7a_100000150123_100000729493 [0,0,0,0,0,0|3,0,1]=4 326 B16R1.1223 COC(=O)c1ccc(cc1)OCCCCO 34a_100000150123_100011216708 [0,0,0,0,0,0|3,0,1]=4 327 B16R1.1223 COC(=O)c1ccc(cc1)OCCCCO 7a_100000150123_100000210776 [0,0,0,0,0,0|3,0,1]=4 328 B16R1.1223 COC(=O)c1ccc(cc1)OCCCSC 62a_100011310726_200000210301 [0,0,0,0,0,0|3,0,1]=4 329 B16R1.1223 COC(=O)c1ccc(cc1)OCCCSC 62a_200000210301_100011310726 [0,0,0,0,0,0|3,0,1]=4 330 B16R1.1223 COC(=O)c1ccc(cc1)OCCCS[13CH3] 62a_100011310726_200025704644 [0,0,0,0,0,0|3,0,1]=4 331 B16R1.1223 COC(=O)c1ccc(cc1)OCCCS[13CH3] 62a_200025704644_100011310726 [0,0,0,0,0,0|3,0,1]=4 332 B16R1.1223 COC(=O)c1ccc(cc1)SCCCCF 62a_100000150774_100000729493 [0,0,0,0,0,0|3,0,1]=4 333 B16R1.1223 COC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000150774 [0,0,0,0,0,0|3,0,1]=4 334 B16R1.1223 COC(=O)c1ccc(cc1)SCCCCO 62a_100000150774_100000210776 [0,0,0,0,0,0|3,0,1]=4 335 B16R1.1223 COC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000150774 [0,0,0,0,0,0|3,0,1]=4 336 B16R1.1223 COCCCCc1ccc(cc1)C(=O)OC 34a_100010141194_200000210301 [0,0,0,0,0,0|2,0,1]=3 337 B16R1.1223 COCCCCc1ccc(cc1)C(=O)OC 7a_100010141194_200000210301 [0,0,0,0,0,0|2,0,1]=3 338 B16R1.1223 COCCCNc1ccc(cc1)C(=O)NN 27a_100150723488_100000183614 [0,0,0,0,0,0|4,0,0]=4 339 B16R1.1223 COCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000740836 [0,0,0,0,0,0|3,0,1]=4 340 B16R1.1223 COCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000740836 [0,0,0,0,0,0|3,0,1]=4 341 B16R1.1223 COCCCOc1ccc(cc1)C(=O)CF 1458a_100000684957_100015361967 [0,0,0,0,0,0|3,0,1]=4 342 B16R1.1223 COCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000740836 [0,0,0,0,0,0|3,0,1]=4 343 B16R1.1223 COCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000740836 [0,0,0,0,0,0|3,0,1]=4 344 B16R1.1223 COCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000740836 [0,0,0,0,0,0|4,0,0]=4 345 B16R1.1223 COCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000740836 [0,0,0,0,0,0|3,0,1]=4 346 B16R1.1223 COCCCOc1ccc(cc1)C(=O)OC 34a_100138415774_100011310726 [0,0,0,0,0,0|3,0,1]=4 347 B16R1.1223 COCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000740836 [0,0,0,0,0,0|3,0,1]=4 348 B16R1.1223 COCCCSc1ccc(cc1)C(=O)C#N 62a_100000709357_100009994572 [0,0,0,0,0,0|3,0,1]=4 349 B16R1.1223 COCCCSc1ccc(cc1)C(=O)C=O 62a_100000709357_100000725942 [0,0,0,0,0,0|3,0,0]=3 350 B16R1.1223 COCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000709357 [0,0,0,0,0,0|3,0,0]=3 351 B16R1.1223 COCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000709357 [0,0,0,0,0,0|3,0,1]=4 352 B16R1.1223 COCCCSc1ccc(cc1)C(=O)CN 62a_100000709357_100000017248 [0,0,0,0,0,0|3,0,1]=4 353 B16R1.1223 COCCCSc1ccc(cc1)C(=O)CO 62a_100000709357_100011219529 [0,0,0,0,0,0|3,0,1]=4 354 B16R1.1223 COCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000709357 [0,0,0,0,0,0|3,0,1]=4 355 B16R1.1223 COCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000709357 [0,0,0,0,0,0|4,0,0]=4 356 B16R1.1223 COCCCSc1ccc(cc1)C(=O)NN 62a_100000709357_100000183614 [0,0,0,0,0,0|4,0,0]=4 357 B16R1.1223 COCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000709357 [0,0,0,0,0,0|3,0,1]=4 358 B16R1.1223 COCCCSc1ccc(cc1)C(=O)OC 62a_100000709357_100000150774 [0,0,0,0,0,0|3,0,1]=4 359 B16R1.1223 COCCNCc1ccc(cc1)C(=O)OC 2230a_100000209980_100000735637 [0,0,0,0,0,0|3,0,1]=4 360 B16R1.1223 COCCNCc1ccc(cc1)C(=O)OC 270004a_100000209980_100000148700 [0,0,0,0,0,0|3,0,1]=4 361 B16R1.1223 COCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100011201679 [0,0,0,0,0,0|3,0,1]=4 362 B16R1.1223 COCCOCc1ccc(cc1)C(=O)OC 34a_100000210237_100000735637 [0,0,0,0,0,0|3,0,1]=4 363 B16R1.1223 COCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000233755 [0,0,0,0,0,0|3,0,1]=4 364 B16R1.1223 COCCSCc1ccc(cc1)C(=O)OC 62a_100000233755_100000187170 [0,0,0,0,0,0|3,0,1]=4 365 B16R1.1223 COCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000233755 [0,0,0,0,0,0|3,0,1]=4 366 B16R1.1223 COCSCCc1ccc(cc1)C(=O)OC 62a_100000766300_100010192280 [0,0,0,0,0,0|3,0,1]=4 367 B16R1.1223 COCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000766300 [0,0,0,0,0,0|3,0,1]=4 368 B16R1.1223 CSCCCNc1ccc(cc1)C(=O)NN 27a_100000749238_100000183614 [0,0,0,0,0,0|4,0,0]=4 369 B16R1.1223 N#CC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100009994572 [0,0,0,0,0,0|3,0,1]=4 370 B16R1.1223 N#CC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100009994572 [0,0,0,0,0,0|3,0,1]=4 371 B16R1.1223 N#CCCCSc1ccc(cc1)C(=O)C=O 62a_100000687738_100000725942 [0,0,0,0,0,0|3,0,1]=4 372 B16R1.1223 N#CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000687738 [0,0,0,0,0,0|3,0,1]=4 373 B16R1.1223 NCC(=O)c1ccc(cc1)SCCCCF 62a_100000017248_100000729493 [0,0,0,0,0,0|3,0,1]=4 374 B16R1.1223 NCC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000017248 [0,0,0,0,0,0|3,0,1]=4 375 B16R1.1223 NCC(=O)c1ccc(cc1)SCCCCO 62a_100000017248_100000210776 [0,0,0,0,0,0|3,0,1]=4 376 B16R1.1223 NCC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000017248 [0,0,0,0,0,0|3,0,1]=4 377 B16R1.1223 NNC(=O)c1ccc(cc1)NCCCCO 27a_100000750430_100000183614 [0,0,0,0,0,0|4,0,0]=4 378 B16R1.1223 NNC(=O)c1ccc(cc1)OCCCCF 34a_100000185078_100000729493 [0,0,0,0,0,0|4,0,0]=4 379 B16R1.1223 NNC(=O)c1ccc(cc1)OCCCCO 34a_100000185078_100011216708 [0,0,0,0,0,0|4,0,0]=4 380 B16R1.1223 NNC(=O)c1ccc(cc1)SCCCCF 62a_100000183614_100000729493 [0,0,0,0,0,0|4,0,0]=4 381 B16R1.1223 NNC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000183614 [0,0,0,0,0,0|4,0,0]=4 382 B16R1.1223 NNC(=O)c1ccc(cc1)SCCCCO 62a_100000183614_100000210776 [0,0,0,0,0,0|4,0,0]=4 383 B16R1.1223 NNC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000183614 [0,0,0,0,0,0|4,0,0]=4 384 B16R1.1223 O=C(CBr)c1ccc(cc1)OCCCCF 7a_100009814261_100000729493 [0,0,0,0,0,0|3,0,1]=4 385 B16R1.1223 O=C(CBr)c1ccc(cc1)OCCCCO 7a_100009814261_100000210776 [0,0,0,0,0,0|3,0,1]=4 386 B16R1.1223 O=C(CCl)c1ccc(cc1)OCCCCF 7a_100000018856_100000729493 [0,0,0,0,0,0|3,0,1]=4 387 B16R1.1223 O=C(CCl)c1ccc(cc1)OCCCCO 7a_100000018856_100000210776 [0,0,0,0,0,0|3,0,1]=4 388 B16R1.1223 O=C(CF)c1ccc(cc1)OCCCCF 34a_200010654591_100000729493 [0,0,0,0,0,0|3,0,1]=4 389 B16R1.1223 O=C(CF)c1ccc(cc1)OCCCCF 7a_200010654591_100000729493 [0,0,0,0,0,0|3,0,1]=4 390 B16R1.1223 O=C(CF)c1ccc(cc1)OCCCCO 34a_200010654591_100011216708 [0,0,0,0,0,0|3,0,1]=4 391 B16R1.1223 O=C(CF)c1ccc(cc1)OCCCCO 7a_200010654591_100000210776 [0,0,0,0,0,0|3,0,1]=4 392 B16R1.1223 O=C(CO)c1ccc(cc1)SCCCCF 62a_100000729493_100011219529 [0,0,0,0,0,0|3,0,1]=4 393 B16R1.1223 O=C(CO)c1ccc(cc1)SCCCCF 62a_100011219529_100000729493 [0,0,0,0,0,0|3,0,1]=4 394 B16R1.1223 O=C(CO)c1ccc(cc1)SCCCCO 62a_100000210776_100011219529 [0,0,0,0,0,0|3,0,1]=4 395 B16R1.1223 O=C(CO)c1ccc(cc1)SCCCCO 62a_100011219529_100000210776 [0,0,0,0,0,0|3,0,1]=4 396 B16R1.1223 O=CC(=O)c1ccc(cc1)SCCCCF 62a_100000725942_100000729493 [0,0,0,0,0,0|3,0,0]=3 397 B16R1.1223 O=CC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000725942 [0,0,0,0,0,0|3,0,0]=3 398 B16R1.1223 O=CC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000725942 [0,0,0,0,0,0|3,0,0]=3 399 B16R1.1223 O=CC(=O)c1ccc(cc1)SCCCCO 62a_100000725942_100000210776 [0,0,0,0,0,0|3,0,0]=3 400 B16R1.1223 O=CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_200011292268 [0,0,0,0,0,0|3,0,1]=4 401 B16R1.1223 O=CCCCSc1ccc(cc1)C(=O)C=O 62a_200011292268_100000725942 [0,0,0,0,0,0|3,0,1]=4 402 B15R1.557 CCCC=Cc1ccc(cc1)C(=O)C=O 271570a_100016258520_100000725942 [1,0,0,0,0,0|1,0,2]=4 403 B15R1.557 CCCCCc1ccc(cc1)C(=O)CC 1458a_100000037971_100000210202 [1,0,0,0,0,0|0,0,2]=3 404 B15R1.557 CCCCCc1ccc(cc1)C(=O)CF 1458a_100000037971_100015361967 [1,0,0,0,0,0|1,0,1]=3 405 B15R1.557 CCCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000037971 [1,0,0,0,0,0|1,0,1]=3 406 B15R1.557 CCCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000037971 [1,0,0,0,0,0|1,0,1]=3 407 B15R1.557 CCCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000037971 [1,0,0,0,0,0|1,0,1]=3 408 B15R1.557 CCCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000037971 [1,0,0,0,0,0|1,0,1]=3 409 B15R1.557 CCCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210211 [1,0,0,0,0,0|2,0,1]=4 410 B15R1.557 CCCCNc1ccc(cc1)C(=O)NC 27a_100000102301_100000155074 [1,0,0,0,0,0|2,0,1]=4 411 B15R1.557 CCCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210210 [1,0,0,0,0,0|2,0,1]=4 412 B15R1.557 CCCCNc1ccc(cc1)C(=O)NN 27a_100000102301_100000183614 [1,0,0,0,0,0|3,0,0]=4 413 B15R1.557 CCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210211 [1,0,0,0,0,0|2,0,1]=4 414 B15R1.557 CCCCOc1ccc(cc1)C(=O)CC 1458a_100000182901_100000210202 [1,0,0,0,0,0|1,0,2]=4 415 B15R1.557 CCCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210210 [1,0,0,0,0,0|1,0,2]=4 416 B15R1.557 CCCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210211 [1,0,0,0,0,0|1,0,2]=4 417 B15R1.557 CCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210211 [1,0,0,0,0,0|2,0,1]=4 418 B15R1.557 CCCCOc1ccc(cc1)C(=O)CF 1458a_100000182901_100015361967 [1,0,0,0,0,0|2,0,1]=4 419 B15R1.557 CCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000210210 [1,0,0,0,0,0|2,0,1]=4 420 B15R1.557 CCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000210211 [1,0,0,0,0,0|2,0,1]=4 421 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000182901 [1,0,0,0,0,0|2,0,1]=4 422 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000182901 [1,0,0,0,0,0|2,0,1]=4 423 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000182901 [1,0,0,0,0,0|2,0,1]=4 424 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210210 [1,0,0,0,0,0|2,0,1]=4 425 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000182901 [1,0,0,0,0,0|2,0,1]=4 426 B15R1.557 CCCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210211 [1,0,0,0,0,0|2,0,1]=4 427 B15R1.557 CCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210210 [1,0,0,0,0,0|3,0,0]=4 428 B15R1.557 CCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210210 [1,0,0,0,0,0|2,0,1]=4 429 B15R1.557 CCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210211 [1,0,0,0,0,0|2,0,1]=4 430 B15R1.557 CCCCSc1ccc(cc1)C(=O)C#N 62a_100000210211_100009994572 [1,0,0,0,0,0|2,0,1]=4 431 B15R1.557 CCCCSc1ccc(cc1)C(=O)C=O 62a_100000210211_100000725942 [1,0,0,0,0,0|2,0,0]=3 432 B15R1.557 CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210210 [1,0,0,0,0,0|2,0,0]=3 433 B15R1.557 CCCCSc1ccc(cc1)C(=O)CC 62a_100000210211_100000211647 [1,0,0,0,0,0|1,0,2]=4 434 B15R1.557 CCCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210210 [1,0,0,0,0,0|1,0,2]=4 435 B15R1.557 CCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000210210 [1,0,0,0,0,0|2,0,1]=4 436 B15R1.557 CCCCSc1ccc(cc1)C(=O)CN 62a_100000210211_100000017248 [1,0,0,0,0,0|2,0,1]=4 437 B15R1.557 CCCCSc1ccc(cc1)C(=O)CO 62a_100000210211_100011219529 [1,0,0,0,0,0|2,0,1]=4 438 B15R1.557 CCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000210210 [1,0,0,0,0,0|2,0,1]=4 439 B15R1.557 CCCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210210 [1,0,0,0,0,0|2,0,1]=4 440 B15R1.557 CCCCSc1ccc(cc1)C(=O)NC 62a_100000210211_100000155074 [1,0,0,0,0,0|2,0,1]=4 441 B15R1.557 CCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000210210 [1,0,0,0,0,0|3,0,0]=4 442 B15R1.557 CCCCSc1ccc(cc1)C(=O)NN 62a_100000210211_100000183614 [1,0,0,0,0,0|3,0,0]=4 443 B15R1.557 CCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210210 [1,0,0,0,0,0|2,0,1]=4 444 B15R1.557 CCCCSc1ccc(cc1)C(=O)OC 62a_100000210211_100000150774 [1,0,0,0,0,0|2,0,1]=4 445 B15R1.557 CCCNCc1ccc(cc1)C(=O)NC 207a_100020643023_100000043907 [1,0,0,0,0,0|2,0,1]=4 446 B15R1.557 CCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000210303 [1,0,0,0,0,0|2,0,1]=4 447 B15R1.557 CCCNCc1ccc(cc1)C(=O)NC 270004a_100020643023_100000043907 [1,0,0,0,0,0|2,0,1]=4 448 B15R1.557 CCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000210303 [1,0,0,0,0,0|2,0,1]=4 449 B15R1.557 CCCNCc1ccc(cc1)C(=O)OC 270004a_100020643023_100000148700 [1,0,0,0,0,0|2,0,1]=4 450 B15R1.557 CCCOCc1ccc(cc1)C(=O)NC 34a_100000210258_100000753832 [1,0,0,0,0,0|2,0,1]=4 451 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210303 [1,0,0,0,0,0|2,0,1]=4 452 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 34a_100000210258_100000735637 [1,0,0,0,0,0|2,0,1]=4 453 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210303 [1,0,0,0,0,0|2,0,1]=4 454 B15R1.557 CCCSCc1ccc(cc1)C(=O)NC 62a_100000210303_100000753832 [1,0,0,0,0,0|2,0,1]=4 455 B15R1.557 CCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000210303 [1,0,0,0,0,0|2,0,1]=4 456 B15R1.557 CCCSCc1ccc(cc1)C(=O)OC 62a_100000210303_100000187170 [1,0,0,0,0,0|2,0,1]=4 457 B15R1.557 CCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210303 [1,0,0,0,0,0|2,0,1]=4 458 B15R1.557 CCNCCc1ccc(cc1)C(=O)OC 2230a_100015525214_100010192280 [1,0,0,0,0,0|2,0,1]=4 459 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000210202 [1,0,0,0,0,0|2,0,1]=4 460 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 34a_100121572206_100010192280 [1,0,0,0,0,0|2,0,1]=4 461 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000210202 [1,0,0,0,0,0|2,0,1]=4 462 B15R1.557 CCOCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000739092 [1,0,0,0,0,0|3,0,0]=4 463 B15R1.557 CCOCSc1ccc(cc1)C(=O)C=O 62a_100000739092_100000725942 [1,0,0,0,0,0|3,0,0]=4 464 B15R1.557 CCSCCc1ccc(cc1)C(=O)OC 62a_100000210202_100010192280 [1,0,0,0,0,0|2,0,1]=4 465 B15R1.557 CCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000210202 [1,0,0,0,0,0|2,0,1]=4 466 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 2230a_106832991635_100010192279 [1,0,0,0,0,0|2,0,1]=4 467 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 34a_100102657272_100010192279 [1,0,0,0,0,0|2,0,1]=4 468 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 7a_106832991635_100010192279 [1,0,0,0,0,0|2,0,1]=4 469 B15R1.557 COC(=O)c1ccc(cc1)CCCSC 62a_100010192279_200000210301 [1,0,0,0,0,0|2,0,1]=4 470 B15R1.557 COC(=O)c1ccc(cc1)CCCSC 62a_200000210301_100010192279 [1,0,0,0,0,0|2,0,1]=4 471 B15R1.557 COC(=O)c1ccc(cc1)CCCS[13CH3] 62a_100010192279_200025704644 [1,0,0,0,0,0|2,0,1]=4 472 B15R1.557 COC(=O)c1ccc(cc1)CCCS[13CH3] 62a_200025704644_100010192279 [1,0,0,0,0,0|2,0,1]=4 473 B15R1.557 COCCCc1ccc(cc1)C(=O)OC 34a_100138415774_100010192279 [1,0,0,0,0,0|2,0,1]=4 474 B15R1.557 COCCSc1ccc(cc1)C(=O)C=O 62a_100000233755_100000725942 [1,0,0,0,0,0|3,0,0]=4 475 B15R1.557 COCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000233755 [1,0,0,0,0,0|3,0,0]=4 476 B15R1.557 CSCCSc1ccc(cc1)C(=O)C=O 62a_100000212216_100000725942 [1,0,0,0,0,0|3,0,0]=4 477 B15R1.557 CSCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000751147 [1,0,0,0,0,0|3,0,0]=4 478 B15R1.557 O=CC(=O)c1ccc(cc1)SCCCF 62a_100000725942_100011934791 [1,0,0,0,0,0|3,0,0]=4 479 B15R1.557 O=CC(=O)c1ccc(cc1)SCCCF 62a_100011934791_100000725942 [1,0,0,0,0,0|3,0,0]=4 480 B15R1.557 O=CC(=O)c1ccc(cc1)SCCCO 62a_100000725942_100011215043 [1,0,0,0,0,0|3,0,0]=4 481 B15R1.557 O=CC(=O)c1ccc(cc1)SCCCO 62a_100011215043_100000725942 [1,0,0,0,0,0|3,0,0]=4 482 B15R1.1030 C=C(C)c1ccc(cc1)C=CCCCC 271570a_100016275911_100000185454 [1,0,0,0,0,0|1,0,2]=4 483 B15R1.1030 C=C(C)c1ccc(cc1)CCCCCC 271570a_100000694244_100009814338 [1,0,0,0,0,0|1,0,0]=2 484 B15R1.1030 C=C(C)c1ccc(cc1)CNCCCC 271570a_100000694244_100015187156 [1,0,0,0,0,0|2,0,0]=3 485 B15R1.1030 C=C(C)c1ccc(cc1)CNCCOC 271570a_100000694244_100015187160 [1,0,0,0,0,0|3,0,0]=4 486 B15R1.1030 C=C(C)c1ccc(cc1)COCCOC 271570a_100000694244_100000755069 [1,0,0,0,0,0|3,0,0]=4 487 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCC 271570a_100000694244_200011214818 [1,0,0,0,0,0|2,0,0]=3 488 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCC 34a_100009880102_100000718602 [1,0,0,0,0,0|2,0,0]=3 489 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCC 7a_100009880102_100000210326 [1,0,0,0,0,0|2,0,0]=3 490 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCF 34a_100009880102_100000729493 [1,0,0,0,0,0|3,0,0]=4 491 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCF 7a_100009880102_100000729493 [1,0,0,0,0,0|3,0,0]=4 492 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCO 34a_100009880102_100011216708 [1,0,0,0,0,0|3,0,0]=4 493 B15R1.1030 C=C(C)c1ccc(cc1)OCCCCO 7a_100009880102_100000210776 [1,0,0,0,0,0|3,0,0]=4 494 B15R1.1030 C=C(C)c1ccc(cc1)OCCCNC 271570a_100000694244_100102699777 [1,0,0,0,0,0|3,0,0]=4 495 B15R1.1030 C=C(C)c1ccc(cc1)OCCCOC 271570a_100000694244_200011326559 [1,0,0,0,0,0|3,0,0]=4 496 B15R1.1030 C=C(C)c1ccc(cc1)OCCCOC 34a_100009880102_100000740836 [1,0,0,0,0,0|3,0,0]=4 497 B15R1.1030 C=C(C)c1ccc(cc1)OCCCOC 7a_100009880102_100000740836 [1,0,0,0,0,0|3,0,0]=4 498 B15R1.1030 C=C(C)c1ccc(cc1)OCCNCC 271570a_100000694244_100000762749 [1,0,0,0,0,0|3,0,0]=4 499 B15R1.1030 C=C(C)c1ccc(cc1)OCCOCC 271570a_100000694244_200000169944 [1,0,0,0,0,0|3,0,0]=4 500 B15R1.1030 C=C(C)c1ccc(cc1)OCCOCC 34a_100009880102_100000210147 [1,0,0,0,0,0|3,0,0]=4 501 B15R1.1030 C=C(C)c1ccc(cc1)OCCOCC 7a_100009880102_100011215890 [1,0,0,0,0,0|3,0,0]=4 502 B15R1.1030 C=C(C)c1ccc(cc1)OCCSCC 34a_100009880102_100000757381 [1,0,0,0,0,0|3,0,0]=4 503 B15R1.1030 C=C(C)c1ccc(cc1)OCCSCC 7a_100009880102_100000757381 [1,0,0,0,0,0|3,0,0]=4 504 B15R1.1030 C=C(C)c1ccc(cc1)SCCCCF 62a_100000185454_100000729493 [1,0,0,0,0,0|3,0,0]=4 505 B15R1.1030 C=C(C)c1ccc(cc1)SCCCCF 62a_100000729493_100000185454 [1,0,0,0,0,0|3,0,0]=4 506 B15R1.1030 C=C(C)c1ccc(cc1)SCCCCO 62a_100000185454_100000210776 [1,0,0,0,0,0|3,0,0]=4 507 B15R1.1030 C=C(C)c1ccc(cc1)SCCCCO 62a_100000210776_100000185454 [1,0,0,0,0,0|3,0,0]=4 508 B15R1.1030 C=C(C)c1ccc(cc1)SCCCOC 62a_100000185454_100000709357 [1,0,0,0,0,0|3,0,0]=4 509 B15R1.1030 C=C(C)c1ccc(cc1)SCCCOC 62a_100000709357_100000185454 [1,0,0,0,0,0|3,0,0]=4 510 B15R1.1030 C=C(C)c1ccc(cc1)SCCOCC 62a_100000185454_100011215890 [1,0,0,0,0,0|3,0,0]=4 511 B15R1.1030 C=C(C)c1ccc(cc1)SCCOCC 62a_100000210147_100000185454 [1,0,0,0,0,0|3,0,0]=4 512 B15R1.1030 C=C(C)c1ccc(cc1)SCCSCC 62a_100000185454_100000757381 [1,0,0,0,0,0|3,0,0]=4 513 B15R1.1030 C=C(C)c1ccc(cc1)SCCSCC 62a_100000757381_100000185454 [1,0,0,0,0,0|3,0,0]=4 514 B15R1.1030 CC(=O)c1ccc(cc1)CCNCCF 34a_100000724931_200000038727 [1,0,0,0,0,0|2,0,1]=4 515 B15R1.1030 CC(=O)c1ccc(cc1)CCNCCO 2230a_100016997473_200000038727 [1,0,0,0,0,0|2,0,1]=4 516 B15R1.1030 CC(=O)c1ccc(cc1)CCNCCO 34a_100016990907_200000038727 [1,0,0,0,0,0|2,0,1]=4 517 B15R1.1030 CC(=O)c1ccc(cc1)CCOCCBr 34a_100000211926_200000038727 [1,0,0,0,0,0|2,0,1]=4 518 B15R1.1030 CC(=O)c1ccc(cc1)CCOCCN 34a_100000210304_200000038727 [1,0,0,0,0,0|2,0,1]=4 519 B15R1.1030 CC(=O)c1ccc(cc1)CCSCCF 62a_100011217306_200000038727 [1,0,0,0,0,0|2,0,1]=4 520 B15R1.1030 CC(=O)c1ccc(cc1)CCSCCF 62a_200000038727_100011217306 [1,0,0,0,0,0|2,0,1]=4 521 B15R1.1030 CC(=O)c1ccc(cc1)CCSCCO 62a_100000211926_200000038727 [1,0,0,0,0,0|2,0,1]=4 522 B15R1.1030 CC(=O)c1ccc(cc1)CCSCCO 62a_200000038727_100000211926 [1,0,0,0,0,0|2,0,1]=4 523 B15R1.1030 CC(=O)c1ccc(cc1)CNCCCF 2230a_100015189416_100000756337 [1,0,0,0,0,0|2,0,1]=4 524 B15R1.1030 CC(=O)c1ccc(cc1)CNCCCF 34a_100015189416_100000756337 [1,0,0,0,0,0|2,0,1]=4 525 B15R1.1030 CC(=O)c1ccc(cc1)COCCCBr 34a_100011217188_100000756337 [1,0,0,0,0,0|2,0,1]=4 526 B15R1.1030 CC(=O)c1ccc(cc1)COCCCCl 34a_100000230001_100000756337 [1,0,0,0,0,0|2,0,1]=4 527 B15R1.1030 CC(=O)c1ccc(cc1)COCCCF 34a_100000759539_100000756337 [1,0,0,0,0,0|2,0,1]=4 528 B15R1.1030 CC(=O)c1ccc(cc1)COCCCF 7a_100000082505_100011934791 [1,0,0,0,0,0|2,0,1]=4 529 B15R1.1030 CC(=O)c1ccc(cc1)COCCCN 34a_100000182051_100000756337 [1,0,0,0,0,0|2,0,1]=4 530 B15R1.1030 CC(=O)c1ccc(cc1)COCCCO 7a_100000082505_100011215043 [1,0,0,0,0,0|2,0,1]=4 531 B15R1.1030 CC(=O)c1ccc(cc1)CSCCCF 62a_100000756337_100011934791 [1,0,0,0,0,0|2,0,1]=4 532 B15R1.1030 CC(=O)c1ccc(cc1)CSCCCF 62a_100011934791_100000756337 [1,0,0,0,0,0|2,0,1]=4 533 B15R1.1030 CC(=O)c1ccc(cc1)CSCCCO 62a_100000756337_100011215043 [1,0,0,0,0,0|2,0,1]=4 534 B15R1.1030 CC(=O)c1ccc(cc1)CSCCCO 62a_100011215043_100000756337 [1,0,0,0,0,0|2,0,1]=4 535 B15R1.1030 CC(=O)c1ccc(cc1)OCCCCF 34a_100000185113_100000729493 [1,0,0,0,0,0|2,0,1]=4 536 B15R1.1030 CC(=O)c1ccc(cc1)OCCCCF 7a_100000185113_100000729493 [1,0,0,0,0,0|2,0,1]=4 537 B15R1.1030 CC(=O)c1ccc(cc1)OCCCCO 34a_100000185113_100011216708 [1,0,0,0,0,0|2,0,1]=4 538 B15R1.1030 CC(=O)c1ccc(cc1)OCCCCO 7a_100000185113_100000210776 [1,0,0,0,0,0|2,0,1]=4 539 B15R1.1030 CC(=O)c1ccc(cc1)SCCCCF 62a_100000185465_100000729493 [1,0,0,0,0,0|2,0,1]=4 540 B15R1.1030 CC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000185465 [1,0,0,0,0,0|2,0,1]=4 541 B15R1.1030 CC(=O)c1ccc(cc1)SCCCCO 62a_100000185465_100000210776 [1,0,0,0,0,0|2,0,1]=4 542 B15R1.1030 CC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000185465 [1,0,0,0,0,0|2,0,1]=4 543 B15R1.1030 CCCCC=Cc1ccc(cc1)C(=O)C 271570a_100016275911_100000185465 [1,0,0,0,0,0|0,0,3]=4 544 B15R1.1030 CCCCC=Cc1ccc(cc1)C(=O)N 271570a_100016275911_100000162191 [1,0,0,0,0,0|1,0,2]=4 545 B15R1.1030 CCCCCCc1ccc(cc1)C(=O)C 1458a_100000032748_200000210301 [1,0,0,0,0,0|0,0,1]=2 546 B15R1.1030 CCCCCCc1ccc(cc1)C(=O)[13CH3] 1458a_100000032748_200025704644 [1,0,0,0,0,0|0,0,1]=2 547 B15R1.1030 CCCCCNc1ccc(cc1)C(=O)N 27a_100000209983_100000162191 [1,0,0,0,0,0|2,0,0]=3 548 B15R1.1030 CCCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000718602 [1,0,0,0,0,0|2,0,0]=3 549 B15R1.1030 CCCCCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210326 [1,0,0,0,0,0|3,0,0]=4 550 B15R1.1030 CCCCCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000718602 [1,0,0,0,0,0|3,0,0]=4 551 B15R1.1030 CCCCCNc1ccc(cn1)C(=O)C 27a_100000209983_100000690552 [1,0,0,0,0,0|2,0,1]=4 552 B15R1.1030 CCCCCNc1ccc(cn1)C(=O)N 27a_100000209983_100000162237 [1,0,0,0,0,0|3,0,0]=4 553 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)C 1458a_100000186157_200000210301 [1,0,0,0,0,0|1,0,1]=3 554 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000718602 [1,0,0,0,0,0|1,0,1]=3 555 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210326 [1,0,0,0,0,0|1,0,1]=3 556 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000718602 [1,0,0,0,0,0|2,0,0]=3 557 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210326 [1,0,0,0,0,0|2,0,0]=3 558 B15R1.1030 CCCCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000186157_200025704644 [1,0,0,0,0,0|1,0,1]=3 559 B15R1.1030 CCCCCOc1ccc(cc1)S(=O)C 34a_200000064373_100000718602 [1,0,0,0,0,0|2,0,1]=4 560 B15R1.1030 CCCCCOc1ccc(cc1)S(=O)C 7a_200000064373_100000210326 [1,0,0,0,0,0|2,0,1]=4 561 B15R1.1030 CCCCCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000718602 [1,0,0,0,0,0|3,0,0]=4 562 B15R1.1030 CCCCCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210326 [1,0,0,0,0,0|3,0,0]=4 563 B15R1.1030 CCCCCOc1ccc(nc1)C(=O)C 34a_100012001710_100000718602 [1,0,0,0,0,0|2,0,1]=4 564 B15R1.1030 CCCCCOc1ccc(nc1)C(=O)C 7a_100012001710_100000210326 [1,0,0,0,0,0|2,0,1]=4 565 B15R1.1030 CCCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210326 [1,0,0,0,0,0|1,0,1]=3 566 B15R1.1030 CCCCCSc1ccc(cc1)C(=O)C 62a_100000210326_100000185465 [1,0,0,0,0,0|1,0,1]=3 567 B15R1.1030 CCCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210326 [1,0,0,0,0,0|2,0,0]=3 568 B15R1.1030 CCCCCSc1ccc(cc1)C(=O)N 62a_100000210326_100000162191 [1,0,0,0,0,0|2,0,0]=3 569 B15R1.1030 CCCCCSc1ccc(cc1)S(=O)C 62a_100009816266_100000210326 [1,0,0,0,0,0|2,0,1]=4 570 B15R1.1030 CCCCCSc1ccc(cn1)C(=O)C 62a_100000210326_100000684857 [1,0,0,0,0,0|2,0,1]=4 571 B15R1.1030 CCCCCSc1ccc(cn1)C(=O)C 62a_100000684857_100000210326 [1,0,0,0,0,0|2,0,1]=4 572 B15R1.1030 CCCCCSc1ccc(cn1)C(=O)N 62a_100000162237_100000210326 [1,0,0,0,0,0|3,0,0]=4 573 B15R1.1030 CCCCCSc1ccc(cn1)C(=O)N 62a_100000210326_100000162237 [1,0,0,0,0,0|3,0,0]=4 574 B15R1.1030 CCCCCSc1ccc(nc1)C(=O)C 62a_100000210326_100000686046 [1,0,0,0,0,0|2,0,1]=4 575 B15R1.1030 CCCCCSc1ccc(nc1)C(=O)C 62a_100000686046_100000210326 [1,0,0,0,0,0|2,0,1]=4 576 B15R1.1030 CCCCCSc1ccc(nc1)C(=O)N 62a_100000210326_100011219284 [1,0,0,0,0,0|3,0,0]=4 577 B15R1.1030 CCCCCSc1ccc(nc1)C(=O)N 62a_100011219284_100000210326 [1,0,0,0,0,0|3,0,0]=4 578 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)C 2230a_100000102301_100000756337 [1,0,0,0,0,0|1,0,1]=3 579 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)C 7a_106832991798_100000756337 [1,0,0,0,0,0|1,0,1]=3 580 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)N 207a_100000102301_100000038677 [1,0,0,0,0,0|2,0,0]=3 581 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)N 2230a_100000102301_100000231043 [1,0,0,0,0,0|2,0,0]=3 582 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)N 270004a_100000102301_100000038677 [1,0,0,0,0,0|2,0,0]=3 583 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)N 7a_106832991798_100000231043 [1,0,0,0,0,0|2,0,0]=3 584 B15R1.1030 CCCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210211 [1,0,0,0,0,0|2,0,0]=3 585 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 207a_100000102301_100000189386 [1,0,0,0,0,0|3,0,0]=4 586 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000102301_100000181861 [1,0,0,0,0,0|3,0,0]=4 587 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000210211 [1,0,0,0,0,0|3,0,0]=4 588 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 270004a_100000102301_100000189386 [1,0,0,0,0,0|3,0,0]=4 589 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000210210 [1,0,0,0,0,0|3,0,0]=4 590 B15R1.1030 CCCCNCc1ccc(cc1)[N+](=O)[O-] 7a_106832991798_100000181861 [1,0,0,0,0,0|3,0,0]=4 591 B15R1.1030 CCCCNCc1ccc(nc1)C(=O)O 269956a_100000762669_100000210211 [1,0,0,0,0,0|3,0,0]=4 592 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)C 34a_100000210227_100000756337 [1,0,0,0,0,0|1,0,1]=3 593 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000210211 [1,0,0,0,0,0|1,0,1]=3 594 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)C 7a_100000210227_100000756337 [1,0,0,0,0,0|1,0,1]=3 595 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000210210 [1,0,0,0,0,0|2,0,0]=3 596 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)N 34a_100000210227_100000231043 [1,0,0,0,0,0|2,0,0]=3 597 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000210211 [1,0,0,0,0,0|2,0,0]=3 598 B15R1.1030 CCCCOCc1ccc(cc1)C(=O)N 7a_100000210227_100000231043 [1,0,0,0,0,0|2,0,0]=3 599 B15R1.1030 CCCCOCc1ccc(cc1)[N+](=O)[O-] 34a_100000210227_100000181861 [1,0,0,0,0,0|3,0,0]=4 600 B15R1.1030 CCCCOCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000210210 [1,0,0,0,0,0|3,0,0]=4 601 B15R1.1030 CCCCOCc1ccc(cc1)[N+](=O)[O-] 7a_100000210227_100000181861 [1,0,0,0,0,0|3,0,0]=4 602 B15R1.1030 CCCCSCc1ccc(cc1)C(=O)C 62a_100000210211_100000756337 [1,0,0,0,0,0|1,0,1]=3 603 B15R1.1030 CCCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000210210 [1,0,0,0,0,0|1,0,1]=3 604 B15R1.1030 CCCCSCc1ccc(cc1)C(=O)N 62a_100000210211_100000231043 [1,0,0,0,0,0|2,0,0]=3 605 B15R1.1030 CCCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000210210 [1,0,0,0,0,0|2,0,0]=3 606 B15R1.1030 CCCCSCc1ccc(cc1)[N+](=O)[O-] 62a_100000210211_100000184243 [1,0,0,0,0,0|3,0,0]=4 607 B15R1.1030 CCCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000210207 [1,0,0,0,0,0|2,0,0]=3 608 B15R1.1030 CCCNCCc1ccc(cc1)[N+](=O)[O-] 2230a_100000744123_100000210303 [1,0,0,0,0,0|3,0,0]=4 609 B15R1.1030 CCCNCCc1ccc(cc1)[N+](=O)[O-] 34a_100000744123_100000210303 [1,0,0,0,0,0|3,0,0]=4 610 B15R1.1030 CCCOCCc1ccc(cc1)C(=O)C 34a_100000210258_200000038727 [1,0,0,0,0,0|1,0,1]=3 611 B15R1.1030 CCCOCCc1ccc(cc1)[N+](=O)[O-] 34a_100000210258_100000736421 [1,0,0,0,0,0|3,0,0]=4 612 B15R1.1030 CCCOCCc1ccc(cc1)[N+](=O)[O-] 34a_100000704122_100000210303 [1,0,0,0,0,0|3,0,0]=4 613 B15R1.1030 CCCOCCc1ccc(cc1)[N+](=O)[O-] 7a_100000704122_100000210303 [1,0,0,0,0,0|3,0,0]=4 614 B15R1.1030 CCCSCCc1ccc(cc1)C(=O)C 62a_100000210303_200000038727 [1,0,0,0,0,0|1,0,1]=3 615 B15R1.1030 CCCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000210303 [1,0,0,0,0,0|1,0,1]=3 616 B15R1.1030 CCCSCCc1ccc(cc1)[N+](=O)[O-] 62a_100000210303_100000736421 [1,0,0,0,0,0|3,0,0]=4 617 B15R1.1030 CCNCCCc1ccc(cc1)[N+](=O)[O-] 2230a_100015525214_100010167727 [1,0,0,0,0,0|3,0,0]=4 618 B15R1.1030 CCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000210202 [1,0,0,0,0,0|3,0,0]=4 619 B15R1.1030 CCOCCCc1ccc(cc1)[N+](=O)[O-] 34a_100000090596_100000210202 [1,0,0,0,0,0|3,0,0]=4 620 B15R1.1030 CCOCCCc1ccc(cc1)[N+](=O)[O-] 34a_100121572206_100010167727 [1,0,0,0,0,0|3,0,0]=4 621 B15R1.1030 CCOCCCc1ccc(cc1)[N+](=O)[O-] 7a_100000090596_100000210202 [1,0,0,0,0,0|3,0,0]=4 622 B15R1.1030 CCOCCNc1ccc(cc1)C(=O)N 27a_100011200944_100000162191 [1,0,0,0,0,0|3,0,0]=4 623 B15R1.1030 CCOCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210147 [1,0,0,0,0,0|3,0,0]=4 624 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)C 1458a_200000217202_200000210301 [1,0,0,0,0,0|2,0,1]=4 625 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210147 [1,0,0,0,0,0|2,0,1]=4 626 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)C 7a_100000185113_100011215890 [1,0,0,0,0,0|2,0,1]=4 627 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210147 [1,0,0,0,0,0|3,0,0]=4 628 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)N 7a_100000746352_100011215890 [1,0,0,0,0,0|3,0,0]=4 629 B15R1.1030 CCOCCOc1ccc(cc1)C(=O)[13CH3] 1458a_200000217202_200025704644 [1,0,0,0,0,0|2,0,1]=4 630 B15R1.1030 CCOCCSc1ccc(cc1)C(=O)C 62a_100000185465_100011215890 [1,0,0,0,0,0|2,0,1]=4 631 B15R1.1030 CCOCCSc1ccc(cc1)C(=O)C 62a_100000210147_100000185465 [1,0,0,0,0,0|2,0,1]=4 632 B15R1.1030 CCOCCSc1ccc(cc1)C(=O)N 62a_100000162191_100011215890 [1,0,0,0,0,0|3,0,0]=4 633 B15R1.1030 CCOCCSc1ccc(cc1)C(=O)N 62a_100000210147_100000162191 [1,0,0,0,0,0|3,0,0]=4 634 B15R1.1030 CCOCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000739092 [1,0,0,0,0,0|3,0,0]=4 635 B15R1.1030 CCOCSCc1ccc(cc1)C(=O)C 62a_100000739092_100000756337 [1,0,0,0,0,0|2,0,1]=4 636 B15R1.1030 CCOCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000739092 [1,0,0,0,0,0|2,0,1]=4 637 B15R1.1030 CCOCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000739092 [1,0,0,0,0,0|3,0,0]=4 638 B15R1.1030 CCOCSCc1ccc(cc1)C(=O)N 62a_100000739092_100000231043 [1,0,0,0,0,0|3,0,0]=4 639 B15R1.1030 CCSCCCc1ccc(cc1)[N+](=O)[O-] 62a_100000210202_100010167727 [1,0,0,0,0,0|3,0,0]=4 640 B15R1.1030 CCSCCNc1ccc(cc1)C(=O)N 27a_100000106463_100000162191 [1,0,0,0,0,0|3,0,0]=4 641 B15R1.1030 CCSCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000757381 [1,0,0,0,0,0|3,0,0]=4 642 B15R1.1030 CCSCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000757381 [1,0,0,0,0,0|2,0,1]=4 643 B15R1.1030 CCSCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000757381 [1,0,0,0,0,0|2,0,1]=4 644 B15R1.1030 CCSCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000757381 [1,0,0,0,0,0|3,0,0]=4 645 B15R1.1030 CCSCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000757381 [1,0,0,0,0,0|3,0,0]=4 646 B15R1.1030 CCSCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000757381 [1,0,0,0,0,0|2,0,1]=4 647 B15R1.1030 CCSCCSc1ccc(cc1)C(=O)C 62a_100000757381_100000185465 [1,0,0,0,0,0|2,0,1]=4 648 B15R1.1030 CCSCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000757381 [1,0,0,0,0,0|3,0,0]=4 649 B15R1.1030 CCSCCSc1ccc(cc1)C(=O)N 62a_100000757381_100000162191 [1,0,0,0,0,0|3,0,0]=4 650 B15R1.1030 COCCCCc1ccc(cc1)[N+](=O)[O-] 34a_200000039267_200000210301 [1,0,0,0,0,0|3,0,0]=4 651 B15R1.1030 COCCCCc1ccc(cc1)[N+](=O)[O-] 7a_200000039267_200000210301 [1,0,0,0,0,0|3,0,0]=4 652 B15R1.1030 COCCCNc1ccc(cc1)C(=O)N 27a_100150723488_100000162191 [1,0,0,0,0,0|3,0,0]=4 653 B15R1.1030 COCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000740836 [1,0,0,0,0,0|3,0,0]=4 654 B15R1.1030 COCCCOc1ccc(cc1)C(=O)C 1458a_100000684957_200000210301 [1,0,0,0,0,0|2,0,1]=4 655 B15R1.1030 COCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000740836 [1,0,0,0,0,0|2,0,1]=4 656 B15R1.1030 COCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000740836 [1,0,0,0,0,0|2,0,1]=4 657 B15R1.1030 COCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000740836 [1,0,0,0,0,0|3,0,0]=4 658 B15R1.1030 COCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000740836 [1,0,0,0,0,0|3,0,0]=4 659 B15R1.1030 COCCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000684957_200025704644 [1,0,0,0,0,0|2,0,1]=4 660 B15R1.1030 COCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000709357 [1,0,0,0,0,0|2,0,1]=4 661 B15R1.1030 COCCCSc1ccc(cc1)C(=O)C 62a_100000709357_100000185465 [1,0,0,0,0,0|2,0,1]=4 662 B15R1.1030 COCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000709357 [1,0,0,0,0,0|3,0,0]=4 663 B15R1.1030 COCCCSc1ccc(cc1)C(=O)N 62a_100000709357_100000162191 [1,0,0,0,0,0|3,0,0]=4 664 B15R1.1030 COCCNCc1ccc(cc1)C(=O)C 2230a_100000209980_100000756337 [1,0,0,0,0,0|2,0,1]=4 665 B15R1.1030 COCCNCc1ccc(cc1)C(=O)N 207a_100000209980_100000038677 [1,0,0,0,0,0|3,0,0]=4 666 B15R1.1030 COCCNCc1ccc(cc1)C(=O)N 2230a_100000209980_100000231043 [1,0,0,0,0,0|3,0,0]=4 667 B15R1.1030 COCCNCc1ccc(cc1)C(=O)N 270004a_100000209980_100000038677 [1,0,0,0,0,0|3,0,0]=4 668 B15R1.1030 COCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000233755 [1,0,0,0,0,0|3,0,0]=4 669 B15R1.1030 COCCOCc1ccc(cc1)C(=O)C 34a_100000210237_100000756337 [1,0,0,0,0,0|2,0,1]=4 670 B15R1.1030 COCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000233755 [1,0,0,0,0,0|2,0,1]=4 671 B15R1.1030 COCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100011201679 [1,0,0,0,0,0|3,0,0]=4 672 B15R1.1030 COCCOCc1ccc(cc1)C(=O)N 34a_100000210237_100000231043 [1,0,0,0,0,0|3,0,0]=4 673 B15R1.1030 COCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000233755 [1,0,0,0,0,0|3,0,0]=4 674 B15R1.1030 COCCSCc1ccc(cc1)C(=O)C 62a_100000233755_100000756337 [1,0,0,0,0,0|2,0,1]=4 675 B15R1.1030 COCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000233755 [1,0,0,0,0,0|2,0,1]=4 676 B15R1.1030 COCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000233755 [1,0,0,0,0,0|3,0,0]=4 677 B15R1.1030 COCCSCc1ccc(cc1)C(=O)N 62a_100000233755_100000231043 [1,0,0,0,0,0|3,0,0]=4 678 B15R1.1030 COCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000766300 [1,0,0,0,0,0|3,0,0]=4 679 B15R1.1030 COCSCCc1ccc(cc1)C(=O)C 62a_100000766300_200000038727 [1,0,0,0,0,0|2,0,1]=4 680 B15R1.1030 COCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000766300 [1,0,0,0,0,0|2,0,1]=4 681 B15R1.1030 CSCCCNc1ccc(cc1)C(=O)N 27a_100000749238_100000162191 [1,0,0,0,0,0|3,0,0]=4 682 B15R1.1030 CSCCNCc1ccc(cc1)C(=O)C 2230a_100020590264_100000756337 [1,0,0,0,0,0|2,0,1]=4 683 B15R1.1030 CSCCNCc1ccc(cc1)C(=O)N 207a_100020590264_100000038677 [1,0,0,0,0,0|3,0,0]=4 684 B15R1.1030 CSCCNCc1ccc(cc1)C(=O)N 2230a_100020590264_100000231043 [1,0,0,0,0,0|3,0,0]=4 685 B15R1.1030 CSCCNCc1ccc(cc1)C(=O)N 270004a_100020590264_100000038677 [1,0,0,0,0,0|3,0,0]=4 686 B15R1.1030 CSCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000212216 [1,0,0,0,0,0|3,0,0]=4 687 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)C 34a_100000230434_100000756337 [1,0,0,0,0,0|2,0,1]=4 688 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000212216 [1,0,0,0,0,0|2,0,1]=4 689 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)C 7a_100000230434_100000756337 [1,0,0,0,0,0|2,0,1]=4 690 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000212216 [1,0,0,0,0,0|3,0,0]=4 691 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)N 34a_100000230434_100000231043 [1,0,0,0,0,0|3,0,0]=4 692 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000212216 [1,0,0,0,0,0|3,0,0]=4 693 B15R1.1030 CSCCOCc1ccc(cc1)C(=O)N 7a_100000230434_100000231043 [1,0,0,0,0,0|3,0,0]=4 694 B15R1.1030 CSCCSCc1ccc(cc1)C(=O)C 62a_100000212216_100000756337 [1,0,0,0,0,0|2,0,1]=4 695 B15R1.1030 CSCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000751147 [1,0,0,0,0,0|2,0,1]=4 696 B15R1.1030 CSCCSCc1ccc(cc1)C(=O)N 62a_100000212216_100000231043 [1,0,0,0,0,0|3,0,0]=4 697 B15R1.1030 CSCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000751147 [1,0,0,0,0,0|3,0,0]=4 698 B15R1.1030 CSCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100011218213 [1,0,0,0,0,0|3,0,0]=4 699 B15R1.1030 CSCSCCc1ccc(cc1)C(=O)C 62a_100011218213_200000038727 [1,0,0,0,0,0|2,0,1]=4 700 B15R1.1030 CSCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100011218213 [1,0,0,0,0,0|2,0,1]=4 701 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCF 207a_100015189416_100000038677 [1,0,0,0,0,0|3,0,0]=4 702 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCF 2230a_100015189416_100000231043 [1,0,0,0,0,0|3,0,0]=4 703 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCF 270004a_100015189416_100000038677 [1,0,0,0,0,0|3,0,0]=4 704 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCF 34a_100015189416_100000231043 [1,0,0,0,0,0|3,0,0]=4 705 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCO 207a_100000182051_100000038677 [1,0,0,0,0,0|3,0,0]=4 706 B15R1.1030 NC(=O)c1ccc(cc1)CNCCCO 270004a_100000182051_100000038677 [1,0,0,0,0,0|3,0,0]=4 707 B15R1.1030 NC(=O)c1ccc(cc1)COCCCBr 34a_100011217188_100000231043 [1,0,0,0,0,0|3,0,0]=4 708 B15R1.1030 NC(=O)c1ccc(cc1)COCCCCl 34a_100000230001_100000231043 [1,0,0,0,0,0|3,0,0]=4 709 B15R1.1030 NC(=O)c1ccc(cc1)COCCCF 34a_100000162016_100011934791 [1,0,0,0,0,0|3,0,0]=4 710 B15R1.1030 NC(=O)c1ccc(cc1)COCCCF 34a_100000759539_100000231043 [1,0,0,0,0,0|3,0,0]=4 711 B15R1.1030 NC(=O)c1ccc(cc1)COCCCF 7a_100000162016_100011934791 [1,0,0,0,0,0|3,0,0]=4 712 B15R1.1030 NC(=O)c1ccc(cc1)COCCCO 34a_100000162016_100000230001 [1,0,0,0,0,0|3,0,0]=4 713 B15R1.1030 NC(=O)c1ccc(cc1)COCCCO 7a_100000162016_100011215043 [1,0,0,0,0,0|3,0,0]=4 714 B15R1.1030 NC(=O)c1ccc(cc1)CSCCCF 62a_100000231043_100011934791 [1,0,0,0,0,0|3,0,0]=4 715 B15R1.1030 NC(=O)c1ccc(cc1)CSCCCF 62a_100011934791_100000231043 [1,0,0,0,0,0|3,0,0]=4 716 B15R1.1030 NC(=O)c1ccc(cc1)CSCCCO 62a_100000231043_100011215043 [1,0,0,0,0,0|3,0,0]=4 717 B15R1.1030 NC(=O)c1ccc(cc1)CSCCCO 62a_100011215043_100000231043 [1,0,0,0,0,0|3,0,0]=4 718 B15R1.1030 NC(=O)c1ccc(cc1)NCCCCF 34a_100000210537_100000729493 [1,0,0,0,0,0|3,0,0]=4 719 B15R1.1030 NC(=O)c1ccc(cc1)NCCCCO 27a_100000750430_100000162191 [1,0,0,0,0,0|3,0,0]=4 720 B15R1.1030 NC(=O)c1ccc(cc1)NCCCCO 34a_100000210537_100011216708 [1,0,0,0,0,0|3,0,0]=4 721 B15R1.1030 NC(=O)c1ccc(cc1)OCCCCF 34a_100000746352_100000729493 [1,0,0,0,0,0|3,0,0]=4 722 B15R1.1030 NC(=O)c1ccc(cc1)OCCCCF 7a_100000746352_100000729493 [1,0,0,0,0,0|3,0,0]=4 723 B15R1.1030 NC(=O)c1ccc(cc1)OCCCCO 34a_100000746352_100011216708 [1,0,0,0,0,0|3,0,0]=4 724 B15R1.1030 NC(=O)c1ccc(cc1)OCCCCO 7a_100000746352_100000210776 [1,0,0,0,0,0|3,0,0]=4 725 B15R1.1030 NC(=O)c1ccc(cc1)SCCCCF 62a_100000162191_100000729493 [1,0,0,0,0,0|3,0,0]=4 726 B15R1.1030 NC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_100000162191 [1,0,0,0,0,0|3,0,0]=4 727 B15R1.1030 NC(=O)c1ccc(cc1)SCCCCO 62a_100000162191_100000210776 [1,0,0,0,0,0|3,0,0]=4 728 B15R1.1030 NC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_100000162191 [1,0,0,0,0,0|3,0,0]=4 729 B15R1.1030 NCCCOCc1ccc(cc1)C(=O)N 34a_100000182051_100000231043 [1,0,0,0,0,0|3,0,0]=4 730 B15R1.1030 O=C(O)c1ccc(cc1)CCNCCF 269956a_100000704756_100011217306 [1,0,0,0,0,0|3,0,0]=4 731 B15R1.1030 O=C(O)c1ccc(cc1)CCNCCO 269956a_100000704756_100000211926 [1,0,0,0,0,0|3,0,0]=4 732 B15R1.1030 O=C(O)c1ccc(cc1)CNCCCF 269956a_100000181780_100011934791 [1,0,0,0,0,0|3,0,0]=4 733 B15R1.1030 O=C(O)c1ccc(cc1)CNCCCO 269956a_100000181780_100011215043 [1,0,0,0,0,0|3,0,0]=4 734 B15R1.1030 [13CH3]OCCCCc1ccc(cc1)[N+](=O)[O-] 34a_200000039267_200025704644 [1,0,0,0,0,0|3,0,0]=4 735 B15R1.1030 [13CH3]OCCCCc1ccc(cc1)[N+](=O)[O-] 7a_200000039267_200025704644 [1,0,0,0,0,0|3,0,0]=4 736 B15R1.1033 C/C=C/c1ccc(cc1)C=CCCCC 271570a_100016275911_100016259036 [1,0,0,0,0,0|0,0,3]=4 737 B15R1.1033 C/C=C/c1ccc(cc1)SCCCCF 62a_100000729493_100016259036 [1,0,0,0,0,0|2,0,1]=4 738 B15R1.1033 C/C=C/c1ccc(cc1)SCCCCF 62a_100016259036_100000729493 [1,0,0,0,0,0|2,0,1]=4 739 B15R1.1033 C/C=C/c1ccc(cc1)SCCCCO 62a_100000210776_100016259036 [1,0,0,0,0,0|2,0,1]=4 740 B15R1.1033 C/C=C/c1ccc(cc1)SCCCCO 62a_100016259036_100000210776 [1,0,0,0,0,0|2,0,1]=4 741 B15R1.1033 C/C=C/c1ccc(cc1)SCCCOC 62a_100000709357_100016259036 [1,0,0,0,0,0|2,0,1]=4 742 B15R1.1033 C/C=C/c1ccc(cc1)SCCCOC 62a_100016259036_100000709357 [1,0,0,0,0,0|2,0,1]=4 743 B15R1.1033 C/C=C/c1ccc(cc1)SCCOCC 62a_100000210147_100016259036 [1,0,0,0,0,0|2,0,1]=4 744 B15R1.1033 C/C=C/c1ccc(cc1)SCCOCC 62a_100016259036_100011215890 [1,0,0,0,0,0|2,0,1]=4 745 B15R1.1033 C/C=C/c1ccc(cc1)SCCSCC 62a_100000757381_100016259036 [1,0,0,0,0,0|2,0,1]=4 746 B15R1.1033 C/C=C/c1ccc(cc1)SCCSCC 62a_100016259036_100000757381 [1,0,0,0,0,0|2,0,1]=4 747 B15R1.1033 C=C=Cc1ccc(cc1)CCCCCC 271570a_100015277604_100009814338 [1,0,0,0,0,0|0,0,1]=2 748 B15R1.1033 C=C=Cc1ccc(cc1)CNCCCC 271570a_100015277604_100015187156 [1,0,0,0,0,0|1,0,1]=3 749 B15R1.1033 C=C=Cc1ccc(cc1)CNCCOC 271570a_100015277604_100015187160 [1,0,0,0,0,0|2,0,1]=4 750 B15R1.1033 C=C=Cc1ccc(cc1)COCCOC 271570a_100015277604_100000755069 [1,0,0,0,0,0|2,0,1]=4 751 B15R1.1033 C=C=Cc1ccc(cc1)OCCCCC 271570a_100015277604_200011214818 [1,0,0,0,0,0|1,0,1]=3 752 B15R1.1033 C=C=Cc1ccc(cc1)OCCCNC 271570a_100015277604_100102699777 [1,0,0,0,0,0|2,0,1]=4 753 B15R1.1033 C=C=Cc1ccc(cc1)OCCCOC 271570a_100015277604_200011326559 [1,0,0,0,0,0|2,0,1]=4 754 B15R1.1033 C=C=Cc1ccc(cc1)OCCNCC 271570a_100015277604_100000762749 [1,0,0,0,0,0|2,0,1]=4 755 B15R1.1033 C=C=Cc1ccc(cc1)OCCOCC 271570a_100015277604_200000169944 [1,0,0,0,0,0|2,0,1]=4 756 B15R1.1033 C=CCc1ccc(cc1)OCCCCC 34a_100000078792_100000718602 [1,0,0,0,0,0|1,0,1]=3 757 B15R1.1033 C=CCc1ccc(cc1)OCCCCC 7a_100000078792_100000210326 [1,0,0,0,0,0|1,0,1]=3 758 B15R1.1033 C=CCc1ccc(cc1)OCCCCF 34a_100000078792_100000729493 [1,0,0,0,0,0|2,0,1]=4 759 B15R1.1033 C=CCc1ccc(cc1)OCCCCF 7a_100000078792_100000729493 [1,0,0,0,0,0|2,0,1]=4 760 B15R1.1033 C=CCc1ccc(cc1)OCCCCO 34a_100000078792_100011216708 [1,0,0,0,0,0|2,0,1]=4 761 B15R1.1033 C=CCc1ccc(cc1)OCCCCO 7a_100000078792_100000210776 [1,0,0,0,0,0|2,0,1]=4 762 B15R1.1033 C=CCc1ccc(cc1)OCCCOC 34a_100000078792_100000740836 [1,0,0,0,0,0|2,0,1]=4 763 B15R1.1033 C=CCc1ccc(cc1)OCCCOC 7a_100000078792_100000740836 [1,0,0,0,0,0|2,0,1]=4 764 B15R1.1033 C=CCc1ccc(cc1)OCCOCC 34a_100000078792_100000210147 [1,0,0,0,0,0|2,0,1]=4 765 B15R1.1033 C=CCc1ccc(cc1)OCCOCC 7a_100000078792_100011215890 [1,0,0,0,0,0|2,0,1]=4 766 B15R1.1033 C=CCc1ccc(cc1)OCCSCC 34a_100000078792_100000757381 [1,0,0,0,0,0|2,0,1]=4 767 B15R1.1033 C=CCc1ccc(cc1)OCCSCC 7a_100000078792_100000757381 [1,0,0,0,0,0|2,0,1]=4 768 B15R1.1033 C=COc1ccc(cc1)SCCCCC 62a_100000210326_100000704263 [1,0,0,0,0,0|2,0,0]=3 769 B15R1.1033 C=COc1ccc(cc1)SCCCCC 62a_100000704263_100000210326 [1,0,0,0,0,0|2,0,0]=3 770 B15R1.1033 C=COc1ccc(cc1)SCCCCF 62a_100000704263_100000729493 [1,0,0,0,0,0|3,0,0]=4 771 B15R1.1033 C=COc1ccc(cc1)SCCCCF 62a_100000729493_100000704263 [1,0,0,0,0,0|3,0,0]=4 772 B15R1.1033 C=COc1ccc(cc1)SCCCCO 62a_100000210776_100000704263 [1,0,0,0,0,0|3,0,0]=4 773 B15R1.1033 C=COc1ccc(cc1)SCCCCO 62a_100000704263_100000210776 [1,0,0,0,0,0|3,0,0]=4 774 B15R1.1033 C=COc1ccc(cc1)SCCCOC 62a_100000704263_100000709357 [1,0,0,0,0,0|3,0,0]=4 775 B15R1.1033 C=COc1ccc(cc1)SCCCOC 62a_100000709357_100000704263 [1,0,0,0,0,0|3,0,0]=4 776 B15R1.1033 C=COc1ccc(cc1)SCCOCC 62a_100000210147_100000704263 [1,0,0,0,0,0|3,0,0]=4 777 B15R1.1033 C=COc1ccc(cc1)SCCOCC 62a_100000704263_100011215890 [1,0,0,0,0,0|3,0,0]=4 778 B15R1.1033 C=COc1ccc(cc1)SCCSCC 62a_100000704263_100000757381 [1,0,0,0,0,0|3,0,0]=4 779 B15R1.1033 C=COc1ccc(cc1)SCCSCC 62a_100000757381_100000704263 [1,0,0,0,0,0|3,0,0]=4 780 B15R1.1033 CC=Cc1ccc(cc1)CCCCCC 271570a_100016259895_100009814338 [1,0,0,0,0,0|0,0,1]=2 781 B15R1.1033 CC=Cc1ccc(cc1)CNCCCC 271570a_100016259895_100015187156 [1,0,0,0,0,0|1,0,1]=3 782 B15R1.1033 CC=Cc1ccc(cc1)CNCCOC 271570a_100016259895_100015187160 [1,0,0,0,0,0|2,0,1]=4 783 B15R1.1033 CC=Cc1ccc(cc1)COCCOC 271570a_100016259895_100000755069 [1,0,0,0,0,0|2,0,1]=4 784 B15R1.1033 CC=Cc1ccc(cc1)OCCCCC 271570a_100016259895_200011214818 [1,0,0,0,0,0|1,0,1]=3 785 B15R1.1033 CC=Cc1ccc(cc1)OCCCNC 271570a_100016259895_100102699777 [1,0,0,0,0,0|2,0,1]=4 786 B15R1.1033 CC=Cc1ccc(cc1)OCCCOC 271570a_100016259895_200011326559 [1,0,0,0,0,0|2,0,1]=4 787 B15R1.1033 CC=Cc1ccc(cc1)OCCNCC 271570a_100016259895_100000762749 [1,0,0,0,0,0|2,0,1]=4 788 B15R1.1033 CC=Cc1ccc(cc1)OCCOCC 271570a_100016259895_200000169944 [1,0,0,0,0,0|2,0,1]=4 789 B15R1.1033 CCCCCCc1ccc(cc1)CNC 2230a_200000080172_200000210301 [1,0,0,0,0,0|1,0,2]=4 790 B15R1.1033 CCCCCCc1ccc(cc1)CNC 26a_100102657272_100000011238 [1,0,0,0,0,0|1,0,2]=4 791 B15R1.1033 CCCCCCc1ccc(cc1)CNC 34a_200000080172_200000210301 [1,0,0,0,0,0|1,0,2]=4 792 B15R1.1033 CCCCCCc1ccc(cc1)CN[13CH3] 2230a_200000080172_200025704644 [1,0,0,0,0,0|1,0,2]=4 793 B15R1.1033 CCCCCCc1ccc(cc1)CN[13CH3] 34a_200000080172_200025704644 [1,0,0,0,0,0|1,0,2]=4 794 B15R1.1033 CCCCCCc1ccc(cc1)NCC 2230a_100000035805_100000210202 [1,0,0,0,0,0|1,0,2]=4 795 B15R1.1033 CCCCCCc1ccc(cc1)NCC 34a_100000035805_100000210202 [1,0,0,0,0,0|1,0,2]=4 796 B15R1.1033 CCCCCCc1ccc(cc1)NCC 7a_100000035805_100000210202 [1,0,0,0,0,0|1,0,2]=4 797 B15R1.1033 CCCCCCc1ccc(cc1)NCF 34a_100000035805_100015361967 [1,0,0,0,0,0|2,0,1]=4 798 B15R1.1033 CCCCCCc1ccc(cc1)NCF 7a_100000035805_100015361967 [1,0,0,0,0,0|2,0,1]=4 799 B15R1.1033 CCCCCCc1ccc(cc1)OCC 34a_100000011238_100000210202 [1,0,0,0,0,0|1,0,2]=4 800 B15R1.1033 CCCCCCc1ccc(cc1)OCC 7a_100000011238_100000210202 [1,0,0,0,0,0|1,0,2]=4 801 B15R1.1033 CCCCCCc1ccc(cc1)OCF 34a_100000011238_100015361967 [1,0,0,0,0,0|2,0,1]=4 802 B15R1.1033 CCCCCCc1ccc(cc1)OCF 7a_100000011238_100015361967 [1,0,0,0,0,0|2,0,1]=4 803 B15R1.1033 CCCCCCc1ccc(cc1)SCC 62a_100000210202_100009814338 [1,0,0,0,0,0|1,0,2]=4 804 B15R1.1033 CCCCCCc1ccc(cc1)SCC 62a_100009814338_100000210202 [1,0,0,0,0,0|1,0,2]=4 805 B15R1.1033 CCCCCCc1ccc(cc1)SCF 62a_100009814338_100015361967 [1,0,0,0,0,0|2,0,1]=4 806 B15R1.1033 CCCCCCc1ccc(cc1)SCF 62a_100015361967_100009814338 [1,0,0,0,0,0|2,0,1]=4 807 B15R1.1033 CCCCCSc1ccc(cc1)CC=O 62a_100000210326_100011361690 [1,0,0,0,0,0|2,0,1]=4 808 B15R1.1033 CCCCCSc1ccc(cc1)CC=O 62a_100011361690_100000210326 [1,0,0,0,0,0|2,0,1]=4 809 B15R1.1033 CCOCCSc1ccc(cc1)/C=C/Br 62a_100000210147_200016255901 [1,0,0,0,0,0|3,0,0]=4 810 B15R1.1033 CCOCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100011215890 [1,0,0,0,0,0|3,0,0]=4 811 B15R1.1033 CCSCCSc1ccc(cc1)/C=C/Br 62a_100000757381_200016255901 [1,0,0,0,0,0|3,0,0]=4 812 B15R1.1033 CCSCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000757381 [1,0,0,0,0,0|3,0,0]=4 813 B15R1.1033 COCCCSc1ccc(cc1)/C=C/Br 62a_100000709357_200016255901 [1,0,0,0,0,0|3,0,0]=4 814 B15R1.1033 COCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000709357 [1,0,0,0,0,0|3,0,0]=4 815 B15R1.1033 FCCCCSc1ccc(cc1)/C=C/Br 62a_100000729493_200016255901 [1,0,0,0,0,0|3,0,0]=4 816 B15R1.1033 FCCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000729493 [1,0,0,0,0,0|3,0,0]=4 817 B15R1.1033 OCCCCSc1ccc(cc1)/C=C/Br 62a_100000210776_200016255901 [1,0,0,0,0,0|3,0,0]=4 818 B15R1.1033 OCCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000210776 [1,0,0,0,0,0|3,0,0]=4 819 B17R1.327 CCCCCNc1ccc(c(c1)Cl)C(=O)NC 34a_100000742945_100000718602 [0,1,0,0,0,0|2,0,1]=4 820 B17R1.327 CCCCCNc1ccc(c(c1)Cl)C(=O)NC 7a_100000742945_100000210326 [0,1,0,0,0,0|2,0,1]=4 821 B17R1.327 CCCCCNc1ccc(c(c1)F)C(=O)CC 27a_100000209983_100012360378 [0,1,0,0,0,0|1,0,2]=4 822 B17R1.327 CCCCCNc1ccc(c(c1)F)C(=O)NC 27a_100000209983_100000233932 [0,1,0,0,0,0|2,0,1]=4 823 B17R1.327 CCCCCNc1ccc(c(c1)F)C(=O)NC 34a_100011533607_100000718602 [0,1,0,0,0,0|2,0,1]=4 824 B17R1.327 CCCCCNc1ccc(c(c1)F)C(=O)NC 7a_100011533607_100000210326 [0,1,0,0,0,0|2,0,1]=4 825 B17R1.327 CCCCCNc1ccc(c(c1)O)C(=O)NC 34a_100000223174_100000718602 [0,1,0,0,0,0|2,0,1]=4 826 B17R1.327 CCCCCOc1ccc(c(c1)Br)C(=O)OC 34a_100010150825_100000718602 [0,1,0,0,0,0|2,0,1]=4 827 B17R1.327 CCCCCOc1ccc(c(c1)Br)C(=O)OC 7a_100010150825_100000210326 [0,1,0,0,0,0|2,0,1]=4 828 B17R1.327 CCCCCOc1ccc(c(c1)C)C(=O)OC 34a_100012000157_100000718602 [0,1,0,0,0,0|2,0,1]=4 829 B17R1.327 CCCCCOc1ccc(c(c1)C)C(=O)OC 7a_100012000157_100000210326 [0,1,0,0,0,0|2,0,1]=4 830 B17R1.327 CCCCCOc1ccc(c(c1)Cl)C(=O)OC 34a_100000081488_100000718602 [0,1,0,0,0,0|2,0,1]=4 831 B17R1.327 CCCCCOc1ccc(c(c1)Cl)C(=O)OC 7a_100000081488_100000210326 [0,1,0,0,0,0|2,0,1]=4 832 B17R1.327 CCCCCOc1ccc(c(c1)F)C(=O)OC 34a_100011999631_100000718602 [0,1,0,0,0,0|2,0,1]=4 833 B17R1.327 CCCCCOc1ccc(c(c1)F)C(=O)OC 7a_100011999631_100000210326 [0,1,0,0,0,0|2,0,1]=4 834 B17R1.327 CCCCCOc1ccc(c(c1)N)C(=O)OC 34a_100000701581_100000718602 [0,1,0,0,0,0|2,0,1]=4 835 B17R1.327 CCCCCOc1ccc(c(c1)N)C(=O)OC 7a_100000701581_100000210326 [0,1,0,0,0,0|2,0,1]=4 836 B17R1.327 CCCCCSc1ccc(c(c1)Br)C(=O)OC 62a_100000210326_100010247156 [0,1,0,0,0,0|2,0,1]=4 837 B17R1.327 CCCCCSc1ccc(c(c1)Br)C(=O)OC 62a_100010247156_100000210326 [0,1,0,0,0,0|2,0,1]=4 838 B17R1.327 CCCCCSc1ccc(c(c1)C)C(=O)CC 62a_100000210326_200012361375 [0,1,0,0,0,0|1,0,2]=4 839 B17R1.327 CCCCCSc1ccc(c(c1)C)C(=O)CC 62a_200012361375_100000210326 [0,1,0,0,0,0|1,0,2]=4 840 B17R1.327 CCCCCSc1ccc(c(c1)C)C(=O)OC 62a_100000210326_100000747612 [0,1,0,0,0,0|2,0,1]=4 841 B17R1.327 CCCCCSc1ccc(c(c1)C)C(=O)OC 62a_100000747612_100000210326 [0,1,0,0,0,0|2,0,1]=4 842 B17R1.327 CCCCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000060724_100000210326 [0,1,0,0,0,0|2,0,1]=4 843 B17R1.327 CCCCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000210326_100000060724 [0,1,0,0,0,0|2,0,1]=4 844 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)CC 62a_100000210326_100012360378 [0,1,0,0,0,0|1,0,2]=4 845 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)CC 62a_100012360378_100000210326 [0,1,0,0,0,0|1,0,2]=4 846 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)NC 62a_100000210326_100000233932 [0,1,0,0,0,0|2,0,1]=4 847 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)NC 62a_100000233932_100000210326 [0,1,0,0,0,0|2,0,1]=4 848 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)OC 62a_100000210326_100000216654 [0,1,0,0,0,0|2,0,1]=4 849 B17R1.327 CCCCCSc1ccc(c(c1)F)C(=O)OC 62a_100000216654_100000210326 [0,1,0,0,0,0|2,0,1]=4 850 B17R1.327 CCCCCSc1ccc(c(c1)N)C(=O)OC 62a_100011373473_100000210326 [0,1,0,0,0,0|2,0,1]=4 851 B17R1.327 CCCCCSc1ccc(c(c1)O)C(=O)OC 62a_100000210326_100000062286 [0,1,0,0,0,0|2,0,1]=4 852 B17R1.327 CCCCNCc1ccc(c(c1)Br)C(=O)OC 2230a_100000102301_100012340598 [0,1,0,0,0,0|2,0,1]=4 853 B17R1.327 CCCCNCc1ccc(c(c1)Br)C(=O)OC 7a_106832991798_100012340598 [0,1,0,0,0,0|2,0,1]=4 854 B17R1.327 CCCCNCc1ccc(c(c1)C)C(=O)OC 2230a_100000102301_100010991300 [0,1,0,0,0,0|2,0,1]=4 855 B17R1.327 CCCCNCc1ccc(c(c1)C)C(=O)OC 270004a_100000102301_100010370968 [0,1,0,0,0,0|2,0,1]=4 856 B17R1.327 CCCCNCc1ccc(c(c1)C)C(=O)OC 7a_106832991798_100010991300 [0,1,0,0,0,0|2,0,1]=4 857 B17R1.327 CCCCNCc1ccc(c(c1)Cl)C(=O)OC 2230a_100000102301_100010128985 [0,1,0,0,0,0|2,0,1]=4 858 B17R1.327 CCCCNCc1ccc(c(c1)Cl)C(=O)OC 270004a_100000102301_100010630601 [0,1,0,0,0,0|2,0,1]=4 859 B17R1.327 CCCCNCc1ccc(c(c1)Cl)C(=O)OC 7a_106832991798_100010128985 [0,1,0,0,0,0|2,0,1]=4 860 B17R1.327 CCCCNCc1ccc(c(c1)F)C(=O)OC 2230a_100000102301_100000686969 [0,1,0,0,0,0|2,0,1]=4 861 B17R1.327 CCCCNCc1ccc(c(c1)F)C(=O)OC 270004a_100000102301_100012457946 [0,1,0,0,0,0|2,0,1]=4 862 B17R1.327 CCCCNCc1ccc(c(c1)F)C(=O)OC 7a_106832991798_100000686969 [0,1,0,0,0,0|2,0,1]=4 863 B17R1.327 CCCCOCc1ccc(c(c1)Br)C(=O)OC 34a_100000210227_100012340598 [0,1,0,0,0,0|2,0,1]=4 864 B17R1.327 CCCCOCc1ccc(c(c1)Br)C(=O)OC 7a_100000210227_100012340598 [0,1,0,0,0,0|2,0,1]=4 865 B17R1.327 CCCCOCc1ccc(c(c1)C)C(=O)OC 34a_100000210227_100010991300 [0,1,0,0,0,0|2,0,1]=4 866 B17R1.327 CCCCOCc1ccc(c(c1)C)C(=O)OC 7a_100000210227_100010991300 [0,1,0,0,0,0|2,0,1]=4 867 B17R1.327 CCCCOCc1ccc(c(c1)Cl)C(=O)OC 34a_100000210227_100010128985 [0,1,0,0,0,0|2,0,1]=4 868 B17R1.327 CCCCOCc1ccc(c(c1)Cl)C(=O)OC 7a_100000210227_100010128985 [0,1,0,0,0,0|2,0,1]=4 869 B17R1.327 CCCCOCc1ccc(c(c1)F)C(=O)OC 34a_100000210227_100000686969 [0,1,0,0,0,0|2,0,1]=4 870 B17R1.327 CCCCOCc1ccc(c(c1)F)C(=O)OC 34a_100012183857_100000210210 [0,1,0,0,0,0|2,0,1]=4 871 B17R1.327 CCCCOCc1ccc(c(c1)F)C(=O)OC 7a_100000210227_100000686969 [0,1,0,0,0,0|2,0,1]=4 872 B17R1.327 CCCCOCc1ccc(c(c1)F)C(=O)OC 7a_100012183857_100000210211 [0,1,0,0,0,0|2,0,1]=4 873 B17R1.327 CCCCSCc1ccc(c(c1)Br)C(=O)OC 62a_100000210211_100012340598 [0,1,0,0,0,0|2,0,1]=4 874 B17R1.327 CCCCSCc1ccc(c(c1)Br)C(=O)OC 62a_100012340598_100000210210 [0,1,0,0,0,0|2,0,1]=4 875 B17R1.327 CCCCSCc1ccc(c(c1)C)C(=O)OC 62a_100000210211_100010991300 [0,1,0,0,0,0|2,0,1]=4 876 B17R1.327 CCCCSCc1ccc(c(c1)C)C(=O)OC 62a_100010991300_100000210210 [0,1,0,0,0,0|2,0,1]=4 877 B17R1.327 CCCCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100000210211_100010128985 [0,1,0,0,0,0|2,0,1]=4 878 B17R1.327 CCCCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100010128985_100000210210 [0,1,0,0,0,0|2,0,1]=4 879 B17R1.327 CCCCSCc1ccc(c(c1)F)C(=O)OC 62a_100000210211_100000686969 [0,1,0,0,0,0|2,0,1]=4 880 B17R1.327 CCCCSCc1ccc(c(c1)F)C(=O)OC 62a_100000686969_100000210210 [0,1,0,0,0,0|2,0,1]=4 881 B17R1.715 C#CCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000184674 [0,1,0,0,0,0|0,0,2]=3 882 B17R1.715 C#CCC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100000184674 [0,1,0,0,0,0|1,0,2]=4 883 B17R1.715 C=CCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000210623 [0,1,0,0,0,0|0,0,0]=1 884 B17R1.715 C=CCC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100000210623 [0,1,0,0,0,0|1,0,0]=2 885 B17R1.715 C=CCC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100000210623 [0,1,0,0,0,0|2,0,0]=3 886 B17R1.715 C=CCC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100000210623 [0,1,0,0,0,0|2,0,0]=3 887 B17R1.715 C=CCC(O)c1ccc(cc1)SCCCCC 62a_100000210326_100011466436 [0,1,0,0,0,0|1,0,2]=4 888 B17R1.715 C=CCC(O)c1ccc(cc1)SCCCCC 62a_100011466436_100000210326 [0,1,0,0,0,0|1,0,2]=4 889 B17R1.715 CC#CC(=O)c1ccc(cc1)SCCCCC 62a_100000210326_100153741113 [0,1,0,0,0,0|1,0,2]=4 890 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CC#N 1458a_100000032748_100011214920 [0,1,0,0,0,0|0,0,2]=3 891 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CCC 1458a_100000032748_100000210303 [0,1,0,0,0,0|0,0,2]=3 892 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CCF 1458a_100000032748_100011217306 [0,1,0,0,0,0|0,0,2]=3 893 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CCO 1458a_100000032748_100000211926 [0,1,0,0,0,0|0,0,2]=3 894 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000010291 [0,1,0,0,0,0|0,0,2]=3 895 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CNC 34a_100102657272_100000010291 [0,1,0,0,0,0|0,0,2]=3 896 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000010291 [0,1,0,0,0,0|0,0,2]=3 897 B17R1.715 CCCCCCc1ccc(cc1)C(=O)COC 34a_100138415774_100000010291 [0,1,0,0,0,0|0,0,2]=3 898 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CSC 62a_100000010291_200000210301 [0,1,0,0,0,0|0,0,2]=3 899 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000010291 [0,1,0,0,0,0|0,0,2]=3 900 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000010291_200025704644 [0,1,0,0,0,0|0,0,2]=3 901 B17R1.715 CCCCCCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000010291 [0,1,0,0,0,0|0,0,2]=3 902 B17R1.715 CCCCCCc1ccc(cc1)C(=O)NCC 11a_100015525214_100000032748 [0,1,0,0,0,0|0,0,2]=3 903 B17R1.715 CCCCCCc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000032748 [0,1,0,0,0,0|0,0,2]=3 904 B17R1.715 CCCCCCc1ccc(cc1)C(=O)NCC 527a_100015525214_100000032748 [0,1,0,0,0,0|0,0,2]=3 905 B17R1.715 CCCCCCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000032748 [0,1,0,0,0,0|1,0,1]=3 906 B17R1.715 CCCCCNc1ccc(cc1)C(=O)NCC 2230a_100000741011_100000210326 [0,1,0,0,0,0|1,0,2]=4 907 B17R1.715 CCCCCNc1ccc(cc1)C(=O)NCC 27a_100000209983_100000155177 [0,1,0,0,0,0|1,0,2]=4 908 B17R1.715 CCCCCNc1ccc(cc1)C(=O)NCC 34a_100000741011_100000718602 [0,1,0,0,0,0|1,0,2]=4 909 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CC#N 1458a_100000186157_100011214920 [0,1,0,0,0,0|1,0,2]=4 910 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CC#N 7a_100009871544_100000210326 [0,1,0,0,0,0|1,0,2]=4 911 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCC 1458a_100000186157_100000210303 [0,1,0,0,0,0|1,0,2]=4 912 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCC 34a_100011216482_100000718602 [0,1,0,0,0,0|1,0,2]=4 913 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCC 7a_100011216482_100000210326 [0,1,0,0,0,0|1,0,2]=4 914 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCCl 7a_100009879949_100000210326 [0,1,0,0,0,0|1,0,2]=4 915 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCF 1458a_100000186157_100011217306 [0,1,0,0,0,0|1,0,2]=4 916 B17R1.715 CCCCCOc1ccc(cc1)C(=O)CCO 1458a_100000186157_100000211926 [0,1,0,0,0,0|1,0,2]=4 917 B17R1.715 CCCCCOc1ccc(cc1)C(=O)COC 34a_200009861119_100000718602 [0,1,0,0,0,0|1,0,2]=4 918 B17R1.715 CCCCCOc1ccc(cc1)C(=O)COC 7a_200009861119_100000210326 [0,1,0,0,0,0|1,0,2]=4 919 B17R1.715 CCCCCOc1ccc(cc1)C(=O)NCC 11a_100015525214_100000186157 [0,1,0,0,0,0|1,0,2]=4 920 B17R1.715 CCCCCOc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000186157 [0,1,0,0,0,0|1,0,2]=4 921 B17R1.715 CCCCCOc1ccc(cc1)C(=O)NCC 527a_100015525214_100000186157 [0,1,0,0,0,0|1,0,2]=4 922 B17R1.715 CCCCCOc1ccc(cc1)C(=O)NNC 22a_100016993582_100000186157 [0,1,0,0,0,0|2,0,1]=4 923 B17R1.715 CCCCCOc1ccc(cc1)C(=O)OCC 34a_100000169885_100000718602 [0,1,0,0,0,0|1,0,2]=4 924 B17R1.715 CCCCCOc1ccc(cc1)C(=O)OCC 7a_100000169885_100000210326 [0,1,0,0,0,0|1,0,2]=4 925 B17R1.715 CCCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000210326_200020603514 [0,1,0,0,0,0|2,0,0]=3 926 B17R1.715 CCCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100000210326 [0,1,0,0,0,0|2,0,0]=3 927 B17R1.715 CCCCCSc1ccc(cc1)C(=O)CC#N 62a_100000210326_100000740217 [0,1,0,0,0,0|1,0,2]=4 928 B17R1.715 CCCCCSc1ccc(cc1)C(=O)CC#N 62a_100000740217_100000210326 [0,1,0,0,0,0|1,0,2]=4 929 B17R1.715 CCCCCSc1ccc(cc1)C(=O)CCC 62a_100000210326_100011267722 [0,1,0,0,0,0|1,0,2]=4 930 B17R1.715 CCCCCSc1ccc(cc1)C(=O)CCC 62a_100011267722_100000210326 [0,1,0,0,0,0|1,0,2]=4 931 B17R1.715 CCCCCSc1ccc(cc1)C(=O)COC 62a_200011343064_100000210326 [0,1,0,0,0,0|1,0,2]=4 932 B17R1.715 CCCCCSc1ccc(cc1)C(=O)NCC 62a_100000155177_100000210326 [0,1,0,0,0,0|1,0,2]=4 933 B17R1.715 CCCCCSc1ccc(cc1)C(=O)NCC 62a_100000210326_100000155177 [0,1,0,0,0,0|1,0,2]=4 934 B17R1.715 CCCCCSc1ccc(cc1)C(=O)OCC 62a_100000169895_100000210326 [0,1,0,0,0,0|1,0,2]=4 935 B17R1.715 CCCCCSc1ccc(cc1)C(=O)OCC 62a_100000210326_100000169919 [0,1,0,0,0,0|1,0,2]=4 936 B17R1.715 CCCCNCc1ccc(cc1)C(=O)NCC 2230a_100000102301_100011266492 [0,1,0,0,0,0|1,0,2]=4 937 B17R1.715 CCCCNCc1ccc(cc1)C(=O)NCC 7a_106832991798_100011266492 [0,1,0,0,0,0|1,0,2]=4 938 B17R1.715 CCCCNCc1ccc(cc1)C(=O)OCC 2230a_100000102301_100009812261 [0,1,0,0,0,0|1,0,2]=4 939 B17R1.715 CCCCNCc1ccc(cc1)C(=O)OCC 270004a_100000102301_100000170165 [0,1,0,0,0,0|1,0,2]=4 940 B17R1.715 CCCCNCc1ccc(cc1)C(=O)OCC 7a_106832991798_100009812261 [0,1,0,0,0,0|1,0,2]=4 941 B17R1.715 CCCCOCc1ccc(cc1)C(=O)NCC 34a_100000210227_100011266492 [0,1,0,0,0,0|1,0,2]=4 942 B17R1.715 CCCCOCc1ccc(cc1)C(=O)NCC 