0 B19R1.26147 C=C(CCCC(=O)CCC=C(C)C)c1ccccc1 1458a_200009911520_100011217483 [0,0,0,0,0,0|3,0,1]=4 1 B19R1.26147 CC(=CCC/C(=C/CNC(=O)c1ccccc1)/C)C 11a_200020676162_100000185807 [0,0,0,0,0,0|1,0,0]=1 2 B19R1.26147 CC(=CCC/C(=C/CNC(=O)c1ccccc1)/C)C 1626a_200020676162_100000185807 [0,0,0,0,0,0|1,0,0]=1 3 B19R1.26147 CC(=CCC/C(=C/CNC(=O)c1ccccc1)/C)C 527a_200020676162_100000185807 [0,0,0,0,0,0|1,0,0]=1 4 B19R1.26147 CC(=CCC/C(=C/CNC(C)c1ccccc1)/C)C 2230a_200020676162_100000230085 [0,0,0,0,0,0|2,0,1]=3 5 B19R1.26147 CC(=CCC/C(=C/CNC(C)c1ccccc1)/C)C 34a_200020676162_100000211855 [0,0,0,0,0,0|2,0,1]=3 6 B19R1.26147 CC(=CCC/C(=C/CNC(C)c1ccccn1)/C)C 2230a_100000181244_100016991246 [0,0,0,0,0,0|3,0,1]=4 7 B19R1.26147 CC(=CCC/C(=C/CNC(C)c1cccnc1)/C)C 2230a_100000195435_100016991246 [0,0,0,0,0,0|3,0,1]=4 8 B19R1.26147 CC(=CCC/C(=C/CNC(C)c1ccncc1)/C)C 2230a_100000181269_100016991246 [0,0,0,0,0,0|3,0,1]=4 9 B19R1.26147 CC(=CCC/C(=C/CN[C@H](C)c1ccccc1)/C)C 2230a_100000751104_100016991246 [0,0,0,0,0,0|2,0,1]=3 10 B19R1.26147 CC(=CCC/C(=C/CO[C@H](C)c1ccccc1)/C)C 34a_100000761318_100016991246 [0,0,0,0,0,0|1,0,1]=2 11 B19R1.26147 CC(=CCC/C(=C/CO[C@H](C)c1ccccc1)/C)C 7a_100000761318_100016991246 [0,0,0,0,0,0|1,0,1]=2 12 B19R1.26147 CC(=CCC/C(=C\COC(C)c1ccccc1)/C)C 34a_100016990311_100000211855 [0,0,0,0,0,0|1,0,1]=2 13 B19R1.26147 CC(=CCC/C(=C\COC(C)c1ccccc1)/C)C 7a_100016990311_100000230085 [0,0,0,0,0,0|1,0,1]=2 14 B19R1.26147 CC(=CCC/C(=C\COC(C)c1cnccn1)/C)C 7a_100016990311_200000703233 [0,0,0,0,0,0|3,0,1]=4 15 B19R1.26147 CC(=CCCC(=O)CCNC(=O)c1ccccc1)C 1458a_100000182757_100011217483 [0,0,0,0,0,0|2,0,1]=3 16 B19R1.26147 CC(=CCCC(C)C=NNC(=O)c1ccccc1)C 4a_100000184135_100000033009 [0,0,0,0,0,0|2,0,1]=3 17 B19R1.26147 CC(=CCCC(C)C=NNC(=O)c1ccccn1)C 4a_100000184044_100000033009 [0,0,0,0,0,0|3,0,1]=4 18 B19R1.26147 CC(=CCCC(C)C=NNC(=O)c1cccnc1)C 4a_100000189771_100000033009 [0,0,0,0,0,0|3,0,1]=4 19 B19R1.26147 CC(=CCCC(C)C=NNC(=O)c1ccncc1)C 4a_100000189768_100000033009 [0,0,0,0,0,0|3,0,1]=4 20 B19R1.26147 CC(=CCCC(C)CCOC(C)c1ccccc1)C 34a_100000017536_100000211855 [0,0,0,0,0,0|1,0,3]=4 21 B19R1.26147 CC(=CCCC(C)CCOC(C)c1ccccc1)C 7a_100000017536_100000230085 [0,0,0,0,0,0|1,0,3]=4 22 B19R1.26147 CC(=CCCC(C)CCO[C@H](C)c1ccccc1)C 34a_100000761318_100009814015 [0,0,0,0,0,0|1,0,3]=4 23 B19R1.26147 CC(=CCCC(C)CCO[C@H](C)c1ccccc1)C 7a_100000761318_100009814015 [0,0,0,0,0,0|1,0,3]=4 24 B19R1.26147 CC(=CCCC(C)OCCC(=O)c1ccccc1)C 7a_100102619829_100000750707 [0,0,0,0,0,0|2,0,1]=3 25 B19R1.26147 CC(=CCCC(C)OCCS(=O)c1ccccc1)C 7a_100102619829_100000740319 [0,0,0,0,0,0|3,0,1]=4 26 B19R1.26147 CC(=CCCC(C)OCOC(=O)c1ccccc1)C 7a_100102619829_100000073877 [0,0,0,0,0,0|1,0,1]=2 27 B19R1.26147 CC(=CCNC(=O)CCNC(=O)c1ccccc1)C 11a_100000718196_100000182757 [0,0,0,0,0,0|3,0,1]=4 28 B19R1.26147 CC(=CCNC(=O)CCNC(=O)c1ccccc1)C 1626a_100000718196_100000182757 [0,0,0,0,0,0|3,0,1]=4 29 B19R1.26147 CC(=CCNC(=O)CCNC(=O)c1ccccc1)C 527a_100000718196_100000182757 [0,0,0,0,0,0|3,0,1]=4 30 B19R1.26147 CC(=O)NCCC(=O)CCOC(=O)c1ccccc1 1458a_100000183196_100000184176 [0,0,0,0,0,0|3,0,1]=4 31 B19R1.26147 CC(=O)SCCC(=O)CCOC(=O)c1ccccc1 1458a_100000048949_100000184176 [0,0,0,0,0,0|3,0,1]=4 32 B19R1.26147 CC(C)/C=C/CC(=O)CCOC(=O)c1ccccc1 1458a_100016292215_100000184176 [0,0,0,0,0,0|1,0,3]=4 33 B19R1.26147 CC(C)CCCC(=O)CCOC(=O)c1ccccc1 1458a_100011216857_100000184176 [0,0,0,0,0,0|1,0,3]=4 34 B19R1.26147 CC(C)CCCC(C)OCOC(=O)c1ccccc1 7a_200011218570_100000073877 [0,0,0,0,0,0|1,0,3]=4 35 B19R1.26147 CN(C)CCCN(C)CCOC(=O)c1ccccc1 269982a_100000225831_100009812718 [0,0,0,0,0,0|2,0,2]=4 36 B18R1.1157 CC(=CCCNCCNC(=O)c1ccccc1)C 2230a_100000736134_100011217483 [1,0,0,0,0,0|2,0,1]=4 37 B18R1.1157 CC(=CCCOCCNC(=O)c1ccccc1)C 34a_200000158897_100011217483 [1,0,0,0,0,0|2,0,1]=4 38 B18R1.1157 CC(=CCCOCCNC(=O)c1ccccc1)C 7a_200000158897_100011217483 [1,0,0,0,0,0|2,0,1]=4 39 B18R1.1157 CC(=CCCOCCOC(=O)c1ccccc1)C 7a_100000025465_100011217483 [1,0,0,0,0,0|1,0,1]=3 40 B18R1.1157 CC(=CCCSCCCC(=O)c1ccccc1)C 62a_100000211006_100011217483 [1,0,0,0,0,0|2,0,1]=4 41 B18R1.1157 CC(=CCCSCCCC(=O)c1ccccc1)C 62a_100011217483_100000211006 [1,0,0,0,0,0|2,0,1]=4 42 B18R1.1157 CC(=CCCSCCNC(=O)c1ccccc1)C 62a_100011217483_200011215302 [1,0,0,0,0,0|2,0,1]=4 43 B18R1.1157 CC(=CCCSCCNC(=O)c1ccccc1)C 62a_200011215302_100011217483 [1,0,0,0,0,0|2,0,1]=4 44 B18R1.1157 CC(=CCCSCCOC(=O)c1ccccc1)C 62a_100009812718_100011217483 [1,0,0,0,0,0|1,0,1]=3 45 B18R1.1157 CC(=CCCSCCOC(=O)c1ccccc1)C 62a_100011217483_100009812718 [1,0,0,0,0,0|1,0,1]=3 46 B18R1.1157 CC(=CCNCCCOC(=O)c1ccccc1)C 34a_100000718196_200009892979 [1,0,0,0,0,0|1,0,2]=4 47 B18R1.1157 CC(=CCOCCCOC(=O)c1ccccc1)C 34a_100000753907_200009892979 [1,0,0,0,0,0|1,0,2]=4 48 B18R1.1157 CC(=CCSCCCOC(=O)c1ccccc1)C 62a_100000761012_200009892979 [1,0,0,0,0,0|1,0,2]=4 49 B18R1.1157 CC(=CCSCCCOC(=O)c1ccccc1)C 62a_200009892979_100000761012 [1,0,0,0,0,0|1,0,2]=4 50 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccc1)/C)C 2230a_100015324214_100016991246 [1,0,0,0,0,0|1,0,1]=3 51 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccc1)/C)C 2230a_200020676162_100015291786 [1,0,0,0,0,0|1,0,1]=3 52 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccc1)/C)C 270004a_200020676162_100015611070 [1,0,0,0,0,0|1,0,1]=3 53 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccc1)/C)C 34a_100015324214_100016991246 [1,0,0,0,0,0|1,0,1]=3 54 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccc1)/C)C 34a_200020676162_100015291786 [1,0,0,0,0,0|1,0,1]=3 55 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccn1)/C)C 2230a_200020676162_100000721315 [1,0,0,0,0,0|2,0,1]=4 56 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccn1)/C)C 270004a_200020676162_100000209966 [1,0,0,0,0,0|2,0,1]=4 57 B18R1.21046 CC(=CCC/C(=C/CNCc1ccccn1)/C)C 34a_200020676162_100000721315 [1,0,0,0,0,0|2,0,1]=4 58 B18R1.21046 CC(=CCC/C(=C/CNCc1cccnc1)/C)C 2230a_200020676162_100000741622 [1,0,0,0,0,0|2,0,1]=4 59 B18R1.21046 CC(=CCC/C(=C/CNCc1cccnc1)/C)C 270004a_200020676162_100000209961 [1,0,0,0,0,0|2,0,1]=4 60 B18R1.21046 CC(=CCC/C(=C/CNCc1cccnc1)/C)C 34a_200020676162_100000733263 [1,0,0,0,0,0|2,0,1]=4 61 B18R1.21046 CC(=CCC/C(=C/CNCc1ccncc1)/C)C 2230a_200020676162_100015193705 [1,0,0,0,0,0|2,0,1]=4 62 B18R1.21046 CC(=CCC/C(=C/COCc1ccccc1)/C)C 34a_100000210790_100016991246 [1,0,0,0,0,0|0,0,1]=2 63 B18R1.21046 CC(=CCC/C(=C/COCc1ccccc1)/C)C 7a_100000210790_100016991246 [1,0,0,0,0,0|0,0,1]=2 64 B18R1.21046 CC(=CCC/C(=C/CSCc1ccccc1)/C)C 62a_100000211182_100016991246 [1,0,0,0,0,0|0,1,1]=3 65 B18R1.21046 CC(=CCC/C(=C/CSCc1ccccc1)/C)C 62a_100016991246_100015291786 [1,0,0,0,0,0|0,1,1]=3 66 B18R1.21046 