7a_100000210227_100011266492 [0,1,0,0,0,0|1,0,2]=4 943 B17R1.715 CCCCOCc1ccc(cc1)C(=O)OCC 34a_100000210227_100009812261 [0,1,0,0,0,0|1,0,2]=4 944 B17R1.715 CCCCOCc1ccc(cc1)C(=O)OCC 7a_100000210227_100009812261 [0,1,0,0,0,0|1,0,2]=4 945 B17R1.715 CCCCSCc1ccc(cc1)C(=O)NCC 62a_100000210211_100011266492 [0,1,0,0,0,0|1,0,2]=4 946 B17R1.715 CCCCSCc1ccc(cc1)C(=O)NCC 62a_100011266492_100000210210 [0,1,0,0,0,0|1,0,2]=4 947 B17R1.715 CCCCSCc1ccc(cc1)C(=O)OCC 62a_100000210211_100009812261 [0,1,0,0,0,0|1,0,2]=4 948 B17R1.715 CCCCSCc1ccc(cc1)C(=O)OCC 62a_100009812261_100000210210 [0,1,0,0,0,0|1,0,2]=4 949 B17R1.715 CCOCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000210147_200020603514 [0,1,0,0,0,0|3,0,0]=4 950 B17R1.715 CCOCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100011215890 [0,1,0,0,0,0|3,0,0]=4 951 B17R1.715 CCSCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000757381_200020603514 [0,1,0,0,0,0|3,0,0]=4 952 B17R1.715 CCSCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100000757381 [0,1,0,0,0,0|3,0,0]=4 953 B17R1.715 COCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000709357_200020603514 [0,1,0,0,0,0|3,0,0]=4 954 B17R1.715 COCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100000709357 [0,1,0,0,0,0|3,0,0]=4 955 B17R1.715 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCF 62a_100000729493_200020603514 [0,1,0,0,0,0|3,0,0]=4 956 B17R1.715 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCF 62a_200020603514_100000729493 [0,1,0,0,0,0|3,0,0]=4 957 B17R1.715 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCO 62a_100000210776_200020603514 [0,1,0,0,0,0|3,0,0]=4 958 B17R1.715 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCO 62a_200020603514_100000210776 [0,1,0,0,0,0|3,0,0]=4 959 B17R1.962 CCCC(=O)CCc1ccc(cc1)C(=O)OC 1458a_100000070832_100000210303 [0,1,0,0,0,0|1,0,2]=4 960 B17R1.962 CCCC(=O)CCc1ccc(cc1)C(=O)OC 1458a_100000211992_100010192280 [0,1,0,0,0,0|1,0,2]=4 961 B17R1.962 CCCC(=O)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000747444 [0,1,0,0,0,0|2,0,1]=4 962 B17R1.962 CCCC(=O)CSc1ccc(cc1)C(=O)C=O 62a_100000747444_100000725942 [0,1,0,0,0,0|2,0,1]=4 963 B17R1.962 CCCC(C)CNc1ccc(cc1)C(=O)NC 2230a_100000184841_100011216630 [0,1,0,0,0,0|2,0,1]=4 964 B17R1.962 CCCC(C)CNc1ccc(cc1)C(=O)NC 34a_100000184841_100011216630 [0,1,0,0,0,0|2,0,1]=4 965 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CBr 7a_100009814261_100011216630 [0,1,0,0,0,0|2,0,1]=4 966 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CC 34a_100000212119_100011216630 [0,1,0,0,0,0|1,0,2]=4 967 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CC 7a_100000212119_100011216630 [0,1,0,0,0,0|1,0,2]=4 968 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CCl 7a_100000018856_100011216630 [0,1,0,0,0,0|2,0,1]=4 969 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CF 34a_200010654591_100011216630 [0,1,0,0,0,0|2,0,1]=4 970 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)CF 7a_200010654591_100011216630 [0,1,0,0,0,0|2,0,1]=4 971 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)NC 34a_100000192141_100011216630 [0,1,0,0,0,0|2,0,1]=4 972 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)NC 7a_100000192141_100011216630 [0,1,0,0,0,0|2,0,1]=4 973 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)NN 34a_100000185078_100011216630 [0,1,0,0,0,0|3,0,0]=4 974 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)OC 34a_100000150123_100011216630 [0,1,0,0,0,0|2,0,1]=4 975 B17R1.962 CCCC(C)COc1ccc(cc1)C(=O)OC 7a_100000150123_100011216630 [0,1,0,0,0,0|2,0,1]=4 976 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)C#N 62a_100011216630_100009994572 [0,1,0,0,0,0|2,0,1]=4 977 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011216630 [0,1,0,0,0,0|2,0,0]=3 978 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)C=O 62a_100011216630_100000725942 [0,1,0,0,0,0|2,0,0]=3 979 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CC 62a_100000211647_100011216630 [0,1,0,0,0,0|1,0,2]=4 980 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CC 62a_100011216630_100000211647 [0,1,0,0,0,0|1,0,2]=4 981 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CN 62a_100000017248_100011216630 [0,1,0,0,0,0|2,0,1]=4 982 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CN 62a_100011216630_100000017248 [0,1,0,0,0,0|2,0,1]=4 983 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CO 62a_100011216630_100011219529 [0,1,0,0,0,0|2,0,1]=4 984 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)CO 62a_100011219529_100011216630 [0,1,0,0,0,0|2,0,1]=4 985 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)NC 62a_100000155074_100011216630 [0,1,0,0,0,0|2,0,1]=4 986 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)NC 62a_100011216630_100000155074 [0,1,0,0,0,0|2,0,1]=4 987 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)NN 62a_100000183614_100011216630 [0,1,0,0,0,0|3,0,0]=4 988 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)NN 62a_100011216630_100000183614 [0,1,0,0,0,0|3,0,0]=4 989 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)OC 62a_100000150774_100011216630 [0,1,0,0,0,0|2,0,1]=4 990 B17R1.962 CCCC(C)CSc1ccc(cc1)C(=O)OC 62a_100011216630_100000150774 [0,1,0,0,0,0|2,0,1]=4 991 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 207a_100000741246_100000043907 [0,1,0,0,0,0|2,0,1]=4 992 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 2230a_100000741246_100000753832 [0,1,0,0,0,0|2,0,1]=4 993 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000766640 [0,1,0,0,0,0|2,0,1]=4 994 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 270004a_100000741246_100000043907 [0,1,0,0,0,0|2,0,1]=4 995 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 270004a_100000743749_100000211909 [0,1,0,0,0,0|2,0,1]=4 996 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)NC 34a_100000743749_100000766640 [0,1,0,0,0,0|2,0,1]=4 997 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)OC 2230a_100000741246_100000735637 [0,1,0,0,0,0|2,0,1]=4 998 B17R1.962 CCCC(C)NCc1ccc(cc1)C(=O)OC 270004a_100000741246_100000148700 [0,1,0,0,0,0|2,0,1]=4 999 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)NC 34a_100000764384_100000753832 [0,1,0,0,0,0|2,0,1]=4 1000 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)NC 7a_100000764384_100000753832 [0,1,0,0,0,0|2,0,1]=4 1001 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)OC 34a_100000151488_100000766640 [0,1,0,0,0,0|2,0,1]=4 1002 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)OC 34a_100000764384_100000735637 [0,1,0,0,0,0|2,0,1]=4 1003 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)OC 7a_100000151488_100000766640 [0,1,0,0,0,0|2,0,1]=4 1004 B17R1.962 CCCC(C)OCc1ccc(cc1)C(=O)OC 7a_100000764384_100000735637 [0,1,0,0,0,0|2,0,1]=4 1005 B17R1.962 CCCC(C)SCc1ccc(cc1)C(=O)NC 62a_100000753832_100000766640 [0,1,0,0,0,0|2,0,1]=4 1006 B17R1.962 CCCC(C)SCc1ccc(cc1)C(=O)NC 62a_100000766640_100000753832 [0,1,0,0,0,0|2,0,1]=4 1007 B17R1.962 CCCC(C)SCc1ccc(cc1)C(=O)OC 62a_100000735637_100000766640 [0,1,0,0,0,0|2,0,1]=4 1008 B17R1.962 CCCC(C)SCc1ccc(cc1)C(=O)OC 62a_100000766640_100000187170 [0,1,0,0,0,0|2,0,1]=4 1009 B17R1.962 CCCN(C)CCc1ccc(cc1)C(=O)OC 2230a_100000747261_100010192280 [0,1,0,0,0,0|2,0,1]=4 1010 B17R1.962 CCCN(C)CCc1ccc(cc1)C(=O)OC 269982a_100000747261_100010192280 [0,1,0,0,0,0|2,0,1]=4 1011 B17R1.962 COCC(O)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215053 [0,1,0,0,0,0|3,0,0]=4 1012 B17R1.962 COCC(O)CSc1ccc(cc1)C(=O)C=O 62a_100011215053_100000725942 [0,1,0,0,0,0|3,0,0]=4 1013 B17R1.1155 CCC(=O)CCCc1ccc(cc1)C(=O)OC 1458a_100000210414_100010192279 [0,1,0,0,0,0|1,0,2]=4 1014 B17R1.1155 CCC(=O)c1ccc(cc1)CNCC(C)CC 26a_100020588543_100000212119 [0,1,0,0,0,0|1,0,2]=4 1015 B17R1.1155 CCC(C)CCNc1ccc(cc1)C(=O)NC 27a_100020591266_100000155074 [0,1,0,0,0,0|2,0,1]=4 1016 B17R1.1155 CCC(C)CCNc1ccc(cc1)C(=O)NN 27a_100020591266_100000183614 [0,1,0,0,0,0|3,0,0]=4 1017 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)CBr 26a_100020588543_100009814261 [0,1,0,0,0,0|2,0,1]=4 1018 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)CCl 26a_100020588543_100000018856 [0,1,0,0,0,0|2,0,1]=4 1019 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)CF 26a_100020588543_200010654591 [0,1,0,0,0,0|2,0,1]=4 1020 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 207a_100020588543_100000043907 [0,1,0,0,0,0|2,0,1]=4 1021 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000748023 [0,1,0,0,0,0|2,0,1]=4 1022 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 2230a_100020588543_100000753832 [0,1,0,0,0,0|2,0,1]=4 1023 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 270004a_100000743749_100000243153 [0,1,0,0,0,0|2,0,1]=4 1024 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 270004a_100020588543_100000043907 [0,1,0,0,0,0|2,0,1]=4 1025 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000748023 [0,1,0,0,0,0|2,0,1]=4 1026 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)OC 2230a_100020588543_100000735637 [0,1,0,0,0,0|2,0,1]=4 1027 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)OC 26a_100020588543_100000150123 [0,1,0,0,0,0|2,0,1]=4 1028 B17R1.1155 CCC(C)CNCc1ccc(cc1)C(=O)OC 270004a_100020588543_100000148700 [0,1,0,0,0,0|2,0,1]=4 1029 B17R1.1155 CCC(C)COCc1ccc(cc1)C(=O)OC 34a_100000151488_100000748023 [0,1,0,0,0,0|2,0,1]=4 1030 B17R1.1155 CCC(C)COCc1ccc(cc1)C(=O)OC 7a_100000151488_100000748023 [0,1,0,0,0,0|2,0,1]=4 1031 B17R1.1155 CCC(C)CSCc1ccc(cc1)C(=O)NC 62a_100000748023_100000753832 [0,1,0,0,0,0|2,0,1]=4 1032 B17R1.1155 CCC(C)CSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000748023 [0,1,0,0,0,0|2,0,1]=4 1033 B17R1.1155 CCC(C)CSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000748023 [0,1,0,0,0,0|2,0,1]=4 1034 B17R1.1155 CCC(C)CSCc1ccc(cc1)C(=O)OC 62a_100000748023_100000187170 [0,1,0,0,0,0|2,0,1]=4 1035 B17R1.1155 CCC(C)NCCc1ccc(cc1)C(=O)OC 2230a_100000209981_100010192280 [0,1,0,0,0,0|2,0,1]=4 1036 B17R1.1155 CCC(C)OCCc1ccc(cc1)C(=O)OC 34a_100010779965_100011215416 [0,1,0,0,0,0|2,0,1]=4 1037 B17R1.1155 CCC(C)OCCc1ccc(cc1)C(=O)OC 7a_100000210228_100010192280 [0,1,0,0,0,0|2,0,1]=4 1038 B17R1.1155 CCC(C)OCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000758301 [0,1,0,0,0,0|2,0,1]=4 1039 B17R1.1155 CCC(C)SCCc1ccc(cc1)C(=O)OC 62a_100000758301_100010192280 [0,1,0,0,0,0|2,0,1]=4 1040 B17R1.1155 CCC(C)SCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000758301 [0,1,0,0,0,0|2,0,1]=4 1041 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)NC 207a_100011218483_100000043907 [0,1,0,0,0,0|2,0,1]=4 1042 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100011218378 [0,1,0,0,0,0|2,0,1]=4 1043 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)NC 2230a_100011218483_100000753832 [0,1,0,0,0,0|2,0,1]=4 1044 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)NC 270004a_100011218483_100000043907 [0,1,0,0,0,0|2,0,1]=4 1045 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)NC 34a_100000743749_100011218378 [0,1,0,0,0,0|2,0,1]=4 1046 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)OC 2230a_100011218483_100000735637 [0,1,0,0,0,0|2,0,1]=4 1047 B17R1.1155 CCC(O)CNCc1ccc(cc1)C(=O)OC 270004a_100011218483_100000148700 [0,1,0,0,0,0|2,0,1]=4 1048 B17R1.1155 CCC(O)COCc1ccc(cc1)C(=O)OC 34a_100000151488_100011218378 [0,1,0,0,0,0|2,0,1]=4 1049 B17R1.1155 CCC(O)COCc1ccc(cc1)C(=O)OC 7a_100000151488_100011218378 [0,1,0,0,0,0|2,0,1]=4 1050 B17R1.1155 CCC(O)CSCc1ccc(cc1)C(=O)NC 62a_100000753832_100011218378 [0,1,0,0,0,0|2,0,1]=4 1051 B17R1.1155 CCC(O)CSCc1ccc(cc1)C(=O)NC 62a_100011218378_100000753832 [0,1,0,0,0,0|2,0,1]=4 1052 B17R1.1155 CCC(O)CSCc1ccc(cc1)C(=O)OC 62a_100000735637_100011218378 [0,1,0,0,0,0|2,0,1]=4 1053 B17R1.1155 CCC(O)CSCc1ccc(cc1)C(=O)OC 62a_100011218378_100000187170 [0,1,0,0,0,0|2,0,1]=4 1054 B17R1.1155 CCN(C)CCCc1ccc(cc1)C(=O)OC 2230a_100000225621_100010192279 [0,1,0,0,0,0|2,0,1]=4 1055 B17R1.1155 CCN(C)CCCc1ccc(cc1)C(=O)OC 269982a_100000225621_100010192279 [0,1,0,0,0,0|2,0,1]=4 1056 B17R1.1155 CC[C@H](C)CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100009816398 [0,1,0,0,0,0|2,0,1]=4 1057 B17R1.1155 CC[C@H](C)CNCc1ccc(cc1)C(=O)NC 34a_100000743749_100009816398 [0,1,0,0,0,0|2,0,1]=4 1058 B17R1.1155 CC[C@H](C)COCc1ccc(cc1)C(=O)NC 7a_100009816381_100000753832 [0,1,0,0,0,0|2,0,1]=4 1059 B17R1.1155 CC[C@H](C)COCc1ccc(cc1)C(=O)OC 34a_100000151488_100009816398 [0,1,0,0,0,0|2,0,1]=4 1060 B17R1.1155 CC[C@H](C)COCc1ccc(cc1)C(=O)OC 7a_100000151488_100009816398 [0,1,0,0,0,0|2,0,1]=4 1061 B17R1.1155 CC[C@H](C)COCc1ccc(cc1)C(=O)OC 7a_100009816381_100000735637 [0,1,0,0,0,0|2,0,1]=4 1062 B17R1.1155 CC[C@H](C)CSCc1ccc(cc1)C(=O)NC 62a_100000753832_100009816398 [0,1,0,0,0,0|2,0,1]=4 1063 B17R1.1155 CC[C@H](C)CSCc1ccc(cc1)C(=O)NC 62a_100009816398_100000753832 [0,1,0,0,0,0|2,0,1]=4 1064 B17R1.1155 CC[C@H](C)CSCc1ccc(cc1)C(=O)OC 62a_100000735637_100009816398 [0,1,0,0,0,0|2,0,1]=4 1065 B17R1.1155 CC[C@H](C)CSCc1ccc(cc1)C(=O)OC 62a_100009816398_100000187170 [0,1,0,0,0,0|2,0,1]=4 1066 B17R1.1175 CC(=O)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215641 [0,1,0,0,0,0|2,0,1]=4 1067 B17R1.1175 CC(=O)CCCSc1ccc(cc1)C(=O)C=O 62a_100011215641_100000725942 [0,1,0,0,0,0|2,0,1]=4 1068 B17R1.1175 CC(C)CCCNc1ccc(cc1)C(=O)NN 27a_200000737386_100000183614 [0,1,0,0,0,0|3,0,0]=4 1069 B17R1.1175 CC(C)CCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100011214892 [0,1,0,0,0,0|2,0,1]=4 1070 B17R1.1175 CC(C)CCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100011214892 [0,1,0,0,0,0|2,0,1]=4 1071 B17R1.1175 CC(C)CCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100011214892 [0,1,0,0,0,0|2,0,1]=4 1072 B17R1.1175 CC(C)CCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100011214892 [0,1,0,0,0,0|2,0,1]=4 1073 B17R1.1175 CC(C)CCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100011214892 [0,1,0,0,0,0|3,0,0]=4 1074 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)C#N 62a_100011214892_100009994572 [0,1,0,0,0,0|2,0,1]=4 1075 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011214892 [0,1,0,0,0,0|2,0,0]=3 1076 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)C=O 62a_100011214892_100000725942 [0,1,0,0,0,0|2,0,0]=3 1077 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100011214892 [0,1,0,0,0,0|2,0,1]=4 1078 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)CN 62a_100011214892_100000017248 [0,1,0,0,0,0|2,0,1]=4 1079 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)CO 62a_100011214892_100011219529 [0,1,0,0,0,0|2,0,1]=4 1080 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100011214892 [0,1,0,0,0,0|2,0,1]=4 1081 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100011214892 [0,1,0,0,0,0|3,0,0]=4 1082 B17R1.1175 CC(C)CCCSc1ccc(cc1)C(=O)NN 62a_100011214892_100000183614 [0,1,0,0,0,0|3,0,0]=4 1083 B17R1.1175 CC(C)CCNCc1ccc(cc1)C(=O)CBr 26a_100000210545_100009814261 [0,1,0,0,0,0|2,0,1]=4 1084 B17R1.1175 CC(C)CCNCc1ccc(cc1)C(=O)CCl 26a_100000210545_100000018856 [0,1,0,0,0,0|2,0,1]=4 1085 B17R1.1175 CC(C)CCNCc1ccc(cc1)C(=O)CF 26a_100000210545_200010654591 [0,1,0,0,0,0|2,0,1]=4 1086 B17R1.1175 CC(C)OCCSc1ccc(cc1)C(=O)C=O 62a_100000211751_100000725942 [0,1,0,0,0,0|3,0,0]=4 1087 B17R1.1175 CC(C)OCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000211751 [0,1,0,0,0,0|3,0,0]=4 1088 B17R1.1175 CC(C)SCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000730970 [0,1,0,0,0,0|3,0,0]=4 1089 B17R1.1175 CC(C)SCCSc1ccc(cc1)C(=O)C=O 62a_100000730970_100000725942 [0,1,0,0,0,0|3,0,0]=4 1090 B17R1.1175 CC(O)CCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_200000718107 [0,1,0,0,0,0|2,0,1]=4 1091 B17R1.1175 CC(O)CCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_200000718107 [0,1,0,0,0,0|2,0,1]=4 1092 B17R1.1175 CC(O)CCCOc1ccc(cc1)C(=O)CF 34a_200010654591_200000718107 [0,1,0,0,0,0|2,0,1]=4 1093 B17R1.1175 CC(O)CCCOc1ccc(cc1)C(=O)CF 7a_200010654591_200000718107 [0,1,0,0,0,0|2,0,1]=4 1094 B17R1.1175 CC(O)CCCOc1ccc(cc1)C(=O)NN 34a_100000185078_200000718107 [0,1,0,0,0,0|3,0,0]=4 1095 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)C#N 62a_200000718107_100009994572 [0,1,0,0,0,0|2,0,1]=4 1096 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000718107 [0,1,0,0,0,0|2,0,0]=3 1097 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)C=O 62a_200000718107_100000725942 [0,1,0,0,0,0|2,0,0]=3 1098 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)CN 62a_100000017248_200000718107 [0,1,0,0,0,0|2,0,1]=4 1099 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)CN 62a_200000718107_100000017248 [0,1,0,0,0,0|2,0,1]=4 1100 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)CO 62a_100011219529_200000718107 [0,1,0,0,0,0|2,0,1]=4 1101 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)CO 62a_200000718107_100011219529 [0,1,0,0,0,0|2,0,1]=4 1102 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)NN 62a_100000183614_200000718107 [0,1,0,0,0,0|3,0,0]=4 1103 B17R1.1175 CC(O)CCCSc1ccc(cc1)C(=O)NN 62a_200000718107_100000183614 [0,1,0,0,0,0|3,0,0]=4 1104 B17R1.1175 CCC(=O)c1ccc(cc1)CNCCC(C)C 26a_100000210545_100000212119 [0,1,0,0,0,0|1,0,2]=4 1105 B17R1.1175 CCC(=O)c1ccc(cc1)OCCCC(C)C 34a_100000212119_100011214892 [0,1,0,0,0,0|1,0,2]=4 1106 B17R1.1175 CCC(=O)c1ccc(cc1)OCCCC(C)C 7a_100000212119_100011214892 [0,1,0,0,0,0|1,0,2]=4 1107 B17R1.1175 CCC(=O)c1ccc(cc1)OCCCC(C)O 34a_100000212119_200000718107 [0,1,0,0,0,0|1,0,2]=4 1108 B17R1.1175 CCC(=O)c1ccc(cc1)OCCCC(C)O 7a_100000212119_200000718107 [0,1,0,0,0,0|1,0,2]=4 1109 B17R1.1175 CCC(=O)c1ccc(cc1)SCCCC(C)C 62a_100000211647_100011214892 [0,1,0,0,0,0|1,0,2]=4 1110 B17R1.1175 CCC(=O)c1ccc(cc1)SCCCC(C)C 62a_100011214892_100000211647 [0,1,0,0,0,0|1,0,2]=4 1111 B17R1.1175 CCC(=O)c1ccc(cc1)SCCCC(C)O 62a_100000211647_200000718107 [0,1,0,0,0,0|1,0,2]=4 1112 B17R1.1175 CCC(=O)c1ccc(cc1)SCCCC(C)O 62a_200000718107_100000211647 [0,1,0,0,0,0|1,0,2]=4 1113 B17R1.1175 CN(C)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000757444 [0,1,0,0,0,0|3,0,0]=4 1114 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)C 207a_100000210545_100000043907 [0,1,0,0,0,0|2,0,1]=4 1115 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)C 2230a_100000743749_100000210312 [0,1,0,0,0,0|2,0,1]=4 1116 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)C 269862a_100000743749_100000185833 [0,1,0,0,0,0|2,0,1]=4 1117 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)C 270004a_100000210545_100000043907 [0,1,0,0,0,0|2,0,1]=4 1118 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)C 34a_100000743749_100000210312 [0,1,0,0,0,0|2,0,1]=4 1119 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)O 207a_200000755665_100000043907 [0,1,0,0,0,0|2,0,1]=4 1120 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)O 2230a_100000743749_100012276601 [0,1,0,0,0,0|2,0,1]=4 1121 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)O 2230a_200000755665_100000753832 [0,1,0,0,0,0|2,0,1]=4 1122 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)O 270004a_200000755665_100000043907 [0,1,0,0,0,0|2,0,1]=4 1123 B17R1.1175 CNC(=O)c1ccc(cc1)CNCCC(C)O 34a_100000743749_100012276601 [0,1,0,0,0,0|2,0,1]=4 1124 B17R1.1175 CNC(=O)c1ccc(cc1)COCCC(C)Br 34a_100009893172_100000753832 [0,1,0,0,0,0|2,0,1]=4 1125 B17R1.1175 CNC(=O)c1ccc(cc1)COCCC(C)C 34a_100000210254_100000753832 [0,1,0,0,0,0|2,0,1]=4 1126 B17R1.1175 CNC(=O)c1ccc(cc1)COCCC(C)C 7a_100000210254_100000753832 [0,1,0,0,0,0|2,0,1]=4 1127 B17R1.1175 CNC(=O)c1ccc(cc1)COCC[C@@H](C)N 34a_100000706166_100000753832 [0,1,0,0,0,0|2,0,1]=4 1128 B17R1.1175 CNC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000210312_100000753832 [0,1,0,0,0,0|2,0,1]=4 1129 B17R1.1175 CNC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000753832_100000210312 [0,1,0,0,0,0|2,0,1]=4 1130 B17R1.1175 CNC(=O)c1ccc(cc1)CSCCC(C)O 62a_100000753832_100012276601 [0,1,0,0,0,0|2,0,1]=4 1131 B17R1.1175 CNC(=O)c1ccc(cc1)CSCCC(C)O 62a_100012276601_100000753832 [0,1,0,0,0,0|2,0,1]=4 1132 B17R1.1175 CNC(=O)c1ccc(cc1)NCCCC(C)C 2230a_100000184841_100011214892 [0,1,0,0,0,0|2,0,1]=4 1133 B17R1.1175 CNC(=O)c1ccc(cc1)NCCCC(C)C 27a_200000737386_100000155074 [0,1,0,0,0,0|2,0,1]=4 1134 B17R1.1175 CNC(=O)c1ccc(cc1)NCCCC(C)C 34a_100000184841_100011214892 [0,1,0,0,0,0|2,0,1]=4 1135 B17R1.1175 CNC(=O)c1ccc(cc1)NCCCC(C)O 2230a_100000184841_200000718107 [0,1,0,0,0,0|2,0,1]=4 1136 B17R1.1175 CNC(=O)c1ccc(cc1)NCCCC(C)O 34a_100000184841_200000718107 [0,1,0,0,0,0|2,0,1]=4 1137 B17R1.1175 CNC(=O)c1ccc(cc1)OCCCC(C)C 34a_100000192141_100011214892 [0,1,0,0,0,0|2,0,1]=4 1138 B17R1.1175 CNC(=O)c1ccc(cc1)OCCCC(C)C 7a_100000192141_100011214892 [0,1,0,0,0,0|2,0,1]=4 1139 B17R1.1175 CNC(=O)c1ccc(cc1)OCCCC(C)O 34a_100000192141_200000718107 [0,1,0,0,0,0|2,0,1]=4 1140 B17R1.1175 CNC(=O)c1ccc(cc1)OCCCC(C)O 7a_100000192141_200000718107 [0,1,0,0,0,0|2,0,1]=4 1141 B17R1.1175 CNC(=O)c1ccc(cc1)SCCCC(C)C 62a_100000155074_100011214892 [0,1,0,0,0,0|2,0,1]=4 1142 B17R1.1175 CNC(=O)c1ccc(cc1)SCCCC(C)C 62a_100011214892_100000155074 [0,1,0,0,0,0|2,0,1]=4 1143 B17R1.1175 CNC(=O)c1ccc(cc1)SCCCC(C)O 62a_100000155074_200000718107 [0,1,0,0,0,0|2,0,1]=4 1144 B17R1.1175 CNC(=O)c1ccc(cc1)SCCCC(C)O 62a_200000718107_100000155074 [0,1,0,0,0,0|2,0,1]=4 1145 B17R1.1175 COC(=O)c1ccc(cc1)CCCNC(C)C 2230a_100138425928_100010192279 [0,1,0,0,0,0|2,0,1]=4 1146 B17R1.1175 COC(=O)c1ccc(cc1)CCCNC(C)C 34a_100138425928_100010192279 [0,1,0,0,0,0|2,0,1]=4 1147 B17R1.1175 COC(=O)c1ccc(cc1)CCCOC(C)C 34a_100000212225_100010192279 [0,1,0,0,0,0|2,0,1]=4 1148 B17R1.1175 COC(=O)c1ccc(cc1)CCCSC(C)C 62a_100000210206_100010192279 [0,1,0,0,0,0|2,0,1]=4 1149 B17R1.1175 COC(=O)c1ccc(cc1)CCCSC(C)C 62a_100010192279_100000210206 [0,1,0,0,0,0|2,0,1]=4 1150 B17R1.1175 COC(=O)c1ccc(cc1)CCNCC(C)C 2230a_100000210953_100010192280 [0,1,0,0,0,0|2,0,1]=4 1151 B17R1.1175 COC(=O)c1ccc(cc1)CCNCC(C)C 34a_100000210953_100010192280 [0,1,0,0,0,0|2,0,1]=4 1152 B17R1.1175 COC(=O)c1ccc(cc1)CCNCC(C)O 2230a_100000210904_100010192280 [0,1,0,0,0,0|2,0,1]=4 1153 B17R1.1175 COC(=O)c1ccc(cc1)CCNCC(C)O 34a_100000210904_100010192280 [0,1,0,0,0,0|2,0,1]=4 1154 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)Br 34a_100012180447_100010192280 [0,1,0,0,0,0|2,0,1]=4 1155 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)C 34a_100000210257_100010192280 [0,1,0,0,0,0|2,0,1]=4 1156 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)C 34a_100010779965_100000210624 [0,1,0,0,0,0|2,0,1]=4 1157 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)C 7a_100010779965_100000210760 [0,1,0,0,0,0|2,0,1]=4 1158 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)F 34a_100015925927_100010192280 [0,1,0,0,0,0|2,0,1]=4 1159 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)O 34a_100010779965_100011218427 [0,1,0,0,0,0|2,0,1]=4 1160 B17R1.1175 COC(=O)c1ccc(cc1)CCOCC(C)O 7a_100010779965_100011218427 [0,1,0,0,0,0|2,0,1]=4 1161 B17R1.1175 COC(=O)c1ccc(cc1)CCOC[C@@H](C)Cl 34a_100016084084_100010192280 [0,1,0,0,0,0|2,0,1]=4 1162 B17R1.1175 COC(=O)c1ccc(cc1)CCOC[C@@H](C)N 34a_100000737577_100010192280 [0,1,0,0,0,0|2,0,1]=4 1163 B17R1.1175 COC(=O)c1ccc(cc1)CCOC[C@@H](C)O 34a_100010779965_100009817552 [0,1,0,0,0,0|2,0,1]=4 1164 B17R1.1175 COC(=O)c1ccc(cc1)CCOC[C@@H](C)O 7a_100010779965_100009817552 [0,1,0,0,0,0|2,0,1]=4 1165 B17R1.1175 COC(=O)c1ccc(cc1)CCSCC(C)C 62a_100000210624_100010192280 [0,1,0,0,0,0|2,0,1]=4 1166 B17R1.1175 COC(=O)c1ccc(cc1)CCSCC(C)C 62a_100010192280_100000210760 [0,1,0,0,0,0|2,0,1]=4 1167 B17R1.1175 COC(=O)c1ccc(cc1)CCSCC(C)O 62a_100010192280_100011218427 [0,1,0,0,0,0|2,0,1]=4 1168 B17R1.1175 COC(=O)c1ccc(cc1)CCSCC(C)O 62a_100011218427_100010192280 [0,1,0,0,0,0|2,0,1]=4 1169 B17R1.1175 COC(=O)c1ccc(cc1)CCSC[C@@H](C)O 62a_100009817552_100010192280 [0,1,0,0,0,0|2,0,1]=4 1170 B17R1.1175 COC(=O)c1ccc(cc1)CCSC[C@@H](C)O 62a_100010192280_100009817552 [0,1,0,0,0,0|2,0,1]=4 1171 B17R1.1175 COC(=O)c1ccc(cc1)CNCCC(C)C 26a_100000210545_100000150123 [0,1,0,0,0,0|2,0,1]=4 1172 B17R1.1175 COC(=O)c1ccc(cc1)CNCCC(C)C 270004a_100000210545_100000148700 [0,1,0,0,0,0|2,0,1]=4 1173 B17R1.1175 COC(=O)c1ccc(cc1)CNCCC(C)O 2230a_200000755665_100000735637 [0,1,0,0,0,0|2,0,1]=4 1174 B17R1.1175 COC(=O)c1ccc(cc1)CNCCC(C)O 270004a_200000755665_100000148700 [0,1,0,0,0,0|2,0,1]=4 1175 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)Br 34a_100009893172_100000735637 [0,1,0,0,0,0|2,0,1]=4 1176 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)C 34a_100000151488_100000210312 [0,1,0,0,0,0|2,0,1]=4 1177 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)C 34a_100000210254_100000735637 [0,1,0,0,0,0|2,0,1]=4 1178 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)C 7a_100000151488_100000210626 [0,1,0,0,0,0|2,0,1]=4 1179 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)C 7a_100000210254_100000735637 [0,1,0,0,0,0|2,0,1]=4 1180 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)O 34a_100000151488_100012276601 [0,1,0,0,0,0|2,0,1]=4 1181 B17R1.1175 COC(=O)c1ccc(cc1)COCCC(C)O 7a_100000151488_100012276601 [0,1,0,0,0,0|2,0,1]=4 1182 B17R1.1175 COC(=O)c1ccc(cc1)COCC[C@@H](C)N 34a_100000706166_100000735637 [0,1,0,0,0,0|2,0,1]=4 1183 B17R1.1175 COC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000210312_100000187170 [0,1,0,0,0,0|2,0,1]=4 1184 B17R1.1175 COC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000735637_100000210312 [0,1,0,0,0,0|2,0,1]=4 1185 B17R1.1175 COC(=O)c1ccc(cc1)CSCCC(C)O 62a_100000735637_100012276601 [0,1,0,0,0,0|2,0,1]=4 1186 B17R1.1175 COC(=O)c1ccc(cc1)CSCCC(C)O 62a_100012276601_100000187170 [0,1,0,0,0,0|2,0,1]=4 1187 B17R1.1175 COC(=O)c1ccc(cc1)OCCCC(C)C 34a_100000150123_100011214892 [0,1,0,0,0,0|2,0,1]=4 1188 B17R1.1175 COC(=O)c1ccc(cc1)OCCCC(C)C 7a_100000150123_100011214892 [0,1,0,0,0,0|2,0,1]=4 1189 B17R1.1175 COC(=O)c1ccc(cc1)OCCCC(C)O 34a_100000150123_200000718107 [0,1,0,0,0,0|2,0,1]=4 1190 B17R1.1175 COC(=O)c1ccc(cc1)OCCCC(C)O 7a_100000150123_200000718107 [0,1,0,0,0,0|2,0,1]=4 1191 B17R1.1175 COC(=O)c1ccc(cc1)SCCCC(C)C 62a_100000150774_100011214892 [0,1,0,0,0,0|2,0,1]=4 1192 B17R1.1175 COC(=O)c1ccc(cc1)SCCCC(C)C 62a_100011214892_100000150774 [0,1,0,0,0,0|2,0,1]=4 1193 B17R1.1175 COC(=O)c1ccc(cc1)SCCCC(C)O 62a_100000150774_200000718107 [0,1,0,0,0,0|2,0,1]=4 1194 B17R1.1175 COC(=O)c1ccc(cc1)SCCCC(C)O 62a_200000718107_100000150774 [0,1,0,0,0,0|2,0,1]=4 1195 B17R1.1264 CCCCC=Cc1ccc(cc1)C(=O)C(=O)N 271570a_100016275911_200009822167 [0,1,0,0,0,0|1,0,2]=4 1196 B17R1.1264 CCCCCCc1ccc(cc1)C(=O)C(C)C 1458a_100000032748_100000210206 [0,1,0,0,0,0|0,0,2]=3 1197 B17R1.1264 CCCCCCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000032748 [0,1,0,0,0,0|1,0,1]=3 1198 B17R1.1264 CCCCCCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000032748 [0,1,0,0,0,0|1,0,1]=3 1199 B17R1.1264 CCCCCCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000032748 [0,1,0,0,0,0|1,0,1]=3 1200 B17R1.1264 CCCCCCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000032748 [0,1,0,0,0,0|1,0,1]=3 1201 B17R1.1264 CCCCCNc1ccc(cc1)C(=O)C(C)C 27a_100000209983_100011220430 [0,1,0,0,0,0|1,0,2]=4 1202 B17R1.1264 CCCCCNc1ccc(cc1)C(=O)N(C)C 27a_100000209983_100000159574 [0,1,0,0,0,0|2,0,1]=4 1203 B17R1.1264 CCCCCNc1ccc(cc1)C(=O)N(C)C 34a_100000184784_100000718602 [0,1,0,0,0,0|2,0,1]=4 1204 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_100000718602 [0,1,0,0,0,0|1,0,2]=4 1205 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_100000210326 [0,1,0,0,0,0|1,0,2]=4 1206 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)C(C)C 1458a_100000186157_100000210206 [0,1,0,0,0,0|1,0,2]=4 1207 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)C(C)C 34a_100011995950_100000718602 [0,1,0,0,0,0|1,0,2]=4 1208 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)C(C)C 7a_100011995950_100000210326 [0,1,0,0,0,0|1,0,2]=4 1209 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000186157 [0,1,0,0,0,0|2,0,1]=4 1210 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000186157 [0,1,0,0,0,0|2,0,1]=4 1211 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000186157 [0,1,0,0,0,0|2,0,1]=4 1212 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 34a_100000192105_100000718602 [0,1,0,0,0,0|2,0,1]=4 1213 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000186157 [0,1,0,0,0,0|2,0,1]=4 1214 B17R1.1264 CCCCCOc1ccc(cc1)C(=O)N(C)C 7a_100000192105_100000210326 [0,1,0,0,0,0|2,0,1]=4 1215 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000210326 [0,1,0,0,0,0|2,0,0]=3 1216 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)C(C)C 62a_100000210326_100011220430 [0,1,0,0,0,0|1,0,2]=4 1217 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)C(C)C 62a_100011220430_100000210326 [0,1,0,0,0,0|1,0,2]=4 1218 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)C(O)O 62a_100000210326_200009815832 [0,1,0,0,0,0|2,0,1]=4 1219 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)C(O)O 62a_200009815832_100000210326 [0,1,0,0,0,0|2,0,1]=4 1220 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)N(C)C 62a_100000159574_100000210326 [0,1,0,0,0,0|2,0,1]=4 1221 B17R1.1264 CCCCCSc1ccc(cc1)C(=O)N(C)C 62a_100000210326_100000159574 [0,1,0,0,0,0|2,0,1]=4 1222 B17R1.1264 CCCCNCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100015187156 [0,1,0,0,0,0|2,0,1]=4 1223 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 207a_100000102301_100000050693 [0,1,0,0,0,0|2,0,1]=4 1224 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 2230a_100000102301_100000230106 [0,1,0,0,0,0|2,0,1]=4 1225 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 2230a_100000246156_100000210211 [0,1,0,0,0,0|2,0,1]=4 1226 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 270004a_100000102301_100000050693 [0,1,0,0,0,0|2,0,1]=4 1227 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 34a_100000246156_100000210210 [0,1,0,0,0,0|2,0,1]=4 1228 B17R1.1264 CCCCNCc1ccc(cc1)C(=O)N(C)C 7a_106832991798_100000230106 [0,1,0,0,0,0|2,0,1]=4 1229 B17R1.1264 CCCCOCc1ccc(cc1)C(=O)N(C)C 34a_100000159455_100000210210 [0,1,0,0,0,0|2,0,1]=4 1230 B17R1.1264 CCCCOCc1ccc(cc1)C(=O)N(C)C 34a_100000210227_100000230106 [0,1,0,0,0,0|2,0,1]=4 1231 B17R1.1264 CCCCOCc1ccc(cc1)C(=O)N(C)C 7a_100000159455_100000210211 [0,1,0,0,0,0|2,0,1]=4 1232 B17R1.1264 CCCCOCc1ccc(cc1)C(=O)N(C)C 7a_100000210227_100000230106 [0,1,0,0,0,0|2,0,1]=4 1233 B17R1.1264 CCCCSCc1ccc(cc1)C(=O)N(C)C 62a_100000210211_100000230106 [0,1,0,0,0,0|2,0,1]=4 1234 B17R1.1264 CCCCSCc1ccc(cc1)C(=O)N(C)C 62a_100000230106_100000210210 [0,1,0,0,0,0|2,0,1]=4 1235 B17R1.1264 CCOCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100011215890 [0,1,0,0,0,0|3,0,0]=4 1236 B17R1.1264 CCSCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000757381 [0,1,0,0,0,0|3,0,0]=4 1237 B17R1.1264 COCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000709357 [0,1,0,0,0,0|3,0,0]=4 1238 B17R1.1264 NC(=O)C(=O)c1ccc(cc1)SCCCCF 62a_200009822167_100000729493 [0,1,0,0,0,0|3,0,0]=4 1239 B17R1.1264 NC(=O)C(=O)c1ccc(cc1)SCCCCO 62a_200009822167_100000210776 [0,1,0,0,0,0|3,0,0]=4 1240 B17R1.1455 C#CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100010269958 [0,1,0,0,0,0|1,0,2]=4 1241 B17R1.1455 C#CCCCCSc1ccc(cc1)C(=O)C=O 62a_100010269958_100000725942 [0,1,0,0,0,0|1,0,2]=4 1242 B17R1.1455 C=CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215482 [0,1,0,0,0,0|1,0,2]=4 1243 B17R1.1455 C=CCCCCSc1ccc(cc1)C(=O)C=O 62a_100011215482_100000725942 [0,1,0,0,0,0|1,0,2]=4 1244 B17R1.1455 CC/C=C\CCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100015370543 [0,1,0,0,0,0|1,0,2]=4 1245 B17R1.1455 CC/C=C\CCSc1ccc(cc1)C(=O)C=O 62a_100015370543_100000725942 [0,1,0,0,0,0|1,0,2]=4 1246 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCCF 34a_100000212119_100000729378 [0,1,0,0,0,0|1,0,2]=4 1247 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCCF 7a_100000212119_100000729378 [0,1,0,0,0,0|1,0,2]=4 1248 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCCO 34a_100000212119_100000746330 [0,1,0,0,0,0|1,0,2]=4 1249 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCCO 7a_100000212119_100000746330 [0,1,0,0,0,0|1,0,2]=4 1250 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCOC 34a_100000212119_100000755781 [0,1,0,0,0,0|1,0,2]=4 1251 B17R1.1455 CCC(=O)c1ccc(cc1)OCCCCOC 7a_100000212119_100000730899 [0,1,0,0,0,0|1,0,2]=4 1252 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCCF 62a_100000211647_100000729378 [0,1,0,0,0,0|1,0,2]=4 1253 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000211647 [0,1,0,0,0,0|1,0,2]=4 1254 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCCO 62a_100000211647_100000746330 [0,1,0,0,0,0|1,0,2]=4 1255 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000211647 [0,1,0,0,0,0|1,0,2]=4 1256 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCOC 62a_100000211647_100000730899 [0,1,0,0,0,0|1,0,2]=4 1257 B17R1.1455 CCC(=O)c1ccc(cc1)SCCCCOC 62a_100000730899_100000211647 [0,1,0,0,0,0|1,0,2]=4 1258 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)C#N 271570a_100000062253_100009994572 [0,1,0,0,0,0|1,0,2]=4 1259 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)C=O 271570a_100000062253_100000725942 [0,1,0,0,0,0|1,0,1]=3 1260 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)CC 271570a_100000062253_100000211647 [0,1,0,0,0,0|0,0,3]=4 1261 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)CN 271570a_100000062253_100000017248 [0,1,0,0,0,0|1,0,2]=4 1262 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)CO 271570a_100000062253_100011219529 [0,1,0,0,0,0|1,0,2]=4 1263 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)NC 271570a_100000062253_100000155074 [0,1,0,0,0,0|1,0,2]=4 1264 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)NN 271570a_100000062253_100000183614 [0,1,0,0,0,0|2,0,1]=4 1265 B17R1.1455 CCCCCC=Cc1ccc(cc1)C(=O)OC 271570a_100000062253_100000150774 [0,1,0,0,0,0|1,0,2]=4 1266 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)CC 1458a_100000012247_100000210202 [0,1,0,0,0,0|0,0,2]=3 1267 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)CF 1458a_100000012247_100015361967 [0,1,0,0,0,0|1,0,1]=3 1268 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000012247 [0,1,0,0,0,0|1,0,1]=3 1269 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000012247 [0,1,0,0,0,0|1,0,1]=3 1270 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000012247 [0,1,0,0,0,0|1,0,1]=3 1271 B17R1.1455 CCCCCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000012247 [0,1,0,0,0,0|1,0,1]=3 1272 B17R1.1455 CCCCCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210314 [0,1,0,0,0,0|1,0,1]=3 1273 B17R1.1455 CCCCCCNc1ccc(cc1)C(=O)NC 27a_100000210581_100000155074 [0,1,0,0,0,0|1,0,1]=3 1274 B17R1.1455 CCCCCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210314 [0,1,0,0,0,0|1,0,1]=3 1275 B17R1.1455 CCCCCCNc1ccc(cc1)C(=O)NN 27a_100000210581_100000183614 [0,1,0,0,0,0|2,0,0]=3 1276 B17R1.1455 CCCCCCNc1ccc(cn1)C(=O)NC 27a_100000210581_100000159860 [0,1,0,0,0,0|2,0,1]=4 1277 B17R1.1455 CCCCCCNc1ccc(cn1)C(=O)NN 27a_100000210581_100000189807 [0,1,0,0,0,0|3,0,0]=4 1278 B17R1.1455 CCCCCCNc1ccc(cn1)C(=O)OC 27a_100000210581_100000733799 [0,1,0,0,0,0|2,0,1]=4 1279 B17R1.1455 CCCCCCNc1ccc(nc1)C(=O)NC 27a_100000210581_100011781262 [0,1,0,0,0,0|2,0,1]=4 1280 B17R1.1455 CCCCCCOc1ccc(cc1)C(=NO)C 34a_100000164205_100000210314 [0,1,0,0,0,0|3,0,0]=4 1281 B17R1.1455 CCCCCCOc1ccc(cc1)C(=NO)N 34a_100000231063_100000210314 [0,1,0,0,0,0|3,0,0]=4 1282 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210314 [0,1,0,0,0,0|1,0,1]=3 1283 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CC 1458a_100000182910_100000210202 [0,1,0,0,0,0|0,0,2]=3 1284 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210314 [0,1,0,0,0,0|0,0,2]=3 1285 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210314 [0,1,0,0,0,0|0,0,2]=3 1286 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210314 [0,1,0,0,0,0|1,0,1]=3 1287 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CF 1458a_100000182910_100015361967 [0,1,0,0,0,0|1,0,1]=3 1288 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000210314 [0,1,0,0,0,0|1,0,1]=3 1289 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000210314 [0,1,0,0,0,0|1,0,1]=3 1290 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000182910 [0,1,0,0,0,0|1,0,1]=3 1291 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000182910 [0,1,0,0,0,0|1,0,1]=3 1292 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000182910 [0,1,0,0,0,0|1,0,1]=3 1293 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210314 [0,1,0,0,0,0|1,0,1]=3 1294 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000182910 [0,1,0,0,0,0|1,0,1]=3 1295 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210314 [0,1,0,0,0,0|1,0,1]=3 1296 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210314 [0,1,0,0,0,0|2,0,0]=3 1297 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210314 [0,1,0,0,0,0|1,0,1]=3 1298 B17R1.1455 CCCCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210314 [0,1,0,0,0,0|1,0,1]=3 1299 B17R1.1455 CCCCCCOc1ccc(nc1)C(=O)NC 34a_100009861314_100000210314 [0,1,0,0,0,0|2,0,1]=4 1300 B17R1.1455 CCCCCCOc1ccc(nc1)C(=O)NC 7a_100009861314_100000210314 [0,1,0,0,0,0|2,0,1]=4 1301 B17R1.1455 CCCCCCOc1ccc(nc1)C(=O)OC 34a_100011997255_100000210314 [0,1,0,0,0,0|2,0,1]=4 1302 B17R1.1455 CCCCCCOc1ccc(nc1)C(=O)OC 7a_100011997255_100000210314 [0,1,0,0,0,0|2,0,1]=4 1303 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)C#N 62a_100000210314_100009994572 [0,1,0,0,0,0|1,0,1]=3 1304 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000210314_100000725942 [0,1,0,0,0,0|1,0,0]=2 1305 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210757 [0,1,0,0,0,0|1,0,0]=2 1306 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CC 62a_100000210314_100000211647 [0,1,0,0,0,0|0,0,2]=3 1307 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210757 [0,1,0,0,0,0|0,0,2]=3 1308 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000210757 [0,1,0,0,0,0|1,0,1]=3 1309 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CN 62a_100000210314_100000017248 [0,1,0,0,0,0|1,0,1]=3 1310 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CO 62a_100000210314_100011219529 [0,1,0,0,0,0|1,0,1]=3 1311 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000210757 [0,1,0,0,0,0|1,0,1]=3 1312 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210757 [0,1,0,0,0,0|1,0,1]=3 1313 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)NC 62a_100000210314_100000155074 [0,1,0,0,0,0|1,0,1]=3 1314 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000210757 [0,1,0,0,0,0|2,0,0]=3 1315 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)NN 62a_100000210314_100000183614 [0,1,0,0,0,0|2,0,0]=3 1316 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210757 [0,1,0,0,0,0|1,0,1]=3 1317 B17R1.1455 CCCCCCSc1ccc(cc1)C(=O)OC 62a_100000210314_100000150774 [0,1,0,0,0,0|1,0,1]=3 1318 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)NC 62a_100000159860_100000210757 [0,1,0,0,0,0|2,0,1]=4 1319 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)NC 62a_100000210314_100000159860 [0,1,0,0,0,0|2,0,1]=4 1320 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)NN 62a_100000189807_100000210757 [0,1,0,0,0,0|3,0,0]=4 1321 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)NN 62a_100000210314_100000189807 [0,1,0,0,0,0|3,0,0]=4 1322 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)OC 62a_100000210314_100000733799 [0,1,0,0,0,0|2,0,1]=4 1323 B17R1.1455 CCCCCCSc1ccc(cn1)C(=O)OC 62a_100000733799_100000210757 [0,1,0,0,0,0|2,0,1]=4 1324 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)CC 62a_100000210314_100012351654 [0,1,0,0,0,0|1,0,2]=4 1325 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)CC 62a_100012351654_100000210757 [0,1,0,0,0,0|1,0,2]=4 1326 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)NC 62a_100000210314_100011781262 [0,1,0,0,0,0|2,0,1]=4 1327 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)NC 62a_100011781262_100000210757 [0,1,0,0,0,0|2,0,1]=4 1328 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)NN 62a_100000210314_100011781063 [0,1,0,0,0,0|3,0,0]=4 1329 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)NN 62a_100011781063_100000210757 [0,1,0,0,0,0|3,0,0]=4 1330 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)OC 62a_100000210314_100102712061 [0,1,0,0,0,0|2,0,1]=4 1331 B17R1.1455 CCCCCCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210757 [0,1,0,0,0,0|2,0,1]=4 1332 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)NC 207a_100000209983_100000043907 [0,1,0,0,0,0|1,0,1]=3 1333 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)NC 2230a_100000209983_100000753832 [0,1,0,0,0,0|1,0,1]=3 1334 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000210326 [0,1,0,0,0,0|1,0,1]=3 1335 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)NC 270004a_100000209983_100000043907 [0,1,0,0,0,0|1,0,1]=3 1336 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000718602 [0,1,0,0,0,0|1,0,1]=3 1337 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)OC 2230a_100000209983_100000735637 [0,1,0,0,0,0|1,0,1]=3 1338 B17R1.1455 CCCCCNCc1ccc(cc1)C(=O)OC 270004a_100000209983_100000148700 [0,1,0,0,0,0|1,0,1]=3 1339 B17R1.1455 CCCCCNCc1ccc(cn1)C(=O)OC 2230a_100000209983_100000063545 [0,1,0,0,0,0|2,0,1]=4 1340 B17R1.1455 CCCCCNCc1ccc(cn1)C(=O)OC 270004a_100000209983_100000762506 [0,1,0,0,0,0|2,0,1]=4 1341 B17R1.1455 CCCCCNCc1ccc(nc1)C(=O)OC 2230a_100000209983_100010177729 [0,1,0,0,0,0|2,0,1]=4 1342 B17R1.1455 CCCCCNCc1ccc(nc1)C(=O)OC 270004a_100000209983_102516457225 [0,1,0,0,0,0|2,0,1]=4 1343 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)NC 34a_100000210253_100000753832 [0,1,0,0,0,0|1,0,1]=3 1344 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)NC 7a_100000210253_100000753832 [0,1,0,0,0,0|1,0,1]=3 1345 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000718602 [0,1,0,0,0,0|1,0,1]=3 1346 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)OC 34a_100000210253_100000735637 [0,1,0,0,0,0|1,0,1]=3 1347 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210326 [0,1,0,0,0,0|1,0,1]=3 1348 B17R1.1455 CCCCCOCc1ccc(cc1)C(=O)OC 7a_100000210253_100000735637 [0,1,0,0,0,0|1,0,1]=3 1349 B17R1.1455 CCCCCOCc1ccc(cn1)C(=O)OC 34a_100000210253_100010230174 [0,1,0,0,0,0|2,0,1]=4 1350 B17R1.1455 CCCCCOCc1ccc(cn1)C(=O)OC 34a_100000239634_100000718602 [0,1,0,0,0,0|2,0,1]=4 1351 B17R1.1455 CCCCCOCc1ccc(cn1)C(=O)OC 7a_100000210253_100000063545 [0,1,0,0,0,0|2,0,1]=4 1352 B17R1.1455 CCCCCOCc1ccc(nc1)C(=O)OC 34a_100000210253_100010177729 [0,1,0,0,0,0|2,0,1]=4 1353 B17R1.1455 CCCCCOCc1ccc(nc1)C(=O)OC 34a_100009873365_100000718602 [0,1,0,0,0,0|2,0,1]=4 1354 B17R1.1455 CCCCCOCc1ccc(nc1)C(=O)OC 7a_100000210253_100010177729 [0,1,0,0,0,0|2,0,1]=4 1355 B17R1.1455 CCCCCOCc1ccc(nc1)C(=O)OC 7a_100009873365_100000210326 [0,1,0,0,0,0|2,0,1]=4 1356 B17R1.1455 CCCCCSCc1ccc(cc1)C(=O)NC 62a_100000210326_100000753832 [0,1,0,0,0,0|1,0,1]=3 1357 B17R1.1455 CCCCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000210326 [0,1,0,0,0,0|1,0,1]=3 1358 B17R1.1455 CCCCCSCc1ccc(cc1)C(=O)OC 62a_100000210326_100000187170 [0,1,0,0,0,0|1,0,1]=3 1359 B17R1.1455 CCCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210326 [0,1,0,0,0,0|1,0,1]=3 1360 B17R1.1455 CCCCCSCc1ccc(cn1)C(=O)OC 62a_100000210326_100010230174 [0,1,0,0,0,0|2,0,1]=4 1361 B17R1.1455 CCCCCSCc1ccc(cn1)C(=O)OC 62a_100010230174_100000210326 [0,1,0,0,0,0|2,0,1]=4 1362 B17R1.1455 CCCCCSCc1ccc(nc1)C(=O)OC 62a_100000210326_100010177729 [0,1,0,0,0,0|2,0,1]=4 1363 B17R1.1455 CCCCCSCc1ccc(nc1)C(=O)OC 62a_100010177729_100000210326 [0,1,0,0,0,0|2,0,1]=4 1364 B17R1.1455 CCCCNCCc1ccc(cc1)C(=O)OC 2230a_100000102301_100010192280 [0,1,0,0,0,0|1,0,1]=3 1365 B17R1.1455 CCCCNCCc1ccc(cc1)C(=O)OC 7a_106832991798_100010192280 [0,1,0,0,0,0|1,0,1]=3 1366 B17R1.1455 CCCCOCCc1ccc(cc1)C(=O)OC 34a_100000210227_100010192280 [0,1,0,0,0,0|1,0,1]=3 1367 B17R1.1455 CCCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000210210 [0,1,0,0,0,0|1,0,1]=3 1368 B17R1.1455 CCCCOCCc1ccc(cc1)C(=O)OC 7a_100000210227_100010192280 [0,1,0,0,0,0|1,0,1]=3 1369 B17R1.1455 CCCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000210211 [0,1,0,0,0,0|1,0,1]=3 1370 B17R1.1455 CCCCOCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100011995733 [0,1,0,0,0,0|2,0,1]=4 1371 B17R1.1455 CCCCOCNc1ccc(cc1)C(=O)NC 34a_100000184841_100011995733 [0,1,0,0,0,0|2,0,1]=4 1372 B17R1.1455 CCCCOCOc1ccc(cc1)C(=O)CC 34a_100000212119_100011995733 [0,1,0,0,0,0|1,0,2]=4 1373 B17R1.1455 CCCCOCOc1ccc(cc1)C(=O)CF 34a_200010654591_100011995733 [0,1,0,0,0,0|2,0,1]=4 1374 B17R1.1455 CCCCOCOc1ccc(cc1)C(=O)NC 34a_100000192141_100011995733 [0,1,0,0,0,0|2,0,1]=4 1375 B17R1.1455 CCCCOCOc1ccc(cc1)C(=O)NN 34a_100000185078_100011995733 [0,1,0,0,0,0|3,0,0]=4 1376 B17R1.1455 CCCCOCOc1ccc(cc1)C(=O)OC 34a_100000150123_100011995733 [0,1,0,0,0,0|2,0,1]=4 1377 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)C#N 62a_100011995733_100009994572 [0,1,0,0,0,0|2,0,1]=4 1378 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011995733 [0,1,0,0,0,0|2,0,0]=3 1379 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)C=O 62a_100011995733_100000725942 [0,1,0,0,0,0|2,0,0]=3 1380 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CC 62a_100000211647_100011995733 [0,1,0,0,0,0|1,0,2]=4 1381 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CC 62a_100011995733_100000211647 [0,1,0,0,0,0|1,0,2]=4 1382 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CN 62a_100000017248_100011995733 [0,1,0,0,0,0|2,0,1]=4 1383 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CN 62a_100011995733_100000017248 [0,1,0,0,0,0|2,0,1]=4 1384 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CO 62a_100011219529_100011995733 [0,1,0,0,0,0|2,0,1]=4 1385 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)CO 62a_100011995733_100011219529 [0,1,0,0,0,0|2,0,1]=4 1386 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)NC 62a_100000155074_100011995733 [0,1,0,0,0,0|2,0,1]=4 1387 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)NC 62a_100011995733_100000155074 [0,1,0,0,0,0|2,0,1]=4 1388 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)NN 62a_100000183614_100011995733 [0,1,0,0,0,0|3,0,0]=4 1389 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)NN 62a_100011995733_100000183614 [0,1,0,0,0,0|3,0,0]=4 1390 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)OC 62a_100000150774_100011995733 [0,1,0,0,0,0|2,0,1]=4 1391 B17R1.1455 CCCCOCSc1ccc(cc1)C(=O)OC 62a_100011995733_100000150774 [0,1,0,0,0,0|2,0,1]=4 1392 B17R1.1455 CCCCSCCc1ccc(cc1)C(=O)OC 62a_100000210211_100010192280 [0,1,0,0,0,0|1,0,1]=3 1393 B17R1.1455 CCCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000210210 [0,1,0,0,0,0|1,0,1]=3 1394 B17R1.1455 CCCOCCCc1ccc(cc1)C(=O)OC 34a_100000210258_100010192279 [0,1,0,0,0,0|1,0,1]=3 1395 B17R1.1455 CCCOCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100011215938 [0,1,0,0,0,0|2,0,1]=4 1396 B17R1.1455 CCCOCCNc1ccc(cc1)C(=O)NC 27a_100161115042_100000155074 [0,1,0,0,0,0|2,0,1]=4 1397 B17R1.1455 CCCOCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100011215938 [0,1,0,0,0,0|2,0,1]=4 1398 B17R1.1455 CCCOCCNc1ccc(cc1)C(=O)NN 27a_100161115042_100000183614 [0,1,0,0,0,0|3,0,0]=4 1399 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100011215938 [0,1,0,0,0,0|2,0,1]=4 1400 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100011215938 [0,1,0,0,0,0|1,0,2]=4 1401 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100011215938 [0,1,0,0,0,0|1,0,2]=4 1402 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100011215938 [0,1,0,0,0,0|2,0,1]=4 1403 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100011215938 [0,1,0,0,0,0|2,0,1]=4 1404 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100011215938 [0,1,0,0,0,0|2,0,1]=4 1405 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100011215938 [0,1,0,0,0,0|2,0,1]=4 1406 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100011215938 [0,1,0,0,0,0|2,0,1]=4 1407 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100011215938 [0,1,0,0,0,0|3,0,0]=4 1408 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100011215938 [0,1,0,0,0,0|2,0,1]=4 1409 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)OC 34a_100000210258_100000742590 [0,1,0,0,0,0|2,0,1]=4 1410 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)OC 34a_100011216607_100000210303 [0,1,0,0,0,0|2,0,1]=4 1411 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100011215938 [0,1,0,0,0,0|2,0,1]=4 1412 B17R1.1455 CCCOCCOc1ccc(cc1)C(=O)OC 7a_100011216607_100000210303 [0,1,0,0,0,0|2,0,1]=4 1413 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)C#N 62a_100011215938_100009994572 [0,1,0,0,0,0|2,0,1]=4 1414 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011215938 [0,1,0,0,0,0|2,0,0]=3 1415 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)C=O 62a_100011215938_100000725942 [0,1,0,0,0,0|2,0,0]=3 1416 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100011215938 [0,1,0,0,0,0|1,0,2]=4 1417 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CC 62a_100011215938_100000211647 [0,1,0,0,0,0|1,0,2]=4 1418 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100011215938 [0,1,0,0,0,0|2,0,1]=4 1419 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CN 62a_100011215938_100000017248 [0,1,0,0,0,0|2,0,1]=4 1420 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CO 62a_100011215938_100011219529 [0,1,0,0,0,0|2,0,1]=4 1421 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100011215938 [0,1,0,0,0,0|2,0,1]=4 1422 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100011215938 [0,1,0,0,0,0|2,0,1]=4 1423 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)NC 62a_100011215938_100000155074 [0,1,0,0,0,0|2,0,1]=4 1424 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100011215938 [0,1,0,0,0,0|3,0,0]=4 1425 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)NN 62a_100011215938_100000183614 [0,1,0,0,0,0|3,0,0]=4 1426 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100011215938 [0,1,0,0,0,0|2,0,1]=4 1427 B17R1.1455 CCCOCCSc1ccc(cc1)C(=O)OC 62a_100011215938_100000150774 [0,1,0,0,0,0|2,0,1]=4 1428 B17R1.1455 CCCSCCCc1ccc(cc1)C(=O)OC 62a_100000210303_100010192279 [0,1,0,0,0,0|1,0,1]=3 1429 B17R1.1455 CCCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000210303 [0,1,0,0,0,0|1,0,1]=3 1430 B17R1.1455 CCCSCCNc1ccc(cc1)C(=O)NC 27a_100020603323_100000155074 [0,1,0,0,0,0|2,0,1]=4 1431 B17R1.1455 CCCSCCNc1ccc(cc1)C(=O)NN 27a_100020603323_100000183614 [0,1,0,0,0,0|3,0,0]=4 1432 B17R1.1455 CCCSCCOc1ccc(cc1)C(=O)OC 62a_100000210303_100000742590 [0,1,0,0,0,0|2,0,1]=4 1433 B17R1.1455 CCCSCCOc1ccc(cc1)C(=O)OC 62a_100000742590_100000210303 [0,1,0,0,0,0|2,0,1]=4 1434 B17R1.1455 CCNCCCOc1ccc(cc1)C(=O)OC 2230a_100015525214_100011310726 [0,1,0,0,0,0|2,0,1]=4 1435 B17R1.1455 CCOCCCCc1ccc(cc1)C(=O)OC 34a_100010141194_100000210202 [0,1,0,0,0,0|1,0,1]=3 1436 B17R1.1455 CCOCCCCc1ccc(cc1)C(=O)OC 7a_100010141194_100000210202 [0,1,0,0,0,0|1,0,1]=3 1437 B17R1.1455 CCOCCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100012232248 [0,1,0,0,0,0|2,0,1]=4 1438 B17R1.1455 CCOCCCNc1ccc(cc1)C(=O)NC 27a_100000210961_100000155074 [0,1,0,0,0,0|2,0,1]=4 1439 B17R1.1455 CCOCCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100012232248 [0,1,0,0,0,0|2,0,1]=4 1440 B17R1.1455 CCOCCCNc1ccc(cc1)C(=O)NN 27a_100000210961_100000183614 [0,1,0,0,0,0|3,0,0]=4 1441 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100012232248 [0,1,0,0,0,0|2,0,1]=4 1442 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100012232248 [0,1,0,0,0,0|1,0,2]=4 1443 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100012232248 [0,1,0,0,0,0|1,0,2]=4 1444 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100012232248 [0,1,0,0,0,0|2,0,1]=4 1445 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100012232248 [0,1,0,0,0,0|2,0,1]=4 1446 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100012232248 [0,1,0,0,0,0|2,0,1]=4 1447 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100012232248 [0,1,0,0,0,0|2,0,1]=4 1448 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100012232248 [0,1,0,0,0,0|2,0,1]=4 1449 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100012232248 [0,1,0,0,0,0|3,0,0]=4 1450 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100012232248 [0,1,0,0,0,0|2,0,1]=4 1451 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)OC 34a_100121572206_100011310726 [0,1,0,0,0,0|2,0,1]=4 1452 B17R1.1455 CCOCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100012232248 [0,1,0,0,0,0|2,0,1]=4 1453 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)C#N 62a_100012232248_100009994572 [0,1,0,0,0,0|2,0,1]=4 1454 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100012232248 [0,1,0,0,0,0|2,0,0]=3 1455 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)C=O 62a_100012232248_100000725942 [0,1,0,0,0,0|2,0,0]=3 1456 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100012232248 [0,1,0,0,0,0|1,0,2]=4 1457 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CC 62a_100012232248_100000211647 [0,1,0,0,0,0|1,0,2]=4 1458 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100012232248 [0,1,0,0,0,0|2,0,1]=4 1459 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CN 62a_100012232248_100000017248 [0,1,0,0,0,0|2,0,1]=4 1460 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100012232248 [0,1,0,0,0,0|2,0,1]=4 1461 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)CO 62a_100012232248_100011219529 [0,1,0,0,0,0|2,0,1]=4 1462 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100012232248 [0,1,0,0,0,0|2,0,1]=4 1463 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)NC 62a_100012232248_100000155074 [0,1,0,0,0,0|2,0,1]=4 1464 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100012232248 [0,1,0,0,0,0|3,0,0]=4 1465 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)NN 62a_100012232248_100000183614 [0,1,0,0,0,0|3,0,0]=4 1466 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100012232248 [0,1,0,0,0,0|2,0,1]=4 1467 B17R1.1455 CCOCCCSc1ccc(cc1)C(=O)OC 62a_100012232248_100000150774 [0,1,0,0,0,0|2,0,1]=4 1468 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 207a_100011200944_100000043907 [0,1,0,0,0,0|2,0,1]=4 1469 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100011215890 [0,1,0,0,0,0|2,0,1]=4 1470 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 2230a_102516460346_100000753832 [0,1,0,0,0,0|2,0,1]=4 1471 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 270004a_102516460346_100000043907 [0,1,0,0,0,0|2,0,1]=4 1472 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000210147 [0,1,0,0,0,0|2,0,1]=4 1473 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)NC 34a_102516460346_100000753832 [0,1,0,0,0,0|2,0,1]=4 1474 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)OC 2230a_102516460346_100000735637 [0,1,0,0,0,0|2,0,1]=4 1475 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)OC 270004a_102516460346_100000148700 [0,1,0,0,0,0|2,0,1]=4 1476 B17R1.1455 CCOCCNCc1ccc(cc1)C(=O)OC 34a_102516460346_100000735637 [0,1,0,0,0,0|2,0,1]=4 1477 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)NC 34a_100000210136_100000753832 [0,1,0,0,0,0|2,0,1]=4 1478 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)NC 7a_100000210136_100000753832 [0,1,0,0,0,0|2,0,1]=4 1479 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210147 [0,1,0,0,0,0|2,0,1]=4 1480 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)OC 34a_100000210136_100000735637 [0,1,0,0,0,0|2,0,1]=4 1481 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100011215890 [0,1,0,0,0,0|2,0,1]=4 1482 B17R1.1455 CCOCCOCc1ccc(cc1)C(=O)OC 7a_100000210136_100000735637 [0,1,0,0,0,0|2,0,1]=4 1483 B17R1.1455 CCOCCSCc1ccc(cc1)C(=O)NC 62a_100000210147_100000753832 [0,1,0,0,0,0|2,0,1]=4 1484 B17R1.1455 CCOCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100011215890 [0,1,0,0,0,0|2,0,1]=4 1485 B17R1.1455 CCOCCSCc1ccc(cc1)C(=O)OC 62a_100000210147_100000187170 [0,1,0,0,0,0|2,0,1]=4 1486 B17R1.1455 CCOCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100011215890 [0,1,0,0,0,0|2,0,1]=4 1487 B17R1.1455 CCOCSCCc1ccc(cc1)C(=O)OC 62a_100000739092_100010192280 [0,1,0,0,0,0|2,0,1]=4 1488 B17R1.1455 CCOCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000739092 [0,1,0,0,0,0|2,0,1]=4 1489 B17R1.1455 CCSCCCOc1ccc(cc1)C(=O)OC 62a_100000210202_100011310726 [0,1,0,0,0,0|2,0,1]=4 1490 B17R1.1455 CCSCCCOc1ccc(cc1)C(=O)OC 62a_100011310726_100000210202 [0,1,0,0,0,0|2,0,1]=4 1491 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)NC 207a_100000106463_100000043907 [0,1,0,0,0,0|2,0,1]=4 1492 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)NC 2230a_100000106463_100000753832 [0,1,0,0,0,0|2,0,1]=4 1493 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000757381 [0,1,0,0,0,0|2,0,1]=4 1494 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)NC 270004a_100000106463_100000043907 [0,1,0,0,0,0|2,0,1]=4 1495 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000757381 [0,1,0,0,0,0|2,0,1]=4 1496 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)OC 2230a_100000106463_100000735637 [0,1,0,0,0,0|2,0,1]=4 1497 B17R1.1455 CCSCCNCc1ccc(cc1)C(=O)OC 270004a_100000106463_100000148700 [0,1,0,0,0,0|2,0,1]=4 1498 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)NC 34a_100000212035_100000753832 [0,1,0,0,0,0|2,0,1]=4 1499 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)NC 7a_100000212035_100000753832 [0,1,0,0,0,0|2,0,1]=4 1500 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000757381 [0,1,0,0,0,0|2,0,1]=4 1501 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)OC 34a_100000212035_100000735637 [0,1,0,0,0,0|2,0,1]=4 1502 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000757381 [0,1,0,0,0,0|2,0,1]=4 1503 B17R1.1455 CCSCCOCc1ccc(cc1)C(=O)OC 7a_100000212035_100000735637 [0,1,0,0,0,0|2,0,1]=4 1504 B17R1.1455 CCSCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000757381 [0,1,0,0,0,0|2,0,1]=4 1505 B17R1.1455 CCSCCSCc1ccc(cc1)C(=O)NC 62a_100000757381_100000753832 [0,1,0,0,0,0|2,0,1]=4 1506 B17R1.1455 CCSCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000757381 [0,1,0,0,0,0|2,0,1]=4 1507 B17R1.1455 CCSCCSCc1ccc(cc1)C(=O)OC 62a_100000757381_100000187170 [0,1,0,0,0,0|2,0,1]=4 1508 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCF 2230a_100000743749_100000729493 [0,1,0,0,0,0|2,0,1]=4 1509 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCF 34a_100000743749_100000729493 [0,1,0,0,0,0|2,0,1]=4 1510 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 207a_100000750430_100000043907 [0,1,0,0,0,0|2,0,1]=4 1511 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 2230a_100000743749_100000210776 [0,1,0,0,0,0|2,0,1]=4 1512 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 2230a_100000750430_100000753832 [0,1,0,0,0,0|2,0,1]=4 1513 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 270004a_100000750430_100000043907 [0,1,0,0,0,0|2,0,1]=4 1514 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 34a_100000743749_100011216708 [0,1,0,0,0,0|2,0,1]=4 1515 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCCO 34a_100000750430_100000753832 [0,1,0,0,0,0|2,0,1]=4 1516 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCOC 207a_100150723488_100000043907 [0,1,0,0,0,0|2,0,1]=4 1517 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCOC 2230a_100000743749_100000740836 [0,1,0,0,0,0|2,0,1]=4 1518 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCOC 270004a_100150723488_100000043907 [0,1,0,0,0,0|2,0,1]=4 1519 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCOC 34a_100000743749_100000740836 [0,1,0,0,0,0|2,0,1]=4 1520 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCOC 34a_100150723488_100000753832 [0,1,0,0,0,0|2,0,1]=4 1521 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCSC 207a_100000749238_100000043907 [0,1,0,0,0,0|2,0,1]=4 1522 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCSC 2230a_100000749238_100000753832 [0,1,0,0,0,0|2,0,1]=4 1523 B17R1.1455 CNC(=O)c1ccc(cc1)CNCCCSC 270004a_100000749238_100000043907 [0,1,0,0,0,0|2,0,1]=4 1524 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCBr 34a_100011216708_100000753832 [0,1,0,0,0,0|2,0,1]=4 1525 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCCl 34a_100000210776_100000753832 [0,1,0,0,0,0|2,0,1]=4 1526 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCCl 7a_100000210776_100000753832 [0,1,0,0,0,0|2,0,1]=4 1527 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCF 34a_100011995726_100000753832 [0,1,0,0,0,0|2,0,1]=4 1528 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCF 7a_100011995726_100000753832 [0,1,0,0,0,0|2,0,1]=4 1529 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCI 34a_200012148704_100000753832 [0,1,0,0,0,0|2,0,1]=4 1530 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCCN 34a_100000750430_100000753832 [0,1,0,0,0,0|2,0,1]=4 1531 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCOC 34a_100000740835_100000753832 [0,1,0,0,0,0|2,0,1]=4 1532 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCSC 34a_100000690336_100000753832 [0,1,0,0,0,0|2,0,1]=4 1533 B17R1.1455 CNC(=O)c1ccc(cc1)COCCCSC 7a_100000690336_100000753832 [0,1,0,0,0,0|2,0,1]=4 1534 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCCF 62a_100000729493_100000753832 [0,1,0,0,0,0|2,0,1]=4 1535 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCCF 62a_100000753832_100000729493 [0,1,0,0,0,0|2,0,1]=4 1536 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCCO 62a_100000210776_100000753832 [0,1,0,0,0,0|2,0,1]=4 1537 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCCO 62a_100000753832_100000210776 [0,1,0,0,0,0|2,0,1]=4 1538 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCOC 62a_100000709357_100000753832 [0,1,0,0,0,0|2,0,1]=4 1539 B17R1.1455 CNC(=O)c1ccc(cc1)CSCCCOC 62a_100000753832_100000709357 [0,1,0,0,0,0|2,0,1]=4 1540 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCCF 2230a_100000184841_100000729378 [0,1,0,0,0,0|2,0,1]=4 1541 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCCF 34a_100000184841_100000729378 [0,1,0,0,0,0|2,0,1]=4 1542 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCCO 2230a_100000184841_100000746330 [0,1,0,0,0,0|2,0,1]=4 1543 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCCO 27a_100000762737_100000155074 [0,1,0,0,0,0|2,0,1]=4 1544 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCCO 34a_100000184841_100000746330 [0,1,0,0,0,0|2,0,1]=4 1545 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCOC 2230a_100000184841_100000730899 [0,1,0,0,0,0|2,0,1]=4 1546 B17R1.1455 CNC(=O)c1ccc(cc1)NCCCCOC 34a_100000184841_100000755781 [0,1,0,0,0,0|2,0,1]=4 1547 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCCF 34a_100000192141_100000729378 [0,1,0,0,0,0|2,0,1]=4 1548 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCCF 7a_100000192141_100000729378 [0,1,0,0,0,0|2,0,1]=4 1549 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCCO 34a_100000192141_100000746330 [0,1,0,0,0,0|2,0,1]=4 1550 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCCO 7a_100000192141_100000746330 [0,1,0,0,0,0|2,0,1]=4 1551 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCOC 34a_100000192141_100000755781 [0,1,0,0,0,0|2,0,1]=4 1552 B17R1.1455 CNC(=O)c1ccc(cc1)OCCCCOC 7a_100000192141_100000730899 [0,1,0,0,0,0|2,0,1]=4 1553 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCCF 62a_100000155074_100000729378 [0,1,0,0,0,0|2,0,1]=4 1554 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000155074 [0,1,0,0,0,0|2,0,1]=4 1555 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCCO 62a_100000155074_100000746330 [0,1,0,0,0,0|2,0,1]=4 1556 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000155074 [0,1,0,0,0,0|2,0,1]=4 1557 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCOC 62a_100000155074_100000730899 [0,1,0,0,0,0|2,0,1]=4 1558 B17R1.1455 CNC(=O)c1ccc(cc1)SCCCCOC 62a_100000730899_100000155074 [0,1,0,0,0,0|2,0,1]=4 1559 B17R1.1455 CNCCCOCc1ccc(cc1)C(=O)NC 34a_100000213112_100000753832 [0,1,0,0,0,0|2,0,1]=4 1560 B17R1.1455 CNCCCOCc1ccc(cc1)C(=O)OC 34a_100000213112_100000735637 [0,1,0,0,0,0|2,0,1]=4 1561 B17R1.1455 COC(=O)c1ccc(cc1)CCCCOCF 34a_100010141194_100015361967 [0,1,0,0,0,0|2,0,1]=4 1562 B17R1.1455 COC(=O)c1ccc(cc1)CCCCOCF 7a_100010141194_100015361967 [0,1,0,0,0,0|2,0,1]=4 1563 B17R1.1455 COC(=O)c1ccc(cc1)CCCNCCF 34a_100000724931_100010192279 [0,1,0,0,0,0|2,0,1]=4 1564 B17R1.1455 COC(=O)c1ccc(cc1)CCCNCCO 2230a_100016997473_100010192279 [0,1,0,0,0,0|2,0,1]=4 1565 B17R1.1455 COC(=O)c1ccc(cc1)CCCNCCO 34a_100016990907_100010192279 [0,1,0,0,0,0|2,0,1]=4 1566 B17R1.1455 COC(=O)c1ccc(cc1)CCCOCCBr 34a_100000211926_100010192279 [0,1,0,0,0,0|2,0,1]=4 1567 B17R1.1455 COC(=O)c1ccc(cc1)CCCOCCN 34a_100000210304_100010192279 [0,1,0,0,0,0|2,0,1]=4 1568 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCCF 62a_100010192279_100011217306 [0,1,0,0,0,0|2,0,1]=4 1569 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCCF 62a_100011217306_100010192279 [0,1,0,0,0,0|2,0,1]=4 1570 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCCO 62a_100000211926_100010192279 [0,1,0,0,0,0|2,0,1]=4 1571 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCCO 62a_100010192279_100000211926 [0,1,0,0,0,0|2,0,1]=4 1572 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCSC 62a_100010192279_100011218213 [0,1,0,0,0,0|2,0,1]=4 1573 B17R1.1455 COC(=O)c1ccc(cc1)CCCSCSC 62a_100011218213_100010192279 [0,1,0,0,0,0|2,0,1]=4 1574 B17R1.1455 COC(=O)c1ccc(cc1)CCNCCCF 2230a_100015189416_100010192280 [0,1,0,0,0,0|2,0,1]=4 1575 B17R1.1455 COC(=O)c1ccc(cc1)CCNCCCF 34a_100015189416_100010192280 [0,1,0,0,0,0|2,0,1]=4 1576 B17R1.1455 COC(=O)c1ccc(cc1)CCNCCSC 2230a_100020590264_100010192280 [0,1,0,0,0,0|2,0,1]=4 1577 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCBr 34a_100011217188_100010192280 [0,1,0,0,0,0|2,0,1]=4 1578 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCCl 34a_100000230001_100010192280 [0,1,0,0,0,0|2,0,1]=4 1579 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCF 34a_100000759539_100010192280 [0,1,0,0,0,0|2,0,1]=4 1580 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCF 34a_100010779965_100011934791 [0,1,0,0,0,0|2,0,1]=4 1581 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCF 7a_100010779965_100011934791 [0,1,0,0,0,0|2,0,1]=4 1582 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCN 34a_100000182051_100010192280 [0,1,0,0,0,0|2,0,1]=4 1583 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCO 34a_100010779965_100000230001 [0,1,0,0,0,0|2,0,1]=4 1584 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCCO 7a_100010779965_100011215043 [0,1,0,0,0,0|2,0,1]=4 1585 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCSC 34a_100000230434_100010192280 [0,1,0,0,0,0|2,0,1]=4 1586 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCSC 34a_100010779965_100000212216 [0,1,0,0,0,0|2,0,1]=4 1587 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCSC 7a_100000230434_100010192280 [0,1,0,0,0,0|2,0,1]=4 1588 B17R1.1455 COC(=O)c1ccc(cc1)CCOCCSC 7a_100010779965_100000212216 [0,1,0,0,0,0|2,0,1]=4 1589 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCCF 62a_100010192280_100011934791 [0,1,0,0,0,0|2,0,1]=4 1590 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCCF 62a_100011934791_100010192280 [0,1,0,0,0,0|2,0,1]=4 1591 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCCO 62a_100010192280_100011215043 [0,1,0,0,0,0|2,0,1]=4 1592 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCCO 62a_100011215043_100010192280 [0,1,0,0,0,0|2,0,1]=4 1593 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCSC 62a_100000212216_100010192280 [0,1,0,0,0,0|2,0,1]=4 1594 B17R1.1455 COC(=O)c1ccc(cc1)CCSCCSC 62a_100010192280_100000751147 [0,1,0,0,0,0|2,0,1]=4 1595 B17R1.1455 COC(=O)c1ccc(cc1)CNCCCCO 2230a_100000750430_100000735637 [0,1,0,0,0,0|2,0,1]=4 1596 B17R1.1455 COC(=O)c1ccc(cc1)CNCCCCO 270004a_100000750430_100000148700 [0,1,0,0,0,0|2,0,1]=4 1597 B17R1.1455 COC(=O)c1ccc(cc1)CNCCCCO 34a_100000750430_100000735637 [0,1,0,0,0,0|2,0,1]=4 1598 B17R1.1455 COC(=O)c1ccc(cc1)CNCCCSC 2230a_100000749238_100000735637 [0,1,0,0,0,0|2,0,1]=4 1599 B17R1.1455 COC(=O)c1ccc(cc1)CNCCCSC 270004a_100000749238_100000148700 [0,1,0,0,0,0|2,0,1]=4 1600 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCBr 34a_100011216708_100000735637 [0,1,0,0,0,0|2,0,1]=4 1601 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCCl 34a_100000210776_100000735637 [0,1,0,0,0,0|2,0,1]=4 1602 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCCl 7a_100000210776_100000735637 [0,1,0,0,0,0|2,0,1]=4 1603 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCF 34a_100000151488_100000729493 [0,1,0,0,0,0|2,0,1]=4 1604 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCF 34a_100011995726_100000735637 [0,1,0,0,0,0|2,0,1]=4 1605 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCF 7a_100000151488_100000729493 [0,1,0,0,0,0|2,0,1]=4 1606 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCF 7a_100011995726_100000735637 [0,1,0,0,0,0|2,0,1]=4 1607 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCI 34a_200012148704_100000735637 [0,1,0,0,0,0|2,0,1]=4 1608 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCN 34a_100000750430_100000735637 [0,1,0,0,0,0|2,0,1]=4 1609 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCO 34a_100000151488_100011216708 [0,1,0,0,0,0|2,0,1]=4 1610 B17R1.1455 COC(=O)c1ccc(cc1)COCCCCO 7a_100000151488_100000210776 [0,1,0,0,0,0|2,0,1]=4 1611 B17R1.1455 COC(=O)c1ccc(cc1)COCCCSC 34a_100000690336_100000735637 [0,1,0,0,0,0|2,0,1]=4 1612 B17R1.1455 COC(=O)c1ccc(cc1)COCCCSC 7a_100000690336_100000735637 [0,1,0,0,0,0|2,0,1]=4 1613 B17R1.1455 COC(=O)c1ccc(cc1)CSCCCCF 62a_100000729493_100000187170 [0,1,0,0,0,0|2,0,1]=4 1614 B17R1.1455 COC(=O)c1ccc(cc1)CSCCCCF 62a_100000735637_100000729493 [0,1,0,0,0,0|2,0,1]=4 1615 B17R1.1455 COC(=O)c1ccc(cc1)CSCCCCO 62a_100000210776_100000187170 [0,1,0,0,0,0|2,0,1]=4 1616 B17R1.1455 COC(=O)c1ccc(cc1)CSCCCCO 62a_100000735637_100000210776 [0,1,0,0,0,0|2,0,1]=4 1617 B17R1.1455 COC(=O)c1ccc(cc1)OCCCCCF 34a_100000150123_100000729378 [0,1,0,0,0,0|2,0,1]=4 1618 B17R1.1455 COC(=O)c1ccc(cc1)OCCCCCF 7a_100000150123_100000729378 [0,1,0,0,0,0|2,0,1]=4 1619 B17R1.1455 COC(=O)c1ccc(cc1)OCCCCCO 34a_100000150123_100000746330 [0,1,0,0,0,0|2,0,1]=4 1620 B17R1.1455 COC(=O)c1ccc(cc1)OCCCCCO 7a_100000150123_100000746330 [0,1,0,0,0,0|2,0,1]=4 1621 B17R1.1455 COC(=O)c1ccc(cc1)SCCCCCF 62a_100000150774_100000729378 [0,1,0,0,0,0|2,0,1]=4 1622 B17R1.1455 COC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000150774 [0,1,0,0,0,0|2,0,1]=4 1623 B17R1.1455 COC(=O)c1ccc(cc1)SCCCCCO 62a_100000150774_100000746330 [0,1,0,0,0,0|2,0,1]=4 1624 B17R1.1455 COC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000150774 [0,1,0,0,0,0|2,0,1]=4 1625 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000730899 [0,1,0,0,0,0|2,0,1]=4 1626 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000730899 [0,1,0,0,0,0|2,0,1]=4 1627 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000755781 [0,1,0,0,0,0|2,0,1]=4 1628 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000730899 [0,1,0,0,0,0|2,0,1]=4 1629 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000755781 [0,1,0,0,0,0|3,0,0]=4 1630 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000755781 [0,1,0,0,0,0|2,0,1]=4 1631 B17R1.1455 COCCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000730899 [0,1,0,0,0,0|2,0,1]=4 1632 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)C#N 62a_100000730899_100009994572 [0,1,0,0,0,0|2,0,1]=4 1633 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000730899 [0,1,0,0,0,0|2,0,0]=3 1634 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)C=O 62a_100000730899_100000725942 [0,1,0,0,0,0|2,0,0]=3 1635 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000730899 [0,1,0,0,0,0|2,0,1]=4 1636 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)CN 62a_100000730899_100000017248 [0,1,0,0,0,0|2,0,1]=4 1637 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)CO 62a_100000730899_100011219529 [0,1,0,0,0,0|2,0,1]=4 1638 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000730899 [0,1,0,0,0,0|2,0,1]=4 1639 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000730899 [0,1,0,0,0,0|3,0,0]=4 1640 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)NN 62a_100000730899_100000183614 [0,1,0,0,0,0|3,0,0]=4 1641 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000730899 [0,1,0,0,0,0|2,0,1]=4 1642 B17R1.1455 COCCCCSc1ccc(cc1)C(=O)OC 62a_100000730899_100000150774 [0,1,0,0,0,0|2,0,1]=4 1643 B17R1.1455 COCCCNCc1ccc(cc1)C(=O)OC 270004a_100150723488_100000148700 [0,1,0,0,0,0|2,0,1]=4 1644 B17R1.1455 COCCCNCc1ccc(cc1)C(=O)OC 34a_100150723488_100000735637 [0,1,0,0,0,0|2,0,1]=4 1645 B17R1.1455 COCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000740836 [0,1,0,0,0,0|2,0,1]=4 1646 B17R1.1455 COCCCOCc1ccc(cc1)C(=O)OC 34a_100000740835_100000735637 [0,1,0,0,0,0|2,0,1]=4 1647 B17R1.1455 COCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000740836 [0,1,0,0,0,0|2,0,1]=4 1648 B17R1.1455 COCCCSCc1ccc(cc1)C(=O)OC 62a_100000709357_100000187170 [0,1,0,0,0,0|2,0,1]=4 1649 B17R1.1455 COCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000709357 [0,1,0,0,0,0|2,0,1]=4 1650 B17R1.1455 COCCNCCc1ccc(cc1)C(=O)OC 2230a_100000209980_100010192280 [0,1,0,0,0,0|2,0,1]=4 1651 B17R1.1455 COCCOCCc1ccc(cc1)C(=O)OC 34a_100000210237_100010192280 [0,1,0,0,0,0|2,0,1]=4 1652 B17R1.1455 COCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100011201679 [0,1,0,0,0,0|2,0,1]=4 1653 B17R1.1455 COCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000233755 [0,1,0,0,0,0|2,0,1]=4 1654 B17R1.1455 COCCOCSc1ccc(cc1)C(=O)C=O 62a_100000231047_100000725942 [0,1,0,0,0,0|3,0,0]=4 1655 B17R1.1455 COCCOCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000231047 [0,1,0,0,0,0|3,0,0]=4 1656 B17R1.1455 COCCSCCc1ccc(cc1)C(=O)OC 62a_100000233755_100010192280 [0,1,0,0,0,0|2,0,1]=4 1657 B17R1.1455 COCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000233755 [0,1,0,0,0,0|2,0,1]=4 1658 B17R1.1455 COCSCCCc1ccc(cc1)C(=O)OC 62a_100000766300_100010192279 [0,1,0,0,0,0|2,0,1]=4 1659 B17R1.1455 COCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000766300 [0,1,0,0,0,0|2,0,1]=4 1660 B17R1.1455 N#CC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100009994572 [0,1,0,0,0,0|2,0,1]=4 1661 B17R1.1455 N#CC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100009994572 [0,1,0,0,0,0|2,0,1]=4 1662 B17R1.1455 N#CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000211819 [0,1,0,0,0,0|2,0,1]=4 1663 B17R1.1455 N#CCCCCSc1ccc(cc1)C(=O)C=O 62a_100011219923_100000725942 [0,1,0,0,0,0|2,0,1]=4 1664 B17R1.1455 NCC(=O)c1ccc(cc1)SCCCCCF 62a_100000017248_100000729378 [0,1,0,0,0,0|2,0,1]=4 1665 B17R1.1455 NCC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000017248 [0,1,0,0,0,0|2,0,1]=4 1666 B17R1.1455 NCC(=O)c1ccc(cc1)SCCCCCO 62a_100000017248_100000746330 [0,1,0,0,0,0|2,0,1]=4 1667 B17R1.1455 NCC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000017248 [0,1,0,0,0,0|2,0,1]=4 1668 B17R1.1455 NNC(=O)c1ccc(cc1)NCCCCCO 27a_100000762737_100000183614 [0,1,0,0,0,0|3,0,0]=4 1669 B17R1.1455 NNC(=O)c1ccc(cc1)OCCCCCF 34a_100000185078_100000729378 [0,1,0,0,0,0|3,0,0]=4 1670 B17R1.1455 NNC(=O)c1ccc(cc1)OCCCCCO 34a_100000185078_100000746330 [0,1,0,0,0,0|3,0,0]=4 1671 B17R1.1455 NNC(=O)c1ccc(cc1)SCCCCCF 62a_100000183614_100000729378 [0,1,0,0,0,0|3,0,0]=4 1672 B17R1.1455 NNC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000183614 [0,1,0,0,0,0|3,0,0]=4 1673 B17R1.1455 NNC(=O)c1ccc(cc1)SCCCCCO 62a_100000183614_100000746330 [0,1,0,0,0,0|3,0,0]=4 1674 B17R1.1455 NNC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000183614 [0,1,0,0,0,0|3,0,0]=4 1675 B17R1.1455 O=C(CBr)c1ccc(cc1)OCCCCCF 7a_100009814261_100000729378 [0,1,0,0,0,0|2,0,1]=4 1676 B17R1.1455 O=C(CBr)c1ccc(cc1)OCCCCCO 7a_100009814261_100000746330 [0,1,0,0,0,0|2,0,1]=4 1677 B17R1.1455 O=C(CCl)c1ccc(cc1)OCCCCCF 7a_100000018856_100000729378 [0,1,0,0,0,0|2,0,1]=4 1678 B17R1.1455 O=C(CCl)c1ccc(cc1)OCCCCCO 7a_100000018856_100000746330 [0,1,0,0,0,0|2,0,1]=4 1679 B17R1.1455 O=C(CF)c1ccc(cc1)OCCCCCF 34a_200010654591_100000729378 [0,1,0,0,0,0|2,0,1]=4 1680 B17R1.1455 O=C(CF)c1ccc(cc1)OCCCCCF 7a_200010654591_100000729378 [0,1,0,0,0,0|2,0,1]=4 1681 B17R1.1455 O=C(CF)c1ccc(cc1)OCCCCCO 34a_200010654591_100000746330 [0,1,0,0,0,0|2,0,1]=4 1682 B17R1.1455 O=C(CF)c1ccc(cc1)OCCCCCO 7a_200010654591_100000746330 [0,1,0,0,0,0|2,0,1]=4 1683 B17R1.1455 O=C(CO)c1ccc(cc1)SCCCCCF 62a_100000729378_100011219529 [0,1,0,0,0,0|2,0,1]=4 1684 B17R1.1455 O=C(CO)c1ccc(cc1)SCCCCCF 62a_100011219529_100000729378 [0,1,0,0,0,0|2,0,1]=4 1685 B17R1.1455 O=C(CO)c1ccc(cc1)SCCCCCO 62a_100000746330_100011219529 [0,1,0,0,0,0|2,0,1]=4 1686 B17R1.1455 O=C(CO)c1ccc(cc1)SCCCCCO 62a_100011219529_100000746330 [0,1,0,0,0,0|2,0,1]=4 1687 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCCCCF 62a_100000725942_100000729378 [0,1,0,0,0,0|2,0,0]=3 1688 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000725942 [0,1,0,0,0,0|2,0,0]=3 1689 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCCCCO 62a_100000725942_100000746330 [0,1,0,0,0,0|2,0,0]=3 1690 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000725942 [0,1,0,0,0,0|2,0,0]=3 1691 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCOCCO 62a_100000725942_100011215305 [0,1,0,0,0,0|3,0,0]=4 1692 B17R1.1455 O=CC(=O)c1ccc(cc1)SCCOCCO 62a_100011215305_100000725942 [0,1,0,0,0,0|3,0,0]=4 1693 B17R1.1455 O=CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000139335_100000725942 [0,1,0,0,0,0|2,0,1]=4 1694 B17R1.1455 O=CCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000139335 [0,1,0,0,0,0|2,0,1]=4 1695 B17R1.1857 CCCCCC(=O)c1ccc(cc1)C(=O)NC 1458a_100011298788_100000210326 [0,1,0,0,0,0|1,0,2]=4 1696 B17R1.1857 CCCCCC(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_100000210326 [0,1,0,0,0,0|1,0,2]=4 1697 B17R1.1857 CCCCCN(C)c1ccc(cc1)C(=O)NC 27a_100000223495_100000155074 [0,1,0,0,0,0|2,0,1]=4 1698 B17R1.1857 CCCCCN(C)c1ccc(cc1)C(=O)NN 27a_100000223495_100000183614 [0,1,0,0,0,0|3,0,0]=4 1699 B17R1.1857 CCCCCN(C)c1ccc(cc1)C(=O)OC 2230a_100000220287_100000210326 [0,1,0,0,0,0|2,0,1]=4 1700 B17R1.1857 CCCCCN(C)c1ccc(cc1)C(=O)OC 269982a_100000220287_100000210215 [0,1,0,0,0,0|2,0,1]=4 1701 B17R1.1857 CCCCCN(C)c1ccc(cc1)C(=O)OC 34a_100000220287_100000718602 [0,1,0,0,0,0|2,0,1]=4 1702 B17R1.1857 CCCCNC(C)c1ccc(cc1)C(=O)OC 2230a_100000102301_100010159609 [0,1,0,0,0,0|2,0,1]=4 1703 B17R1.1857 CCCCNC(C)c1ccc(cc1)C(=O)OC 7a_106832991798_100010159609 [0,1,0,0,0,0|2,0,1]=4 1704 B17R1.1857 CCCCOC(C)c1ccc(cc1)C(=O)OC 34a_100000036437_100000210210 [0,1,0,0,0,0|2,0,1]=4 1705 B17R1.1857 CCCCOC(C)c1ccc(cc1)C(=O)OC 7a_100000036437_100000210211 [0,1,0,0,0,0|2,0,1]=4 1706 B17R1.1857 CCCCOC(C)c1ccc(cc1)C(=O)OC 7a_100000210227_100010159609 [0,1,0,0,0,0|2,0,1]=4 1707 B17R1.1857 CCCCSC(C)c1ccc(cc1)C(=O)OC 62a_100000210211_100010159609 [0,1,0,0,0,0|2,0,1]=4 1708 B17R1.1857 CCCCSC(C)c1ccc(cc1)C(=O)OC 62a_100010159609_100000210210 [0,1,0,0,0,0|2,0,1]=4 1709 B17R1.9318 CCCCC(=Cc1ccc(cc1)C(=O)C=O)Br 271570a_206741709834_100000725942 [0,1,0,0,0,0|1,0,2]=4 1710 B17R1.9318 CCCCC(=O)Cc1ccc(cc1)C(=O)NC 1458a_100000210183_100000753832 [0,1,0,0,0,0|1,0,2]=4 1711 B17R1.9318 CCCCC(=O)Cc1ccc(cc1)C(=O)OC 1458a_100000210183_100000735637 [0,1,0,0,0,0|1,0,2]=4 1712 B17R1.9318 CCCCC(=O)Cc1ccc(cc1)C(=O)OC 1458a_100012277402_100000210211 [0,1,0,0,0,0|1,0,2]=4 1713 B17R1.9318 CCCCC(C)Nc1ccc(cc1)C(=O)NC 2230a_100000184841_200011215066 [0,1,0,0,0,0|2,0,1]=4 1714 B17R1.9318 CCCCC(C)Nc1ccc(cc1)C(=O)NC 27a_100000126638_100000155074 [0,1,0,0,0,0|2,0,1]=4 1715 B17R1.9318 CCCCC(C)Nc1ccc(cc1)C(=O)NC 34a_100000184841_200011215066 [0,1,0,0,0,0|2,0,1]=4 1716 B17R1.9318 CCCCC(C)Nc1ccc(cc1)C(=O)NN 27a_100000126638_100000183614 [0,1,0,0,0,0|3,0,0]=4 1717 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200011215066 [0,1,0,0,0,0|2,0,1]=4 1718 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CC 34a_100000212119_200011215066 [0,1,0,0,0,0|1,0,2]=4 1719 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CC 7a_100000212119_200011215066 [0,1,0,0,0,0|1,0,2]=4 1720 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200011215066 [0,1,0,0,0,0|2,0,1]=4 1721 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CF 34a_200010654591_200011215066 [0,1,0,0,0,0|2,0,1]=4 1722 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)CF 7a_200010654591_200011215066 [0,1,0,0,0,0|2,0,1]=4 1723 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)NC 34a_100000192141_200011215066 [0,1,0,0,0,0|2,0,1]=4 1724 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)NC 7a_100000192141_200011215066 [0,1,0,0,0,0|2,0,1]=4 1725 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)NN 34a_100000185078_200011215066 [0,1,0,0,0,0|3,0,0]=4 1726 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)OC 34a_100000150123_200011215066 [0,1,0,0,0,0|2,0,1]=4 1727 B17R1.9318 CCCCC(C)Oc1ccc(cc1)C(=O)OC 7a_100000150123_200011215066 [0,1,0,0,0,0|2,0,1]=4 1728 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)C#N 62a_200011215066_100009994572 [0,1,0,0,0,0|2,0,1]=4 1729 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200011215066 [0,1,0,0,0,0|2,0,0]=3 1730 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_200011215066_100000725942 [0,1,0,0,0,0|2,0,0]=3 1731 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CC 62a_100000211647_200011215066 [0,1,0,0,0,0|1,0,2]=4 1732 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CC 62a_200011215066_100000211647 [0,1,0,0,0,0|1,0,2]=4 1733 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CN 62a_100000017248_200011215066 [0,1,0,0,0,0|2,0,1]=4 1734 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CN 62a_200011215066_100000017248 [0,1,0,0,0,0|2,0,1]=4 1735 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CO 62a_100011219529_200011215066 [0,1,0,0,0,0|2,0,1]=4 1736 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)CO 62a_200011215066_100011219529 [0,1,0,0,0,0|2,0,1]=4 1737 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)NC 62a_100000155074_200011215066 [0,1,0,0,0,0|2,0,1]=4 1738 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)NC 62a_200011215066_100000155074 [0,1,0,0,0,0|2,0,1]=4 1739 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)NN 62a_100000183614_200011215066 [0,1,0,0,0,0|3,0,0]=4 1740 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)NN 62a_200011215066_100000183614 [0,1,0,0,0,0|3,0,0]=4 1741 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)OC 62a_100000150774_200011215066 [0,1,0,0,0,0|2,0,1]=4 1742 B17R1.9318 CCCCC(C)Sc1ccc(cc1)C(=O)OC 62a_200011215066_100000150774 [0,1,0,0,0,0|2,0,1]=4 1743 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)CBr 26a_100000207549_100009814261 [0,1,0,0,0,0|2,0,1]=4 1744 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)CC 26a_100000207549_100000212119 [0,1,0,0,0,0|1,0,2]=4 1745 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)CCl 26a_100000207549_100000018856 [0,1,0,0,0,0|2,0,1]=4 1746 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)CF 26a_100000207549_200010654591 [0,1,0,0,0,0|2,0,1]=4 1747 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)NC 2230a_100000207549_100000753832 [0,1,0,0,0,0|2,0,1]=4 1748 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)NC 269982a_100000207549_100000753832 [0,1,0,0,0,0|2,0,1]=4 1749 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)NC 270004a_100000207549_100000043907 [0,1,0,0,0,0|2,0,1]=4 1750 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 2230a_100000207549_100000735637 [0,1,0,0,0,0|2,0,1]=4 1751 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 2230a_100000737656_100000210211 [0,1,0,0,0,0|2,0,1]=4 1752 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 269982a_100000207549_100000735637 [0,1,0,0,0,0|2,0,1]=4 1753 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 269982a_100000737656_100000210211 [0,1,0,0,0,0|2,0,1]=4 1754 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 26a_100000207549_100000150123 [0,1,0,0,0,0|2,0,1]=4 1755 B17R1.9318 CCCCN(C)Cc1ccc(cc1)C(=O)OC 270004a_100000207549_100000148700 [0,1,0,0,0,0|2,0,1]=4 1756 B17R1.10890 CCCCCNc1ccc(cc1C)C(=O)NC 2230a_100000739472_100000210326 [0,1,0,0,0,0|2,0,1]=4 1757 B17R1.10890 CCCCCNc1ccc(cc1C)C(=O)NC 27a_100000209983_200013065384 [0,1,0,0,0,0|2,0,1]=4 1758 B17R1.10890 CCCCCNc1ccc(cc1C)C(=O)NC 34a_100000739472_100000718602 [0,1,0,0,0,0|2,0,1]=4 1759 B17R1.10890 CCCCCNc1ccc(cc1C)C(=O)NC 7a_100000739472_100000210326 [0,1,0,0,0,0|2,0,1]=4 1760 B17R1.10890 CCCCCNc1ccc(cc1C)C(=O)NN 27a_100000209983_100012339724 [0,1,0,0,0,0|3,0,0]=4 1761 B17R1.10890 CCCCCOc1ccc(cc1Br)C(=O)OC 34a_100000216328_100000718602 [0,1,0,0,0,0|2,0,1]=4 1762 B17R1.10890 CCCCCOc1ccc(cc1Br)C(=O)OC 7a_100000216328_100000210326 [0,1,0,0,0,0|2,0,1]=4 1763 B17R1.10890 CCCCCOc1ccc(cc1C)C(=O)OC 34a_100011997373_100000718602 [0,1,0,0,0,0|2,0,1]=4 1764 B17R1.10890 CCCCCOc1ccc(cc1C)C(=O)OC 7a_100011997373_100000210326 [0,1,0,0,0,0|2,0,1]=4 1765 B17R1.10890 CCCCCOc1ccc(cc1Cl)C(=O)CC 34a_100011218862_100000718602 [0,1,0,0,0,0|1,0,2]=4 1766 B17R1.10890 CCCCCOc1ccc(cc1Cl)C(=O)CC 7a_100011218862_100000210326 [0,1,0,0,0,0|1,0,2]=4 1767 B17R1.10890 CCCCCOc1ccc(cc1Cl)C(=O)CCl 7a_200010170092_100000210326 [0,1,0,0,0,0|2,0,1]=4 1768 B17R1.10890 CCCCCOc1ccc(cc1Cl)C(=O)OC 34a_100000151454_100000718602 [0,1,0,0,0,0|2,0,1]=4 1769 B17R1.10890 CCCCCOc1ccc(cc1Cl)C(=O)OC 7a_100000151454_100000210326 [0,1,0,0,0,0|2,0,1]=4 1770 B17R1.10890 CCCCCOc1ccc(cc1F)C(=O)OC 34a_100000075456_100000718602 [0,1,0,0,0,0|2,0,1]=4 1771 B17R1.10890 CCCCCOc1ccc(cc1F)C(=O)OC 7a_100000075456_100000210326 [0,1,0,0,0,0|2,0,1]=4 1772 B17R1.10890 CCCCCOc1ccc(cc1I)C(=O)OC 34a_100010162523_100000718602 [0,1,0,0,0,0|2,0,1]=4 1773 B17R1.10890 CCCCCOc1ccc(cc1I)C(=O)OC 7a_100010162523_100000210326 [0,1,0,0,0,0|2,0,1]=4 1774 B17R1.10890 CCCCCOc1ccc(cc1N)C(=O)NN 34a_200000039609_100000718602 [0,1,0,0,0,0|3,0,0]=4 1775 B17R1.10890 CCCCCOc1ccc(cc1N)C(=O)OC 34a_100000724433_100000718602 [0,1,0,0,0,0|2,0,1]=4 1776 B17R1.10890 CCCCCOc1ccc(cc1N)C(=O)OC 7a_100000724433_100000210326 [0,1,0,0,0,0|2,0,1]=4 1777 B17R1.10890 CCCCCSc1ccc(cc1Br)C(=O)OC 62a_100000210326_100011294788 [0,1,0,0,0,0|2,0,1]=4 1778 B17R1.10890 CCCCCSc1ccc(cc1Br)C(=O)OC 62a_100011294788_100000210326 [0,1,0,0,0,0|2,0,1]=4 1779 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)CC 62a_100000210326_200012349626 [0,1,0,0,0,0|1,0,2]=4 1780 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)CC 62a_200012349626_100000210326 [0,1,0,0,0,0|1,0,2]=4 1781 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)NC 62a_100000210326_200013065384 [0,1,0,0,0,0|2,0,1]=4 1782 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)NC 62a_200013065384_100000210326 [0,1,0,0,0,0|2,0,1]=4 1783 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)NN 62a_100000210326_100012339724 [0,1,0,0,0,0|3,0,0]=4 1784 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)NN 62a_100012339724_100000210326 [0,1,0,0,0,0|3,0,0]=4 1785 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)OC 62a_100000210326_100011215878 [0,1,0,0,0,0|2,0,1]=4 1786 B17R1.10890 CCCCCSc1ccc(cc1C)C(=O)OC 62a_100011215878_100000210326 [0,1,0,0,0,0|2,0,1]=4 1787 B17R1.10890 CCCCCSc1ccc(cc1Cl)C(=O)OC 62a_100000210326_100012356344 [0,1,0,0,0,0|2,0,1]=4 1788 B17R1.10890 CCCCCSc1ccc(cc1Cl)C(=O)OC 62a_100012356344_100000210326 [0,1,0,0,0,0|2,0,1]=4 1789 B17R1.10890 CCCCCSc1ccc(cc1F)C(=O)CN 62a_100000210326_100016989600 [0,1,0,0,0,0|2,0,1]=4 1790 B17R1.10890 CCCCCSc1ccc(cc1F)C(=O)CN 62a_100016989600_100000210326 [0,1,0,0,0,0|2,0,1]=4 1791 B17R1.10890 CCCCCSc1ccc(cc1F)C(=O)OC 62a_100000210326_100000703229 [0,1,0,0,0,0|2,0,1]=4 1792 B17R1.10890 CCCCCSc1ccc(cc1F)C(=O)OC 62a_100000703229_100000210326 [0,1,0,0,0,0|2,0,1]=4 1793 B17R1.10890 CCCCCSc1ccc(cc1N)C(=O)OC 62a_100000210326_100011450966 [0,1,0,0,0,0|2,0,1]=4 1794 B17R1.10890 CCCCCSc1ccc(cc1N)C(=O)OC 62a_100011450966_100000210326 [0,1,0,0,0,0|2,0,1]=4 1795 B17R1.10890 CCCCCSc1ccc(cc1O)C(=O)OC 62a_100000210326_100012350776 [0,1,0,0,0,0|2,0,1]=4 1796 B17R1.10890 CCCCCSc1ccc(cc1O)C(=O)OC 62a_100012350776_100000210326 [0,1,0,0,0,0|2,0,1]=4 1797 B17R1.10890 CCCCNCc1ccc(cc1Br)C(=O)OC 2230a_100000102301_100010201862 [0,1,0,0,0,0|2,0,1]=4 1798 B17R1.10890 CCCCNCc1ccc(cc1Br)C(=O)OC 270004a_100000102301_100000727569 [0,1,0,0,0,0|2,0,1]=4 1799 B17R1.10890 CCCCNCc1ccc(cc1Br)C(=O)OC 7a_106832991798_100010201862 [0,1,0,0,0,0|2,0,1]=4 1800 B17R1.10890 CCCCNCc1ccc(cc1C)C(=O)OC 270004a_100000102301_100010289884 [0,1,0,0,0,0|2,0,1]=4 1801 B17R1.10890 CCCCNCc1ccc(cc1Cl)C(=O)OC 2230a_100000102301_100012194053 [0,1,0,0,0,0|2,0,1]=4 1802 B17R1.10890 CCCCNCc1ccc(cc1Cl)C(=O)OC 270004a_100000102301_100012179231 [0,1,0,0,0,0|2,0,1]=4 1803 B17R1.10890 CCCCNCc1ccc(cc1Cl)C(=O)OC 7a_106832991798_100012194053 [0,1,0,0,0,0|2,0,1]=4 1804 B17R1.10890 CCCCNCc1ccc(cc1F)C(=O)OC 2230a_100000102301_100000694138 [0,1,0,0,0,0|2,0,1]=4 1805 B17R1.10890 CCCCNCc1ccc(cc1F)C(=O)OC 270004a_100000102301_100012178685 [0,1,0,0,0,0|2,0,1]=4 1806 B17R1.10890 CCCCNCc1ccc(cc1F)C(=O)OC 7a_106832991798_100000694138 [0,1,0,0,0,0|2,0,1]=4 1807 B17R1.10890 CCCCOCc1ccc(cc1Br)C(=O)OC 34a_100000210227_100010201862 [0,1,0,0,0,0|2,0,1]=4 1808 B17R1.10890 CCCCOCc1ccc(cc1Br)C(=O)OC 34a_100012355398_100000210210 [0,1,0,0,0,0|2,0,1]=4 1809 B17R1.10890 CCCCOCc1ccc(cc1Br)C(=O)OC 7a_100000210227_100010201862 [0,1,0,0,0,0|2,0,1]=4 1810 B17R1.10890 CCCCOCc1ccc(cc1Br)C(=O)OC 7a_100012355398_100000210211 [0,1,0,0,0,0|2,0,1]=4 1811 B17R1.10890 CCCCOCc1ccc(cc1Cl)C(=O)OC 34a_100000210227_100012194053 [0,1,0,0,0,0|2,0,1]=4 1812 B17R1.10890 CCCCOCc1ccc(cc1Cl)C(=O)OC 7a_100000210227_100012194053 [0,1,0,0,0,0|2,0,1]=4 1813 B17R1.10890 CCCCOCc1ccc(cc1F)C(=O)OC 34a_100000094453_100000210210 [0,1,0,0,0,0|2,0,1]=4 1814 B17R1.10890 CCCCOCc1ccc(cc1F)C(=O)OC 34a_100000210227_100000694138 [0,1,0,0,0,0|2,0,1]=4 1815 B17R1.10890 CCCCOCc1ccc(cc1F)C(=O)OC 7a_100000094453_100000210211 [0,1,0,0,0,0|2,0,1]=4 1816 B17R1.10890 CCCCOCc1ccc(cc1F)C(=O)OC 7a_100000210227_100000694138 [0,1,0,0,0,0|2,0,1]=4 1817 B17R1.10890 CCCCSCc1ccc(cc1Br)C(=O)OC 62a_100000210211_100010201862 [0,1,0,0,0,0|2,0,1]=4 1818 B17R1.10890 CCCCSCc1ccc(cc1Br)C(=O)OC 62a_100010201862_100000210210 [0,1,0,0,0,0|2,0,1]=4 1819 B17R1.10890 CCCCSCc1ccc(cc1Cl)C(=O)OC 62a_100000210211_100012194053 [0,1,0,0,0,0|2,0,1]=4 1820 B17R1.10890 CCCCSCc1ccc(cc1Cl)C(=O)OC 62a_100012194053_100000210210 [0,1,0,0,0,0|2,0,1]=4 1821 B17R1.10890 CCCCSCc1ccc(cc1F)C(=O)OC 62a_100000210211_100000694138 [0,1,0,0,0,0|2,0,1]=4 1822 B17R1.10890 CCCCSCc1ccc(cc1F)C(=O)OC 62a_100000694138_100000210210 [0,1,0,0,0,0|2,0,1]=4 1823 B17R2.224 CCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000210202 [0,0,0,1,0,0|0,0,2]=3 1824 B17R2.224 CCC(=O)c1ccc(cc1)C2CCOCC2 1458a_200010239727_100000210202 [0,0,0,1,0,0|1,0,2]=4 1825 B17R2.224 CCC(=O)c1ccc(cc1)N2CCCCC2 1458a_100000759421_100000210202 [0,0,0,1,0,0|1,0,2]=4 1826 B17R2.224 CNC(=O)c1ccc(cc1)C2CCCCC2 11a_106832991635_100000185286 [0,0,0,1,0,0|1,0,1]=3 1827 B17R2.224 CNC(=O)c1ccc(cc1)C2CCCCC2 1626a_100102657272_100000185286 [0,0,0,1,0,0|1,0,1]=3 1828 B17R2.224 CNC(=O)c1ccc(cc1)C2CCCCC2 240690a_100102657272_100000185286 [0,0,0,1,0,0|1,0,1]=3 1829 B17R2.224 CNC(=O)c1ccc(cc1)C2CCCCC2 527a_100102657272_100000185286 [0,0,0,1,0,0|1,0,1]=3 1830 B17R2.224 CNC(=O)c1ccc(cc1)C2CCOCC2 11a_106832991635_200010239727 [0,0,0,1,0,0|2,0,1]=4 1831 B17R2.224 CNC(=O)c1ccc(cc1)C2CCOCC2 1626a_100102657272_200010239727 [0,0,0,1,0,0|2,0,1]=4 1832 B17R2.224 CNC(=O)c1ccc(cc1)C2CCOCC2 240690a_100102657272_200010239727 [0,0,0,1,0,0|2,0,1]=4 1833 B17R2.224 CNC(=O)c1ccc(cc1)C2CCOCC2 527a_100102657272_200010239727 [0,0,0,1,0,0|2,0,1]=4 1834 B17R2.224 CNC(=O)c1ccc(cc1)N2CCCCC2 11a_106832991635_100000759421 [0,0,0,1,0,0|2,0,1]=4 1835 B17R2.224 CNC(=O)c1ccc(cc1)N2CCCCC2 1626a_100102657272_100000759421 [0,0,0,1,0,0|2,0,1]=4 1836 B17R2.224 CNC(=O)c1ccc(cc1)N2CCCCC2 240690a_100102657272_100000759421 [0,0,0,1,0,0|2,0,1]=4 1837 B17R2.224 CNC(=O)c1ccc(cc1)N2CCCCC2 527a_100102657272_100000759421 [0,0,0,1,0,0|2,0,1]=4 1838 B17R2.224 O=C(CF)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100015361967 [0,0,0,1,0,0|1,0,1]=3 1839 B17R2.224 O=C(CF)c1ccc(cc1)C2CCOCC2 1458a_200010239727_100015361967 [0,0,0,1,0,0|2,0,1]=4 1840 B17R2.224 O=C(CF)c1ccc(cc1)N2CCCCC2 1458a_100000759421_100015361967 [0,0,0,1,0,0|2,0,1]=4 1841 B17R2.224 O=CC(=O)c1ccc(cc1)C2=CCCCC2 271570a_100000062251_100000725942 [0,0,0,1,0,0|1,0,2]=4 1842 B17R2.570 CCC(=O)c1ccc(cc1)CN2CCCC2 1458a_100000188122_100000210202 [0,0,0,1,0,0|1,0,2]=4 1843 B17R2.570 CCC(=O)c1ccc(cc1)CN2CCCC2 26a_100000188435_100000212119 [0,0,0,1,0,0|1,0,2]=4 1844 B17R2.570 CCC(=O)c1ccc(cc1)OC2CCCC2 1458a_100000738054_100000210202 [0,0,0,1,0,0|1,0,2]=4 1845 B17R2.570 CCC(=O)c1ccc(cc1)OC2CCCC2 34a_100000212119_100000179811 [0,0,0,1,0,0|1,0,2]=4 1846 B17R2.570 CCC(=O)c1ccc(cc1)OC2CCCC2 7a_100000212119_100000179811 [0,0,0,1,0,0|1,0,2]=4 1847 B17R2.570 CCC(=O)c1ccc(cc1)SC2CCCC2 62a_100000211647_100000179811 [0,0,0,1,0,0|1,0,2]=4 1848 B17R2.570 CCC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000211647 [0,0,0,1,0,0|1,0,2]=4 1849 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 11a_106832991635_100000188122 [0,0,0,1,0,0|2,0,1]=4 1850 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 1626a_100102657272_100000188122 [0,0,0,1,0,0|2,0,1]=4 1851 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 2230a_100000188435_100000753832 [0,0,0,1,0,0|2,0,1]=4 1852 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 240690a_100102657272_100000188122 [0,0,0,1,0,0|2,0,1]=4 1853 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 269982a_100000188435_100000753832 [0,0,0,1,0,0|2,0,1]=4 1854 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 270004a_100000188435_100000043907 [0,0,0,1,0,0|2,0,1]=4 1855 B17R2.570 CNC(=O)c1ccc(cc1)CN2CCCC2 527a_100102657272_100000188122 [0,0,0,1,0,0|2,0,1]=4 1856 B17R2.570 CNC(=O)c1ccc(cc1)NC2CCCC2 2230a_100000184841_100000179811 [0,0,0,1,0,0|2,0,1]=4 1857 B17R2.570 CNC(=O)c1ccc(cc1)NC2CCCC2 27a_100000211070_100000155074 [0,0,0,1,0,0|2,0,1]=4 1858 B17R2.570 CNC(=O)c1ccc(cc1)NC2CCCC2 34a_100000184841_100000179811 [0,0,0,1,0,0|2,0,1]=4 1859 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 11a_106832991635_100000738054 [0,0,0,1,0,0|2,0,1]=4 1860 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 1626a_100102657272_100000738054 [0,0,0,1,0,0|2,0,1]=4 1861 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 240690a_100102657272_100000738054 [0,0,0,1,0,0|2,0,1]=4 1862 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 34a_100000192141_100000179811 [0,0,0,1,0,0|2,0,1]=4 1863 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 527a_100102657272_100000738054 [0,0,0,1,0,0|2,0,1]=4 1864 B17R2.570 CNC(=O)c1ccc(cc1)OC2CCCC2 7a_100000192141_100000179811 [0,0,0,1,0,0|2,0,1]=4 1865 B17R2.570 CNC(=O)c1ccc(cc1)SC2CCCC2 62a_100000155074_100000179811 [0,0,0,1,0,0|2,0,1]=4 1866 B17R2.570 CNC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000155074 [0,0,0,1,0,0|2,0,1]=4 1867 B17R2.570 COC(=O)c1ccc(cc1)CN2CCCC2 2230a_100000188435_100000735637 [0,0,0,1,0,0|2,0,1]=4 1868 B17R2.570 COC(=O)c1ccc(cc1)CN2CCCC2 269982a_100000188435_100000735637 [0,0,0,1,0,0|2,0,1]=4 1869 B17R2.570 COC(=O)c1ccc(cc1)CN2CCCC2 26a_100000188435_100000150123 [0,0,0,1,0,0|2,0,1]=4 1870 B17R2.570 COC(=O)c1ccc(cc1)CN2CCCC2 270004a_100000188435_100000148700 [0,0,0,1,0,0|2,0,1]=4 1871 B17R2.570 COC(=O)c1ccc(cc1)OC2CCCC2 34a_100000150123_100000179811 [0,0,0,1,0,0|2,0,1]=4 1872 B17R2.570 COC(=O)c1ccc(cc1)OC2CCCC2 7a_100000150123_100000179811 [0,0,0,1,0,0|2,0,1]=4 1873 B17R2.570 COC(=O)c1ccc(cc1)SC2CCCC2 62a_100000150774_100000179811 [0,0,0,1,0,0|2,0,1]=4 1874 B17R2.570 COC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000150774 [0,0,0,1,0,0|2,0,1]=4 1875 B17R2.570 N#CC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100009994572 [0,0,0,1,0,0|2,0,1]=4 1876 B17R2.570 NCC(=O)c1ccc(cc1)SC2CCCC2 62a_100000017248_100000179811 [0,0,0,1,0,0|2,0,1]=4 1877 B17R2.570 NCC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000017248 [0,0,0,1,0,0|2,0,1]=4 1878 B17R2.570 NNC(=O)c1ccc(cc1)NC2CCCC2 27a_100000211070_100000183614 [0,0,0,1,0,0|3,0,0]=4 1879 B17R2.570 NNC(=O)c1ccc(cc1)OC2CCCC2 34a_100000185078_100000179811 [0,0,0,1,0,0|3,0,0]=4 1880 B17R2.570 NNC(=O)c1ccc(cc1)SC2CCCC2 62a_100000183614_100000179811 [0,0,0,1,0,0|3,0,0]=4 1881 B17R2.570 NNC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000183614 [0,0,0,1,0,0|3,0,0]=4 1882 B17R2.570 O=C(CBr)c1ccc(cc1)CN2CCCC2 26a_100000188435_100009814261 [0,0,0,1,0,0|2,0,1]=4 1883 B17R2.570 O=C(CBr)c1ccc(cc1)OC2CCCC2 7a_100009814261_100000179811 [0,0,0,1,0,0|2,0,1]=4 1884 B17R2.570 O=C(CCl)c1ccc(cc1)CN2CCCC2 26a_100000188435_100000018856 [0,0,0,1,0,0|2,0,1]=4 1885 B17R2.570 O=C(CCl)c1ccc(cc1)OC2CCCC2 7a_100000018856_100000179811 [0,0,0,1,0,0|2,0,1]=4 1886 B17R2.570 O=C(CF)c1ccc(cc1)CN2CCCC2 1458a_100000188122_100015361967 [0,0,0,1,0,0|2,0,1]=4 1887 B17R2.570 O=C(CF)c1ccc(cc1)CN2CCCC2 26a_100000188435_200010654591 [0,0,0,1,0,0|2,0,1]=4 1888 B17R2.570 O=C(CF)c1ccc(cc1)OC2CCCC2 1458a_100000738054_100015361967 [0,0,0,1,0,0|2,0,1]=4 1889 B17R2.570 O=C(CF)c1ccc(cc1)OC2CCCC2 34a_200010654591_100000179811 [0,0,0,1,0,0|2,0,1]=4 1890 B17R2.570 O=C(CF)c1ccc(cc1)OC2CCCC2 7a_200010654591_100000179811 [0,0,0,1,0,0|2,0,1]=4 1891 B17R2.570 O=C(CO)c1ccc(cc1)SC2CCCC2 62a_100011217020_100011219529 [0,0,0,1,0,0|2,0,1]=4 1892 B17R2.570 O=C(CO)c1ccc(cc1)SC2CCCC2 62a_100011219529_100000179811 [0,0,0,1,0,0|2,0,1]=4 1893 B17R2.570 O=CC(=O)c1ccc(cc1)C=C2CCCC2 271570a_100010378317_100000725942 [0,0,0,1,0,0|1,0,2]=4 1894 B17R2.570 O=CC(=O)c1ccc(cc1)SC2CCCC2 62a_100000725942_100000179811 [0,0,0,1,0,0|2,0,0]=3 1895 B17R2.570 O=CC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000725942 [0,0,0,1,0,0|2,0,0]=3 1896 B17R2.570 O=CC(=O)c1ccc(cc1)SC2CCOC2 62a_100000725942_100000690089 [0,0,0,1,0,0|3,0,0]=4 1897 B17R2.572 CNC(=O)c1ccc(cc1)N2CCC[C@@H]2C 27a_100020605311_100000155074 [0,0,0,1,0,0|2,0,1]=4 1898 B17R2.572 CNC(=O)c1ccc(cc1)N2CCC[C@H]2C 27a_100015189458_100000155074 [0,0,0,1,0,0|2,0,1]=4 1899 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2C 2230a_100160571641_200000210301 [0,0,0,1,0,0|2,0,1]=4 1900 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2C 269982a_100160571641_200000210301 [0,0,0,1,0,0|2,0,1]=4 1901 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2C 34a_100160571641_200000210301 [0,0,0,1,0,0|2,0,1]=4 1902 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2[13CH3] 2230a_100160571641_200025704644 [0,0,0,1,0,0|2,0,1]=4 1903 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2[13CH3] 269982a_100160571641_200025704644 [0,0,0,1,0,0|2,0,1]=4 1904 B17R2.572 COC(=O)c1ccc(cc1)[C@H]2CCCN2[13CH3] 34a_100160571641_200025704644 [0,0,0,1,0,0|2,0,1]=4 1905 B17R2.572 C[C@@H]1CCCN1c2ccc(cc2)C(=O)NN 27a_100015189458_100000183614 [0,0,0,1,0,0|3,0,0]=4 1906 B17R2.572 C[C@H]1CCCN1c2ccc(cc2)C(=O)NN 27a_100020605311_100000183614 [0,0,0,1,0,0|3,0,0]=4 1907 B17R2.573 CC1CCN1Cc2ccc(cc2)C(=O)CBr 26a_100000755817_100009814261 [0,0,0,1,0,0|2,0,1]=4 1908 B17R2.573 CC1CCN1Cc2ccc(cc2)C(=O)CCl 26a_100000755817_100000018856 [0,0,0,1,0,0|2,0,1]=4 1909 B17R2.573 CC1CCN1Cc2ccc(cc2)C(=O)CF 26a_100000755817_200010654591 [0,0,0,1,0,0|2,0,1]=4 1910 B17R2.573 CCC(=O)c1ccc(cc1)CN2CCC2C 26a_100000755817_100000212119 [0,0,0,1,0,0|1,0,2]=4 1911 B17R2.573 CNC(=O)c1ccc(cc1)CN2CCC2C 269982a_100000755817_100000753832 [0,0,0,1,0,0|2,0,1]=4 1912 B17R2.573 CNC(=O)c1ccc(cc1)CN2CCC2C 34a_100000755817_100000753832 [0,0,0,1,0,0|2,0,1]=4 1913 B17R2.573 COC(=O)c1ccc(cc1)CN2CCC2C 269982a_100000755817_100000735637 [0,0,0,1,0,0|2,0,1]=4 1914 B17R2.573 COC(=O)c1ccc(cc1)CN2CCC2C 26a_100000755817_100000150123 [0,0,0,1,0,0|2,0,1]=4 1915 B17R2.573 COC(=O)c1ccc(cc1)CN2CCC2C 34a_100000755817_100000735637 [0,0,0,1,0,0|2,0,1]=4 1916 B17R2.57813 CCC(=O)c1ccc(cc1)OCCC2CC2 34a_100000212119_100000694398 [0,0,0,1,0,0|1,0,2]=4 1917 B17R2.57813 CCC(=O)c1ccc(cc1)OCCC2CC2 7a_100000212119_100000764125 [0,0,0,1,0,0|1,0,2]=4 1918 B17R2.57813 CCC(=O)c1ccc(cc1)SCCC2CC2 62a_100000211647_100000764125 [0,0,0,1,0,0|1,0,2]=4 1919 B17R2.57813 CCC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000211647 [0,0,0,1,0,0|1,0,2]=4 1920 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 207a_100000735609_100000043907 [0,0,0,1,0,0|2,0,1]=4 1921 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 2230a_100000735609_100000753832 [0,0,0,1,0,0|2,0,1]=4 1922 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 2230a_100000743749_100000742324 [0,0,0,1,0,0|2,0,1]=4 1923 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 269862a_100000743749_100000741477 [0,0,0,1,0,0|2,0,1]=4 1924 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 270004a_100000735609_100000043907 [0,0,0,1,0,0|2,0,1]=4 1925 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 34a_100000735609_100000753832 [0,0,0,1,0,0|2,0,1]=4 1926 B17R2.57813 CNC(=O)c1ccc(cc1)CNCC2CC2 34a_100000743749_100000742324 [0,0,0,1,0,0|2,0,1]=4 1927 B17R2.57813 CNC(=O)c1ccc(cc1)COCC2CC2 34a_100000211283_100000753832 [0,0,0,1,0,0|2,0,1]=4 1928 B17R2.57813 CNC(=O)c1ccc(cc1)CSCC2CC2 62a_100000753832_100000742324 [0,0,0,1,0,0|2,0,1]=4 1929 B17R2.57813 CNC(=O)c1ccc(cc1)CSCC2CC2 62a_100000756562_100000753832 [0,0,0,1,0,0|2,0,1]=4 1930 B17R2.57813 CNC(=O)c1ccc(cc1)NCCC2CC2 2230a_100000184841_100000694398 [0,0,0,1,0,0|2,0,1]=4 1931 B17R2.57813 CNC(=O)c1ccc(cc1)NCCC2CC2 27a_100000764129_100000155074 [0,0,0,1,0,0|2,0,1]=4 1932 B17R2.57813 CNC(=O)c1ccc(cc1)NCCC2CC2 34a_100000184841_100000694398 [0,0,0,1,0,0|2,0,1]=4 1933 B17R2.57813 CNC(=O)c1ccc(cc1)OCCC2CC2 34a_100000192141_100000694398 [0,0,0,1,0,0|2,0,1]=4 1934 B17R2.57813 CNC(=O)c1ccc(cc1)OCCC2CC2 7a_100000192141_100000764125 [0,0,0,1,0,0|2,0,1]=4 1935 B17R2.57813 CNC(=O)c1ccc(cc1)SCCC2CC2 62a_100000155074_100000764125 [0,0,0,1,0,0|2,0,1]=4 1936 B17R2.57813 CNC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000155074 [0,0,0,1,0,0|2,0,1]=4 1937 B17R2.57813 COC(=O)c1ccc(cc1)CCNC2CC2 34a_100000212008_100010192280 [0,0,0,1,0,0|2,0,1]=4 1938 B17R2.57813 COC(=O)c1ccc(cc1)CCOC2CC2 34a_100010779965_100000211595 [0,0,0,1,0,0|2,0,1]=4 1939 B17R2.57813 COC(=O)c1ccc(cc1)CCSC2CC2 62a_100010192280_100000211595 [0,0,0,1,0,0|2,0,1]=4 1940 B17R2.57813 COC(=O)c1ccc(cc1)CNCC2CC2 2230a_100000735609_100000735637 [0,0,0,1,0,0|2,0,1]=4 1941 B17R2.57813 COC(=O)c1ccc(cc1)CNCC2CC2 270004a_100000735609_100000148700 [0,0,0,1,0,0|2,0,1]=4 1942 B17R2.57813 COC(=O)c1ccc(cc1)CNCC2CC2 34a_100000735609_100000735637 [0,0,0,1,0,0|2,0,1]=4 1943 B17R2.57813 COC(=O)c1ccc(cc1)COCC2CC2 34a_100000151488_100000742324 [0,0,0,1,0,0|2,0,1]=4 1944 B17R2.57813 COC(=O)c1ccc(cc1)COCC2CC2 34a_100000211283_100000735637 [0,0,0,1,0,0|2,0,1]=4 1945 B17R2.57813 COC(=O)c1ccc(cc1)COCC2CC2 7a_100000151488_100000742324 [0,0,0,1,0,0|2,0,1]=4 1946 B17R2.57813 COC(=O)c1ccc(cc1)CSCC2CC2 62a_100000735637_100000742324 [0,0,0,1,0,0|2,0,1]=4 1947 B17R2.57813 COC(=O)c1ccc(cc1)CSCC2CC2 62a_100000756562_100000187170 [0,0,0,1,0,0|2,0,1]=4 1948 B17R2.57813 COC(=O)c1ccc(cc1)OCCC2CC2 34a_100000150123_100000694398 [0,0,0,1,0,0|2,0,1]=4 1949 B17R2.57813 COC(=O)c1ccc(cc1)OCCC2CC2 7a_100000150123_100000764125 [0,0,0,1,0,0|2,0,1]=4 1950 B17R2.57813 COC(=O)c1ccc(cc1)SCCC2CC2 62a_100000150774_100000764125 [0,0,0,1,0,0|2,0,1]=4 1951 B17R2.57813 COC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000150774 [0,0,0,1,0,0|2,0,1]=4 1952 B17R2.57813 N#CC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100009994572 [0,0,0,1,0,0|2,0,1]=4 1953 B17R2.57813 NCC(=O)c1ccc(cc1)SCCC2CC2 62a_100000017248_100000764125 [0,0,0,1,0,0|2,0,1]=4 1954 B17R2.57813 NCC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000017248 [0,0,0,1,0,0|2,0,1]=4 1955 B17R2.57813 NNC(=O)c1ccc(cc1)NCCC2CC2 27a_100000764129_100000183614 [0,0,0,1,0,0|3,0,0]=4 1956 B17R2.57813 NNC(=O)c1ccc(cc1)OCCC2CC2 34a_100000185078_100000694398 [0,0,0,1,0,0|3,0,0]=4 1957 B17R2.57813 NNC(=O)c1ccc(cc1)SCCC2CC2 62a_100000183614_100000764125 [0,0,0,1,0,0|3,0,0]=4 1958 B17R2.57813 NNC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000183614 [0,0,0,1,0,0|3,0,0]=4 1959 B17R2.57813 O=C(CBr)c1ccc(cc1)OCCC2CC2 7a_100009814261_100000764125 [0,0,0,1,0,0|2,0,1]=4 1960 B17R2.57813 O=C(CCl)c1ccc(cc1)OCCC2CC2 7a_100000018856_100000764125 [0,0,0,1,0,0|2,0,1]=4 1961 B17R2.57813 O=C(CF)c1ccc(cc1)OCCC2CC2 34a_200010654591_100000694398 [0,0,0,1,0,0|2,0,1]=4 1962 B17R2.57813 O=C(CF)c1ccc(cc1)OCCC2CC2 7a_200010654591_100000764125 [0,0,0,1,0,0|2,0,1]=4 1963 B17R2.57813 O=C(CO)c1ccc(cc1)SCCC2CC2 62a_100000764125_100011219529 [0,0,0,1,0,0|2,0,1]=4 1964 B17R2.57813 O=C(CO)c1ccc(cc1)SCCC2CC2 62a_100011219529_100000764125 [0,0,0,1,0,0|2,0,1]=4 1965 B17R2.57813 O=CC(=O)c1ccc(cc1)SCCC2CC2 62a_100000725942_100000764125 [0,0,0,1,0,0|2,0,0]=3 1966 B17R2.57813 O=CC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000725942 [0,0,0,1,0,0|2,0,0]=3 1967 B17R2.57813 O=CC(=O)c1ccc(cc1)SCCC2CO2 62a_100000725942_100000732470 [0,0,0,1,0,0|3,0,0]=4 1968 B17R2.57813 O=CC(=O)c1ccc(cc1)SCCC2CO2 62a_100000732470_100000725942 [0,0,0,1,0,0|3,0,0]=4 1969 B17R2.57814 CCC(=O)c1ccc(cc1)OCC2CCC2 34a_100000212119_100000763275 [0,0,0,1,0,0|1,0,2]=4 1970 B17R2.57814 CCC(=O)c1ccc(cc1)OCC2CCC2 7a_100000212119_100000763275 [0,0,0,1,0,0|1,0,2]=4 1971 B17R2.57814 CCC(=O)c1ccc(cc1)SCC2CCC2 62a_100000211647_100000763275 [0,0,0,1,0,0|1,0,2]=4 1972 B17R2.57814 CCC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000211647 [0,0,0,1,0,0|1,0,2]=4 1973 B17R2.57814 CNC(=O)c1ccc(cc1)CNC2CCC2 2230a_100000749019_100000753832 [0,0,0,1,0,0|2,0,1]=4 1974 B17R2.57814 CNC(=O)c1ccc(cc1)CNC2CCC2 270004a_100000743749_100000241760 [0,0,0,1,0,0|2,0,1]=4 1975 B17R2.57814 CNC(=O)c1ccc(cc1)CNC2CCC2 34a_100000743749_100000749161 [0,0,0,1,0,0|2,0,1]=4 1976 B17R2.57814 CNC(=O)c1ccc(cc1)CNC2CCC2 34a_100000749019_100000753832 [0,0,0,1,0,0|2,0,1]=4 1977 B17R2.57814 CNC(=O)c1ccc(cc1)COC2CCC2 34a_100000748187_100000753832 [0,0,0,1,0,0|2,0,1]=4 1978 B17R2.57814 CNC(=O)c1ccc(cc1)CSC2CCC2 62a_100000753832_100000749161 [0,0,0,1,0,0|2,0,1]=4 1979 B17R2.57814 CNC(=O)c1ccc(cc1)NCC2CCC2 2230a_100000184841_100000763275 [0,0,0,1,0,0|2,0,1]=4 1980 B17R2.57814 CNC(=O)c1ccc(cc1)NCC2CCC2 27a_100000738700_100000155074 [0,0,0,1,0,0|2,0,1]=4 1981 B17R2.57814 CNC(=O)c1ccc(cc1)NCC2CCC2 34a_100000184841_100000763275 [0,0,0,1,0,0|2,0,1]=4 1982 B17R2.57814 CNC(=O)c1ccc(cc1)OCC2CCC2 34a_100000192141_100000763275 [0,0,0,1,0,0|2,0,1]=4 1983 B17R2.57814 CNC(=O)c1ccc(cc1)OCC2CCC2 7a_100000192141_100000763275 [0,0,0,1,0,0|2,0,1]=4 1984 B17R2.57814 CNC(=O)c1ccc(cc1)SCC2CCC2 62a_100000155074_100000763275 [0,0,0,1,0,0|2,0,1]=4 1985 B17R2.57814 CNC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000155074 [0,0,0,1,0,0|2,0,1]=4 1986 B17R2.57814 COC(=O)c1ccc(cc1)CCN2CCC2 269982a_100000754969_100010192280 [0,0,0,1,0,0|2,0,1]=4 1987 B17R2.57814 COC(=O)c1ccc(cc1)CNC2CCC2 2230a_100000749019_100000735637 [0,0,0,1,0,0|2,0,1]=4 1988 B17R2.57814 COC(=O)c1ccc(cc1)CNC2CCC2 34a_100000749019_100000735637 [0,0,0,1,0,0|2,0,1]=4 1989 B17R2.57814 COC(=O)c1ccc(cc1)COC2CCC2 34a_100000151488_100000749161 [0,0,0,1,0,0|2,0,1]=4 1990 B17R2.57814 COC(=O)c1ccc(cc1)COC2CCC2 34a_100000748187_100000735637 [0,0,0,1,0,0|2,0,1]=4 1991 B17R2.57814 COC(=O)c1ccc(cc1)CSC2CCC2 62a_100000735637_100000749161 [0,0,0,1,0,0|2,0,1]=4 1992 B17R2.57814 COC(=O)c1ccc(cc1)OCC2CCC2 34a_100000150123_100000763275 [0,0,0,1,0,0|2,0,1]=4 1993 B17R2.57814 COC(=O)c1ccc(cc1)OCC2CCC2 7a_100000150123_100000763275 [0,0,0,1,0,0|2,0,1]=4 1994 B17R2.57814 COC(=O)c1ccc(cc1)SCC2CCC2 62a_100000150774_100000763275 [0,0,0,1,0,0|2,0,1]=4 1995 B17R2.57814 COC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000150774 [0,0,0,1,0,0|2,0,1]=4 1996 B17R2.57814 N#CC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100009994572 [0,0,0,1,0,0|2,0,1]=4 1997 B17R2.57814 NCC(=O)c1ccc(cc1)SCC2CCC2 62a_100000017248_100000763275 [0,0,0,1,0,0|2,0,1]=4 1998 B17R2.57814 NCC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000017248 [0,0,0,1,0,0|2,0,1]=4 1999 B17R2.57814 NNC(=O)c1ccc(cc1)NCC2CCC2 27a_100000738700_100000183614 [0,0,0,1,0,0|3,0,0]=4 2000 B17R2.57814 NNC(=O)c1ccc(cc1)OCC2CCC2 34a_100000185078_100000763275 [0,0,0,1,0,0|3,0,0]=4 2001 B17R2.57814 NNC(=O)c1ccc(cc1)SCC2CCC2 62a_100000183614_100000763275 [0,0,0,1,0,0|3,0,0]=4 2002 B17R2.57814 NNC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000183614 [0,0,0,1,0,0|3,0,0]=4 2003 B17R2.57814 O=C(CBr)c1ccc(cc1)OCC2CCC2 7a_100009814261_100000763275 [0,0,0,1,0,0|2,0,1]=4 2004 B17R2.57814 O=C(CCl)c1ccc(cc1)OCC2CCC2 7a_100000018856_100000763275 [0,0,0,1,0,0|2,0,1]=4 2005 B17R2.57814 O=C(CF)c1ccc(cc1)OCC2CCC2 34a_200010654591_100000763275 [0,0,0,1,0,0|2,0,1]=4 2006 B17R2.57814 O=C(CF)c1ccc(cc1)OCC2CCC2 7a_200010654591_100000763275 [0,0,0,1,0,0|2,0,1]=4 2007 B17R2.57814 O=C(CO)c1ccc(cc1)SCC2CCC2 62a_100000763275_100011219529 [0,0,0,1,0,0|2,0,1]=4 2008 B17R2.57814 O=C(CO)c1ccc(cc1)SCC2CCC2 62a_100011219529_100000763275 [0,0,0,1,0,0|2,0,1]=4 2009 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2CCC2 62a_100000725942_100000763275 [0,0,0,1,0,0|2,0,0]=3 2010 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000725942 [0,0,0,1,0,0|2,0,0]=3 2011 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2CCO2 62a_100000103362_100000725942 [0,0,0,1,0,0|3,0,0]=4 2012 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2CCO2 62a_100000725942_100000103362 [0,0,0,1,0,0|3,0,0]=4 2013 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2COC2 62a_100000725942_100010264016 [0,0,0,1,0,0|3,0,0]=4 2014 B17R2.57814 O=CC(=O)c1ccc(cc1)SCC2COC2 62a_100010264016_100000725942 [0,0,0,1,0,0|3,0,0]=4 2015 B17R2.166180 C#CCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215417 [0,0,0,1,0,0|1,0,2]=4 2016 B17R2.166180 C#CCCCSc1ccc2c(c1)C=CC2=O 62a_100011215417_100010210589 [0,0,0,1,0,0|1,0,2]=4 2017 B17R2.166180 C=CCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000757094 [0,0,0,1,0,0|1,0,2]=4 2018 B17R2.166180 C=CCCCSc1ccc2c(c1)C=CC2=O 62a_100011713584_100010210589 [0,0,0,1,0,0|1,0,2]=4 2019 B17R2.166180 CC/C=C\CSc1ccc2c(c1)C=CC2=O 62a_100010210589_100103147603 [0,0,0,1,0,0|1,0,2]=4 2020 B17R2.166180 CC/C=C\CSc1ccc2c(c1)C=CC2=O 62a_100103147603_100010210589 [0,0,0,1,0,0|1,0,2]=4 2021 B17R2.166180 CCC#CCSc1ccc2c(c1)C=CC2=O 62a_100009813939_100010210589 [0,0,0,1,0,0|1,0,2]=4 2022 B17R2.166180 CCC#CCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100009813939 [0,0,0,1,0,0|1,0,2]=4 2023 B17R2.166180 CCCCC=Cc1ccc2c(c1)C=CC2=O 271570a_100016275911_100010210589 [0,0,0,1,0,0|0,0,2]=3 2024 B17R2.166180 CCCCCNc1ccc2c(c1)ccn2C 34a_100011270241_100000718602 [0,0,0,1,0,0|3,0,0]=4 2025 B17R2.166180 CCCCCOc1ccc2c(c1)CCC2=O 34a_100000708912_100000718602 [0,0,0,1,0,0|1,0,2]=4 2026 B17R2.166180 CCCCCOc1ccc2c(c1)CCC2=O 7a_100000708912_100000210326 [0,0,0,1,0,0|1,0,2]=4 2027 B17R2.166180 CCCCCOc1ccc2c(c1)CNC2=O 34a_100000098542_100000718602 [0,0,0,1,0,0|2,0,1]=4 2028 B17R2.166180 CCCCCOc1ccc2c(c1)COC2=O 7a_100000044543_100000210326 [0,0,0,1,0,0|2,0,1]=4 2029 B17R2.166180 CCCCCSc1ccc2c(=O)[nH][nH]c2c1 62a_100000210326_100012353722 [0,0,0,1,0,0|3,0,0]=4 2030 B17R2.166180 CCCCCSc1ccc2c(c1)C=CC2=O 62a_100000210326_100010210589 [0,0,0,1,0,0|1,0,0]=2 2031 B17R2.166180 CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000210326 [0,0,0,1,0,0|1,0,0]=2 2032 B17R2.166180 CCCCCSc1ccc2c(c1)CCC2=O 62a_100000210326_100000737041 [0,0,0,1,0,0|1,0,2]=4 2033 B17R2.166180 CCCCCSc1ccc2c(c1)CCC2=O 62a_100000737041_100000210326 [0,0,0,1,0,0|1,0,2]=4 2034 B17R2.166180 CCCCCSc1ccc2c(c1)CNC2=O 62a_100000210326_100000692135 [0,0,0,1,0,0|2,0,1]=4 2035 B17R2.166180 CCCCCSc1ccc2c(c1)CNC2=O 62a_100000692135_100000210326 [0,0,0,1,0,0|2,0,1]=4 2036 B17R2.166180 CCCCCSc1ccc2c(c1)COC2=O 62a_100009816608_100000210326 [0,0,0,1,0,0|2,0,1]=4 2037 B17R2.166180 CCCCCSc1ccc2c(c1)OCC2=O 62a_100000210326_100000686717 [0,0,0,1,0,0|2,0,1]=4 2038 B17R2.166180 CCCCCSc1ccc2c(c1)ccn2C 62a_100000210326_100011202928 [0,0,0,1,0,0|3,0,0]=4 2039 B17R2.166180 CCCCCSc1ccc2c(c[nH]c2c1)C 62a_100000210326_100010209589 [0,0,0,1,0,0|3,0,0]=4 2040 B17R2.166180 CCCCNCc1ccc2c(c1)ccn2C 207a_100000102301_100011361496 [0,0,0,1,0,0|3,0,0]=4 2041 B17R2.166180 CCCCNCc1ccc2c(c1)ccn2C 270004a_100000102301_100011361496 [0,0,0,1,0,0|3,0,0]=4 2042 B17R2.166180 CCCCNCc1ccc2c(c1)ccn2C 34a_102125277283_100000210210 [0,0,0,1,0,0|3,0,0]=4 2043 B17R2.166180 CCOCCSc1ccc2c(c1)C=CC2=O 62a_100000210147_100010210589 [0,0,0,1,0,0|2,0,0]=3 2044 B17R2.166180 CCOCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215890 [0,0,0,1,0,0|2,0,0]=3 2045 B17R2.166180 CCSCCSc1ccc2c(c1)C=CC2=O 62a_100000757381_100010210589 [0,0,0,1,0,0|2,0,0]=3 2046 B17R2.166180 CCSCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000757381 [0,0,0,1,0,0|2,0,0]=3 2047 B17R2.166180 COCCCSc1ccc2c(c1)C=CC2=O 62a_100000709357_100010210589 [0,0,0,1,0,0|2,0,0]=3 2048 B17R2.166180 COCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000709357 [0,0,0,1,0,0|2,0,0]=3 2049 B17R2.166180 N#CCCCSc1ccc2c(c1)C=CC2=O 62a_100000687738_100010210589 [0,0,0,1,0,0|2,0,1]=4 2050 B17R2.166180 N#CCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000687738 [0,0,0,1,0,0|2,0,1]=4 2051 B17R2.166180 O=C1C=Cc2c1ccc(c2)SCCCCF 62a_100000729493_100010210589 [0,0,0,1,0,0|2,0,0]=3 2052 B17R2.166180 O=C1C=Cc2c1ccc(c2)SCCCCF 62a_100010210589_100000729493 [0,0,0,1,0,0|2,0,0]=3 2053 B17R2.166180 O=C1C=Cc2c1ccc(c2)SCCCCO 62a_100000210776_100010210589 [0,0,0,1,0,0|2,0,0]=3 2054 B17R2.166180 O=C1C=Cc2c1ccc(c2)SCCCCO 62a_100010210589_100000210776 [0,0,0,1,0,0|2,0,0]=3 2055 B17R2.166180 O=CCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_200011292268 [0,0,0,1,0,0|2,0,1]=4 2056 B17R2.166180 O=CCCCSc1ccc2c(c1)C=CC2=O 62a_200011292268_100010210589 [0,0,0,1,0,0|2,0,1]=4 2057 B17R1.714 C#CCCCOc1ccc(cc1)NC(=O)C=C 34a_100011235904_100000695029 [0,0,0,0,0,1|1,0,2]=4 2058 B17R1.714 C=CC(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000185746 [0,0,0,0,0,1|0,0,0]=1 2059 B17R1.714 C=CC(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000185746 [0,0,0,0,0,1|0,0,0]=1 2060 B17R1.714 C=CC(=O)Nc1ccc(cc1)OC/C=C\CC 34a_100011235904_100103147603 [0,0,0,0,0,1|1,0,2]=4 2061 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCC#CCC 34a_100011235904_100009813939 [0,0,0,0,0,1|1,0,2]=4 2062 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000185746 [0,0,0,0,0,1|1,0,0]=2 2063 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000185746 [0,0,0,0,0,1|1,0,0]=2 2064 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCCC 34a_100011235904_100000718602 [0,0,0,0,0,1|1,0,0]=2 2065 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCCF 34a_100011235904_100000729493 [0,0,0,0,0,1|2,0,0]=3 2066 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCCO 34a_100011235904_100011216708 [0,0,0,0,0,1|2,0,0]=3 2067 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCCOC 34a_100011235904_100000740836 [0,0,0,0,0,1|2,0,0]=3 2068 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCOCC 34a_100011235904_100000210147 [0,0,0,0,0,1|2,0,0]=3 2069 B17R1.714 C=CC(=O)Nc1ccc(cc1)OCCSCC 34a_100011235904_100000757381 [0,0,0,0,0,1|2,0,0]=3 2070 B17R1.714 C=CC(C)Sc1ccc(cc1)CNCCCC 62a_100011215867_100015187156 [0,0,0,0,0,1|2,0,1]=4 2071 B17R1.714 C=CC(C)Sc1ccc(cc1)OCCCCC 62a_100011215867_200011214818 [0,0,0,0,0,1|2,0,1]=4 2072 B17R1.714 C=CCCCOc1ccc(cc1)NC(=O)C=C 34a_100011235904_100000757094 [0,0,0,0,0,1|1,0,2]=4 2073 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CC 11a_100000035805_100000210414 [0,0,0,0,0,1|0,0,2]=3 2074 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CC 1626a_100000035805_100000210414 [0,0,0,0,0,1|0,0,2]=3 2075 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CC 22a_100000035805_100000210414 [0,0,0,0,0,1|0,0,2]=3 2076 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CC 527a_100000035805_100000210414 [0,0,0,0,0,1|0,0,2]=3 2077 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CO 22a_100000035805_100000210174 [0,0,0,0,0,1|1,0,1]=3 2078 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)CO 527a_100000035805_100000210174 [0,0,0,0,0,1|1,0,1]=3 2079 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)NC 2430a_100000035805_100102657272 [0,0,0,0,0,1|1,0,1]=3 2080 B17R1.714 CCCCCCc1ccc(cc1)NC(=O)NC 512a_100000035805_100102657272 [0,0,0,0,0,1|1,0,1]=3 2081 B17R1.714 CCCCCNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000210326 [0,0,0,0,0,1|2,0,1]=4 2082 B17R1.714 CCCCCNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000718602 [0,0,0,0,0,1|2,0,1]=4 2083 B17R1.714 CCCCCNc1ccc(cc1)NC(=O)CC 34a_100000186511_100000718602 [0,0,0,0,0,1|1,0,2]=4 2084 B17R1.714 CCCCCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000718602 [0,0,0,0,0,1|2,0,1]=4 2085 B17R1.714 CCCCCOc1ccc(cc1)CC(=O)NC 34a_200000020795_100000718602 [0,0,0,0,0,1|2,0,1]=4 2086 B17R1.714 CCCCCOc1ccc(cc1)CC(=O)NN 34a_100000020777_100000718602 [0,0,0,0,0,1|3,0,0]=4 2087 B17R1.714 CCCCCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000718602 [0,0,0,0,0,1|2,0,1]=4 2088 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 11a_103437854202_100000210414 [0,0,0,0,0,1|1,0,2]=4 2089 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 1626a_103437854202_100000210414 [0,0,0,0,0,1|1,0,2]=4 2090 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 22a_103437854202_100000210414 [0,0,0,0,0,1|1,0,2]=4 2091 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 34a_200000243810_100000718602 [0,0,0,0,0,1|1,0,2]=4 2092 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 527a_103437854202_100000210414 [0,0,0,0,0,1|1,0,2]=4 2093 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CC 7a_200000243810_100000210326 [0,0,0,0,0,1|1,0,2]=4 2094 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000718602 [0,0,0,0,0,1|2,0,1]=4 2095 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CO 22a_103437854202_100000210174 [0,0,0,0,0,1|2,0,1]=4 2096 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)CO 527a_103437854202_100000210174 [0,0,0,0,0,1|2,0,1]=4 2097 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)NC 2430a_103437854202_100102657272 [0,0,0,0,0,1|2,0,1]=4 2098 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)NC 512a_103437854202_100102657272 [0,0,0,0,0,1|2,0,1]=4 2099 B17R1.714 CCCCCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000718602 [0,0,0,0,0,1|2,0,1]=4 2100 B17R1.714 CCCCCSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000210326 [0,0,0,0,0,1|2,0,1]=4 2101 B17R1.714 CCCCCSc1ccc(cc1)CC(=O)NC 62a_100000210326_100000155101 [0,0,0,0,0,1|2,0,1]=4 2102 B17R1.714 CCCCCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000210326 [0,0,0,0,0,1|2,0,1]=4 2103 B17R1.714 