CC(=CCC/C(=C/CSCc1ccccn1)/C)C 62a_100000721315_100016991246 [1,0,0,0,0,0|1,1,1]=4 67 B18R1.21046 CC(=CCC/C(=C/CSCc1ccccn1)/C)C 62a_100016991246_100000721315 [1,0,0,0,0,0|1,1,1]=4 68 B18R1.21046 CC(=CCC/C(=C/CSCc1cccnc1)/C)C 62a_100000741622_100016991246 [1,0,0,0,0,0|1,1,1]=4 69 B18R1.21046 CC(=CCC/C(=C/CSCc1cccnc1)/C)C 62a_100016991246_100000741622 [1,0,0,0,0,0|1,1,1]=4 70 B18R1.21046 CC(=CCC/C(=C/CSCc1ccncc1)/C)C 62a_100015193705_100016991246 [1,0,0,0,0,0|1,1,1]=4 71 B18R1.21046 CC(=CCC/C(=C/CSCc1ccncc1)/C)C 62a_100016991246_100015193705 [1,0,0,0,0,0|1,1,1]=4 72 B18R1.21046 CC(=CCC/C(=C\COCc1ccccc1)/C)C 34a_100016990311_100015291786 [1,0,0,0,0,0|0,0,1]=2 73 B18R1.21046 CC(=CCC/C(=C\COCc1ccccc1)/C)C 7a_100016990311_100000211182 [1,0,0,0,0,0|0,0,1]=2 74 B18R1.21046 CC(=CCC/C(=C\COCc1ccccn1)/C)C 34a_100016990311_100000721315 [1,0,0,0,0,0|1,0,1]=3 75 B18R1.21046 CC(=CCC/C(=C\COCc1ccccn1)/C)C 7a_100016990311_100000721315 [1,0,0,0,0,0|1,0,1]=3 76 B18R1.21046 CC(=CCC/C(=C\COCc1cccnc1)/C)C 34a_100016990311_100000733263 [1,0,0,0,0,0|1,0,1]=3 77 B18R1.21046 CC(=CCC/C(=C\COCc1cccnc1)/C)C 7a_100016990311_100000741622 [1,0,0,0,0,0|1,0,1]=3 78 B18R1.21046 CC(=CCC/C(=C\COCc1cccnn1)/C)C 34a_100016990311_100016990269 [1,0,0,0,0,0|2,0,1]=4 79 B18R1.21046 CC(=CCC/C(=C\COCc1cccnn1)/C)C 7a_100016990311_100016990269 [1,0,0,0,0,0|2,0,1]=4 80 B18R1.21046 CC(=CCC/C(=C\COCc1ccncc1)/C)C 7a_100016990311_100015193705 [1,0,0,0,0,0|1,0,1]=3 81 B18R1.21046 CC(=CCC/C(=C\COCc1cnccn1)/C)C 34a_100016990311_100016995436 [1,0,0,0,0,0|2,0,1]=4 82 B18R1.21046 CC(=CCC/C(=C\COCc1cnccn1)/C)C 7a_100016990311_100016995436 [1,0,0,0,0,0|2,0,1]=4 83 B18R1.21046 CC(=CCC/C(=C\COCc1cncnc1)/C)C 34a_100016990311_100015196519 [1,0,0,0,0,0|2,0,1]=4 84 B18R1.21046 CC(=CCC/C(=C\COCc1cncnc1)/C)C 7a_100016990311_100015196519 [1,0,0,0,0,0|2,0,1]=4 85 B18R1.21046 CC(=CCC/C(=C\COCc1ncccn1)/C)C 34a_100016990311_100000703007 [1,0,0,0,0,0|2,0,1]=4 86 B18R1.21046 CC(=CCC/C(=C\COCc1ncccn1)/C)C 7a_100016990311_100000703007 [1,0,0,0,0,0|2,0,1]=4 87 B18R1.21046 CC(=CCCC(=CC=NNc1ccccc1)C)C 4a_100015195140_100000211119 [1,0,0,0,0,0|2,0,1]=4 88 B18R1.21046 CC(=CCCC(=O)C=C/C=C/c1ccccc1)C 1458a_100016289705_100011217483 [1,0,0,0,0,0|2,0,1]=4 89 B18R1.21046 CC(=CCCC(=O)CCOCc1ccccc1)C 1458a_100000743319_100011217483 [1,0,0,0,0,0|1,0,2]=4 90 B18R1.21046 CC(=CCCC(C)CCOCc1ccccc1)C 34a_100000017536_100015291786 [1,0,0,0,0,0|0,0,3]=4 91 B18R1.21046 CC(=CCCC(C)CCOCc1ccccc1)C 34a_100000210790_100009814015 [1,0,0,0,0,0|0,0,3]=4 92 B18R1.21046 CC(=CCCC(C)CCOCc1ccccc1)C 7a_100000017536_100000211182 [1,0,0,0,0,0|0,0,3]=4 93 B18R1.21046 CC(=CCCC(C)CCOCc1ccccc1)C 7a_100000210790_100009814015 [1,0,0,0,0,0|0,0,3]=4 94 B18R1.21046 CC(=CCCC(C)NC/C=C/c1ccccc1)C 270004a_100020603302_100000765506 [1,0,0,0,0,0|2,0,1]=4 95 B18R1.21046 CC(=CCCC(C)OC/C=C/c1ccccc1)C 34a_100102619829_100016265936 [1,0,0,0,0,0|2,0,1]=4 96 B18R1.21046 CC(=CCCC(C)OC/C=C/c1ccccc1)C 7a_100102619829_100016265936 [1,0,0,0,0,0|2,0,1]=4 97 B18R1.21046 CC(=CCCC(C)OCOCc1ccccc1)C 34a_100102619829_100000763385 [1,0,0,0,0,0|1,0,2]=4 98 B18R1.21046 CC(=CCCN(C)CCOCc1ccccc1)C 2230a_100000687121_100011217483 [1,0,0,0,0,0|1,0,2]=4 99 B18R1.21046 CC(=CCCN(C)CCOCc1ccccc1)C 269982a_100000687121_100011217483 [1,0,0,0,0,0|1,0,2]=4 100 B20R1.31045 CC(=CCC/C(=C/CNC(C)(C)c1ccccc1)/C)C 2230a_100011218174_100016991246 [0,1,0,0,0,0|2,0,1]=4 101 B20R1.31045 CC(=CCC/C(=C/CNC(C)(C)c1ccccc1)/C)C 2230a_200020676162_100000034625 [0,1,0,0,0,0|2,0,1]=4 102 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1)/C)C 270084a_200020676162_100000210345 [0,1,0,0,0,0|2,0,0]=3 103 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1)/C)C 274078a_200020676162_100000210345 [0,1,0,0,0,0|2,0,0]=3 104 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1)/C)C 40a_200020676162_100000032697 [0,1,0,0,0,0|2,0,0]=3 105 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccn1)/C)C 270084a_200020676162_100016994956 [0,1,0,0,0,0|3,0,0]=4 106 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccn1)/C)C 274078a_200020676162_100016994956 [0,1,0,0,0,0|3,0,0]=4 107 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccn1)/C)C 40a_200020676162_100000070048 [0,1,0,0,0,0|3,0,0]=4 108 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1cccnc1)/C)C 270084a_200020676162_100000736704 [0,1,0,0,0,0|3,0,0]=4 109 B20R1.31045 CC(=CCC/C(=C/CNS(=O)(=O)c1cccnc1)/C)C 274078a_200020676162_100000736704 [0,1,0,0,0,0|3,0,0]=4 110 B20R1.31045 CC(=CCC/C(=C/COC(C)(C)c1ccccc1)/C)C 7a_100000694644_100016991246 [0,1,0,0,0,0|1,0,1]=3 111 B20R1.31045 CC(=CCC/C(=C/COC(C)(C)c1ccccn1)/C)C 7a_100000041474_100016991246 [0,1,0,0,0,0|2,0,1]=4 112 B20R1.31045 CC(=CCC/C(=C\COC(F)(F)c1ccccc1)/C)C 7a_100016990311_100000036403 [0,1,0,0,0,0|1,0,1]=3 113 B20R1.31058 CC(=CCCC(=O)[C@H](C)CSC(=O)c1ccccc1)C 1458a_100016998329_100011217483 [0,1,0,0,0,0|1,1,1]=4 114 B20R1.31083 CN(C)C(=O)CCC(=O)CCOC(=O)c1ccccc1 1458a_100011200748_100000184176 [0,1,0,0,0,0|2,0,1]=4 115 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Br)/C)C 11a_200020676162_100000185839 [0,1,0,0,0,0|1,0,0]=2 116 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Br)/C)C 1626a_200020676162_100000185839 [0,1,0,0,0,0|1,0,0]=2 117 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Br)/C)C 527a_200020676162_100000185839 [0,1,0,0,0,0|1,0,0]=2 118 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C)/C)C 11a_200020676162_100000188618 [0,1,0,0,0,0|1,0,0]=2 119 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C)/C)C 1626a_200020676162_100000188618 [0,1,0,0,0,0|1,0,0]=2 120 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C)/C)C 527a_200020676162_100000188618 [0,1,0,0,0,0|1,0,0]=2 121 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Cl)/C)C 11a_200020676162_100000210187 [0,1,0,0,0,0|1,0,0]=2 122 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Cl)/C)C 1626a_200020676162_100000210187 [0,1,0,0,0,0|1,0,0]=2 123 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)Cl)/C)C 527a_200020676162_100000210187 [0,1,0,0,0,0|1,0,0]=2 124 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)F)/C)C 11a_200020676162_100000187176 [0,1,0,0,0,0|1,0,0]=2 125 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)F)/C)C 1626a_200020676162_100000187176 [0,1,0,0,0,0|1,0,0]=2 126 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)F)/C)C 527a_200020676162_100000187176 [0,1,0,0,0,0|1,0,0]=2 127 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)I)/C)C 11a_200020676162_100000187904 [0,1,0,0,0,0|1,0,0]=2 128 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)I)/C)C 1626a_200020676162_100000187904 [0,1,0,0,0,0|1,0,0]=2 129 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)I)/C)C 527a_200020676162_100000187904 [0,1,0,0,0,0|1,0,0]=2 130 B20R1.52890 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)O)/C)C 527a_200020676162_100000212099 [0,1,0,0,0,0|1,0,0]=2 131 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)Br)/C)C 2230a_200020676162_100000755118 [0,1,0,0,0,0|2,0,1]=4 132 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)Br)/C)C 34a_200020676162_100000755118 [0,1,0,0,0,0|2,0,1]=4 133 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)C)/C)C 2230a_200020676162_100011261388 [0,1,0,0,0,0|2,0,1]=4 134 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)C)/C)C 34a_200020676162_100011261388 [0,1,0,0,0,0|2,0,1]=4 135 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)Cl)/C)C 2230a_200020676162_100000684792 [0,1,0,0,0,0|2,0,1]=4 136 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)F)/C)C 2230a_200020676162_100000743420 [0,1,0,0,0,0|2,0,1]=4 137 B20R1.52890 CC(=CCC/C(=C/CNC(C)c1ccc(cc1)F)/C)C 34a_200020676162_100000743420 [0,1,0,0,0,0|2,0,1]=4 138 B20R1.52890 CC(=CCC/C(=C/CN[C@@H](C)c1ccc(cc1)F)/C)C 2230a_100025705893_100016991246 [0,1,0,0,0,0|2,0,1]=4 139 B20R1.52890 CC(=CCC/C(=C/CN[C@@H](C)c1ccc(cc1)F)/C)C 34a_100025705893_100016991246 [0,1,0,0,0,0|2,0,1]=4 140 B20R1.52890 CC(=CCC/C(=C/CN[C@@H](C)c1ccc(cc1)I)/C)C 2230a_100000753911_100016991246 [0,1,0,0,0,0|2,0,1]=4 141 B20R1.52890 CC(=CCC/C(=C/CN[C@@H](C)c1ccc(cc1)O)/C)C 2230a_100161106496_100016991246 [0,1,0,0,0,0|2,0,1]=4 142 B20R1.52890 CC(=CCC/C(=C/CN[C@H](C)c1ccc(cc1)Br)/C)C 2230a_100000720352_100016991246 [0,1,0,0,0,0|2,0,1]=4 143 B20R1.52890 CC(=CCC/C(=C/CN[C@H](C)c1ccc(cc1)C)/C)C 2230a_100016988085_100016991246 [0,1,0,0,0,0|2,0,1]=4 144 B20R1.52890 CC(=CCC/C(=C/CN[C@H](C)c1ccc(cc1)C)/C)C 34a_100016988085_100016991246 [0,1,0,0,0,0|2,0,1]=4 145 B20R1.52890 CC(=CCC/C(=C/CN[C@H](C)c1ccc(cc1)Cl)/C)C 2230a_100015205461_100016991246 [0,1,0,0,0,0|2,0,1]=4 146 B20R1.52890 CC(=CCC/C(=C/CN[C@H](C)c1ccc(cc1)Cl)/C)C 34a_100015205461_100016991246 [0,1,0,0,0,0|2,0,1]=4 147 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(cc1)F)/C)C 34a_100000181323_100016991246 [0,1,0,0,0,0|1,0,1]=3 148 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(cc1)F)/C)C 7a_100000181323_100016991246 [0,1,0,0,0,0|1,0,1]=3 149 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(cc1)N)/C)C 34a_100011216399_100016991246 [0,1,0,0,0,0|1,0,1]=3 150 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(cn1)Br)/C)C 34a_100012353650_100016991246 [0,1,0,0,0,0|2,0,1]=4 151 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(cn1)Br)/C)C 7a_100012353650_100016991246 [0,1,0,0,0,0|2,0,1]=4 152 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)Br)/C)C 34a_200010274204_100016991246 [0,1,0,0,0,0|2,0,1]=4 153 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)Br)/C)C 7a_200010274204_100016991246 [0,1,0,0,0,0|2,0,1]=4 154 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)C)/C)C 34a_200011815720_100016991246 [0,1,0,0,0,0|2,0,1]=4 155 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)C)/C)C 7a_200011815720_100016991246 [0,1,0,0,0,0|2,0,1]=4 156 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)Cl)/C)C 34a_200012017543_100016991246 [0,1,0,0,0,0|2,0,1]=4 157 B20R1.52890 CC(=CCC/C(=C/COC(C)c1ccc(nc1)Cl)/C)C 7a_200012017543_100016991246 [0,1,0,0,0,0|2,0,1]=4 158 B20R1.52890 CC(=CCC/C(=C/CO[C@H](C)c1ccc(cc1)C)/C)C 34a_100000690690_100016991246 [0,1,0,0,0,0|1,0,1]=3 159 B20R1.52890 CC(=CCC/C(=C/CO[C@H](C)c1ccc(cc1)C)/C)C 7a_100000690690_100016991246 [0,1,0,0,0,0|1,0,1]=3 160 B20R1.52890 CC(=CCC/C(=C\COC(C)c1ccc(cc1)C)/C)C 34a_100016990311_100011261388 [0,1,0,0,0,0|1,0,1]=3 161 B20R1.52890 CC(=CCC/C(=C\COC(C)c1ccc(cc1)C)/C)C 7a_100016990311_100011261388 [0,1,0,0,0,0|1,0,1]=3 162 B20R1.52890 CC(=CCC/C(=C\COC(C)c1ccc(cc1)F)/C)C 34a_100016990311_100000743420 [0,1,0,0,0,0|1,0,1]=3 163 B20R1.52890 CC(=CCC/C(=C\COC(C)c1ccc(cc1)F)/C)C 7a_100016990311_100000743420 [0,1,0,0,0,0|1,0,1]=3 164 B20R1.52890 CC(=CCCC(=O)CCNC(=O)c1ccc(cc1)Br)C 1458a_100000184271_100011217483 [0,1,0,0,0,0|2,0,1]=4 165 B20R1.52890 CC(=CCCC(=O)CCNC(=O)c1ccc(cc1)Cl)C 1458a_100000184362_100011217483 [0,1,0,0,0,0|2,0,1]=4 166 B20R1.52890 CC(=CCCC(=O)CCNC(=O)c1ccc(cc1)F)C 1458a_100000195280_100011217483 [0,1,0,0,0,0|2,0,1]=4 167 B20R1.52890 CC(=CCCC(C)C=NNC(=O)c1ccc(cc1)Br)C 4a_100000183614_100000033009 [0,1,0,0,0,0|2,0,1]=4 168 B20R1.52890 CC(=CCCC(C)C=NNC(=O)c1ccc(cc1)C)C 4a_100000189790_100000033009 [0,1,0,0,0,0|2,0,1]=4 169 B20R1.52890 CC(=CCCC(C)C=NNC(=O)c1ccc(cc1)Cl)C 4a_100000184390_100000033009 [0,1,0,0,0,0|2,0,1]=4 170 B20R1.52890 CC(=CCCC(C)C=NNC(=O)c1ccc(cc1)F)C 4a_100000182866_100000033009 [0,1,0,0,0,0|2,0,1]=4 171 B20R1.52890 CC(=CCCC(C)C=NNC(=O)c1ccc(cc1)I)C 4a_100000189773_100000033009 [0,1,0,0,0,0|2,0,1]=4 172 B20R1.52890 CC(=CCCC(C)OCCC(=O)c1ccc(cc1)Br)C 7a_100102619829_100011215963 [0,1,0,0,0,0|2,0,1]=4 173 B20R1.52890 CC(=CCCC(C)OCCC(=O)c1ccc(cc1)C)C 7a_100102619829_100000701375 [0,1,0,0,0,0|2,0,1]=4 174 B20R1.52890 CC(=CCCC(C)OCCC(=O)c1ccc(cc1)Cl)C 7a_100102619829_100011216492 [0,1,0,0,0,0|2,0,1]=4 175 B20R1.52890 CC(=CCCC(C)OCCC(=O)c1ccc(cc1)F)C 7a_100102619829_100000211231 [0,1,0,0,0,0|2,0,1]=4 176 B20R1.52890 CC(=CCCC(C)OCCC(=O)c1ccc(cc1)O)C 7a_100102619829_100009879949 [0,1,0,0,0,0|2,0,1]=4 177 B20R1.52890 [2H]C(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)F 34a_217856618577_100016991246 [0,1,0,0,0,0|1,0,1]=3 178 B20R1.52890 [2H]C(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)F 7a_217856618577_100016991246 [0,1,0,0,0,0|1,0,1]=3 179 B20R1.61706 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1)C)C 1458a_100016995320_100000211460 [0,1,0,0,0,0|1,0,1]=3 180 B20R1.61706 CC(=CCCC(=CC(=O)CC(=O)c1ccccn1)C)C 1458a_100016995320_100000027445 [0,1,0,0,0,0|2,0,1]=4 181 B20R1.61706 CC(=CCCC(=CC(=O)CC(=O)c1cccnc1)C)C 1458a_100016995320_100015188593 [0,1,0,0,0,0|2,0,1]=4 182 B20R1.61706 CC(=CCCC(=CC(=O)CC(=O)c1ccncc1)C)C 1458a_100016995320_100000027454 [0,1,0,0,0,0|2,0,1]=4 183 B20R1.61706 CC(=CCCC(=O)CC(C)NC(=O)c1ccccc1)C 1458a_100000195627_100011217483 [0,1,0,0,0,0|2,0,1]=4 184 B20R1.61708 C=C(C(=O)C/C=C(\C)/CCC=C(C)C)c1ccccc1 1458a_100000065200_100016991246 [0,1,0,0,0,0|2,0,0]=3 185 B20R1.61708 CC(=CCC/C(=C/CC(=O)C(F)c1ccccc1)/C)C 1458a_100000698975_100016991246 [0,1,0,0,0,0|2,0,1]=4 186 B20R1.61708 CC(=CCC/C(=C/CC(=O)[C@@H](C)c1ccccc1)/C)C 1458a_100000751047_100016991246 [0,1,0,0,0,0|2,0,1]=4 187 B20R1.61708 CC(=CCC/C(=C/CC(=O)[C@H](O)c1ccccc1)/C)C 1458a_100000684486_100016991246 [0,1,0,0,0,0|1,0,2]=4 188 B20R1.61708 CC(=CCC/C(=C/CN(C)C(C)c1ccccc1)/C)C 2230a_100000195388_100016991246 [0,1,0,0,0,0|2,0,1]=4 189 B20R1.61708 