CCCCCSc1ccc(cc1)CC(=O)OC 62a_100000210326_100000149743 [0,0,0,0,0,1|2,0,1]=4 2104 B17R1.714 CCCCCSc1ccc(cc1)NC(=O)CN 62a_100000210326_100000741985 [0,0,0,0,0,1|2,0,1]=4 2105 B17R1.714 CCCCCSc1ccc(cc1)NC(=O)OC 62a_100000210326_100000181880 [0,0,0,0,0,1|2,0,1]=4 2106 B17R1.714 CCCCCSc1ccc(cc1)OC(=O)CC 62a_100000210326_200009811598 [0,0,0,0,0,1|1,0,2]=4 2107 B17R1.714 CCCCNCc1ccc(cc1)CC(=O)OC 2230a_100000102301_100009816886 [0,0,0,0,0,1|2,0,1]=4 2108 B17R1.714 CCCCNCc1ccc(cc1)CC(=O)OC 270004a_100000102301_100009886798 [0,0,0,0,0,1|2,0,1]=4 2109 B17R1.714 CCCCNCc1ccc(cc1)CC(=O)OC 7a_106832991798_100009816886 [0,0,0,0,0,1|2,0,1]=4 2110 B17R1.714 CCCCNCc1ccc(cc1)OC(=O)CC 270004a_100000102301_200000014686 [0,0,0,0,0,1|1,0,2]=4 2111 B17R1.714 CCCCOCc1ccc(cc1)CC(=O)OC 34a_100000087118_100000210210 [0,0,0,0,0,1|2,0,1]=4 2112 B17R1.714 CCCCOCc1ccc(cc1)CC(=O)OC 34a_100000210227_100009816886 [0,0,0,0,0,1|2,0,1]=4 2113 B17R1.714 CCCCOCc1ccc(cc1)CC(=O)OC 7a_100000210227_100009816886 [0,0,0,0,0,1|2,0,1]=4 2114 B17R1.714 CCCCSCc1ccc(cc1)CC(=O)OC 62a_100000210211_100009816886 [0,0,0,0,0,1|2,0,1]=4 2115 B17R1.714 CCCCSCc1ccc(cc1)CC(=O)OC 62a_100009816886_100000210210 [0,0,0,0,0,1|2,0,1]=4 2116 B14R1.65 CCCCc1ccc(cc1)C(=O)C#N 271570a_100020621405_100009994572 [2,0,0,0,0,0|1,0,1]=4 2117 B14R1.65 CCCCc1ccc(cc1)C(=O)C=O 271570a_100020621405_100000725942 [2,0,0,0,0,0|1,0,0]=3 2118 B14R1.65 CCCCc1ccc(cc1)C(=O)CC 1458a_100000186158_100000210202 [2,0,0,0,0,0|0,0,2]=4 2119 B14R1.65 CCCCc1ccc(cc1)C(=O)CC 271570a_100020621405_100000211647 [2,0,0,0,0,0|0,0,2]=4 2120 B14R1.65 CCCCc1ccc(cc1)C(=O)CF 1458a_100000186158_100015361967 [2,0,0,0,0,0|1,0,1]=4 2121 B14R1.65 CCCCc1ccc(cc1)C(=O)CN 271570a_100020621405_100000017248 [2,0,0,0,0,0|1,0,1]=4 2122 B14R1.65 CCCCc1ccc(cc1)C(=O)CO 271570a_100020621405_100011219529 [2,0,0,0,0,0|1,0,1]=4 2123 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000186158 [2,0,0,0,0,0|1,0,1]=4 2124 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000186158 [2,0,0,0,0,0|1,0,1]=4 2125 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000186158 [2,0,0,0,0,0|1,0,1]=4 2126 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 271570a_100020621405_100000155074 [2,0,0,0,0,0|1,0,1]=4 2127 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000186158 [2,0,0,0,0,0|1,0,1]=4 2128 B14R1.65 CCCCc1ccc(cc1)C(=O)NN 271570a_100020621405_100000183614 [2,0,0,0,0,0|2,0,0]=4 2129 B14R1.65 CCCCc1ccc(cc1)C(=O)OC 271570a_100020621405_100000150774 [2,0,0,0,0,0|1,0,1]=4 2130 B14R1.65 CCCSc1ccc(cc1)C(=O)C=O 62a_100000210303_100000725942 [2,0,0,0,0,0|2,0,0]=4 2131 B14R1.65 CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210303 [2,0,0,0,0,0|2,0,0]=4 2132 B14R1.462 C=C(C)c1ccc(cc1)CCCCC 271570a_100000694244_100009813665 [2,0,0,0,0,0|1,0,0]=3 2133 B14R1.462 C=C(C)c1ccc(cc1)OCCCC 271570a_100000694244_100000230682 [2,0,0,0,0,0|2,0,0]=4 2134 B14R1.462 C=C(C)c1ccc(cc1)OCCCC 34a_100009880102_100000210210 [2,0,0,0,0,0|2,0,0]=4 2135 B14R1.462 C=C(C)c1ccc(cc1)OCCCC 7a_100009880102_100000210211 [2,0,0,0,0,0|2,0,0]=4 2136 B14R1.462 C=C(C)c1ccc(cc1)SCCCC 62a_100000185454_100000210210 [2,0,0,0,0,0|2,0,0]=4 2137 B14R1.462 C=C(C)c1ccc(cc1)SCCCC 62a_100000210211_100000185454 [2,0,0,0,0,0|2,0,0]=4 2138 B14R1.462 CCCCCc1ccc(cc1)C(=O)C 1458a_100000037971_200000210301 [2,0,0,0,0,0|0,0,1]=3 2139 B14R1.462 CCCCCc1ccc(cc1)C(=O)[13CH3] 1458a_100000037971_200025704644 [2,0,0,0,0,0|0,0,1]=3 2140 B14R1.462 CCCCNc1ccc(cc1)C(=O)N 27a_100000102301_100000162191 [2,0,0,0,0,0|2,0,0]=4 2141 B14R1.462 CCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210210 [2,0,0,0,0,0|2,0,0]=4 2142 B14R1.462 CCCCOc1ccc(cc1)C(=O)C 1458a_100000182901_200000210301 [2,0,0,0,0,0|1,0,1]=4 2143 B14R1.462 CCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210210 [2,0,0,0,0,0|1,0,1]=4 2144 B14R1.462 CCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210211 [2,0,0,0,0,0|1,0,1]=4 2145 B14R1.462 CCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210210 [2,0,0,0,0,0|2,0,0]=4 2146 B14R1.462 CCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210211 [2,0,0,0,0,0|2,0,0]=4 2147 B14R1.462 CCCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000182901_200025704644 [2,0,0,0,0,0|1,0,1]=4 2148 B14R1.462 CCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210210 [2,0,0,0,0,0|1,0,1]=4 2149 B14R1.462 CCCCSc1ccc(cc1)C(=O)C 62a_100000210211_100000185465 [2,0,0,0,0,0|1,0,1]=4 2150 B14R1.462 CCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210210 [2,0,0,0,0,0|2,0,0]=4 2151 B14R1.462 CCCCSc1ccc(cc1)C(=O)N 62a_100000210211_100000162191 [2,0,0,0,0,0|2,0,0]=4 2152 B14R1.462 CCCNCc1ccc(cc1)C(=O)N 207a_100020643023_100000038677 [2,0,0,0,0,0|2,0,0]=4 2153 B14R1.462 CCCNCc1ccc(cc1)C(=O)N 270004a_100020643023_100000038677 [2,0,0,0,0,0|2,0,0]=4 2154 B14R1.462 CCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210207 [2,0,0,0,0,0|2,0,0]=4 2155 B14R1.462 CCCOCc1ccc(cc1)C(=O)C 34a_100000210258_100000756337 [2,0,0,0,0,0|1,0,1]=4 2156 B14R1.462 CCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000210303 [2,0,0,0,0,0|1,0,1]=4 2157 B14R1.462 CCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000210303 [2,0,0,0,0,0|2,0,0]=4 2158 B14R1.462 CCCOCc1ccc(cc1)C(=O)N 34a_100000210258_100000231043 [2,0,0,0,0,0|2,0,0]=4 2159 B14R1.462 CCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000210303 [2,0,0,0,0,0|2,0,0]=4 2160 B14R1.462 CCCSCc1ccc(cc1)C(=O)C 62a_100000210303_100000756337 [2,0,0,0,0,0|1,0,1]=4 2161 B14R1.462 CCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000210303 [2,0,0,0,0,0|1,0,1]=4 2162 B14R1.462 CCCSCc1ccc(cc1)C(=O)N 62a_100000210303_100000231043 [2,0,0,0,0,0|2,0,0]=4 2163 B14R1.462 CCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000210303 [2,0,0,0,0,0|2,0,0]=4 2164 B14R1.462 CCNCCc1ccc(cc1)C(=O)C 2230a_100015525214_200000038727 [2,0,0,0,0,0|1,0,1]=4 2165 B14R1.462 CCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000210202 [2,0,0,0,0,0|2,0,0]=4 2166 B14R1.462 CCOCCc1ccc(cc1)C(=O)C 34a_100121572206_200000038727 [2,0,0,0,0,0|1,0,1]=4 2167 B14R1.462 CCSCCc1ccc(cc1)C(=O)C 62a_100000210202_200000038727 [2,0,0,0,0,0|1,0,1]=4 2168 B14R1.462 CCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000210202 [2,0,0,0,0,0|1,0,1]=4 2169 B14R1.465 C/C=C/c1ccc(cc1)SCCCC 62a_100000210211_100016259036 [2,0,0,0,0,0|1,0,1]=4 2170 B14R1.465 C/C=C/c1ccc(cc1)SCCCC 62a_100016259036_100000210210 [2,0,0,0,0,0|1,0,1]=4 2171 B14R1.465 C=C=Cc1ccc(cc1)CCCCC 271570a_100015277604_100009813665 [2,0,0,0,0,0|0,0,1]=3 2172 B14R1.465 C=C=Cc1ccc(cc1)OCCCC 271570a_100015277604_100000230682 [2,0,0,0,0,0|1,0,1]=4 2173 B14R1.465 C=CCc1ccc(cc1)OCCCC 34a_100000078792_100000210210 [2,0,0,0,0,0|1,0,1]=4 2174 B14R1.465 C=CCc1ccc(cc1)OCCCC 7a_100000078792_100000210211 [2,0,0,0,0,0|1,0,1]=4 2175 B14R1.465 C=COc1ccc(cc1)SCCCC 62a_100000210211_100000704263 [2,0,0,0,0,0|2,0,0]=4 2176 B14R1.465 C=COc1ccc(cc1)SCCCC 62a_100000704263_100000210210 [2,0,0,0,0,0|2,0,0]=4 2177 B14R1.465 CC=Cc1ccc(cc1)CCCCC 271570a_100016259895_100009813665 [2,0,0,0,0,0|0,0,1]=3 2178 B14R1.465 CC=Cc1ccc(cc1)OCCCC 271570a_100016259895_100000230682 [2,0,0,0,0,0|1,0,1]=4 2179 B14R1.465 CCCCSc1ccc(cc1)/C=C/Br 62a_100000210211_200016255901 [2,0,0,0,0,0|2,0,0]=4 2180 B14R1.465 CCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000210210 [2,0,0,0,0,0|2,0,0]=4 2181 B14R1.776 C=Cc1ccc(cc1)CCCCCC 271570a_100011290941_100009814338 [2,0,0,0,0,0|0,0,0]=2 2182 B14R1.776 C=Cc1ccc(cc1)CCNCCF 34a_100000724931_100000142037 [2,0,0,0,0,0|2,0,0]=4 2183 B14R1.776 C=Cc1ccc(cc1)CCNCCO 2230a_100016997473_100000142037 [2,0,0,0,0,0|2,0,0]=4 2184 B14R1.776 C=Cc1ccc(cc1)CCNCCO 34a_100016990907_100000142037 [2,0,0,0,0,0|2,0,0]=4 2185 B14R1.776 C=Cc1ccc(cc1)CCOCCBr 34a_100000211926_100000142037 [2,0,0,0,0,0|2,0,0]=4 2186 B14R1.776 C=Cc1ccc(cc1)CCOCCC 34a_100000210258_100000142037 [2,0,0,0,0,0|1,0,0]=3 2187 B14R1.776 C=Cc1ccc(cc1)CCOCCN 34a_100000210304_100000142037 [2,0,0,0,0,0|2,0,0]=4 2188 B14R1.776 C=Cc1ccc(cc1)CCSCCC 62a_100000142037_100000210303 [2,0,0,0,0,0|1,0,0]=3 2189 B14R1.776 C=Cc1ccc(cc1)CCSCCC 62a_100000210303_100000142037 [2,0,0,0,0,0|1,0,0]=3 2190 B14R1.776 C=Cc1ccc(cc1)CCSCCF 62a_100000142037_100011217306 [2,0,0,0,0,0|2,0,0]=4 2191 B14R1.776 C=Cc1ccc(cc1)CCSCCF 62a_100011217306_100000142037 [2,0,0,0,0,0|2,0,0]=4 2192 B14R1.776 C=Cc1ccc(cc1)CCSCCO 62a_100000142037_100000211926 [2,0,0,0,0,0|2,0,0]=4 2193 B14R1.776 C=Cc1ccc(cc1)CCSCCO 62a_100000211926_100000142037 [2,0,0,0,0,0|2,0,0]=4 2194 B14R1.776 C=Cc1ccc(cc1)CCSCOC 62a_100000142037_100000766300 [2,0,0,0,0,0|2,0,0]=4 2195 B14R1.776 C=Cc1ccc(cc1)CCSCOC 62a_100000766300_100000142037 [2,0,0,0,0,0|2,0,0]=4 2196 B14R1.776 C=Cc1ccc(cc1)CCSCSC 62a_100000142037_100011218213 [2,0,0,0,0,0|2,0,0]=4 2197 B14R1.776 C=Cc1ccc(cc1)CCSCSC 62a_100011218213_100000142037 [2,0,0,0,0,0|2,0,0]=4 2198 B14R1.776 C=Cc1ccc(cc1)CNCCCC 2230a_100000102301_100000034074 [2,0,0,0,0,0|1,0,0]=3 2199 B14R1.776 C=Cc1ccc(cc1)CNCCCC 270004a_100000102301_100011361436 [2,0,0,0,0,0|1,0,0]=3 2200 B14R1.776 C=Cc1ccc(cc1)CNCCCC 271570a_100011290941_100015187156 [2,0,0,0,0,0|1,0,0]=3 2201 B14R1.776 C=Cc1ccc(cc1)CNCCCC 34a_200011934891_100000210210 [2,0,0,0,0,0|1,0,0]=3 2202 B14R1.776 C=Cc1ccc(cc1)CNCCCC 7a_106832991798_100000034074 [2,0,0,0,0,0|1,0,0]=3 2203 B14R1.776 C=Cc1ccc(cc1)CNCCCF 2230a_100015189416_100000034074 [2,0,0,0,0,0|2,0,0]=4 2204 B14R1.776 C=Cc1ccc(cc1)CNCCCF 270004a_100015189416_100011361436 [2,0,0,0,0,0|2,0,0]=4 2205 B14R1.776 C=Cc1ccc(cc1)CNCCCF 34a_100015189416_100000034074 [2,0,0,0,0,0|2,0,0]=4 2206 B14R1.776 C=Cc1ccc(cc1)CNCCCF 34a_200011934891_100011934791 [2,0,0,0,0,0|2,0,0]=4 2207 B14R1.776 C=Cc1ccc(cc1)CNCCCO 270004a_100000182051_100011361436 [2,0,0,0,0,0|2,0,0]=4 2208 B14R1.776 C=Cc1ccc(cc1)CNCCCO 34a_200011934891_100000230001 [2,0,0,0,0,0|2,0,0]=4 2209 B14R1.776 C=Cc1ccc(cc1)CNCCOC 2230a_100000209980_100000034074 [2,0,0,0,0,0|2,0,0]=4 2210 B14R1.776 C=Cc1ccc(cc1)CNCCOC 270004a_100000209980_100011361436 [2,0,0,0,0,0|2,0,0]=4 2211 B14R1.776 C=Cc1ccc(cc1)CNCCOC 271570a_100011290941_100015187160 [2,0,0,0,0,0|2,0,0]=4 2212 B14R1.776 C=Cc1ccc(cc1)CNCCOC 34a_200011934891_100011201679 [2,0,0,0,0,0|2,0,0]=4 2213 B14R1.776 C=Cc1ccc(cc1)CNCCSC 2230a_100020590264_100000034074 [2,0,0,0,0,0|2,0,0]=4 2214 B14R1.776 C=Cc1ccc(cc1)CNCCSC 270004a_100020590264_100011361436 [2,0,0,0,0,0|2,0,0]=4 2215 B14R1.776 C=Cc1ccc(cc1)CNCCSC 34a_200011934891_100000212216 [2,0,0,0,0,0|2,0,0]=4 2216 B14R1.776 C=Cc1ccc(cc1)COCCCBr 34a_100011217188_100000034074 [2,0,0,0,0,0|2,0,0]=4 2217 B14R1.776 C=Cc1ccc(cc1)COCCCC 34a_100000073583_100000210210 [2,0,0,0,0,0|1,0,0]=3 2218 B14R1.776 C=Cc1ccc(cc1)COCCCC 34a_100000210227_100000034074 [2,0,0,0,0,0|1,0,0]=3 2219 B14R1.776 C=Cc1ccc(cc1)COCCCC 7a_100000073583_100000210211 [2,0,0,0,0,0|1,0,0]=3 2220 B14R1.776 C=Cc1ccc(cc1)COCCCC 7a_100000210227_100000034074 [2,0,0,0,0,0|1,0,0]=3 2221 B14R1.776 C=Cc1ccc(cc1)COCCCCl 34a_100000230001_100000034074 [2,0,0,0,0,0|2,0,0]=4 2222 B14R1.776 C=Cc1ccc(cc1)COCCCF 34a_100000073583_100011934791 [2,0,0,0,0,0|2,0,0]=4 2223 B14R1.776 C=Cc1ccc(cc1)COCCCF 34a_100000759539_100000034074 [2,0,0,0,0,0|2,0,0]=4 2224 B14R1.776 C=Cc1ccc(cc1)COCCCF 7a_100000073583_100011934791 [2,0,0,0,0,0|2,0,0]=4 2225 B14R1.776 C=Cc1ccc(cc1)COCCCN 34a_100000182051_100000034074 [2,0,0,0,0,0|2,0,0]=4 2226 B14R1.776 C=Cc1ccc(cc1)COCCCO 34a_100000073583_100000230001 [2,0,0,0,0,0|2,0,0]=4 2227 B14R1.776 C=Cc1ccc(cc1)COCCCO 7a_100000073583_100011215043 [2,0,0,0,0,0|2,0,0]=4 2228 B14R1.776 C=Cc1ccc(cc1)COCCOC 271570a_100011290941_100000755069 [2,0,0,0,0,0|2,0,0]=4 2229 B14R1.776 C=Cc1ccc(cc1)COCCOC 34a_100000073583_100011201679 [2,0,0,0,0,0|2,0,0]=4 2230 B14R1.776 C=Cc1ccc(cc1)COCCOC 34a_100000210237_100000034074 [2,0,0,0,0,0|2,0,0]=4 2231 B14R1.776 C=Cc1ccc(cc1)COCCOC 7a_100000073583_100000233755 [2,0,0,0,0,0|2,0,0]=4 2232 B14R1.776 C=Cc1ccc(cc1)COCCSC 34a_100000073583_100000212216 [2,0,0,0,0,0|2,0,0]=4 2233 B14R1.776 C=Cc1ccc(cc1)COCCSC 34a_100000230434_100000034074 [2,0,0,0,0,0|2,0,0]=4 2234 B14R1.776 C=Cc1ccc(cc1)COCCSC 7a_100000073583_100000212216 [2,0,0,0,0,0|2,0,0]=4 2235 B14R1.776 C=Cc1ccc(cc1)COCCSC 7a_100000230434_100000034074 [2,0,0,0,0,0|2,0,0]=4 2236 B14R1.776 C=Cc1ccc(cc1)CSCCCC 62a_100000034074_100000210210 [2,0,0,0,0,0|1,0,0]=3 2237 B14R1.776 C=Cc1ccc(cc1)CSCCCC 62a_100000210211_100000034074 [2,0,0,0,0,0|1,0,0]=3 2238 B14R1.776 C=Cc1ccc(cc1)CSCCCF 62a_100000034074_100011934791 [2,0,0,0,0,0|2,0,0]=4 2239 B14R1.776 C=Cc1ccc(cc1)CSCCCF 62a_100011934791_100000034074 [2,0,0,0,0,0|2,0,0]=4 2240 B14R1.776 C=Cc1ccc(cc1)CSCCCO 62a_100000034074_100011215043 [2,0,0,0,0,0|2,0,0]=4 2241 B14R1.776 C=Cc1ccc(cc1)CSCCCO 62a_100011215043_100000034074 [2,0,0,0,0,0|2,0,0]=4 2242 B14R1.776 C=Cc1ccc(cc1)CSCCOC 62a_100000034074_100000233755 [2,0,0,0,0,0|2,0,0]=4 2243 B14R1.776 C=Cc1ccc(cc1)CSCCOC 62a_100000233755_100000034074 [2,0,0,0,0,0|2,0,0]=4 2244 B14R1.776 C=Cc1ccc(cc1)CSCCSC 62a_100000034074_100000751147 [2,0,0,0,0,0|2,0,0]=4 2245 B14R1.776 C=Cc1ccc(cc1)CSCCSC 62a_100000212216_100000034074 [2,0,0,0,0,0|2,0,0]=4 2246 B14R1.776 C=Cc1ccc(cc1)CSCOCC 62a_100000034074_100000739092 [2,0,0,0,0,0|2,0,0]=4 2247 B14R1.776 C=Cc1ccc(cc1)CSCOCC 62a_100000739092_100000034074 [2,0,0,0,0,0|2,0,0]=4 2248 B14R1.776 C=Cc1ccc(cc1)NCCCCC 34a_100011218248_100000718602 [2,0,0,0,0,0|1,0,0]=3 2249 B14R1.776 C=Cc1ccc(cc1)NCCCCF 34a_100011218248_100000729493 [2,0,0,0,0,0|2,0,0]=4 2250 B14R1.776 C=Cc1ccc(cc1)NCCCCO 34a_100011218248_100011216708 [2,0,0,0,0,0|2,0,0]=4 2251 B14R1.776 C=Cc1ccc(cc1)NCCCOC 34a_100011218248_100000740836 [2,0,0,0,0,0|2,0,0]=4 2252 B14R1.776 C=Cc1ccc(cc1)NCCOCC 34a_100011218248_100000210147 [2,0,0,0,0,0|2,0,0]=4 2253 B14R1.776 C=Cc1ccc(cc1)NCCSCC 34a_100011218248_100000757381 [2,0,0,0,0,0|2,0,0]=4 2254 B14R1.776 C=Cc1ccc(cc1)OCCCCC 271570a_100011290941_200011214818 [2,0,0,0,0,0|1,0,0]=3 2255 B14R1.776 C=Cc1ccc(cc1)OCCCCC 34a_100000189437_100000718602 [2,0,0,0,0,0|1,0,0]=3 2256 B14R1.776 C=Cc1ccc(cc1)OCCCCC 7a_100000189437_100000210326 [2,0,0,0,0,0|1,0,0]=3 2257 B14R1.776 C=Cc1ccc(cc1)OCCCCF 34a_100000189437_100000729493 [2,0,0,0,0,0|2,0,0]=4 2258 B14R1.776 C=Cc1ccc(cc1)OCCCCF 7a_100000189437_100000729493 [2,0,0,0,0,0|2,0,0]=4 2259 B14R1.776 C=Cc1ccc(cc1)OCCCCO 34a_100000189437_100011216708 [2,0,0,0,0,0|2,0,0]=4 2260 B14R1.776 C=Cc1ccc(cc1)OCCCCO 7a_100000189437_100000210776 [2,0,0,0,0,0|2,0,0]=4 2261 B14R1.776 C=Cc1ccc(cc1)OCCCNC 271570a_100011290941_100102699777 [2,0,0,0,0,0|2,0,0]=4 2262 B14R1.776 C=Cc1ccc(cc1)OCCCOC 271570a_100011290941_200011326559 [2,0,0,0,0,0|2,0,0]=4 2263 B14R1.776 C=Cc1ccc(cc1)OCCCOC 34a_100000189437_100000740836 [2,0,0,0,0,0|2,0,0]=4 2264 B14R1.776 C=Cc1ccc(cc1)OCCCOC 7a_100000189437_100000740836 [2,0,0,0,0,0|2,0,0]=4 2265 B14R1.776 C=Cc1ccc(cc1)OCCNCC 271570a_100011290941_100000762749 [2,0,0,0,0,0|2,0,0]=4 2266 B14R1.776 C=Cc1ccc(cc1)OCCOCC 271570a_100011290941_200000169944 [2,0,0,0,0,0|2,0,0]=4 2267 B14R1.776 C=Cc1ccc(cc1)OCCOCC 34a_100000189437_100000210147 [2,0,0,0,0,0|2,0,0]=4 2268 B14R1.776 C=Cc1ccc(cc1)OCCOCC 7a_100000189437_100011215890 [2,0,0,0,0,0|2,0,0]=4 2269 B14R1.776 C=Cc1ccc(cc1)OCCSCC 34a_100000189437_100000757381 [2,0,0,0,0,0|2,0,0]=4 2270 B14R1.776 C=Cc1ccc(cc1)OCCSCC 7a_100000189437_100000757381 [2,0,0,0,0,0|2,0,0]=4 2271 B14R1.776 C=Cc1ccc(cc1)SCCCCC 62a_100000210326_100000748128 [2,0,0,0,0,0|1,0,0]=3 2272 B14R1.776 C=Cc1ccc(cc1)SCCCCC 62a_100000748128_100000210326 [2,0,0,0,0,0|1,0,0]=3 2273 B14R1.776 C=Cc1ccc(cc1)SCCCCF 62a_100000729493_100000748128 [2,0,0,0,0,0|2,0,0]=4 2274 B14R1.776 C=Cc1ccc(cc1)SCCCCF 62a_100000748128_100000729493 [2,0,0,0,0,0|2,0,0]=4 2275 B14R1.776 C=Cc1ccc(cc1)SCCCCO 62a_100000210776_100000748128 [2,0,0,0,0,0|2,0,0]=4 2276 B14R1.776 C=Cc1ccc(cc1)SCCCCO 62a_100000748128_100000210776 [2,0,0,0,0,0|2,0,0]=4 2277 B14R1.776 C=Cc1ccc(cc1)SCCCOC 62a_100000709357_100000748128 [2,0,0,0,0,0|2,0,0]=4 2278 B14R1.776 C=Cc1ccc(cc1)SCCCOC 62a_100000748128_100000709357 [2,0,0,0,0,0|2,0,0]=4 2279 B14R1.776 C=Cc1ccc(cc1)SCCOCC 62a_100000210147_100000748128 [2,0,0,0,0,0|2,0,0]=4 2280 B14R1.776 C=Cc1ccc(cc1)SCCOCC 62a_100000748128_100011215890 [2,0,0,0,0,0|2,0,0]=4 2281 B14R1.776 C=Cc1ccc(cc1)SCCSCC 62a_100000748128_100000757381 [2,0,0,0,0,0|2,0,0]=4 2282 B14R1.776 C=Cc1ccc(cc1)SCCSCC 62a_100000757381_100000748128 [2,0,0,0,0,0|2,0,0]=4 2283 B14R1.776 C=Cc1ccc(nc1)SCCCCC 62a_100000210326_103436540071 [2,0,0,0,0,0|2,0,0]=4 2284 B14R1.776 C=Cc1ccc(nc1)SCCCCC 62a_103436540071_100000210326 [2,0,0,0,0,0|2,0,0]=4 2285 B14R1.776 CCCCC=Cc1ccc(cc1)C=O 271570a_100016275911_100000186029 [2,0,0,0,0,0|0,0,2]=4 2286 B14R1.776 CCCCCCc1ccc(cc1)NC 2230a_100000035805_200000210301 [2,0,0,0,0,0|1,0,1]=4 2287 B14R1.776 CCCCCCc1ccc(cc1)NC 34a_100000035805_200000210301 [2,0,0,0,0,0|1,0,1]=4 2288 B14R1.776 CCCCCCc1ccc(cc1)NC 7a_100000035805_200000210301 [2,0,0,0,0,0|1,0,1]=4 2289 B14R1.776 CCCCCCc1ccc(cc1)N[13CH3] 2230a_100000035805_200025704644 [2,0,0,0,0,0|1,0,1]=4 2290 B14R1.776 CCCCCCc1ccc(cc1)N[13CH3] 34a_100000035805_200025704644 [2,0,0,0,0,0|1,0,1]=4 2291 B14R1.776 CCCCCCc1ccc(cc1)N[13CH3] 7a_100000035805_200025704644 [2,0,0,0,0,0|1,0,1]=4 2292 B14R1.776 CCCCCCc1ccc(cc1)OC 34a_100000011238_200000210301 [2,0,0,0,0,0|1,0,1]=4 2293 B14R1.776 CCCCCCc1ccc(cc1)OC 7a_100000011238_200000210301 [2,0,0,0,0,0|1,0,1]=4 2294 B14R1.776 CCCCCCc1ccc(cc1)O[13CH3] 34a_100000011238_200025704644 [2,0,0,0,0,0|1,0,1]=4 2295 B14R1.776 CCCCCCc1ccc(cc1)O[13CH3] 7a_100000011238_200025704644 [2,0,0,0,0,0|1,0,1]=4 2296 B14R1.776 CCCCCCc1ccc(cc1)SC 62a_100009814338_200000210301 [2,0,0,0,0,0|1,0,1]=4 2297 B14R1.776 CCCCCCc1ccc(cc1)SC 62a_200000210301_100009814338 [2,0,0,0,0,0|1,0,1]=4 2298 B14R1.776 CCCCCCc1ccc(cc1)S[13CH3] 62a_100009814338_200025704644 [2,0,0,0,0,0|1,0,1]=4 2299 B14R1.776 CCCCCCc1ccc(cc1)S[13CH3] 62a_200025704644_100009814338 [2,0,0,0,0,0|1,0,1]=4 2300 B14R1.776 CCCCCSc1ccc(cc1)C=O 62a_100000188517_100000210326 [2,0,0,0,0,0|1,0,0]=3 2301 B14R1.776 CCCCCSc1ccc(cc1)C=O 62a_100000210326_100000188517 [2,0,0,0,0,0|1,0,0]=3 2302 B14R1.776 CCCCCSc1ccc(cn1)C=O 62a_100000210326_100000766901 [2,0,0,0,0,0|2,0,0]=4 2303 B14R1.776 CCCCCSc1ccc(cn1)C=O 62a_100000766901_100000210326 [2,0,0,0,0,0|2,0,0]=4 2304 B14R1.776 CCCCCSc1ccc(nc1)C=O 62a_100000210326_100000754260 [2,0,0,0,0,0|2,0,0]=4 2305 B14R1.776 CCCCCSc1ccc(nc1)C=O 62a_100000754260_100000210326 [2,0,0,0,0,0|2,0,0]=4 2306 B14R1.776 CCCCNCc1ccc(cc1)C=O 2230a_100000102301_100009816848 [2,0,0,0,0,0|1,0,0]=3 2307 B14R1.776 CCCCNCc1ccc(cc1)C=O 7a_106832991798_100009816848 [2,0,0,0,0,0|1,0,0]=3 2308 B14R1.776 CCCCOCc1ccc(cc1)C=O 34a_100000210227_100009816848 [2,0,0,0,0,0|1,0,0]=3 2309 B14R1.776 CCCCOCc1ccc(cc1)C=O 7a_100000210227_100009816848 [2,0,0,0,0,0|1,0,0]=3 2310 B14R1.776 CCCCSCc1ccc(cc1)C=O 62a_100000210211_100009816848 [2,0,0,0,0,0|1,0,0]=3 2311 B14R1.776 CCCCSCc1ccc(cc1)C=O 62a_100009816848_100000210210 [2,0,0,0,0,0|1,0,0]=3 2312 B14R1.776 CCNCCOc1ccc(cc1)C=O 2230a_100015525214_100000040479 [2,0,0,0,0,0|2,0,0]=4 2313 B14R1.776 CCOCCOc1ccc(cc1)C=O 34a_100121572206_100000040479 [2,0,0,0,0,0|2,0,0]=4 2314 B14R1.776 CCOCCSc1ccc(cc1)C=O 62a_100000188517_100011215890 [2,0,0,0,0,0|2,0,0]=4 2315 B14R1.776 CCOCCSc1ccc(cc1)C=O 62a_100000210147_100000188517 [2,0,0,0,0,0|2,0,0]=4 2316 B14R1.776 CCOCSCc1ccc(cc1)C=O 62a_100000739092_100009816848 [2,0,0,0,0,0|2,0,0]=4 2317 B14R1.776 CCOCSCc1ccc(cc1)C=O 62a_100009816848_100000739092 [2,0,0,0,0,0|2,0,0]=4 2318 B14R1.776 CCSCCOc1ccc(cc1)C=O 62a_100000040479_100000210202 [2,0,0,0,0,0|2,0,0]=4 2319 B14R1.776 CCSCCOc1ccc(cc1)C=O 62a_100000210202_100000040479 [2,0,0,0,0,0|2,0,0]=4 2320 B14R1.776 CCSCCSc1ccc(cc1)C=O 62a_100000188517_100000757381 [2,0,0,0,0,0|2,0,0]=4 2321 B14R1.776 CCSCCSc1ccc(cc1)C=O 62a_100000757381_100000188517 [2,0,0,0,0,0|2,0,0]=4 2322 B14R1.776 COCCCSc1ccc(cc1)C=O 62a_100000188517_100000709357 [2,0,0,0,0,0|2,0,0]=4 2323 B14R1.776 COCCCSc1ccc(cc1)C=O 62a_100000709357_100000188517 [2,0,0,0,0,0|2,0,0]=4 2324 B14R1.776 COCCNCc1ccc(cc1)C=O 2230a_100000209980_100009816848 [2,0,0,0,0,0|2,0,0]=4 2325 B14R1.776 COCCOCc1ccc(cc1)C=O 34a_100000210237_100009816848 [2,0,0,0,0,0|2,0,0]=4 2326 B14R1.776 COCCSCc1ccc(cc1)C=O 62a_100000233755_100009816848 [2,0,0,0,0,0|2,0,0]=4 2327 B14R1.776 COCCSCc1ccc(cc1)C=O 62a_100009816848_100000233755 [2,0,0,0,0,0|2,0,0]=4 2328 B14R1.776 CSCCNCc1ccc(cc1)C=O 2230a_100020590264_100009816848 [2,0,0,0,0,0|2,0,0]=4 2329 B14R1.776 CSCCOCc1ccc(cc1)C=O 34a_100000230434_100009816848 [2,0,0,0,0,0|2,0,0]=4 2330 B14R1.776 CSCCOCc1ccc(cc1)C=O 7a_100000230434_100009816848 [2,0,0,0,0,0|2,0,0]=4 2331 B14R1.776 CSCCSCc1ccc(cc1)C=O 62a_100000212216_100009816848 [2,0,0,0,0,0|2,0,0]=4 2332 B14R1.776 CSCCSCc1ccc(cc1)C=O 62a_100009816848_100000751147 [2,0,0,0,0,0|2,0,0]=4 2333 B14R1.776 NCCCOCc1ccc(cc1)C=O 34a_100000182051_100009816848 [2,0,0,0,0,0|2,0,0]=4 2334 B14R1.776 O=Cc1ccc(cc1)CNCCCF 2230a_100015189416_100009816848 [2,0,0,0,0,0|2,0,0]=4 2335 B14R1.776 O=Cc1ccc(cc1)CNCCCF 34a_100015189416_100009816848 [2,0,0,0,0,0|2,0,0]=4 2336 B14R1.776 O=Cc1ccc(cc1)COCCCBr 34a_100011217188_100009816848 [2,0,0,0,0,0|2,0,0]=4 2337 B14R1.776 O=Cc1ccc(cc1)COCCCCl 34a_100000230001_100009816848 [2,0,0,0,0,0|2,0,0]=4 2338 B14R1.776 O=Cc1ccc(cc1)COCCCF 34a_100000759539_100009816848 [2,0,0,0,0,0|2,0,0]=4 2339 B14R1.776 O=Cc1ccc(cc1)CSCCCF 62a_100009816848_100011934791 [2,0,0,0,0,0|2,0,0]=4 2340 B14R1.776 O=Cc1ccc(cc1)CSCCCF 62a_100011934791_100009816848 [2,0,0,0,0,0|2,0,0]=4 2341 B14R1.776 O=Cc1ccc(cc1)CSCCCO 62a_100009816848_100011215043 [2,0,0,0,0,0|2,0,0]=4 2342 B14R1.776 O=Cc1ccc(cc1)CSCCCO 62a_100011215043_100009816848 [2,0,0,0,0,0|2,0,0]=4 2343 B14R1.776 O=Cc1ccc(cc1)SCCCCF 62a_100000188517_100000729493 [2,0,0,0,0,0|2,0,0]=4 2344 B14R1.776 O=Cc1ccc(cc1)SCCCCF 62a_100000729493_100000188517 [2,0,0,0,0,0|2,0,0]=4 2345 B14R1.776 O=Cc1ccc(cc1)SCCCCO 62a_100000188517_100000210776 [2,0,0,0,0,0|2,0,0]=4 2346 B14R1.776 O=Cc1ccc(cc1)SCCCCO 62a_100000210776_100000188517 [2,0,0,0,0,0|2,0,0]=4 2347 B16R1.26 C#CCC(=O)c1ccc(cc1)CCCCC 1458a_100000037971_100000184674 [1,1,0,0,0,0|0,0,2]=4 2348 B16R1.26 C=CCC(=O)c1ccc(cc1)/C=C/CCC 1458a_200020627273_100000210623 [1,1,0,0,0,0|0,0,2]=4 2349 B16R1.26 C=CCC(=O)c1ccc(cc1)CCCCC 1458a_100000037971_100000210623 [1,1,0,0,0,0|0,0,0]=2 2350 B16R1.26 C=CCC(=O)c1ccc(cc1)OCCCC 1458a_100000182901_100000210623 [1,1,0,0,0,0|1,0,0]=3 2351 B16R1.26 C=CCC(=O)c1ccc(cc1)OCCOC 1458a_100000243733_100000210623 [1,1,0,0,0,0|2,0,0]=4 2352 B16R1.26 CCCCCc1ccc(cc1)C(=O)CC#N 1458a_100000037971_100011214920 [1,1,0,0,0,0|0,0,2]=4 2353 B16R1.26 CCCCCc1ccc(cc1)C(=O)CCC 1458a_100000037971_100000210303 [1,1,0,0,0,0|0,0,2]=4 2354 B16R1.26 CCCCCc1ccc(cc1)C(=O)CCF 1458a_100000037971_100011217306 [1,1,0,0,0,0|0,0,2]=4 2355 B16R1.26 CCCCCc1ccc(cc1)C(=O)CCO 1458a_100000037971_100000211926 [1,1,0,0,0,0|0,0,2]=4 2356 B16R1.26 CCCCCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000734901 [1,1,0,0,0,0|0,0,2]=4 2357 B16R1.26 CCCCCc1ccc(cc1)C(=O)CNC 34a_100102657272_100000734901 [1,1,0,0,0,0|0,0,2]=4 2358 B16R1.26 CCCCCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000734901 [1,1,0,0,0,0|0,0,2]=4 2359 B16R1.26 CCCCCc1ccc(cc1)C(=O)COC 34a_100138415774_100000734901 [1,1,0,0,0,0|0,0,2]=4 2360 B16R1.26 CCCCCc1ccc(cc1)C(=O)CSC 62a_100000734901_200000210301 [1,1,0,0,0,0|0,0,2]=4 2361 B16R1.26 CCCCCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000734901 [1,1,0,0,0,0|0,0,2]=4 2362 B16R1.26 CCCCCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000734901_200025704644 [1,1,0,0,0,0|0,0,2]=4 2363 B16R1.26 CCCCCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000734901 [1,1,0,0,0,0|0,0,2]=4 2364 B16R1.26 CCCCCc1ccc(cc1)C(=O)NCC 11a_100015525214_100000037971 [1,1,0,0,0,0|0,0,2]=4 2365 B16R1.26 CCCCCc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000037971 [1,1,0,0,0,0|0,0,2]=4 2366 B16R1.26 CCCCCc1ccc(cc1)C(=O)NCC 527a_100015525214_100000037971 [1,1,0,0,0,0|0,0,2]=4 2367 B16R1.26 CCCCCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000037971 [1,1,0,0,0,0|1,0,1]=4 2368 B16R1.26 CCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000210211_200020603514 [1,1,0,0,0,0|2,0,0]=4 2369 B16R1.26 CCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100000210210 [1,1,0,0,0,0|2,0,0]=4 2370 B16R1.665 CCCCCc1ccc(cc1)C(=O)C(C)C 1458a_100000037971_100000210206 [1,1,0,0,0,0|0,0,2]=4 2371 B16R1.665 CCCCCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000037971 [1,1,0,0,0,0|1,0,1]=4 2372 B16R1.665 CCCCCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000037971 [1,1,0,0,0,0|1,0,1]=4 2373 B16R1.665 CCCCCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000037971 [1,1,0,0,0,0|1,0,1]=4 2374 B16R1.665 CCCCCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000037971 [1,1,0,0,0,0|1,0,1]=4 2375 B16R1.665 CCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000210210 [1,1,0,0,0,0|2,0,0]=4 2376 B16R1.1120 CC(C)CCSc1ccc(cc1)C(=O)C=O 62a_100000210312_100000725942 [1,1,0,0,0,0|2,0,0]=4 2377 B16R1.1120 CC(C)CCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210312 [1,1,0,0,0,0|2,0,0]=4 2378 B16R1.1120 CC(O)CCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100012276601 [1,1,0,0,0,0|2,0,0]=4 2379 B16R1.1120 CC(O)CCSc1ccc(cc1)C(=O)C=O 62a_100012276601_100000725942 [1,1,0,0,0,0|2,0,0]=4 2380 B16R1.1136 CCC(C)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000748023 [1,1,0,0,0,0|2,0,0]=4 2381 B16R1.1136 CCC(C)CSc1ccc(cc1)C(=O)C=O 62a_100000748023_100000725942 [1,1,0,0,0,0|2,0,0]=4 2382 B16R1.1136 CCC(O)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011218378 [1,1,0,0,0,0|2,0,0]=4 2383 B16R1.1136 CCC(O)CSc1ccc(cc1)C(=O)C=O 62a_100011218378_100000725942 [1,1,0,0,0,0|2,0,0]=4 2384 B16R1.1136 CC[C@H](C)CSc1ccc(cc1)C(=O)C=O 62a_100000725942_100009816398 [1,1,0,0,0,0|2,0,0]=4 2385 B16R1.1136 CC[C@H](C)CSc1ccc(cc1)C(=O)C=O 62a_100009816398_100000725942 [1,1,0,0,0,0|2,0,0]=4 2386 B16R1.1530 CCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_100000766640 [1,1,0,0,0,0|2,0,0]=4 2387 B16R1.1530 CCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000766640_100000725942 [1,1,0,0,0,0|2,0,0]=4 2388 B16R1.276 CCCCCNc1ccc(c(c1)Br)C(=O)N 27a_100000209983_200010146565 [1,1,0,0,0,0|2,0,0]=4 2389 B16R1.276 CCCCCNc1ccc(c(c1)C)C(=O)N 27a_100000209983_100011327924 [1,1,0,0,0,0|2,0,0]=4 2390 B16R1.276 CCCCCNc1ccc(c(c1)C)C(=O)N 34a_200000751758_100000718602 [1,1,0,0,0,0|2,0,0]=4 2391 B16R1.276 CCCCCNc1ccc(c(c1)C)C(=O)N 7a_200000751758_100000210326 [1,1,0,0,0,0|2,0,0]=4 2392 B16R1.276 CCCCCNc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_100000718602 [1,1,0,0,0,0|2,0,0]=4 2393 B16R1.276 CCCCCNc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_100000210326 [1,1,0,0,0,0|2,0,0]=4 2394 B16R1.276 CCCCCNc1ccc(c(c1)F)C(=O)C 27a_100000209983_100000690205 [1,1,0,0,0,0|1,0,1]=4 2395 B16R1.276 CCCCCNc1ccc(c(c1)F)C(=O)N 27a_100000209983_100000216903 [1,1,0,0,0,0|2,0,0]=4 2396 B16R1.276 CCCCCNc1ccc(c(c1)F)C(=O)N 34a_100000749959_100000718602 [1,1,0,0,0,0|2,0,0]=4 2397 B16R1.276 CCCCCNc1ccc(c(c1)F)C(=O)N 7a_100000749959_100000210326 [1,1,0,0,0,0|2,0,0]=4 2398 B16R1.276 CCCCCNc1ccc(c(c1)O)C(=O)N 34a_100000223280_100000718602 [1,1,0,0,0,0|2,0,0]=4 2399 B16R1.276 CCCCCNc1ccc(c(c1)O)C(=O)N 7a_100000223280_100000210326 [1,1,0,0,0,0|2,0,0]=4 2400 B16R1.276 CCCCCOc1ccc(c(c1)Br)C(=O)C 34a_100012340537_100000718602 [1,1,0,0,0,0|1,0,1]=4 2401 B16R1.276 CCCCCOc1ccc(c(c1)Br)C(=O)C 7a_100012340537_100000210326 [1,1,0,0,0,0|1,0,1]=4 2402 B16R1.276 CCCCCOc1ccc(c(c1)C)C(=O)C 34a_100000702595_100000718602 [1,1,0,0,0,0|1,0,1]=4 2403 B16R1.276 CCCCCOc1ccc(c(c1)C)C(=O)C 7a_100000702595_100000210326 [1,1,0,0,0,0|1,0,1]=4 2404 B16R1.276 CCCCCOc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_100000718602 [1,1,0,0,0,0|1,0,1]=4 2405 B16R1.276 CCCCCOc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_100000210326 [1,1,0,0,0,0|1,0,1]=4 2406 B16R1.276 CCCCCOc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_100000718602 [1,1,0,0,0,0|2,0,0]=4 2407 B16R1.276 CCCCCOc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_100000210326 [1,1,0,0,0,0|2,0,0]=4 2408 B16R1.276 CCCCCOc1ccc(c(c1)F)C(=O)C 34a_100000752407_100000718602 [1,1,0,0,0,0|1,0,1]=4 2409 B16R1.276 CCCCCOc1ccc(c(c1)F)C(=O)C 7a_100000752407_100000210326 [1,1,0,0,0,0|1,0,1]=4 2410 B16R1.276 CCCCCOc1ccc(c(c1)F)C(=O)N 34a_200012186767_100000718602 [1,1,0,0,0,0|2,0,0]=4 2411 B16R1.276 CCCCCOc1ccc(c(c1)F)C(=O)N 7a_200012186767_100000210326 [1,1,0,0,0,0|2,0,0]=4 2412 B16R1.276 CCCCCOc1ccc(c(c1)N)C(=O)N 34a_100012186684_100000718602 [1,1,0,0,0,0|2,0,0]=4 2413 B16R1.276 CCCCCOc1ccc(c(c1)N)C(=O)N 7a_100012186684_100000210326 [1,1,0,0,0,0|2,0,0]=4 2414 B16R1.276 CCCCCSc1ccc(c(c1)Br)C(=O)N 62a_200010146565_100000210326 [1,1,0,0,0,0|2,0,0]=4 2415 B16R1.276 CCCCCSc1ccc(c(c1)C)C(=O)C 62a_100000210326_100012360112 [1,1,0,0,0,0|1,0,1]=4 2416 B16R1.276 CCCCCSc1ccc(c(c1)C)C(=O)C 62a_100012360112_100000210326 [1,1,0,0,0,0|1,0,1]=4 2417 B16R1.276 CCCCCSc1ccc(c(c1)C)C(=O)N 62a_100000210326_100011327924 [1,1,0,0,0,0|2,0,0]=4 2418 B16R1.276 CCCCCSc1ccc(c(c1)C)C(=O)N 62a_100011327924_100000210326 [1,1,0,0,0,0|2,0,0]=4 2419 B16R1.276 CCCCCSc1ccc(c(c1)F)C(=O)C 62a_100000690205_100000210326 [1,1,0,0,0,0|1,0,1]=4 2420 B16R1.276 CCCCCSc1ccc(c(c1)F)C(=O)N 62a_100000216903_100000210326 [1,1,0,0,0,0|2,0,0]=4 2421 B16R1.276 CCCCCSc1ccc(c(c1)N)C(=O)C 62a_100011590516_100000210326 [1,1,0,0,0,0|1,0,1]=4 2422 B16R1.276 CCCCCSc1ccc(c(c1)N)C(=O)N 62a_100012349972_100000210326 [1,1,0,0,0,0|2,0,0]=4 2423 B16R1.276 CCCCCSc1ccc(c(c1)O)C(=O)N 62a_100011550861_100000210326 [1,1,0,0,0,0|2,0,0]=4 2424 B16R1.925 C=C(C)c1ccc(cc1)OCC(C)CCC 34a_100009880102_100011216630 [1,1,0,0,0,0|2,0,0]=4 2425 B16R1.925 C=C(C)c1ccc(cc1)OCC(C)CCC 7a_100009880102_100011216630 [1,1,0,0,0,0|2,0,0]=4 2426 B16R1.925 CCCC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000211992_200000038727 [1,1,0,0,0,0|0,0,2]=4 2427 B16R1.925 CCCC(C)CNc1ccc(cc1)C(=O)N 34a_100000210537_100011216630 [1,1,0,0,0,0|2,0,0]=4 2428 B16R1.925 CCCC(C)COc1ccc(cc1)C(=O)C 34a_100000185113_100011216630 [1,1,0,0,0,0|1,0,1]=4 2429 B16R1.925 CCCC(C)COc1ccc(cc1)C(=O)C 7a_100000185113_100011216630 [1,1,0,0,0,0|1,0,1]=4 2430 B16R1.925 CCCC(C)COc1ccc(cc1)C(=O)N 34a_100000746352_100011216630 [1,1,0,0,0,0|2,0,0]=4 2431 B16R1.925 CCCC(C)COc1ccc(cc1)C(=O)N 7a_100000746352_100011216630 [1,1,0,0,0,0|2,0,0]=4 2432 B16R1.925 CCCC(C)CSc1ccc(cc1)C(=O)C 62a_100000185465_100011216630 [1,1,0,0,0,0|1,0,1]=4 2433 B16R1.925 CCCC(C)CSc1ccc(cc1)C(=O)C 62a_100011216630_100000185465 [1,1,0,0,0,0|1,0,1]=4 2434 B16R1.925 CCCC(C)CSc1ccc(cc1)C(=O)N 62a_100000162191_100011216630 [1,1,0,0,0,0|2,0,0]=4 2435 B16R1.925 CCCC(C)CSc1ccc(cc1)C(=O)N 62a_100011216630_100000162191 [1,1,0,0,0,0|2,0,0]=4 2436 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)C 2230a_100000741246_100000756337 [1,1,0,0,0,0|1,0,1]=4 2437 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)N 207a_100000741246_100000038677 [1,1,0,0,0,0|2,0,0]=4 2438 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)N 2230a_100000741246_100000231043 [1,1,0,0,0,0|2,0,0]=4 2439 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)N 270004a_100000185037_100000211909 [1,1,0,0,0,0|2,0,0]=4 2440 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)N 270004a_100000741246_100000038677 [1,1,0,0,0,0|2,0,0]=4 2441 B16R1.925 CCCC(C)NCc1ccc(cc1)C(=O)O 269956a_100000181780_100000766640 [1,1,0,0,0,0|2,0,0]=4 2442 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)C 34a_100000764384_100000756337 [1,1,0,0,0,0|1,0,1]=4 2443 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)C 7a_100000082505_100000766640 [1,1,0,0,0,0|1,0,1]=4 2444 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)C 7a_100000764384_100000756337 [1,1,0,0,0,0|1,0,1]=4 2445 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)N 34a_100000162016_100000766640 [1,1,0,0,0,0|2,0,0]=4 2446 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)N 34a_100000764384_100000231043 [1,1,0,0,0,0|2,0,0]=4 2447 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)N 7a_100000162016_100000766640 [1,1,0,0,0,0|2,0,0]=4 2448 B16R1.925 CCCC(C)OCc1ccc(cc1)C(=O)N 7a_100000764384_100000231043 [1,1,0,0,0,0|2,0,0]=4 2449 B16R1.925 CCCC(C)SCc1ccc(cc1)C(=O)C 62a_100000756337_100000766640 [1,1,0,0,0,0|1,0,1]=4 2450 B16R1.925 CCCC(C)SCc1ccc(cc1)C(=O)C 62a_100000766640_100000756337 [1,1,0,0,0,0|1,0,1]=4 2451 B16R1.925 CCCC(C)SCc1ccc(cc1)C(=O)N 62a_100000231043_100000766640 [1,1,0,0,0,0|2,0,0]=4 2452 B16R1.925 CCCC(C)SCc1ccc(cc1)C(=O)N 62a_100000766640_100000231043 [1,1,0,0,0,0|2,0,0]=4 2453 B16R1.925 CCCN(C)CCc1ccc(cc1)C(=O)C 2230a_100000747261_200000038727 [1,1,0,0,0,0|1,0,1]=4 2454 B16R1.925 CCCN(C)CCc1ccc(cc1)C(=O)C 269982a_100000747261_200000038727 [1,1,0,0,0,0|1,0,1]=4 2455 B16R1.1094 C=C(C)c1ccc(cc1)CNCC(C)CC 26a_100020588543_100009880102 [1,1,0,0,0,0|2,0,0]=4 2456 B16R1.1094 CCC(C)CCNc1ccc(cc1)C(=O)N 27a_100020591266_100000162191 [1,1,0,0,0,0|2,0,0]=4 2457 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)C 2230a_100020588543_100000756337 [1,1,0,0,0,0|1,0,1]=4 2458 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)C 26a_100020588543_100000185113 [1,1,0,0,0,0|1,0,1]=4 2459 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)N 207a_100020588543_100000038677 [1,1,0,0,0,0|2,0,0]=4 2460 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)N 2230a_100020588543_100000231043 [1,1,0,0,0,0|2,0,0]=4 2461 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)N 270004a_100000185037_100000243153 [1,1,0,0,0,0|2,0,0]=4 2462 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)N 270004a_100020588543_100000038677 [1,1,0,0,0,0|2,0,0]=4 2463 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000748023 [1,1,0,0,0,0|2,0,0]=4 2464 B16R1.1094 CCC(C)CNCc1ccc(cc1)C(=O)[O-] 26a_100020588543_100016998105 [1,1,0,0,0,0|2,0,0]=4 2465 B16R1.1094 CCC(C)COCc1ccc(cc1)C(=O)C 7a_100000082505_100000748023 [1,1,0,0,0,0|1,0,1]=4 2466 B16R1.1094 CCC(C)COCc1ccc(cc1)C(=O)N 34a_100000162016_100000748023 [1,1,0,0,0,0|2,0,0]=4 2467 B16R1.1094 CCC(C)COCc1ccc(cc1)C(=O)N 7a_100000162016_100000748023 [1,1,0,0,0,0|2,0,0]=4 2468 B16R1.1094 CCC(C)CSCc1ccc(cc1)C(=O)C 62a_100000748023_100000756337 [1,1,0,0,0,0|1,0,1]=4 2469 B16R1.1094 CCC(C)CSCc1ccc(cc1)C(=O)C 62a_100000756337_100000748023 [1,1,0,0,0,0|1,0,1]=4 2470 B16R1.1094 CCC(C)CSCc1ccc(cc1)C(=O)N 62a_100000231043_100000748023 [1,1,0,0,0,0|2,0,0]=4 2471 B16R1.1094 CCC(C)CSCc1ccc(cc1)C(=O)N 62a_100000748023_100000231043 [1,1,0,0,0,0|2,0,0]=4 2472 B16R1.1094 CCC(C)NCCc1ccc(cc1)C(=O)C 2230a_100000209981_200000038727 [1,1,0,0,0,0|1,0,1]=4 2473 B16R1.1094 CCC(C)NCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000758301 [1,1,0,0,0,0|2,0,0]=4 2474 B16R1.1094 CCC(C)OCCc1ccc(cc1)C(=O)C 7a_100000210228_200000038727 [1,1,0,0,0,0|1,0,1]=4 2475 B16R1.1094 CCC(C)SCCc1ccc(cc1)C(=O)C 62a_100000758301_200000038727 [1,1,0,0,0,0|1,0,1]=4 2476 B16R1.1094 CCC(C)SCCc1ccc(cc1)C(=O)C 62a_200000038727_100000758301 [1,1,0,0,0,0|1,0,1]=4 2477 B16R1.1094 CCC(O)CNCc1ccc(cc1)C(=O)C 2230a_100011218483_100000756337 [1,1,0,0,0,0|1,0,1]=4 2478 B16R1.1094 CCC(O)CNCc1ccc(cc1)C(=O)N 207a_100011218483_100000038677 [1,1,0,0,0,0|2,0,0]=4 2479 B16R1.1094 CCC(O)CNCc1ccc(cc1)C(=O)N 2230a_100011218483_100000231043 [1,1,0,0,0,0|2,0,0]=4 2480 B16R1.1094 CCC(O)CNCc1ccc(cc1)C(=O)N 270004a_100011218483_100000038677 [1,1,0,0,0,0|2,0,0]=4 2481 B16R1.1094 CCC(O)CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100011218378 [1,1,0,0,0,0|2,0,0]=4 2482 B16R1.1094 CCC(O)COCc1ccc(cc1)C(=O)C 7a_100000082505_100011218378 [1,1,0,0,0,0|1,0,1]=4 2483 B16R1.1094 CCC(O)COCc1ccc(cc1)C(=O)N 34a_100000162016_100011218378 [1,1,0,0,0,0|2,0,0]=4 2484 B16R1.1094 CCC(O)COCc1ccc(cc1)C(=O)N 7a_100000162016_100011218378 [1,1,0,0,0,0|2,0,0]=4 2485 B16R1.1094 CCC(O)CSCc1ccc(cc1)C(=O)C 62a_100000756337_100011218378 [1,1,0,0,0,0|1,0,1]=4 2486 B16R1.1094 CCC(O)CSCc1ccc(cc1)C(=O)C 62a_100011218378_100000756337 [1,1,0,0,0,0|1,0,1]=4 2487 B16R1.1094 CCC(O)CSCc1ccc(cc1)C(=O)N 62a_100000231043_100011218378 [1,1,0,0,0,0|2,0,0]=4 2488 B16R1.1094 CCC(O)CSCc1ccc(cc1)C(=O)N 62a_100011218378_100000231043 [1,1,0,0,0,0|2,0,0]=4 2489 B16R1.1094 CC[C@H](C)CNCc1ccc(cc1)C(=O)O 269956a_100000181780_100009816398 [1,1,0,0,0,0|2,0,0]=4 2490 B16R1.1094 CC[C@H](C)COCc1ccc(cc1)C(=O)C 7a_100000082505_100009816398 [1,1,0,0,0,0|1,0,1]=4 2491 B16R1.1094 CC[C@H](C)COCc1ccc(cc1)C(=O)C 7a_100009816381_100000756337 [1,1,0,0,0,0|1,0,1]=4 2492 B16R1.1094 CC[C@H](C)COCc1ccc(cc1)C(=O)N 34a_100000162016_100009816398 [1,1,0,0,0,0|2,0,0]=4 2493 B16R1.1094 CC[C@H](C)COCc1ccc(cc1)C(=O)N 7a_100000162016_100009816398 [1,1,0,0,0,0|2,0,0]=4 2494 B16R1.1094 CC[C@H](C)COCc1ccc(cc1)C(=O)N 7a_100009816381_100000231043 [1,1,0,0,0,0|2,0,0]=4 2495 B16R1.1094 CC[C@H](C)CSCc1ccc(cc1)C(=O)C 62a_100000756337_100009816398 [1,1,0,0,0,0|1,0,1]=4 2496 B16R1.1094 CC[C@H](C)CSCc1ccc(cc1)C(=O)C 62a_100009816398_100000756337 [1,1,0,0,0,0|1,0,1]=4 2497 B16R1.1094 CC[C@H](C)CSCc1ccc(cc1)C(=O)N 62a_100000231043_100009816398 [1,1,0,0,0,0|2,0,0]=4 2498 B16R1.1094 CC[C@H](C)CSCc1ccc(cc1)C(=O)N 62a_100009816398_100000231043 [1,1,0,0,0,0|2,0,0]=4 2499 B16R1.1229 CCCCCNc1ccc(cc1Br)C(=O)N 27a_100000209983_100009814583 [1,1,0,0,0,0|2,0,0]=4 2500 B16R1.1229 CCCCCNc1ccc(cc1C)C(=O)N 27a_100000209983_100011218126 [1,1,0,0,0,0|2,0,0]=4 2501 B16R1.1229 CCCCCNc1ccc(cc1C)C(=O)N 34a_100000746439_100000718602 [1,1,0,0,0,0|2,0,0]=4 2502 B16R1.1229 CCCCCNc1ccc(cc1C)C(=O)N 7a_100000746439_100000210326 [1,1,0,0,0,0|2,0,0]=4 2503 B16R1.1229 CCCCCNc1ccc(cc1F)C(=O)N 27a_100000209983_100000686215 [1,1,0,0,0,0|2,0,0]=4 2504 B16R1.1229 CCCCCOc1ccc(cc1Br)C(=O)C 34a_100011772453_100000718602 [1,1,0,0,0,0|1,0,1]=4 2505 B16R1.1229 CCCCCOc1ccc(cc1Br)C(=O)C 7a_100011772453_100000210326 [1,1,0,0,0,0|1,0,1]=4 2506 B16R1.1229 CCCCCOc1ccc(cc1C)C(=O)C 34a_100000188726_100000718602 [1,1,0,0,0,0|1,0,1]=4 2507 B16R1.1229 CCCCCOc1ccc(cc1C)C(=O)C 7a_100000188726_100000210326 [1,1,0,0,0,0|1,0,1]=4 2508 B16R1.1229 CCCCCOc1ccc(cc1Cl)C(=O)C 34a_100000188625_100000718602 [1,1,0,0,0,0|1,0,1]=4 2509 B16R1.1229 CCCCCOc1ccc(cc1Cl)C(=O)C 7a_100000188625_100000210326 [1,1,0,0,0,0|1,0,1]=4 2510 B16R1.1229 CCCCCOc1ccc(cc1Cl)C(=O)N 34a_200000192832_100000718602 [1,1,0,0,0,0|2,0,0]=4 2511 B16R1.1229 CCCCCOc1ccc(cc1Cl)C(=O)N 7a_200000192832_100000210326 [1,1,0,0,0,0|2,0,0]=4 2512 B16R1.1229 CCCCCOc1ccc(cc1F)C(=O)C 34a_100000751691_100000718602 [1,1,0,0,0,0|1,0,1]=4 2513 B16R1.1229 CCCCCOc1ccc(cc1F)C(=O)C 7a_100000751691_100000210326 [1,1,0,0,0,0|1,0,1]=4 2514 B16R1.1229 CCCCCOc1ccc(cc1N)C(=O)C 34a_100000117292_100000718602 [1,1,0,0,0,0|1,0,1]=4 2515 B16R1.1229 CCCCCOc1ccc(cc1N)C(=O)C 7a_100000117292_100000210326 [1,1,0,0,0,0|1,0,1]=4 2516 B16R1.1229 CCCCCSc1ccc(cc1Br)C(=O)C 62a_100000210326_100010146554 [1,1,0,0,0,0|1,0,1]=4 2517 B16R1.1229 CCCCCSc1ccc(cc1Br)C(=O)C 62a_100010146554_100000210326 [1,1,0,0,0,0|1,0,1]=4 2518 B16R1.1229 CCCCCSc1ccc(cc1Br)C(=O)N 62a_100000210326_100009814583 [1,1,0,0,0,0|2,0,0]=4 2519 B16R1.1229 CCCCCSc1ccc(cc1Br)C(=O)N 62a_100009814583_100000210326 [1,1,0,0,0,0|2,0,0]=4 2520 B16R1.1229 CCCCCSc1ccc(cc1C)C(=O)C 62a_100000210326_100000697869 [1,1,0,0,0,0|1,0,1]=4 2521 B16R1.1229 CCCCCSc1ccc(cc1C)C(=O)C 62a_100000697869_100000210326 [1,1,0,0,0,0|1,0,1]=4 2522 B16R1.1229 CCCCCSc1ccc(cc1C)C(=O)N 62a_100000210326_100011218126 [1,1,0,0,0,0|2,0,0]=4 2523 B16R1.1229 CCCCCSc1ccc(cc1C)C(=O)N 62a_100011218126_100000210326 [1,1,0,0,0,0|2,0,0]=4 2524 B16R1.1229 CCCCCSc1ccc(cc1F)C(=O)C 62a_100000210326_100000690002 [1,1,0,0,0,0|1,0,1]=4 2525 B16R1.1229 CCCCCSc1ccc(cc1F)C(=O)C 62a_100000690002_100000210326 [1,1,0,0,0,0|1,0,1]=4 2526 B16R1.1229 CCCCCSc1ccc(cc1F)C(=O)N 62a_100000210326_100000686215 [1,1,0,0,0,0|2,0,0]=4 2527 B16R1.1229 CCCCCSc1ccc(cc1F)C(=O)N 62a_100000686215_100000210326 [1,1,0,0,0,0|2,0,0]=4 2528 B16R1.1229 CCCCCSc1ccc(cc1N)C(=O)C 62a_100009816534_100000210326 [1,1,0,0,0,0|1,0,1]=4 2529 B16R1.1229 CCCCCSc1ccc(cc1O)C(=O)N 62a_100000210326_100012344895 [1,1,0,0,0,0|2,0,0]=4 2530 B16R1.1229 CCCCCSc1ccc(cc1O)C(=O)N 62a_100012344895_100000210326 [1,1,0,0,0,0|2,0,0]=4 2531 B16R1.1229 CCCCNCc1ccc(cc1Br)C(=O)C 2230a_100000102301_100010884425 [1,1,0,0,0,0|1,0,1]=4 2532 B16R1.1229 CCCCNCc1ccc(cc1Br)C(=O)C 7a_106832991798_100010884425 [1,1,0,0,0,0|1,0,1]=4 2533 B16R1.1229 CCCCOCc1ccc(cc1Br)C(=O)C 34a_100000210227_100010884425 [1,1,0,0,0,0|1,0,1]=4 2534 B16R1.1229 CCCCOCc1ccc(cc1Br)C(=O)C 7a_100000210227_100010884425 [1,1,0,0,0,0|1,0,1]=4 2535 B16R1.1229 CCCCSCc1ccc(cc1Br)C(=O)C 62a_100010884425_100000210210 [1,1,0,0,0,0|1,0,1]=4 2536 B16R1.1274 C=C(C)c1ccc(cc1)CNCCC(C)C 26a_100000210545_100009880102 [1,1,0,0,0,0|2,0,0]=4 2537 B16R1.1274 C=C(C)c1ccc(cc1)OCCCC(C)C 34a_100009880102_100011214892 [1,1,0,0,0,0|2,0,0]=4 2538 B16R1.1274 C=C(C)c1ccc(cc1)OCCCC(C)C 7a_100009880102_100011214892 [1,1,0,0,0,0|2,0,0]=4 2539 B16R1.1274 C=C(C)c1ccc(cc1)OCCCC(C)O 34a_100009880102_200000718107 [1,1,0,0,0,0|2,0,0]=4 2540 B16R1.1274 C=C(C)c1ccc(cc1)OCCCC(C)O 7a_100009880102_200000718107 [1,1,0,0,0,0|2,0,0]=4 2541 B16R1.1274 C=C(C)c1ccc(cc1)SCCCC(C)O 62a_100000185454_200000718107 [1,1,0,0,0,0|2,0,0]=4 2542 B16R1.1274 C=C(C)c1ccc(cc1)SCCCC(C)O 62a_200000718107_100000185454 [1,1,0,0,0,0|2,0,0]=4 2543 B16R1.1274 CC(=O)c1ccc(cc1)CCNCC(C)C 2230a_100000210953_200000038727 [1,1,0,0,0,0|1,0,1]=4 2544 B16R1.1274 CC(=O)c1ccc(cc1)CCNCC(C)C 34a_100000210953_200000038727 [1,1,0,0,0,0|1,0,1]=4 2545 B16R1.1274 CC(=O)c1ccc(cc1)CCNCC(C)O 2230a_100000210904_200000038727 [1,1,0,0,0,0|1,0,1]=4 2546 B16R1.1274 CC(=O)c1ccc(cc1)CCNCC(C)O 34a_100000210904_200000038727 [1,1,0,0,0,0|1,0,1]=4 2547 B16R1.1274 CC(=O)c1ccc(cc1)CCOCC(C)Br 34a_100012180447_200000038727 [1,1,0,0,0,0|1,0,1]=4 2548 B16R1.1274 CC(=O)c1ccc(cc1)CCOCC(C)C 34a_100000210257_200000038727 [1,1,0,0,0,0|1,0,1]=4 2549 B16R1.1274 CC(=O)c1ccc(cc1)CCOCC(C)F 34a_100015925927_200000038727 [1,1,0,0,0,0|1,0,1]=4 2550 B16R1.1274 CC(=O)c1ccc(cc1)CCOC[C@@H](C)Cl 34a_100016084084_200000038727 [1,1,0,0,0,0|1,0,1]=4 2551 B16R1.1274 CC(=O)c1ccc(cc1)CCOC[C@@H](C)N 34a_100000737577_200000038727 [1,1,0,0,0,0|1,0,1]=4 2552 B16R1.1274 CC(=O)c1ccc(cc1)CCSCC(C)C 62a_100000210624_200000038727 [1,1,0,0,0,0|1,0,1]=4 2553 B16R1.1274 CC(=O)c1ccc(cc1)CCSCC(C)C 62a_200000038727_100000210760 [1,1,0,0,0,0|1,0,1]=4 2554 B16R1.1274 CC(=O)c1ccc(cc1)CCSCC(C)O 62a_100011218427_200000038727 [1,1,0,0,0,0|1,0,1]=4 2555 B16R1.1274 CC(=O)c1ccc(cc1)CCSCC(C)O 62a_200000038727_100011218427 [1,1,0,0,0,0|1,0,1]=4 2556 B16R1.1274 CC(=O)c1ccc(cc1)CCSC[C@@H](C)O 62a_100009817552_200000038727 [1,1,0,0,0,0|1,0,1]=4 2557 B16R1.1274 CC(=O)c1ccc(cc1)CCSC[C@@H](C)O 62a_200000038727_100009817552 [1,1,0,0,0,0|1,0,1]=4 2558 B16R1.1274 CC(=O)c1ccc(cc1)CNCCC(C)C 26a_100000210545_100000185113 [1,1,0,0,0,0|1,0,1]=4 2559 B16R1.1274 CC(=O)c1ccc(cc1)CNCCC(C)O 2230a_200000755665_100000756337 [1,1,0,0,0,0|1,0,1]=4 2560 B16R1.1274 CC(=O)c1ccc(cc1)COCCC(C)Br 34a_100009893172_100000756337 [1,1,0,0,0,0|1,0,1]=4 2561 B16R1.1274 CC(=O)c1ccc(cc1)COCCC(C)C 34a_100000210254_100000756337 [1,1,0,0,0,0|1,0,1]=4 2562 B16R1.1274 CC(=O)c1ccc(cc1)COCCC(C)C 7a_100000082505_100000210626 [1,1,0,0,0,0|1,0,1]=4 2563 B16R1.1274 CC(=O)c1ccc(cc1)COCCC(C)C 7a_100000210254_100000756337 [1,1,0,0,0,0|1,0,1]=4 2564 B16R1.1274 CC(=O)c1ccc(cc1)COCCC(C)O 7a_100000082505_100012276601 [1,1,0,0,0,0|1,0,1]=4 2565 B16R1.1274 CC(=O)c1ccc(cc1)COCC[C@@H](C)N 34a_100000706166_100000756337 [1,1,0,0,0,0|1,0,1]=4 2566 B16R1.1274 CC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000210312_100000756337 [1,1,0,0,0,0|1,0,1]=4 2567 B16R1.1274 CC(=O)c1ccc(cc1)CSCCC(C)C 62a_100000756337_100000210312 [1,1,0,0,0,0|1,0,1]=4 2568 B16R1.1274 CC(=O)c1ccc(cc1)CSCCC(C)O 62a_100000756337_100012276601 [1,1,0,0,0,0|1,0,1]=4 2569 B16R1.1274 CC(=O)c1ccc(cc1)CSCCC(C)O 62a_100012276601_100000756337 [1,1,0,0,0,0|1,0,1]=4 2570 B16R1.1274 CC(=O)c1ccc(cc1)OCCCC(C)C 34a_100000185113_100011214892 [1,1,0,0,0,0|1,0,1]=4 2571 B16R1.1274 CC(=O)c1ccc(cc1)OCCCC(C)C 7a_100000185113_100011214892 [1,1,0,0,0,0|1,0,1]=4 2572 B16R1.1274 CC(=O)c1ccc(cc1)OCCCC(C)O 34a_100000185113_200000718107 [1,1,0,0,0,0|1,0,1]=4 2573 B16R1.1274 CC(=O)c1ccc(cc1)OCCCC(C)O 7a_100000185113_200000718107 [1,1,0,0,0,0|1,0,1]=4 2574 B16R1.1274 CC(=O)c1ccc(cc1)SCCCC(C)C 62a_100000185465_100011214892 [1,1,0,0,0,0|1,0,1]=4 2575 B16R1.1274 CC(=O)c1ccc(cc1)SCCCC(C)C 62a_100011214892_100000185465 [1,1,0,0,0,0|1,0,1]=4 2576 B16R1.1274 CC(=O)c1ccc(cc1)SCCCC(C)O 62a_100000185465_200000718107 [1,1,0,0,0,0|1,0,1]=4 2577 B16R1.1274 CC(=O)c1ccc(cc1)SCCCC(C)O 62a_200000718107_100000185465 [1,1,0,0,0,0|1,0,1]=4 2578 B16R1.1274 CC(Br)CCOCc1ccc(cc1)C(=O)N 34a_100009893172_100000231043 [1,1,0,0,0,0|2,0,0]=4 2579 B16R1.1274 CC(C)CCCNc1ccc(cc1)C(=O)N 27a_200000737386_100000162191 [1,1,0,0,0,0|2,0,0]=4 2580 B16R1.1274 CC(C)CCCNc1ccc(cc1)C(=O)N 34a_100000210537_100011214892 [1,1,0,0,0,0|2,0,0]=4 2581 B16R1.1274 CC(C)CCCOc1ccc(cc1)C(=O)N 34a_100000746352_100011214892 [1,1,0,0,0,0|2,0,0]=4 2582 B16R1.1274 CC(C)CCCOc1ccc(cc1)C(=O)N 7a_100000746352_100011214892 [1,1,0,0,0,0|2,0,0]=4 2583 B16R1.1274 CC(C)CCCSc1ccc(cc1)C(=O)N 62a_100000162191_100011214892 [1,1,0,0,0,0|2,0,0]=4 2584 B16R1.1274 CC(C)CCCSc1ccc(cc1)C(=O)N 62a_100011214892_100000162191 [1,1,0,0,0,0|2,0,0]=4 2585 B16R1.1274 CC(C)CCNCc1ccc(cc1)C(=O)N 207a_100000210545_100000038677 [1,1,0,0,0,0|2,0,0]=4 2586 B16R1.1274 CC(C)CCNCc1ccc(cc1)C(=O)N 269862a_100000185037_100000185833 [1,1,0,0,0,0|2,0,0]=4 2587 B16R1.1274 CC(C)CCNCc1ccc(cc1)C(=O)N 270004a_100000210545_100000038677 [1,1,0,0,0,0|2,0,0]=4 2588 B16R1.1274 CC(C)CCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210312 [1,1,0,0,0,0|2,0,0]=4 2589 B16R1.1274 CC(C)CCNCc1ccc(cc1)C(=O)[O-] 26a_100000210545_100016998105 [1,1,0,0,0,0|2,0,0]=4 2590 B16R1.1274 CC(C)CCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000210312 [1,1,0,0,0,0|2,0,0]=4 2591 B16R1.1274 CC(C)CCOCc1ccc(cc1)C(=O)N 34a_100000210254_100000231043 [1,1,0,0,0,0|2,0,0]=4 2592 B16R1.1274 CC(C)CCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000210626 [1,1,0,0,0,0|2,0,0]=4 2593 B16R1.1274 CC(C)CCOCc1ccc(cc1)C(=O)N 7a_100000210254_100000231043 [1,1,0,0,0,0|2,0,0]=4 2594 B16R1.1274 CC(C)CCSCc1ccc(cc1)C(=O)N 62a_100000210312_100000231043 [1,1,0,0,0,0|2,0,0]=4 2595 B16R1.1274 CC(C)CCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000210312 [1,1,0,0,0,0|2,0,0]=4 2596 B16R1.1274 CC(C)CNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000210760 [1,1,0,0,0,0|2,0,0]=4 2597 B16R1.1274 CC(O)CCCNc1ccc(cc1)C(=O)N 34a_100000210537_200000718107 [1,1,0,0,0,0|2,0,0]=4 2598 B16R1.1274 CC(O)CCCOc1ccc(cc1)C(=O)N 34a_100000746352_200000718107 [1,1,0,0,0,0|2,0,0]=4 2599 B16R1.1274 CC(O)CCCOc1ccc(cc1)C(=O)N 7a_100000746352_200000718107 [1,1,0,0,0,0|2,0,0]=4 2600 B16R1.1274 CC(O)CCCSc1ccc(cc1)C(=O)N 62a_100000162191_200000718107 [1,1,0,0,0,0|2,0,0]=4 2601 B16R1.1274 CC(O)CCCSc1ccc(cc1)C(=O)N 62a_200000718107_100000162191 [1,1,0,0,0,0|2,0,0]=4 2602 B16R1.1274 CC(O)CCNCc1ccc(cc1)C(=O)N 207a_200000755665_100000038677 [1,1,0,0,0,0|2,0,0]=4 2603 B16R1.1274 CC(O)CCNCc1ccc(cc1)C(=O)N 2230a_200000755665_100000231043 [1,1,0,0,0,0|2,0,0]=4 2604 B16R1.1274 CC(O)CCNCc1ccc(cc1)C(=O)N 270004a_200000755665_100000038677 [1,1,0,0,0,0|2,0,0]=4 2605 B16R1.1274 CC(O)CCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100012276601 [1,1,0,0,0,0|2,0,0]=4 2606 B16R1.1274 CC(O)CCOCc1ccc(cc1)C(=O)N 34a_100000162016_100012276601 [1,1,0,0,0,0|2,0,0]=4 2607 B16R1.1274 CC(O)CCOCc1ccc(cc1)C(=O)N 7a_100000162016_100012276601 [1,1,0,0,0,0|2,0,0]=4 2608 B16R1.1274 CC(O)CCSCc1ccc(cc1)C(=O)N 62a_100000231043_100012276601 [1,1,0,0,0,0|2,0,0]=4 2609 B16R1.1274 CC(O)CCSCc1ccc(cc1)C(=O)N 62a_100012276601_100000231043 [1,1,0,0,0,0|2,0,0]=4 2610 B16R1.1274 CC(O)CNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100011218427 [1,1,0,0,0,0|2,0,0]=4 2611 B16R1.1274 C[C@@H](N)CCOCc1ccc(cc1)C(=O)N 34a_100000706166_100000231043 [1,1,0,0,0,0|2,0,0]=4 2612 B16R1.1274 C[C@@H](O)CNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100009817552 [1,1,0,0,0,0|2,0,0]=4 2613 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCC 271570a_100000694244_100011216197 [1,1,0,0,0,0|1,0,0]=3 2614 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCC 34a_100009880102_100000210314 [1,1,0,0,0,0|1,0,0]=3 2615 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCC 7a_100009880102_100000210314 [1,1,0,0,0,0|1,0,0]=3 2616 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCF 34a_100009880102_100000729378 [1,1,0,0,0,0|2,0,0]=4 2617 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCF 7a_100009880102_100000729378 [1,1,0,0,0,0|2,0,0]=4 2618 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCO 34a_100009880102_100000746330 [1,1,0,0,0,0|2,0,0]=4 2619 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCCO 7a_100009880102_100000746330 [1,1,0,0,0,0|2,0,0]=4 2620 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCOC 34a_100009880102_100000755781 [1,1,0,0,0,0|2,0,0]=4 2621 B16R1.1402 C=C(C)c1ccc(cc1)OCCCCOC 7a_100009880102_100000730899 [1,1,0,0,0,0|2,0,0]=4 2622 B16R1.1402 C=C(C)c1ccc(cc1)OCCCOCC 34a_100009880102_100012232248 [1,1,0,0,0,0|2,0,0]=4 2623 B16R1.1402 C=C(C)c1ccc(cc1)OCCCOCC 7a_100009880102_100012232248 [1,1,0,0,0,0|2,0,0]=4 2624 B16R1.1402 C=C(C)c1ccc(cc1)OCCOCCC 34a_100009880102_100011215938 [1,1,0,0,0,0|2,0,0]=4 2625 B16R1.1402 C=C(C)c1ccc(cc1)OCCOCCC 7a_100009880102_100011215938 [1,1,0,0,0,0|2,0,0]=4 2626 B16R1.1402 C=C(C)c1ccc(cc1)OCOCCCC 34a_100009880102_100011995733 [1,1,0,0,0,0|2,0,0]=4 2627 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCCF 62a_100000185454_100000729378 [1,1,0,0,0,0|2,0,0]=4 2628 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCCF 62a_100000729378_100000185454 [1,1,0,0,0,0|2,0,0]=4 2629 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCCO 62a_100000185454_100000746330 [1,1,0,0,0,0|2,0,0]=4 2630 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCCO 62a_100000746330_100000185454 [1,1,0,0,0,0|2,0,0]=4 2631 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCOC 62a_100000185454_100000730899 [1,1,0,0,0,0|2,0,0]=4 2632 B16R1.1402 C=C(C)c1ccc(cc1)SCCCCOC 62a_100000730899_100000185454 [1,1,0,0,0,0|2,0,0]=4 2633 B16R1.1402 C=C(C)c1ccc(cc1)SCCCOCC 62a_100000185454_100012232248 [1,1,0,0,0,0|2,0,0]=4 2634 B16R1.1402 C=C(C)c1ccc(cc1)SCCCOCC 62a_100012232248_100000185454 [1,1,0,0,0,0|2,0,0]=4 2635 B16R1.1402 C=C(C)c1ccc(cc1)SCCOCCC 62a_100000185454_100011215938 [1,1,0,0,0,0|2,0,0]=4 2636 B16R1.1402 C=C(C)c1ccc(cc1)SCCOCCC 62a_100011215938_100000185454 [1,1,0,0,0,0|2,0,0]=4 2637 B16R1.1402 C=C(C)c1ccc(cc1)SCOCCCC 62a_100000185454_100011995733 [1,1,0,0,0,0|2,0,0]=4 2638 B16R1.1402 C=C(C)c1ccc(cc1)SCOCCCC 62a_100011995733_100000185454 [1,1,0,0,0,0|2,0,0]=4 2639 B16R1.1402 CC(=O)c1ccc(cc1)CCNCCCF 2230a_100015189416_200000038727 [1,1,0,0,0,0|1,0,1]=4 2640 B16R1.1402 CC(=O)c1ccc(cc1)CCNCCCF 34a_100015189416_200000038727 [1,1,0,0,0,0|1,0,1]=4 2641 B16R1.1402 CC(=O)c1ccc(cc1)CCOCCCBr 34a_100011217188_200000038727 [1,1,0,0,0,0|1,0,1]=4 2642 B16R1.1402 CC(=O)c1ccc(cc1)CCOCCCCl 34a_100000230001_200000038727 [1,1,0,0,0,0|1,0,1]=4 2643 B16R1.1402 CC(=O)c1ccc(cc1)CCOCCCF 34a_100000759539_200000038727 [1,1,0,0,0,0|1,0,1]=4 2644 B16R1.1402 CC(=O)c1ccc(cc1)CCOCCCN 34a_100000182051_200000038727 [1,1,0,0,0,0|1,0,1]=4 2645 B16R1.1402 CC(=O)c1ccc(cc1)CCSCCCF 62a_100011934791_200000038727 [1,1,0,0,0,0|1,0,1]=4 2646 B16R1.1402 CC(=O)c1ccc(cc1)CCSCCCF 62a_200000038727_100011934791 [1,1,0,0,0,0|1,0,1]=4 2647 B16R1.1402 CC(=O)c1ccc(cc1)CCSCCCO 62a_100011215043_200000038727 [1,1,0,0,0,0|1,0,1]=4 2648 B16R1.1402 CC(=O)c1ccc(cc1)CCSCCCO 62a_200000038727_100011215043 [1,1,0,0,0,0|1,0,1]=4 2649 B16R1.1402 CC(=O)c1ccc(cc1)CNCCCCO 2230a_100000750430_100000756337 [1,1,0,0,0,0|1,0,1]=4 2650 B16R1.1402 CC(=O)c1ccc(cc1)CNCCCCO 34a_100000750430_100000756337 [1,1,0,0,0,0|1,0,1]=4 2651 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCBr 34a_100011216708_100000756337 [1,1,0,0,0,0|1,0,1]=4 2652 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCCl 34a_100000210776_100000756337 [1,1,0,0,0,0|1,0,1]=4 2653 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCCl 7a_100000210776_100000756337 [1,1,0,0,0,0|1,0,1]=4 2654 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCF 34a_100011995726_100000756337 [1,1,0,0,0,0|1,0,1]=4 2655 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCF 7a_100000082505_100000729493 [1,1,0,0,0,0|1,0,1]=4 2656 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCF 7a_100011995726_100000756337 [1,1,0,0,0,0|1,0,1]=4 2657 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCI 34a_200012148704_100000756337 [1,1,0,0,0,0|1,0,1]=4 2658 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCN 34a_100000750430_100000756337 [1,1,0,0,0,0|1,0,1]=4 2659 B16R1.1402 CC(=O)c1ccc(cc1)COCCCCO 7a_100000082505_100000210776 [1,1,0,0,0,0|1,0,1]=4 2660 B16R1.1402 CC(=O)c1ccc(cc1)CSCCCCF 62a_100000729493_100000756337 [1,1,0,0,0,0|1,0,1]=4 2661 B16R1.1402 CC(=O)c1ccc(cc1)CSCCCCF 62a_100000756337_100000729493 [1,1,0,0,0,0|1,0,1]=4 2662 B16R1.1402 CC(=O)c1ccc(cc1)CSCCCCO 62a_100000210776_100000756337 [1,1,0,0,0,0|1,0,1]=4 2663 B16R1.1402 CC(=O)c1ccc(cc1)CSCCCCO 62a_100000756337_100000210776 [1,1,0,0,0,0|1,0,1]=4 2664 B16R1.1402 CC(=O)c1ccc(cc1)OCCCCCF 34a_100000185113_100000729378 [1,1,0,0,0,0|1,0,1]=4 2665 B16R1.1402 CC(=O)c1ccc(cc1)OCCCCCF 7a_100000185113_100000729378 [1,1,0,0,0,0|1,0,1]=4 2666 B16R1.1402 CC(=O)c1ccc(cc1)OCCCCCO 34a_100000185113_100000746330 [1,1,0,0,0,0|1,0,1]=4 2667 B16R1.1402 CC(=O)c1ccc(cc1)OCCCCCO 7a_100000185113_100000746330 [1,1,0,0,0,0|1,0,1]=4 2668 B16R1.1402 CC(=O)c1ccc(cc1)SCCCCCF 62a_100000185465_100000729378 [1,1,0,0,0,0|1,0,1]=4 2669 B16R1.1402 CC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000185465 [1,1,0,0,0,0|1,0,1]=4 2670 B16R1.1402 CC(=O)c1ccc(cc1)SCCCCCO 62a_100000185465_100000746330 [1,1,0,0,0,0|1,0,1]=4 2671 B16R1.1402 CC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000185465 [1,1,0,0,0,0|1,0,1]=4 2672 B16R1.1402 CCCCCC=Cc1ccc(cc1)C(=O)C 271570a_100000062253_100000185465 [1,1,0,0,0,0|0,0,2]=4 2673 B16R1.1402 CCCCCC=Cc1ccc(cc1)C(=O)N 271570a_100000062253_100000162191 [1,1,0,0,0,0|1,0,1]=4 2674 B16R1.1402 CCCCCCCc1ccc(cc1)C(=O)C 1458a_100000012247_200000210301 [1,1,0,0,0,0|0,0,1]=3 2675 B16R1.1402 CCCCCCCc1ccc(cc1)C(=O)[13CH3] 1458a_100000012247_200025704644 [1,1,0,0,0,0|0,0,1]=3 2676 B16R1.1402 CCCCCCNc1ccc(cc1)C(=O)N 27a_100000210581_100000162191 [1,1,0,0,0,0|1,0,0]=3 2677 B16R1.1402 CCCCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210314 [1,1,0,0,0,0|1,0,0]=3 2678 B16R1.1402 CCCCCCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210314 [1,1,0,0,0,0|2,0,0]=4 2679 B16R1.1402 CCCCCCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210314 [1,1,0,0,0,0|2,0,0]=4 2680 B16R1.1402 CCCCCCNc1ccc(cn1)C(=O)C 27a_100000210581_100000690552 [1,1,0,0,0,0|1,0,1]=4 2681 B16R1.1402 CCCCCCNc1ccc(cn1)C(=O)N 27a_100000210581_100000162237 [1,1,0,0,0,0|2,0,0]=4 2682 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)C 1458a_100000182910_200000210301 [1,1,0,0,0,0|0,0,1]=3 2683 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210314 [1,1,0,0,0,0|0,0,1]=3 2684 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210314 [1,1,0,0,0,0|0,0,1]=3 2685 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210314 [1,1,0,0,0,0|1,0,0]=3 2686 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210314 [1,1,0,0,0,0|1,0,0]=3 2687 B16R1.1402 CCCCCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000182910_200025704644 [1,1,0,0,0,0|0,0,1]=3 2688 B16R1.1402 CCCCCCOc1ccc(cc1)S(=O)C 34a_200000064373_100000210314 [1,1,0,0,0,0|1,0,1]=4 2689 B16R1.1402 CCCCCCOc1ccc(cc1)S(=O)C 7a_200000064373_100000210314 [1,1,0,0,0,0|1,0,1]=4 2690 B16R1.1402 CCCCCCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210314 [1,1,0,0,0,0|2,0,0]=4 2691 B16R1.1402 CCCCCCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210314 [1,1,0,0,0,0|2,0,0]=4 2692 B16R1.1402 CCCCCCOc1ccc(nc1)C(=O)C 34a_100012001710_100000210314 [1,1,0,0,0,0|1,0,1]=4 2693 B16R1.1402 CCCCCCOc1ccc(nc1)C(=O)C 7a_100012001710_100000210314 [1,1,0,0,0,0|1,0,1]=4 2694 B16R1.1402 CCCCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210757 [1,1,0,0,0,0|0,0,1]=3 2695 B16R1.1402 CCCCCCSc1ccc(cc1)C(=O)C 62a_100000210314_100000185465 [1,1,0,0,0,0|0,0,1]=3 2696 B16R1.1402 CCCCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210757 [1,1,0,0,0,0|1,0,0]=3 2697 B16R1.1402 CCCCCCSc1ccc(cc1)C(=O)N 62a_100000210314_100000162191 [1,1,0,0,0,0|1,0,0]=3 2698 B16R1.1402 CCCCCCSc1ccc(cc1)S(=O)C 62a_100009816266_100000210757 [1,1,0,0,0,0|1,0,1]=4 2699 B16R1.1402 CCCCCCSc1ccc(cn1)C(=O)C 62a_100000210314_100000684857 [1,1,0,0,0,0|1,0,1]=4 2700 B16R1.1402 CCCCCCSc1ccc(cn1)C(=O)C 62a_100000684857_100000210757 [1,1,0,0,0,0|1,0,1]=4 2701 B16R1.1402 CCCCCCSc1ccc(cn1)C(=O)N 62a_100000162237_100000210757 [1,1,0,0,0,0|2,0,0]=4 2702 B16R1.1402 CCCCCCSc1ccc(cn1)C(=O)N 62a_100000210314_100000162237 [1,1,0,0,0,0|2,0,0]=4 2703 B16R1.1402 CCCCCCSc1ccc(nc1)C(=O)C 62a_100000210314_100000686046 [1,1,0,0,0,0|1,0,1]=4 2704 B16R1.1402 CCCCCCSc1ccc(nc1)C(=O)C 62a_100000686046_100000210757 [1,1,0,0,0,0|1,0,1]=4 2705 B16R1.1402 CCCCCCSc1ccc(nc1)C(=O)N 62a_100000210314_100011219284 [1,1,0,0,0,0|2,0,0]=4 2706 B16R1.1402 CCCCCCSc1ccc(nc1)C(=O)N 62a_100011219284_100000210757 [1,1,0,0,0,0|2,0,0]=4 2707 B16R1.1402 CCCCCNCc1ccc(cc1)C(=O)C 2230a_100000209983_100000756337 [1,1,0,0,0,0|0,0,1]=3 2708 B16R1.1402 CCCCCNCc1ccc(cc1)C(=O)N 207a_100000209983_100000038677 [1,1,0,0,0,0|1,0,0]=3 2709 B16R1.1402 CCCCCNCc1ccc(cc1)C(=O)N 2230a_100000209983_100000231043 [1,1,0,0,0,0|1,0,0]=3 2710 B16R1.1402 CCCCCNCc1ccc(cc1)C(=O)N 270004a_100000209983_100000038677 [1,1,0,0,0,0|1,0,0]=3 2711 B16R1.1402 CCCCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210326 [1,1,0,0,0,0|1,0,0]=3 2712 B16R1.1402 CCCCCNCc1ccc(cc1)[N+](=O)[O-] 207a_100000209983_100000189386 [1,1,0,0,0,0|2,0,0]=4 2713 B16R1.1402 CCCCCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000209983_100000181861 [1,1,0,0,0,0|2,0,0]=4 2714 B16R1.1402 CCCCCNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_100000210326 [1,1,0,0,0,0|2,0,0]=4 2715 B16R1.1402 CCCCCNCc1ccc(cc1)[N+](=O)[O-] 270004a_100000209983_100000189386 [1,1,0,0,0,0|2,0,0]=4 2716 B16R1.1402 CCCCCNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_100000718602 [1,1,0,0,0,0|2,0,0]=4 2717 B16R1.1402 CCCCCNCc1ccc(nc1)C(=O)O 269956a_100000762669_100000210326 [1,1,0,0,0,0|2,0,0]=4 2718 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)C 34a_100000210253_100000756337 [1,1,0,0,0,0|0,0,1]=3 2719 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000210326 [1,1,0,0,0,0|0,0,1]=3 2720 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)C 7a_100000210253_100000756337 [1,1,0,0,0,0|0,0,1]=3 2721 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000718602 [1,1,0,0,0,0|1,0,0]=3 2722 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)N 34a_100000210253_100000231043 [1,1,0,0,0,0|1,0,0]=3 2723 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000210326 [1,1,0,0,0,0|1,0,0]=3 2724 B16R1.1402 CCCCCOCc1ccc(cc1)C(=O)N 7a_100000210253_100000231043 [1,1,0,0,0,0|1,0,0]=3 2725 B16R1.1402 CCCCCOCc1ccc(cc1)[N+](=O)[O-] 34a_100000210253_100000181861 [1,1,0,0,0,0|2,0,0]=4 2726 B16R1.1402 CCCCCOCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_100000718602 [1,1,0,0,0,0|2,0,0]=4 2727 B16R1.1402 