CC(=CCC/C(=C/CN(C)C(C)c1ccccc1)/C)C 269982a_100000195388_100016991246 [0,1,0,0,0,0|2,0,1]=4 190 B20R1.61708 CC(=CCCN(C)CCN(C)C(=O)c1ccccc1)C 2230a_200011982063_100011217483 [0,1,0,0,0,0|2,0,1]=4 191 B20R1.61708 CC(=CCCN(C)CCN(C)C(=O)c1ccccc1)C 269982a_200011982063_100011217483 [0,1,0,0,0,0|2,0,1]=4 192 B20R1.80205 C#CC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100011219616_100016991246 [0,1,0,0,0,0|1,0,1]=3 193 B20R1.80205 C#CC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100011219616_100016991246 [0,1,0,0,0,0|1,0,1]=3 194 B20R1.80205 C=CC(NC/C=C(\C)/CCC=C(C)C)c1ccccc1 2230a_200020676162_200000085779 [0,1,0,0,0,0|2,0,1]=4 195 B20R1.80205 C=CC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100011215659_100016991246 [0,1,0,0,0,0|1,0,1]=3 196 B20R1.80205 C=CC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100011215659_100016991246 [0,1,0,0,0,0|1,0,1]=3 197 B20R1.80205 CC(=CCC/C(=C/CN[C@H](CO)c1ccccc1)/C)C 2230a_100000751927_100016991246 [0,1,0,0,0,0|1,0,2]=4 198 B20R1.80205 CC(=CCC/C(=C/CN[C@H](CO)c1ccccc1)/C)C 34a_100000751927_100016991246 [0,1,0,0,0,0|1,0,2]=4 199 B20R1.80205 CC(=CCC/C(=C/COC(C#N)c1ccccc1)/C)C 7a_100011217353_100016991246 [0,1,0,0,0,0|1,0,1]=3 200 B20R1.80205 CC(=CCC/C(=C/COC(CBr)c1ccccc1)/C)C 7a_100000185958_100016991246 [0,1,0,0,0,0|1,0,1]=3 201 B20R1.80205 CC(=CCC/C(=C/COC(CN)c1ccccc1)/C)C 34a_100000210709_100016991246 [0,1,0,0,0,0|1,0,1]=3 202 B20R1.80205 CC(=CCC/C(=C/CO[C@H](CCl)c1ccccc1)/C)C 34a_100011933945_100016991246 [0,1,0,0,0,0|1,0,1]=3 203 B20R1.80205 CC(=CCC/C(=C/CO[C@H](CCl)c1ccccc1)/C)C 7a_100011933945_100016991246 [0,1,0,0,0,0|1,0,1]=3 204 B20R1.80205 CCC(NC/C=C(\C)/CCC=C(C)C)c1ccccc1 2230a_100000737752_100016991246 [0,1,0,0,0,0|2,0,1]=4 205 B20R1.80205 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100000698172_100016991246 [0,1,0,0,0,0|1,0,1]=3 206 B20R1.80205 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100000698172_100016991246 [0,1,0,0,0,0|1,0,1]=3 207 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Br)/C)C 11a_200020676162_100000188424 [0,1,0,0,0,0|1,0,0]=2 208 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Br)/C)C 1626a_200020676162_100000188424 [0,1,0,0,0,0|1,0,0]=2 209 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Br)/C)C 527a_200020676162_100000188424 [0,1,0,0,0,0|1,0,0]=2 210 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1C)/C)C 11a_200020676162_100000212026 [0,1,0,0,0,0|1,0,0]=2 211 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1C)/C)C 1626a_200020676162_100000212026 [0,1,0,0,0,0|1,0,0]=2 212 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1C)/C)C 527a_200020676162_100000212026 [0,1,0,0,0,0|1,0,0]=2 213 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Cl)/C)C 11a_200020676162_100000185844 [0,1,0,0,0,0|1,0,0]=2 214 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Cl)/C)C 1626a_200020676162_100000185844 [0,1,0,0,0,0|1,0,0]=2 215 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1Cl)/C)C 527a_200020676162_100000185844 [0,1,0,0,0,0|1,0,0]=2 216 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1F)/C)C 11a_200020676162_100000188656 [0,1,0,0,0,0|1,0,0]=2 217 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1F)/C)C 1626a_200020676162_100000188656 [0,1,0,0,0,0|1,0,0]=2 218 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1F)/C)C 527a_200020676162_100000188656 [0,1,0,0,0,0|1,0,0]=2 219 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1I)/C)C 11a_200020676162_100000187884 [0,1,0,0,0,0|1,0,0]=2 220 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1I)/C)C 1626a_200020676162_100000187884 [0,1,0,0,0,0|1,0,0]=2 221 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1I)/C)C 527a_200020676162_100000187884 [0,1,0,0,0,0|1,0,0]=2 222 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1[O-])/C)C 1626a_200020676162_100009911694 [0,1,0,0,0,0|1,0,0]=2 223 B20R1.370440 CC(=CCC/C(=C/CNC(=O)c1ccccc1[O-])/C)C 527a_200020676162_100009911694 [0,1,0,0,0,0|1,0,0]=2 224 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1Br)/C)C 2230a_100000181357_100016991246 [0,1,0,0,0,0|2,0,1]=4 225 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1C)/C)C 2230a_100000181355_100016991246 [0,1,0,0,0,0|2,0,1]=4 226 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1C)/C)C 34a_100000181355_100016991246 [0,1,0,0,0,0|2,0,1]=4 227 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1Cl)/C)C 2230a_100000174978_100016991246 [0,1,0,0,0,0|2,0,1]=4 228 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1Cl)/C)C 2230a_200020676162_100000181259 [0,1,0,0,0,0|2,0,1]=4 229 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1Cl)/C)C 34a_100000174978_100016991246 [0,1,0,0,0,0|2,0,1]=4 230 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1F)/C)C 2230a_100000181408_100016991246 [0,1,0,0,0,0|2,0,1]=4 231 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1F)/C)C 2230a_200020676162_200000741388 [0,1,0,0,0,0|2,0,1]=4 232 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1F)/C)C 34a_100000181408_100016991246 [0,1,0,0,0,0|2,0,1]=4 233 B20R1.370440 CC(=CCC/C(=C/CNC(C)c1ccccc1F)/C)C 34a_200020676162_200000741388 [0,1,0,0,0,0|2,0,1]=4 234 B20R1.370440 CC(=CCC/C(=C/CN[C@H](C)c1ccccc1O)/C)C 2230a_100025703389_100016991246 [0,1,0,0,0,0|2,0,1]=4 235 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccccc1C)/C)C 34a_100000742021_100016991246 [0,1,0,0,0,0|1,0,1]=3 236 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccccc1C)/C)C 7a_100000742021_100016991246 [0,1,0,0,0,0|1,0,1]=3 237 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccccc1F)/C)C 34a_100000697922_100016991246 [0,1,0,0,0,0|1,0,1]=3 238 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccccc1F)/C)C 7a_100000697922_100016991246 [0,1,0,0,0,0|1,0,1]=3 239 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccccc1N)/C)C 7a_100011405641_100016991246 [0,1,0,0,0,0|1,0,1]=3 240 B20R1.370440 CC(=CCC/C(=C/COC(C)c1cccnc1Cl)/C)C 34a_100009865335_100016991246 [0,1,0,0,0,0|2,0,1]=4 241 B20R1.370440 CC(=CCC/C(=C/COC(C)c1cccnc1Cl)/C)C 7a_100009865335_100016991246 [0,1,0,0,0,0|2,0,1]=4 242 B20R1.370440 CC(=CCC/C(=C/COC(C)c1ccncc1F)/C)C 34a_100012180158_100016991246 [0,1,0,0,0,0|2,0,1]=4 243 B20R1.370440 CC(=CCC/C(=C/CO[C@@H](C)c1ncccc1Br)/C)C 7a_100013325542_100016991246 [0,1,0,0,0,0|2,0,1]=4 244 B20R1.370440 CC(=CCC/C(=C\COC(C)c1ccccc1F)/C)C 34a_100016990311_200000741388 [0,1,0,0,0,0|1,0,1]=3 245 B20R1.370440 CC(=CCC/C(=C\COC(C)c1ccccc1F)/C)C 7a_100016990311_200000741388 [0,1,0,0,0,0|1,0,1]=3 246 B20R1.370440 CC(=CCCC(=O)CCNC(=O)c1ccccc1C)C 1458a_100000195313_100011217483 [0,1,0,0,0,0|2,0,1]=4 247 B20R1.370440 CC(=CCCC(=O)CCNC(=O)c1ccccc1Cl)C 