CCCCCOCc1ccc(cc1)[N+](=O)[O-] 7a_100000210253_100000181861 [1,1,0,0,0,0|2,0,0]=4 2728 B16R1.1402 CCCCCSCc1ccc(cc1)C(=O)C 62a_100000210326_100000756337 [1,1,0,0,0,0|0,0,1]=3 2729 B16R1.1402 CCCCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000210326 [1,1,0,0,0,0|0,0,1]=3 2730 B16R1.1402 CCCCCSCc1ccc(cc1)C(=O)N 62a_100000210326_100000231043 [1,1,0,0,0,0|1,0,0]=3 2731 B16R1.1402 CCCCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000210326 [1,1,0,0,0,0|1,0,0]=3 2732 B16R1.1402 CCCCCSCc1ccc(cc1)[N+](=O)[O-] 62a_100000210326_100000184243 [1,1,0,0,0,0|2,0,0]=4 2733 B16R1.1402 CCCCNCCc1ccc(cc1)C(=O)C 2230a_100000102301_200000038727 [1,1,0,0,0,0|0,0,1]=3 2734 B16R1.1402 CCCCNCCc1ccc(cc1)C(=O)C 7a_106832991798_200000038727 [1,1,0,0,0,0|0,0,1]=3 2735 B16R1.1402 CCCCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000210211 [1,1,0,0,0,0|1,0,0]=3 2736 B16R1.1402 CCCCNCCc1ccc(cc1)[N+](=O)[O-] 2230a_100000102301_100000736421 [1,1,0,0,0,0|2,0,0]=4 2737 B16R1.1402 CCCCNCCc1ccc(cc1)[N+](=O)[O-] 2230a_100000744123_100000210211 [1,1,0,0,0,0|2,0,0]=4 2738 B16R1.1402 CCCCNCCc1ccc(cc1)[N+](=O)[O-] 34a_100000744123_100000210210 [1,1,0,0,0,0|2,0,0]=4 2739 B16R1.1402 CCCCNCCc1ccc(cc1)[N+](=O)[O-] 7a_106832991798_100000736421 [1,1,0,0,0,0|2,0,0]=4 2740 B16R1.1402 CCCCOCCc1ccc(cc1)C(=O)C 34a_100000210227_200000038727 [1,1,0,0,0,0|0,0,1]=3 2741 B16R1.1402 CCCCOCCc1ccc(cc1)C(=O)C 7a_100000210227_200000038727 [1,1,0,0,0,0|0,0,1]=3 2742 B16R1.1402 CCCCOCCc1ccc(cc1)[N+](=O)[O-] 34a_100000210227_100000736421 [1,1,0,0,0,0|2,0,0]=4 2743 B16R1.1402 CCCCOCCc1ccc(cc1)[N+](=O)[O-] 34a_100000704122_100000210210 [1,1,0,0,0,0|2,0,0]=4 2744 B16R1.1402 CCCCOCCc1ccc(cc1)[N+](=O)[O-] 7a_100000210227_100000736421 [1,1,0,0,0,0|2,0,0]=4 2745 B16R1.1402 CCCCOCCc1ccc(cc1)[N+](=O)[O-] 7a_100000704122_100000210211 [1,1,0,0,0,0|2,0,0]=4 2746 B16R1.1402 CCCCOCNc1ccc(cc1)C(=O)N 34a_100000210537_100011995733 [1,1,0,0,0,0|2,0,0]=4 2747 B16R1.1402 CCCCOCOc1ccc(cc1)C(=O)C 34a_100000185113_100011995733 [1,1,0,0,0,0|1,0,1]=4 2748 B16R1.1402 CCCCOCOc1ccc(cc1)C(=O)N 34a_100000746352_100011995733 [1,1,0,0,0,0|2,0,0]=4 2749 B16R1.1402 CCCCOCSc1ccc(cc1)C(=O)C 62a_100000185465_100011995733 [1,1,0,0,0,0|1,0,1]=4 2750 B16R1.1402 CCCCOCSc1ccc(cc1)C(=O)C 62a_100011995733_100000185465 [1,1,0,0,0,0|1,0,1]=4 2751 B16R1.1402 CCCCOCSc1ccc(cc1)C(=O)N 62a_100000162191_100011995733 [1,1,0,0,0,0|2,0,0]=4 2752 B16R1.1402 CCCCOCSc1ccc(cc1)C(=O)N 62a_100011995733_100000162191 [1,1,0,0,0,0|2,0,0]=4 2753 B16R1.1402 CCCCSCCc1ccc(cc1)C(=O)C 62a_100000210211_200000038727 [1,1,0,0,0,0|0,0,1]=3 2754 B16R1.1402 CCCCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000210210 [1,1,0,0,0,0|0,0,1]=3 2755 B16R1.1402 CCCCSCCc1ccc(cc1)[N+](=O)[O-] 62a_100000210211_100000736421 [1,1,0,0,0,0|2,0,0]=4 2756 B16R1.1402 CCCNCCOc1ccc(cc1)C(=O)O 269956a_100015187144_100000210207 [1,1,0,0,0,0|2,0,0]=4 2757 B16R1.1402 CCCOCCCc1ccc(cc1)[N+](=O)[O-] 34a_100000090596_100000210303 [1,1,0,0,0,0|2,0,0]=4 2758 B16R1.1402 CCCOCCCc1ccc(cc1)[N+](=O)[O-] 34a_100000210258_100010167727 [1,1,0,0,0,0|2,0,0]=4 2759 B16R1.1402 CCCOCCCc1ccc(cc1)[N+](=O)[O-] 7a_100000090596_100000210303 [1,1,0,0,0,0|2,0,0]=4 2760 B16R1.1402 CCCOCCNc1ccc(cc1)C(=O)N 27a_100161115042_100000162191 [1,1,0,0,0,0|2,0,0]=4 2761 B16R1.1402 CCCOCCNc1ccc(cc1)C(=O)N 34a_100000210537_100011215938 [1,1,0,0,0,0|2,0,0]=4 2762 B16R1.1402 CCCOCCOc1ccc(cc1)C(=O)C 34a_100000185113_100011215938 [1,1,0,0,0,0|1,0,1]=4 2763 B16R1.1402 CCCOCCOc1ccc(cc1)C(=O)C 7a_100000185113_100011215938 [1,1,0,0,0,0|1,0,1]=4 2764 B16R1.1402 CCCOCCOc1ccc(cc1)C(=O)N 34a_100000746352_100011215938 [1,1,0,0,0,0|2,0,0]=4 2765 B16R1.1402 CCCOCCOc1ccc(cc1)C(=O)N 7a_100000746352_100011215938 [1,1,0,0,0,0|2,0,0]=4 2766 B16R1.1402 CCCOCCSc1ccc(cc1)C(=O)C 62a_100000185465_100011215938 [1,1,0,0,0,0|1,0,1]=4 2767 B16R1.1402 CCCOCCSc1ccc(cc1)C(=O)C 62a_100011215938_100000185465 [1,1,0,0,0,0|1,0,1]=4 2768 B16R1.1402 CCCOCCSc1ccc(cc1)C(=O)N 62a_100000162191_100011215938 [1,1,0,0,0,0|2,0,0]=4 2769 B16R1.1402 CCCOCCSc1ccc(cc1)C(=O)N 62a_100011215938_100000162191 [1,1,0,0,0,0|2,0,0]=4 2770 B16R1.1402 CCCSCCCc1ccc(cc1)[N+](=O)[O-] 62a_100000210303_100010167727 [1,1,0,0,0,0|2,0,0]=4 2771 B16R1.1402 CCCSCCNc1ccc(cc1)C(=O)N 27a_100020603323_100000162191 [1,1,0,0,0,0|2,0,0]=4 2772 B16R1.1402 CCOCCCCc1ccc(cc1)[N+](=O)[O-] 34a_200000039267_100000210202 [1,1,0,0,0,0|2,0,0]=4 2773 B16R1.1402 CCOCCCCc1ccc(cc1)[N+](=O)[O-] 7a_200000039267_100000210202 [1,1,0,0,0,0|2,0,0]=4 2774 B16R1.1402 CCOCCCNc1ccc(cc1)C(=O)N 27a_100000210961_100000162191 [1,1,0,0,0,0|2,0,0]=4 2775 B16R1.1402 CCOCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100012232248 [1,1,0,0,0,0|2,0,0]=4 2776 B16R1.1402 CCOCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100012232248 [1,1,0,0,0,0|1,0,1]=4 2777 B16R1.1402 CCOCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100012232248 [1,1,0,0,0,0|1,0,1]=4 2778 B16R1.1402 CCOCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100012232248 [1,1,0,0,0,0|2,0,0]=4 2779 B16R1.1402 CCOCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100012232248 [1,1,0,0,0,0|2,0,0]=4 2780 B16R1.1402 CCOCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100012232248 [1,1,0,0,0,0|1,0,1]=4 2781 B16R1.1402 CCOCCCSc1ccc(cc1)C(=O)C 62a_100012232248_100000185465 [1,1,0,0,0,0|1,0,1]=4 2782 B16R1.1402 CCOCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100012232248 [1,1,0,0,0,0|2,0,0]=4 2783 B16R1.1402 CCOCCCSc1ccc(cc1)C(=O)N 62a_100012232248_100000162191 [1,1,0,0,0,0|2,0,0]=4 2784 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)C 2230a_102516460346_100000756337 [1,1,0,0,0,0|1,0,1]=4 2785 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)C 34a_102516460346_100000756337 [1,1,0,0,0,0|1,0,1]=4 2786 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)N 207a_100011200944_100000038677 [1,1,0,0,0,0|2,0,0]=4 2787 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)N 2230a_102516460346_100000231043 [1,1,0,0,0,0|2,0,0]=4 2788 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)N 270004a_102516460346_100000038677 [1,1,0,0,0,0|2,0,0]=4 2789 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)N 34a_102516460346_100000231043 [1,1,0,0,0,0|2,0,0]=4 2790 B16R1.1402 CCOCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210147 [1,1,0,0,0,0|2,0,0]=4 2791 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)C 34a_100000210136_100000756337 [1,1,0,0,0,0|1,0,1]=4 2792 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100011215890 [1,1,0,0,0,0|1,0,1]=4 2793 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)C 7a_100000210136_100000756337 [1,1,0,0,0,0|1,0,1]=4 2794 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000210147 [1,1,0,0,0,0|2,0,0]=4 2795 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)N 34a_100000210136_100000231043 [1,1,0,0,0,0|2,0,0]=4 2796 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100011215890 [1,1,0,0,0,0|2,0,0]=4 2797 B16R1.1402 CCOCCOCc1ccc(cc1)C(=O)N 7a_100000210136_100000231043 [1,1,0,0,0,0|2,0,0]=4 2798 B16R1.1402 CCOCCSCc1ccc(cc1)C(=O)C 62a_100000210147_100000756337 [1,1,0,0,0,0|1,0,1]=4 2799 B16R1.1402 CCOCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100011215890 [1,1,0,0,0,0|1,0,1]=4 2800 B16R1.1402 CCOCCSCc1ccc(cc1)C(=O)N 62a_100000210147_100000231043 [1,1,0,0,0,0|2,0,0]=4 2801 B16R1.1402 CCOCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100011215890 [1,1,0,0,0,0|2,0,0]=4 2802 B16R1.1402 CCOCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000739092 [1,1,0,0,0,0|2,0,0]=4 2803 B16R1.1402 CCOCSCCc1ccc(cc1)C(=O)C 62a_100000739092_200000038727 [1,1,0,0,0,0|1,0,1]=4 2804 B16R1.1402 CCOCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000739092 [1,1,0,0,0,0|1,0,1]=4 2805 B16R1.1402 CCSCCNCc1ccc(cc1)C(=O)C 2230a_100000106463_100000756337 [1,1,0,0,0,0|1,0,1]=4 2806 B16R1.1402 CCSCCNCc1ccc(cc1)C(=O)N 207a_100000106463_100000038677 [1,1,0,0,0,0|2,0,0]=4 2807 B16R1.1402 CCSCCNCc1ccc(cc1)C(=O)N 2230a_100000106463_100000231043 [1,1,0,0,0,0|2,0,0]=4 2808 B16R1.1402 CCSCCNCc1ccc(cc1)C(=O)N 270004a_100000106463_100000038677 [1,1,0,0,0,0|2,0,0]=4 2809 B16R1.1402 CCSCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000757381 [1,1,0,0,0,0|2,0,0]=4 2810 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)C 34a_100000212035_100000756337 [1,1,0,0,0,0|1,0,1]=4 2811 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000757381 [1,1,0,0,0,0|1,0,1]=4 2812 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)C 7a_100000212035_100000756337 [1,1,0,0,0,0|1,0,1]=4 2813 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000757381 [1,1,0,0,0,0|2,0,0]=4 2814 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)N 34a_100000212035_100000231043 [1,1,0,0,0,0|2,0,0]=4 2815 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000757381 [1,1,0,0,0,0|2,0,0]=4 2816 B16R1.1402 CCSCCOCc1ccc(cc1)C(=O)N 7a_100000212035_100000231043 [1,1,0,0,0,0|2,0,0]=4 2817 B16R1.1402 CCSCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000757381 [1,1,0,0,0,0|1,0,1]=4 2818 B16R1.1402 CCSCCSCc1ccc(cc1)C(=O)C 62a_100000757381_100000756337 [1,1,0,0,0,0|1,0,1]=4 2819 B16R1.1402 CCSCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000757381 [1,1,0,0,0,0|2,0,0]=4 2820 B16R1.1402 CCSCCSCc1ccc(cc1)C(=O)N 62a_100000757381_100000231043 [1,1,0,0,0,0|2,0,0]=4 2821 B16R1.1402 CNCCCOCc1ccc(cc1)C(=O)C 34a_100000213112_100000756337 [1,1,0,0,0,0|1,0,1]=4 2822 B16R1.1402 CNCCCOCc1ccc(cc1)C(=O)N 34a_100000213112_100000231043 [1,1,0,0,0,0|2,0,0]=4 2823 B16R1.1402 COCCCCNc1ccc(cc1)C(=O)N 34a_100000210537_100000755781 [1,1,0,0,0,0|2,0,0]=4 2824 B16R1.1402 COCCCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000755781 [1,1,0,0,0,0|1,0,1]=4 2825 B16R1.1402 COCCCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000730899 [1,1,0,0,0,0|1,0,1]=4 2826 B16R1.1402 COCCCCOc1ccc(cc1)C(=O)N 34a_100000746352_100000755781 [1,1,0,0,0,0|2,0,0]=4 2827 B16R1.1402 COCCCCOc1ccc(cc1)C(=O)N 7a_100000746352_100000730899 [1,1,0,0,0,0|2,0,0]=4 2828 B16R1.1402 COCCCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000730899 [1,1,0,0,0,0|1,0,1]=4 2829 B16R1.1402 COCCCCSc1ccc(cc1)C(=O)C 62a_100000730899_100000185465 [1,1,0,0,0,0|1,0,1]=4 2830 B16R1.1402 COCCCCSc1ccc(cc1)C(=O)N 62a_100000162191_100000730899 [1,1,0,0,0,0|2,0,0]=4 2831 B16R1.1402 COCCCCSc1ccc(cc1)C(=O)N 62a_100000730899_100000162191 [1,1,0,0,0,0|2,0,0]=4 2832 B16R1.1402 COCCCNCc1ccc(cc1)C(=O)C 34a_100150723488_100000756337 [1,1,0,0,0,0|1,0,1]=4 2833 B16R1.1402 COCCCNCc1ccc(cc1)C(=O)N 207a_100150723488_100000038677 [1,1,0,0,0,0|2,0,0]=4 2834 B16R1.1402 COCCCNCc1ccc(cc1)C(=O)N 270004a_100150723488_100000038677 [1,1,0,0,0,0|2,0,0]=4 2835 B16R1.1402 COCCCNCc1ccc(cc1)C(=O)N 34a_100150723488_100000231043 [1,1,0,0,0,0|2,0,0]=4 2836 B16R1.1402 COCCCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000740836 [1,1,0,0,0,0|2,0,0]=4 2837 B16R1.1402 COCCCOCc1ccc(cc1)C(=O)C 34a_100000740835_100000756337 [1,1,0,0,0,0|1,0,1]=4 2838 B16R1.1402 COCCCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000740836 [1,1,0,0,0,0|1,0,1]=4 2839 B16R1.1402 COCCCOCc1ccc(cc1)C(=O)N 34a_100000162016_100000740836 [1,1,0,0,0,0|2,0,0]=4 2840 B16R1.1402 COCCCOCc1ccc(cc1)C(=O)N 34a_100000740835_100000231043 [1,1,0,0,0,0|2,0,0]=4 2841 B16R1.1402 COCCCOCc1ccc(cc1)C(=O)N 7a_100000162016_100000740836 [1,1,0,0,0,0|2,0,0]=4 2842 B16R1.1402 COCCCSCc1ccc(cc1)C(=O)C 62a_100000709357_100000756337 [1,1,0,0,0,0|1,0,1]=4 2843 B16R1.1402 COCCCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000709357 [1,1,0,0,0,0|1,0,1]=4 2844 B16R1.1402 COCCCSCc1ccc(cc1)C(=O)N 62a_100000231043_100000709357 [1,1,0,0,0,0|2,0,0]=4 2845 B16R1.1402 COCCCSCc1ccc(cc1)C(=O)N 62a_100000709357_100000231043 [1,1,0,0,0,0|2,0,0]=4 2846 B16R1.1402 COCCNCCc1ccc(cc1)C(=O)C 2230a_100000209980_200000038727 [1,1,0,0,0,0|1,0,1]=4 2847 B16R1.1402 COCCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000233755 [1,1,0,0,0,0|2,0,0]=4 2848 B16R1.1402 COCCOCCc1ccc(cc1)C(=O)C 34a_100000210237_200000038727 [1,1,0,0,0,0|1,0,1]=4 2849 B16R1.1402 COCCSCCc1ccc(cc1)C(=O)C 62a_100000233755_200000038727 [1,1,0,0,0,0|1,0,1]=4 2850 B16R1.1402 COCCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000233755 [1,1,0,0,0,0|1,0,1]=4 2851 B16R1.1402 CSCCCNCc1ccc(cc1)C(=O)C 2230a_100000749238_100000756337 [1,1,0,0,0,0|1,0,1]=4 2852 B16R1.1402 CSCCCNCc1ccc(cc1)C(=O)N 207a_100000749238_100000038677 [1,1,0,0,0,0|2,0,0]=4 2853 B16R1.1402 CSCCCNCc1ccc(cc1)C(=O)N 2230a_100000749238_100000231043 [1,1,0,0,0,0|2,0,0]=4 2854 B16R1.1402 CSCCCNCc1ccc(cc1)C(=O)N 270004a_100000749238_100000038677 [1,1,0,0,0,0|2,0,0]=4 2855 B16R1.1402 CSCCCOCc1ccc(cc1)C(=O)C 34a_100000690336_100000756337 [1,1,0,0,0,0|1,0,1]=4 2856 B16R1.1402 CSCCCOCc1ccc(cc1)C(=O)C 7a_100000690336_100000756337 [1,1,0,0,0,0|1,0,1]=4 2857 B16R1.1402 CSCCCOCc1ccc(cc1)C(=O)N 34a_100000690336_100000231043 [1,1,0,0,0,0|2,0,0]=4 2858 B16R1.1402 CSCCCOCc1ccc(cc1)C(=O)N 7a_100000690336_100000231043 [1,1,0,0,0,0|2,0,0]=4 2859 B16R1.1402 CSCCNCCc1ccc(cc1)C(=O)C 2230a_100020590264_200000038727 [1,1,0,0,0,0|1,0,1]=4 2860 B16R1.1402 CSCCNCCc1ccc(cc1)C(=O)O 269956a_100000704756_100000212216 [1,1,0,0,0,0|2,0,0]=4 2861 B16R1.1402 CSCCOCCc1ccc(cc1)C(=O)C 34a_100000230434_200000038727 [1,1,0,0,0,0|1,0,1]=4 2862 B16R1.1402 CSCCOCCc1ccc(cc1)C(=O)C 7a_100000230434_200000038727 [1,1,0,0,0,0|1,0,1]=4 2863 B16R1.1402 CSCCSCCc1ccc(cc1)C(=O)C 62a_100000212216_200000038727 [1,1,0,0,0,0|1,0,1]=4 2864 B16R1.1402 CSCCSCCc1ccc(cc1)C(=O)C 62a_200000038727_100000751147 [1,1,0,0,0,0|1,0,1]=4 2865 B16R1.1402 NC(=O)c1ccc(cc1)CNCCCCO 207a_100000750430_100000038677 [1,1,0,0,0,0|2,0,0]=4 2866 B16R1.1402 NC(=O)c1ccc(cc1)CNCCCCO 2230a_100000750430_100000231043 [1,1,0,0,0,0|2,0,0]=4 2867 B16R1.1402 NC(=O)c1ccc(cc1)CNCCCCO 270004a_100000750430_100000038677 [1,1,0,0,0,0|2,0,0]=4 2868 B16R1.1402 NC(=O)c1ccc(cc1)CNCCCCO 34a_100000750430_100000231043 [1,1,0,0,0,0|2,0,0]=4 2869 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCBr 34a_100011216708_100000231043 [1,1,0,0,0,0|2,0,0]=4 2870 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCCl 34a_100000210776_100000231043 [1,1,0,0,0,0|2,0,0]=4 2871 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCCl 7a_100000210776_100000231043 [1,1,0,0,0,0|2,0,0]=4 2872 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCF 34a_100000162016_100000729493 [1,1,0,0,0,0|2,0,0]=4 2873 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCF 34a_100011995726_100000231043 [1,1,0,0,0,0|2,0,0]=4 2874 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCF 7a_100000162016_100000729493 [1,1,0,0,0,0|2,0,0]=4 2875 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCF 7a_100011995726_100000231043 [1,1,0,0,0,0|2,0,0]=4 2876 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCI 34a_200012148704_100000231043 [1,1,0,0,0,0|2,0,0]=4 2877 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCO 34a_100000162016_100011216708 [1,1,0,0,0,0|2,0,0]=4 2878 B16R1.1402 NC(=O)c1ccc(cc1)COCCCCO 7a_100000162016_100000210776 [1,1,0,0,0,0|2,0,0]=4 2879 B16R1.1402 NC(=O)c1ccc(cc1)CSCCCCF 62a_100000231043_100000729493 [1,1,0,0,0,0|2,0,0]=4 2880 B16R1.1402 NC(=O)c1ccc(cc1)CSCCCCF 62a_100000729493_100000231043 [1,1,0,0,0,0|2,0,0]=4 2881 B16R1.1402 NC(=O)c1ccc(cc1)CSCCCCO 62a_100000210776_100000231043 [1,1,0,0,0,0|2,0,0]=4 2882 B16R1.1402 NC(=O)c1ccc(cc1)CSCCCCO 62a_100000231043_100000210776 [1,1,0,0,0,0|2,0,0]=4 2883 B16R1.1402 NC(=O)c1ccc(cc1)NCCCCCF 34a_100000210537_100000729378 [1,1,0,0,0,0|2,0,0]=4 2884 B16R1.1402 NC(=O)c1ccc(cc1)NCCCCCO 27a_100000762737_100000162191 [1,1,0,0,0,0|2,0,0]=4 2885 B16R1.1402 NC(=O)c1ccc(cc1)NCCCCCO 34a_100000210537_100000746330 [1,1,0,0,0,0|2,0,0]=4 2886 B16R1.1402 NC(=O)c1ccc(cc1)OCCCCCF 34a_100000746352_100000729378 [1,1,0,0,0,0|2,0,0]=4 2887 B16R1.1402 NC(=O)c1ccc(cc1)OCCCCCF 7a_100000746352_100000729378 [1,1,0,0,0,0|2,0,0]=4 2888 B16R1.1402 NC(=O)c1ccc(cc1)OCCCCCO 34a_100000746352_100000746330 [1,1,0,0,0,0|2,0,0]=4 2889 B16R1.1402 NC(=O)c1ccc(cc1)OCCCCCO 7a_100000746352_100000746330 [1,1,0,0,0,0|2,0,0]=4 2890 B16R1.1402 NC(=O)c1ccc(cc1)SCCCCCF 62a_100000162191_100000729378 [1,1,0,0,0,0|2,0,0]=4 2891 B16R1.1402 NC(=O)c1ccc(cc1)SCCCCCF 62a_100000729378_100000162191 [1,1,0,0,0,0|2,0,0]=4 2892 B16R1.1402 NC(=O)c1ccc(cc1)SCCCCCO 62a_100000162191_100000746330 [1,1,0,0,0,0|2,0,0]=4 2893 B16R1.1402 NC(=O)c1ccc(cc1)SCCCCCO 62a_100000746330_100000162191 [1,1,0,0,0,0|2,0,0]=4 2894 B16R1.1402 NCCCCOCc1ccc(cc1)C(=O)N 34a_100000750430_100000231043 [1,1,0,0,0,0|2,0,0]=4 2895 B16R1.1402 O=C(O)c1ccc(cc1)CCNCCCF 269956a_100000704756_100011934791 [1,1,0,0,0,0|2,0,0]=4 2896 B16R1.1402 O=C(O)c1ccc(cc1)CCNCCCO 269956a_100000704756_100011215043 [1,1,0,0,0,0|2,0,0]=4 2897 B16R1.1402 O=C(O)c1ccc(cc1)CNCCCCF 269956a_100000181780_100000729493 [1,1,0,0,0,0|2,0,0]=4 2898 B16R1.1402 O=C(O)c1ccc(cc1)CNCCCCO 269956a_100000181780_100000210776 [1,1,0,0,0,0|2,0,0]=4 2899 B16R1.1713 C=C(C)c1ccc(cc1)C(=O)CCCCC 1458a_200009908186_100000210326 [1,1,0,0,0,0|1,0,1]=4 2900 B16R1.1713 C=C(C)c1ccc(cc1)C(=O)CCCCC 271570a_100000694244_200011267725 [1,1,0,0,0,0|1,0,1]=4 2901 B16R1.1713 CCCCCC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_100000210326 [1,1,0,0,0,0|1,0,1]=4 2902 B16R1.1713 CCCCCN(C)c1ccc(cc1)C(=O)N 27a_100000223495_100000162191 [1,1,0,0,0,0|2,0,0]=4 2903 B16R1.1713 CCCCN[C@@H](C)c1ccc(cc1)C(=O)O 269956a_100020638929_100000210211 [1,1,0,0,0,0|2,0,0]=4 2904 B16R1.1713 CCCCOC(C)c1ccc(cc1)C(=O)N 7a_200010363529_100000210211 [1,1,0,0,0,0|2,0,0]=4 2905 B16R1.7635 C=C(C)c1ccc(cc1)CN(C)CCCC 26a_100000207549_100009880102 [1,1,0,0,0,0|2,0,0]=4 2906 B16R1.7635 C=C(C)c1ccc(cc1)OC(C)CCCC 34a_100009880102_200011215066 [1,1,0,0,0,0|2,0,0]=4 2907 B16R1.7635 C=C(C)c1ccc(cc1)OC(C)CCCC 7a_100009880102_200011215066 [1,1,0,0,0,0|2,0,0]=4 2908 B16R1.7635 CCCCC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000210183_100000756337 [1,1,0,0,0,0|0,0,2]=4 2909 B16R1.7635 CCCCC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000210183_100000231043 [1,1,0,0,0,0|1,0,1]=4 2910 B16R1.7635 CCCCC(C)Nc1ccc(cc1)C(=O)N 27a_100000126638_100000162191 [1,1,0,0,0,0|2,0,0]=4 2911 B16R1.7635 CCCCC(C)Nc1ccc(cc1)C(=O)N 34a_100000210537_200011215066 [1,1,0,0,0,0|2,0,0]=4 2912 B16R1.7635 CCCCC(C)Oc1ccc(cc1)C(=O)C 34a_100000185113_200011215066 [1,1,0,0,0,0|1,0,1]=4 2913 B16R1.7635 CCCCC(C)Oc1ccc(cc1)C(=O)C 7a_100000185113_200011215066 [1,1,0,0,0,0|1,0,1]=4 2914 B16R1.7635 CCCCC(C)Oc1ccc(cc1)C(=O)N 34a_100000746352_200011215066 [1,1,0,0,0,0|2,0,0]=4 2915 B16R1.7635 CCCCC(C)Oc1ccc(cc1)C(=O)N 7a_100000746352_200011215066 [1,1,0,0,0,0|2,0,0]=4 2916 B16R1.7635 CCCCC(C)Sc1ccc(cc1)C(=O)C 62a_100000185465_200011215066 [1,1,0,0,0,0|1,0,1]=4 2917 B16R1.7635 CCCCC(C)Sc1ccc(cc1)C(=O)C 62a_200011215066_100000185465 [1,1,0,0,0,0|1,0,1]=4 2918 B16R1.7635 CCCCC(C)Sc1ccc(cc1)C(=O)N 62a_100000162191_200011215066 [1,1,0,0,0,0|2,0,0]=4 2919 B16R1.7635 CCCCC(C)Sc1ccc(cc1)C(=O)N 62a_200011215066_100000162191 [1,1,0,0,0,0|2,0,0]=4 2920 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)C 2230a_100000207549_100000756337 [1,1,0,0,0,0|1,0,1]=4 2921 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)C 269982a_100000207549_100000756337 [1,1,0,0,0,0|1,0,1]=4 2922 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)C 26a_100000207549_100000185113 [1,1,0,0,0,0|1,0,1]=4 2923 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)N 2230a_100000207549_100000231043 [1,1,0,0,0,0|2,0,0]=4 2924 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)N 269982a_100000207549_100000231043 [1,1,0,0,0,0|2,0,0]=4 2925 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)N 270004a_100000207549_100000038677 [1,1,0,0,0,0|2,0,0]=4 2926 B16R1.7635 CCCCN(C)Cc1ccc(cc1)C(=O)[O-] 26a_100000207549_100016998105 [1,1,0,0,0,0|2,0,0]=4 2927 B16R1.14 C/C=C/c1ccc(cc1)SCCCC(C)O 62a_100016259036_200000718107 [1,1,0,0,0,0|1,0,1]=4 2928 B16R1.14 C/C=C/c1ccc(cc1)SCCCC(C)O 62a_200000718107_100016259036 [1,1,0,0,0,0|1,0,1]=4 2929 B16R1.14 C=CCc1ccc(cc1)CNCCC(C)C 26a_100000210545_100000078792 [1,1,0,0,0,0|1,0,1]=4 2930 B16R1.14 C=CCc1ccc(cc1)OCCCC(C)C 34a_100000078792_100011214892 [1,1,0,0,0,0|1,0,1]=4 2931 B16R1.14 C=CCc1ccc(cc1)OCCCC(C)C 7a_100000078792_100011214892 [1,1,0,0,0,0|1,0,1]=4 2932 B16R1.14 C=CCc1ccc(cc1)OCCCC(C)O 34a_100000078792_200000718107 [1,1,0,0,0,0|1,0,1]=4 2933 B16R1.14 C=CCc1ccc(cc1)OCCCC(C)O 7a_100000078792_200000718107 [1,1,0,0,0,0|1,0,1]=4 2934 B16R1.14 C=COc1ccc(cc1)SCCCC(C)C 62a_100000704263_100011214892 [1,1,0,0,0,0|2,0,0]=4 2935 B16R1.14 C=COc1ccc(cc1)SCCCC(C)C 62a_100011214892_100000704263 [1,1,0,0,0,0|2,0,0]=4 2936 B16R1.14 C=COc1ccc(cc1)SCCCC(C)O 62a_100000704263_200000718107 [1,1,0,0,0,0|2,0,0]=4 2937 B16R1.14 C=COc1ccc(cc1)SCCCC(C)O 62a_200000718107_100000704263 [1,1,0,0,0,0|2,0,0]=4 2938 B16R1.14 CC(O)CCCSc1ccc(cc1)/C=C/Br 62a_200000718107_200016255901 [1,1,0,0,0,0|2,0,0]=4 2939 B16R1.14 CC(O)CCCSc1ccc(cc1)/C=C/Br 62a_200016255901_200000718107 [1,1,0,0,0,0|2,0,0]=4 2940 B16R1.1226 CCCCCCc1ccc(cc1)NC(=O)C 11a_100000035805_100015343762 [1,1,0,0,0,0|1,0,1]=4 2941 B16R1.1226 CCCCCCc1ccc(cc1)NC(=O)C 1626a_100000035805_100015343762 [1,1,0,0,0,0|1,0,1]=4 2942 B16R1.1226 CCCCCCc1ccc(cc1)NC(=O)C 22a_100000035805_100000070787 [1,1,0,0,0,0|1,0,1]=4 2943 B16R1.1226 CCCCCCc1ccc(cc1)NC(=O)C 527a_100000035805_100103153847 [1,1,0,0,0,0|1,0,1]=4 2944 B16R1.1226 CCCCCOc1ccc(cc1)C=C(C)C 271570a_100102525489_200011214818 [1,1,0,0,0,0|1,0,1]=4 2945 B16R1.1226 CCCCNCc1ccc(cc1)C=C(C)C 271570a_100102525489_100015187156 [1,1,0,0,0,0|1,0,1]=4 2946 B16R1.1228 C=CCNc1ccc(cc1)CCCCCC 2230a_100000035805_100000210623 [1,1,0,0,0,0|0,0,1]=3 2947 B16R1.1228 C=CCNc1ccc(cc1)CCCCCC 34a_100000035805_100015514636 [1,1,0,0,0,0|0,0,1]=3 2948 B16R1.1228 C=CCNc1ccc(cc1)CCCCCC 7a_100000035805_100015514636 [1,1,0,0,0,0|0,0,1]=3 2949 B16R1.1228 C=CCNc1ccc(cc1)OCCCCC 2230a_103437854202_100000210623 [1,1,0,0,0,0|1,0,1]=4 2950 B16R1.1228 C=CCNc1ccc(cc1)OCCCCC 34a_103437854202_100015514636 [1,1,0,0,0,0|1,0,1]=4 2951 B16R1.1228 C=CCOc1ccc(cc1)CCCCCC 34a_100000011238_100015514636 [1,1,0,0,0,0|0,0,1]=3 2952 B16R1.1228 C=CCOc1ccc(cc1)CCCCCC 7a_100000011238_100015514636 [1,1,0,0,0,0|0,0,1]=3 2953 B16R1.1228 C=CCOc1ccc(cc1)CNCCCC 207a_100000102301_100000172049 [1,1,0,0,0,0|1,0,1]=4 2954 B16R1.1228 C=CCOc1ccc(cc1)CNCCCC 270004a_100000102301_100000172049 [1,1,0,0,0,0|1,0,1]=4 2955 B16R1.1228 C=CCOc1ccc(cc1)OCCCCC 34a_100000183632_100015514636 [1,1,0,0,0,0|1,0,1]=4 2956 B16R1.1228 C=CCOc1ccc(cc1)OCCCCC 7a_100000183632_100015514636 [1,1,0,0,0,0|1,0,1]=4 2957 B16R1.1228 C=CCOc1ccc(cc1)SCCCCC 62a_100000172055_100000210326 [1,1,0,0,0,0|1,0,1]=4 2958 B16R1.1228 C=CCOc1ccc(cc1)SCCCCC 62a_100000210326_100000172055 [1,1,0,0,0,0|1,0,1]=4 2959 B16R1.1228 C=CCSc1ccc(cc1)CNCCCC 62a_100000210623_100015187156 [1,1,0,0,0,0|1,0,1]=4 2960 B16R1.1228 C=CCSc1ccc(cc1)CNCCCC 62a_100015187156_100000210623 [1,1,0,0,0,0|1,0,1]=4 2961 B16R1.1228 C=CCSc1ccc(cc1)OCCCCC 62a_100000210623_200011214818 [1,1,0,0,0,0|1,0,1]=4 2962 B16R1.1228 CC=NNc1ccc(cc1)CCCCCC 4a_100020605313_200000210099 [1,1,0,0,0,0|1,0,1]=4 2963 B16R1.1228 CCCCCCc1ccc(cc1)NCC=O 2230a_100000035805_200015260668 [1,1,0,0,0,0|1,0,1]=4 2964 B16R1.1228 CCCCCCc1ccc(cc1)NCC=O 34a_100000035805_200009817547 [1,1,0,0,0,0|1,0,1]=4 2965 B16R1.1228 CCCCCCc1ccc(cc1)NCC=O 7a_100000035805_200015260668 [1,1,0,0,0,0|1,0,1]=4 2966 B16R1.1228 CCCCCCc1ccc(cc1)OCC=O 34a_100000011238_200009817547 [1,1,0,0,0,0|1,0,1]=4 2967 B16R1.1228 CCCCCCc1ccc(cc1)OCC=O 7a_100000011238_200015260668 [1,1,0,0,0,0|1,0,1]=4 2968 B16R1.1228 CCCCCCc1ccc(cc1)SCC=O 62a_100009814338_200015260668 [1,1,0,0,0,0|1,0,1]=4 2969 B16R1.1228 CCCCCCc1ccc(cc1)SCC=O 62a_200015260668_100009814338 [1,1,0,0,0,0|1,0,1]=4 2970 B16R1.1228 CCCCCSc1ccc(cc1)/C=C/C=O 62a_100000210326_100016291818 [1,1,0,0,0,0|1,0,0]=3 2971 B16R1.1228 CCCCCSc1ccc(cc1)/C=C/C=O 62a_100016291818_100000210326 [1,1,0,0,0,0|1,0,0]=3 2972 B16R1.1228 CCCCCSc1ccc(cc1)C=COC 62a_100000210326_100020630460 [1,1,0,0,0,0|1,0,1]=4 2973 B16R1.1228 CCCCCSc1ccc(cc1)C=COC 62a_100020630460_100000210326 [1,1,0,0,0,0|1,0,1]=4 2974 B16R1.1228 CCOCCSc1ccc(cc1)/C=C/C=O 62a_100000210147_100016291818 [1,1,0,0,0,0|2,0,0]=4 2975 B16R1.1228 CCOCCSc1ccc(cc1)/C=C/C=O 62a_100016291818_100011215890 [1,1,0,0,0,0|2,0,0]=4 2976 B16R1.1228 CCSCCSc1ccc(cc1)/C=C/C=O 62a_100000757381_100016291818 [1,1,0,0,0,0|2,0,0]=4 2977 B16R1.1228 CCSCCSc1ccc(cc1)/C=C/C=O 62a_100016291818_100000757381 [1,1,0,0,0,0|2,0,0]=4 2978 B16R1.1228 COCCCSc1ccc(cc1)/C=C/C=O 62a_100000709357_100016291818 [1,1,0,0,0,0|2,0,0]=4 2979 B16R1.1228 COCCCSc1ccc(cc1)/C=C/C=O 62a_100016291818_100000709357 [1,1,0,0,0,0|2,0,0]=4 2980 B16R1.1228 O=C/C=C/c1ccc(cc1)SCCCCF 62a_100000729493_100016291818 [1,1,0,0,0,0|2,0,0]=4 2981 B16R1.1228 O=C/C=C/c1ccc(cc1)SCCCCF 62a_100016291818_100000729493 [1,1,0,0,0,0|2,0,0]=4 2982 B16R1.1228 O=C/C=C/c1ccc(cc1)SCCCCO 62a_100000210776_100016291818 [1,1,0,0,0,0|2,0,0]=4 2983 B16R1.1228 O=C/C=C/c1ccc(cc1)SCCCCO 62a_100016291818_100000210776 [1,1,0,0,0,0|2,0,0]=4 2984 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCCF 62a_100000729378_100016259036 [1,1,0,0,0,0|1,0,1]=4 2985 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCCF 62a_100016259036_100000729378 [1,1,0,0,0,0|1,0,1]=4 2986 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCCO 62a_100000746330_100016259036 [1,1,0,0,0,0|1,0,1]=4 2987 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCCO 62a_100016259036_100000746330 [1,1,0,0,0,0|1,0,1]=4 2988 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCOC 62a_100000730899_100016259036 [1,1,0,0,0,0|1,0,1]=4 2989 B16R1.1405 C/C=C/c1ccc(cc1)SCCCCOC 62a_100016259036_100000730899 [1,1,0,0,0,0|1,0,1]=4 2990 B16R1.1405 C/C=C/c1ccc(cc1)SCCCOCC 62a_100012232248_100016259036 [1,1,0,0,0,0|1,0,1]=4 2991 B16R1.1405 C/C=C/c1ccc(cc1)SCCCOCC 62a_100016259036_100012232248 [1,1,0,0,0,0|1,0,1]=4 2992 B16R1.1405 C/C=C/c1ccc(cc1)SCCOCCC 62a_100011215938_100016259036 [1,1,0,0,0,0|1,0,1]=4 2993 B16R1.1405 C/C=C/c1ccc(cc1)SCCOCCC 62a_100016259036_100011215938 [1,1,0,0,0,0|1,0,1]=4 2994 B16R1.1405 C/C=C/c1ccc(cc1)SCOCCCC 62a_100011995733_100016259036 [1,1,0,0,0,0|1,0,1]=4 2995 B16R1.1405 C/C=C/c1ccc(cc1)SCOCCCC 62a_100016259036_100011995733 [1,1,0,0,0,0|1,0,1]=4 2996 B16R1.1405 C=C=Cc1ccc(cc1)OCCCCCC 271570a_100015277604_100011216197 [1,1,0,0,0,0|0,0,1]=3 2997 B16R1.1405 C=CCc1ccc(cc1)OCCCCCC 34a_100000078792_100000210314 [1,1,0,0,0,0|0,0,1]=3 2998 B16R1.1405 C=CCc1ccc(cc1)OCCCCCC 7a_100000078792_100000210314 [1,1,0,0,0,0|0,0,1]=3 2999 B16R1.1405 C=CCc1ccc(cc1)OCCCCCF 34a_100000078792_100000729378 [1,1,0,0,0,0|1,0,1]=4 3000 B16R1.1405 C=CCc1ccc(cc1)OCCCCCF 7a_100000078792_100000729378 [1,1,0,0,0,0|1,0,1]=4 3001 B16R1.1405 C=CCc1ccc(cc1)OCCCCCO 34a_100000078792_100000746330 [1,1,0,0,0,0|1,0,1]=4 3002 B16R1.1405 C=CCc1ccc(cc1)OCCCCCO 7a_100000078792_100000746330 [1,1,0,0,0,0|1,0,1]=4 3003 B16R1.1405 C=CCc1ccc(cc1)OCCCCOC 34a_100000078792_100000755781 [1,1,0,0,0,0|1,0,1]=4 3004 B16R1.1405 C=CCc1ccc(cc1)OCCCCOC 7a_100000078792_100000730899 [1,1,0,0,0,0|1,0,1]=4 3005 B16R1.1405 C=CCc1ccc(cc1)OCCCOCC 34a_100000078792_100012232248 [1,1,0,0,0,0|1,0,1]=4 3006 B16R1.1405 C=CCc1ccc(cc1)OCCCOCC 7a_100000078792_100012232248 [1,1,0,0,0,0|1,0,1]=4 3007 B16R1.1405 C=CCc1ccc(cc1)OCCOCCC 34a_100000078792_100011215938 [1,1,0,0,0,0|1,0,1]=4 3008 B16R1.1405 C=CCc1ccc(cc1)OCCOCCC 7a_100000078792_100011215938 [1,1,0,0,0,0|1,0,1]=4 3009 B16R1.1405 C=CCc1ccc(cc1)OCOCCCC 34a_100000078792_100011995733 [1,1,0,0,0,0|1,0,1]=4 3010 B16R1.1405 C=COc1ccc(cc1)SCCCCCC 62a_100000210314_100000704263 [1,1,0,0,0,0|1,0,0]=3 3011 B16R1.1405 C=COc1ccc(cc1)SCCCCCC 62a_100000704263_100000210757 [1,1,0,0,0,0|1,0,0]=3 3012 B16R1.1405 C=COc1ccc(cc1)SCCCCCF 62a_100000704263_100000729378 [1,1,0,0,0,0|2,0,0]=4 3013 B16R1.1405 C=COc1ccc(cc1)SCCCCCF 62a_100000729378_100000704263 [1,1,0,0,0,0|2,0,0]=4 3014 B16R1.1405 C=COc1ccc(cc1)SCCCCCO 62a_100000704263_100000746330 [1,1,0,0,0,0|2,0,0]=4 3015 B16R1.1405 C=COc1ccc(cc1)SCCCCCO 62a_100000746330_100000704263 [1,1,0,0,0,0|2,0,0]=4 3016 B16R1.1405 C=COc1ccc(cc1)SCCCCOC 62a_100000704263_100000730899 [1,1,0,0,0,0|2,0,0]=4 3017 B16R1.1405 C=COc1ccc(cc1)SCCCCOC 62a_100000730899_100000704263 [1,1,0,0,0,0|2,0,0]=4 3018 B16R1.1405 C=COc1ccc(cc1)SCCCOCC 62a_100000704263_100012232248 [1,1,0,0,0,0|2,0,0]=4 3019 B16R1.1405 C=COc1ccc(cc1)SCCCOCC 62a_100012232248_100000704263 [1,1,0,0,0,0|2,0,0]=4 3020 B16R1.1405 C=COc1ccc(cc1)SCCOCCC 62a_100000704263_100011215938 [1,1,0,0,0,0|2,0,0]=4 3021 B16R1.1405 C=COc1ccc(cc1)SCCOCCC 62a_100011215938_100000704263 [1,1,0,0,0,0|2,0,0]=4 3022 B16R1.1405 C=COc1ccc(cc1)SCOCCCC 62a_100000704263_100011995733 [1,1,0,0,0,0|2,0,0]=4 3023 B16R1.1405 C=COc1ccc(cc1)SCOCCCC 62a_100011995733_100000704263 [1,1,0,0,0,0|2,0,0]=4 3024 B16R1.1405 CC=Cc1ccc(cc1)OCCCCCC 271570a_100016259895_100011216197 [1,1,0,0,0,0|0,0,1]=3 3025 B16R1.1405 CCCCCCSc1ccc(cc1)CC=O 62a_100000210314_100011361690 [1,1,0,0,0,0|1,0,1]=4 3026 B16R1.1405 CCCCCCSc1ccc(cc1)CC=O 62a_100011361690_100000210757 [1,1,0,0,0,0|1,0,1]=4 3027 B16R1.1405 CCCCOCSc1ccc(cc1)/C=C/Br 62a_100011995733_200016255901 [1,1,0,0,0,0|2,0,0]=4 3028 B16R1.1405 CCCCOCSc1ccc(cc1)/C=C/Br 62a_200016255901_100011995733 [1,1,0,0,0,0|2,0,0]=4 3029 B16R1.1405 CCCOCCSc1ccc(cc1)/C=C/Br 62a_100011215938_200016255901 [1,1,0,0,0,0|2,0,0]=4 3030 B16R1.1405 CCCOCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100011215938 [1,1,0,0,0,0|2,0,0]=4 3031 B16R1.1405 CCOCCCSc1ccc(cc1)/C=C/Br 62a_100012232248_200016255901 [1,1,0,0,0,0|2,0,0]=4 3032 B16R1.1405 CCOCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100012232248 [1,1,0,0,0,0|2,0,0]=4 3033 B16R1.1405 COCCCCSc1ccc(cc1)/C=C/Br 62a_100000730899_200016255901 [1,1,0,0,0,0|2,0,0]=4 3034 B16R1.1405 COCCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000730899 [1,1,0,0,0,0|2,0,0]=4 3035 B16R1.1405 OCCCCCSc1ccc(cc1)/C=C/Br 62a_100000746330_200016255901 [1,1,0,0,0,0|2,0,0]=4 3036 B16R1.1405 OCCCCCSc1ccc(cc1)/C=C/Br 62a_200016255901_100000746330 [1,1,0,0,0,0|2,0,0]=4 3037 B16R1.1712 C=C=Cc1ccc(cc1)C(=O)CCCCC 271570a_100015277604_200011267725 [1,1,0,0,0,0|0,0,2]=4 3038 B16R1.1712 CC=Cc1ccc(cc1)C(=O)CCCCC 271570a_100016259895_200011267725 [1,1,0,0,0,0|0,0,2]=4 3039 B16R1.7115 C=CCc1ccc(cc1)OCC(C)CCC 34a_100000078792_100011216630 [1,1,0,0,0,0|1,0,1]=4 3040 B16R1.7115 C=CCc1ccc(cc1)OCC(C)CCC 7a_100000078792_100011216630 [1,1,0,0,0,0|1,0,1]=4 3041 B16R1.7115 C=COc1ccc(cc1)SCC(C)CCC 62a_100000704263_100011216630 [1,1,0,0,0,0|2,0,0]=4 3042 B16R1.7115 C=COc1ccc(cc1)SCC(C)CCC 62a_100011216630_100000704263 [1,1,0,0,0,0|2,0,0]=4 3043 B16R1.7116 C=CCc1ccc(cc1)CNCC(C)CC 26a_100020588543_100000078792 [1,1,0,0,0,0|1,0,1]=4 3044 B16R1.7638 C=CCc1ccc(cc1)CN(C)CCCC 26a_100000207549_100000078792 [1,1,0,0,0,0|1,0,1]=4 3045 B16R1.7638 C=CCc1ccc(cc1)OC(C)CCCC 34a_100000078792_200011215066 [1,1,0,0,0,0|1,0,1]=4 3046 B16R1.7638 C=CCc1ccc(cc1)OC(C)CCCC 7a_100000078792_200011215066 [1,1,0,0,0,0|1,0,1]=4 3047 B16R1.7638 C=COc1ccc(cc1)SC(C)CCCC 62a_100000704263_200011215066 [1,1,0,0,0,0|2,0,0]=4 3048 B16R1.7638 C=COc1ccc(cc1)SC(C)CCCC 62a_200011215066_100000704263 [1,1,0,0,0,0|2,0,0]=4 3049 B18R1.674 C=C(Br)C(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100009813364 [0,1,0,0,0,1|0,0,0]=2 3050 B18R1.674 C=C(Br)C(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100009813364 [0,1,0,0,0,1|0,0,0]=2 3051 B18R1.674 C=C(Br)C(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100009813364 [0,1,0,0,0,1|1,0,0]=3 3052 B18R1.674 C=C(Br)C(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100009813364 [0,1,0,0,0,1|1,0,0]=3 3053 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100000185857 [0,1,0,0,0,1|0,0,0]=2 3054 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000185857 [0,1,0,0,0,1|0,0,0]=2 3055 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000185857 [0,1,0,0,0,1|0,0,0]=2 3056 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100000185857 [0,1,0,0,0,1|1,0,0]=3 3057 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000185857 [0,1,0,0,0,1|1,0,0]=3 3058 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000185857 [0,1,0,0,0,1|1,0,0]=3 3059 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCC 34a_200000065598_100000718602 [0,1,0,0,0,1|1,0,0]=3 3060 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCF 34a_200000065598_100000729493 [0,1,0,0,0,1|2,0,0]=4 3061 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCCO 34a_200000065598_100011216708 [0,1,0,0,0,1|2,0,0]=4 3062 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCCOC 34a_200000065598_100000740836 [0,1,0,0,0,1|2,0,0]=4 3063 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCOCC 34a_200000065598_100000210147 [0,1,0,0,0,1|2,0,0]=4 3064 B18R1.674 C=C(C)C(=O)Nc1ccc(cc1)OCCSCC 34a_200000065598_100000757381 [0,1,0,0,0,1|2,0,0]=4 3065 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100000039160 [0,1,0,0,0,1|0,0,0]=2 3066 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000039160 [0,1,0,0,0,1|0,0,0]=2 3067 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000039160 [0,1,0,0,0,1|0,0,0]=2 3068 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100000039160 [0,1,0,0,0,1|1,0,0]=3 3069 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000039160 [0,1,0,0,0,1|1,0,0]=3 3070 B18R1.674 C=C(Cl)C(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000039160 [0,1,0,0,0,1|1,0,0]=3 3071 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100000036797 [0,1,0,0,0,1|0,0,0]=2 3072 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000036797 [0,1,0,0,0,1|0,0,0]=2 3073 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000036797 [0,1,0,0,0,1|0,0,0]=2 3074 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100000036797 [0,1,0,0,0,1|1,0,0]=3 3075 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000036797 [0,1,0,0,0,1|1,0,0]=3 3076 B18R1.674 C=C(F)C(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000036797 [0,1,0,0,0,1|1,0,0]=3 3077 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(=O)N 22a_100000035805_100011215815 [0,1,0,0,0,1|1,0,0]=3 3078 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)C 11a_100000035805_100000210198 [0,1,0,0,0,1|0,0,2]=4 3079 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)C 1626a_100000035805_100000210198 [0,1,0,0,0,1|0,0,2]=4 3080 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)C 22a_100000035805_100000210198 [0,1,0,0,0,1|0,0,2]=4 3081 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)C 527a_100000035805_100000210198 [0,1,0,0,0,1|0,0,2]=4 3082 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)F 11a_100000035805_100000062450 [0,1,0,0,0,1|0,0,2]=4 3083 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)F 1626a_100000035805_100000062450 [0,1,0,0,0,1|0,0,2]=4 3084 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)F 22a_100000035805_100000062450 [0,1,0,0,0,1|0,0,2]=4 3085 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(C)F 527a_100000035805_100000062450 [0,1,0,0,0,1|0,0,2]=4 3086 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(F)F 11a_100000035805_100000210393 [0,1,0,0,0,1|1,0,1]=4 3087 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(F)F 1626a_100000035805_100000210393 [0,1,0,0,0,1|1,0,1]=4 3088 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(F)F 22a_100000035805_100000210393 [0,1,0,0,0,1|1,0,1]=4 3089 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(F)F 527a_100000035805_100000210393 [0,1,0,0,0,1|1,0,1]=4 3090 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)C(O)O 22a_100000035805_100000233687 [0,1,0,0,0,1|1,0,1]=4 3091 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)N(C)C 2430a_100000035805_100102631434 [0,1,0,0,0,1|1,0,1]=4 3092 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)[C@@H](C)O 22a_100000035805_100000717761 [0,1,0,0,0,1|0,0,2]=4 3093 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)[C@H](C)O 1626a_100000035805_217856618621 [0,1,0,0,0,1|0,0,2]=4 3094 B18R1.674 CCCCCCc1ccc(cc1)NC(=O)[C@H](C)O 22a_100000035805_217856618621 [0,1,0,0,0,1|0,0,2]=4 3095 B18R1.674 CCCCCOc1ccc(cc1)NC(=O)C(=O)N 22a_103437854202_100011215815 [0,1,0,0,0,1|2,0,0]=4 3096 B18R1.678 CCCCCCc1ccc(cc1)NC(C=O)C=O 2230a_100000035805_100000736813 [0,1,0,0,0,1|1,0,1]=4 3097 B18R1.678 CCCCCCc1ccc(cc1)NC(C=O)C=O 34a_100000035805_100000736813 [0,1,0,0,0,1|1,0,1]=4 3098 B18R1.678 CCCCCCc1ccc(cc1)OC(C=O)C=O 34a_100000011238_100000736813 [0,1,0,0,0,1|1,0,1]=4 3099 B18R1.678 CCCCCCc1ccc(cc1)SC(C=O)C=O 62a_100000736813_100009814338 [0,1,0,0,0,1|1,0,1]=4 3100 B18R1.678 CCCCCCc1ccc(cc1)SC(C=O)C=O 62a_100009814338_100000736813 [0,1,0,0,0,1|1,0,1]=4 3101 B18R1.1052 C=CC(=O)Nc1ccc(cc1)CNCC(C)CC 26a_100020588543_100011235904 [0,1,0,0,0,1|1,0,0]=3 3102 B18R1.1106 C#CCCCCOc1ccc(cc1)NC(=O)C=C 34a_100011235904_100010269958 [0,1,0,0,0,1|0,0,2]=4 3103 B18R1.1106 C=CC(=O)Nc1ccc(cc1)CCCCCCC 1626a_200000032916_100000185746 [0,1,0,0,0,1|0,0,0]=2 3104 B18R1.1106 C=CC(=O)Nc1ccc(cc1)CCCCCCC 22a_200000032916_100000185746 [0,1,0,0,0,1|0,0,0]=2 3105 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCC/C=C\CC 34a_100011235904_100015370543 [0,1,0,0,0,1|0,0,2]=4 3106 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCCC 1626a_100011202612_100000185746 [0,1,0,0,0,1|0,0,0]=2 3107 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCCC 22a_100011202612_100000185746 [0,1,0,0,0,1|0,0,0]=2 3108 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCCC 34a_100011235904_100000210314 [0,1,0,0,0,1|0,0,0]=2 3109 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCCF 34a_100011235904_100000729378 [0,1,0,0,0,1|1,0,0]=3 3110 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCCO 34a_100011235904_100000746330 [0,1,0,0,0,1|1,0,0]=3 3111 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCCOC 34a_100011235904_100000755781 [0,1,0,0,0,1|1,0,0]=3 3112 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCCOCC 34a_100011235904_100012232248 [0,1,0,0,0,1|1,0,0]=3 3113 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCOCCC 34a_100011235904_100011215938 [0,1,0,0,0,1|1,0,0]=3 3114 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCCOCCO 34a_100011235904_100000692535 [0,1,0,0,0,1|2,0,0]=4 3115 B18R1.1106 C=CC(=O)Nc1ccc(cc1)OCOCCCC 34a_100011235904_100011995733 [0,1,0,0,0,1|1,0,0]=3 3116 B18R1.1106 C=CCCCCOc1ccc(cc1)NC(=O)C=C 34a_100011235904_100011215482 [0,1,0,0,0,1|0,0,2]=4 3117 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CC 11a_200000032916_100000210414 [0,1,0,0,0,1|0,0,2]=4 3118 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CC 1626a_200000032916_100000210414 [0,1,0,0,0,1|0,0,2]=4 3119 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CC 22a_200000032916_100000210414 [0,1,0,0,0,1|0,0,2]=4 3120 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CC 527a_200000032916_100000210414 [0,1,0,0,0,1|0,0,2]=4 3121 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CO 22a_200000032916_100000210174 [0,1,0,0,0,1|1,0,1]=4 3122 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)CO 527a_200000032916_100000210174 [0,1,0,0,0,1|1,0,1]=4 3123 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)NC 2430a_200000032916_100102657272 [0,1,0,0,0,1|1,0,1]=4 3124 B18R1.1106 CCCCCCCc1ccc(cc1)NC(=O)NC 512a_200000032916_100102657272 [0,1,0,0,0,1|1,0,1]=4 3125 B18R1.1106 CCCCCCNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000210314 [0,1,0,0,0,1|1,0,1]=4 3126 B18R1.1106 CCCCCCNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000210314 [0,1,0,0,0,1|1,0,1]=4 3127 B18R1.1106 CCCCCCNc1ccc(cc1)NC(=O)CC 34a_100000186511_100000210314 [0,1,0,0,0,1|0,0,2]=4 3128 B18R1.1106 CCCCCCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000210314 [0,1,0,0,0,1|1,0,1]=4 3129 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)CC 1458a_100000314579_100000210202 [0,1,0,0,0,1|0,0,2]=4 3130 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)CF 1458a_100000314579_100015361967 [0,1,0,0,0,1|1,0,1]=4 3131 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NC 11a_106832991635_100000314579 [0,1,0,0,0,1|1,0,1]=4 3132 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000314579 [0,1,0,0,0,1|1,0,1]=4 3133 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000314579 [0,1,0,0,0,1|1,0,1]=4 3134 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NC 34a_200000020795_100000210314 [0,1,0,0,0,1|1,0,1]=4 3135 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NC 527a_100102657272_100000314579 [0,1,0,0,0,1|1,0,1]=4 3136 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)NN 34a_100000020777_100000210314 [0,1,0,0,0,1|2,0,0]=4 3137 B18R1.1106 CCCCCCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000210314 [0,1,0,0,0,1|1,0,1]=4 3138 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 11a_100011202612_100000210414 [0,1,0,0,0,1|0,0,2]=4 3139 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 1626a_100011202612_100000210414 [0,1,0,0,0,1|0,0,2]=4 3140 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 22a_100011202612_100000210414 [0,1,0,0,0,1|0,0,2]=4 3141 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 34a_200000243810_100000210314 [0,1,0,0,0,1|0,0,2]=4 3142 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 527a_100011202612_100000210414 [0,1,0,0,0,1|0,0,2]=4 3143 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CC 7a_200000243810_100000210314 [0,1,0,0,0,1|0,0,2]=4 3144 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000210314 [0,1,0,0,0,1|1,0,1]=4 3145 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CO 22a_100011202612_100000210174 [0,1,0,0,0,1|1,0,1]=4 3146 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)CO 527a_100011202612_100000210174 [0,1,0,0,0,1|1,0,1]=4 3147 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)NC 2430a_100011202612_100102657272 [0,1,0,0,0,1|1,0,1]=4 3148 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)NC 512a_100011202612_100102657272 [0,1,0,0,0,1|1,0,1]=4 3149 B18R1.1106 CCCCCCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000210314 [0,1,0,0,0,1|1,0,1]=4 3150 B18R1.1106 CCCCCCSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000210757 [0,1,0,0,0,1|1,0,1]=4 3151 B18R1.1106 CCCCCCSc1ccc(cc1)CC(=O)NC 62a_100000210314_100000155101 [0,1,0,0,0,1|1,0,1]=4 3152 B18R1.1106 CCCCCCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000210757 [0,1,0,0,0,1|1,0,1]=4 3153 B18R1.1106 CCCCCCSc1ccc(cc1)CC(=O)OC 62a_100000210314_100000149743 [0,1,0,0,0,1|1,0,1]=4 3154 B18R1.1106 CCCCCCSc1ccc(cc1)NC(=O)CN 62a_100000210314_100000741985 [0,1,0,0,0,1|1,0,1]=4 3155 B18R1.1106 CCCCCCSc1ccc(cc1)NC(=O)OC 62a_100000210314_100000181880 [0,1,0,0,0,1|1,0,1]=4 3156 B18R1.1106 CCCCCCSc1ccc(cc1)OC(=O)CC 62a_100000210314_200009811598 [0,1,0,0,0,1|0,0,2]=4 3157 B18R1.1106 CCCCCNCc1ccc(cc1)CC(=O)OC 2230a_100000209983_100009816886 [0,1,0,0,0,1|1,0,1]=4 3158 B18R1.1106 CCCCCNCc1ccc(cc1)CC(=O)OC 270004a_100000209983_100009886798 [0,1,0,0,0,1|1,0,1]=4 3159 B18R1.1106 CCCCCNCc1ccc(cc1)OC(=O)CC 270004a_100000209983_200000014686 [0,1,0,0,0,1|0,0,2]=4 3160 B18R1.1106 CCCCCOCc1ccc(cc1)CC(=O)OC 34a_100000087118_100000718602 [0,1,0,0,0,1|1,0,1]=4 3161 B18R1.1106 CCCCCOCc1ccc(cc1)CC(=O)OC 34a_100000210253_100009816886 [0,1,0,0,0,1|1,0,1]=4 3162 B18R1.1106 CCCCCOCc1ccc(cc1)CC(=O)OC 7a_100000210253_100009816886 [0,1,0,0,0,1|1,0,1]=4 3163 B18R1.1106 CCCCCSCc1ccc(cc1)CC(=O)OC 62a_100000210326_100009816886 [0,1,0,0,0,1|1,0,1]=4 3164 B18R1.1106 CCCCCSCc1ccc(cc1)CC(=O)OC 62a_100009816886_100000210326 [0,1,0,0,0,1|1,0,1]=4 3165 B18R1.4822 C=CC(=O)Nc1ccc(cc1)CNCCC(C)C 26a_100000210545_100011235904 [0,1,0,0,0,1|1,0,0]=3 3166 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCCC(=O)C 34a_100011235904_100000685027 [0,1,0,0,0,1|1,0,1]=4 3167 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCCC(C)C 34a_100011235904_100011214892 [0,1,0,0,0,1|1,0,0]=3 3168 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCCC(C)O 34a_100011235904_200000718107 [0,1,0,0,0,1|1,0,0]=3 3169 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCCN(C)C 22a_100000753343_100000185746 [0,1,0,0,0,1|2,0,0]=4 3170 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCOC(C)C 34a_100011235904_100000211751 [0,1,0,0,0,1|2,0,0]=4 3171 B18R1.4822 C=CC(=O)Nc1ccc(cc1)OCCSC(C)C 34a_100011235904_100000730970 [0,1,0,0,0,1|2,0,0]=4 3172 B18R1.4958 C=CC(=O)Nc1ccc(cc1)CN(C)CCCC 26a_100000207549_100011235904 [0,1,0,0,0,1|1,0,0]=3 3173 B18R1.4958 C=CC(=O)Nc1ccc(cc1)CN(C)CCCO 26a_100000213112_100011235904 [0,1,0,0,0,1|2,0,0]=4 3174 B18R1.4958 C=CC(=O)Nc1ccc(cc1)CN(C)CCOC 26a_100000743101_100011235904 [0,1,0,0,0,1|2,0,0]=4 3175 B18R1.4958 C=CC(=O)Nc1ccc(cc1)CN(C)CCSC 26a_100000686725_100011235904 [0,1,0,0,0,1|2,0,0]=4 3176 B18R1.4958 C=CC(=O)Nc1ccc(cc1)NC(=O)CCCC 1626a_200000189024_100000185746 [0,1,0,0,0,1|1,0,1]=4 3177 B18R1.4958 C=CC(=O)Nc1ccc(cc1)NC(=O)CCCC 22a_200000189024_100000185746 [0,1,0,0,0,1|1,0,1]=4 3178 B18R1.4958 C=CC(=O)Nc1ccc(cc1)OC(C)CCCC 34a_100011235904_200011215066 [0,1,0,0,0,1|1,0,0]=3 3179 B18R1.29525 C=CC(=O)Nc1ccc(cc1)OCC(C)CCC 34a_100011235904_100011216630 [0,1,0,0,0,1|1,0,0]=3 3180 B18R1.29525 C=CC(=O)Nc1ccc(cc1)OCC(O)COC 34a_100011235904_100011215053 [0,1,0,0,0,1|2,0,0]=4 3181 B18R1.35685 C#CCC(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100011220946 [0,1,0,0,0,1|0,0,2]=4 3182 B18R1.35685 C#CCC(=O)Nc1ccc(cc1)CCCCCC 527a_100000035805_100011220946 [0,1,0,0,0,1|0,0,2]=4 3183 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100000210193 [0,1,0,0,0,1|0,0,0]=2 3184 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000210193 [0,1,0,0,0,1|0,0,0]=2 3185 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000210193 [0,1,0,0,0,1|0,0,0]=2 3186 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)CCCCCC 527a_100000035805_100000210193 [0,1,0,0,0,1|0,0,0]=2 3187 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100000210193 [0,1,0,0,0,1|1,0,0]=3 3188 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000210193 [0,1,0,0,0,1|1,0,0]=3 3189 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000210193 [0,1,0,0,0,1|1,0,0]=3 3190 B18R1.35685 C=CCC(=O)Nc1ccc(cc1)OCCCCC 527a_103437854202_100000210193 [0,1,0,0,0,1|1,0,0]=3 3191 B18R1.35685 C=CCN(C)Cc1ccc(cc1)CCCCCC 26a_100000225617_100000011238 [0,1,0,0,0,1|2,0,0]=4 3192 B18R1.35685 CC#CC(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000763181 [0,1,0,0,0,1|0,0,2]=4 3193 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)CCCCCC 11a_100000035805_100000210699 [0,1,0,0,0,1|0,0,0]=2 3194 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)CCCCCC 1626a_100000035805_100000210699 [0,1,0,0,0,1|0,0,0]=2 3195 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)CCCCCC 22a_100000035805_100000210699 [0,1,0,0,0,1|0,0,0]=2 3196 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)OCCCCC 11a_103437854202_100000210699 [0,1,0,0,0,1|1,0,0]=3 3197 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)OCCCCC 1626a_103437854202_100000210699 [0,1,0,0,0,1|1,0,0]=3 3198 B18R1.35685 CC=CC(=O)Nc1ccc(cc1)OCCCCC 22a_103437854202_100000210699 [0,1,0,0,0,1|1,0,0]=3 3199 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)C=CBr 1626a_100000035805_100016273825 [0,1,0,0,0,1|0,0,0]=2 3200 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)C=CCl 11a_100000035805_200016279998 [0,1,0,0,0,1|0,0,0]=2 3201 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)C=CCl 1626a_100000035805_200016279998 [0,1,0,0,0,1|0,0,0]=2 3202 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)C=CI 1626a_100000035805_100016256311 [0,1,0,0,0,1|0,0,0]=2 3203 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CC#N 1626a_100000035805_100051588842 [0,1,0,0,0,1|0,0,2]=4 3204 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CC#N 22a_100000035805_100051588842 [0,1,0,0,0,1|0,0,2]=4 3205 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CCC 11a_100000035805_100000211992 [0,1,0,0,0,1|0,0,2]=4 3206 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CCC 1626a_100000035805_100000211992 [0,1,0,0,0,1|0,0,2]=4 3207 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CCC 22a_100000035805_100000211992 [0,1,0,0,0,1|0,0,2]=4 3208 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CCC 527a_100000035805_100000211992 [0,1,0,0,0,1|0,0,2]=4 3209 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CCO 22a_100000035805_100011216618 [0,1,0,0,0,1|0,0,2]=4 3210 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)COC 11a_100000035805_100000210968 [0,1,0,0,0,1|0,0,2]=4 3211 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)COC 1626a_100000035805_100000210968 [0,1,0,0,0,1|0,0,2]=4 3212 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)COC 22a_100000035805_100000210968 [0,1,0,0,0,1|0,0,2]=4 3213 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)COC 527a_100000035805_100000210968 [0,1,0,0,0,1|0,0,2]=4 3214 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CSC 11a_100000035805_100000184570 [0,1,0,0,0,1|0,0,2]=4 3215 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CSC 1626a_100000035805_100000184570 [0,1,0,0,0,1|0,0,2]=4 3216 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CSC 22a_100000035805_100000184570 [0,1,0,0,0,1|0,0,2]=4 3217 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)CSC 527a_100000035805_100000184570 [0,1,0,0,0,1|0,0,2]=4 3218 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)NCC 2430a_100000035805_100015525214 [0,1,0,0,0,1|0,0,2]=4 3219 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)NCC 512a_100000035805_100015525214 [0,1,0,0,0,1|0,0,2]=4 3220 B18R1.35685 CCCCCCc1ccc(cc1)NC(=O)NNC 512a_100000035805_100016993582 [0,1,0,0,0,1|1,0,1]=4 3221 B18R1.35685 CCCCCOc1ccc(cc1)NC(=O)C=CBr 1626a_103437854202_100016273825 [0,1,0,0,0,1|1,0,0]=3 3222 B18R1.35685 CCCCCOc1ccc(cc1)NC(=O)C=CCl 11a_103437854202_200016279998 [0,1,0,0,0,1|1,0,0]=3 3223 B18R1.35685 CCCCCOc1ccc(cc1)NC(=O)C=CCl 1626a_103437854202_200016279998 [0,1,0,0,0,1|1,0,0]=3 3224 B18R1.35685 CCCCCOc1ccc(cc1)NC(=O)C=CI 1626a_103437854202_100016256311 [0,1,0,0,0,1|1,0,0]=3 3225 B18R1.4125 CCCCCCNc1ccc(c(c1)Cl)C(=O)NC 34a_100000742945_100000210314 [0,2,0,0,0,0|1,0,1]=4 3226 B18R1.4125 CCCCCCNc1ccc(c(c1)Cl)C(=O)NC 7a_100000742945_100000210314 [0,2,0,0,0,0|1,0,1]=4 3227 B18R1.4125 CCCCCCNc1ccc(c(c1)F)C(=O)CC 27a_100000210581_100012360378 [0,2,0,0,0,0|0,0,2]=4 3228 B18R1.4125 CCCCCCNc1ccc(c(c1)F)C(=O)NC 27a_100000210581_100000233932 [0,2,0,0,0,0|1,0,1]=4 3229 B18R1.4125 CCCCCCNc1ccc(c(c1)F)C(=O)NC 34a_100011533607_100000210314 [0,2,0,0,0,0|1,0,1]=4 3230 B18R1.4125 CCCCCCNc1ccc(c(c1)F)C(=O)NC 7a_100011533607_100000210314 [0,2,0,0,0,0|1,0,1]=4 3231 B18R1.4125 CCCCCCNc1ccc(c(c1)O)C(=O)NC 34a_100000223174_100000210314 [0,2,0,0,0,0|1,0,1]=4 3232 B18R1.4125 CCCCCCOc1ccc(c(c1)Br)C(=O)OC 34a_100010150825_100000210314 [0,2,0,0,0,0|1,0,1]=4 3233 B18R1.4125 CCCCCCOc1ccc(c(c1)Br)C(=O)OC 7a_100010150825_100000210314 [0,2,0,0,0,0|1,0,1]=4 3234 B18R1.4125 CCCCCCOc1ccc(c(c1)C)C(=O)OC 34a_100012000157_100000210314 [0,2,0,0,0,0|1,0,1]=4 3235 B18R1.4125 CCCCCCOc1ccc(c(c1)C)C(=O)OC 7a_100012000157_100000210314 [0,2,0,0,0,0|1,0,1]=4 3236 B18R1.4125 CCCCCCOc1ccc(c(c1)Cl)C(=O)OC 34a_100000081488_100000210314 [0,2,0,0,0,0|1,0,1]=4 3237 B18R1.4125 CCCCCCOc1ccc(c(c1)Cl)C(=O)OC 7a_100000081488_100000210314 [0,2,0,0,0,0|1,0,1]=4 3238 B18R1.4125 CCCCCCOc1ccc(c(c1)F)C(=O)OC 34a_100011999631_100000210314 [0,2,0,0,0,0|1,0,1]=4 3239 B18R1.4125 CCCCCCOc1ccc(c(c1)F)C(=O)OC 7a_100011999631_100000210314 [0,2,0,0,0,0|1,0,1]=4 3240 B18R1.4125 CCCCCCOc1ccc(c(c1)N)C(=O)OC 34a_100000701581_100000210314 [0,2,0,0,0,0|1,0,1]=4 3241 B18R1.4125 CCCCCCOc1ccc(c(c1)N)C(=O)OC 7a_100000701581_100000210314 [0,2,0,0,0,0|1,0,1]=4 3242 B18R1.4125 CCCCCCSc1ccc(c(c1)Br)C(=O)OC 62a_100000210314_100010247156 [0,2,0,0,0,0|1,0,1]=4 3243 B18R1.4125 CCCCCCSc1ccc(c(c1)Br)C(=O)OC 62a_100010247156_100000210757 [0,2,0,0,0,0|1,0,1]=4 3244 B18R1.4125 CCCCCCSc1ccc(c(c1)C)C(=O)OC 62a_100000210314_100000747612 [0,2,0,0,0,0|1,0,1]=4 3245 B18R1.4125 CCCCCCSc1ccc(c(c1)C)C(=O)OC 62a_100000747612_100000210757 [0,2,0,0,0,0|1,0,1]=4 3246 B18R1.4125 CCCCCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000060724_100000210757 [0,2,0,0,0,0|1,0,1]=4 3247 B18R1.4125 CCCCCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000210314_100000060724 [0,2,0,0,0,0|1,0,1]=4 3248 B18R1.4125 CCCCCCSc1ccc(c(c1)F)C(=O)NC 62a_100000210314_100000233932 [0,2,0,0,0,0|1,0,1]=4 3249 B18R1.4125 CCCCCCSc1ccc(c(c1)F)C(=O)NC 62a_100000233932_100000210757 [0,2,0,0,0,0|1,0,1]=4 3250 B18R1.4125 CCCCCCSc1ccc(c(c1)F)C(=O)OC 62a_100000210314_100000216654 [0,2,0,0,0,0|1,0,1]=4 3251 B18R1.4125 CCCCCCSc1ccc(c(c1)F)C(=O)OC 62a_100000216654_100000210757 [0,2,0,0,0,0|1,0,1]=4 3252 B18R1.4125 CCCCCCSc1ccc(c(c1)N)C(=O)OC 62a_100011373473_100000210757 [0,2,0,0,0,0|1,0,1]=4 3253 B18R1.4125 CCCCCCSc1ccc(c(c1)O)C(=O)OC 62a_100000210314_100000062286 [0,2,0,0,0,0|1,0,1]=4 3254 B18R1.4125 CCCCCNCc1ccc(c(c1)Br)C(=O)OC 2230a_100000209983_100012340598 [0,2,0,0,0,0|1,0,1]=4 3255 B18R1.4125 CCCCCNCc1ccc(c(c1)C)C(=O)OC 2230a_100000209983_100010991300 [0,2,0,0,0,0|1,0,1]=4 3256 B18R1.4125 CCCCCNCc1ccc(c(c1)C)C(=O)OC 270004a_100000209983_100010370968 [0,2,0,0,0,0|1,0,1]=4 3257 B18R1.4125 CCCCCNCc1ccc(c(c1)Cl)C(=O)OC 2230a_100000209983_100010128985 [0,2,0,0,0,0|1,0,1]=4 3258 B18R1.4125 CCCCCNCc1ccc(c(c1)Cl)C(=O)OC 270004a_100000209983_100010630601 [0,2,0,0,0,0|1,0,1]=4 3259 B18R1.4125 CCCCCNCc1ccc(c(c1)F)C(=O)OC 2230a_100000209983_100000686969 [0,2,0,0,0,0|1,0,1]=4 3260 B18R1.4125 CCCCCNCc1ccc(c(c1)F)C(=O)OC 270004a_100000209983_100012457946 [0,2,0,0,0,0|1,0,1]=4 3261 B18R1.4125 CCCCCOCc1ccc(c(c1)Br)C(=O)OC 34a_100000210253_100012340598 [0,2,0,0,0,0|1,0,1]=4 3262 B18R1.4125 CCCCCOCc1ccc(c(c1)Br)C(=O)OC 7a_100000210253_100012340598 [0,2,0,0,0,0|1,0,1]=4 3263 B18R1.4125 CCCCCOCc1ccc(c(c1)C)C(=O)OC 34a_100000210253_100010991300 [0,2,0,0,0,0|1,0,1]=4 3264 B18R1.4125 CCCCCOCc1ccc(c(c1)C)C(=O)OC 7a_100000210253_100010991300 [0,2,0,0,0,0|1,0,1]=4 3265 B18R1.4125 CCCCCOCc1ccc(c(c1)Cl)C(=O)OC 34a_100000210253_100010128985 [0,2,0,0,0,0|1,0,1]=4 3266 B18R1.4125 CCCCCOCc1ccc(c(c1)Cl)C(=O)OC 7a_100000210253_100010128985 [0,2,0,0,0,0|1,0,1]=4 3267 B18R1.4125 CCCCCOCc1ccc(c(c1)F)C(=O)OC 34a_100000210253_100000686969 [0,2,0,0,0,0|1,0,1]=4 3268 B18R1.4125 CCCCCOCc1ccc(c(c1)F)C(=O)OC 34a_100012183857_100000718602 [0,2,0,0,0,0|1,0,1]=4 3269 B18R1.4125 CCCCCOCc1ccc(c(c1)F)C(=O)OC 7a_100000210253_100000686969 [0,2,0,0,0,0|1,0,1]=4 3270 B18R1.4125 CCCCCOCc1ccc(c(c1)F)C(=O)OC 7a_100012183857_100000210326 [0,2,0,0,0,0|1,0,1]=4 3271 B18R1.4125 CCCCCSCc1ccc(c(c1)Br)C(=O)OC 62a_100000210326_100012340598 [0,2,0,0,0,0|1,0,1]=4 3272 B18R1.4125 CCCCCSCc1ccc(c(c1)Br)C(=O)OC 62a_100012340598_100000210326 [0,2,0,0,0,0|1,0,1]=4 3273 B18R1.4125 CCCCCSCc1ccc(c(c1)C)C(=O)OC 62a_100000210326_100010991300 [0,2,0,0,0,0|1,0,1]=4 3274 B18R1.4125 CCCCCSCc1ccc(c(c1)C)C(=O)OC 62a_100010991300_100000210326 [0,2,0,0,0,0|1,0,1]=4 3275 B18R1.4125 CCCCCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100000210326_100010128985 [0,2,0,0,0,0|1,0,1]=4 3276 B18R1.4125 CCCCCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100010128985_100000210326 [0,2,0,0,0,0|1,0,1]=4 3277 B18R1.4125 CCCCCSCc1ccc(c(c1)F)C(=O)OC 62a_100000210326_100000686969 [0,2,0,0,0,0|1,0,1]=4 3278 B18R1.4125 CCCCCSCc1ccc(c(c1)F)C(=O)OC 62a_100000686969_100000210326 [0,2,0,0,0,0|1,0,1]=4 3279 B18R1.673 C=C(C)CC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000748629 [0,2,0,0,0,0|0,0,0]=2 3280 B18R1.673 C=C(C)CC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100000748629 [0,2,0,0,0,0|1,0,0]=3 3281 B18R1.673 C=C(C)CC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100000748629 [0,2,0,0,0,0|2,0,0]=4 3282 B18R1.673 C=C(C)CC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100000748629 [0,2,0,0,0,0|2,0,0]=4 3283 B18R1.673 C=C(F)CC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100009893438 [0,2,0,0,0,0|0,0,0]=2 3284 B18R1.673 C=C(F)CC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100009893438 [0,2,0,0,0,0|1,0,0]=3 3285 B18R1.673 C=C(F)CC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100009893438 [0,2,0,0,0,0|2,0,0]=4 3286 B18R1.673 C=C(F)CC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100009893438 [0,2,0,0,0,0|2,0,0]=4 3287 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CC(=O)C 1458a_100000070787_100000010291 [0,2,0,0,0,0|0,0,1]=3 3288 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CC(=O)N 1458a_100000032748_100000187820 [0,2,0,0,0,0|0,0,1]=3 3289 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000032748_100020667443 [0,2,0,0,0,0|0,0,1]=3 3290 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CC(C)O 1458a_100000032748_100011218427 [0,2,0,0,0,0|0,0,2]=4 3291 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CC(F)F 1458a_100000032748_100011934356 [0,2,0,0,0,0|0,0,2]=4 3292 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100000010291 [0,2,0,0,0,0|0,0,2]=4 3293 B18R1.673 CCCCCCc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100000010291 [0,2,0,0,0,0|0,0,2]=4 3294 B18R1.673 CCCCCCc1ccc(cc1)C(=O)C[N+](=O)[O-] 1458a_100000032748_100000761209 [0,2,0,0,0,0|1,0,1]=4 3295 B18R1.673 CCCCCCc1ccc(cc1)C(=O)NC(C)C 11a_100138425928_100000032748 [0,2,0,0,0,0|0,0,2]=4 3296 B18R1.673 CCCCCCc1ccc(cc1)C(=O)NC(C)C 1626a_100138425928_100000032748 [0,2,0,0,0,0|0,0,2]=4 3297 B18R1.673 CCCCCCc1ccc(cc1)C(=O)NC(C)C 240690a_100138425928_100000032748 [0,2,0,0,0,0|0,0,2]=4 3298 B18R1.673 CCCCCCc1ccc(cc1)C(=O)NC(C)C 527a_100138425928_100000032748 [0,2,0,0,0,0|0,0,2]=4 3299 B18R1.673 CCCCCOc1ccc(cc1)C(=O)CC(=O)N 1458a_100000186157_100000187820 [0,2,0,0,0,0|1,0,1]=4 3300 B18R1.673 CCCCCOc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000186157_100020667443 [0,2,0,0,0,0|1,0,1]=4 3301 B18R1.673 CCCCCSc1ccc(cc1)C(=O)CC(=O)C 62a_100000184285_100000210326 [0,2,0,0,0,0|1,0,1]=4 3302 B18R1.868 CC(C)CCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100011214892_200020603514 [0,2,0,0,0,0|2,0,0]=4 3303 B18R1.868 CC(C)CCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100011214892 [0,2,0,0,0,0|2,0,0]=4 3304 B18R1.868 CC(O)CCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200000718107_200020603514 [0,2,0,0,0,0|2,0,0]=4 3305 B18R1.868 CC(O)CCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_200000718107 [0,2,0,0,0,0|2,0,0]=4 3306 B18R1.1107 C#CCC(=O)c1ccc(cc1)CCCCCCC 1458a_100000012247_100000184674 [0,2,0,0,0,0|0,0,2]=4 3307 B18R1.1107 C#CCC(=O)c1ccc(cc1)OCCCCCC 1458a_100000182910_100000184674 [0,2,0,0,0,0|0,0,2]=4 3308 B18R1.1107 C=CCC(=O)c1ccc(cc1)CCCCCCC 1458a_100000012247_100000210623 [0,2,0,0,0,0|0,0,0]=2 3309 B18R1.1107 C=CCC(=O)c1ccc(cc1)OCCCCCC 1458a_100000182910_100000210623 [0,2,0,0,0,0|0,0,0]=2 3310 B18R1.1107 C=CCC(O)c1ccc(cc1)SCCCCCC 62a_100000210314_100011466436 [0,2,0,0,0,0|0,0,2]=4 3311 B18R1.1107 C=CCC(O)c1ccc(cc1)SCCCCCC 62a_100011466436_100000210757 [0,2,0,0,0,0|0,0,2]=4 3312 B18R1.1107 CC#CC(=O)c1ccc(cc1)SCCCCCC 62a_100000210314_100153741113 [0,2,0,0,0,0|0,0,2]=4 3313 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)CC#N 1458a_100000012247_100011214920 [0,2,0,0,0,0|0,0,2]=4 3314 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)CCF 1458a_100000012247_100011217306 [0,2,0,0,0,0|0,0,2]=4 3315 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)CCO 1458a_100000012247_100000211926 [0,2,0,0,0,0|0,0,2]=4 3316 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)NCC 11a_100015525214_100000012247 [0,2,0,0,0,0|0,0,2]=4 3317 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000012247 [0,2,0,0,0,0|0,0,2]=4 3318 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)NCC 527a_100015525214_100000012247 [0,2,0,0,0,0|0,0,2]=4 3319 B18R1.1107 CCCCCCCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000012247 [0,2,0,0,0,0|1,0,1]=4 3320 B18R1.1107 CCCCCCNc1ccc(cc1)C(=O)NCC 2230a_100000741011_100000210314 [0,2,0,0,0,0|0,0,2]=4 3321 B18R1.1107 CCCCCCNc1ccc(cc1)C(=O)NCC 27a_100000210581_100000155177 [0,2,0,0,0,0|0,0,2]=4 3322 B18R1.1107 CCCCCCNc1ccc(cc1)C(=O)NCC 34a_100000741011_100000210314 [0,2,0,0,0,0|0,0,2]=4 3323 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CC#N 1458a_100000182910_100011214920 [0,2,0,0,0,0|0,0,2]=4 3324 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CC#N 7a_100009871544_100000210314 [0,2,0,0,0,0|0,0,2]=4 3325 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCC 1458a_100000182910_100000210303 [0,2,0,0,0,0|0,0,2]=4 3326 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCC 34a_100011216482_100000210314 [0,2,0,0,0,0|0,0,2]=4 3327 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCC 7a_100011216482_100000210314 [0,2,0,0,0,0|0,0,2]=4 3328 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCCl 7a_100009879949_100000210314 [0,2,0,0,0,0|0,0,2]=4 3329 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCF 1458a_100000182910_100011217306 [0,2,0,0,0,0|0,0,2]=4 3330 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)CCO 1458a_100000182910_100000211926 [0,2,0,0,0,0|0,0,2]=4 3331 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)COC 34a_200009861119_100000210314 [0,2,0,0,0,0|0,0,2]=4 3332 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)COC 7a_200009861119_100000210314 [0,2,0,0,0,0|0,0,2]=4 3333 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)NCC 11a_100015525214_100000182910 [0,2,0,0,0,0|0,0,2]=4 3334 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)NCC 240690a_100015525214_100000182910 [0,2,0,0,0,0|0,0,2]=4 3335 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)NCC 527a_100015525214_100000182910 [0,2,0,0,0,0|0,0,2]=4 3336 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)NNC 22a_100016993582_100000182910 [0,2,0,0,0,0|1,0,1]=4 3337 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)OCC 34a_100000169885_100000210314 [0,2,0,0,0,0|0,0,2]=4 3338 B18R1.1107 CCCCCCOc1ccc(cc1)C(=O)OCC 7a_100000169885_100000210314 [0,2,0,0,0,0|0,0,2]=4 3339 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)CC#N 62a_100000210314_100000740217 [0,2,0,0,0,0|0,0,2]=4 3340 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)CC#N 62a_100000740217_100000210757 [0,2,0,0,0,0|0,0,2]=4 3341 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)COC 62a_200011343064_100000210757 [0,2,0,0,0,0|0,0,2]=4 3342 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)NCC 62a_100000155177_100000210757 [0,2,0,0,0,0|0,0,2]=4 3343 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)NCC 62a_100000210314_100000155177 [0,2,0,0,0,0|0,0,2]=4 3344 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)OCC 62a_100000169895_100000210757 [0,2,0,0,0,0|0,0,2]=4 3345 B18R1.1107 CCCCCCSc1ccc(cc1)C(=O)OCC 62a_100000210314_100000169919 [0,2,0,0,0,0|0,0,2]=4 3346 B18R1.1107 CCCCCNCc1ccc(cc1)C(=O)NCC 2230a_100000209983_100011266492 [0,2,0,0,0,0|0,0,2]=4 3347 B18R1.1107 CCCCCNCc1ccc(cc1)C(=O)OCC 2230a_100000209983_100009812261 [0,2,0,0,0,0|0,0,2]=4 3348 B18R1.1107 CCCCCNCc1ccc(cc1)C(=O)OCC 270004a_100000209983_100000170165 [0,2,0,0,0,0|0,0,2]=4 3349 B18R1.1107 CCCCCOCc1ccc(cc1)C(=O)NCC 34a_100000210253_100011266492 [0,2,0,0,0,0|0,0,2]=4 3350 B18R1.1107 CCCCCOCc1ccc(cc1)C(=O)NCC 7a_100000210253_100011266492 [0,2,0,0,0,0|0,0,2]=4 3351 B18R1.1107 CCCCCOCc1ccc(cc1)C(=O)OCC 34a_100000210253_100009812261 [0,2,0,0,0,0|0,0,2]=4 3352 B18R1.1107 CCCCCOCc1ccc(cc1)C(=O)OCC 7a_100000210253_100009812261 [0,2,0,0,0,0|0,0,2]=4 3353 B18R1.1107 CCCCCSCc1ccc(cc1)C(=O)NCC 62a_100000210326_100011266492 [0,2,0,0,0,0|0,0,2]=4 3354 B18R1.1107 CCCCCSCc1ccc(cc1)C(=O)NCC 62a_100011266492_100000210326 [0,2,0,0,0,0|0,0,2]=4 3355 B18R1.1107 CCCCCSCc1ccc(cc1)C(=O)OCC 62a_100000210326_100009812261 [0,2,0,0,0,0|0,0,2]=4 3356 B18R1.1107 CCCCCSCc1ccc(cc1)C(=O)OCC 62a_100009812261_100000210326 [0,2,0,0,0,0|0,0,2]=4 3357 B18R1.1107 CCCCOCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100011995733_200020603514 [0,2,0,0,0,0|2,0,0]=4 3358 B18R1.1107 CCCCOCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100011995733 [0,2,0,0,0,0|2,0,0]=4 3359 B18R1.1107 CCCOCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100011215938_200020603514 [0,2,0,0,0,0|2,0,0]=4 3360 B18R1.1107 CCCOCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100011215938 [0,2,0,0,0,0|2,0,0]=4 3361 B18R1.1107 CCOCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100012232248_200020603514 [0,2,0,0,0,0|2,0,0]=4 3362 B18R1.1107 CCOCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100012232248 [0,2,0,0,0,0|2,0,0]=4 3363 B18R1.1107 COCCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100000730899_200020603514 [0,2,0,0,0,0|2,0,0]=4 3364 B18R1.1107 COCCCCSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100000730899 [0,2,0,0,0,0|2,0,0]=4 3365 B18R1.1107 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCCF 62a_100000729378_200020603514 [0,2,0,0,0,0|2,0,0]=4 3366 B18R1.1107 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCCF 62a_200020603514_100000729378 [0,2,0,0,0,0|2,0,0]=4 3367 B18R1.1107 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCCO 62a_100000746330_200020603514 [0,2,0,0,0,0|2,0,0]=4 3368 B18R1.1107 O=C/C=C(/Cl)\c1ccc(cc1)SCCCCCO 62a_200020603514_100000746330 [0,2,0,0,0,0|2,0,0]=4 3369 B18R1.4959 C=CCC(=O)c1ccc(cc1)NC(=O)CCCC 1458a_100000244124_100000210623 [0,2,0,0,0,0|1,0,1]=4 3370 B18R1.24275 CCCC(C)CSc1ccc(cc1)/C(=C\C=O)/Cl 62a_100011216630_200020603514 [0,2,0,0,0,0|2,0,0]=4 3371 B18R1.24275 CCCC(C)CSc1ccc(cc1)/C(=C\C=O)/Cl 62a_200020603514_100011216630 [0,2,0,0,0,0|2,0,0]=4 3372 B18R1.35695 C#CCCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000753159 [0,2,0,0,0,0|0,0,2]=4 3373 B18R1.35695 C#CCNC(=O)c1ccc(cc1)CCCCCC 11a_100000212058_100000032748 [0,2,0,0,0,0|0,0,2]=4 3374 B18R1.35695 C#CCNC(=O)c1ccc(cc1)CCCCCC 1626a_100000212058_100000032748 [0,2,0,0,0,0|0,0,2]=4 3375 B18R1.35695 C#CCNC(=O)c1ccc(cc1)CCCCCC 240690a_100000212058_100000032748 [0,2,0,0,0,0|0,0,2]=4 3376 B18R1.35695 C#CCNC(=O)c1ccc(cc1)CCCCCC 527a_100000212058_100000032748 [0,2,0,0,0,0|0,0,2]=4 3377 B18R1.35695 C/C=C/CC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100102629194 [0,2,0,0,0,0|0,0,0]=2 3378 B18R1.35695 C/C=C/CC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100102629194 [0,2,0,0,0,0|1,0,0]=3 3379 B18R1.35695 C/C=C/CC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100102629194 [0,2,0,0,0,0|2,0,0]=4 3380 B18R1.35695 C/C=C/CC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100102629194 [0,2,0,0,0,0|2,0,0]=4 3381 B18R1.35695 C=CCCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000754431 [0,2,0,0,0,0|0,0,0]=2 3382 B18R1.35695 C=CCCC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100000754431 [0,2,0,0,0,0|1,0,0]=3 3383 B18R1.35695 C=CCCC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100000754431 [0,2,0,0,0,0|2,0,0]=4 3384 B18R1.35695 C=CCCC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100000754431 [0,2,0,0,0,0|2,0,0]=4 3385 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCCF 62a_100000729493_200012050250 [0,2,0,0,0,0|2,0,0]=4 3386 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCCF 62a_200012050250_100000729493 [0,2,0,0,0,0|2,0,0]=4 3387 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCCO 62a_100000210776_200012050250 [0,2,0,0,0,0|2,0,0]=4 3388 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCCO 62a_200012050250_100000210776 [0,2,0,0,0,0|2,0,0]=4 3389 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCOC 62a_100000709357_200012050250 [0,2,0,0,0,0|2,0,0]=4 3390 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCCOC 62a_200012050250_100000709357 [0,2,0,0,0,0|2,0,0]=4 3391 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCOCC 62a_100000210147_200012050250 [0,2,0,0,0,0|2,0,0]=4 3392 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCOCC 62a_200012050250_100011215890 [0,2,0,0,0,0|2,0,0]=4 3393 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCSCC 62a_100000757381_200012050250 [0,2,0,0,0,0|2,0,0]=4 3394 B18R1.35695 C=CCCC(=O)c1ccc(cc1)SCCSCC 62a_200012050250_100000757381 [0,2,0,0,0,0|2,0,0]=4 3395 B18R1.35695 C=CCNC(=O)c1ccc(cc1)CCCCCC 1626a_100020586998_100000032748 [0,2,0,0,0,0|0,0,0]=2 3396 B18R1.35695 C=CCNC(=O)c1ccc(cc1)CCCCCC 240690a_100020586998_100000032748 [0,2,0,0,0,0|0,0,0]=2 3397 B18R1.35695 C=CCNC(=O)c1ccc(cc1)CCCCCC 527a_100020586998_100000032748 [0,2,0,0,0,0|0,0,0]=2 3398 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCC 2230a_100000742746_100000210326 [0,2,0,0,0,0|1,0,0]=3 3399 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCC 34a_100000742746_100000718602 [0,2,0,0,0,0|1,0,0]=3 3400 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCF 2230a_100000742746_100000729493 [0,2,0,0,0,0|2,0,0]=4 3401 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCF 34a_100000742746_100000729493 [0,2,0,0,0,0|2,0,0]=4 3402 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCO 2230a_100000742746_100000210776 [0,2,0,0,0,0|2,0,0]=4 3403 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCCO 34a_100000742746_100011216708 [0,2,0,0,0,0|2,0,0]=4 3404 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCOC 2230a_100000742746_100000740836 [0,2,0,0,0,0|2,0,0]=4 3405 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCCOC 34a_100000742746_100000740836 [0,2,0,0,0,0|2,0,0]=4 3406 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCOCC 2230a_100000742746_100011215890 [0,2,0,0,0,0|2,0,0]=4 3407 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCOCC 34a_100000742746_100000210147 [0,2,0,0,0,0|2,0,0]=4 3408 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCSCC 2230a_100000742746_100000757381 [0,2,0,0,0,0|2,0,0]=4 3409 B18R1.35695 C=CCNC(=O)c1ccc(cc1)NCCSCC 34a_100000742746_100000757381 [0,2,0,0,0,0|2,0,0]=4 3410 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCCC 1626a_100020586998_100000186157 [0,2,0,0,0,0|1,0,0]=3 3411 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCCC 240690a_100020586998_100000186157 [0,2,0,0,0,0|1,0,0]=3 3412 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCCC 527a_100020586998_100000186157 [0,2,0,0,0,0|1,0,0]=3 3413 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCOC 1626a_100020586998_100000684957 [0,2,0,0,0,0|2,0,0]=4 3414 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCOC 240690a_100020586998_100000684957 [0,2,0,0,0,0|2,0,0]=4 3415 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCCOC 527a_100020586998_100000684957 [0,2,0,0,0,0|2,0,0]=4 3416 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCOCC 1626a_100020586998_200000217202 [0,2,0,0,0,0|2,0,0]=4 3417 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCOCC 240690a_100020586998_200000217202 [0,2,0,0,0,0|2,0,0]=4 3418 B18R1.35695 C=CCNC(=O)c1ccc(cc1)OCCOCC 527a_100020586998_200000217202 [0,2,0,0,0,0|2,0,0]=4 3419 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCCCC 7a_200000006381_100000210326 [0,2,0,0,0,0|1,0,0]=3 3420 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCCCF 7a_200000006381_100000729493 [0,2,0,0,0,0|2,0,0]=4 3421 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCCCO 7a_200000006381_100000210776 [0,2,0,0,0,0|2,0,0]=4 3422 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCCOC 7a_200000006381_100000740836 [0,2,0,0,0,0|2,0,0]=4 3423 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCOCC 7a_200000006381_100011215890 [0,2,0,0,0,0|2,0,0]=4 3424 B18R1.35695 C=CCOC(=O)c1ccc(cc1)OCCSCC 7a_200000006381_100000757381 [0,2,0,0,0,0|2,0,0]=4 3425 B18R1.35695 CC#CCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000748600 [0,2,0,0,0,0|0,0,2]=4 3426 B18R1.35695 CC=CCC(=O)c1ccc(cc1)CCCCCC 1458a_100000032748_100000070051 [0,2,0,0,0,0|0,0,0]=2 3427 B18R1.35695 CC=CCC(=O)c1ccc(cc1)OCCCCC 1458a_100000186157_100000070051 [0,2,0,0,0,0|1,0,0]=3 3428 B18R1.35695 CC=CCC(=O)c1ccc(cc1)OCCCOC 1458a_100000684957_100000070051 [0,2,0,0,0,0|2,0,0]=4 3429 B18R1.35695 CC=CCC(=O)c1ccc(cc1)OCCOCC 1458a_200000217202_100000070051 [0,2,0,0,0,0|2,0,0]=4 3430 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CCC#N 1458a_100000032748_100011215226 [0,2,0,0,0,0|0,0,2]=4 3431 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CCCF 1458a_100000032748_100011934791 [0,2,0,0,0,0|0,0,2]=4 3432 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CCCO 1458a_100000032748_100011215043 [0,2,0,0,0,0|0,0,2]=4 3433 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CCOC 1458a_100000032748_100000233755 [0,2,0,0,0,0|0,0,2]=4 3434 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CCSC 1458a_100000032748_100000751147 [0,2,0,0,0,0|0,0,2]=4 3435 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CNCC 2230a_100015525214_100000010291 [0,2,0,0,0,0|0,0,2]=4 3436 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)COCC 34a_100121572206_100000010291 [0,2,0,0,0,0|0,0,2]=4 3437 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CSCC 62a_100000010291_100000210202 [0,2,0,0,0,0|0,0,2]=4 3438 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CSCC 62a_100000210202_100000010291 [0,2,0,0,0,0|0,0,2]=4 3439 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CSCF 62a_100000010291_100015361967 [0,2,0,0,0,0|0,0,2]=4 3440 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)CSCF 62a_100015361967_100000010291 [0,2,0,0,0,0|0,0,2]=4 3441 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCC#N 1626a_100000734998_100000032748 [0,2,0,0,0,0|0,0,2]=4 3442 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCC#N 527a_100000734998_100000032748 [0,2,0,0,0,0|0,0,2]=4 3443 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCC 11a_100020643023_100000032748 [0,2,0,0,0,0|0,0,2]=4 3444 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCC 1626a_100020643023_100000032748 [0,2,0,0,0,0|0,0,2]=4 3445 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCC 240690a_100020643023_100000032748 [0,2,0,0,0,0|0,0,2]=4 3446 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCC 527a_100020643023_100000032748 [0,2,0,0,0,0|0,0,2]=4 3447 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCF 11a_100000724931_100000032748 [0,2,0,0,0,0|0,0,2]=4 3448 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCF 1626a_100000724931_100000032748 [0,2,0,0,0,0|0,0,2]=4 3449 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCF 240690a_100000724931_100000032748 [0,2,0,0,0,0|0,0,2]=4 3450 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCF 527a_100000724931_100000032748 [0,2,0,0,0,0|0,0,2]=4 3451 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCO 240690a_100000210304_100000032748 [0,2,0,0,0,0|0,0,2]=4 3452 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NCCO 527a_100000210304_100000032748 [0,2,0,0,0,0|0,0,2]=4 3453 B18R1.35695 CCCCCCc1ccc(cc1)C(=O)NNCC 22a_100000756455_100000032748 [0,2,0,0,0,0|0,0,2]=4 3454 B18R1.883 CCCC(C)CSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100011216630 [0,2,0,0,0,0|2,0,0]=4 3455 B18R1.1378 CCCCC(=O)CCc1ccc(cc1)C(=O)OC 1458a_100000070832_100000210211 [0,2,0,0,0,0|1,0,1]=4 3456 B18R1.1378 CCCCC(=O)CCc1ccc(cc1)C(=O)OC 1458a_100000210183_100010192280 [0,2,0,0,0,0|1,0,1]=4 3457 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 207a_100000126638_100000043907 [0,2,0,0,0,0|1,0,1]=4 3458 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 2230a_100000126638_100000753832 [0,2,0,0,0,0|1,0,1]=4 3459 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 2230a_100000743749_200011215066 [0,2,0,0,0,0|1,0,1]=4 3460 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 270004a_100000126638_100000043907 [0,2,0,0,0,0|1,0,1]=4 3461 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 270004a_100000743749_100000210087 [0,2,0,0,0,0|1,0,1]=4 3462 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)NC 34a_100000743749_200011215066 [0,2,0,0,0,0|1,0,1]=4 3463 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)OC 2230a_100000126638_100000735637 [0,2,0,0,0,0|1,0,1]=4 3464 B18R1.1378 CCCCC(C)NCc1ccc(cc1)C(=O)OC 270004a_100000126638_100000148700 [0,2,0,0,0,0|1,0,1]=4 3465 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)NC 34a_100000687866_100000753832 [0,2,0,0,0,0|1,0,1]=4 3466 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)NC 7a_100000687866_100000753832 [0,2,0,0,0,0|1,0,1]=4 3467 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)OC 34a_100000151488_200011215066 [0,2,0,0,0,0|1,0,1]=4 3468 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)OC 34a_100000687866_100000735637 [0,2,0,0,0,0|1,0,1]=4 3469 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)OC 7a_100000151488_200011215066 [0,2,0,0,0,0|1,0,1]=4 3470 B18R1.1378 CCCCC(C)OCc1ccc(cc1)C(=O)OC 7a_100000687866_100000735637 [0,2,0,0,0,0|1,0,1]=4 3471 B18R1.1378 CCCCC(C)SCc1ccc(cc1)C(=O)NC 62a_100000753832_200011215066 [0,2,0,0,0,0|1,0,1]=4 3472 B18R1.1378 CCCCC(C)SCc1ccc(cc1)C(=O)NC 62a_200011215066_100000753832 [0,2,0,0,0,0|1,0,1]=4 3473 B18R1.1378 CCCCC(C)SCc1ccc(cc1)C(=O)OC 62a_100000735637_200011215066 [0,2,0,0,0,0|1,0,1]=4 3474 B18R1.1378 CCCCC(C)SCc1ccc(cc1)C(=O)OC 62a_200011215066_100000187170 [0,2,0,0,0,0|1,0,1]=4 3475 B18R1.1378 CCCCN(C)CCc1ccc(cc1)C(=O)OC 2230a_100000207549_100010192280 [0,2,0,0,0,0|1,0,1]=4 3476 B18R1.1378 CCCCN(C)CCc1ccc(cc1)C(=O)OC 269982a_100000207549_100010192280 [0,2,0,0,0,0|1,0,1]=4 3477 B18R1.1486 CCCC(=O)CCCc1ccc(cc1)C(=O)OC 1458a_100000211992_100010192279 [0,2,0,0,0,0|1,0,1]=4 3478 B18R1.1486 CCCC(C)CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100011216630 [0,2,0,0,0,0|1,0,1]=4 3479 B18R1.1486 CCCC(C)CNCc1ccc(cc1)C(=O)NC 270004a_100000743749_100000243154 [0,2,0,0,0,0|1,0,1]=4 3480 B18R1.1486 CCCC(C)CNCc1ccc(cc1)C(=O)NC 34a_100000743749_100011216630 [0,2,0,0,0,0|1,0,1]=4 3481 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)NC 34a_100000688023_100000753832 [0,2,0,0,0,0|1,0,1]=4 3482 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)NC 7a_100000688023_100000753832 [0,2,0,0,0,0|1,0,1]=4 3483 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)OC 34a_100000151488_100011216630 [0,2,0,0,0,0|1,0,1]=4 3484 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)OC 34a_100000688023_100000735637 [0,2,0,0,0,0|1,0,1]=4 3485 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)OC 7a_100000151488_100011216630 [0,2,0,0,0,0|1,0,1]=4 3486 B18R1.1486 CCCC(C)COCc1ccc(cc1)C(=O)OC 7a_100000688023_100000735637 [0,2,0,0,0,0|1,0,1]=4 3487 B18R1.1486 CCCC(C)CSCc1ccc(cc1)C(=O)NC 62a_100000753832_100011216630 [0,2,0,0,0,0|1,0,1]=4 3488 B18R1.1486 CCCC(C)CSCc1ccc(cc1)C(=O)NC 62a_100011216630_100000753832 [0,2,0,0,0,0|1,0,1]=4 3489 B18R1.1486 CCCC(C)CSCc1ccc(cc1)C(=O)OC 62a_100000735637_100011216630 [0,2,0,0,0,0|1,0,1]=4 3490 B18R1.1486 CCCC(C)CSCc1ccc(cc1)C(=O)OC 62a_100011216630_100000187170 [0,2,0,0,0,0|1,0,1]=4 3491 B18R1.1486 CCCC(C)NCCc1ccc(cc1)C(=O)OC 2230a_100000741246_100010192280 [0,2,0,0,0,0|1,0,1]=4 3492 B18R1.1486 CCCC(C)OCCc1ccc(cc1)C(=O)OC 34a_100000764384_100010192280 [0,2,0,0,0,0|1,0,1]=4 3493 B18R1.1486 CCCC(C)OCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000766640 [0,2,0,0,0,0|1,0,1]=4 3494 B18R1.1486 CCCC(C)OCCc1ccc(cc1)C(=O)OC 7a_100000764384_100010192280 [0,2,0,0,0,0|1,0,1]=4 3495 B18R1.1486 CCCC(C)OCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000766640 [0,2,0,0,0,0|1,0,1]=4 3496 B18R1.1486 CCCC(C)SCCc1ccc(cc1)C(=O)OC 62a_100000766640_100010192280 [0,2,0,0,0,0|1,0,1]=4 3497 B18R1.1486 CCCC(C)SCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000766640 [0,2,0,0,0,0|1,0,1]=4 3498 B18R1.1486 CCCN(C)CCCc1ccc(cc1)C(=O)OC 2230a_100000747261_100010192279 [0,2,0,0,0,0|1,0,1]=4 3499 B18R1.1486 CCCN(C)CCCc1ccc(cc1)C(=O)OC 269982a_100000747261_100010192279 [0,2,0,0,0,0|1,0,1]=4 3500 B18R1.1486 CCC[C@H](N)COCc1ccc(cc1)C(=O)NC 34a_100000732646_100000753832 [0,2,0,0,0,0|1,0,1]=4 3501 B18R1.1486 CCC[C@H](N)COCc1ccc(cc1)C(=O)OC 34a_100000732646_100000735637 [0,2,0,0,0,0|1,0,1]=4 3502 B18R1.1062 CC(C)CCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_100011261404 [0,2,0,0,0,0|2,0,0]=4 3503 B18R1.1062 CC(C)CCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100011261404_100000725942 [0,2,0,0,0,0|2,0,0]=4 3504 B18R1.1197 CCC(C)CCNCc1ccc(cc1)C(=O)NC 207a_100020591266_100000043907 [0,2,0,0,0,0|1,0,1]=4 3505 B18R1.1197 CCC(C)CCNCc1ccc(cc1)C(=O)NC 2230a_100020591266_100000753832 [0,2,0,0,0,0|1,0,1]=4 3506 B18R1.1197 CCC(C)CCNCc1ccc(cc1)C(=O)NC 270004a_100020591266_100000043907 [0,2,0,0,0,0|1,0,1]=4 3507 B18R1.1197 CCC(C)CCNCc1ccc(cc1)C(=O)OC 2230a_100020591266_100000735637 [0,2,0,0,0,0|1,0,1]=4 3508 B18R1.1197 CCC(C)CCNCc1ccc(cc1)C(=O)OC 270004a_100020591266_100000148700 [0,2,0,0,0,0|1,0,1]=4 3509 B18R1.1197 CCC(C)CCOCc1ccc(cc1)C(=O)NC 7a_100011215188_100000753832 [0,2,0,0,0,0|1,0,1]=4 3510 B18R1.1197 CCC(C)CCOCc1ccc(cc1)C(=O)OC 7a_100011215188_100000735637 [0,2,0,0,0,0|1,0,1]=4 3511 B18R1.1197 CCC(C)CNCCc1ccc(cc1)C(=O)OC 2230a_100020588543_100010192280 [0,2,0,0,0,0|1,0,1]=4 3512 B18R1.1197 CCC(C)COCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000748023 [0,2,0,0,0,0|1,0,1]=4 3513 B18R1.1197 CCC(C)COCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000748023 [0,2,0,0,0,0|1,0,1]=4 3514 B18R1.1197 CCC(C)CSCCc1ccc(cc1)C(=O)OC 62a_100000748023_100010192280 [0,2,0,0,0,0|1,0,1]=4 3515 B18R1.1197 CCC(C)CSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000748023 [0,2,0,0,0,0|1,0,1]=4 3516 B18R1.1197 CCC(C)NCCCc1ccc(cc1)C(=O)OC 2230a_100000209981_100010192279 [0,2,0,0,0,0|1,0,1]=4 3517 B18R1.1197 CCC(C)OCCCc1ccc(cc1)C(=O)OC 7a_100000210228_100010192279 [0,2,0,0,0,0|1,0,1]=4 3518 B18R1.1197 CCC(C)SCCCc1ccc(cc1)C(=O)OC 62a_100000758301_100010192279 [0,2,0,0,0,0|1,0,1]=4 3519 B18R1.1197 CCC(C)SCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000758301 [0,2,0,0,0,0|1,0,1]=4 3520 B18R1.1197 CCC(O)CNCCc1ccc(cc1)C(=O)OC 2230a_100011218483_100010192280 [0,2,0,0,0,0|1,0,1]=4 3521 B18R1.1197 CCC(O)COCCc1ccc(cc1)C(=O)OC 34a_100010779965_100011218378 [0,2,0,0,0,0|1,0,1]=4 3522 B18R1.1197 CCC(O)COCCc1ccc(cc1)C(=O)OC 7a_100010779965_100011218378 [0,2,0,0,0,0|1,0,1]=4 3523 B18R1.1197 CCC(O)CSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100011218378 [0,2,0,0,0,0|1,0,1]=4 3524 B18R1.1197 CCC(O)CSCCc1ccc(cc1)C(=O)OC 62a_100011218378_100010192280 [0,2,0,0,0,0|1,0,1]=4 3525 B18R1.1197 CCN(C)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100015186262 [0,2,0,0,0,0|2,0,0]=4 3526 B18R1.1197 CC[C@H](C)COCCc1ccc(cc1)C(=O)OC 34a_100010779965_100009816398 [0,2,0,0,0,0|1,0,1]=4 3527 B18R1.1197 CC[C@H](C)COCCc1ccc(cc1)C(=O)OC 7a_100009816381_100010192280 [0,2,0,0,0,0|1,0,1]=4 3528 B18R1.1197 CC[C@H](C)COCCc1ccc(cc1)C(=O)OC 7a_100010779965_100009816398 [0,2,0,0,0,0|1,0,1]=4 3529 B18R1.1197 CC[C@H](C)CSCCc1ccc(cc1)C(=O)OC 62a_100009816398_100010192280 [0,2,0,0,0,0|1,0,1]=4 3530 B18R1.1197 CC[C@H](C)CSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100009816398 [0,2,0,0,0,0|1,0,1]=4 3531 B18R1.10612 CC(C)CCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100011214892 [0,2,0,0,0,0|2,0,0]=4 3532 B18R1.10612 CC(O)CCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200000718107 [0,2,0,0,0,0|2,0,0]=4 3533 B18R1.33532 CC(C)(O)CCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100009888830 [0,2,0,0,0,0|2,0,0]=4 3534 B18R1.33532 CC(C)(O)CCCSc1ccc(cc1)C(=O)C=O 62a_100009888830_100000725942 [0,2,0,0,0,0|2,0,0]=4 3535 B18R1.1283 CCCCCC=Cc1ccc(cc1)C(=O)C(=O)N 271570a_100000062253_200009822167 [0,2,0,0,0,0|1,0,1]=4 3536 B18R1.1283 CCCCCCCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000012247 [0,2,0,0,0,0|1,0,1]=4 3537 B18R1.1283 CCCCCCCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000012247 [0,2,0,0,0,0|1,0,1]=4 3538 B18R1.1283 CCCCCCCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000012247 [0,2,0,0,0,0|1,0,1]=4 3539 B18R1.1283 CCCCCCCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000012247 [0,2,0,0,0,0|1,0,1]=4 3540 B18R1.1283 CCCCCCNc1ccc(cc1)C(=O)C(C)C 27a_100000210581_100011220430 [0,2,0,0,0,0|0,0,2]=4 3541 B18R1.1283 CCCCCCNc1ccc(cc1)C(=O)N(C)C 27a_100000210581_100000159574 [0,2,0,0,0,0|1,0,1]=4 3542 B18R1.1283 CCCCCCNc1ccc(cc1)C(=O)N(C)C 34a_100000184784_100000210314 [0,2,0,0,0,0|1,0,1]=4 3543 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_100000210314 [0,2,0,0,0,0|0,0,2]=4 3544 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_100000210314 [0,2,0,0,0,0|0,0,2]=4 3545 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)C(C)C 1458a_100000182910_100000210206 [0,2,0,0,0,0|0,0,2]=4 3546 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)C(C)C 34a_100011995950_100000210314 [0,2,0,0,0,0|0,0,2]=4 3547 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)C(C)C 7a_100011995950_100000210314 [0,2,0,0,0,0|0,0,2]=4 3548 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000182910 [0,2,0,0,0,0|1,0,1]=4 3549 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000182910 [0,2,0,0,0,0|1,0,1]=4 3550 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000182910 [0,2,0,0,0,0|1,0,1]=4 3551 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 34a_100000192105_100000210314 [0,2,0,0,0,0|1,0,1]=4 3552 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000182910 [0,2,0,0,0,0|1,0,1]=4 3553 B18R1.1283 CCCCCCOc1ccc(cc1)C(=O)N(C)C 7a_100000192105_100000210314 [0,2,0,0,0,0|1,0,1]=4 3554 B18R1.1283 CCCCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000210757 [0,2,0,0,0,0|1,0,0]=3 3555 B18R1.1283 CCCCCCSc1ccc(cc1)C(=O)C(O)O 62a_100000210314_200009815832 [0,2,0,0,0,0|1,0,1]=4 3556 B18R1.1283 CCCCCCSc1ccc(cc1)C(=O)C(O)O 62a_200009815832_100000210757 [0,2,0,0,0,0|1,0,1]=4 3557 B18R1.1283 CCCCCCSc1ccc(cc1)C(=O)N(C)C 62a_100000159574_100000210757 [0,2,0,0,0,0|1,0,1]=4 3558 B18R1.1283 CCCCCCSc1ccc(cc1)C(=O)N(C)C 62a_100000210314_100000159574 [0,2,0,0,0,0|1,0,1]=4 3559 B18R1.1283 CCCCCNCc1ccc(cc1)C(=O)N(C)C 207a_100000209983_100000050693 [0,2,0,0,0,0|1,0,1]=4 3560 B18R1.1283 CCCCCNCc1ccc(cc1)C(=O)N(C)C 2230a_100000209983_100000230106 [0,2,0,0,0,0|1,0,1]=4 3561 B18R1.1283 CCCCCNCc1ccc(cc1)C(=O)N(C)C 2230a_100000246156_100000210326 [0,2,0,0,0,0|1,0,1]=4 3562 B18R1.1283 CCCCCNCc1ccc(cc1)C(=O)N(C)C 270004a_100000209983_100000050693 [0,2,0,0,0,0|1,0,1]=4 3563 B18R1.1283 CCCCCNCc1ccc(cc1)C(=O)N(C)C 34a_100000246156_100000718602 [0,2,0,0,0,0|1,0,1]=4 3564 B18R1.1283 CCCCCOCc1ccc(cc1)C(=O)N(C)C 34a_100000159455_100000718602 [0,2,0,0,0,0|1,0,1]=4 3565 B18R1.1283 CCCCCOCc1ccc(cc1)C(=O)N(C)C 34a_100000210253_100000230106 [0,2,0,0,0,0|1,0,1]=4 3566 B18R1.1283 CCCCCOCc1ccc(cc1)C(=O)N(C)C 7a_100000159455_100000210326 [0,2,0,0,0,0|1,0,1]=4 3567 B18R1.1283 CCCCCOCc1ccc(cc1)C(=O)N(C)C 7a_100000210253_100000230106 [0,2,0,0,0,0|1,0,1]=4 3568 B18R1.1283 CCCCCSCc1ccc(cc1)C(=O)N(C)C 62a_100000210326_100000230106 [0,2,0,0,0,0|1,0,1]=4 3569 B18R1.1283 CCCCCSCc1ccc(cc1)C(=O)N(C)C 62a_100000230106_100000210326 [0,2,0,0,0,0|1,0,1]=4 3570 B18R1.1283 CCCCOCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100011995733 [0,2,0,0,0,0|2,0,0]=4 3571 B18R1.1283 CCCOCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100011215938 [0,2,0,0,0,0|2,0,0]=4 3572 B18R1.1283 CCOCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100012232248 [0,2,0,0,0,0|2,0,0]=4 3573 B18R1.1283 COCCCCSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_100000730899 [0,2,0,0,0,0|2,0,0]=4 3574 B18R1.1283 NC(=O)C(=O)c1ccc(cc1)SCCCCCF 62a_200009822167_100000729378 [0,2,0,0,0,0|2,0,0]=4 3575 B18R1.1283 NC(=O)C(=O)c1ccc(cc1)SCCCCCO 62a_200009822167_100000746330 [0,2,0,0,0,0|2,0,0]=4 3576 B18R1.10640 CCCCC(C)Sc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200011215066 [0,2,0,0,0,0|2,0,0]=4 3577 B18R1.21911 CCCCCCc1ccc(cc1)C(=O)C(F)(F)F 1458a_100000032748_200000243211 [0,2,0,0,0,0|1,0,1]=4 3578 B18R1.21912 C=C(Br)S(=O)(=O)c1ccc(cc1)SCCCCC 62a_200009814305_100000210326 [0,2,0,0,0,0|2,0,0]=4 3579 B18R1.322 C#CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100012094781 [0,2,0,0,0,0|1,0,1]=4 3580 B18R1.322 C#CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100012094781_100000725942 [0,2,0,0,0,0|1,0,1]=4 3581 B18R1.322 C=CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000700193_100000725942 [0,2,0,0,0,0|1,0,1]=4 3582 B18R1.322 C=CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000700193 [0,2,0,0,0,0|1,0,1]=4 3583 B18R1.322 CCC(=O)c1ccc(cc1)OCCCCCCF 34a_100000212119_100015922095 [0,2,0,0,0,0|0,0,2]=4 3584 B18R1.322 CCC(=O)c1ccc(cc1)OCCCCCCF 7a_100000212119_100015922095 [0,2,0,0,0,0|0,0,2]=4 3585 B18R1.322 CCC(=O)c1ccc(cc1)OCCCCCCO 1458a_100006003884_100000210202 [0,2,0,0,0,0|0,0,2]=4 3586 B18R1.322 CCC(=O)c1ccc(cc1)OCCCCCCO 34a_100000212119_100000766143 [0,2,0,0,0,0|0,0,2]=4 3587 B18R1.322 CCC(=O)c1ccc(cc1)OCCCCCCO 7a_100000212119_100000766143 [0,2,0,0,0,0|0,0,2]=4 3588 B18R1.322 CCC(=O)c1ccc(cc1)SCCCCCCF 62a_100000211647_100015922095 [0,2,0,0,0,0|0,0,2]=4 3589 B18R1.322 CCC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000211647 [0,2,0,0,0,0|0,0,2]=4 3590 B18R1.322 CCC(=O)c1ccc(cc1)SCCCCCCO 62a_100000211647_100000766143 [0,2,0,0,0,0|0,0,2]=4 3591 B18R1.322 CCC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000211647 [0,2,0,0,0,0|0,0,2]=4 3592 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)C#N 271570a_200015348155_100009994572 [0,2,0,0,0,0|1,0,1]=4 3593 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)C=O 271570a_200015348155_100000725942 [0,2,0,0,0,0|1,0,0]=3 3594 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)CN 271570a_200015348155_100000017248 [0,2,0,0,0,0|1,0,1]=4 3595 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)CO 271570a_200015348155_100011219529 [0,2,0,0,0,0|1,0,1]=4 3596 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)NC 271570a_200015348155_100000155074 [0,2,0,0,0,0|1,0,1]=4 3597 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)NN 271570a_200015348155_100000183614 [0,2,0,0,0,0|2,0,0]=4 3598 B18R1.322 CCCCCCC=Cc1ccc(cc1)C(=O)OC 271570a_200015348155_100000150774 [0,2,0,0,0,0|1,0,1]=4 3599 B18R1.322 CCCCCCCCc1ccc(cc1)C(=O)CF 1458a_100000093814_100015361967 [0,2,0,0,0,0|1,0,1]=4 3600 B18R1.322 CCCCCCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000093814 [0,2,0,0,0,0|1,0,1]=4 3601 B18R1.322 CCCCCCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000093814 [0,2,0,0,0,0|1,0,1]=4 3602 B18R1.322 CCCCCCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000093814 [0,2,0,0,0,0|1,0,1]=4 3603 B18R1.322 CCCCCCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000093814 [0,2,0,0,0,0|1,0,1]=4 3604 B18R1.322 CCCCCCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210681 [0,2,0,0,0,0|1,0,1]=4 3605 B18R1.322 CCCCCCCNc1ccc(cc1)C(=O)NC 27a_100000229938_100000155074 [0,2,0,0,0,0|1,0,1]=4 3606 B18R1.322 CCCCCCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210614 [0,2,0,0,0,0|1,0,1]=4 3607 B18R1.322 CCCCCCCNc1ccc(cc1)C(=O)NN 27a_100000229938_100000183614 [0,2,0,0,0,0|2,0,0]=4 3608 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000210614 [0,2,0,0,0,0|1,0,1]=4 3609 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CC 1458a_100000261473_100000210202 [0,2,0,0,0,0|0,0,2]=4 3610 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210614 [0,2,0,0,0,0|0,0,2]=4 3611 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210614 [0,2,0,0,0,0|0,0,2]=4 3612 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000210614 [0,2,0,0,0,0|1,0,1]=4 3613 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CF 1458a_100000261473_100015361967 [0,2,0,0,0,0|1,0,1]=4 3614 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000210614 [0,2,0,0,0,0|1,0,1]=4 3615 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000210614 [0,2,0,0,0,0|1,0,1]=4 3616 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000261473 [0,2,0,0,0,0|1,0,1]=4 3617 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000261473 [0,2,0,0,0,0|1,0,1]=4 3618 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000261473 [0,2,0,0,0,0|1,0,1]=4 3619 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210614 [0,2,0,0,0,0|1,0,1]=4 3620 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000261473 [0,2,0,0,0,0|1,0,1]=4 3621 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210614 [0,2,0,0,0,0|1,0,1]=4 3622 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000210614 [0,2,0,0,0,0|2,0,0]=4 3623 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210614 [0,2,0,0,0,0|1,0,1]=4 3624 B18R1.322 CCCCCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210614 [0,2,0,0,0,0|1,0,1]=4 3625 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)C#N 62a_100000210614_100009994572 [0,2,0,0,0,0|1,0,1]=4 3626 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000210614_100000725942 [0,2,0,0,0,0|1,0,0]=3 3627 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000210316 [0,2,0,0,0,0|1,0,0]=3 3628 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000210316 [0,2,0,0,0,0|1,0,1]=4 3629 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)CN 62a_100000210614_100000017248 [0,2,0,0,0,0|1,0,1]=4 3630 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)CO 62a_100000210614_100011219529 [0,2,0,0,0,0|1,0,1]=4 3631 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000210316 [0,2,0,0,0,0|1,0,1]=4 3632 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210316 [0,2,0,0,0,0|1,0,1]=4 3633 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)NC 62a_100000210614_100000155074 [0,2,0,0,0,0|1,0,1]=4 3634 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000210316 [0,2,0,0,0,0|2,0,0]=4 3635 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)NN 62a_100000210614_100000183614 [0,2,0,0,0,0|2,0,0]=4 3636 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210316 [0,2,0,0,0,0|1,0,1]=4 3637 B18R1.322 CCCCCCCSc1ccc(cc1)C(=O)OC 62a_100000210614_100000150774 [0,2,0,0,0,0|1,0,1]=4 3638 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)NC 207a_100000210581_100000043907 [0,2,0,0,0,0|1,0,1]=4 3639 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)NC 2230a_100000210581_100000753832 [0,2,0,0,0,0|1,0,1]=4 3640 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000210314 [0,2,0,0,0,0|1,0,1]=4 3641 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)NC 270004a_100000210581_100000043907 [0,2,0,0,0,0|1,0,1]=4 3642 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000210314 [0,2,0,0,0,0|1,0,1]=4 3643 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)OC 2230a_100000210581_100000735637 [0,2,0,0,0,0|1,0,1]=4 3644 B18R1.322 CCCCCCNCc1ccc(cc1)C(=O)OC 270004a_100000210581_100000148700 [0,2,0,0,0,0|1,0,1]=4 3645 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)NC 34a_100000210259_100000753832 [0,2,0,0,0,0|1,0,1]=4 3646 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)NC 7a_100000210259_100000753832 [0,2,0,0,0,0|1,0,1]=4 3647 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210314 [0,2,0,0,0,0|1,0,1]=4 3648 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)OC 34a_100000210259_100000735637 [0,2,0,0,0,0|1,0,1]=4 3649 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210314 [0,2,0,0,0,0|1,0,1]=4 3650 B18R1.322 CCCCCCOCc1ccc(cc1)C(=O)OC 7a_100000210259_100000735637 [0,2,0,0,0,0|1,0,1]=4 3651 B18R1.322 CCCCCCSCc1ccc(cc1)C(=O)NC 62a_100000210314_100000753832 [0,2,0,0,0,0|1,0,1]=4 3652 B18R1.322 CCCCCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000210757 [0,2,0,0,0,0|1,0,1]=4 3653 B18R1.322 CCCCCCSCc1ccc(cc1)C(=O)OC 62a_100000210314_100000187170 [0,2,0,0,0,0|1,0,1]=4 3654 B18R1.322 CCCCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210757 [0,2,0,0,0,0|1,0,1]=4 3655 B18R1.322 CCCCCNCCc1ccc(cc1)C(=O)OC 2230a_100000209983_100010192280 [0,2,0,0,0,0|1,0,1]=4 3656 B18R1.322 CCCCCOCCc1ccc(cc1)C(=O)OC 34a_100000210253_100010192280 [0,2,0,0,0,0|1,0,1]=4 3657 B18R1.322 CCCCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000718602 [0,2,0,0,0,0|1,0,1]=4 3658 B18R1.322 CCCCCOCCc1ccc(cc1)C(=O)OC 7a_100000210253_100010192280 [0,2,0,0,0,0|1,0,1]=4 3659 B18R1.322 CCCCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000210326 [0,2,0,0,0,0|1,0,1]=4 3660 B18R1.322 CCCCCSCCc1ccc(cc1)C(=O)OC 62a_100000210326_100010192280 [0,2,0,0,0,0|1,0,1]=4 3661 B18R1.322 CCCCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000210326 [0,2,0,0,0,0|1,0,1]=4 3662 B18R1.322 CCCCNCCCc1ccc(cc1)C(=O)OC 2230a_100000102301_100010192279 [0,2,0,0,0,0|1,0,1]=4 3663 B18R1.322 CCCCNCCCc1ccc(cc1)C(=O)OC 7a_106832991798_100010192279 [0,2,0,0,0,0|1,0,1]=4 3664 B18R1.322 CCCCNCCOc1ccc(cc1)C(=O)OC 2230a_100000102301_100000742590 [0,2,0,0,0,0|1,0,1]=4 3665 B18R1.322 CCCCNCCOc1ccc(cc1)C(=O)OC 7a_106832991798_100000742590 [0,2,0,0,0,0|1,0,1]=4 3666 B18R1.322 CCCCOCCCc1ccc(cc1)C(=O)OC 34a_100000210227_100010192279 [0,2,0,0,0,0|1,0,1]=4 3667 B18R1.322 CCCCOCCCc1ccc(cc1)C(=O)OC 7a_100000210227_100010192279 [0,2,0,0,0,0|1,0,1]=4 3668 B18R1.322 CCCCOCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000743108 [0,2,0,0,0,0|1,0,1]=4 3669 B18R1.322 CCCCOCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000743108 [0,2,0,0,0,0|1,0,1]=4 3670 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100000743108 [0,2,0,0,0,0|1,0,1]=4 3671 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000743108 [0,2,0,0,0,0|0,0,2]=4 3672 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000743108 [0,2,0,0,0,0|0,0,2]=4 3673 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100000743108 [0,2,0,0,0,0|1,0,1]=4 3674 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100000743108 [0,2,0,0,0,0|1,0,1]=4 3675 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100000743108 [0,2,0,0,0,0|1,0,1]=4 3676 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000743108 [0,2,0,0,0,0|1,0,1]=4 3677 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000743108 [0,2,0,0,0,0|1,0,1]=4 3678 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100000743108 [0,2,0,0,0,0|2,0,0]=4 3679 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000743108 [0,2,0,0,0,0|1,0,1]=4 3680 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 34a_100000210227_100000742590 [0,2,0,0,0,0|1,0,1]=4 3681 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 34a_100011216607_100000210210 [0,2,0,0,0,0|1,0,1]=4 3682 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000743108 [0,2,0,0,0,0|1,0,1]=4 3683 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 7a_100000210227_100000742590 [0,2,0,0,0,0|1,0,1]=4 3684 B18R1.322 CCCCOCCOc1ccc(cc1)C(=O)OC 7a_100011216607_100000210211 [0,2,0,0,0,0|1,0,1]=4 3685 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)C#N 62a_100000743108_100009994572 [0,2,0,0,0,0|1,0,1]=4 3686 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000743108 [0,2,0,0,0,0|1,0,0]=3 3687 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)C=O 62a_100000743108_100000725942 [0,2,0,0,0,0|1,0,0]=3 3688 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000743108 [0,2,0,0,0,0|0,0,2]=4 3689 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CC 62a_100000743108_100000211647 [0,2,0,0,0,0|0,0,2]=4 3690 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100000743108 [0,2,0,0,0,0|1,0,1]=4 3691 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CN 62a_100000743108_100000017248 [0,2,0,0,0,0|1,0,1]=4 3692 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CO 62a_100000743108_100011219529 [0,2,0,0,0,0|1,0,1]=4 3693 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100000743108 [0,2,0,0,0,0|1,0,1]=4 3694 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000743108 [0,2,0,0,0,0|1,0,1]=4 3695 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)NC 62a_100000743108_100000155074 [0,2,0,0,0,0|1,0,1]=4 3696 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100000743108 [0,2,0,0,0,0|2,0,0]=4 3697 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)NN 62a_100000743108_100000183614 [0,2,0,0,0,0|2,0,0]=4 3698 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000743108 [0,2,0,0,0,0|1,0,1]=4 3699 B18R1.322 CCCCOCCSc1ccc(cc1)C(=O)OC 62a_100000743108_100000150774 [0,2,0,0,0,0|1,0,1]=4 3700 B18R1.322 CCCCOCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100011995733 [0,2,0,0,0,0|1,0,1]=4 3701 B18R1.322 CCCCOCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100011995733 [0,2,0,0,0,0|1,0,1]=4 3702 B18R1.322 CCCCOCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100011995733 [0,2,0,0,0,0|1,0,1]=4 3703 B18R1.322 CCCCOCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100011995733 [0,2,0,0,0,0|1,0,1]=4 3704 B18R1.322 CCCCOCSCc1ccc(cc1)C(=O)NC 62a_100011995733_100000753832 [0,2,0,0,0,0|1,0,1]=4 3705 B18R1.322 CCCCOCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100011995733 [0,2,0,0,0,0|1,0,1]=4 3706 B18R1.322 CCCCOCSCc1ccc(cc1)C(=O)OC 62a_100011995733_100000187170 [0,2,0,0,0,0|1,0,1]=4 3707 B18R1.322 CCCCSCCCc1ccc(cc1)C(=O)OC 62a_100000210211_100010192279 [0,2,0,0,0,0|1,0,1]=4 3708 B18R1.322 CCCCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000210210 [0,2,0,0,0,0|1,0,1]=4 3709 B18R1.322 CCCCSCCNc1ccc(cc1)C(=O)NC 27a_100025743550_100000155074 [0,2,0,0,0,0|1,0,1]=4 3710 B18R1.322 CCCCSCCNc1ccc(cc1)C(=O)NN 27a_100025743550_100000183614 [0,2,0,0,0,0|2,0,0]=4 3711 B18R1.322 CCCCSCCOc1ccc(cc1)C(=O)OC 62a_100000210211_100000742590 [0,2,0,0,0,0|1,0,1]=4 3712 B18R1.322 CCCCSCCOc1ccc(cc1)C(=O)OC 62a_100000742590_100000210210 [0,2,0,0,0,0|1,0,1]=4 3713 B18R1.322 CCCOCCCCc1ccc(cc1)C(=O)OC 34a_100010141194_100000210303 [0,2,0,0,0,0|1,0,1]=4 3714 B18R1.322 CCCOCCCCc1ccc(cc1)C(=O)OC 7a_100010141194_100000210303 [0,2,0,0,0,0|1,0,1]=4 3715 B18R1.322 CCCOCCCNc1ccc(cc1)C(=O)NC 27a_100011217757_100000155074 [0,2,0,0,0,0|1,0,1]=4 3716 B18R1.322 CCCOCCCNc1ccc(cc1)C(=O)NN 27a_100011217757_100000183614 [0,2,0,0,0,0|2,0,0]=4 3717 B18R1.322 CCCOCCCOc1ccc(cc1)C(=O)OC 34a_100000210258_100011310726 [0,2,0,0,0,0|1,0,1]=4 3718 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 207a_100161115042_100000043907 [0,2,0,0,0,0|1,0,1]=4 3719 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100011215938 [0,2,0,0,0,0|1,0,1]=4 3720 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 2230a_100161115042_100000753832 [0,2,0,0,0,0|1,0,1]=4 3721 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 270004a_100161115042_100000043907 [0,2,0,0,0,0|1,0,1]=4 3722 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100011215938 [0,2,0,0,0,0|1,0,1]=4 3723 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)NC 34a_100161115042_100000753832 [0,2,0,0,0,0|1,0,1]=4 3724 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)OC 2230a_100161115042_100000735637 [0,2,0,0,0,0|1,0,1]=4 3725 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)OC 270004a_100161115042_100000148700 [0,2,0,0,0,0|1,0,1]=4 3726 B18R1.322 CCCOCCNCc1ccc(cc1)C(=O)OC 34a_100161115042_100000735637 [0,2,0,0,0,0|1,0,1]=4 3727 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)NC 34a_100000752267_100000753832 [0,2,0,0,0,0|1,0,1]=4 3728 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)NC 7a_100000752267_100000753832 [0,2,0,0,0,0|1,0,1]=4 3729 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100011215938 [0,2,0,0,0,0|1,0,1]=4 3730 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)OC 34a_100000752267_100000735637 [0,2,0,0,0,0|1,0,1]=4 3731 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100011215938 [0,2,0,0,0,0|1,0,1]=4 3732 B18R1.322 CCCOCCOCc1ccc(cc1)C(=O)OC 7a_100000752267_100000735637 [0,2,0,0,0,0|1,0,1]=4 3733 B18R1.322 CCCOCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100011215938 [0,2,0,0,0,0|1,0,1]=4 3734 B18R1.322 CCCOCCSCc1ccc(cc1)C(=O)NC 62a_100011215938_100000753832 [0,2,0,0,0,0|1,0,1]=4 3735 B18R1.322 CCCOCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100011215938 [0,2,0,0,0,0|1,0,1]=4 3736 B18R1.322 CCCOCCSCc1ccc(cc1)C(=O)OC 62a_100011215938_100000187170 [0,2,0,0,0,0|1,0,1]=4 3737 B18R1.322 CCCSCCCOc1ccc(cc1)C(=O)OC 62a_100000210303_100011310726 [0,2,0,0,0,0|1,0,1]=4 3738 B18R1.322 CCCSCCCOc1ccc(cc1)C(=O)OC 62a_100011310726_100000210303 [0,2,0,0,0,0|1,0,1]=4 3739 B18R1.322 CCCSCCNCc1ccc(cc1)C(=O)NC 207a_100020603323_100000043907 [0,2,0,0,0,0|1,0,1]=4 3740 B18R1.322 CCCSCCNCc1ccc(cc1)C(=O)NC 2230a_100020603323_100000753832 [0,2,0,0,0,0|1,0,1]=4 3741 B18R1.322 CCCSCCNCc1ccc(cc1)C(=O)NC 270004a_100020603323_100000043907 [0,2,0,0,0,0|1,0,1]=4 3742 B18R1.322 CCCSCCNCc1ccc(cc1)C(=O)OC 2230a_100020603323_100000735637 [0,2,0,0,0,0|1,0,1]=4 3743 B18R1.322 CCCSCCNCc1ccc(cc1)C(=O)OC 270004a_100020603323_100000148700 [0,2,0,0,0,0|1,0,1]=4 3744 B18R1.322 CCCSCCOCc1ccc(cc1)C(=O)NC 34a_200000230433_100000753832 [0,2,0,0,0,0|1,0,1]=4 3745 B18R1.322 CCCSCCOCc1ccc(cc1)C(=O)NC 7a_200000230433_100000753832 [0,2,0,0,0,0|1,0,1]=4 3746 B18R1.322 CCCSCCOCc1ccc(cc1)C(=O)OC 34a_200000230433_100000735637 [0,2,0,0,0,0|1,0,1]=4 3747 B18R1.322 CCCSCCOCc1ccc(cc1)C(=O)OC 7a_200000230433_100000735637 [0,2,0,0,0,0|1,0,1]=4 3748 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 207a_100000210961_100000043907 [0,2,0,0,0,0|1,0,1]=4 3749 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 2230a_100000210961_100000753832 [0,2,0,0,0,0|1,0,1]=4 3750 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100012232248 [0,2,0,0,0,0|1,0,1]=4 3751 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 270004a_100000210961_100000043907 [0,2,0,0,0,0|1,0,1]=4 3752 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 34a_100000210961_100000753832 [0,2,0,0,0,0|1,0,1]=4 3753 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100012232248 [0,2,0,0,0,0|1,0,1]=4 3754 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)OC 2230a_100000210961_100000735637 [0,2,0,0,0,0|1,0,1]=4 3755 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)OC 270004a_100000210961_100000148700 [0,2,0,0,0,0|1,0,1]=4 3756 B18R1.322 CCOCCCNCc1ccc(cc1)C(=O)OC 34a_100000210961_100000735637 [0,2,0,0,0,0|1,0,1]=4 3757 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)NC 34a_100000757476_100000753832 [0,2,0,0,0,0|1,0,1]=4 3758 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)NC 7a_100000757476_100000753832 [0,2,0,0,0,0|1,0,1]=4 3759 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100012232248 [0,2,0,0,0,0|1,0,1]=4 3760 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)OC 34a_100000757476_100000735637 [0,2,0,0,0,0|1,0,1]=4 3761 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100012232248 [0,2,0,0,0,0|1,0,1]=4 3762 B18R1.322 CCOCCCOCc1ccc(cc1)C(=O)OC 7a_100000757476_100000735637 [0,2,0,0,0,0|1,0,1]=4 3763 B18R1.322 CCOCCCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100012232248 [0,2,0,0,0,0|1,0,1]=4 3764 B18R1.322 CCOCCCSCc1ccc(cc1)C(=O)NC 62a_100012232248_100000753832 [0,2,0,0,0,0|1,0,1]=4 3765 B18R1.322 CCOCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100012232248 [0,2,0,0,0,0|1,0,1]=4 3766 B18R1.322 CCOCCCSCc1ccc(cc1)C(=O)OC 62a_100012232248_100000187170 [0,2,0,0,0,0|1,0,1]=4 3767 B18R1.322 CCOCCNCCc1ccc(cc1)C(=O)OC 2230a_102516460346_100010192280 [0,2,0,0,0,0|1,0,1]=4 3768 B18R1.322 CCOCCNCCc1ccc(cc1)C(=O)OC 34a_102516460346_100010192280 [0,2,0,0,0,0|1,0,1]=4 3769 B18R1.322 CCOCCOCCc1ccc(cc1)C(=O)OC 34a_100000210136_100010192280 [0,2,0,0,0,0|1,0,1]=4 3770 B18R1.322 CCOCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000210147 [0,2,0,0,0,0|1,0,1]=4 3771 B18R1.322 CCOCCOCCc1ccc(cc1)C(=O)OC 7a_100000210136_100010192280 [0,2,0,0,0,0|1,0,1]=4 3772 B18R1.322 CCOCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100011215890 [0,2,0,0,0,0|1,0,1]=4 3773 B18R1.322 CCOCCSCCc1ccc(cc1)C(=O)OC 62a_100000210147_100010192280 [0,2,0,0,0,0|1,0,1]=4 3774 B18R1.322 CCOCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100011215890 [0,2,0,0,0,0|1,0,1]=4 3775 B18R1.322 CCOCSCCCc1ccc(cc1)C(=O)OC 62a_100000739092_100010192279 [0,2,0,0,0,0|1,0,1]=4 3776 B18R1.322 CCOCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000739092 [0,2,0,0,0,0|1,0,1]=4 3777 B18R1.322 CCSCCCOCc1ccc(cc1)C(=O)NC 34a_100011216438_100000753832 [0,2,0,0,0,0|1,0,1]=4 3778 B18R1.322 CCSCCCOCc1ccc(cc1)C(=O)NC 7a_100011216438_100000753832 [0,2,0,0,0,0|1,0,1]=4 3779 B18R1.322 CCSCCCOCc1ccc(cc1)C(=O)OC 34a_100011216438_100000735637 [0,2,0,0,0,0|1,0,1]=4 3780 B18R1.322 CCSCCCOCc1ccc(cc1)C(=O)OC 7a_100011216438_100000735637 [0,2,0,0,0,0|1,0,1]=4 3781 B18R1.322 CCSCCNCCc1ccc(cc1)C(=O)OC 2230a_100000106463_100010192280 [0,2,0,0,0,0|1,0,1]=4 3782 B18R1.322 CCSCCOCCc1ccc(cc1)C(=O)OC 34a_100000212035_100010192280 [0,2,0,0,0,0|1,0,1]=4 3783 B18R1.322 CCSCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000757381 [0,2,0,0,0,0|1,0,1]=4 3784 B18R1.322 CCSCCOCCc1ccc(cc1)C(=O)OC 7a_100000212035_100010192280 [0,2,0,0,0,0|1,0,1]=4 3785 B18R1.322 CCSCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000757381 [0,2,0,0,0,0|1,0,1]=4 3786 B18R1.322 CCSCCSCCc1ccc(cc1)C(=O)OC 62a_100000757381_100010192280 [0,2,0,0,0,0|1,0,1]=4 3787 B18R1.322 CCSCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000757381 [0,2,0,0,0,0|1,0,1]=4 3788 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCF 2230a_100000743749_100000729378 [0,2,0,0,0,0|1,0,1]=4 3789 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCF 34a_100000743749_100000729378 [0,2,0,0,0,0|1,0,1]=4 3790 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 207a_100000762737_100000043907 [0,2,0,0,0,0|1,0,1]=4 3791 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 2230a_100000743749_100000746330 [0,2,0,0,0,0|1,0,1]=4 3792 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 2230a_100000762737_100000753832 [0,2,0,0,0,0|1,0,1]=4 3793 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 270004a_100000762737_100000043907 [0,2,0,0,0,0|1,0,1]=4 3794 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 34a_100000743749_100000746330 [0,2,0,0,0,0|1,0,1]=4 3795 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCCO 34a_100000762737_100000753832 [0,2,0,0,0,0|1,0,1]=4 3796 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCOC 2230a_100000743749_100000730899 [0,2,0,0,0,0|1,0,1]=4 3797 B18R1.322 CNC(=O)c1ccc(cc1)CNCCCCOC 34a_100000743749_100000755781 [0,2,0,0,0,0|1,0,1]=4 3798 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCBr 34a_100000746331_100000753832 [0,2,0,0,0,0|1,0,1]=4 3799 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCBr 7a_100000746331_100000753832 [0,2,0,0,0,0|1,0,1]=4 3800 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCCl 34a_100000746330_100000753832 [0,2,0,0,0,0|1,0,1]=4 3801 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCCl 7a_100000746330_100000753832 [0,2,0,0,0,0|1,0,1]=4 3802 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCI 34a_200012148887_100000753832 [0,2,0,0,0,0|1,0,1]=4 3803 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCI 7a_200012148887_100000753832 [0,2,0,0,0,0|1,0,1]=4 3804 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCCN 34a_100000762737_100000753832 [0,2,0,0,0,0|1,0,1]=4 3805 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCOC 34a_100000740925_100000753832 [0,2,0,0,0,0|1,0,1]=4 3806 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCSC 34a_100011217163_100000753832 [0,2,0,0,0,0|1,0,1]=4 3807 B18R1.322 CNC(=O)c1ccc(cc1)COCCCCSC 7a_100011217163_100000753832 [0,2,0,0,0,0|1,0,1]=4 3808 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCCF 62a_100000729378_100000753832 [0,2,0,0,0,0|1,0,1]=4 3809 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCCF 62a_100000753832_100000729378 [0,2,0,0,0,0|1,0,1]=4 3810 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCCO 62a_100000746330_100000753832 [0,2,0,0,0,0|1,0,1]=4 3811 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCCO 62a_100000753832_100000746330 [0,2,0,0,0,0|1,0,1]=4 3812 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCOC 62a_100000730899_100000753832 [0,2,0,0,0,0|1,0,1]=4 3813 B18R1.322 CNC(=O)c1ccc(cc1)CSCCCCOC 62a_100000753832_100000730899 [0,2,0,0,0,0|1,0,1]=4 3814 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCCF 2230a_100000184841_100015922095 [0,2,0,0,0,0|1,0,1]=4 3815 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCCF 34a_100000184841_100015922095 [0,2,0,0,0,0|1,0,1]=4 3816 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCCO 2230a_100000184841_100000766143 [0,2,0,0,0,0|1,0,1]=4 3817 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCCO 27a_100000686447_100000155074 [0,2,0,0,0,0|1,0,1]=4 3818 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCCO 34a_100000184841_100000766143 [0,2,0,0,0,0|1,0,1]=4 3819 B18R1.322 CNC(=O)c1ccc(cc1)NCCCCCOC 27a_100000747528_100000155074 [0,2,0,0,0,0|1,0,1]=4 3820 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCF 34a_100000192141_100015922095 [0,2,0,0,0,0|1,0,1]=4 3821 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCF 7a_100000192141_100015922095 [0,2,0,0,0,0|1,0,1]=4 3822 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCO 1626a_100102657272_100006003884 [0,2,0,0,0,0|1,0,1]=4 3823 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCO 240690a_100102657272_100006003884 [0,2,0,0,0,0|1,0,1]=4 3824 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCO 34a_100000192141_100000766143 [0,2,0,0,0,0|1,0,1]=4 3825 B18R1.322 CNC(=O)c1ccc(cc1)OCCCCCCO 7a_100000192141_100000766143 [0,2,0,0,0,0|1,0,1]=4 3826 B18R1.322 CNC(=O)c1ccc(cc1)SCCCCCCF 62a_100000155074_100015922095 [0,2,0,0,0,0|1,0,1]=4 3827 B18R1.322 CNC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000155074 [0,2,0,0,0,0|1,0,1]=4 3828 B18R1.322 CNC(=O)c1ccc(cc1)SCCCCCCO 62a_100000155074_100000766143 [0,2,0,0,0,0|1,0,1]=4 3829 B18R1.322 CNC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000155074 [0,2,0,0,0,0|1,0,1]=4 3830 B18R1.322 CNCCCOCCc1ccc(cc1)C(=O)OC 34a_100000213112_100010192280 [0,2,0,0,0,0|1,0,1]=4 3831 B18R1.322 COC(=O)c1ccc(cc1)CCCCOCCF 34a_100010141194_100011217306 [0,2,0,0,0,0|1,0,1]=4 3832 B18R1.322 COC(=O)c1ccc(cc1)CCCCOCCF 7a_100010141194_100011217306 [0,2,0,0,0,0|1,0,1]=4 3833 B18R1.322 COC(=O)c1ccc(cc1)CCCCOCCO 34a_100010141194_100000211926 [0,2,0,0,0,0|1,0,1]=4 3834 B18R1.322 COC(=O)c1ccc(cc1)CCCCOCCO 7a_100010141194_100000211926 [0,2,0,0,0,0|1,0,1]=4 3835 B18R1.322 COC(=O)c1ccc(cc1)CCCCOCSC 34a_100010141194_100011218213 [0,2,0,0,0,0|1,0,1]=4 3836 B18R1.322 COC(=O)c1ccc(cc1)CCCNCCCF 2230a_100015189416_100010192279 [0,2,0,0,0,0|1,0,1]=4 3837 B18R1.322 COC(=O)c1ccc(cc1)CCCNCCCF 34a_100015189416_100010192279 [0,2,0,0,0,0|1,0,1]=4 3838 B18R1.322 COC(=O)c1ccc(cc1)CCCNCCSC 2230a_100020590264_100010192279 [0,2,0,0,0,0|1,0,1]=4 3839 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCCBr 34a_100011217188_100010192279 [0,2,0,0,0,0|1,0,1]=4 3840 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCCCl 34a_100000230001_100010192279 [0,2,0,0,0,0|1,0,1]=4 3841 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCCF 34a_100000759539_100010192279 [0,2,0,0,0,0|1,0,1]=4 3842 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCCN 34a_100000182051_100010192279 [0,2,0,0,0,0|1,0,1]=4 3843 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCSC 34a_100000230434_100010192279 [0,2,0,0,0,0|1,0,1]=4 3844 B18R1.322 COC(=O)c1ccc(cc1)CCCOCCSC 7a_100000230434_100010192279 [0,2,0,0,0,0|1,0,1]=4 3845 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCCF 62a_100010192279_100011934791 [0,2,0,0,0,0|1,0,1]=4 3846 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCCF 62a_100011934791_100010192279 [0,2,0,0,0,0|1,0,1]=4 3847 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCCO 62a_100010192279_100011215043 [0,2,0,0,0,0|1,0,1]=4 3848 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCCO 62a_100011215043_100010192279 [0,2,0,0,0,0|1,0,1]=4 3849 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCSC 62a_100000212216_100010192279 [0,2,0,0,0,0|1,0,1]=4 3850 B18R1.322 COC(=O)c1ccc(cc1)CCCSCCSC 62a_100010192279_100000751147 [0,2,0,0,0,0|1,0,1]=4 3851 B18R1.322 COC(=O)c1ccc(cc1)CCNCCCCO 2230a_100000750430_100010192280 [0,2,0,0,0,0|1,0,1]=4 3852 B18R1.322 COC(=O)c1ccc(cc1)CCNCCCCO 34a_100000750430_100010192280 [0,2,0,0,0,0|1,0,1]=4 3853 B18R1.322 COC(=O)c1ccc(cc1)CCNCCCSC 2230a_100000749238_100010192280 [0,2,0,0,0,0|1,0,1]=4 3854 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCBr 34a_100011216708_100010192280 [0,2,0,0,0,0|1,0,1]=4 3855 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCCl 34a_100000210776_100010192280 [0,2,0,0,0,0|1,0,1]=4 3856 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCCl 7a_100000210776_100010192280 [0,2,0,0,0,0|1,0,1]=4 3857 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCF 34a_100010779965_100000729493 [0,2,0,0,0,0|1,0,1]=4 3858 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCF 34a_100011995726_100010192280 [0,2,0,0,0,0|1,0,1]=4 3859 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCF 7a_100010779965_100000729493 [0,2,0,0,0,0|1,0,1]=4 3860 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCF 7a_100011995726_100010192280 [0,2,0,0,0,0|1,0,1]=4 3861 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCI 34a_200012148704_100010192280 [0,2,0,0,0,0|1,0,1]=4 3862 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCN 34a_100000750430_100010192280 [0,2,0,0,0,0|1,0,1]=4 3863 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCO 34a_100010779965_100011216708 [0,2,0,0,0,0|1,0,1]=4 3864 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCCO 7a_100010779965_100000210776 [0,2,0,0,0,0|1,0,1]=4 3865 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCSC 34a_100000690336_100010192280 [0,2,0,0,0,0|1,0,1]=4 3866 B18R1.322 COC(=O)c1ccc(cc1)CCOCCCSC 7a_100000690336_100010192280 [0,2,0,0,0,0|1,0,1]=4 3867 B18R1.322 COC(=O)c1ccc(cc1)CCSCCCCF 62a_100000729493_100010192280 [0,2,0,0,0,0|1,0,1]=4 3868 B18R1.322 COC(=O)c1ccc(cc1)CCSCCCCF 62a_100010192280_100000729493 [0,2,0,0,0,0|1,0,1]=4 3869 B18R1.322 COC(=O)c1ccc(cc1)CCSCCCCO 62a_100000210776_100010192280 [0,2,0,0,0,0|1,0,1]=4 3870 B18R1.322 COC(=O)c1ccc(cc1)CCSCCCCO 62a_100010192280_100000210776 [0,2,0,0,0,0|1,0,1]=4 3871 B18R1.322 COC(=O)c1ccc(cc1)CNCCCCCO 2230a_100000762737_100000735637 [0,2,0,0,0,0|1,0,1]=4 3872 B18R1.322 COC(=O)c1ccc(cc1)CNCCCCCO 270004a_100000762737_100000148700 [0,2,0,0,0,0|1,0,1]=4 3873 B18R1.322 COC(=O)c1ccc(cc1)CNCCCCCO 34a_100000762737_100000735637 [0,2,0,0,0,0|1,0,1]=4 3874 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCBr 34a_100000746331_100000735637 [0,2,0,0,0,0|1,0,1]=4 3875 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCBr 7a_100000746331_100000735637 [0,2,0,0,0,0|1,0,1]=4 3876 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCCl 34a_100000746330_100000735637 [0,2,0,0,0,0|1,0,1]=4 3877 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCCl 7a_100000746330_100000735637 [0,2,0,0,0,0|1,0,1]=4 3878 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCF 34a_100000151488_100000729378 [0,2,0,0,0,0|1,0,1]=4 3879 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCF 7a_100000151488_100000729378 [0,2,0,0,0,0|1,0,1]=4 3880 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCI 34a_200012148887_100000735637 [0,2,0,0,0,0|1,0,1]=4 3881 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCI 7a_200012148887_100000735637 [0,2,0,0,0,0|1,0,1]=4 3882 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCN 34a_100000762737_100000735637 [0,2,0,0,0,0|1,0,1]=4 