1458a_100000182440_100011217483 [0,1,0,0,0,0|2,0,1]=4 248 B20R1.370440 CC(=CCCC(C)C=NNC(=O)c1ccccc1Br)C 4a_100000183644_100000033009 [0,1,0,0,0,0|2,0,1]=4 249 B20R1.370440 CC(=CCCC(C)C=NNC(=O)c1ccccc1C)C 4a_100000181371_100000033009 [0,1,0,0,0,0|2,0,1]=4 250 B20R1.370440 CC(=CCCC(C)C=NNC(=O)c1ccccc1Cl)C 4a_100000186534_100000033009 [0,1,0,0,0,0|2,0,1]=4 251 B20R1.370440 CC(=CCCC(C)C=NNC(=O)c1ccccc1F)C 4a_100000183521_100000033009 [0,1,0,0,0,0|2,0,1]=4 252 B20R1.370440 CC(=CCCC(C)C=NNC(=O)c1ccccc1I)C 4a_100000190081_100000033009 [0,1,0,0,0,0|2,0,1]=4 253 B20R1.370440 CC(=CCCC(C)OCCC(=O)c1ccccc1F)C 7a_100102619829_100000086012 [0,1,0,0,0,0|2,0,1]=4 254 B20R1.370440 CC(=CCCC(C)OCCC(=O)c1ccccc1O)C 7a_100102619829_100009873196 [0,1,0,0,0,0|2,0,1]=4 255 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Br)/C)C 11a_200020676162_100000210664 [0,1,0,0,0,0|1,0,0]=2 256 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Br)/C)C 1626a_200020676162_100000210664 [0,1,0,0,0,0|1,0,0]=2 257 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Br)/C)C 527a_200020676162_100000210664 [0,1,0,0,0,0|1,0,0]=2 258 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C)/C)C 11a_200020676162_100000189346 [0,1,0,0,0,0|1,0,0]=2 259 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C)/C)C 1626a_200020676162_100000189346 [0,1,0,0,0,0|1,0,0]=2 260 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C)/C)C 527a_200020676162_100000189346 [0,1,0,0,0,0|1,0,0]=2 261 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Cl)/C)C 11a_200020676162_100000210390 [0,1,0,0,0,0|1,0,0]=2 262 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Cl)/C)C 1626a_200020676162_100000210390 [0,1,0,0,0,0|1,0,0]=2 263 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)Cl)/C)C 527a_200020676162_100000210390 [0,1,0,0,0,0|1,0,0]=2 264 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)F)/C)C 11a_200020676162_100000210950 [0,1,0,0,0,0|1,0,0]=2 265 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)F)/C)C 1626a_200020676162_100000210950 [0,1,0,0,0,0|1,0,0]=2 266 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)F)/C)C 527a_200020676162_100000210950 [0,1,0,0,0,0|1,0,0]=2 267 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)I)/C)C 11a_200020676162_100000184098 [0,1,0,0,0,0|1,0,0]=2 268 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)I)/C)C 1626a_200020676162_100000184098 [0,1,0,0,0,0|1,0,0]=2 269 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)I)/C)C 527a_200020676162_100000184098 [0,1,0,0,0,0|1,0,0]=2 270 B20R1.380202 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)O)/C)C 527a_200020676162_100000183914 [0,1,0,0,0,0|1,0,0]=2 271 B20R1.380202 CC(=CCC/C(=C/CNC(C)c1cccc(c1)Br)/C)C 2230a_100020642005_100016991246 [0,1,0,0,0,0|2,0,1]=4 272 B20R1.380202 CC(=CCC/C(=C/CNC(C)c1cccc(c1)Cl)/C)C 2230a_100102723534_100016991246 [0,1,0,0,0,0|2,0,1]=4 273 B20R1.380202 CC(=CCC/C(=C/CNC(C)c1cccc(c1)Cl)/C)C 34a_100102723534_100016991246 [0,1,0,0,0,0|2,0,1]=4 274 B20R1.380202 CC(=CCC/C(=C/CNC(C)c1cccc(c1)O)/C)C 2230a_100000740644_100016991246 [0,1,0,0,0,0|2,0,1]=4 275 B20R1.380202 CC(=CCC/C(=C/CN[C@H](C)c1cccc(c1)C)/C)C 2230a_100000698126_100016991246 [0,1,0,0,0,0|2,0,1]=4 276 B20R1.380202 CC(=CCC/C(=C/CN[C@H](C)c1cccc(c1)C)/C)C 34a_100000698126_100016991246 [0,1,0,0,0,0|2,0,1]=4 277 B20R1.380202 CC(=CCC/C(=C/CN[C@H](C)c1cccc(c1)F)/C)C 2230a_100015193778_100016991246 [0,1,0,0,0,0|2,0,1]=4 278 B20R1.380202 CC(=CCC/C(=C/CN[C@H](C)c1cccc(c1)F)/C)C 34a_100015193778_100016991246 [0,1,0,0,0,0|2,0,1]=4 279 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cc(ccn1)Cl)/C)C 7a_100000144657_100016991246 [0,1,0,0,0,0|2,0,1]=4 280 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)C)/C)C 34a_100000757818_100016991246 [0,1,0,0,0,0|1,0,1]=3 281 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)C)/C)C 7a_100000757818_100016991246 [0,1,0,0,0,0|1,0,1]=3 282 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)F)/C)C 34a_100000744526_100016991246 [0,1,0,0,0,0|1,0,1]=3 283 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)F)/C)C 7a_100000744526_100016991246 [0,1,0,0,0,0|1,0,1]=3 284 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)N)/C)C 34a_100011217120_100016991246 [0,1,0,0,0,0|1,0,1]=3 285 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(c1)N)/C)C 7a_100011217120_100016991246 [0,1,0,0,0,0|1,0,1]=3 286 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(n1)Br)/C)C 7a_100009820884_100016991246 [0,1,0,0,0,0|2,0,1]=4 287 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(n1)C)/C)C 34a_200011877368_100016991246 [0,1,0,0,0,0|2,0,1]=4 288 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cccc(n1)C)/C)C 7a_200011877368_100016991246 [0,1,0,0,0,0|2,0,1]=4 289 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cncc(c1)Br)/C)C 34a_100012351597_100016991246 [0,1,0,0,0,0|2,0,1]=4 290 B20R1.380202 CC(=CCC/C(=C/COC(C)c1cncc(c1)Br)/C)C 7a_100012351597_100016991246 [0,1,0,0,0,0|2,0,1]=4 291 B20R1.380202 CC(=CCCC(=O)CCNC(=O)c1cccc(c1)C)C 1458a_100000184521_100011217483 [0,1,0,0,0,0|2,0,1]=4 292 B20R1.380202 CC(=CCCC(C)C=NNC(=O)c1cccc(c1)Br)C 4a_100000189783_100000033009 [0,1,0,0,0,0|2,0,1]=4 293 B20R1.380202 CC(=CCCC(C)C=NNC(=O)c1cccc(c1)C)C 4a_100000189845_100000033009 [0,1,0,0,0,0|2,0,1]=4 294 B20R1.380202 CC(=CCCC(C)C=NNC(=O)c1cccc(c1)Cl)C 4a_100000183659_100000033009 [0,1,0,0,0,0|2,0,1]=4 295 B20R1.380202 CC(=CCCC(C)C=NNC(=O)c1cccc(c1)F)C 4a_100000189798_100000033009 [0,1,0,0,0,0|2,0,1]=4 296 B20R1.380202 CC(=CCCC(C)C=NNC(=O)c1cccc(c1)I)C 4a_100000186306_100000033009 [0,1,0,0,0,0|2,0,1]=4 297 B20R2.8489489 CC(=CCCC(=O)C=C1OC(=O)c2c1cccc2)C 1458a_200000693922_100011217483 [0,0,0,1,0,0|1,0,1]=3 298 B20R2.8489489 CC(=CCCC(=O)CC1NC(=O)c2c1cccc2)C 1458a_100000066322_100011217483 [0,0,0,1,0,0|2,0,1]=4 299 B20R2.8489489 CC(=CCCC(=O)CC1OC(=O)c2c1cccc2)C 1458a_100000185305_100011217483 [0,0,0,1,0,0|1,0,1]=3 300 B20R2.8489489 CC(=CCCC(C)OC1CC(=O)c2c1cccc2)C 7a_100102619829_100010208147 [0,0,0,1,0,0|2,0,1]=4 301 B20R2.8489489 CC(=CCNC(=O)CC1OC(=O)c2c1cccc2)C 11a_100000718196_100000185305 [0,0,0,1,0,0|2,0,1]=4 302 B20R2.8489489 CC(=CCNC(=O)CC1OC(=O)c2c1cccc2)C 1626a_100000718196_100000185305 [0,0,0,1,0,0|2,0,1]=4 303 B20R2.8489489 CC(=CCNC(=O)CC1OC(=O)c2c1cccc2)C 527a_100000718196_100000185305 [0,0,0,1,0,0|2,0,1]=4 304 B20R2.10959353 CC(=CCC/C(=C/CSC1Cc2c1cccc2)/C)C 62a_100009813401_100016991246 [0,0,0,1,0,0|1,1,1]=4 305 B20R2.10959353 CC(=CCC/C(=C/CSC1Cc2c1cccc2)/C)C 62a_100016991246_100009813401 [0,0,0,1,0,0|1,1,1]=4 306 B20R2.10959353 CC(=CCC/C(=C\COC1Cc2c1cccc2)/C)C 7a_100016990311_100009813401 [0,0,0,1,0,0|1,0,1]=3 307 B18R1.5070 C=C(C)CCC(=O)CCOC(=O)c1ccccc1 