3883 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCO 34a_100000151488_100000746330 [0,2,0,0,0,0|1,0,1]=4 3884 B18R1.322 COC(=O)c1ccc(cc1)COCCCCCO 7a_100000151488_100000746330 [0,2,0,0,0,0|1,0,1]=4 3885 B18R1.322 COC(=O)c1ccc(cc1)COCCCCSC 34a_100011217163_100000735637 [0,2,0,0,0,0|1,0,1]=4 3886 B18R1.322 COC(=O)c1ccc(cc1)COCCCCSC 7a_100011217163_100000735637 [0,2,0,0,0,0|1,0,1]=4 3887 B18R1.322 COC(=O)c1ccc(cc1)CSCCCCCF 62a_100000729378_100000187170 [0,2,0,0,0,0|1,0,1]=4 3888 B18R1.322 COC(=O)c1ccc(cc1)CSCCCCCF 62a_100000735637_100000729378 [0,2,0,0,0,0|1,0,1]=4 3889 B18R1.322 COC(=O)c1ccc(cc1)CSCCCCCO 62a_100000735637_100000746330 [0,2,0,0,0,0|1,0,1]=4 3890 B18R1.322 COC(=O)c1ccc(cc1)CSCCCCCO 62a_100000746330_100000187170 [0,2,0,0,0,0|1,0,1]=4 3891 B18R1.322 COC(=O)c1ccc(cc1)OCCCCCCF 34a_100000150123_100015922095 [0,2,0,0,0,0|1,0,1]=4 3892 B18R1.322 COC(=O)c1ccc(cc1)OCCCCCCF 7a_100000150123_100015922095 [0,2,0,0,0,0|1,0,1]=4 3893 B18R1.322 COC(=O)c1ccc(cc1)OCCCCCCO 34a_100000150123_100000766143 [0,2,0,0,0,0|1,0,1]=4 3894 B18R1.322 COC(=O)c1ccc(cc1)OCCCCCCO 7a_100000150123_100000766143 [0,2,0,0,0,0|1,0,1]=4 3895 B18R1.322 COC(=O)c1ccc(cc1)SCCCCCCF 62a_100000150774_100015922095 [0,2,0,0,0,0|1,0,1]=4 3896 B18R1.322 COC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000150774 [0,2,0,0,0,0|1,0,1]=4 3897 B18R1.322 COC(=O)c1ccc(cc1)SCCCCCCO 62a_100000150774_100000766143 [0,2,0,0,0,0|1,0,1]=4 3898 B18R1.322 COC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000150774 [0,2,0,0,0,0|1,0,1]=4 3899 B18R1.322 COCCCCCNc1ccc(cc1)C(=O)NN 27a_100000747528_100000183614 [0,2,0,0,0,0|2,0,0]=4 3900 B18R1.322 COCCCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000755781 [0,2,0,0,0,0|1,0,1]=4 3901 B18R1.322 COCCCCOCc1ccc(cc1)C(=O)OC 34a_100000740925_100000735637 [0,2,0,0,0,0|1,0,1]=4 3902 B18R1.322 COCCCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000730899 [0,2,0,0,0,0|1,0,1]=4 3903 B18R1.322 COCCCCSCc1ccc(cc1)C(=O)OC 62a_100000730899_100000187170 [0,2,0,0,0,0|1,0,1]=4 3904 B18R1.322 COCCCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000730899 [0,2,0,0,0,0|1,0,1]=4 3905 B18R1.322 COCCCNCCc1ccc(cc1)C(=O)OC 34a_100150723488_100010192280 [0,2,0,0,0,0|1,0,1]=4 3906 B18R1.322 COCCCOCCc1ccc(cc1)C(=O)OC 34a_100000740835_100010192280 [0,2,0,0,0,0|1,0,1]=4 3907 B18R1.322 COCCCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000740836 [0,2,0,0,0,0|1,0,1]=4 3908 B18R1.322 COCCCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000740836 [0,2,0,0,0,0|1,0,1]=4 3909 B18R1.322 COCCCSCCc1ccc(cc1)C(=O)OC 62a_100000709357_100010192280 [0,2,0,0,0,0|1,0,1]=4 3910 B18R1.322 COCCCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000709357 [0,2,0,0,0,0|1,0,1]=4 3911 B18R1.322 COCCNCCCc1ccc(cc1)C(=O)OC 2230a_100000209980_100010192279 [0,2,0,0,0,0|1,0,1]=4 3912 B18R1.322 COCCOCCCc1ccc(cc1)C(=O)OC 34a_100000210237_100010192279 [0,2,0,0,0,0|1,0,1]=4 3913 B18R1.322 COCCOCCSc1ccc(cc1)C(=O)C=O 62a_100000695917_100000725942 [0,2,0,0,0,0|2,0,0]=4 3914 B18R1.322 COCCOCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000695917 [0,2,0,0,0,0|2,0,0]=4 3915 B18R1.322 COCCSCCCc1ccc(cc1)C(=O)OC 62a_100000233755_100010192279 [0,2,0,0,0,0|1,0,1]=4 3916 B18R1.322 COCCSCCCc1ccc(cc1)C(=O)OC 62a_100010192279_100000233755 [0,2,0,0,0,0|1,0,1]=4 3917 B18R1.322 N#CC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100009994572 [0,2,0,0,0,0|1,0,1]=4 3918 B18R1.322 N#CC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100009994572 [0,2,0,0,0,0|1,0,1]=4 3919 B18R1.322 N#CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100009813376 [0,2,0,0,0,0|1,0,1]=4 3920 B18R1.322 N#CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100009813376_100000725942 [0,2,0,0,0,0|1,0,1]=4 3921 B18R1.322 NCC(=O)c1ccc(cc1)SCCCCCCF 62a_100000017248_100015922095 [0,2,0,0,0,0|1,0,1]=4 3922 B18R1.322 NCC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000017248 [0,2,0,0,0,0|1,0,1]=4 3923 B18R1.322 NCC(=O)c1ccc(cc1)SCCCCCCO 62a_100000017248_100000766143 [0,2,0,0,0,0|1,0,1]=4 3924 B18R1.322 NCC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000017248 [0,2,0,0,0,0|1,0,1]=4 3925 B18R1.322 NNC(=O)c1ccc(cc1)NCCCCCCO 27a_100000686447_100000183614 [0,2,0,0,0,0|2,0,0]=4 3926 B18R1.322 NNC(=O)c1ccc(cc1)OCCCCCCF 34a_100000185078_100015922095 [0,2,0,0,0,0|2,0,0]=4 3927 B18R1.322 NNC(=O)c1ccc(cc1)OCCCCCCO 34a_100000185078_100000766143 [0,2,0,0,0,0|2,0,0]=4 3928 B18R1.322 NNC(=O)c1ccc(cc1)SCCCCCCF 62a_100000183614_100015922095 [0,2,0,0,0,0|2,0,0]=4 3929 B18R1.322 NNC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000183614 [0,2,0,0,0,0|2,0,0]=4 3930 B18R1.322 NNC(=O)c1ccc(cc1)SCCCCCCO 62a_100000183614_100000766143 [0,2,0,0,0,0|2,0,0]=4 3931 B18R1.322 NNC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000183614 [0,2,0,0,0,0|2,0,0]=4 3932 B18R1.322 O=C(CBr)c1ccc(cc1)OCCCCCCF 7a_100009814261_100015922095 [0,2,0,0,0,0|1,0,1]=4 3933 B18R1.322 O=C(CBr)c1ccc(cc1)OCCCCCCO 7a_100009814261_100000766143 [0,2,0,0,0,0|1,0,1]=4 3934 B18R1.322 O=C(CCl)c1ccc(cc1)OCCCCCCF 7a_100000018856_100015922095 [0,2,0,0,0,0|1,0,1]=4 3935 B18R1.322 O=C(CCl)c1ccc(cc1)OCCCCCCO 7a_100000018856_100000766143 [0,2,0,0,0,0|1,0,1]=4 3936 B18R1.322 O=C(CF)c1ccc(cc1)OCCCCCCF 34a_200010654591_100015922095 [0,2,0,0,0,0|1,0,1]=4 3937 B18R1.322 O=C(CF)c1ccc(cc1)OCCCCCCF 7a_200010654591_100015922095 [0,2,0,0,0,0|1,0,1]=4 3938 B18R1.322 O=C(CF)c1ccc(cc1)OCCCCCCO 1458a_100006003884_100015361967 [0,2,0,0,0,0|1,0,1]=4 3939 B18R1.322 O=C(CF)c1ccc(cc1)OCCCCCCO 34a_200010654591_100000766143 [0,2,0,0,0,0|1,0,1]=4 3940 B18R1.322 O=C(CF)c1ccc(cc1)OCCCCCCO 7a_200010654591_100000766143 [0,2,0,0,0,0|1,0,1]=4 3941 B18R1.322 O=C(CO)c1ccc(cc1)SCCCCCCF 62a_100011219529_100015922095 [0,2,0,0,0,0|1,0,1]=4 3942 B18R1.322 O=C(CO)c1ccc(cc1)SCCCCCCF 62a_100015922095_100011219529 [0,2,0,0,0,0|1,0,1]=4 3943 B18R1.322 O=C(CO)c1ccc(cc1)SCCCCCCO 62a_100000766143_100011219529 [0,2,0,0,0,0|1,0,1]=4 3944 B18R1.322 O=C(CO)c1ccc(cc1)SCCCCCCO 62a_100011219529_100000766143 [0,2,0,0,0,0|1,0,1]=4 3945 B18R1.322 O=CC(=O)c1ccc(cc1)SCCCCCCF 62a_100000725942_100015922095 [0,2,0,0,0,0|1,0,0]=3 3946 B18R1.322 O=CC(=O)c1ccc(cc1)SCCCCCCF 62a_100015922095_100000725942 [0,2,0,0,0,0|1,0,0]=3 3947 B18R1.322 O=CC(=O)c1ccc(cc1)SCCCCCCO 62a_100000725942_100000766143 [0,2,0,0,0,0|1,0,0]=3 3948 B18R1.322 O=CC(=O)c1ccc(cc1)SCCCCCCO 62a_100000766143_100000725942 [0,2,0,0,0,0|1,0,0]=3 3949 B18R1.322 O=CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000139337_100000725942 [0,2,0,0,0,0|1,0,1]=4 3950 B18R1.322 O=CCCCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000139337 [0,2,0,0,0,0|1,0,1]=4 3951 B18R1.1061 CC(=O)CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000735457 [0,2,0,0,0,0|1,0,1]=4 3952 B18R1.1061 CC(=O)CCCCSc1ccc(cc1)C(=O)C=O 62a_100000735457_100000725942 [0,2,0,0,0,0|1,0,1]=4 3953 B18R1.1061 CC(C)CCCCOc1ccc(cc1)C(=O)CBr 7a_100009814261_100011216152 [0,2,0,0,0,0|1,0,1]=4 3954 B18R1.1061 CC(C)CCCCOc1ccc(cc1)C(=O)CCl 7a_100000018856_100011216152 [0,2,0,0,0,0|1,0,1]=4 3955 B18R1.1061 CC(C)CCCCOc1ccc(cc1)C(=O)CF 34a_200010654591_100011216152 [0,2,0,0,0,0|1,0,1]=4 3956 B18R1.1061 CC(C)CCCCOc1ccc(cc1)C(=O)CF 7a_200010654591_100011216152 [0,2,0,0,0,0|1,0,1]=4 3957 B18R1.1061 CC(C)CCCCOc1ccc(cc1)C(=O)NN 34a_100000185078_100011216152 [0,2,0,0,0,0|2,0,0]=4 3958 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)C#N 62a_100011216152_100009994572 [0,2,0,0,0,0|1,0,1]=4 3959 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100011216152 [0,2,0,0,0,0|1,0,0]=3 3960 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)C=O 62a_100011216152_100000725942 [0,2,0,0,0,0|1,0,0]=3 3961 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)CN 62a_100000017248_100011216152 [0,2,0,0,0,0|1,0,1]=4 3962 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)CN 62a_100011216152_100000017248 [0,2,0,0,0,0|1,0,1]=4 3963 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)CO 62a_100011216152_100011219529 [0,2,0,0,0,0|1,0,1]=4 3964 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)CO 62a_100011219529_100011216152 [0,2,0,0,0,0|1,0,1]=4 3965 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)NN 62a_100000183614_100011216152 [0,2,0,0,0,0|2,0,0]=4 3966 B18R1.1061 CC(C)CCCCSc1ccc(cc1)C(=O)NN 62a_100011216152_100000183614 [0,2,0,0,0,0|2,0,0]=4 3967 B18R1.1061 CCC(=O)c1ccc(cc1)OCCCCC(C)C 34a_100000212119_100011216152 [0,2,0,0,0,0|0,0,2]=4 3968 B18R1.1061 CCC(=O)c1ccc(cc1)OCCCCC(C)C 7a_100000212119_100011216152 [0,2,0,0,0,0|0,0,2]=4 3969 B18R1.1061 CN(C)CCCCSc1ccc(cc1)C(=O)C=O 62a_100000725942_100000690147 [0,2,0,0,0,0|2,0,0]=4 3970 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 207a_200000737386_100000043907 [0,2,0,0,0,0|1,0,1]=4 3971 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 2230a_100000743749_100011214892 [0,2,0,0,0,0|1,0,1]=4 3972 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 2230a_200000737386_100000753832 [0,2,0,0,0,0|1,0,1]=4 3973 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 270004a_200000737386_100000043907 [0,2,0,0,0,0|1,0,1]=4 3974 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 34a_100000743749_100011214892 [0,2,0,0,0,0|1,0,1]=4 3975 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)C 34a_200000737386_100000753832 [0,2,0,0,0,0|1,0,1]=4 3976 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)O 2230a_100000743749_200000718107 [0,2,0,0,0,0|1,0,1]=4 3977 B18R1.1061 CNC(=O)c1ccc(cc1)CNCCCC(C)O 34a_100000743749_200000718107 [0,2,0,0,0,0|1,0,1]=4 3978 B18R1.1061 CNC(=O)c1ccc(cc1)COCCCC(C)C 34a_100000210774_100000753832 [0,2,0,0,0,0|1,0,1]=4 3979 B18R1.1061 CNC(=O)c1ccc(cc1)COCCCC(C)C 7a_100000210774_100000753832 [0,2,0,0,0,0|1,0,1]=4 3980 B18R1.1061 CNC(=O)c1ccc(cc1)CSCCCC(C)C 62a_100000753832_100011214892 [0,2,0,0,0,0|1,0,1]=4 3981 B18R1.1061 CNC(=O)c1ccc(cc1)CSCCCC(C)C 62a_100011214892_100000753832 [0,2,0,0,0,0|1,0,1]=4 3982 B18R1.1061 CNC(=O)c1ccc(cc1)CSCCCC(C)O 62a_100000753832_200000718107 [0,2,0,0,0,0|1,0,1]=4 3983 B18R1.1061 CNC(=O)c1ccc(cc1)CSCCCC(C)O 62a_200000718107_100000753832 [0,2,0,0,0,0|1,0,1]=4 3984 B18R1.1061 CNC(=O)c1ccc(cc1)NCCCCC(C)C 2230a_100000184841_100011216152 [0,2,0,0,0,0|1,0,1]=4 3985 B18R1.1061 CNC(=O)c1ccc(cc1)NCCCCC(C)C 34a_100000184841_100011216152 [0,2,0,0,0,0|1,0,1]=4 3986 B18R1.1061 CNC(=O)c1ccc(cc1)OCCCCC(C)C 34a_100000192141_100011216152 [0,2,0,0,0,0|1,0,1]=4 3987 B18R1.1061 CNC(=O)c1ccc(cc1)OCCCCC(C)C 7a_100000192141_100011216152 [0,2,0,0,0,0|1,0,1]=4 3988 B18R1.1061 CNC(=O)c1ccc(cc1)SCCCCC(C)C 62a_100000155074_100011216152 [0,2,0,0,0,0|1,0,1]=4 3989 B18R1.1061 CNC(=O)c1ccc(cc1)SCCCCC(C)C 62a_100011216152_100000155074 [0,2,0,0,0,0|1,0,1]=4 3990 B18R1.1061 COC(=O)c1ccc(cc1)CCCCOC(C)C 34a_100010141194_100000210206 [0,2,0,0,0,0|1,0,1]=4 3991 B18R1.1061 COC(=O)c1ccc(cc1)CCCCOC(C)C 7a_100010141194_100000210206 [0,2,0,0,0,0|1,0,1]=4 3992 B18R1.1061 COC(=O)c1ccc(cc1)CCCNCC(C)C 2230a_100000210953_100010192279 [0,2,0,0,0,0|1,0,1]=4 3993 B18R1.1061 COC(=O)c1ccc(cc1)CCCNCC(C)C 34a_100000210953_100010192279 [0,2,0,0,0,0|1,0,1]=4 3994 B18R1.1061 COC(=O)c1ccc(cc1)CCCNCC(C)O 2230a_100000210904_100010192279 [0,2,0,0,0,0|1,0,1]=4 3995 B18R1.1061 COC(=O)c1ccc(cc1)CCCNCC(C)O 34a_100000210904_100010192279 [0,2,0,0,0,0|1,0,1]=4 3996 B18R1.1061 COC(=O)c1ccc(cc1)CCCOCC(C)Br 34a_100012180447_100010192279 [0,2,0,0,0,0|1,0,1]=4 3997 B18R1.1061 COC(=O)c1ccc(cc1)CCCOCC(C)C 34a_100000210257_100010192279 [0,2,0,0,0,0|1,0,1]=4 3998 B18R1.1061 COC(=O)c1ccc(cc1)CCCOCC(C)F 34a_100015925927_100010192279 [0,2,0,0,0,0|1,0,1]=4 3999 B18R1.1061 COC(=O)c1ccc(cc1)CCCOC[C@@H](C)Cl 34a_100016084084_100010192279 [0,2,0,0,0,0|1,0,1]=4 4000 B18R1.1061 COC(=O)c1ccc(cc1)CCCOC[C@@H](C)N 34a_100000737577_100010192279 [0,2,0,0,0,0|1,0,1]=4 4001 B18R1.1061 COC(=O)c1ccc(cc1)CCCSCC(C)C 62a_100000210624_100010192279 [0,2,0,0,0,0|1,0,1]=4 4002 B18R1.1061 COC(=O)c1ccc(cc1)CCCSCC(C)C 62a_100010192279_100000210760 [0,2,0,0,0,0|1,0,1]=4 4003 B18R1.1061 COC(=O)c1ccc(cc1)CCCSCC(C)O 62a_100010192279_100011218427 [0,2,0,0,0,0|1,0,1]=4 4004 B18R1.1061 COC(=O)c1ccc(cc1)CCCSCC(C)O 62a_100011218427_100010192279 [0,2,0,0,0,0|1,0,1]=4 4005 B18R1.1061 COC(=O)c1ccc(cc1)CCCSC[C@@H](C)O 62a_100009817552_100010192279 [0,2,0,0,0,0|1,0,1]=4 4006 B18R1.1061 COC(=O)c1ccc(cc1)CCCSC[C@@H](C)O 62a_100010192279_100009817552 [0,2,0,0,0,0|1,0,1]=4 4007 B18R1.1061 COC(=O)c1ccc(cc1)CCNCCC(C)O 2230a_200000755665_100010192280 [0,2,0,0,0,0|1,0,1]=4 4008 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)Br 34a_100009893172_100010192280 [0,2,0,0,0,0|1,0,1]=4 4009 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)C 34a_100000210254_100010192280 [0,2,0,0,0,0|1,0,1]=4 4010 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)C 34a_100010779965_100000210312 [0,2,0,0,0,0|1,0,1]=4 4011 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)C 7a_100000210254_100010192280 [0,2,0,0,0,0|1,0,1]=4 4012 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)C 7a_100010779965_100000210626 [0,2,0,0,0,0|1,0,1]=4 4013 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)O 34a_100010779965_100012276601 [0,2,0,0,0,0|1,0,1]=4 4014 B18R1.1061 COC(=O)c1ccc(cc1)CCOCCC(C)O 7a_100010779965_100012276601 [0,2,0,0,0,0|1,0,1]=4 4015 B18R1.1061 COC(=O)c1ccc(cc1)CCOCC[C@@H](C)N 34a_100000706166_100010192280 [0,2,0,0,0,0|1,0,1]=4 4016 B18R1.1061 COC(=O)c1ccc(cc1)CCSCCC(C)C 62a_100000210312_100010192280 [0,2,0,0,0,0|1,0,1]=4 4017 B18R1.1061 COC(=O)c1ccc(cc1)CCSCCC(C)C 62a_100010192280_100000210312 [0,2,0,0,0,0|1,0,1]=4 4018 B18R1.1061 COC(=O)c1ccc(cc1)CCSCCC(C)O 62a_100010192280_100012276601 [0,2,0,0,0,0|1,0,1]=4 4019 B18R1.1061 COC(=O)c1ccc(cc1)CCSCCC(C)O 62a_100012276601_100010192280 [0,2,0,0,0,0|1,0,1]=4 4020 B18R1.1061 COC(=O)c1ccc(cc1)CNCCCC(C)C 2230a_200000737386_100000735637 [0,2,0,0,0,0|1,0,1]=4 4021 B18R1.1061 COC(=O)c1ccc(cc1)CNCCCC(C)C 270004a_200000737386_100000148700 [0,2,0,0,0,0|1,0,1]=4 4022 B18R1.1061 COC(=O)c1ccc(cc1)CNCCCC(C)C 34a_200000737386_100000735637 [0,2,0,0,0,0|1,0,1]=4 4023 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)C 34a_100000151488_100011214892 [0,2,0,0,0,0|1,0,1]=4 4024 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)C 34a_100000210774_100000735637 [0,2,0,0,0,0|1,0,1]=4 4025 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)C 7a_100000151488_100011214892 [0,2,0,0,0,0|1,0,1]=4 4026 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)C 7a_100000210774_100000735637 [0,2,0,0,0,0|1,0,1]=4 4027 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)O 34a_100000151488_200000718107 [0,2,0,0,0,0|1,0,1]=4 4028 B18R1.1061 COC(=O)c1ccc(cc1)COCCCC(C)O 7a_100000151488_200000718107 [0,2,0,0,0,0|1,0,1]=4 4029 B18R1.1061 COC(=O)c1ccc(cc1)CSCCCC(C)C 62a_100000735637_100011214892 [0,2,0,0,0,0|1,0,1]=4 4030 B18R1.1061 COC(=O)c1ccc(cc1)CSCCCC(C)C 62a_100011214892_100000187170 [0,2,0,0,0,0|1,0,1]=4 4031 B18R1.1061 COC(=O)c1ccc(cc1)CSCCCC(C)O 62a_100000735637_200000718107 [0,2,0,0,0,0|1,0,1]=4 4032 B18R1.1061 COC(=O)c1ccc(cc1)CSCCCC(C)O 62a_200000718107_100000187170 [0,2,0,0,0,0|1,0,1]=4 4033 B18R1.1061 COC(=O)c1ccc(cc1)OCCCCC(C)C 34a_100000150123_100011216152 [0,2,0,0,0,0|1,0,1]=4 4034 B18R1.1061 COC(=O)c1ccc(cc1)OCCCCC(C)C 7a_100000150123_100011216152 [0,2,0,0,0,0|1,0,1]=4 4035 B18R1.1061 COC(=O)c1ccc(cc1)SCCCCC(C)C 62a_100000150774_100011216152 [0,2,0,0,0,0|1,0,1]=4 4036 B18R1.1061 COC(=O)c1ccc(cc1)SCCCCC(C)C 62a_100011216152_100000150774 [0,2,0,0,0,0|1,0,1]=4 4037 B18R1.5201 CCCCCCC(=O)c1ccc(cc1)C(=O)NC 1458a_100011298788_100000210757 [0,2,0,0,0,0|1,0,1]=4 4038 B18R1.5201 CCCCCCC(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_100000210757 [0,2,0,0,0,0|1,0,1]=4 4039 B18R1.5201 CCCCCCN(C)c1ccc(cc1)C(=O)NC 27a_106256046315_100000155074 [0,2,0,0,0,0|1,0,1]=4 4040 B18R1.5201 CCCCCCN(C)c1ccc(cc1)C(=O)NN 27a_106256046315_100000183614 [0,2,0,0,0,0|2,0,0]=4 4041 B18R1.5201 CCCCCCN(C)c1ccc(cc1)C(=O)OC 2230a_100000220287_100000210314 [0,2,0,0,0,0|1,0,1]=4 4042 B18R1.5201 CCCCCCN(C)c1ccc(cc1)C(=O)OC 269982a_100000220287_100000210757 [0,2,0,0,0,0|1,0,1]=4 4043 B18R1.5201 CCCCCCN(C)c1ccc(cc1)C(=O)OC 34a_100000220287_100000210314 [0,2,0,0,0,0|1,0,1]=4 4044 B18R1.5201 CCCCCNC(C)c1ccc(cc1)C(=O)OC 2230a_100000209983_100010159609 [0,2,0,0,0,0|1,0,1]=4 4045 B18R1.5201 CCCCCOC(C)c1ccc(cc1)C(=O)OC 34a_100000036437_100000718602 [0,2,0,0,0,0|1,0,1]=4 4046 B18R1.5201 CCCCCOC(C)c1ccc(cc1)C(=O)OC 7a_100000036437_100000210326 [0,2,0,0,0,0|1,0,1]=4 4047 B18R1.5201 CCCCCOC(C)c1ccc(cc1)C(=O)OC 7a_100000210253_100010159609 [0,2,0,0,0,0|1,0,1]=4 4048 B18R1.5201 CCCCCSC(C)c1ccc(cc1)C(=O)OC 62a_100000210326_100010159609 [0,2,0,0,0,0|1,0,1]=4 4049 B18R1.5201 CCCCCSC(C)c1ccc(cc1)C(=O)OC 62a_100010159609_100000210326 [0,2,0,0,0,0|1,0,1]=4 4050 B18R1.10134 CCCCCC(=O)Cc1ccc(cc1)C(=O)NC 1458a_100000212188_100000753832 [0,2,0,0,0,0|1,0,1]=4 4051 B18R1.10134 CCCCCC(=O)Cc1ccc(cc1)C(=O)OC 1458a_100000212188_100000735637 [0,2,0,0,0,0|1,0,1]=4 4052 B18R1.10134 CCCCCC(=O)Cc1ccc(cc1)C(=O)OC 1458a_100012277402_100000210326 [0,2,0,0,0,0|1,0,1]=4 4053 B18R1.10134 CCCCCC(C)Nc1ccc(cc1)C(=O)NC 2230a_100000184841_200011218191 [0,2,0,0,0,0|1,0,1]=4 4054 B18R1.10134 CCCCCC(C)Nc1ccc(cc1)C(=O)NC 27a_100000211957_100000155074 [0,2,0,0,0,0|1,0,1]=4 4055 B18R1.10134 CCCCCC(C)Nc1ccc(cc1)C(=O)NC 34a_100000184841_200011218191 [0,2,0,0,0,0|1,0,1]=4 4056 B18R1.10134 CCCCCC(C)Nc1ccc(cc1)C(=O)NN 27a_100000211957_100000183614 [0,2,0,0,0,0|2,0,0]=4 4057 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200011218191 [0,2,0,0,0,0|1,0,1]=4 4058 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CC 34a_100000212119_200011218191 [0,2,0,0,0,0|0,0,2]=4 4059 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CC 7a_100000212119_200011218191 [0,2,0,0,0,0|0,0,2]=4 4060 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200011218191 [0,2,0,0,0,0|1,0,1]=4 4061 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CF 34a_200010654591_200011218191 [0,2,0,0,0,0|1,0,1]=4 4062 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)CF 7a_200010654591_200011218191 [0,2,0,0,0,0|1,0,1]=4 4063 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)NC 34a_100000192141_200011218191 [0,2,0,0,0,0|1,0,1]=4 4064 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)NC 7a_100000192141_200011218191 [0,2,0,0,0,0|1,0,1]=4 4065 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)NN 34a_100000185078_200011218191 [0,2,0,0,0,0|2,0,0]=4 4066 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)OC 34a_100000150123_200011218191 [0,2,0,0,0,0|1,0,1]=4 4067 B18R1.10134 CCCCCC(C)Oc1ccc(cc1)C(=O)OC 7a_100000150123_200011218191 [0,2,0,0,0,0|1,0,1]=4 4068 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)C#N 62a_200011218191_100009994572 [0,2,0,0,0,0|1,0,1]=4 4069 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200011218191 [0,2,0,0,0,0|1,0,0]=3 4070 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)C=O 62a_200011218191_100000725942 [0,2,0,0,0,0|1,0,0]=3 4071 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)CN 62a_100000017248_200011218191 [0,2,0,0,0,0|1,0,1]=4 4072 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)CN 62a_200011218191_100000017248 [0,2,0,0,0,0|1,0,1]=4 4073 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)CO 62a_100011219529_200011218191 [0,2,0,0,0,0|1,0,1]=4 4074 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)CO 62a_200011218191_100011219529 [0,2,0,0,0,0|1,0,1]=4 4075 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)NC 62a_100000155074_200011218191 [0,2,0,0,0,0|1,0,1]=4 4076 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)NC 62a_200011218191_100000155074 [0,2,0,0,0,0|1,0,1]=4 4077 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)NN 62a_100000183614_200011218191 [0,2,0,0,0,0|2,0,0]=4 4078 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)NN 62a_200011218191_100000183614 [0,2,0,0,0,0|2,0,0]=4 4079 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)OC 62a_100000150774_200011218191 [0,2,0,0,0,0|1,0,1]=4 4080 B18R1.10134 CCCCCC(C)Sc1ccc(cc1)C(=O)OC 62a_200011218191_100000150774 [0,2,0,0,0,0|1,0,1]=4 4081 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)CBr 26a_100000223495_100009814261 [0,2,0,0,0,0|1,0,1]=4 4082 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)CC 26a_100000223495_100000212119 [0,2,0,0,0,0|0,0,2]=4 4083 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)CCl 26a_100000223495_100000018856 [0,2,0,0,0,0|1,0,1]=4 4084 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)CF 26a_100000223495_200010654591 [0,2,0,0,0,0|1,0,1]=4 4085 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)NC 2230a_100000223495_100000753832 [0,2,0,0,0,0|1,0,1]=4 4086 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)NC 269982a_100000223495_100000753832 [0,2,0,0,0,0|1,0,1]=4 4087 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)NC 270004a_100000223495_100000043907 [0,2,0,0,0,0|1,0,1]=4 4088 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 2230a_100000223495_100000735637 [0,2,0,0,0,0|1,0,1]=4 4089 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 2230a_100000737656_100000210326 [0,2,0,0,0,0|1,0,1]=4 4090 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 269982a_100000223495_100000735637 [0,2,0,0,0,0|1,0,1]=4 4091 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 269982a_100000737656_100000210215 [0,2,0,0,0,0|1,0,1]=4 4092 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 26a_100000223495_100000150123 [0,2,0,0,0,0|1,0,1]=4 4093 B18R1.10134 CCCCCN(C)Cc1ccc(cc1)C(=O)OC 270004a_100000223495_100000148700 [0,2,0,0,0,0|1,0,1]=4 4094 B18R1.40710 CCCCCCNc1ccc(cc1C)C(=O)NC 2230a_100000739472_100000210314 [0,2,0,0,0,0|1,0,1]=4 4095 B18R1.40710 CCCCCCNc1ccc(cc1C)C(=O)NC 27a_100000210581_200013065384 [0,2,0,0,0,0|1,0,1]=4 4096 B18R1.40710 CCCCCCNc1ccc(cc1C)C(=O)NC 34a_100000739472_100000210314 [0,2,0,0,0,0|1,0,1]=4 4097 B18R1.40710 CCCCCCNc1ccc(cc1C)C(=O)NC 7a_100000739472_100000210314 [0,2,0,0,0,0|1,0,1]=4 4098 B18R1.40710 CCCCCCNc1ccc(cc1C)C(=O)NN 27a_100000210581_100012339724 [0,2,0,0,0,0|2,0,0]=4 4099 B18R1.40710 CCCCCCOc1ccc(cc1Br)C(=O)OC 34a_100000216328_100000210314 [0,2,0,0,0,0|1,0,1]=4 4100 B18R1.40710 CCCCCCOc1ccc(cc1Br)C(=O)OC 7a_100000216328_100000210314 [0,2,0,0,0,0|1,0,1]=4 4101 B18R1.40710 CCCCCCOc1ccc(cc1C)C(=O)OC 34a_100011997373_100000210314 [0,2,0,0,0,0|1,0,1]=4 4102 B18R1.40710 CCCCCCOc1ccc(cc1C)C(=O)OC 7a_100011997373_100000210314 [0,2,0,0,0,0|1,0,1]=4 4103 B18R1.40710 CCCCCCOc1ccc(cc1Cl)C(=O)CC 34a_100011218862_100000210314 [0,2,0,0,0,0|0,0,2]=4 4104 B18R1.40710 CCCCCCOc1ccc(cc1Cl)C(=O)CC 7a_100011218862_100000210314 [0,2,0,0,0,0|0,0,2]=4 4105 B18R1.40710 CCCCCCOc1ccc(cc1Cl)C(=O)CCl 7a_200010170092_100000210314 [0,2,0,0,0,0|1,0,1]=4 4106 B18R1.40710 CCCCCCOc1ccc(cc1Cl)C(=O)OC 34a_100000151454_100000210314 [0,2,0,0,0,0|1,0,1]=4 4107 B18R1.40710 CCCCCCOc1ccc(cc1Cl)C(=O)OC 7a_100000151454_100000210314 [0,2,0,0,0,0|1,0,1]=4 4108 B18R1.40710 CCCCCCOc1ccc(cc1F)C(=O)OC 34a_100000075456_100000210314 [0,2,0,0,0,0|1,0,1]=4 4109 B18R1.40710 CCCCCCOc1ccc(cc1F)C(=O)OC 7a_100000075456_100000210314 [0,2,0,0,0,0|1,0,1]=4 4110 B18R1.40710 CCCCCCOc1ccc(cc1I)C(=O)OC 34a_100010162523_100000210314 [0,2,0,0,0,0|1,0,1]=4 4111 B18R1.40710 CCCCCCOc1ccc(cc1I)C(=O)OC 7a_100010162523_100000210314 [0,2,0,0,0,0|1,0,1]=4 4112 B18R1.40710 CCCCCCOc1ccc(cc1N)C(=O)NN 34a_200000039609_100000210314 [0,2,0,0,0,0|2,0,0]=4 4113 B18R1.40710 CCCCCCOc1ccc(cc1N)C(=O)OC 34a_100000724433_100000210314 [0,2,0,0,0,0|1,0,1]=4 4114 B18R1.40710 CCCCCCOc1ccc(cc1N)C(=O)OC 7a_100000724433_100000210314 [0,2,0,0,0,0|1,0,1]=4 4115 B18R1.40710 CCCCCCSc1ccc(cc1Br)C(=O)OC 62a_100000210314_100011294788 [0,2,0,0,0,0|1,0,1]=4 4116 B18R1.40710 CCCCCCSc1ccc(cc1Br)C(=O)OC 62a_100011294788_100000210757 [0,2,0,0,0,0|1,0,1]=4 4117 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)NC 62a_100000210314_200013065384 [0,2,0,0,0,0|1,0,1]=4 4118 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)NC 62a_200013065384_100000210757 [0,2,0,0,0,0|1,0,1]=4 4119 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)NN 62a_100000210314_100012339724 [0,2,0,0,0,0|2,0,0]=4 4120 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)NN 62a_100012339724_100000210757 [0,2,0,0,0,0|2,0,0]=4 4121 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)OC 62a_100000210314_100011215878 [0,2,0,0,0,0|1,0,1]=4 4122 B18R1.40710 CCCCCCSc1ccc(cc1C)C(=O)OC 62a_100011215878_100000210757 [0,2,0,0,0,0|1,0,1]=4 4123 B18R1.40710 CCCCCCSc1ccc(cc1Cl)C(=O)OC 62a_100000210314_100012356344 [0,2,0,0,0,0|1,0,1]=4 4124 B18R1.40710 CCCCCCSc1ccc(cc1Cl)C(=O)OC 62a_100012356344_100000210757 [0,2,0,0,0,0|1,0,1]=4 4125 B18R1.40710 CCCCCCSc1ccc(cc1F)C(=O)CN 62a_100000210314_100016989600 [0,2,0,0,0,0|1,0,1]=4 4126 B18R1.40710 CCCCCCSc1ccc(cc1F)C(=O)CN 62a_100016989600_100000210757 [0,2,0,0,0,0|1,0,1]=4 4127 B18R1.40710 CCCCCCSc1ccc(cc1F)C(=O)OC 62a_100000210314_100000703229 [0,2,0,0,0,0|1,0,1]=4 4128 B18R1.40710 CCCCCCSc1ccc(cc1F)C(=O)OC 62a_100000703229_100000210757 [0,2,0,0,0,0|1,0,1]=4 4129 B18R1.40710 CCCCCCSc1ccc(cc1N)C(=O)OC 62a_100000210314_100011450966 [0,2,0,0,0,0|1,0,1]=4 4130 B18R1.40710 CCCCCCSc1ccc(cc1N)C(=O)OC 62a_100011450966_100000210757 [0,2,0,0,0,0|1,0,1]=4 4131 B18R1.40710 CCCCCCSc1ccc(cc1O)C(=O)OC 62a_100000210314_100012350776 [0,2,0,0,0,0|1,0,1]=4 4132 B18R1.40710 CCCCCCSc1ccc(cc1O)C(=O)OC 62a_100012350776_100000210757 [0,2,0,0,0,0|1,0,1]=4 4133 B18R1.40710 CCCCCNCc1ccc(cc1Br)C(=O)OC 2230a_100000209983_100010201862 [0,2,0,0,0,0|1,0,1]=4 4134 B18R1.40710 CCCCCNCc1ccc(cc1Br)C(=O)OC 270004a_100000209983_100000727569 [0,2,0,0,0,0|1,0,1]=4 4135 B18R1.40710 CCCCCNCc1ccc(cc1C)C(=O)OC 270004a_100000209983_100010289884 [0,2,0,0,0,0|1,0,1]=4 4136 B18R1.40710 CCCCCNCc1ccc(cc1Cl)C(=O)OC 2230a_100000209983_100012194053 [0,2,0,0,0,0|1,0,1]=4 4137 B18R1.40710 CCCCCNCc1ccc(cc1Cl)C(=O)OC 270004a_100000209983_100012179231 [0,2,0,0,0,0|1,0,1]=4 4138 B18R1.40710 CCCCCNCc1ccc(cc1F)C(=O)OC 2230a_100000209983_100000694138 [0,2,0,0,0,0|1,0,1]=4 4139 B18R1.40710 CCCCCNCc1ccc(cc1F)C(=O)OC 270004a_100000209983_100012178685 [0,2,0,0,0,0|1,0,1]=4 4140 B18R1.40710 CCCCCOCc1ccc(cc1Br)C(=O)OC 34a_100000210253_100010201862 [0,2,0,0,0,0|1,0,1]=4 4141 B18R1.40710 CCCCCOCc1ccc(cc1Br)C(=O)OC 34a_100012355398_100000718602 [0,2,0,0,0,0|1,0,1]=4 4142 B18R1.40710 CCCCCOCc1ccc(cc1Br)C(=O)OC 7a_100000210253_100010201862 [0,2,0,0,0,0|1,0,1]=4 4143 B18R1.40710 CCCCCOCc1ccc(cc1Br)C(=O)OC 7a_100012355398_100000210326 [0,2,0,0,0,0|1,0,1]=4 4144 B18R1.40710 CCCCCOCc1ccc(cc1Cl)C(=O)OC 34a_100000210253_100012194053 [0,2,0,0,0,0|1,0,1]=4 4145 B18R1.40710 CCCCCOCc1ccc(cc1Cl)C(=O)OC 7a_100000210253_100012194053 [0,2,0,0,0,0|1,0,1]=4 4146 B18R1.40710 CCCCCOCc1ccc(cc1F)C(=O)OC 34a_100000094453_100000718602 [0,2,0,0,0,0|1,0,1]=4 4147 B18R1.40710 CCCCCOCc1ccc(cc1F)C(=O)OC 34a_100000210253_100000694138 [0,2,0,0,0,0|1,0,1]=4 4148 B18R1.40710 CCCCCOCc1ccc(cc1F)C(=O)OC 7a_100000094453_100000210326 [0,2,0,0,0,0|1,0,1]=4 4149 B18R1.40710 CCCCCOCc1ccc(cc1F)C(=O)OC 7a_100000210253_100000694138 [0,2,0,0,0,0|1,0,1]=4 4150 B18R1.40710 CCCCCSCc1ccc(cc1Br)C(=O)OC 62a_100000210326_100010201862 [0,2,0,0,0,0|1,0,1]=4 4151 B18R1.40710 CCCCCSCc1ccc(cc1Br)C(=O)OC 62a_100010201862_100000210326 [0,2,0,0,0,0|1,0,1]=4 4152 B18R1.40710 CCCCCSCc1ccc(cc1Cl)C(=O)OC 62a_100000210326_100012194053 [0,2,0,0,0,0|1,0,1]=4 4153 B18R1.40710 CCCCCSCc1ccc(cc1Cl)C(=O)OC 62a_100012194053_100000210326 [0,2,0,0,0,0|1,0,1]=4 4154 B18R1.40710 CCCCCSCc1ccc(cc1F)C(=O)OC 62a_100000210326_100000694138 [0,2,0,0,0,0|1,0,1]=4 4155 B18R1.40710 CCCCCSCc1ccc(cc1F)C(=O)OC 62a_100000694138_100000210326 [0,2,0,0,0,0|1,0,1]=4 4156 B18R1.23088 CCCCC(CC)Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200011216223 [0,2,0,0,0,0|2,0,0]=4 4157 B18R1.23088 CCCCC(CC)Sc1ccc(cc1)C(=O)C=O 62a_200011216223_100000725942 [0,2,0,0,0,0|2,0,0]=4 4158 B16R1.1218 CCCCCCCC=Cc1c[nH]ccc1=O 271570a_100134823654_100009998708 [0,0,1,1,0,0|1,0,1]=4 4159 B16R1.1218 CCCCCCCC=Cc1ccc[nH]c1=O 271570a_100134823654_100000050042 [0,0,1,1,0,0|1,0,1]=4 4160 B16R1.1218 CCCCCCCC=Cc1ccccc1N 271570a_100134823654_100000210017 [0,0,1,1,0,0|1,0,1]=4 4161 B16R1.1218 CCCCCCCC=Cc1ccccc1O 271570a_100134823654_100000739446 [0,0,1,1,0,0|0,0,2]=4 4162 B16R2.33724 O=CC(=O)c1ccc(cc1)SCC2CC2 62a_100000725942_100000742324 [1,0,0,1,0,0|2,0,0]=4 4163 B16R2.33724 O=CC(=O)c1ccc(cc1)SCC2CC2 62a_100000756562_100000725942 [1,0,0,1,0,0|2,0,0]=4 4164 B16R2.33727 O=CC(=O)c1ccc(cc1)SC2CCC2 62a_100000725942_100000749161 [1,0,0,1,0,0|2,0,0]=4 4165 B16R2.205486 CCCC=Cc1ccc2c(c1)C=CC2=O 271570a_100016258520_100010210589 [1,0,0,1,0,0|0,0,2]=4 4166 B16R2.205486 CCCCSc1ccc2c(c1)C=CC2=O 62a_100000210211_100010210589 [1,0,0,1,0,0|1,0,0]=3 4167 B16R2.205486 CCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000210210 [1,0,0,1,0,0|1,0,0]=3 4168 B16R2.205486 CCOCSc1ccc2c(c1)C=CC2=O 62a_100000739092_100010210589 [1,0,0,1,0,0|2,0,0]=4 4169 B16R2.205486 CCOCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000739092 [1,0,0,1,0,0|2,0,0]=4 4170 B16R2.205486 COCCSc1ccc2c(c1)C=CC2=O 62a_100000233755_100010210589 [1,0,0,1,0,0|2,0,0]=4 4171 B16R2.205486 COCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000233755 [1,0,0,1,0,0|2,0,0]=4 4172 B16R2.205486 CSCCSc1ccc2c(c1)C=CC2=O 62a_100000212216_100010210589 [1,0,0,1,0,0|2,0,0]=4 4173 B16R2.205486 CSCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000751147 [1,0,0,1,0,0|2,0,0]=4 4174 B16R2.205486 O=C1C=Cc2c1ccc(c2)SCCCF 62a_100010210589_100011934791 [1,0,0,1,0,0|2,0,0]=4 4175 B16R2.205486 O=C1C=Cc2c1ccc(c2)SCCCF 62a_100011934791_100010210589 [1,0,0,1,0,0|2,0,0]=4 4176 B16R2.205486 O=C1C=Cc2c1ccc(c2)SCCCO 62a_100010210589_100011215043 [1,0,0,1,0,0|2,0,0]=4 4177 B16R2.205486 O=C1C=Cc2c1ccc(c2)SCCCO 62a_100011215043_100010210589 [1,0,0,1,0,0|2,0,0]=4 4178 B16R2.85 C=C(C)c1ccc(cc1)C2CCCCC2 271570a_100000694244_100011217854 [1,0,0,1,0,0|1,0,0]=3 4179 B16R2.85 C=C(C)c1ccc(cc1)C2CCCCN2 271570a_100000694244_100010004824 [1,0,0,1,0,0|2,0,0]=4 4180 B16R2.85 C=C(C)c1ccc(cc1)C2CCNCC2 271570a_100000694244_100000727425 [1,0,0,1,0,0|2,0,0]=4 4181 B16R2.85 C=C(C)c1ccc(cc1)C2CCOCC2 271570a_100000694244_100010167726 [1,0,0,1,0,0|2,0,0]=4 4182 B16R2.85 C=C(C)c1ccc(cc1)N2CCCCC2 271570a_100000694244_100011821443 [1,0,0,1,0,0|2,0,0]=4 4183 B16R2.85 C=C(C)c1ccc(cc1)[C@@H]2CCCNC2 271570a_100000694244_106439422950 [1,0,0,1,0,0|2,0,0]=4 4184 B16R2.85 CC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_200000210301 [1,0,0,1,0,0|0,0,1]=3 4185 B16R2.85 CC(=O)c1ccc(cc1)C2CCOCC2 1458a_200010239727_200000210301 [1,0,0,1,0,0|1,0,1]=4 4186 B16R2.85 CC(=O)c1ccc(cc1)N2CCCCC2 1458a_100000759421_200000210301 [1,0,0,1,0,0|1,0,1]=4 4187 B16R2.85 [13CH3]C(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_200025704644 [1,0,0,1,0,0|0,0,1]=3 4188 B16R2.85 [13CH3]C(=O)c1ccc(cc1)C2CCOCC2 1458a_200010239727_200025704644 [1,0,0,1,0,0|1,0,1]=4 4189 B16R2.85 [13CH3]C(=O)c1ccc(cc1)N2CCCCC2 1458a_100000759421_200025704644 [1,0,0,1,0,0|1,0,1]=4 4190 B16R2.481 C=C(C)c1ccc(cc1)CN2CCCC2 26a_100000188435_100009880102 [1,0,0,1,0,0|2,0,0]=4 4191 B16R2.481 C=C(C)c1ccc(cc1)CN2CCCC2 271570a_100000694244_100015186385 [1,0,0,1,0,0|2,0,0]=4 4192 B16R2.481 C=C(C)c1ccc(cc1)OC2CCCC2 271570a_100000694244_100011472759 [1,0,0,1,0,0|2,0,0]=4 4193 B16R2.481 C=C(C)c1ccc(cc1)OC2CCCC2 34a_100009880102_100000179811 [1,0,0,1,0,0|2,0,0]=4 4194 B16R2.481 C=C(C)c1ccc(cc1)OC2CCCC2 7a_100009880102_100000179811 [1,0,0,1,0,0|2,0,0]=4 4195 B16R2.481 C=C(C)c1ccc(cc1)SC2CCCC2 62a_100000185454_100000179811 [1,0,0,1,0,0|2,0,0]=4 4196 B16R2.481 C=C(C)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000185454 [1,0,0,1,0,0|2,0,0]=4 4197 B16R2.481 CC(=O)c1ccc(cc1)CN2CCCC2 1458a_100000188122_200000210301 [1,0,0,1,0,0|1,0,1]=4 4198 B16R2.481 CC(=O)c1ccc(cc1)CN2CCCC2 2230a_100000188435_100000756337 [1,0,0,1,0,0|1,0,1]=4 4199 B16R2.481 CC(=O)c1ccc(cc1)CN2CCCC2 269982a_100000188435_100000756337 [1,0,0,1,0,0|1,0,1]=4 4200 B16R2.481 CC(=O)c1ccc(cc1)CN2CCCC2 26a_100000188435_100000185113 [1,0,0,1,0,0|1,0,1]=4 4201 B16R2.481 CC(=O)c1ccc(cc1)OC2CCCC2 1458a_100000738054_200000210301 [1,0,0,1,0,0|1,0,1]=4 4202 B16R2.481 CC(=O)c1ccc(cc1)OC2CCCC2 34a_100000185113_100000179811 [1,0,0,1,0,0|1,0,1]=4 4203 B16R2.481 CC(=O)c1ccc(cc1)OC2CCCC2 7a_100000185113_100000179811 [1,0,0,1,0,0|1,0,1]=4 4204 B16R2.481 CC(=O)c1ccc(cc1)SC2CCCC2 62a_100000185465_100000179811 [1,0,0,1,0,0|1,0,1]=4 4205 B16R2.481 CC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000185465 [1,0,0,1,0,0|1,0,1]=4 4206 B16R2.481 NC(=O)c1ccc(cc1)CN2CCCC2 2230a_100000188435_100000231043 [1,0,0,1,0,0|2,0,0]=4 4207 B16R2.481 NC(=O)c1ccc(cc1)CN2CCCC2 269982a_100000188435_100000231043 [1,0,0,1,0,0|2,0,0]=4 4208 B16R2.481 NC(=O)c1ccc(cc1)CN2CCCC2 270004a_100000188435_100000038677 [1,0,0,1,0,0|2,0,0]=4 4209 B16R2.481 NC(=O)c1ccc(cc1)NC2CCCC2 27a_100000211070_100000162191 [1,0,0,1,0,0|2,0,0]=4 4210 B16R2.481 NC(=O)c1ccc(cc1)NC2CCCC2 34a_100000210537_100000179811 [1,0,0,1,0,0|2,0,0]=4 4211 B16R2.481 NC(=O)c1ccc(cc1)OC2CCCC2 34a_100000746352_100000179811 [1,0,0,1,0,0|2,0,0]=4 4212 B16R2.481 NC(=O)c1ccc(cc1)OC2CCCC2 7a_100000746352_100000179811 [1,0,0,1,0,0|2,0,0]=4 4213 B16R2.481 NC(=O)c1ccc(cc1)SC2CCCC2 62a_100000162191_100000179811 [1,0,0,1,0,0|2,0,0]=4 4214 B16R2.481 NC(=O)c1ccc(cc1)SC2CCCC2 62a_100011217020_100000162191 [1,0,0,1,0,0|2,0,0]=4 4215 B16R2.481 O=C([O-])c1ccc(cc1)CN2CCCC2 26a_100000188435_100016998105 [1,0,0,1,0,0|2,0,0]=4 4216 B16R2.481 [13CH3]C(=O)c1ccc(cc1)CN2CCCC2 1458a_100000188122_200025704644 [1,0,0,1,0,0|1,0,1]=4 4217 B16R2.481 [13CH3]C(=O)c1ccc(cc1)OC2CCCC2 1458a_100000738054_200025704644 [1,0,0,1,0,0|1,0,1]=4 4218 B16R2.3212 C[C@@H]1CCCN1c2ccc(cc2)C(=O)N 27a_100015189458_100000162191 [1,0,0,1,0,0|2,0,0]=4 4219 B16R2.3212 C[C@H]1CCCN1c2ccc(cc2)C(=O)N 27a_100020605311_100000162191 [1,0,0,1,0,0|2,0,0]=4 4220 B16R2.3287 C=C(C)c1ccc(cc1)CN2CCC2C 26a_100000755817_100009880102 [1,0,0,1,0,0|2,0,0]=4 4221 B16R2.3287 CC(=O)c1ccc(cc1)CN2CCC2C 269982a_100000755817_100000756337 [1,0,0,1,0,0|1,0,1]=4 4222 B16R2.3287 CC(=O)c1ccc(cc1)CN2CCC2C 26a_100000755817_100000185113 [1,0,0,1,0,0|1,0,1]=4 4223 B16R2.3287 CC(=O)c1ccc(cc1)CN2CCC2C 34a_100000755817_100000756337 [1,0,0,1,0,0|1,0,1]=4 4224 B16R2.3287 CC1CCN1Cc2ccc(cc2)C(=O)N 269982a_100000755817_100000231043 [1,0,0,1,0,0|2,0,0]=4 4225 B16R2.3287 CC1CCN1Cc2ccc(cc2)C(=O)N 34a_100000755817_100000231043 [1,0,0,1,0,0|2,0,0]=4 4226 B16R2.3287 CC1CCN1Cc2ccc(cc2)C(=O)[O-] 26a_100000755817_100016998105 [1,0,0,1,0,0|2,0,0]=4 4227 B16R2.27308 C=C(C)c1ccc(cc1)COCC2CC2 271570a_100000694244_100011493758 [1,0,0,1,0,0|2,0,0]=4 4228 B16R2.27308 C=C(C)c1ccc(cc1)OCCC2CC2 34a_100009880102_100000694398 [1,0,0,1,0,0|2,0,0]=4 4229 B16R2.27308 C=C(C)c1ccc(cc1)OCCC2CC2 7a_100009880102_100000764125 [1,0,0,1,0,0|2,0,0]=4 4230 B16R2.27308 C=C(C)c1ccc(cc1)SCCC2CC2 62a_100000185454_100000764125 [1,0,0,1,0,0|2,0,0]=4 4231 B16R2.27308 C=C(C)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000185454 [1,0,0,1,0,0|2,0,0]=4 4232 B16R2.27308 CC(=O)c1ccc(cc1)CCNC2CC2 34a_100000212008_200000038727 [1,0,0,1,0,0|1,0,1]=4 4233 B16R2.27308 CC(=O)c1ccc(cc1)CCSC2CC2 62a_200000038727_100000211595 [1,0,0,1,0,0|1,0,1]=4 4234 B16R2.27308 CC(=O)c1ccc(cc1)CNCC2CC2 2230a_100000735609_100000756337 [1,0,0,1,0,0|1,0,1]=4 4235 B16R2.27308 CC(=O)c1ccc(cc1)CNCC2CC2 34a_100000735609_100000756337 [1,0,0,1,0,0|1,0,1]=4 4236 B16R2.27308 CC(=O)c1ccc(cc1)COCC2CC2 34a_100000211283_100000756337 [1,0,0,1,0,0|1,0,1]=4 4237 B16R2.27308 CC(=O)c1ccc(cc1)COCC2CC2 7a_100000082505_100000742324 [1,0,0,1,0,0|1,0,1]=4 4238 B16R2.27308 CC(=O)c1ccc(cc1)CSCC2CC2 62a_100000756337_100000742324 [1,0,0,1,0,0|1,0,1]=4 4239 B16R2.27308 CC(=O)c1ccc(cc1)CSCC2CC2 62a_100000756562_100000756337 [1,0,0,1,0,0|1,0,1]=4 4240 B16R2.27308 CC(=O)c1ccc(cc1)OCCC2CC2 34a_100000185113_100000694398 [1,0,0,1,0,0|1,0,1]=4 4241 B16R2.27308 CC(=O)c1ccc(cc1)OCCC2CC2 7a_100000185113_100000764125 [1,0,0,1,0,0|1,0,1]=4 4242 B16R2.27308 CC(=O)c1ccc(cc1)SCCC2CC2 62a_100000185465_100000764125 [1,0,0,1,0,0|1,0,1]=4 4243 B16R2.27308 CC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000185465 [1,0,0,1,0,0|1,0,1]=4 4244 B16R2.27308 NC(=O)c1ccc(cc1)CNCC2CC2 207a_100000735609_100000038677 [1,0,0,1,0,0|2,0,0]=4 4245 B16R2.27308 NC(=O)c1ccc(cc1)CNCC2CC2 2230a_100000735609_100000231043 [1,0,0,1,0,0|2,0,0]=4 4246 B16R2.27308 NC(=O)c1ccc(cc1)CNCC2CC2 269862a_100000185037_100000741477 [1,0,0,1,0,0|2,0,0]=4 4247 B16R2.27308 NC(=O)c1ccc(cc1)CNCC2CC2 270004a_100000735609_100000038677 [1,0,0,1,0,0|2,0,0]=4 4248 B16R2.27308 NC(=O)c1ccc(cc1)CNCC2CC2 34a_100000735609_100000231043 [1,0,0,1,0,0|2,0,0]=4 4249 B16R2.27308 NC(=O)c1ccc(cc1)COCC2CC2 34a_100000162016_100000742324 [1,0,0,1,0,0|2,0,0]=4 4250 B16R2.27308 NC(=O)c1ccc(cc1)COCC2CC2 34a_100000211283_100000231043 [1,0,0,1,0,0|2,0,0]=4 4251 B16R2.27308 NC(=O)c1ccc(cc1)COCC2CC2 7a_100000162016_100000742324 [1,0,0,1,0,0|2,0,0]=4 4252 B16R2.27308 NC(=O)c1ccc(cc1)CSCC2CC2 62a_100000231043_100000742324 [1,0,0,1,0,0|2,0,0]=4 4253 B16R2.27308 NC(=O)c1ccc(cc1)CSCC2CC2 62a_100000756562_100000231043 [1,0,0,1,0,0|2,0,0]=4 4254 B16R2.27308 NC(=O)c1ccc(cc1)NCCC2CC2 27a_100000764129_100000162191 [1,0,0,1,0,0|2,0,0]=4 4255 B16R2.27308 NC(=O)c1ccc(cc1)NCCC2CC2 34a_100000210537_100000694398 [1,0,0,1,0,0|2,0,0]=4 4256 B16R2.27308 NC(=O)c1ccc(cc1)OCCC2CC2 34a_100000746352_100000694398 [1,0,0,1,0,0|2,0,0]=4 4257 B16R2.27308 NC(=O)c1ccc(cc1)OCCC2CC2 7a_100000746352_100000764125 [1,0,0,1,0,0|2,0,0]=4 4258 B16R2.27308 NC(=O)c1ccc(cc1)SCCC2CC2 62a_100000162191_100000764125 [1,0,0,1,0,0|2,0,0]=4 4259 B16R2.27308 NC(=O)c1ccc(cc1)SCCC2CC2 62a_100000764125_100000162191 [1,0,0,1,0,0|2,0,0]=4 4260 B16R2.27308 O=C(O)c1ccc(cc1)CCNC2CC2 269956a_100000704756_100000211595 [1,0,0,1,0,0|2,0,0]=4 4261 B16R2.27308 O=C(O)c1ccc(cc1)CNCC2CC2 269956a_100000181780_100000742324 [1,0,0,1,0,0|2,0,0]=4 4262 B16R2.27309 C=C(C)c1ccc(cc1)OCC2CCC2 34a_100009880102_100000763275 [1,0,0,1,0,0|2,0,0]=4 4263 B16R2.27309 C=C(C)c1ccc(cc1)OCC2CCC2 7a_100009880102_100000763275 [1,0,0,1,0,0|2,0,0]=4 4264 B16R2.27309 C=C(C)c1ccc(cc1)SCC2CCC2 62a_100000185454_100000763275 [1,0,0,1,0,0|2,0,0]=4 4265 B16R2.27309 C=C(C)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000185454 [1,0,0,1,0,0|2,0,0]=4 4266 B16R2.27309 CC(=O)c1ccc(cc1)CCN2CCC2 269982a_100000754969_200000038727 [1,0,0,1,0,0|1,0,1]=4 4267 B16R2.27309 CC(=O)c1ccc(cc1)CNC2CCC2 2230a_100000749019_100000756337 [1,0,0,1,0,0|1,0,1]=4 4268 B16R2.27309 CC(=O)c1ccc(cc1)CNC2CCC2 34a_100000749019_100000756337 [1,0,0,1,0,0|1,0,1]=4 4269 B16R2.27309 CC(=O)c1ccc(cc1)COC2CCC2 34a_100000748187_100000756337 [1,0,0,1,0,0|1,0,1]=4 4270 B16R2.27309 CC(=O)c1ccc(cc1)CSC2CCC2 62a_100000756337_100000749161 [1,0,0,1,0,0|1,0,1]=4 4271 B16R2.27309 CC(=O)c1ccc(cc1)OCC2CCC2 34a_100000185113_100000763275 [1,0,0,1,0,0|1,0,1]=4 4272 B16R2.27309 CC(=O)c1ccc(cc1)OCC2CCC2 7a_100000185113_100000763275 [1,0,0,1,0,0|1,0,1]=4 4273 B16R2.27309 CC(=O)c1ccc(cc1)SCC2CCC2 62a_100000185465_100000763275 [1,0,0,1,0,0|1,0,1]=4 4274 B16R2.27309 CC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000185465 [1,0,0,1,0,0|1,0,1]=4 4275 B16R2.27309 NC(=O)c1ccc(cc1)CNC2CCC2 2230a_100000749019_100000231043 [1,0,0,1,0,0|2,0,0]=4 4276 B16R2.27309 NC(=O)c1ccc(cc1)CNC2CCC2 270004a_100000185037_100000241760 [1,0,0,1,0,0|2,0,0]=4 4277 B16R2.27309 NC(=O)c1ccc(cc1)CNC2CCC2 34a_100000749019_100000231043 [1,0,0,1,0,0|2,0,0]=4 4278 B16R2.27309 NC(=O)c1ccc(cc1)COC2CCC2 34a_100000162016_100000749161 [1,0,0,1,0,0|2,0,0]=4 4279 B16R2.27309 NC(=O)c1ccc(cc1)COC2CCC2 34a_100000748187_100000231043 [1,0,0,1,0,0|2,0,0]=4 4280 B16R2.27309 NC(=O)c1ccc(cc1)CSC2CCC2 62a_100000231043_100000749161 [1,0,0,1,0,0|2,0,0]=4 4281 B16R2.27309 NC(=O)c1ccc(cc1)NCC2CCC2 27a_100000738700_100000162191 [1,0,0,1,0,0|2,0,0]=4 4282 B16R2.27309 NC(=O)c1ccc(cc1)NCC2CCC2 34a_100000210537_100000763275 [1,0,0,1,0,0|2,0,0]=4 4283 B16R2.27309 NC(=O)c1ccc(cc1)OCC2CCC2 34a_100000746352_100000763275 [1,0,0,1,0,0|2,0,0]=4 4284 B16R2.27309 NC(=O)c1ccc(cc1)OCC2CCC2 7a_100000746352_100000763275 [1,0,0,1,0,0|2,0,0]=4 4285 B16R2.27309 NC(=O)c1ccc(cc1)SCC2CCC2 62a_100000162191_100000763275 [1,0,0,1,0,0|2,0,0]=4 4286 B16R2.27309 NC(=O)c1ccc(cc1)SCC2CCC2 62a_100000763275_100000162191 [1,0,0,1,0,0|2,0,0]=4 4287 B16R2.27309 O=C(O)c1ccc(cc1)CNC2CCC2 269956a_100000181780_100000749161 [1,0,0,1,0,0|2,0,0]=4 4288 B16R2.7 C=C=Cc1ccc(cc1)C2CCCCC2 271570a_100015277604_100011217854 [1,0,0,1,0,0|0,0,1]=3 4289 B16R2.7 C=C=Cc1ccc(cc1)C2CCCCN2 271570a_100015277604_100010004824 [1,0,0,1,0,0|1,0,1]=4 4290 B16R2.7 C=C=Cc1ccc(cc1)C2CCNCC2 271570a_100015277604_100000727425 [1,0,0,1,0,0|1,0,1]=4 4291 B16R2.7 C=C=Cc1ccc(cc1)C2CCOCC2 271570a_100015277604_100010167726 [1,0,0,1,0,0|1,0,1]=4 4292 B16R2.7 C=C=Cc1ccc(cc1)N2CCCCC2 271570a_100015277604_100011821443 [1,0,0,1,0,0|1,0,1]=4 4293 B16R2.7 C=C=Cc1ccc(cc1)[C@@H]2CCCNC2 271570a_100015277604_106439422950 [1,0,0,1,0,0|1,0,1]=4 4294 B16R2.7 CC=Cc1ccc(cc1)C2CCCCC2 271570a_100016259895_100011217854 [1,0,0,1,0,0|0,0,1]=3 4295 B16R2.7 CC=Cc1ccc(cc1)C2CCCCN2 271570a_100016259895_100010004824 [1,0,0,1,0,0|1,0,1]=4 4296 B16R2.7 CC=Cc1ccc(cc1)C2CCNCC2 271570a_100016259895_100000727425 [1,0,0,1,0,0|1,0,1]=4 4297 B16R2.7 CC=Cc1ccc(cc1)C2CCOCC2 271570a_100016259895_100010167726 [1,0,0,1,0,0|1,0,1]=4 4298 B16R2.7 CC=Cc1ccc(cc1)N2CCCCC2 271570a_100016259895_100011821443 [1,0,0,1,0,0|1,0,1]=4 4299 B16R2.7 CC=Cc1ccc(cc1)[C@@H]2CCCNC2 271570a_100016259895_106439422950 [1,0,0,1,0,0|1,0,1]=4 4300 B16R2.2242 C=CCc1ccc(cc1)CN2CCC2C 26a_100000755817_100000078792 [1,0,0,1,0,0|1,0,1]=4 4301 B16R2.2895 C/C=C/c1ccc(cc1)SC2CCCC2 62a_100011217020_100016259036 [1,0,0,1,0,0|1,0,1]=4 4302 B16R2.2895 C/C=C/c1ccc(cc1)SC2CCCC2 62a_100016259036_100000179811 [1,0,0,1,0,0|1,0,1]=4 4303 B16R2.2895 C=C=Cc1ccc(cc1)CN2CCCC2 271570a_100015277604_100015186385 [1,0,0,1,0,0|1,0,1]=4 4304 B16R2.2895 C=C=Cc1ccc(cc1)OC2CCCC2 271570a_100015277604_100011472759 [1,0,0,1,0,0|1,0,1]=4 4305 B16R2.2895 C=CCc1ccc(cc1)CN2CCCC2 26a_100000188435_100000078792 [1,0,0,1,0,0|1,0,1]=4 4306 B16R2.2895 C=CCc1ccc(cc1)OC2CCCC2 34a_100000078792_100000179811 [1,0,0,1,0,0|1,0,1]=4 4307 B16R2.2895 C=CCc1ccc(cc1)OC2CCCC2 7a_100000078792_100000179811 [1,0,0,1,0,0|1,0,1]=4 4308 B16R2.2895 C=COc1ccc(cc1)SC2CCCC2 62a_100000704263_100000179811 [1,0,0,1,0,0|2,0,0]=4 4309 B16R2.2895 C=COc1ccc(cc1)SC2CCCC2 62a_100011217020_100000704263 [1,0,0,1,0,0|2,0,0]=4 4310 B16R2.2895 CC=Cc1ccc(cc1)CN2CCCC2 271570a_100016259895_100015186385 [1,0,0,1,0,0|1,0,1]=4 4311 B16R2.2895 CC=Cc1ccc(cc1)OC2CCCC2 271570a_100016259895_100011472759 [1,0,0,1,0,0|1,0,1]=4 4312 B16R2.3136 CCCCCNc1ccc2ccoc2c1 34a_100000102395_100000718602 [1,0,0,1,0,0|2,0,0]=4 4313 B16R2.3136 CCCCCNc1ccc2occc2c1 34a_106430523501_100000718602 [1,0,0,1,0,0|2,0,0]=4 4314 B16R2.3136 CCCCCNc1ccc2sccc2c1 34a_100000681076_100000718602 [1,0,0,1,0,0|2,0,0]=4 4315 B16R2.3136 CCCCCOc1ccc2[nH]ccc2c1 34a_100000756620_100000718602 [1,0,0,1,0,0|2,0,0]=4 4316 B16R2.3136 CCCCCOc1ccc2cc[nH]c2c1 34a_100000036713_100000718602 [1,0,0,1,0,0|2,0,0]=4 4317 B16R2.3136 CCCCCOc1ccc2ccoc2c1 34a_100000089557_100000718602 [1,0,0,1,0,0|2,0,0]=4 4318 B16R2.3136 CCCCCOc1ccc2ccoc2c1 7a_100000089557_100000210326 [1,0,0,1,0,0|2,0,0]=4 4319 B16R2.3136 CCCCCOc1ccc2occc2c1 34a_100000070125_100000718602 [1,0,0,1,0,0|2,0,0]=4 4320 B16R2.3136 CCCCCOc1ccc2occc2c1 7a_100000070125_100000210326 [1,0,0,1,0,0|2,0,0]=4 4321 B16R2.3136 CCCCCOc1ccc2sccc2c1 34a_100012180905_100000718602 [1,0,0,1,0,0|2,0,0]=4 4322 B16R2.3136 CCCCCOc1ccc2sccc2c1 7a_100012180905_100000210326 [1,0,0,1,0,0|2,0,0]=4 4323 B16R2.3136 CCCCCSc1ccc2[nH]ccc2c1 62a_100000210326_100000035808 [1,0,0,1,0,0|2,0,0]=4 4324 B16R2.3136 CCCCCSc1ccc2c(c1)C=CC2 62a_100000210326_100009814306 [1,0,0,1,0,0|1,0,1]=4 4325 B16R2.3136 CCCCCSc1ccc2c(c1)C=CC2 62a_100009814306_100000210326 [1,0,0,1,0,0|1,0,1]=4 4326 B16R2.3136 CCCCCSc1ccc2c(c1)CC=C2 62a_100000210326_200009818231 [1,0,0,1,0,0|1,0,1]=4 4327 B16R2.3136 CCCCCSc1ccc2c(c1)CC=C2 62a_200009818231_100000210326 [1,0,0,1,0,0|1,0,1]=4 4328 B16R2.3136 CCCCCSc1ccc2cc[nH]c2c1 62a_100000210326_100000743809 [1,0,0,1,0,0|2,0,0]=4 4329 B16R2.3136 CCCCCSc1ccc2ccoc2c1 62a_100000210326_100000759542 [1,0,0,1,0,0|2,0,0]=4 4330 B16R2.3136 CCCCCSc1ccc2occc2c1 62a_100000210326_100000691453 [1,0,0,1,0,0|2,0,0]=4 4331 B16R2.3136 CCCCNCc1ccc2[nH]ccc2c1 207a_100000102301_100011197475 [1,0,0,1,0,0|2,0,0]=4 4332 B16R2.3136 CCCCNCc1ccc2[nH]ccc2c1 270004a_100000102301_100011197475 [1,0,0,1,0,0|2,0,0]=4 4333 B16R2.3136 CCCCNCc1ccc2cc[nH]c2c1 207a_100000102301_100011218920 [1,0,0,1,0,0|2,0,0]=4 4334 B16R2.3136 CCCCNCc1ccc2cc[nH]c2c1 270004a_100000102301_100011218920 [1,0,0,1,0,0|2,0,0]=4 4335 B16R2.3136 CCCCNCc1ccc2ccsc2c1 207a_100000102301_100000112508 [1,0,0,1,0,0|2,0,0]=4 4336 B16R2.3136 CCCCNCc1ccc2ccsc2c1 270004a_100000102301_100000112508 [1,0,0,1,0,0|2,0,0]=4 4337 B16R2.3136 CCCCNCc1ccc2occc2c1 207a_100000102301_100000040644 [1,0,0,1,0,0|2,0,0]=4 4338 B16R2.3136 CCCCNCc1ccc2occc2c1 2230a_100020591328_100000210211 [1,0,0,1,0,0|2,0,0]=4 4339 B16R2.3136 CCCCNCc1ccc2occc2c1 270004a_100000102301_100000040644 [1,0,0,1,0,0|2,0,0]=4 4340 B16R2.3136 CCCCNCc1ccc2occc2c1 34a_100020591328_100000210210 [1,0,0,1,0,0|2,0,0]=4 4341 B16R2.3136 CCCCNCc1ccc2sccc2c1 207a_100000102301_100000050658 [1,0,0,1,0,0|2,0,0]=4 4342 B16R2.3136 CCCCNCc1ccc2sccc2c1 2230a_100000732457_100000210211 [1,0,0,1,0,0|2,0,0]=4 4343 B16R2.3136 CCCCNCc1ccc2sccc2c1 270004a_100000102301_100000050658 [1,0,0,1,0,0|2,0,0]=4 4344 B16R2.3136 CCCCNCc1ccc2sccc2c1 34a_100000732457_100000210210 [1,0,0,1,0,0|2,0,0]=4 4345 B16R2.3136 CCCCOCc1ccc2ccoc2c1 34a_200009859634_100000210210 [1,0,0,1,0,0|2,0,0]=4 4346 B16R2.3136 CCCCOCc1ccc2ccoc2c1 7a_200009859634_100000210211 [1,0,0,1,0,0|2,0,0]=4 4347 B16R2.3136 CCCCOCc1ccc2ccsc2c1 34a_100010262773_100000210210 [1,0,0,1,0,0|2,0,0]=4 4348 B16R2.3136 CCCCOCc1ccc2ccsc2c1 7a_100010262773_100000210211 [1,0,0,1,0,0|2,0,0]=4 4349 B16R2.3136 CCCCOCc1ccc2occc2c1 34a_100000067418_100000210210 [1,0,0,1,0,0|2,0,0]=4 4350 B16R2.3136 CCCCOCc1ccc2occc2c1 7a_100000067418_100000210211 [1,0,0,1,0,0|2,0,0]=4 4351 B16R2.3136 CCCCOCc1ccc2sccc2c1 34a_100000068000_100000210210 [1,0,0,1,0,0|2,0,0]=4 4352 B16R2.3136 CCCCOCc1ccc2sccc2c1 7a_100000068000_100000210211 [1,0,0,1,0,0|2,0,0]=4 4353 B16R2.3136 CCCOCCc1ccc2sccc2c1 34a_100000087132_100000210303 [1,0,0,1,0,0|2,0,0]=4 4354 B16R2.3136 CCCOCCc1ccc2sccc2c1 7a_100000087132_100000210303 [1,0,0,1,0,0|2,0,0]=4 4355 B16R2.5996 Br/C=C/c1ccc(cc1)SCC2CCC2 62a_100000763275_200016255901 [1,0,0,1,0,0|2,0,0]=4 4356 B16R2.5996 Br/C=C/c1ccc(cc1)SCC2CCC2 62a_200016255901_100000763275 [1,0,0,1,0,0|2,0,0]=4 4357 B16R2.5996 C/C=C/c1ccc(cc1)SCC2CCC2 62a_100000763275_100016259036 [1,0,0,1,0,0|1,0,1]=4 4358 B16R2.5996 C/C=C/c1ccc(cc1)SCC2CCC2 62a_100016259036_100000763275 [1,0,0,1,0,0|1,0,1]=4 4359 B16R2.5996 C=CCc1ccc(cc1)OCC2CCC2 34a_100000078792_100000763275 [1,0,0,1,0,0|1,0,1]=4 4360 B16R2.5996 C=CCc1ccc(cc1)OCC2CCC2 7a_100000078792_100000763275 [1,0,0,1,0,0|1,0,1]=4 4361 B16R2.5996 C=COc1ccc(cc1)SCC2CCC2 62a_100000704263_100000763275 [1,0,0,1,0,0|2,0,0]=4 4362 B16R2.5996 C=COc1ccc(cc1)SCC2CCC2 62a_100000763275_100000704263 [1,0,0,1,0,0|2,0,0]=4 4363 B16R2.11757 Br/C=C/c1ccc(cc1)SCCC2CC2 62a_100000764125_200016255901 [1,0,0,1,0,0|2,0,0]=4 4364 B16R2.11757 Br/C=C/c1ccc(cc1)SCCC2CC2 62a_200016255901_100000764125 [1,0,0,1,0,0|2,0,0]=4 4365 B16R2.11757 C/C=C/c1ccc(cc1)SCCC2CC2 62a_100000764125_100016259036 [1,0,0,1,0,0|1,0,1]=4 4366 B16R2.11757 C/C=C/c1ccc(cc1)SCCC2CC2 62a_100016259036_100000764125 [1,0,0,1,0,0|1,0,1]=4 4367 B16R2.11757 C=C=Cc1ccc(cc1)COCC2CC2 271570a_100015277604_100011493758 [1,0,0,1,0,0|1,0,1]=4 4368 B16R2.11757 C=CCc1ccc(cc1)OCCC2CC2 34a_100000078792_100000694398 [1,0,0,1,0,0|1,0,1]=4 4369 B16R2.11757 C=CCc1ccc(cc1)OCCC2CC2 7a_100000078792_100000764125 [1,0,0,1,0,0|1,0,1]=4 4370 B16R2.11757 C=COc1ccc(cc1)SCCC2CC2 62a_100000704263_100000764125 [1,0,0,1,0,0|2,0,0]=4 4371 B16R2.11757 C=COc1ccc(cc1)SCCC2CC2 62a_100000764125_100000704263 [1,0,0,1,0,0|2,0,0]=4 4372 B16R2.11757 CC=Cc1ccc(cc1)COCC2CC2 271570a_100016259895_100011493758 [1,0,0,1,0,0|1,0,1]=4 4373 B18R2.2609 C=CC(=O)Nc1ccc(cc1)C2CCCCC2 1626a_100011205399_100000185746 [0,0,0,1,0,1|0,0,0]=2 4374 B18R2.2609 C=CC(=O)Nc1ccc(cc1)C2CCCCC2 22a_100011205399_100000185746 [0,0,0,1,0,1|0,0,0]=2 4375 B18R2.2609 C=CC(=O)Nc1ccc(cc1)C2CCOCC2 1626a_100000103822_100000185746 [0,0,0,1,0,1|1,0,0]=3 4376 B18R2.2609 C=CC(=O)Nc1ccc(cc1)C2CCOCC2 22a_100000103822_100000185746 [0,0,0,1,0,1|1,0,0]=3 4377 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCCCC2 1626a_100000680803_100000185746 [0,0,0,1,0,1|1,0,0]=3 4378 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCCCC2 22a_100000680803_100000185746 [0,0,0,1,0,1|1,0,0]=3 4379 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCOCC2 1626a_100000183583_100000185746 [0,0,0,1,0,1|2,0,0]=4 4380 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCOCC2 22a_100000183583_100000185746 [0,0,0,1,0,1|2,0,0]=4 4381 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCSCC2 1626a_100000759945_100000185746 [0,0,0,1,0,1|2,0,0]=4 4382 B18R2.2609 C=CC(=O)Nc1ccc(cc1)N2CCSCC2 22a_100000759945_100000185746 [0,0,0,1,0,1|2,0,0]=4 4383 B18R2.2609 CCC(=O)Nc1ccc(cc1)C2CCCCC2 11a_100011205399_100000210414 [0,0,0,1,0,1|0,0,2]=4 4384 B18R2.2609 CCC(=O)Nc1ccc(cc1)C2CCCCC2 1626a_100011205399_100000210414 [0,0,0,1,0,1|0,0,2]=4 4385 B18R2.2609 CCC(=O)Nc1ccc(cc1)C2CCCCC2 22a_100011205399_100000210414 [0,0,0,1,0,1|0,0,2]=4 4386 B18R2.2609 CCC(=O)Nc1ccc(cc1)C2CCCCC2 527a_100011205399_100000210414 [0,0,0,1,0,1|0,0,2]=4 4387 B18R2.2609 CNC(=O)Nc1ccc(cc1)C2CCCCC2 2430a_100011205399_100102657272 [0,0,0,1,0,1|1,0,1]=4 4388 B18R2.2609 O=C(CO)Nc1ccc(cc1)C2CCCCC2 22a_100011205399_100000210174 [0,0,0,1,0,1|1,0,1]=4 4389 B18R2.2609 O=C(CO)Nc1ccc(cc1)C2CCCCC2 527a_100011205399_100000210174 [0,0,0,1,0,1|1,0,1]=4 4390 B18R2.13825 C=CC(=O)Nc1ccc(cc1)CN2CCC2C 26a_100000755817_100011235904 [0,0,0,1,0,1|1,0,0]=3 4391 B18R2.36301 CCCCC=Cc1ccc2[nH]c(=O)ccc2c1 271570a_100016275911_100011934725 [0,0,0,1,0,1|0,0,2]=4 4392 B18R2.36301 CCCCC=Cc1ccc2oc(=O)ccc2c1 271570a_100016275911_100009999946 [0,0,0,1,0,1|0,0,2]=4 4393 B18R2.36301 CCCCCNc1ccc2nc(ccc2c1)C 34a_100011216442_100000718602 [0,0,0,1,0,1|2,0,0]=4 4394 B18R2.36301 CCCCCNc1ccc2oc(=O)ccc2c1 7a_100000008519_100000210326 [0,0,0,1,0,1|1,0,0]=3 4395 B18R2.36301 CCCCCOc1ccc2cc(ccc2c1)C 34a_100000074090_100000718602 [0,0,0,1,0,1|2,0,0]=4 4396 B18R2.36301 CCCCCOc1ccc2cc(ccc2c1)C 7a_100000074090_100000210326 [0,0,0,1,0,1|2,0,0]=4 4397 B18R2.36301 CCCCCOc1ccc2cc(ccc2c1)F 34a_100009847029_100000718602 [0,0,0,1,0,1|2,0,0]=4 4398 B18R2.36301 CCCCCOc1ccc2cc(ccc2c1)F 7a_100009847029_100000210326 [0,0,0,1,0,1|2,0,0]=4 4399 B18R2.36301 CCCCCOc1ccc2nc(ccc2c1)C 34a_100000037634_100000718602 [0,0,0,1,0,1|2,0,0]=4 4400 B18R2.36301 CCCCCOc1ccc2nc(ccc2c1)C 7a_100000037634_100000210326 [0,0,0,1,0,1|2,0,0]=4 4401 B18R2.36301 CCCCCOc1ccc2nc(ccc2c1)Cl 34a_100009849208_100000718602 [0,0,0,1,0,1|2,0,0]=4 4402 B18R2.36301 CCCCCOc1ccc2nc(ccc2c1)Cl 7a_100009849208_100000210326 [0,0,0,1,0,1|2,0,0]=4 4403 B18R2.36301 CCCCCOc1ccc2oc(=O)ccc2c1 34a_100000066265_100000718602 [0,0,0,1,0,1|1,0,0]=3 4404 B18R2.36301 CCCCCOc1ccc2oc(=O)ccc2c1 7a_100000066265_100000210326 [0,0,0,1,0,1|1,0,0]=3 4405 B18R2.36301 CCCCCSc1ccc2[nH]c(=O)ccc2c1 62a_100000210326_100011934725 [0,0,0,1,0,1|1,0,0]=3 4406 B18R2.36301 CCCCCSc1ccc2[nH]c(=O)cnc2c1 62a_100000210326_100010209493 [0,0,0,1,0,1|2,0,0]=4 4407 B18R2.36301 CCCCCSc1ccc2cc(ccc2c1)N 62a_100000185457_100000210326 [0,0,0,1,0,1|2,0,0]=4 4408 B18R2.36301 CCCCCSc1ccc2cc(ccc2c1)N 62a_100000210326_100000185457 [0,0,0,1,0,1|2,0,0]=4 4409 B18R2.36301 CCCCCSc1ccc2cc(ccc2c1)O 62a_100000210326_100000185455 [0,0,0,1,0,1|1,0,1]=4 4410 B18R2.36301 CCCCCSc1ccc2nc(ccc2c1)C 62a_100000210326_100000686635 [0,0,0,1,0,1|2,0,0]=4 4411 B18R2.36301 CCCCCSc1ccc2nc(ccc2c1)C 62a_100000686635_100000210326 [0,0,0,1,0,1|2,0,0]=4 4412 B18R2.36301 CCCCCSc1ccc2nc(ccc2c1)N 62a_100011934619_100000210326 [0,0,0,1,0,1|2,0,0]=4 4413 B18R2.36301 CCCCCSc1ccc2oc(=O)ccc2c1 62a_100000210326_100009999946 [0,0,0,1,0,1|1,0,0]=3 4414 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)Br 207a_100000102301_100012356508 [0,0,0,1,0,1|2,0,0]=4 4415 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)Br 2230a_100000102301_100012356510 [0,0,0,1,0,1|2,0,0]=4 4416 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)Br 270004a_100000102301_100012356508 [0,0,0,1,0,1|2,0,0]=4 4417 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)Br 7a_106832991798_100012356510 [0,0,0,1,0,1|2,0,0]=4 4418 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)O 207a_100000102301_100000067190 [0,0,0,1,0,1|1,0,1]=4 4419 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)O 270004a_100000102301_100000067190 [0,0,0,1,0,1|1,0,1]=4 4420 B18R2.36301 CCCCNCc1ccc2cc(ccc2c1)O 34a_200000083168_100000210210 [0,0,0,1,0,1|1,0,1]=4 4421 B18R2.36301 CCCCNCc1ccc2nc(ccc2c1)C 207a_100000102301_100000709793 [0,0,0,1,0,1|2,0,0]=4 4422 B18R2.36301 CCCCNCc1ccc2nc(ccc2c1)C 270004a_100000102301_100000709793 [0,0,0,1,0,1|2,0,0]=4 4423 B18R2.36301 CCCCNCc1ccc2nc(ccc2c1)Cl 270004a_100000102301_100000087602 [0,0,0,1,0,1|2,0,0]=4 4424 B18R2.36301 CCCCNCc1ccc2oc(=O)ccc2c1 2230a_100000102301_200010983872 [0,0,0,1,0,1|1,0,0]=3 4425 B18R2.36301 CCCCNCc1ccc2oc(=O)ccc2c1 270004a_100000102301_100000036638 [0,0,0,1,0,1|1,0,0]=3 4426 B18R2.36301 CCCCNCc1ccc2oc(=O)ccc2c1 7a_106832991798_200010983872 [0,0,0,1,0,1|1,0,0]=3 4427 B18R2.36301 CCCCOCc1ccc2cc(ccc2c1)Br 34a_100000210227_100012356510 [0,0,0,1,0,1|2,0,0]=4 4428 B18R2.36301 CCCCOCc1ccc2cc(ccc2c1)Br 34a_100012356509_100000210210 [0,0,0,1,0,1|2,0,0]=4 4429 B18R2.36301 CCCCOCc1ccc2cc(ccc2c1)Br 7a_100000210227_100012356510 [0,0,0,1,0,1|2,0,0]=4 4430 B18R2.36301 CCCCOCc1ccc2cc(ccc2c1)Br 7a_100012356509_100000210211 [0,0,0,1,0,1|2,0,0]=4 4431 B18R2.36301 CCCCOCc1ccc2nc(ccc2c1)C 34a_100011934618_100000210210 [0,0,0,1,0,1|2,0,0]=4 4432 B18R2.36301 CCCCOCc1ccc2oc(=O)ccc2c1 7a_100000210227_200010983872 [0,0,0,1,0,1|1,0,0]=3 4433 B18R2.36301 CCCCSCc1ccc2oc(=O)ccc2c1 62a_100000210211_200010983872 [0,0,0,1,0,1|1,0,0]=3 4434 B18R2.36301 CCOCCNc1ccc2oc(=O)ccc2c1 7a_100000008519_100011215890 [0,0,0,1,0,1|2,0,0]=4 4435 B18R2.36301 CCOCCOc1ccc2oc(=O)ccc2c1 34a_100000066265_100000210147 [0,0,0,1,0,1|2,0,0]=4 4436 B18R2.36301 CCOCCOc1ccc2oc(=O)ccc2c1 7a_100000066265_100011215890 [0,0,0,1,0,1|2,0,0]=4 4437 B18R2.36301 CCOCCSc1ccc2[nH]c(=O)ccc2c1 62a_100000210147_100011934725 [0,0,0,1,0,1|2,0,0]=4 4438 B18R2.36301 CCOCCSc1ccc2oc(=O)ccc2c1 62a_100000210147_100009999946 [0,0,0,1,0,1|2,0,0]=4 4439 B18R2.36301 CCOCSCc1ccc2oc(=O)ccc2c1 62a_100000739092_200010983872 [0,0,0,1,0,1|2,0,0]=4 4440 B18R2.36301 CCSCCNc1ccc2oc(=O)ccc2c1 7a_100000008519_100000757381 [0,0,0,1,0,1|2,0,0]=4 4441 B18R2.36301 CCSCCOc1ccc2oc(=O)ccc2c1 34a_100000066265_100000757381 [0,0,0,1,0,1|2,0,0]=4 4442 B18R2.36301 CCSCCOc1ccc2oc(=O)ccc2c1 7a_100000066265_100000757381 [0,0,0,1,0,1|2,0,0]=4 4443 B18R2.36301 CCSCCSc1ccc2[nH]c(=O)ccc2c1 62a_100000757381_100011934725 [0,0,0,1,0,1|2,0,0]=4 4444 B18R2.36301 CCSCCSc1ccc2oc(=O)ccc2c1 62a_100000757381_100009999946 [0,0,0,1,0,1|2,0,0]=4 4445 B18R2.36301 COCCCNc1ccc2oc(=O)ccc2c1 7a_100000008519_100000740836 [0,0,0,1,0,1|2,0,0]=4 4446 B18R2.36301 COCCCOc1ccc2oc(=O)ccc2c1 34a_100000066265_100000740836 [0,0,0,1,0,1|2,0,0]=4 4447 B18R2.36301 COCCCOc1ccc2oc(=O)ccc2c1 7a_100000066265_100000740836 [0,0,0,1,0,1|2,0,0]=4 4448 B18R2.36301 COCCCSc1ccc2[nH]c(=O)ccc2c1 62a_100000709357_100011934725 [0,0,0,1,0,1|2,0,0]=4 4449 B18R2.36301 COCCCSc1ccc2oc(=O)ccc2c1 62a_100000709357_100009999946 [0,0,0,1,0,1|2,0,0]=4 4450 B18R2.36301 COCCNCc1ccc2oc(=O)ccc2c1 2230a_100000209980_200010983872 [0,0,0,1,0,1|2,0,0]=4 4451 B18R2.36301 COCCNCc1ccc2oc(=O)ccc2c1 270004a_100000209980_100000036638 [0,0,0,1,0,1|2,0,0]=4 4452 B18R2.36301 COCCSCc1ccc2oc(=O)ccc2c1 62a_100000233755_200010983872 [0,0,0,1,0,1|2,0,0]=4 4453 B18R2.36301 CSCCNCc1ccc2oc(=O)ccc2c1 2230a_100020590264_200010983872 [0,0,0,1,0,1|2,0,0]=4 4454 B18R2.36301 CSCCNCc1ccc2oc(=O)ccc2c1 270004a_100020590264_100000036638 [0,0,0,1,0,1|2,0,0]=4 4455 B18R2.36301 CSCCOCc1ccc2oc(=O)ccc2c1 7a_100000230434_200010983872 [0,0,0,1,0,1|2,0,0]=4 4456 B18R2.36301 CSCCSCc1ccc2oc(=O)ccc2c1 62a_100000212216_200010983872 [0,0,0,1,0,1|2,0,0]=4 4457 B18R2.36301 O=c1ccc2cc(ccc2[nH]1)SCCCCF 62a_100000729493_100011934725 [0,0,0,1,0,1|2,0,0]=4 4458 B18R2.36301 O=c1ccc2cc(ccc2[nH]1)SCCCCO 62a_100000210776_100011934725 [0,0,0,1,0,1|2,0,0]=4 4459 B18R2.36301 O=c1ccc2cc(ccc2o1)CNCCCF 2230a_100015189416_200010983872 [0,0,0,1,0,1|2,0,0]=4 4460 B18R2.36301 O=c1ccc2cc(ccc2o1)CNCCCF 270004a_100015189416_100000036638 [0,0,0,1,0,1|2,0,0]=4 4461 B18R2.36301 O=c1ccc2cc(ccc2o1)CNCCCO 270004a_100000182051_100000036638 [0,0,0,1,0,1|2,0,0]=4 4462 B18R2.36301 O=c1ccc2cc(ccc2o1)CSCCCF 62a_100011934791_200010983872 [0,0,0,1,0,1|2,0,0]=4 4463 B18R2.36301 O=c1ccc2cc(ccc2o1)CSCCCO 62a_100011215043_200010983872 [0,0,0,1,0,1|2,0,0]=4 4464 B18R2.36301 O=c1ccc2cc(ccc2o1)NCCCCF 7a_100000008519_100000729493 [0,0,0,1,0,1|2,0,0]=4 4465 B18R2.36301 O=c1ccc2cc(ccc2o1)NCCCCO 7a_100000008519_100000210776 [0,0,0,1,0,1|2,0,0]=4 4466 B18R2.36301 O=c1ccc2cc(ccc2o1)OCCCCF 34a_100000066265_100000729493 [0,0,0,1,0,1|2,0,0]=4 4467 B18R2.36301 O=c1ccc2cc(ccc2o1)OCCCCF 7a_100000066265_100000729493 [0,0,0,1,0,1|2,0,0]=4 4468 B18R2.36301 O=c1ccc2cc(ccc2o1)OCCCCO 34a_100000066265_100011216708 [0,0,0,1,0,1|2,0,0]=4 4469 B18R2.36301 O=c1ccc2cc(ccc2o1)OCCCCO 7a_100000066265_100000210776 [0,0,0,1,0,1|2,0,0]=4 4470 B18R2.36301 O=c1ccc2cc(ccc2o1)SCCCCF 62a_100000729493_100009999946 [0,0,0,1,0,1|2,0,0]=4 4471 B18R2.36301 O=c1ccc2cc(ccc2o1)SCCCCO 62a_100000210776_100009999946 [0,0,0,1,0,1|2,0,0]=4 4472 B18R2.36307 CCCCCSc1ccc2c(c1)C(=O)C(=O)N2 62a_100000024671_100000210326 [0,0,0,1,0,1|2,0,0]=4 4473 B18R2.36307 CCCCCSc1ccc2c(c1)C(=O)C(=O)N2 62a_100000210326_100000024671 [0,0,0,1,0,1|2,0,0]=4 4474 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CC2CCCC2 1626a_200009976745_100000185746 [0,0,0,1,0,1|0,0,0]=2 4475 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CC2CCCC2 22a_200009976745_100000185746 [0,0,0,1,0,1|0,0,0]=2 4476 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CN2CCCC2 1626a_100000187206_100000185746 [0,0,0,1,0,1|1,0,0]=3 4477 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CN2CCCC2 22a_100000187206_100000185746 [0,0,0,1,0,1|1,0,0]=3 4478 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CN2CCCC2 26a_100000188435_100011235904 [0,0,0,1,0,1|1,0,0]=3 4479 B18R2.126844 C=CC(=O)Nc1ccc(cc1)CN2CCSC2 26a_100011215254_100011235904 [0,0,0,1,0,1|2,0,0]=4 4480 B18R2.126844 C=CC(=O)Nc1ccc(cc1)OC2CCCC2 1626a_200000740385_100000185746 [0,0,0,1,0,1|1,0,0]=3 4481 B18R2.126844 C=CC(=O)Nc1ccc(cc1)OC2CCCC2 22a_200000740385_100000185746 [0,0,0,1,0,1|1,0,0]=3 4482 B18R2.126844 C=CC(=O)Nc1ccc(cc1)OC2CCCC2 34a_100011235904_100000179811 [0,0,0,1,0,1|1,0,0]=3 4483 B18R2.126844 C=CC(=O)Nc1ccc(cc1)OC2CCOC2 34a_100011235904_100000690089 [0,0,0,1,0,1|2,0,0]=4 4484 B18R2.126844 CCC(=O)Nc1ccc(cc1)CC2CCCC2 11a_200009976745_100000210414 [0,0,0,1,0,1|0,0,2]=4 4485 B18R2.126844 CCC(=O)Nc1ccc(cc1)CC2CCCC2 1626a_200009976745_100000210414 [0,0,0,1,0,1|0,0,2]=4 4486 B18R2.126844 CCC(=O)Nc1ccc(cc1)CC2CCCC2 