1458a_200000688413_100000184176 [0,0,0,0,1,0|1,0,2]=4 308 B18R1.5070 CC(=CCC(=O)CCCC(=O)c1ccccc1)C 1458a_100011220947_100000211006 [0,0,0,0,1,0|2,0,1]=4 309 B18R1.5070 CC(=CCC(=O)CCNC(=O)c1ccccc1)C 1458a_100000182757_100000761012 [0,0,0,0,1,0|2,0,1]=4 310 B18R1.5070 CC(=CCC(=O)CCNC(=O)c1ccccc1)C 1458a_100011220947_200011215302 [0,0,0,0,1,0|2,0,1]=4 311 B18R1.5070 CC(=CCC(=O)CCOC(=O)c1ccccc1)C 1458a_100011220947_100000184176 [0,0,0,0,1,0|1,0,1]=3 312 B18R1.5070 CC(C)CCC(=O)CCOC(=O)c1ccccc1 1458a_100000181311_100000184176 [0,0,0,0,1,0|1,0,2]=4 313 B18R1.5070 CC(C)CCC(C)OCOC(=O)c1ccccc1 7a_100011215350_100000073877 [0,0,0,0,1,0|1,0,2]=4 314 B18R1.5070 CC(C)CCC(C)SCOC(=O)c1ccccc1 62a_100000073877_100011261404 [0,0,0,0,1,0|1,0,2]=4 315 B18R1.5070 CC(C)CCC(C)SCOC(=O)c1ccccc1 62a_100011261404_100000073877 [0,0,0,0,1,0|1,0,2]=4 316 B18R1.5070 CC(C)CCN(C)CCOC(=O)c1ccccc1 269982a_100000742789_100009812718 [0,0,0,0,1,0|1,0,2]=4 317 B18R1.5070 CN(C)CCN(C)CCOC(=O)c1ccccc1 269982a_100000225618_100009812718 [0,0,0,0,1,0|2,0,1]=4 318 B18R1.5070 C[S+](C)CCC(=O)CCOC(=O)c1ccccc1 1458a_100009452791_100000184176 [0,0,0,0,1,0|2,0,1]=4 319 B18R1.10622 CC(=CCC/C(=C/CC(=O)c1ccccc1)/C)C 1458a_100000185807_100016991246 [0,0,0,0,1,0|0,0,0]=1 320 B18R1.10622 CC(=CCC/C(=C/CN(C)c1ccccc1)/C)C 2230a_100000210012_100016991246 [0,0,0,0,1,0|2,0,0]=3 321 B18R1.10622 CC(=CCC/C(=C/CN(C)c1ccccc1)/C)C 269982a_100000210012_100016991246 [0,0,0,0,1,0|2,0,0]=3 322 B18R1.10622 CC(=CCC/C(=C/CN(C)c1ccccc1)/C)C 34a_100000210012_100016991246 [0,0,0,0,1,0|2,0,0]=3 323 B18R1.10622 CC(=CCCC(=NNC(=O)c1ccccc1)C)C 4a_100000184135_100000765506 [0,0,0,0,1,0|2,0,0]=3 324 B18R1.10622 CC(=CCCC(=NNC(=O)c1ccccn1)C)C 4a_100000184044_100000765506 [0,0,0,0,1,0|3,0,0]=4 325 B18R1.10622 CC(=CCCC(=NNC(=O)c1cccnc1)C)C 4a_100000189771_100000765506 [0,0,0,0,1,0|3,0,0]=4 326 B18R1.10622 CC(=CCCC(=NNC(=O)c1ccncc1)C)C 4a_100000189768_100000765506 [0,0,0,0,1,0|3,0,0]=4 327 B18R1.10622 CC(=CCCC(=O)CNC(=O)c1ccccc1)C 1458a_100000182045_100011217483 [0,0,0,0,1,0|2,0,0]=3 328 B18R1.10622 CC(=CCCC(=O)CNC(=O)c1cccnc1)C 1458a_100000688122_100011217483 [0,0,0,0,1,0|3,0,0]=4 329 B18R1.10622 CC(=CCCC(=O)CSC(=S)c1ccccc1)C 1458a_100000043459_100011217483 [0,0,0,0,1,0|1,2,0]=4 330 B18R1.10622 CC(=CCCC(C)CCC(=O)c1ccccc1)C 1458a_100000185807_100009814015 [0,0,0,0,1,0|0,0,2]=3 331 B18R1.10622 CC(=CCCC(C)OCC(=O)c1ccccc1)C 7a_100102619829_100000211460 [0,0,0,0,1,0|1,0,1]=3 332 B18R1.10622 CC(=CCCC(C)OCC(=O)c1ccccn1)C 34a_100102619829_100000027445 [0,0,0,0,1,0|2,0,1]=4 333 B18R1.10622 CC(=CCCC(C)OCC(=O)c1ccccn1)C 7a_100102619829_100000027445 [0,0,0,0,1,0|2,0,1]=4 334 B18R1.10622 CC(=CCCC(C)OCC(=O)c1ccncc1)C 7a_100102619829_100015248511 [0,0,0,0,1,0|2,0,1]=4 335 B18R1.10622 CC(=CCNC(=O)CNC(=O)c1ccccc1)C 11a_100000718196_100000182045 [0,0,0,0,1,0|3,0,0]=4 336 B18R1.10622 CC(=CCNC(=O)CNC(=O)c1ccccc1)C 1626a_100000718196_100000182045 [0,0,0,0,1,0|3,0,0]=4 337 B18R1.10622 CC(=CCNC(=O)CNC(=O)c1ccccc1)C 527a_100000718196_100000182045 [0,0,0,0,1,0|3,0,0]=4 338 B18R1.10622 CC(=CCNC(C)COC(=O)c1ccccc1)C 270004a_100000718196_100000000904 [0,0,0,0,1,0|1,0,1]=3 339 B18R1.10622 CC(=CCOC(C)CCC(=O)c1ccccc1)C 7a_200012571355_100000761012 [0,0,0,0,1,0|1,0,2]=4 340 B18R1.10622 CC(=O)NCCC(=O)COC(=O)c1ccccc1 1458a_100000183196_100000073877 [0,0,0,0,1,0|3,0,0]=4 341 B18R1.10622 CC(=O)SCCC(=O)COC(=O)c1ccccc1 1458a_100000048949_100000073877 [0,0,0,0,1,0|3,0,0]=4 342 B18R1.10622 CC(C)/C=C/CC(=O)COC(=O)c1ccccc1 1458a_100016292215_100000073877 [0,0,0,0,1,0|1,0,2]=4 343 B18R1.10622 CC(C)CCCC(=O)COC(=O)c1ccccc1 1458a_100011216857_100000073877 [0,0,0,0,1,0|1,0,2]=4 344 B18R1.10622 CN(C)CCCN(C)COC(=O)c1ccccc1 269982a_100000225831_100000073877 [0,0,0,0,1,0|2,0,1]=4 345 B18R1.21052 CC(=CCC/C(=C/COC(C)c1ccsc1)/C)C 34a_100011350980_100016991246 [0,0,0,0,1,0|2,0,1]=4 346 B18R1.21052 CC(=CCC/C(=C/COC(C)c1ccsc1)/C)C 7a_100011350980_100016991246 [0,0,0,0,1,0|2,0,1]=4 347 B18R1.21052 CC(=CCC/C(=C/CO[C@@H](C)c1ccco1)/C)C 34a_100000755270_100016991246 [0,0,0,0,1,0|2,0,1]=4 348 B18R1.21052 CC(=CCC/C(=C/CO[C@@H](C)c1ccco1)/C)C 7a_100000755270_100016991246 [0,0,0,0,1,0|2,0,1]=4 349 B18R1.21052 CC(=CCC/C(=C/CO[C@H](C)c1cccs1)/C)C 7a_100000750433_100016991246 [0,0,0,0,1,0|2,0,1]=4 350 B20R1.31054 CC(=CCC/C(=C/CNCC(=O)c1ccccn1)/C)C 34a_200020676162_100000027445 [0,0,0,0,0,1|2,0,0]=3 351 B20R1.31054 CC(=CCC/C(=C/CNCC(C)c1ccccc1)/C)C 2230a_100000701038_100016991246 [0,0,0,0,0,1|2,0,1]=4 352 B20R1.31054 CC(=CCC/C(=C/CNCC(C)c1ccccc1)/C)C 2230a_200020676162_100000756946 [0,0,0,0,0,1|2,0,1]=4 353 B20R1.31054 CC(=CCC/C(=C/CNCC(C)c1ccccc1)/C)C 270004a_200020676162_100000212034 [0,0,0,0,0,1|2,0,1]=4 354 B20R1.31054 CC(=CCC/C(=C/CNCC(C)c1ccccc1)/C)C 34a_100000701038_100016991246 [0,0,0,0,0,1|2,0,1]=4 355 B20R1.31054 CC(=CCC/C(=C/CNCC(C)c1ccccc1)/C)C 34a_200020676162_100000756946 [0,0,0,0,0,1|2,0,1]=4 356 B20R1.31054 CC(=CCC/C(=C/CNCC(O)c1ccccc1)/C)C 2230a_100000210709_100016991246 [0,0,0,0,0,1|1,0,2]=4 357 B20R1.31054 CC(=CCC/C(=C/CNCC(O)c1ccccc1)/C)C 2230a_200020676162_100000185958 [0,0,0,0,0,1|1,0,2]=4 358 B20R1.31054 CC(=CCC/C(=C/CNCC(O)c1ccccc1)/C)C 34a_200020676162_100000185958 [0,0,0,0,0,1|1,0,2]=4 359 B20R1.31054 CC(=CCC/C(=C/CNC[C@@H](O)c1ccccc1)/C)C 2230a_200020676162_100011933945 [0,0,0,0,0,1|1,0,2]=4 360 B20R1.31054 CC(=CCC/C(=C/CNC[C@@H](O)c1ccccc1)/C)C 34a_200020676162_100011933945 [0,0,0,0,0,1|1,0,2]=4 361 B20R1.31054 CC(=CCC/C(=C/COCC(C)c1ccccc1)/C)C 34a_100011215166_100016991246 [0,0,0,0,0,1|1,0,1]=3 362 B20R1.31054 CC(=CCC/C(=C/COCC(C)c1ccccc1)/C)C 7a_100011215166_100016991246 [0,0,0,0,0,1|1,0,1]=3 363 B20R1.31054 CC(=CCC/C(=C/COC[C@@H](N)c1ccccc1)/C)C 34a_100000751927_100016991246 [0,0,0,0,0,1|1,0,1]=3 364 B20R1.31054 CC(=CCC/C(=C/COC[C@@H](N)c1ccncc1)/C)C 34a_100138412524_100016991246 [0,0,0,0,0,1|2,0,1]=4 365 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccccc1)/C)C 62a_100000211460_100016991246 [0,0,0,0,0,1|0,1,0]=2 366 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccccc1)/C)C 62a_100016991246_100000211460 [0,0,0,0,0,1|0,1,0]=2 367 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccccn1)/C)C 62a_100000027445_100016991246 [0,0,0,0,0,1|1,1,0]=3 368 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccccn1)/C)C 62a_100016991246_100000027445 [0,0,0,0,0,1|1,1,0]=3 369 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1cccnc1)/C)C 62a_100000757877_100016991246 [0,0,0,0,0,1|1,1,0]=3 370 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1cccnc1)/C)C 62a_100016991246_100000757877 [0,0,0,0,0,1|1,1,0]=3 371 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccncc1)/C)C 62a_100000027454_100016991246 [0,0,0,0,0,1|1,1,0]=3 372 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ccncc1)/C)C 62a_100016991246_100000027454 [0,0,0,0,0,1|1,1,0]=3 373 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ncccn1)/C)C 62a_100016991246_100020636365 [0,0,0,0,0,1|2,1,0]=4 374 B20R1.31054 CC(=CCC/C(=C/CSCC(=O)c1ncccn1)/C)C 62a_100020636365_100016991246 [0,0,0,0,0,1|2,1,0]=4 375 B20R1.31054 CC(=CCC/C(=C/CSCC(O)c1ccccc1)/C)C 62a_100000185958_100016991246 [0,0,0,0,0,1|0,1,2]=4 376 B20R1.31054 CC(=CCC/C(=C/CSCC(O)c1ccccc1)/C)C 62a_100016991246_100000185958 [0,0,0,0,0,1|0,1,2]=4 377 B20R1.31054 CC(=CCC/C(=C/CSCS(=O)c1ccccc1)/C)C 62a_100016991246_100000031784 [0,0,0,0,0,1|1,1,0]=3 378 B20R1.31054 CC(=CCC/C(=C/CSC[C@@H](O)c1ccccc1)/C)C 62a_100011933945_100016991246 [0,0,0,0,0,1|0,1,2]=4 379 B20R1.31054 CC(=CCC/C(=C/CSC[C@@H](O)c1ccccc1)/C)C 62a_100016991246_100011933945 [0,0,0,0,0,1|0,1,2]=4 380 B20R1.31054 CC(=CCC/C(=C\COCC(=O)c1ccccc1)/C)C 7a_100016990311_100000211460 [0,0,0,0,0,1|0,0,0]=1 381 B20R1.31054 CC(=CCC/C(=C\COCC(=O)c1ccccn1)/C)C 34a_100016990311_100000027445 [0,0,0,0,0,1|1,0,0]=2 382 B20R1.31054 CC(=CCC/C(=C\COCC(=O)c1ccccn1)/C)C 7a_100016990311_100000027445 [0,0,0,0,0,1|1,0,0]=2 383 B20R1.31054 CC(=CCC/C(=C\COCC(=O)c1ccncc1)/C)C 7a_100016990311_100015248511 [0,0,0,0,0,1|1,0,0]=2 384 B20R1.31054 CC(=CCC/C(=C\COCC(C)c1ccccc1)/C)C 34a_100016990311_100000756946 [0,0,0,0,0,1|1,0,1]=3 385 B20R1.31054 CC(=CCC/C(=C\COCC(C)c1ccccc1)/C)C 7a_100016990311_100000756946 [0,0,0,0,0,1|1,0,1]=3 386 B20R1.31054 CC(=CCC/C(=C\COCC(O)c1ccccc1)/C)C 34a_100016990311_100000185958 [0,0,0,0,0,1|0,0,2]=3 387 B20R1.31054 CC(=CCC/C(=C\COCC(O)c1ccccc1)/C)C 7a_100016990311_100000185958 [0,0,0,0,0,1|0,0,2]=3 388 B20R1.31054 CC(=CCC/C(=C\COC[C@@H](O)c1ccccc1)/C)C 34a_100016990311_100011933945 [0,0,0,0,0,1|0,0,2]=3 389 B20R1.31054 CC(=CCC/C(=C\COC[C@@H](O)c1ccccc1)/C)C 7a_100016990311_100011933945 [0,0,0,0,0,1|0,0,2]=3 390 B20R1.31054 CC(=CCCC(=CC=NNC(=O)c1ccccc1)C)C 4a_100000184135_100000211119 [0,0,0,0,0,1|1,0,1]=3 391 B20R1.31054 CC(=CCCC(=CC=NNC(=O)c1ccccn1)C)C 4a_100000184044_100000211119 [0,0,0,0,0,1|2,0,1]=4 392 B20R1.31054 CC(=CCCC(=CC=NNC(=O)c1cccnc1)C)C 4a_100000189771_100000211119 [0,0,0,0,0,1|2,0,1]=4 393 B20R1.31054 CC(=CCCC(=CC=NNC(=O)c1ccncc1)C)C 4a_100000189768_100000211119 [0,0,0,0,0,1|2,0,1]=4 394 B20R1.31054 CC(=CCCC(=O)CCCNC(=O)c1ccccc1)C 1458a_100000194758_100011217483 [0,0,0,0,0,1|2,0,1]=4 395 B20R1.31054 CC(=CCCC(C)CC=NNC(=O)c1ccccc1)C 4a_100000184135_100000212096 [0,0,0,0,0,1|2,0,1]=4 396 B20R1.31054 CC(=CCCC(C)CCOCC(=O)c1ccccc1)C 7a_100000017536_100000211460 [0,0,0,0,0,1|0,0,2]=3 397 B20R1.31054 CC(=CCCC(C)CCOCC(=O)c1ccccn1)C 34a_100000017536_100000027445 [0,0,0,0,0,1|1,0,2]=4 398 B20R1.31054 CC(=CCCC(C)CCOCC(=O)c1ccccn1)C 7a_100000017536_100000027445 [0,0,0,0,0,1|1,0,2]=4 399 B20R1.31054 CC(=CCCC(C)CCOCC(=O)c1ccncc1)C 7a_100000017536_100015248511 [0,0,0,0,0,1|1,0,2]=4 400 B20R1.31054 CC(=CCCC(C)CCSCC(=O)c1ccccc1)C 62a_100000211460_100009814015 [0,0,0,0,0,1|0,1,2]=4 401 B20R1.31054 CC(=CCCC(C)CCSCC(=O)c1ccccc1)C 62a_100009814015_100000211460 [0,0,0,0,0,1|0,1,2]=4 402 B20R1.31054 CC(=CCCC(C)NCCNC(=O)c1ccccc1)C 270004a_100000736134_100000765506 [0,0,0,0,0,1|1,0,2]=4 403 B20R1.31054 CC(=CCCC(C)OCCCC(=O)c1ccccc1)C 7a_100102619829_100000211006 [0,0,0,0,0,1|1,0,2]=4 404 B20R1.31054 CC(=CCCC(C)OCCNC(=O)c1ccccc1)C 7a_100102619829_200011215302 [0,0,0,0,0,1|1,0,2]=4 405 B20R1.31054 CC(=CCCC(C)OCCOC(=O)c1ccccc1)C 34a_100102619829_100009812718 [0,0,0,0,0,1|0,0,2]=3 406 B20R1.31054 CC(=CCCC(C)OCCOC(=O)c1ccccc1)C 7a_100102619829_100000184176 [0,0,0,0,0,1|0,0,2]=3 407 B20R1.61711 CC(=CCC/C(=C/CNC(=O)C[n+]1ccccc1)/C)C 11a_200020676162_200000086051 [0,0,0,0,0,1|2,0,0]=3 408 B20R1.61711 CC(=CCC/C(=C/CNC(=O)C[n+]1ccccc1)/C)C 527a_200020676162_200000086051 [0,0,0,0,0,1|2,0,0]=3 409 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1ccccn1)/C)C 11a_200020676162_100000233486 [0,0,0,0,0,1|2,0,0]=3 410 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cccnc1)/C)C 11a_200020676162_100000737805 [0,0,0,0,0,1|2,0,0]=3 411 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cccnc1)/C)C 527a_200020676162_100000737805 [0,0,0,0,0,1|2,0,0]=3 412 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1ccncc1)/C)C 11a_200020676162_100011201483 [0,0,0,0,0,1|2,0,0]=3 413 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cnccn1)/C)C 11a_200020676162_100000726051 [0,0,0,0,0,1|3,0,0]=4 414 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cnccn1)/C)C 527a_200020676162_100000726051 [0,0,0,0,0,1|3,0,0]=4 415 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cncnc1)/C)C 11a_200020676162_100000721575 [0,0,0,0,0,1|3,0,0]=4 416 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Cc1cncnc1)/C)C 527a_200020676162_100000721575 [0,0,0,0,0,1|3,0,0]=4 417 B20R1.61711 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1)/C)C 2430a_100000106764_200020676162 [0,0,0,0,0,1|1,0,0]=2 418 B20R1.61711 CC(=CCC/C(=C/CNC(C)Cc1ccccc1)/C)C 34a_200020676162_200011218536 [0,0,0,0,0,1|2,0,1]=4 419 B20R1.61711 CC(=CCC/C(=C/COC(C)Cc1ccccc1)/C)C 34a_100000748627_100016991246 [0,0,0,0,0,1|1,0,1]=3 420 B20R1.61711 CC(=CCC/C(=C/COC(C)Cc1ccccc1)/C)C 7a_100000748627_100016991246 [0,0,0,0,0,1|1,0,1]=3 421 B20R1.61711 CC(=CCC/C(=C\COC(C)Cc1ccccc1)/C)C 34a_100016990311_200011218536 [0,0,0,0,0,1|1,0,1]=3 422 B20R1.61711 CC(=CCC/C(=C\COC(C)Cc1ccccc1)/C)C 7a_100016990311_200011218536 [0,0,0,0,0,1|1,0,1]=3 423 B20R1.61711 CC(=CCCC(=O)CCCC(=O)Nc1ccccc1)C 1458a_200000181736_100011217483 [0,0,0,0,0,1|2,0,1]=4 424 B20R1.61711 CC(=CCCC(C)C=NNC(=O)Cc1ccccc1)C 4a_100000182964_100000033009 [0,0,0,0,0,1|2,0,1]=4 425 B20R1.61711 CC(=CCCC(C)OCCC(=O)Nc1ccccc1)C 34a_100102619829_100000242058 [0,0,0,0,0,1|2,0,1]=4 426 B20R1.61711 CC(=CCCC(C)OCCC(=O)Nc1ccccc1)C 7a_100102619829_100000242058 [0,0,0,0,0,1|2,0,1]=4 427 B20R1.61711 CC(=CCCC(C)OCCC(=O)Oc1ccccc1)C 7a_100102619829_200000035796 [0,0,0,0,0,1|2,0,1]=4 428 B17R0.178 C/C=C/C=CC(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000185730 [1,0,1,0,0,0|1,0,1]=4 429 B17R0.178 C/C=C/C=CC(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000185730 [1,0,1,0,0,0|1,0,1]=4 430 B17R1.754 C/C=C/CCOCCOC(=O)c1ccccc1 34a_100016278192_100009812718 [2,0,0,0,0,0|1,0,1]=4 431 B17R1.1556 C=CCCC(=O)CCOC(=O)c1ccccc1 1458a_100000749702_100000184176 [2,0,0,0,0,0|1,0,1]=4 432 B17R1.1556 C=CCCC(C)OCOC(=O)c1ccccc1 7a_100000765329_100000073877 [2,0,0,0,0,0|1,0,1]=4 433 B17R1.1556 C=CCCN(C)CCOC(=O)c1ccccc1 269982a_100020639649_100009812718 [2,0,0,0,0,0|1,0,1]=4 434 B17R1.1556 CC=CCC(=O)CCOC(=O)c1ccccc1 1458a_100121576822_100000184176 [2,0,0,0,0,0|1,0,1]=4 435 