22a_200009976745_100000210414 [0,0,0,1,0,1|0,0,2]=4 4487 B18R2.126844 CCC(=O)Nc1ccc(cc1)CC2CCCC2 527a_200009976745_100000210414 [0,0,0,1,0,1|0,0,2]=4 4488 B18R2.126844 CNC(=O)Nc1ccc(cc1)CC2CCCC2 2430a_200009976745_100102657272 [0,0,0,1,0,1|1,0,1]=4 4489 B18R2.126844 O=C(CO)Nc1ccc(cc1)CC2CCCC2 22a_200009976745_100000210174 [0,0,0,1,0,1|1,0,1]=4 4490 B18R2.126844 O=C(CO)Nc1ccc(cc1)CC2CCCC2 527a_200009976745_100000210174 [0,0,0,1,0,1|1,0,1]=4 4491 B18R2.147927 C=CC(=O)Nc1ccc(cc1)OCC2CCC2 34a_100011235904_100000763275 [0,0,0,1,0,1|1,0,0]=3 4492 B18R2.147927 C=CC(=O)Nc1ccc(cc1)OCC2CCO2 34a_100011235904_100000103362 [0,0,0,1,0,1|2,0,0]=4 4493 B18R2.147927 C=CC(=O)Nc1ccc(cc1)OCC2COC2 34a_100011235904_100010264016 [0,0,0,1,0,1|2,0,0]=4 4494 B18R2.776316 C=CC(=O)Nc1ccc2c(c1)N(CCC2)CC 1626a_100011636486_100000185746 [0,0,0,1,0,1|1,0,0]=3 4495 B18R2.776316 C=CC(=O)Nc1ccc2c(c1)N(CCC2)CC 22a_100011636486_100000185746 [0,0,0,1,0,1|1,0,0]=3 4496 B18R2.912288 C=CC(=O)Nc1ccc(cc1)OCCC2CC2 34a_100011235904_100000694398 [0,0,0,1,0,1|1,0,0]=3 4497 B18R2.912288 C=CC(=O)Nc1ccc(cc1)OCCC2CO2 34a_100011235904_100000732470 [0,0,0,1,0,1|2,0,0]=4 4498 B18R2.4565 CCCCCSc1ccc2c(c[nH]c2c1)C=O 62a_100000210326_100011361519 [0,1,0,1,0,0|2,0,0]=4 4499 B18R2.583487 CCCCC=Cc1ccc2c(=O)ccoc2c1 271570a_100016275911_100010062221 [0,1,0,1,0,0|0,0,2]=4 4500 B18R2.583487 CCCCCNc1cc2[nH]ccc(=O)c2cn1 27a_100000209983_100000101246 [0,1,0,1,0,0|2,0,0]=4 4501 B18R2.583487 CCCCCNc1ccc2c(=O)[nH]cnc2c1 27a_100000209983_100000230960 [0,1,0,1,0,0|2,0,0]=4 4502 B18R2.583487 CCCCCNc1ccc2c(cccc2c1)O 34a_100000035793_100000718602 [0,1,0,1,0,0|1,0,1]=4 4503 B18R2.583487 CCCCCNc1ccc2c(cccc2c1)O 7a_100000035793_100000210326 [0,1,0,1,0,0|1,0,1]=4 4504 B18R2.583487 CCCCCNc1ccc2c(ccnc2c1)Cl 27a_100000209983_100009996786 [0,1,0,1,0,0|2,0,0]=4 4505 B18R2.583487 CCCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000718602 [0,1,0,1,0,0|1,0,0]=3 4506 B18R2.583487 CCCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000210326 [0,1,0,1,0,0|1,0,0]=3 4507 B18R2.583487 CCCCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000718602 [0,1,0,1,0,0|1,0,0]=3 4508 B18R2.583487 CCCCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100000210326 [0,1,0,1,0,0|1,0,0]=3 4509 B18R2.583487 CCCCCOc1ccc2c(cccc2c1)N 34a_100000034668_100000718602 [0,1,0,1,0,0|2,0,0]=4 4510 B18R2.583487 CCCCCOc1ccc2c(cccc2c1)N 7a_100000034668_100000210326 [0,1,0,1,0,0|2,0,0]=4 4511 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)Br 34a_100010204257_100000718602 [0,1,0,1,0,0|2,0,0]=4 4512 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)Br 7a_100010204257_100000210326 [0,1,0,1,0,0|2,0,0]=4 4513 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)C 34a_200009854145_100000718602 [0,1,0,1,0,0|2,0,0]=4 4514 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)C 7a_200009854145_100000210326 [0,1,0,1,0,0|2,0,0]=4 4515 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)Cl 34a_100000045489_100000718602 [0,1,0,1,0,0|2,0,0]=4 4516 B18R2.583487 CCCCCOc1ccc2c(ccnc2c1)Cl 7a_100000045489_100000210326 [0,1,0,1,0,0|2,0,0]=4 4517 B18R2.583487 CCCCCOc1ccc2c(nccc2c1)Cl 34a_100009867704_100000718602 [0,1,0,1,0,0|2,0,0]=4 4518 B18R2.583487 CCCCCOc1ccc2c(nccc2c1)Cl 7a_100009867704_100000210326 [0,1,0,1,0,0|2,0,0]=4 4519 B18R2.583487 CCCCCSc1cc2[nH]ccc(=O)c2cn1 62a_100000210326_100000101246 [0,1,0,1,0,0|2,0,0]=4 4520 B18R2.583487 CCCCCSc1cc2cc[nH]c(=O)c2cn1 62a_100010134373_100000210326 [0,1,0,1,0,0|2,0,0]=4 4521 B18R2.583487 CCCCCSc1ccc2c(=O)[nH]cnc2c1 62a_100000210326_100000230960 [0,1,0,1,0,0|2,0,0]=4 4522 B18R2.583487 CCCCCSc1ccc2c(=O)ccoc2c1 62a_100000210326_100010062221 [0,1,0,1,0,0|1,0,0]=3 4523 B18R2.583487 CCCCCSc1ccc2c(cccc2c1)N 62a_100000210326_100010090037 [0,1,0,1,0,0|2,0,0]=4 4524 B18R2.583487 CCCCCSc1ccc2c(cccc2c1)N 62a_100010090037_100000210326 [0,1,0,1,0,0|2,0,0]=4 4525 B18R2.583487 CCCCCSc1ccc2c(cccc2c1)O 62a_100000210326_100010202202 [0,1,0,1,0,0|1,0,1]=4 4526 B18R2.583487 CCCCCSc1ccc2c(ccnc2c1)C 62a_100000210326_100010132309 [0,1,0,1,0,0|2,0,0]=4 4527 B18R2.583487 CCCCCSc1ccc2c(ccnc2c1)C 62a_100010132309_100000210326 [0,1,0,1,0,0|2,0,0]=4 4528 B18R2.583487 CCCCCSc1ccc2c(ccnc2c1)N 62a_200009816820_100000210326 [0,1,0,1,0,0|2,0,0]=4 4529 B18R2.583487 CCCCCSc1ccc2c(ccnc2c1)O 62a_100000210326_100000756855 [0,1,0,1,0,0|1,0,1]=4 4530 B18R2.583487 CCCCCSc1ccc2c(nccc2c1)N 62a_100000210326_100000732483 [0,1,0,1,0,0|2,0,0]=4 4531 B18R2.583487 CCCCCSc1ccc2c(nccc2c1)N 62a_100000732483_100000210326 [0,1,0,1,0,0|2,0,0]=4 4532 B18R2.583487 CCCCCSc1ccc2c(nccc2c1)O 62a_100000210326_100000760485 [0,1,0,1,0,0|1,0,1]=4 4533 B18R2.583487 CCOCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000210147 [0,1,0,1,0,0|2,0,0]=4 4534 B18R2.583487 CCOCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100011215890 [0,1,0,1,0,0|2,0,0]=4 4535 B18R2.583487 CCOCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000210147 [0,1,0,1,0,0|2,0,0]=4 4536 B18R2.583487 CCOCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100011215890 [0,1,0,1,0,0|2,0,0]=4 4537 B18R2.583487 CCOCCSc1ccc2c(=O)ccoc2c1 62a_100000210147_100010062221 [0,1,0,1,0,0|2,0,0]=4 4538 B18R2.583487 CCSCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000757381 [0,1,0,1,0,0|2,0,0]=4 4539 B18R2.583487 CCSCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000757381 [0,1,0,1,0,0|2,0,0]=4 4540 B18R2.583487 CCSCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000757381 [0,1,0,1,0,0|2,0,0]=4 4541 B18R2.583487 CCSCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100000757381 [0,1,0,1,0,0|2,0,0]=4 4542 B18R2.583487 CCSCCSc1ccc2c(=O)ccoc2c1 62a_100000757381_100010062221 [0,1,0,1,0,0|2,0,0]=4 4543 B18R2.583487 COCCCOc1ccc2c(=O)[nH]ccc2c1 34a_100009857879_100000740836 [0,1,0,1,0,0|2,0,0]=4 4544 B18R2.583487 COCCCOc1ccc2c(=O)[nH]ccc2c1 7a_100009857879_100000740836 [0,1,0,1,0,0|2,0,0]=4 4545 B18R2.583487 COCCCOc1ccc2c(=O)ccoc2c1 34a_200000065989_100000740836 [0,1,0,1,0,0|2,0,0]=4 4546 B18R2.583487 COCCCOc1ccc2c(=O)ccoc2c1 7a_200000065989_100000740836 [0,1,0,1,0,0|2,0,0]=4 4547 B18R2.583487 COCCCSc1ccc2c(=O)ccoc2c1 62a_100000709357_100010062221 [0,1,0,1,0,0|2,0,0]=4 4548 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCF 34a_100009857879_100000729493 [0,1,0,1,0,0|2,0,0]=4 4549 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCF 7a_100009857879_100000729493 [0,1,0,1,0,0|2,0,0]=4 4550 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCO 34a_100009857879_100011216708 [0,1,0,1,0,0|2,0,0]=4 4551 B18R2.583487 O=c1[nH]ccc2c1ccc(c2)OCCCCO 7a_100009857879_100000210776 [0,1,0,1,0,0|2,0,0]=4 4552 B18R2.583487 O=c1ccoc2c1ccc(c2)OCCCCF 34a_200000065989_100000729493 [0,1,0,1,0,0|2,0,0]=4 4553 B18R2.583487 O=c1ccoc2c1ccc(c2)OCCCCF 7a_200000065989_100000729493 [0,1,0,1,0,0|2,0,0]=4 4554 B18R2.583487 O=c1ccoc2c1ccc(c2)OCCCCO 34a_200000065989_100011216708 [0,1,0,1,0,0|2,0,0]=4 4555 B18R2.583487 O=c1ccoc2c1ccc(c2)OCCCCO 7a_200000065989_100000210776 [0,1,0,1,0,0|2,0,0]=4 4556 B18R2.583487 O=c1ccoc2c1ccc(c2)SCCCCF 62a_100000729493_100010062221 [0,1,0,1,0,0|2,0,0]=4 4557 B18R2.583487 O=c1ccoc2c1ccc(c2)SCCCCO 62a_100000210776_100010062221 [0,1,0,1,0,0|2,0,0]=4 4558 B18R2.583499 CCCCCSc1ccc2c(c1)NC(=O)C2=O 62a_100000210326_100000049690 [0,1,0,1,0,0|2,0,0]=4 4559 B18R2.583499 CCCCCSc1ccc2c(c1)NC(=O)C2=O 62a_100000239657_100000210326 [0,1,0,1,0,0|2,0,0]=4 4560 B18R2.182 CCCCCCc1ccc(cc1)C2=CCOC2 271570a_100009872500_100009814338 [0,1,0,1,0,0|0,0,2]=4 4561 B18R2.182 CCCCCCc1ccc(cc1)C2=COCC2 271570a_100000118173_100009814338 [0,1,0,1,0,0|1,0,1]=4 4562 B18R2.182 CCCCCCc1ccc(cc1)c2c[nH]cn2 271570a_100000033946_100000756875 [0,1,0,1,0,0|1,0,0]=3 4563 B18R2.182 CCCCCCc1ccc(cc1)c2cc[nH]c2 271570a_100000102155_100009814338 [0,1,0,1,0,0|1,0,0]=3 4564 B18R2.182 CCCCCCc1ccc(cc1)c2cc[nH]n2 271570a_100000033946_100000062575 [0,1,0,1,0,0|1,0,0]=3 4565 B18R2.182 CCCCCCc1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100009814338 [0,1,0,1,0,0|1,0,0]=3 4566 B18R2.182 CCCCCCc1ccc(cc1)c2ccsn2 271570a_100000033946_100009818082 [0,1,0,1,0,0|0,1,0]=3 4567 B18R2.182 CCCCCCc1ccc(cc1)c2cn[nH]c2 271570a_100000033946_100000238712 [0,1,0,1,0,0|2,0,0]=4 4568 B18R2.182 CCCCCCc1ccc(cc1)c2cn[nH]c2 271570a_100000041997_100009814338 [0,1,0,1,0,0|2,0,0]=4 4569 B18R2.182 CCCCCCc1ccc(cc1)c2cnco2 271570a_100000033946_100020591547 [0,1,0,1,0,0|0,0,1]=3 4570 B18R2.182 CCCCCCc1ccc(cc1)c2cncs2 271570a_100000033946_100011934649 [0,1,0,1,0,0|0,1,0]=3 4571 B18R2.182 CCCCCCc1ccc(cc1)c2cncs2 271570a_100010231675_100009814338 [0,1,0,1,0,0|0,1,0]=3 4572 B18R2.182 CCCCCCc1ccc(cc1)c2cnoc2 271570a_100000033946_100009815712 [0,1,0,1,0,0|1,0,1]=4 4573 B18R2.182 CCCCCCc1ccc(cc1)c2cnsc2 271570a_100000033946_100009815736 [0,1,0,1,0,0|1,1,0]=4 4574 B18R2.182 CCCCCCc1ccc(cc1)c2cscn2 271570a_100000033946_100000751502 [0,1,0,1,0,0|1,0,0]=3 4575 B18R2.182 CCCCCCc1ccc(cc1)c2nc[nH]n2 271570a_100000033946_100000761765 [0,1,0,1,0,0|2,0,0]=4 4576 B18R2.182 CCCCCCc1ccc(cc1)c2ncc[nH]2 271570a_100000033946_100025796157 [0,1,0,1,0,0|1,0,0]=3 4577 B18R2.182 CCCCCCc1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100009814338 [0,1,0,1,0,0|1,0,0]=3 4578 B18R2.182 CCCCCCc1ccc(cc1)c2ncco2 271570a_100000033946_100011787736 [0,1,0,1,0,0|0,0,1]=3 4579 B18R2.182 CCCCCCc1ccc(cc1)c2nccs2 271570a_100000033946_100000211983 [0,1,0,1,0,0|0,1,0]=3 4580 B18R2.182 CCCCCCc1ccc(cc1)c2ncns2 271570a_100000033946_100000693119 [0,1,0,1,0,0|1,1,0]=4 4581 B18R2.182 CCCCCCc1ccc(cc1)c2nncs2 271570a_100000033946_100000739804 [0,1,0,1,0,0|1,1,0]=4 4582 B18R2.182 CCCCCNc1ccc(cc1)c2ccco2 2230a_100011217094_100000210326 [0,1,0,1,0,0|1,0,1]=4 4583 B18R2.182 CCCCCNc1ccc(cc1)c2ccco2 34a_100011217094_100000718602 [0,1,0,1,0,0|1,0,1]=4 4584 B18R2.182 CCCCCNc1ccc(cc1)c2ccno2 34a_100011233752_100000718602 [0,1,0,1,0,0|1,0,1]=4 4585 B18R2.182 CCCCCNc1ccc(cc1)c2cnco2 34a_100000041625_100000718602 [0,1,0,1,0,0|1,0,1]=4 4586 B18R2.182 CCCCCNc1ccc(cc1)c2cncs2 2230a_100000123287_100000210326 [0,1,0,1,0,0|1,1,0]=4 4587 B18R2.182 CCCCCNc1ccc(cc1)c2cncs2 34a_100000123287_100000718602 [0,1,0,1,0,0|1,1,0]=4 4588 B18R2.182 CCCCCNc1ccc(cc1)c2ncco2 34a_100000695477_100000718602 [0,1,0,1,0,0|1,0,1]=4 4589 B18R2.182 CCCCCNc1ccc(cc1)c2nccs2 34a_100000741104_100000718602 [0,1,0,1,0,0|1,1,0]=4 4590 B18R2.182 CCCCCOc1ccc(cc1)c2c[nH]cn2 271570a_100011216715_100000756875 [0,1,0,1,0,0|2,0,0]=4 4591 B18R2.182 CCCCCOc1ccc(cc1)c2cc[nH]c2 271570a_100000102155_200011214818 [0,1,0,1,0,0|2,0,0]=4 4592 B18R2.182 CCCCCOc1ccc(cc1)c2cc[nH]n2 271570a_100000062414_200011214818 [0,1,0,1,0,0|2,0,0]=4 4593 B18R2.182 CCCCCOc1ccc(cc1)c2cc[nH]n2 271570a_100011216715_100000062575 [0,1,0,1,0,0|2,0,0]=4 4594 B18R2.182 CCCCCOc1ccc(cc1)c2ccco2 271570a_100000750936_200011214818 [0,1,0,1,0,0|1,0,1]=4 4595 B18R2.182 CCCCCOc1ccc(cc1)c2ccco2 271570a_100011216715_100009814098 [0,1,0,1,0,0|1,0,1]=4 4596 B18R2.182 CCCCCOc1ccc(cc1)c2cccs2 271570a_100000742291_200011214818 [0,1,0,1,0,0|1,1,0]=4 4597 B18R2.182 CCCCCOc1ccc(cc1)c2cccs2 271570a_100011216715_100011215356 [0,1,0,1,0,0|1,1,0]=4 4598 B18R2.182 CCCCCOc1ccc(cc1)c2cccs2 34a_200011934525_100000718602 [0,1,0,1,0,0|1,1,0]=4 4599 B18R2.182 CCCCCOc1ccc(cc1)c2cccs2 7a_200011934525_100000210326 [0,1,0,1,0,0|1,1,0]=4 4600 B18R2.182 CCCCCOc1ccc(cc1)c2ccoc2 271570a_100011216715_100011215275 [0,1,0,1,0,0|1,0,1]=4 4601 B18R2.182 CCCCCOc1ccc(cc1)c2ccoc2 271570a_100011218838_200011214818 [0,1,0,1,0,0|1,0,1]=4 4602 B18R2.182 CCCCCOc1ccc(cc1)c2ccsc2 271570a_100011216715_100000738268 [0,1,0,1,0,0|1,1,0]=4 4603 B18R2.182 CCCCCOc1ccc(cc1)c2ccsc2 271570a_100011934443_200011214818 [0,1,0,1,0,0|1,1,0]=4 4604 B18R2.182 CCCCCOc1ccc(cc1)c2ccsc2 34a_200011934557_100000718602 [0,1,0,1,0,0|1,1,0]=4 4605 B18R2.182 CCCCCOc1ccc(cc1)c2ccsc2 7a_200011934557_100000210326 [0,1,0,1,0,0|1,1,0]=4 4606 B18R2.182 CCCCCOc1ccc(cc1)c2ccsn2 271570a_100011216715_100009818082 [0,1,0,1,0,0|1,1,0]=4 4607 B18R2.182 CCCCCOc1ccc(cc1)c2cnco2 271570a_100011216715_100020591547 [0,1,0,1,0,0|1,0,1]=4 4608 B18R2.182 CCCCCOc1ccc(cc1)c2cnco2 34a_100000048733_100000718602 [0,1,0,1,0,0|1,0,1]=4 4609 B18R2.182 CCCCCOc1ccc(cc1)c2cnco2 7a_100000048733_100000210326 [0,1,0,1,0,0|1,0,1]=4 4610 B18R2.182 CCCCCOc1ccc(cc1)c2cncs2 271570a_100010231675_200011214818 [0,1,0,1,0,0|1,1,0]=4 4611 B18R2.182 CCCCCOc1ccc(cc1)c2cncs2 271570a_100011216715_100011934649 [0,1,0,1,0,0|1,1,0]=4 4612 B18R2.182 CCCCCOc1ccc(cc1)c2cscn2 271570a_100011216715_100000751502 [0,1,0,1,0,0|2,0,0]=4 4613 B18R2.182 CCCCCOc1ccc(cc1)c2ncc[nH]2 271570a_100011216715_100025796157 [0,1,0,1,0,0|2,0,0]=4 4614 B18R2.182 CCCCCOc1ccc(cc1)c2ncc[nH]2 271570a_100016988920_200011214818 [0,1,0,1,0,0|2,0,0]=4 4615 B18R2.182 CCCCCOc1ccc(cc1)c2ncc[nH]2 34a_200000748570_100000718602 [0,1,0,1,0,0|2,0,0]=4 4616 B18R2.182 CCCCCOc1ccc(cc1)c2ncco2 271570a_100011216715_100011787736 [0,1,0,1,0,0|1,0,1]=4 4617 B18R2.182 CCCCCOc1ccc(cc1)c2nccs2 271570a_100011216715_100000211983 [0,1,0,1,0,0|1,1,0]=4 4618 B18R2.182 CCCCCOc1ccc(cc1)c2nccs2 34a_100000744836_100000718602 [0,1,0,1,0,0|1,1,0]=4 4619 B18R2.182 CCCCCSc1ccc(cc1)c2c[nH]cn2 62a_100000210326_100009812454 [0,1,0,1,0,0|2,0,0]=4 4620 B18R2.182 CCCCCSc1ccc(cc1)c2c[nH]cn2 62a_100009812454_100000210326 [0,1,0,1,0,0|2,0,0]=4 4621 B18R2.182 CCCCCSc1ccc(cc1)c2ccn[nH]2 62a_100000210326_100020649029 [0,1,0,1,0,0|2,0,0]=4 4622 B18R2.182 CCCCCSc1ccc(cc1)c2ccn[nH]2 62a_100020649029_100000210326 [0,1,0,1,0,0|2,0,0]=4 4623 B18R2.182 CCCCCSc1ccc(cc1)c2ccno2 62a_100000210326_100011216027 [0,1,0,1,0,0|1,0,1]=4 4624 B18R2.182 CCCCCSc1ccc(cc1)c2ccno2 62a_100011216027_100000210326 [0,1,0,1,0,0|1,0,1]=4 4625 B18R2.182 CCCCCSc1ccc(cc1)c2ccon2 62a_100000210326_200011934941 [0,1,0,1,0,0|1,0,1]=4 4626 B18R2.182 CCCCCSc1ccc(cc1)c2ccon2 62a_200011934941_100000210326 [0,1,0,1,0,0|1,0,1]=4 4627 B18R2.182 CCCCCSc1ccc(cc1)c2cnco2 62a_100000210326_100009814239 [0,1,0,1,0,0|1,0,1]=4 4628 B18R2.182 CCCCCSc1ccc(cc1)c2cnco2 62a_100009814239_100000210326 [0,1,0,1,0,0|1,0,1]=4 4629 B18R2.182 CCCCCSc1ccc(cc1)c2ncc[nH]2 62a_100000210326_100011393233 [0,1,0,1,0,0|2,0,0]=4 4630 B18R2.182 CCCCCSc1ccc(cc1)c2ncc[nH]2 62a_100011393233_100000210326 [0,1,0,1,0,0|2,0,0]=4 4631 B18R2.182 CCCCCSc1ccc(cc1)c2ncco2 62a_100000210326_200010153272 [0,1,0,1,0,0|1,0,1]=4 4632 B18R2.182 CCCCCSc1ccc(cc1)c2ncco2 62a_200010153272_100000210326 [0,1,0,1,0,0|1,0,1]=4 4633 B18R2.182 CCCCNCc1ccc(cc1)c2cc[nH]c2 271570a_100000102155_100015187156 [0,1,0,1,0,0|2,0,0]=4 4634 B18R2.182 CCCCNCc1ccc(cc1)c2cc[nH]n2 271570a_100000062414_100015187156 [0,1,0,1,0,0|2,0,0]=4 4635 B18R2.182 CCCCNCc1ccc(cc1)c2ccco2 207a_100000102301_200011217180 [0,1,0,1,0,0|1,0,1]=4 4636 B18R2.182 CCCCNCc1ccc(cc1)c2ccco2 270004a_100000102301_200011217180 [0,1,0,1,0,0|1,0,1]=4 4637 B18R2.182 CCCCNCc1ccc(cc1)c2ccco2 271570a_100000750936_100015187156 [0,1,0,1,0,0|1,0,1]=4 4638 B18R2.182 CCCCNCc1ccc(cc1)c2cccs2 207a_100000102301_100011216026 [0,1,0,1,0,0|1,1,0]=4 4639 B18R2.182 CCCCNCc1ccc(cc1)c2cccs2 2230a_100011219452_100000210211 [0,1,0,1,0,0|1,1,0]=4 4640 B18R2.182 CCCCNCc1ccc(cc1)c2cccs2 270004a_100000102301_100011216026 [0,1,0,1,0,0|1,1,0]=4 4641 B18R2.182 CCCCNCc1ccc(cc1)c2cccs2 271570a_100000742291_100015187156 [0,1,0,1,0,0|1,1,0]=4 4642 B18R2.182 CCCCNCc1ccc(cc1)c2cccs2 34a_100011219452_100000210210 [0,1,0,1,0,0|1,1,0]=4 4643 B18R2.182 CCCCNCc1ccc(cc1)c2ccoc2 271570a_100011218838_100015187156 [0,1,0,1,0,0|1,0,1]=4 4644 B18R2.182 CCCCNCc1ccc(cc1)c2ccsc2 207a_100000102301_100011217181 [0,1,0,1,0,0|1,1,0]=4 4645 B18R2.182 CCCCNCc1ccc(cc1)c2ccsc2 2230a_100032749009_100000210211 [0,1,0,1,0,0|1,1,0]=4 4646 B18R2.182 CCCCNCc1ccc(cc1)c2ccsc2 270004a_100000102301_100011217181 [0,1,0,1,0,0|1,1,0]=4 4647 B18R2.182 CCCCNCc1ccc(cc1)c2ccsc2 271570a_100011934443_100015187156 [0,1,0,1,0,0|1,1,0]=4 4648 B18R2.182 CCCCNCc1ccc(cc1)c2ccsc2 34a_100032749009_100000210210 [0,1,0,1,0,0|1,1,0]=4 4649 B18R2.182 CCCCNCc1ccc(cc1)c2cnco2 2230a_200000083221_100000210211 [0,1,0,1,0,0|1,0,1]=4 4650 B18R2.182 CCCCNCc1ccc(cc1)c2cncs2 271570a_100010231675_100015187156 [0,1,0,1,0,0|1,1,0]=4 4651 B18R2.182 CCCCNCc1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100015187156 [0,1,0,1,0,0|2,0,0]=4 4652 B18R2.182 CCCCNCc1ccc(cc1)c2nccs2 207a_100000102301_100000050456 [0,1,0,1,0,0|1,1,0]=4 4653 B18R2.182 CCCCNCc1ccc(cc1)c2nccs2 2230a_100011934871_100000210211 [0,1,0,1,0,0|1,1,0]=4 4654 B18R2.182 CCCCNCc1ccc(cc1)c2nccs2 270004a_100000102301_100000050456 [0,1,0,1,0,0|1,1,0]=4 4655 B18R2.182 CCCCNCc1ccc(cc1)c2nccs2 34a_100011934871_100000210210 [0,1,0,1,0,0|1,1,0]=4 4656 B18R2.182 CCCCOCc1ccc(cc1)c2ccco2 34a_100000067678_100000210210 [0,1,0,1,0,0|1,0,1]=4 4657 B18R2.182 CCCCOCc1ccc(cc1)c2ccco2 7a_100000067678_100000210211 [0,1,0,1,0,0|1,0,1]=4 4658 B18R2.182 CCCCOCc1ccc(cc1)c2cccs2 34a_100000067679_100000210210 [0,1,0,1,0,0|1,1,0]=4 4659 B18R2.182 CCCCOCc1ccc(cc1)c2cccs2 7a_100000067679_100000210211 [0,1,0,1,0,0|1,1,0]=4 4660 B18R2.182 CCCCOCc1ccc(cc1)c2ccsc2 34a_100000067682_100000210210 [0,1,0,1,0,0|1,1,0]=4 4661 B18R2.182 CCCCOCc1ccc(cc1)c2ccsc2 7a_100000067682_100000210211 [0,1,0,1,0,0|1,1,0]=4 4662 B18R2.182 CCCCOCc1ccc(cc1)c2nccs2 34a_100000069957_100000210210 [0,1,0,1,0,0|1,1,0]=4 4663 B18R2.182 CCCCSCc1ccc(cc1)c2c[nH]cn2 271570a_200012348848_100000756875 [0,1,0,1,0,0|2,0,0]=4 4664 B18R2.182 CCCCSCc1ccc(cc1)c2cc[nH]n2 271570a_200012348848_100000062575 [0,1,0,1,0,0|2,0,0]=4 4665 B18R2.182 CCCCSCc1ccc(cc1)c2ccco2 271570a_200012348848_100009814098 [0,1,0,1,0,0|1,0,1]=4 4666 B18R2.182 CCCCSCc1ccc(cc1)c2ccoc2 271570a_200012348848_100011215275 [0,1,0,1,0,0|1,0,1]=4 4667 B18R2.182 CCCCSCc1ccc(cc1)c2ccsn2 271570a_200012348848_100009818082 [0,1,0,1,0,0|1,1,0]=4 4668 B18R2.182 CCCCSCc1ccc(cc1)c2cnco2 271570a_200012348848_100020591547 [0,1,0,1,0,0|1,0,1]=4 4669 B18R2.182 CCCCSCc1ccc(cc1)c2cncs2 271570a_200012348848_100011934649 [0,1,0,1,0,0|1,1,0]=4 4670 B18R2.182 CCCCSCc1ccc(cc1)c2cscn2 271570a_200012348848_100000751502 [0,1,0,1,0,0|2,0,0]=4 4671 B18R2.182 CCCCSCc1ccc(cc1)c2ncc[nH]2 271570a_200012348848_100025796157 [0,1,0,1,0,0|2,0,0]=4 4672 B18R2.182 CCCCSCc1ccc(cc1)c2ncco2 271570a_200012348848_100011787736 [0,1,0,1,0,0|1,0,1]=4 4673 B18R2.182 CCCCSCc1ccc(cc1)c2nccs2 271570a_200012348848_100000211983 [0,1,0,1,0,0|1,1,0]=4 4674 B18R2.228 C#CCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000184674 [0,1,0,1,0,0|0,0,2]=4 4675 B18R2.228 C=CCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000210623 [0,1,0,1,0,0|0,0,0]=2 4676 B18R2.228 C=CCC(=O)c1ccc(cc1)C2CCOCC2 1458a_200010239727_100000210623 [0,1,0,1,0,0|1,0,0]=3 4677 B18R2.228 C=CCC(=O)c1ccc(cc1)C2SCCCS2 1458a_100000017732_100000210623 [0,1,0,1,0,0|2,0,0]=4 4678 B18R2.228 C=CCC(=O)c1ccc(cc1)N2CCCCC2 1458a_100000759421_100000210623 [0,1,0,1,0,0|1,0,0]=3 4679 B18R2.228 C=CCC(=O)c1ccc(cc1)N2CCOCC2 1458a_100000747244_100000210623 [0,1,0,1,0,0|2,0,0]=4 4680 B18R2.228 CCCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000210303 [0,1,0,1,0,0|0,0,2]=4 4681 B18R2.228 CCNC(=O)c1ccc(cc1)C2CCCCC2 11a_100015525214_100000185286 [0,1,0,1,0,0|0,0,2]=4 4682 B18R2.228 CCNC(=O)c1ccc(cc1)C2CCCCC2 240690a_100015525214_100000185286 [0,1,0,1,0,0|0,0,2]=4 4683 B18R2.228 CCNC(=O)c1ccc(cc1)C2CCCCC2 527a_100015525214_100000185286 [0,1,0,1,0,0|0,0,2]=4 4684 B18R2.228 CNCC(=O)c1ccc(cc1)C2CCCCC2 2230a_106832991635_100000183778 [0,1,0,1,0,0|0,0,2]=4 4685 B18R2.228 CNCC(=O)c1ccc(cc1)C2CCCCC2 34a_100102657272_100000183778 [0,1,0,1,0,0|0,0,2]=4 4686 B18R2.228 CNCC(=O)c1ccc(cc1)C2CCCCC2 7a_106832991635_100000183778 [0,1,0,1,0,0|0,0,2]=4 4687 B18R2.228 CNNC(=O)c1ccc(cc1)C2CCCCC2 22a_100016993582_100000185286 [0,1,0,1,0,0|1,0,1]=4 4688 B18R2.228 COCC(=O)c1ccc(cc1)C2CCCCC2 34a_100138415774_100000183778 [0,1,0,1,0,0|0,0,2]=4 4689 B18R2.228 CSCC(=O)c1ccc(cc1)C2CCCCC2 62a_100000183778_200000210301 [0,1,0,1,0,0|0,0,2]=4 4690 B18R2.228 CSCC(=O)c1ccc(cc1)C2CCCCC2 62a_200000210301_100000183778 [0,1,0,1,0,0|0,0,2]=4 4691 B18R2.228 N#CCC(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100011214920 [0,1,0,1,0,0|0,0,2]=4 4692 B18R2.228 O=C(CCF)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100011217306 [0,1,0,1,0,0|0,0,2]=4 4693 B18R2.228 O=C(CCO)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000211926 [0,1,0,1,0,0|0,0,2]=4 4694 B18R2.228 [13CH3]SCC(=O)c1ccc(cc1)C2CCCCC2 62a_100000183778_200025704644 [0,1,0,1,0,0|0,0,2]=4 4695 B18R2.228 [13CH3]SCC(=O)c1ccc(cc1)C2CCCCC2 62a_200025704644_100000183778 [0,1,0,1,0,0|0,0,2]=4 4696 B18R2.8102 C=CCC(=O)c1ccc(cc1)CN2CCCC2 1458a_100000188122_100000210623 [0,1,0,1,0,0|1,0,0]=3 4697 B18R2.8102 C=CCC(=O)c1ccc(cc1)OC2CCCC2 1458a_100000738054_100000210623 [0,1,0,1,0,0|1,0,0]=3 4698 B18R2.8102 O=C/C=C(/Cl)\c1ccc(cc1)SC2CCCC2 62a_100011217020_200020603514 [0,1,0,1,0,0|2,0,0]=4 4699 B18R2.8102 O=C/C=C(/Cl)\c1ccc(cc1)SC2CCCC2 62a_200020603514_100000179811 [0,1,0,1,0,0|2,0,0]=4 4700 B18R2.81304 O=C/C=C(/Cl)\c1ccc(cc1)SCCC2CC2 62a_100000764125_200020603514 [0,1,0,1,0,0|2,0,0]=4 4701 B18R2.81304 O=C/C=C(/Cl)\c1ccc(cc1)SCCC2CC2 62a_200020603514_100000764125 [0,1,0,1,0,0|2,0,0]=4 4702 B18R2.81305 O=C/C=C(/Cl)\c1ccc(cc1)SCC2CCC2 62a_100000763275_200020603514 [0,1,0,1,0,0|2,0,0]=4 4703 B18R2.81305 O=C/C=C(/Cl)\c1ccc(cc1)SCC2CCC2 62a_200020603514_100000763275 [0,1,0,1,0,0|2,0,0]=4 4704 B18R2.583496 CCCCCOc1ccc2c(c1)C(=O)NC2=O 7a_100000101950_100000210326 [0,1,0,1,0,0|2,0,0]=4 4705 B18R2.583496 CCCCCOc1ccc2c(c1)C(=O)OC2=O 7a_100000030292_100000210326 [0,1,0,1,0,0|2,0,0]=4 4706 B18R2.583496 CCCCCSc1ccc2c(c1)C(=O)CC2=O 62a_100009997049_100000210326 [0,1,0,1,0,0|1,0,1]=4 4707 B18R2.583496 CCCCCSc1ccc2c(c1)C(=O)NC2=O 62a_100000185758_100000210326 [0,1,0,1,0,0|2,0,0]=4 4708 B18R2.9387 CCC(=O)c1ccc(cc1)OCC2CCCC2 34a_100000212119_100000740388 [0,1,0,1,0,0|0,0,2]=4 4709 B18R2.9387 CCC(=O)c1ccc(cc1)OCC2CCCC2 7a_100000212119_100000740388 [0,1,0,1,0,0|0,0,2]=4 4710 B18R2.9387 CCC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000211647_100000740388 [0,1,0,1,0,0|0,0,2]=4 4711 B18R2.9387 CCC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000211647 [0,1,0,1,0,0|0,0,2]=4 4712 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 207a_100000211070_100000043907 [0,1,0,1,0,0|1,0,1]=4 4713 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 2230a_100000211070_100000753832 [0,1,0,1,0,0|1,0,1]=4 4714 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 2230a_100000743749_100000179811 [0,1,0,1,0,0|1,0,1]=4 4715 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 270004a_100000211070_100000043907 [0,1,0,1,0,0|1,0,1]=4 4716 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 270004a_100000743749_100000210133 [0,1,0,1,0,0|1,0,1]=4 4717 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 34a_100000211070_100000753832 [0,1,0,1,0,0|1,0,1]=4 4718 B18R2.9387 CNC(=O)c1ccc(cc1)CNC2CCCC2 34a_100000743749_100000179811 [0,1,0,1,0,0|1,0,1]=4 4719 B18R2.9387 CNC(=O)c1ccc(cc1)COC2CCCC2 34a_100000210269_100000753832 [0,1,0,1,0,0|1,0,1]=4 4720 B18R2.9387 CNC(=O)c1ccc(cc1)COC2CCCC2 7a_100000210269_100000753832 [0,1,0,1,0,0|1,0,1]=4 4721 B18R2.9387 CNC(=O)c1ccc(cc1)CSC2CCCC2 62a_100000753832_100000179811 [0,1,0,1,0,0|1,0,1]=4 4722 B18R2.9387 CNC(=O)c1ccc(cc1)CSC2CCCC2 62a_100011217020_100000753832 [0,1,0,1,0,0|1,0,1]=4 4723 B18R2.9387 CNC(=O)c1ccc(cc1)NCC2CCCC2 2230a_100000184841_100000740388 [0,1,0,1,0,0|1,0,1]=4 4724 B18R2.9387 CNC(=O)c1ccc(cc1)NCC2CCCC2 27a_100000737975_100000155074 [0,1,0,1,0,0|1,0,1]=4 4725 B18R2.9387 CNC(=O)c1ccc(cc1)NCC2CCCC2 34a_100000184841_100000740388 [0,1,0,1,0,0|1,0,1]=4 4726 B18R2.9387 CNC(=O)c1ccc(cc1)OCC2CCCC2 34a_100000192141_100000740388 [0,1,0,1,0,0|1,0,1]=4 4727 B18R2.9387 CNC(=O)c1ccc(cc1)OCC2CCCC2 7a_100000192141_100000740388 [0,1,0,1,0,0|1,0,1]=4 4728 B18R2.9387 CNC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000155074_100000740388 [0,1,0,1,0,0|1,0,1]=4 4729 B18R2.9387 CNC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000155074 [0,1,0,1,0,0|1,0,1]=4 4730 B18R2.9387 COC(=O)c1ccc(cc1)CCN2CCCC2 2230a_100000188435_100010192280 [0,1,0,1,0,0|1,0,1]=4 4731 B18R2.9387 COC(=O)c1ccc(cc1)CCN2CCCC2 269982a_100000188435_100010192280 [0,1,0,1,0,0|1,0,1]=4 4732 B18R2.9387 COC(=O)c1ccc(cc1)CNC2CCCC2 2230a_100000211070_100000735637 [0,1,0,1,0,0|1,0,1]=4 4733 B18R2.9387 COC(=O)c1ccc(cc1)CNC2CCCC2 270004a_100000211070_100000148700 [0,1,0,1,0,0|1,0,1]=4 4734 B18R2.9387 COC(=O)c1ccc(cc1)CNC2CCCC2 34a_100000211070_100000735637 [0,1,0,1,0,0|1,0,1]=4 4735 B18R2.9387 COC(=O)c1ccc(cc1)COC2CCCC2 34a_100000151488_100000179811 [0,1,0,1,0,0|1,0,1]=4 4736 B18R2.9387 COC(=O)c1ccc(cc1)COC2CCCC2 34a_100000210269_100000735637 [0,1,0,1,0,0|1,0,1]=4 4737 B18R2.9387 COC(=O)c1ccc(cc1)COC2CCCC2 7a_100000151488_100000179811 [0,1,0,1,0,0|1,0,1]=4 4738 B18R2.9387 COC(=O)c1ccc(cc1)COC2CCCC2 7a_100000210269_100000735637 [0,1,0,1,0,0|1,0,1]=4 4739 B18R2.9387 COC(=O)c1ccc(cc1)CSC2CCCC2 62a_100000735637_100000179811 [0,1,0,1,0,0|1,0,1]=4 4740 B18R2.9387 COC(=O)c1ccc(cc1)CSC2CCCC2 62a_100011217020_100000187170 [0,1,0,1,0,0|1,0,1]=4 4741 B18R2.9387 COC(=O)c1ccc(cc1)OCC2CCCC2 34a_100000150123_100000740388 [0,1,0,1,0,0|1,0,1]=4 4742 B18R2.9387 COC(=O)c1ccc(cc1)OCC2CCCC2 7a_100000150123_100000740388 [0,1,0,1,0,0|1,0,1]=4 4743 B18R2.9387 COC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000150774_100000740388 [0,1,0,1,0,0|1,0,1]=4 4744 B18R2.9387 COC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000150774 [0,1,0,1,0,0|1,0,1]=4 4745 B18R2.9387 N#CC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100009994572 [0,1,0,1,0,0|1,0,1]=4 4746 B18R2.9387 NCC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000017248_100000740388 [0,1,0,1,0,0|1,0,1]=4 4747 B18R2.9387 NCC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000017248 [0,1,0,1,0,0|1,0,1]=4 4748 B18R2.9387 NNC(=O)c1ccc(cc1)NCC2CCCC2 27a_100000737975_100000183614 [0,1,0,1,0,0|2,0,0]=4 4749 B18R2.9387 NNC(=O)c1ccc(cc1)OCC2CCCC2 34a_100000185078_100000740388 [0,1,0,1,0,0|2,0,0]=4 4750 B18R2.9387 NNC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000183614_100000740388 [0,1,0,1,0,0|2,0,0]=4 4751 B18R2.9387 NNC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000183614 [0,1,0,1,0,0|2,0,0]=4 4752 B18R2.9387 O=C(CBr)c1ccc(cc1)OCC2CCCC2 7a_100009814261_100000740388 [0,1,0,1,0,0|1,0,1]=4 4753 B18R2.9387 O=C(CCl)c1ccc(cc1)OCC2CCCC2 7a_100000018856_100000740388 [0,1,0,1,0,0|1,0,1]=4 4754 B18R2.9387 O=C(CF)c1ccc(cc1)OCC2CCCC2 34a_200010654591_100000740388 [0,1,0,1,0,0|1,0,1]=4 4755 B18R2.9387 O=C(CF)c1ccc(cc1)OCC2CCCC2 7a_200010654591_100000740388 [0,1,0,1,0,0|1,0,1]=4 4756 B18R2.9387 O=C(CO)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100011219529 [0,1,0,1,0,0|1,0,1]=4 4757 B18R2.9387 O=C(CO)c1ccc(cc1)SCC2CCCC2 62a_100011219529_100000740388 [0,1,0,1,0,0|1,0,1]=4 4758 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000725942_100000740388 [0,1,0,1,0,0|1,0,0]=3 4759 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000725942 [0,1,0,1,0,0|1,0,0]=3 4760 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCCO2 62a_100000203698_100000725942 [0,1,0,1,0,0|2,0,0]=4 4761 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCCO2 62a_100000725942_100000203698 [0,1,0,1,0,0|2,0,0]=4 4762 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCOC2 62a_100000702531_100000725942 [0,1,0,1,0,0|2,0,0]=4 4763 B18R2.9387 O=CC(=O)c1ccc(cc1)SCC2CCOC2 62a_100000725942_100000702531 [0,1,0,1,0,0|2,0,0]=4 4764 B18R2.9394 CCC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 26a_100020605311_100000212119 [0,1,0,1,0,0|0,0,2]=4 4765 B18R2.9394 CCC(=O)c1ccc(cc1)CN2CCC[C@H]2C 26a_100015189458_100000212119 [0,1,0,1,0,0|0,0,2]=4 4766 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 2230a_100020605311_100000753832 [0,1,0,1,0,0|1,0,1]=4 4767 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 269982a_100020605311_100000753832 [0,1,0,1,0,0|1,0,1]=4 4768 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 270004a_100020605311_100000043907 [0,1,0,1,0,0|1,0,1]=4 4769 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@H]2C 2230a_100015189458_100000753832 [0,1,0,1,0,0|1,0,1]=4 4770 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@H]2C 269982a_100015189458_100000753832 [0,1,0,1,0,0|1,0,1]=4 4771 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@H]2C 270004a_100015189458_100000043907 [0,1,0,1,0,0|1,0,1]=4 4772 B18R2.9394 CNC(=O)c1ccc(cc1)CN2CCC[C@H]2C 34a_100015189458_100000753832 [0,1,0,1,0,0|1,0,1]=4 4773 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 2230a_100020605311_100000735637 [0,1,0,1,0,0|1,0,1]=4 4774 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 269982a_100020605311_100000735637 [0,1,0,1,0,0|1,0,1]=4 4775 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 26a_100020605311_100000150123 [0,1,0,1,0,0|1,0,1]=4 4776 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@@H]2C 270004a_100020605311_100000148700 [0,1,0,1,0,0|1,0,1]=4 4777 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@H]2C 2230a_100015189458_100000735637 [0,1,0,1,0,0|1,0,1]=4 4778 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@H]2C 269982a_100015189458_100000735637 [0,1,0,1,0,0|1,0,1]=4 4779 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@H]2C 26a_100015189458_100000150123 [0,1,0,1,0,0|1,0,1]=4 4780 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@H]2C 270004a_100015189458_100000148700 [0,1,0,1,0,0|1,0,1]=4 4781 B18R2.9394 COC(=O)c1ccc(cc1)CN2CCC[C@H]2C 34a_100015189458_100000735637 [0,1,0,1,0,0|1,0,1]=4 4782 B18R2.9394 C[C@@H]1CCCN1Cc2ccc(cc2)C(=O)CBr 26a_100015189458_100009814261 [0,1,0,1,0,0|1,0,1]=4 4783 B18R2.9394 C[C@@H]1CCCN1Cc2ccc(cc2)C(=O)CCl 26a_100015189458_100000018856 [0,1,0,1,0,0|1,0,1]=4 4784 B18R2.9394 C[C@@H]1CCCN1Cc2ccc(cc2)C(=O)CF 26a_100015189458_200010654591 [0,1,0,1,0,0|1,0,1]=4 4785 B18R2.9394 C[C@H]1CCCN1Cc2ccc(cc2)C(=O)CBr 26a_100020605311_100009814261 [0,1,0,1,0,0|1,0,1]=4 4786 B18R2.9394 C[C@H]1CCCN1Cc2ccc(cc2)C(=O)CCl 26a_100020605311_100000018856 [0,1,0,1,0,0|1,0,1]=4 4787 B18R2.9394 C[C@H]1CCCN1Cc2ccc(cc2)C(=O)CF 26a_100020605311_200010654591 [0,1,0,1,0,0|1,0,1]=4 4788 B18R2.9394 O=CC(=O)c1ccc(cc1)S[C@@H]2CCC[C@H]2O 62a_100000725942_200016002552 [0,1,0,1,0,0|2,0,0]=4 4789 B18R2.9394 O=CC(=O)c1ccc(cc1)S[C@@H]2CCC[C@H]2O 62a_200016002552_100000725942 [0,1,0,1,0,0|2,0,0]=4 4790 B18R2.624076 CCCC(=O)CSc1ccc2c(c1)C=CC2=O 62a_100000747444_100010210589 [0,1,0,1,0,0|1,0,1]=4 4791 B18R2.624076 CCCC(=O)CSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000747444 [0,1,0,1,0,0|1,0,1]=4 4792 B18R2.624076 CCCC(C)CSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011216630 [0,1,0,1,0,0|1,0,0]=3 4793 B18R2.624076 CCCC(C)CSc1ccc2c(c1)C=CC2=O 62a_100011216630_100010210589 [0,1,0,1,0,0|1,0,0]=3 4794 B18R2.624076 COCC(O)CSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215053 [0,1,0,1,0,0|2,0,0]=4 4795 B18R2.624076 COCC(O)CSc1ccc2c(c1)C=CC2=O 62a_100011215053_100010210589 [0,1,0,1,0,0|2,0,0]=4 4796 B18R2.698616 CC1(CCC1)CSc2ccc(cc2)C(=O)C=O 62a_100000725942_100000726658 [0,1,0,1,0,0|2,0,0]=4 4797 B18R2.698616 CC1(CCC1)CSc2ccc(cc2)C(=O)C=O 62a_100000726658_100000725942 [0,1,0,1,0,0|2,0,0]=4 4798 B18R2.9386 COC(=O)c1ccc(cc1)CCN2CCC2C 269982a_100000755817_100010192280 [0,1,0,1,0,0|1,0,1]=4 4799 B18R2.9386 COC(=O)c1ccc(cc1)CCN2CCC2C 34a_100000755817_100010192280 [0,1,0,1,0,0|1,0,1]=4 4800 B18R2.9392 CNC(=O)c1ccc(cc1)COCC2CC2C 34a_100000744939_100000753832 [0,1,0,1,0,0|1,0,1]=4 4801 B18R2.9392 CNC(=O)c1ccc(cc1)COCC2CC2C 7a_100000744939_100000753832 [0,1,0,1,0,0|1,0,1]=4 4802 B18R2.9392 COC(=O)c1ccc(cc1)COCC2CC2C 34a_100000744939_100000735637 [0,1,0,1,0,0|1,0,1]=4 4803 B18R2.9392 COC(=O)c1ccc(cc1)COCC2CC2C 7a_100000744939_100000735637 [0,1,0,1,0,0|1,0,1]=4 4804 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 207a_100000738700_100000043907 [0,1,0,1,0,0|1,0,1]=4 4805 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 2230a_100000738700_100000753832 [0,1,0,1,0,0|1,0,1]=4 4806 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 2230a_100000743749_100000763275 [0,1,0,1,0,0|1,0,1]=4 4807 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 269862a_100000743749_100000753134 [0,1,0,1,0,0|1,0,1]=4 4808 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 270004a_100000738700_100000043907 [0,1,0,1,0,0|1,0,1]=4 4809 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 34a_100000738700_100000753832 [0,1,0,1,0,0|1,0,1]=4 4810 B18R2.95652 CNC(=O)c1ccc(cc1)CNCC2CCC2 34a_100000743749_100000763275 [0,1,0,1,0,0|1,0,1]=4 4811 B18R2.95652 CNC(=O)c1ccc(cc1)COCC2CCC2 34a_100000760304_100000753832 [0,1,0,1,0,0|1,0,1]=4 4812 B18R2.95652 CNC(=O)c1ccc(cc1)CSCC2CCC2 62a_100000753832_100000763275 [0,1,0,1,0,0|1,0,1]=4 4813 B18R2.95652 CNC(=O)c1ccc(cc1)CSCC2CCC2 62a_100000763275_100000753832 [0,1,0,1,0,0|1,0,1]=4 4814 B18R2.95652 COC(=O)c1ccc(cc1)CCCN2CCC2 269982a_100000754969_100010192279 [0,1,0,1,0,0|1,0,1]=4 4815 B18R2.95652 COC(=O)c1ccc(cc1)CCNC2CCC2 2230a_100000749019_100010192280 [0,1,0,1,0,0|1,0,1]=4 4816 B18R2.95652 COC(=O)c1ccc(cc1)CCNC2CCC2 34a_100000749019_100010192280 [0,1,0,1,0,0|1,0,1]=4 4817 B18R2.95652 COC(=O)c1ccc(cc1)CCOC2CCC2 34a_100000748187_100010192280 [0,1,0,1,0,0|1,0,1]=4 4818 B18R2.95652 COC(=O)c1ccc(cc1)CCOC2CCC2 34a_100010779965_100000749161 [0,1,0,1,0,0|1,0,1]=4 4819 B18R2.95652 COC(=O)c1ccc(cc1)CCSC2CCC2 62a_100010192280_100000749161 [0,1,0,1,0,0|1,0,1]=4 4820 B18R2.95652 COC(=O)c1ccc(cc1)CNCC2CCC2 2230a_100000738700_100000735637 [0,1,0,1,0,0|1,0,1]=4 4821 B18R2.95652 COC(=O)c1ccc(cc1)CNCC2CCC2 270004a_100000738700_100000148700 [0,1,0,1,0,0|1,0,1]=4 4822 B18R2.95652 COC(=O)c1ccc(cc1)CNCC2CCC2 34a_100000738700_100000735637 [0,1,0,1,0,0|1,0,1]=4 4823 B18R2.95652 COC(=O)c1ccc(cc1)COCC2CCC2 34a_100000151488_100000763275 [0,1,0,1,0,0|1,0,1]=4 4824 B18R2.95652 COC(=O)c1ccc(cc1)COCC2CCC2 34a_100000760304_100000735637 [0,1,0,1,0,0|1,0,1]=4 4825 B18R2.95652 COC(=O)c1ccc(cc1)COCC2CCC2 7a_100000151488_100000763275 [0,1,0,1,0,0|1,0,1]=4 4826 B18R2.95652 COC(=O)c1ccc(cc1)CSCC2CCC2 62a_100000735637_100000763275 [0,1,0,1,0,0|1,0,1]=4 4827 B18R2.95652 COC(=O)c1ccc(cc1)CSCC2CCC2 62a_100000763275_100000187170 [0,1,0,1,0,0|1,0,1]=4 4828 B18R2.40667 CC(=O)CCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215641 [0,1,0,1,0,0|1,0,1]=4 4829 B18R2.40667 CC(=O)CCCSc1ccc2c(c1)C=CC2=O 62a_100011215641_100010210589 [0,1,0,1,0,0|1,0,1]=4 4830 B18R2.40667 CC(C)CCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011214892 [0,1,0,1,0,0|1,0,0]=3 4831 B18R2.40667 CC(C)CCCSc1ccc2c(c1)C=CC2=O 62a_100011214892_100010210589 [0,1,0,1,0,0|1,0,0]=3 4832 B18R2.40667 CC(C)OCCSc1ccc2c(c1)C=CC2=O 62a_100000211751_100010210589 [0,1,0,1,0,0|2,0,0]=4 4833 B18R2.40667 CC(C)OCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000211751 [0,1,0,1,0,0|2,0,0]=4 4834 B18R2.40667 CC(C)SCCSc1ccc2c(c1)C=CC2=O 62a_100000730970_100010210589 [0,1,0,1,0,0|2,0,0]=4 4835 B18R2.40667 CC(C)SCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000730970 [0,1,0,1,0,0|2,0,0]=4 4836 B18R2.40667 CC(O)CCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_200000718107 [0,1,0,1,0,0|1,0,0]=3 4837 B18R2.40667 CC(O)CCCSc1ccc2c(c1)C=CC2=O 62a_200000718107_100010210589 [0,1,0,1,0,0|1,0,0]=3 4838 B18R2.40667 CN(C)CCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000757444 [0,1,0,1,0,0|2,0,0]=4 4839 B18R2.95633 CNC(=O)c1ccc(cc1)CNCCC2CC2 207a_100000764129_100000043907 [0,1,0,1,0,0|1,0,1]=4 4840 B18R2.95633 CNC(=O)c1ccc(cc1)CNCCC2CC2 2230a_100000743749_100000694398 [0,1,0,1,0,0|1,0,1]=4 4841 B18R2.95633 CNC(=O)c1ccc(cc1)CNCCC2CC2 270004a_100000764129_100000043907 [0,1,0,1,0,0|1,0,1]=4 4842 B18R2.95633 CNC(=O)c1ccc(cc1)CNCCC2CC2 34a_100000743749_100000694398 [0,1,0,1,0,0|1,0,1]=4 4843 B18R2.95633 CNC(=O)c1ccc(cc1)CNCCC2CC2 34a_100000764129_100000753832 [0,1,0,1,0,0|1,0,1]=4 4844 B18R2.95633 CNC(=O)c1ccc(cc1)COCCC2CC2 34a_100000754188_100000753832 [0,1,0,1,0,0|1,0,1]=4 4845 B18R2.95633 CNC(=O)c1ccc(cc1)COCCC2CC2 7a_100000754188_100000753832 [0,1,0,1,0,0|1,0,1]=4 4846 B18R2.95633 CNC(=O)c1ccc(cc1)CSCCC2CC2 62a_100000753832_100000764125 [0,1,0,1,0,0|1,0,1]=4 4847 B18R2.95633 CNC(=O)c1ccc(cc1)CSCCC2CC2 62a_100000764125_100000753832 [0,1,0,1,0,0|1,0,1]=4 4848 B18R2.95633 COC(=O)c1ccc(cc1)CCCNC2CC2 34a_100000212008_100010192279 [0,1,0,1,0,0|1,0,1]=4 4849 B18R2.95633 COC(=O)c1ccc(cc1)CCCSC2CC2 62a_100010192279_100000211595 [0,1,0,1,0,0|1,0,1]=4 4850 B18R2.95633 COC(=O)c1ccc(cc1)CCNCC2CC2 2230a_100000735609_100010192280 [0,1,0,1,0,0|1,0,1]=4 4851 B18R2.95633 COC(=O)c1ccc(cc1)CCNCC2CC2 34a_100000735609_100010192280 [0,1,0,1,0,0|1,0,1]=4 4852 B18R2.95633 COC(=O)c1ccc(cc1)CCOCC2CC2 34a_100000211283_100010192280 [0,1,0,1,0,0|1,0,1]=4 4853 B18R2.95633 COC(=O)c1ccc(cc1)CCOCC2CC2 34a_100010779965_100000742324 [0,1,0,1,0,0|1,0,1]=4 4854 B18R2.95633 COC(=O)c1ccc(cc1)CCOCC2CC2 7a_100010779965_100000742324 [0,1,0,1,0,0|1,0,1]=4 4855 B18R2.95633 COC(=O)c1ccc(cc1)CCSCC2CC2 62a_100000756562_100010192280 [0,1,0,1,0,0|1,0,1]=4 4856 B18R2.95633 COC(=O)c1ccc(cc1)CCSCC2CC2 62a_100010192280_100000742324 [0,1,0,1,0,0|1,0,1]=4 4857 B18R2.95633 COC(=O)c1ccc(cc1)CNCCC2CC2 270004a_100000764129_100000148700 [0,1,0,1,0,0|1,0,1]=4 4858 B18R2.95633 COC(=O)c1ccc(cc1)CNCCC2CC2 34a_100000764129_100000735637 [0,1,0,1,0,0|1,0,1]=4 4859 B18R2.95633 COC(=O)c1ccc(cc1)COCCC2CC2 34a_100000151488_100000694398 [0,1,0,1,0,0|1,0,1]=4 4860 B18R2.95633 COC(=O)c1ccc(cc1)COCCC2CC2 34a_100000754188_100000735637 [0,1,0,1,0,0|1,0,1]=4 4861 B18R2.95633 COC(=O)c1ccc(cc1)COCCC2CC2 7a_100000151488_100000764125 [0,1,0,1,0,0|1,0,1]=4 4862 B18R2.95633 COC(=O)c1ccc(cc1)COCCC2CC2 7a_100000754188_100000735637 [0,1,0,1,0,0|1,0,1]=4 4863 B18R2.95633 COC(=O)c1ccc(cc1)CSCCC2CC2 62a_100000735637_100000764125 [0,1,0,1,0,0|1,0,1]=4 4864 B18R2.95633 COC(=O)c1ccc(cc1)CSCCC2CC2 62a_100000764125_100000187170 [0,1,0,1,0,0|1,0,1]=4 4865 B18R2.95633 O=CC(=O)c1ccc(cc1)SCCCC2CO2 62a_100000725942_100000733510 [0,1,0,1,0,0|2,0,0]=4 4866 B18R2.95633 O=CC(=O)c1ccc(cc1)SCCCC2CO2 62a_100000733510_100000725942 [0,1,0,1,0,0|2,0,0]=4 4867 B18R2.2534 CC(C)C(=O)c1ccc(cc1)C2CCCCC2 1458a_100000185286_100000210206 [0,1,0,1,0,0|0,0,2]=4 4868 B18R2.2534 CN(C)C(=O)c1ccc(cc1)C2CCCCC2 11a_100102631434_100000185286 [0,1,0,1,0,0|1,0,1]=4 4869 B18R2.2534 CN(C)C(=O)c1ccc(cc1)C2CCCCC2 1626a_100102631434_100000185286 [0,1,0,1,0,0|1,0,1]=4 4870 B18R2.2534 CN(C)C(=O)c1ccc(cc1)C2CCCCC2 240690a_100102631434_100000185286 [0,1,0,1,0,0|1,0,1]=4 4871 B18R2.2534 CN(C)C(=O)c1ccc(cc1)C2CCCCC2 527a_100102631434_100000185286 [0,1,0,1,0,0|1,0,1]=4 4872 B18R2.12984 NC(=O)C(=O)c1ccc(cc1)SC2CCCC2 62a_200009822167_100000179811 [0,1,0,1,0,0|2,0,0]=4 4873 B18R2.142207 NC(=O)C(=O)c1ccc(cc1)SCCC2CC2 62a_200009822167_100000764125 [0,1,0,1,0,0|2,0,0]=4 4874 B18R2.142208 NC(=O)C(=O)c1ccc(cc1)SCC2CCC2 62a_200009822167_100000763275 [0,1,0,1,0,0|2,0,0]=4 4875 B18R2.287 CCC(=O)c1ccc(cc1)CN2CCCCC2 1458a_100000722371_100000210202 [0,1,0,1,0,0|0,0,2]=4 4876 B18R2.287 CCC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000212119_100000210327 [0,1,0,1,0,0|0,0,2]=4 4877 B18R2.287 CCC(=O)c1ccc(cc1)OC2CCCCC2 7a_100000212119_100000210327 [0,1,0,1,0,0|0,0,2]=4 4878 B18R2.287 CCC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000211647 [0,1,0,1,0,0|0,0,2]=4 4879 B18R2.287 CCC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000211647_100000210327 [0,1,0,1,0,0|0,0,2]=4 4880 B18R2.287 CNC(=O)c1ccc(cc1)CN2CCCCC2 11a_106832991635_100000722371 [0,1,0,1,0,0|1,0,1]=4 4881 B18R2.287 CNC(=O)c1ccc(cc1)CN2CCCCC2 240690a_100102657272_100000722371 [0,1,0,1,0,0|1,0,1]=4 4882 B18R2.287 CNC(=O)c1ccc(cc1)CN2CCCCC2 527a_100102657272_100000722371 [0,1,0,1,0,0|1,0,1]=4 4883 B18R2.287 CNC(=O)c1ccc(cc1)NC2CCCCC2 27a_100000182618_100000155074 [0,1,0,1,0,0|1,0,1]=4 4884 B18R2.287 CNC(=O)c1ccc(cc1)NC2CCCCC2 34a_100000184841_100000210327 [0,1,0,1,0,0|1,0,1]=4 4885 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000192141_100000210327 [0,1,0,1,0,0|1,0,1]=4 4886 B18R2.287 CNC(=O)c1ccc(cc1)OC2CCCCC2 7a_100000192141_100000210327 [0,1,0,1,0,0|1,0,1]=4 4887 B18R2.287 CNC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000155074_100000210327 [0,1,0,1,0,0|1,0,1]=4 4888 B18R2.287 CNC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000155074 [0,1,0,1,0,0|1,0,1]=4 4889 B18R2.287 COC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000150123_100000210327 [0,1,0,1,0,0|1,0,1]=4 4890 B18R2.287 COC(=O)c1ccc(cc1)OC2CCCCC2 7a_100000150123_100000210327 [0,1,0,1,0,0|1,0,1]=4 4891 B18R2.287 COC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000150774_100000210327 [0,1,0,1,0,0|1,0,1]=4 4892 B18R2.287 COC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000150774 [0,1,0,1,0,0|1,0,1]=4 4893 B18R2.287 N#CC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100009994572 [0,1,0,1,0,0|1,0,1]=4 4894 B18R2.287 NCC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000017248_100000210327 [0,1,0,1,0,0|1,0,1]=4 4895 B18R2.287 NCC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000017248 [0,1,0,1,0,0|1,0,1]=4 4896 B18R2.287 NNC(=O)c1ccc(cc1)NC2CCCCC2 27a_100000182618_100000183614 [0,1,0,1,0,0|2,0,0]=4 4897 B18R2.287 NNC(=O)c1ccc(cc1)OC2CCCCC2 34a_100000185078_100000210327 [0,1,0,1,0,0|2,0,0]=4 4898 B18R2.287 NNC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000183614_100000210327 [0,1,0,1,0,0|2,0,0]=4 4899 B18R2.287 NNC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000183614 [0,1,0,1,0,0|2,0,0]=4 4900 B18R2.287 O=C(CBr)c1ccc(cc1)OC2CCCCC2 7a_100009814261_100000210327 [0,1,0,1,0,0|1,0,1]=4 4901 B18R2.287 O=C(CCl)c1ccc(cc1)OC2CCCCC2 7a_100000018856_100000210327 [0,1,0,1,0,0|1,0,1]=4 4902 B18R2.287 O=C(CF)c1ccc(cc1)CN2CCCCC2 1458a_100000722371_100015361967 [0,1,0,1,0,0|1,0,1]=4 4903 B18R2.287 O=C(CF)c1ccc(cc1)OC2CCCCC2 34a_200010654591_100000210327 [0,1,0,1,0,0|1,0,1]=4 4904 B18R2.287 O=C(CF)c1ccc(cc1)OC2CCCCC2 7a_200010654591_100000210327 [0,1,0,1,0,0|1,0,1]=4 4905 B18R2.287 O=C(CO)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100011219529 [0,1,0,1,0,0|1,0,1]=4 4906 B18R2.287 O=C(CO)c1ccc(cc1)SC2CCCCC2 62a_100011219529_100000210327 [0,1,0,1,0,0|1,0,1]=4 4907 B18R2.287 O=CC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000725942 [0,1,0,1,0,0|1,0,0]=3 4908 B18R2.287 O=CC(=O)c1ccc(cc1)SC2CCCCC2 62a_100000725942_100000210327 [0,1,0,1,0,0|1,0,0]=3 4909 B18R2.287 O=CC(=O)c1ccc(cc1)SC2CCCOC2 62a_100000725942_100000693364 [0,1,0,1,0,0|2,0,0]=4 4910 B18R2.287 O=CC(=O)c1ccc(cc1)SC2CCOCC2 62a_100000725942_100011324220 [0,1,0,1,0,0|2,0,0]=4 4911 B18R2.287 O=CC(=O)c1ccc(cc1)SC2CCSCC2 62a_100000725942_100000069128 [0,1,0,1,0,0|2,0,0]=4 4912 B18R2.3200 CCC1CCCN1c2ccc(cc2)C(=O)NC 27a_100000754278_100000155074 [0,1,0,1,0,0|1,0,1]=4 4913 B18R2.3200 CCC1CCCN1c2ccc(cc2)C(=O)NN 27a_100000754278_100000183614 [0,1,0,1,0,0|2,0,0]=4 4914 B18R2.3200 CCN1CCC[C@@H]1c2ccc(cc2)C(=O)OC 2230a_100160571641_100000210202 [0,1,0,1,0,0|1,0,1]=4 4915 B18R2.3200 CCN1CCC[C@@H]1c2ccc(cc2)C(=O)OC 269982a_100160571641_100000204670 [0,1,0,1,0,0|1,0,1]=4 4916 B18R2.3200 CCN1CCC[C@@H]1c2ccc(cc2)C(=O)OC 34a_100160571641_100000210202 [0,1,0,1,0,0|1,0,1]=4 4917 B18R2.9391 CC1CCCCN1c2ccc(cc2)C(=O)NN 27a_100000211376_100000183614 [0,1,0,1,0,0|2,0,0]=4 4918 B18R2.9391 CNC(=O)c1ccc(cc1)N2CCCCC2C 27a_100000211376_100000155074 [0,1,0,1,0,0|1,0,1]=4 4919 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2C 2230a_100025798459_200000210301 [0,1,0,1,0,0|1,0,1]=4 4920 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2C 269982a_100025798459_200000210301 [0,1,0,1,0,0|1,0,1]=4 4921 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2C 34a_100025798459_200000210301 [0,1,0,1,0,0|1,0,1]=4 4922 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2[13CH3] 2230a_100025798459_200025704644 [0,1,0,1,0,0|1,0,1]=4 4923 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2[13CH3] 269982a_100025798459_200025704644 [0,1,0,1,0,0|1,0,1]=4 4924 B18R2.9391 COC(=O)c1ccc(cc1)[C@H]2CCCCN2[13CH3] 34a_100025798459_200025704644 [0,1,0,1,0,0|1,0,1]=4 4925 B18R2.95617 CNC(=O)c1ccc(cc1)N2CCCCCC2 27a_100000185865_100000155074 [0,1,0,1,0,0|1,0,1]=4 4926 B18R2.95617 NNC(=O)c1ccc(cc1)N2CCCCCC2 27a_100000185865_100000183614 [0,1,0,1,0,0|2,0,0]=4 4927 B18R2.95617 O=CC(=O)c1ccc(cc1)C2=CCCCCC2 271570a_200009888920_100000725942 [0,1,0,1,0,0|1,0,1]=4 4928 B18R2.872541 C#CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100010269958 [0,1,0,1,0,0|0,0,2]=4 4929 B18R2.872541 C#CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010269958_100010210589 [0,1,0,1,0,0|0,0,2]=4 4930 B18R2.872541 C=CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215482 [0,1,0,1,0,0|0,0,2]=4 4931 B18R2.872541 C=CCCCCSc1ccc2c(c1)C=CC2=O 62a_100011215482_100010210589 [0,1,0,1,0,0|0,0,2]=4 4932 B18R2.872541 CC/C=C\CCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100015370543 [0,1,0,1,0,0|0,0,2]=4 4933 B18R2.872541 CC/C=C\CCSc1ccc2c(c1)C=CC2=O 62a_100015370543_100010210589 [0,1,0,1,0,0|0,0,2]=4 4934 B18R2.872541 CCCCCC=Cc1ccc2c(c1)C=CC2=O 271570a_100000062253_100010210589 [0,1,0,1,0,0|0,0,1]=3 4935 B18R2.872541 CCCCCCNc1ccc2c(c1)ccn2C 34a_100011270241_100000210314 [0,1,0,1,0,0|2,0,0]=4 4936 B18R2.872541 CCCCCCOc1ccc2c(c1)CCC2=O 34a_100000708912_100000210314 [0,1,0,1,0,0|0,0,2]=4 4937 B18R2.872541 CCCCCCOc1ccc2c(c1)CCC2=O 7a_100000708912_100000210314 [0,1,0,1,0,0|0,0,2]=4 4938 B18R2.872541 CCCCCCOc1ccc2c(c1)CNC2=O 34a_100000098542_100000210314 [0,1,0,1,0,0|1,0,1]=4 4939 B18R2.872541 CCCCCCOc1ccc2c(c1)COC2=O 7a_100000044543_100000210314 [0,1,0,1,0,0|1,0,1]=4 4940 B18R2.872541 CCCCCCSc1ccc2c(=O)[nH][nH]c2c1 62a_100000210314_100012353722 [0,1,0,1,0,0|2,0,0]=4 4941 B18R2.872541 CCCCCCSc1ccc2c(c1)C=CC2=O 62a_100000210314_100010210589 [0,1,0,1,0,0|0,0,0]=2 4942 B18R2.872541 CCCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000210757 [0,1,0,1,0,0|0,0,0]=2 4943 B18R2.872541 CCCCCCSc1ccc2c(c1)CCC2=O 62a_100000210314_100000737041 [0,1,0,1,0,0|0,0,2]=4 4944 B18R2.872541 CCCCCCSc1ccc2c(c1)CCC2=O 62a_100000737041_100000210757 [0,1,0,1,0,0|0,0,2]=4 4945 B18R2.872541 CCCCCCSc1ccc2c(c1)CNC2=O 62a_100000210314_100000692135 [0,1,0,1,0,0|1,0,1]=4 4946 B18R2.872541 CCCCCCSc1ccc2c(c1)CNC2=O 62a_100000692135_100000210757 [0,1,0,1,0,0|1,0,1]=4 4947 B18R2.872541 CCCCCCSc1ccc2c(c1)COC2=O 62a_100009816608_100000210757 [0,1,0,1,0,0|1,0,1]=4 4948 B18R2.872541 CCCCCCSc1ccc2c(c1)OCC2=O 62a_100000210314_100000686717 [0,1,0,1,0,0|1,0,1]=4 4949 B18R2.872541 CCCCCCSc1ccc2c(c1)ccn2C 62a_100000210314_100011202928 [0,1,0,1,0,0|2,0,0]=4 4950 B18R2.872541 CCCCCNCc1ccc2c(c1)ccn2C 207a_100000209983_100011361496 [0,1,0,1,0,0|2,0,0]=4 4951 B18R2.872541 CCCCCNCc1ccc2c(c1)ccn2C 270004a_100000209983_100011361496 [0,1,0,1,0,0|2,0,0]=4 4952 B18R2.872541 CCCCCNCc1ccc2c(c1)ccn2C 34a_102125277283_100000718602 [0,1,0,1,0,0|2,0,0]=4 4953 B18R2.872541 CCCCOCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011995733 [0,1,0,1,0,0|1,0,0]=3 4954 B18R2.872541 CCCCOCSc1ccc2c(c1)C=CC2=O 62a_100011995733_100010210589 [0,1,0,1,0,0|1,0,0]=3 4955 B18R2.872541 CCCOCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100011215938 [0,1,0,1,0,0|1,0,0]=3 4956 B18R2.872541 CCCOCCSc1ccc2c(c1)C=CC2=O 62a_100011215938_100010210589 [0,1,0,1,0,0|1,0,0]=3 4957 B18R2.872541 CCOCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100012232248 [0,1,0,1,0,0|1,0,0]=3 4958 B18R2.872541 CCOCCCSc1ccc2c(c1)C=CC2=O 62a_100012232248_100010210589 [0,1,0,1,0,0|1,0,0]=3 4959 B18R2.872541 COCCCCSc1ccc2c(c1)C=CC2=O 62a_100000730899_100010210589 [0,1,0,1,0,0|1,0,0]=3 4960 B18R2.872541 COCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000730899 [0,1,0,1,0,0|1,0,0]=3 4961 B18R2.872541 COCCOCSc1ccc2c(c1)C=CC2=O 62a_100000231047_100010210589 [0,1,0,1,0,0|2,0,0]=4 4962 B18R2.872541 COCCOCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000231047 [0,1,0,1,0,0|2,0,0]=4 4963 B18R2.872541 N#CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000211819 [0,1,0,1,0,0|1,0,1]=4 4964 B18R2.872541 N#CCCCCSc1ccc2c(c1)C=CC2=O 62a_100011219923_100010210589 [0,1,0,1,0,0|1,0,1]=4 4965 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCCCCF 62a_100000729378_100010210589 [0,1,0,1,0,0|1,0,0]=3 4966 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCCCCF 62a_100010210589_100000729378 [0,1,0,1,0,0|1,0,0]=3 4967 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCCCCO 62a_100000746330_100010210589 [0,1,0,1,0,0|1,0,0]=3 4968 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCCCCO 62a_100010210589_100000746330 [0,1,0,1,0,0|1,0,0]=3 4969 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCOCCO 62a_100010210589_100011215305 [0,1,0,1,0,0|2,0,0]=4 4970 B18R2.872541 O=C1C=Cc2c1ccc(c2)SCCOCCO 62a_100011215305_100010210589 [0,1,0,1,0,0|2,0,0]=4 4971 B18R2.872541 O=CCCCCSc1ccc2c(c1)C=CC2=O 62a_100000139335_100010210589 [0,1,0,1,0,0|1,0,1]=4 4972 B18R2.872541 O=CCCCCSc1ccc2c(c1)C=CC2=O 62a_100010210589_100000139335 [0,1,0,1,0,0|1,0,1]=4 4973 B18R2.891493 CCCCC(=Cc1ccc2c(c1)C=CC2=O)Br 271570a_206741709834_100010210589 [0,1,0,1,0,0|0,0,2]=4 4974 B18R2.891493 CCCCC(C)Sc1ccc2c(c1)C=CC2=O 62a_100010210589_200011215066 [0,1,0,1,0,0|1,0,0]=3 4975 B18R2.891493 CCCCC(C)Sc1ccc2c(c1)C=CC2=O 62a_200011215066_100010210589 [0,1,0,1,0,0|1,0,0]=3 4976 B18R2.9541 CNC(=O)c1ccc(c(c1)Br)C2CCCCC2 11a_106832991635_200010235951 [0,1,0,1,0,0|1,0,1]=4 4977 B18R2.9541 CNC(=O)c1ccc(c(c1)Br)C2CCCCC2 1626a_100102657272_200010235951 [0,1,0,1,0,0|1,0,1]=4 4978 B18R2.9541 CNC(=O)c1ccc(c(c1)Br)C2CCCCC2 240690a_100102657272_200010235951 [0,1,0,1,0,0|1,0,1]=4 4979 B18R2.9541 CNC(=O)c1ccc(c(c1)Br)C2CCCCC2 527a_100102657272_200010235951 [0,1,0,1,0,0|1,0,1]=4 4980 B18R2.9541 COC(=O)c1ccc(c(c1)O)C2CCCCC2 271570a_203496583355_200020633597 [0,1,0,1,0,0|1,0,1]=4 4981 B18R2.9541 O=C(CF)c1ccc(c(c1)Br)C2CCCCC2 1458a_200010235951_100015361967 [0,1,0,1,0,0|1,0,1]=4 4982 B18R3.4180 O=C1C=Cc2c1ccc(c2)C3=CCCCC3 271570a_100000062251_100010210589 [0,0,0,2,0,0|0,0,2]=4 4983 B18R3.53157 O=C1C=Cc2c1ccc(c2)C=C3CCCC3 271570a_100010378317_100010210589 [0,0,0,2,0,0|0,0,2]=4 4984 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCCC3 62a_100010210589_100000179811 [0,0,0,2,0,0|1,0,0]=3 4985 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCCC3 62a_100011217020_100010210589 [0,0,0,2,0,0|1,0,0]=3 4986 B18R3.53157 O=C1C=Cc2c1ccc(c2)SC3CCOC3 62a_100010210589_100000690089 [0,0,0,2,0,0|2,0,0]=4 4987 B18R3.563004 O=C1C=Cc2c1ccc(c2)SCCC3CC3 62a_100000764125_100010210589 [0,0,0,2,0,0|1,0,0]=3 4988 B18R3.563004 O=C1C=Cc2c1ccc(c2)SCCC3CC3 62a_100010210589_100000764125 [0,0,0,2,0,0|1,0,0]=3 4989 B18R3.563004 O=C1C=Cc2c1ccc(c2)SCCC3CO3 62a_100000732470_100010210589 [0,0,0,2,0,0|2,0,0]=4 4990 B18R3.563004 O=C1C=Cc2c1ccc(c2)SCCC3CO3 62a_100010210589_100000732470 [0,0,0,2,0,0|2,0,0]=4 4991 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3CCC3 62a_100000763275_100010210589 [0,0,0,2,0,0|1,0,0]=3 4992 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3CCC3 62a_100010210589_100000763275 [0,0,0,2,0,0|1,0,0]=3 4993 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3CCO3 62a_100000103362_100010210589 [0,0,0,2,0,0|2,0,0]=4 4994 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3CCO3 62a_100010210589_100000103362 [0,0,0,2,0,0|2,0,0]=4 4995 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3COC3 62a_100010210589_100010264016 [0,0,0,2,0,0|2,0,0]=4 4996 B18R3.563009 O=C1C=Cc2c1ccc(c2)SCC3COC3 62a_100010264016_100010210589 [0,0,0,2,0,0|2,0,0]=4 4997 B14R1.220 C=C(C)c1ccc(s1)CCCCCC 271570a_100000694244_100009817186 [1,0,0,0,1,0|2,0,0]=4 4998 B14R1.219 C=C=Cc1ccc(s1)CCCCCC 271570a_100015277604_100009817186 [1,0,0,0,1,0|1,0,1]=4 4999 B14R1.219 CC=Cc1ccc(s1)CCCCCC 271570a_100016259895_100009817186 [1,0,0,0,1,0|1,0,1]=4 5000 B16R1.25 C=CC(=O)Cc1ccc(cc1)OCCOC 1458a_100000185746_100011242488 [1,0,0,0,0,1|2,0,0]=4 5001 B16R1.25 C=CC(=O)Nc1ccc(cc1)CCCCC 1626a_100000211775_100000185746 [1,0,0,0,0,1|0,0,0]=2 5002 B16R1.25 C=CC(=O)Nc1ccc(cc1)CCCCC 22a_100000211775_100000185746 [1,0,0,0,0,1|0,0,0]=2 5003 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCC 1626a_100011194258_100000185746 [1,0,0,0,0,1|1,0,0]=3 5004 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCC 22a_100011194258_100000185746 [1,0,0,0,0,1|1,0,0]=3 5005 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCC 34a_100011235904_100000210210 [1,0,0,0,0,1|1,0,0]=3 5006 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCF 34a_100011235904_100011934791 [1,0,0,0,0,1|2,0,0]=4 5007 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCO 22a_100000730458_100000185746 [1,0,0,0,0,1|2,0,0]=4 5008 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCCO 34a_100011235904_100000230001 [1,0,0,0,0,1|2,0,0]=4 5009 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCOC 1626a_100000739146_100000185746 [1,0,0,0,0,1|2,0,0]=4 5010 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCOC 22a_100000739146_100000185746 [1,0,0,0,0,1|2,0,0]=4 5011 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCOC 34a_100011235904_100011201679 [1,0,0,0,0,1|2,0,0]=4 5012 B16R1.25 C=CC(=O)Nc1ccc(cc1)OCCSC 34a_100011235904_100000212216 [1,0,0,0,0,1|2,0,0]=4 5013 B16R1.25 CCCCCc1ccc(cc1)CC(=O)CC 1458a_100000011233_100000210202 [1,0,0,0,0,1|0,0,2]=4 5014 B16R1.25 CCCCCc1ccc(cc1)CC(=O)CF 1458a_100000011233_100015361967 [1,0,0,0,0,1|1,0,1]=4 5015 B16R1.25 CCCCCc1ccc(cc1)CC(=O)NC 11a_106832991635_100000011233 [1,0,0,0,0,1|1,0,1]=4 5016 B16R1.25 CCCCCc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000011233 [1,0,0,0,0,1|1,0,1]=4 5017 B16R1.25 CCCCCc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000011233 [1,0,0,0,0,1|1,0,1]=4 5018 B16R1.25 CCCCCc1ccc(cc1)CC(=O)NC 527a_100102657272_100000011233 [1,0,0,0,0,1|1,0,1]=4 5019 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CC 11a_100000211775_100000210414 [1,0,0,0,0,1|0,0,2]=4 5020 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CC 1626a_100000211775_100000210414 [1,0,0,0,0,1|0,0,2]=4 5021 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CC 22a_100000211775_100000210414 [1,0,0,0,0,1|0,0,2]=4 5022 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CC 527a_100000211775_100000210414 [1,0,0,0,0,1|0,0,2]=4 5023 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CO 22a_100000211775_100000210174 [1,0,0,0,0,1|1,0,1]=4 5024 B16R1.25 CCCCCc1ccc(cc1)NC(=O)CO 527a_100000211775_100000210174 [1,0,0,0,0,1|1,0,1]=4 5025 B16R1.25 CCCCCc1ccc(cc1)NC(=O)NC 2430a_100000211775_100102657272 [1,0,0,0,0,1|1,0,1]=4 5026 B16R1.25 CCCCCc1ccc(cc1)NC(=O)NC 512a_100000211775_100102657272 [1,0,0,0,0,1|1,0,1]=4 5027 B16R1.264 CCCCCSc1cccc(c1)C(=O)C=O 62a_100000210326_100000726164 [0,0,0,0,1,1|2,0,0]=4 5028 B16R1.264 CCCCCSc1cccc(c1)C(=O)C=O 62a_100000726164_100000210326 [0,0,0,0,1,1|2,0,0]=4 5029 B18R1.677 C=CC(=NNc1ccc(cc1)CCCCCC)C 4a_100020605313_200015361842 [0,0,0,0,0,2|1,0,0]=3 5030 B18R1.677 C=CC(=O)NCc1ccc(cc1)CCCCCC 1626a_200000080172_100000185746 [0,0,0,0,0,2|0,0,0]=2 5031 B18R1.677 C=CC(=O)NCc1ccc(cc1)CCCCCC 240690a_200000080172_200121576911 [0,0,0,0,0,2|0,0,0]=2 5032 B18R1.677 C=CC(=O)NNc1ccc(cc1)CCCCCC 22a_100020605313_100000185746 [0,0,0,0,0,2|0,0,0]=2 5033 B18R1.677 C=CC(O)CNc1ccc(cc1)CCCCCC 2230a_100000035805_100000730141 [0,0,0,0,0,2|0,0,2]=4 5034 B18R1.677 C=CC(O)CNc1ccc(cc1)CCCCCC 34a_100000035805_100000730141 [0,0,0,0,0,2|0,0,2]=4 5035 B18R1.677 C=CC(O)CNc1ccc(cc1)CCCCCC 7a_100000035805_100000730141 [0,0,0,0,0,2|0,0,2]=4 5036 B18R1.677 C=CC(O)COc1ccc(cc1)CCCCCC 34a_100000011238_100000730141 [0,0,0,0,0,2|0,0,2]=4 5037 B18R1.677 C=CC(O)COc1ccc(cc1)CCCCCC 7a_100000011238_100000730141 [0,0,0,0,0,2|0,0,2]=4 5038 B18R1.677 C=CC(O)CSc1ccc(cc1)CCCCCC 62a_100000730141_100009814338 [0,0,0,0,0,2|0,0,2]=4 5039 B18R1.677 C=CC(O)CSc1ccc(cc1)CCCCCC 62a_100009814338_100000730141 [0,0,0,0,0,2|0,0,2]=4 5040 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CC 11a_200000080172_100000210414 [0,0,0,0,0,2|0,0,2]=4 5041 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CC 1626a_200000080172_100000210414 [0,0,0,0,0,2|0,0,2]=4 5042 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CC 240690a_200000080172_100000210414 [0,0,0,0,0,2|0,0,2]=4 5043 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CC 527a_200000080172_100000210414 [0,0,0,0,0,2|0,0,2]=4 5044 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CO 240690a_200000080172_100000210174 [0,0,0,0,0,2|1,0,1]=4 5045 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)CO 527a_200000080172_100000210174 [0,0,0,0,0,2|1,0,1]=4 5046 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 2708a_100102657272_200000080172 [0,0,0,0,0,2|1,0,1]=4 5047 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 2708a_200000080172_106832991635 [0,0,0,0,0,2|1,0,1]=4 5048 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 273464a_100102657272_200000080172 [0,0,0,0,0,2|1,0,1]=4 5049 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 273464a_200000080172_100102657272 [0,0,0,0,0,2|1,0,1]=4 5050 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 512a_106832991638_200000080172 [0,0,0,0,0,2|1,0,1]=4 5051 B18R1.677 CCCCCCc1ccc(cc1)CNC(=O)NC 512a_200000080172_100102657272 [0,0,0,0,0,2|1,0,1]=4 5052 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)CC 7a_100000035805_100000747405 [0,0,0,0,0,2|0,0,2]=4 5053 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)NC 2230a_100000035805_100000183359 [0,0,0,0,0,2|1,0,1]=4 5054 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)NC 34a_100000035805_100000183359 [0,0,0,0,0,2|1,0,1]=4 5055 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)NC 7a_100000035805_100000183359 [0,0,0,0,0,2|1,0,1]=4 5056 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)OC 2230a_100000035805_100000747449 [0,0,0,0,0,2|1,0,1]=4 5057 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)OC 34a_100000035805_100000747449 [0,0,0,0,0,2|1,0,1]=4 5058 B18R1.677 CCCCCCc1ccc(cc1)NCC(=O)OC 7a_100000035805_100000747449 [0,0,0,0,0,2|1,0,1]=4 5059 B18R1.677 CCCCCCc1ccc(cc1)NNC(=O)CC 22a_100020605313_100000210414 [0,0,0,0,0,2|0,0,2]=4 5060 B18R1.677 CCCCCCc1ccc(cc1)NNC(=O)CO 22a_100020605313_100000210174 [0,0,0,0,0,2|1,0,1]=4 5061 B18R1.677 CCCCCCc1ccc(cc1)NNC(=O)NC 273464a_100102657272_100020605313 [0,0,0,0,0,2|1,0,1]=4 5062 B18R1.677 CCCCCCc1ccc(cc1)NNC(=O)NC 512a_100020605313_100102657272 [0,0,0,0,0,2|1,0,1]=4 5063 B18R1.677 CCCCCCc1ccc(cc1)NNC(=O)NC 512a_106832991638_100020605313 [0,0,0,0,0,2|1,0,1]=4 5064 B18R1.677 CCCCCCc1ccc(cc1)OCC(=O)CC 7a_100000011238_100000747405 [0,0,0,0,0,2|0,0,2]=4 5065 B18R1.677 CCCCCCc1ccc(cc1)OCC(=O)NC 34a_100000011238_100000183359 [0,0,0,0,0,2|1,0,1]=4 5066 B18R1.677 CCCCCCc1ccc(cc1)OCC(=O)NC 7a_100000011238_100000183359 [0,0,0,0,0,2|1,0,1]=4 5067 B18R1.677 CCCCCCc1ccc(cc1)OCC(=O)OC 34a_100000011238_100000747449 [0,0,0,0,0,2|1,0,1]=4 5068 B18R1.677 CCCCCCc1ccc(cc1)OCC(=O)OC 7a_100000011238_100000747449 [0,0,0,0,0,2|1,0,1]=4 5069 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)CC 62a_100000747405_100009814338 [0,0,0,0,0,2|0,0,2]=4 5070 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)CC 62a_100009814338_100000747405 [0,0,0,0,0,2|0,0,2]=4 5071 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)NC 62a_100000183359_100009814338 [0,0,0,0,0,2|1,0,1]=4 5072 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)NC 62a_100009814338_100000183359 [0,0,0,0,0,2|1,0,1]=4 5073 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)OC 62a_100000747449_100009814338 [0,0,0,0,0,2|1,0,1]=4 5074 B18R1.677 CCCCCCc1ccc(cc1)SCC(=O)OC 62a_100009814338_100000747449 [0,0,0,0,0,2|1,0,1]=4