B19R1.750 CC(=CCCOCCOC(=O)c1ccc(cc1)C)C 7a_200000031072_100011217483 [1,1,0,0,0,0|1,0,1]=4 436 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Br)/C)C 2230a_100000174977_100016991246 [1,1,0,0,0,0|1,0,1]=4 437 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Br)/C)C 2230a_200020676162_100000698116 [1,1,0,0,0,0|1,0,1]=4 438 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Br)/C)C 270004a_200020676162_100000210085 [1,1,0,0,0,0|1,0,1]=4 439 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Br)/C)C 34a_100000174977_100016991246 [1,1,0,0,0,0|1,0,1]=4 440 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Br)/C)C 34a_200020676162_100000698116 [1,1,0,0,0,0|1,0,1]=4 441 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)C)/C)C 2230a_100000185548_100016991246 [1,1,0,0,0,0|1,0,1]=4 442 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)C)/C)C 2230a_200020676162_100000211840 [1,1,0,0,0,0|1,0,1]=4 443 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)C)/C)C 270004a_200020676162_100000211157 [1,1,0,0,0,0|1,0,1]=4 444 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)C)/C)C 34a_100000185548_100016991246 [1,1,0,0,0,0|1,0,1]=4 445 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)C)/C)C 34a_200020676162_100000211840 [1,1,0,0,0,0|1,0,1]=4 446 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Cl)/C)C 2230a_100000174878_100016991246 [1,1,0,0,0,0|1,0,1]=4 447 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Cl)/C)C 2230a_200020676162_100000181238 [1,1,0,0,0,0|1,0,1]=4 448 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Cl)/C)C 270004a_200020676162_100000210801 [1,1,0,0,0,0|1,0,1]=4 449 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Cl)/C)C 34a_100000174878_100016991246 [1,1,0,0,0,0|1,0,1]=4 450 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)Cl)/C)C 34a_200020676162_100000187163 [1,1,0,0,0,0|1,0,1]=4 451 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)F)/C)C 2230a_100000174948_100016991246 [1,1,0,0,0,0|1,0,1]=4 452 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)F)/C)C 2230a_200020676162_100000230114 [1,1,0,0,0,0|1,0,1]=4 453 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)F)/C)C 270004a_200020676162_100000210812 [1,1,0,0,0,0|1,0,1]=4 454 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)F)/C)C 34a_100000174948_100016991246 [1,1,0,0,0,0|1,0,1]=4 455 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)F)/C)C 34a_200020676162_100000187166 [1,1,0,0,0,0|1,0,1]=4 456 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)I)/C)C 2230a_100000106179_100016991246 [1,1,0,0,0,0|1,0,1]=4 457 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)I)/C)C 2230a_200020676162_100011218688 [1,1,0,0,0,0|1,0,1]=4 458 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)I)/C)C 270004a_200020676162_100000014684 [1,1,0,0,0,0|1,0,1]=4 459 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)I)/C)C 34a_100000106179_100016991246 [1,1,0,0,0,0|1,0,1]=4 460 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)I)/C)C 34a_200020676162_100011218688 [1,1,0,0,0,0|1,0,1]=4 461 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)O)/C)C 2230a_100000743036_100016991246 [1,1,0,0,0,0|1,0,1]=4 462 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)O)/C)C 2230a_200020676162_100011660834 [1,1,0,0,0,0|1,0,1]=4 463 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)O)/C)C 270004a_200020676162_100000188321 [1,1,0,0,0,0|1,0,1]=4 464 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)O)/C)C 34a_100000743036_100016991246 [1,1,0,0,0,0|1,0,1]=4 465 B19R1.10251 CC(=CCC/C(=C/CNCc1cccc(c1)O)/C)C 34a_200020676162_100011660834 [1,1,0,0,0,0|1,0,1]=4 466 B19R1.10251 CC(=CCC/C(=C/COCc1cc(ccn1)C)/C)C 34a_100011998357_100016991246 [1,1,0,0,0,0|1,0,1]=4 467 B19R1.10251 CC(=CCC/C(=C/COCc1cc(ccn1)Cl)/C)C 34a_100000748867_100016991246 [1,1,0,0,0,0|1,0,1]=4 468 B19R1.10251 CC(=CCC/C(=C/COCc1cc(ccn1)N)/C)C 34a_100000692640_100016991246 [1,1,0,0,0,0|1,0,1]=4 469 B19R1.10251 CC(=CCC/C(=C/COCc1ccc[n+](c1)[O-])/C)C 34a_100000037817_100016991246 [1,1,0,0,0,0|1,0,1]=4 470 B19R1.10251 CC(=CCC/C(=C/COCc1ccc[n+](c1)[O-])/C)C 7a_100000037817_100016991246 [1,1,0,0,0,0|1,0,1]=4 471 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)Br)/C)C 34a_100000687537_100016991246 [1,1,0,0,0,0|0,0,1]=3 472 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)Br)/C)C 7a_100000687537_100016991246 [1,1,0,0,0,0|0,0,1]=3 473 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)C)/C)C 34a_100011217746_100016991246 [1,1,0,0,0,0|0,0,1]=3 474 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)C)/C)C 7a_100011217746_100016991246 [1,1,0,0,0,0|0,0,1]=3 475 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)Cl)/C)C 34a_100000241301_100016991246 [1,1,0,0,0,0|0,0,1]=3 476 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)Cl)/C)C 7a_100000241301_100016991246 [1,1,0,0,0,0|0,0,1]=3 477 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)F)/C)C 34a_100000210976_100016991246 [1,1,0,0,0,0|0,0,1]=3 478 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)F)/C)C 7a_100000210976_100016991246 [1,1,0,0,0,0|0,0,1]=3 479 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)I)/C)C 34a_100011215336_100016991246 [1,1,0,0,0,0|0,0,1]=3 480 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)I)/C)C 7a_100011215336_100016991246 [1,1,0,0,0,0|0,0,1]=3 481 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(c1)N)/C)C 34a_100000211919_100016991246 [1,1,0,0,0,0|0,0,1]=3 482 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(n1)Br)/C)C 34a_100000694195_100016991246 [1,1,0,0,0,0|1,0,1]=4 483 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(n1)C)/C)C 34a_100000690600_100016991246 [1,1,0,0,0,0|1,0,1]=4 484 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(n1)Cl)/C)C 34a_100011998359_100016991246 [1,1,0,0,0,0|1,0,1]=4 485 B19R1.10251 CC(=CCC/C(=C/COCc1cccc(n1)F)/C)C 34a_100000086748_100016991246 [1,1,0,0,0,0|1,0,1]=4 486 B19R1.10251 CC(=CCC/C(=C/COCc1ccnc(c1)Br)/C)C 34a_100009814636_100016991246 [1,1,0,0,0,0|1,0,1]=4 487 B19R1.10251 CC(=CCC/C(=C/COCc1ccnc(c1)Br)/C)C 7a_100009814636_100016991246 [1,1,0,0,0,0|1,0,1]=4 488 B19R1.10251 CC(=CCC/C(=C/COCc1ccnc(c1)C)/C)C 34a_100011998630_100016991246 [1,1,0,0,0,0|1,0,1]=4 489 B19R1.10251 CC(=CCC/C(=C/COCc1ccnc(c1)Cl)/C)C 34a_100000748751_100016991246 [1,1,0,0,0,0|1,0,1]=4 490 B19R1.10251 CC(=CCC/C(=C/COCc1ccnc(c1)F)/C)C 34a_100000082451_100016991246 [1,1,0,0,0,0|1,0,1]=4 491 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)Br)/C)C 34a_100011259137_100016991246 [1,1,0,0,0,0|1,0,1]=4 492 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)Br)/C)C 7a_100011259137_100016991246 [1,1,0,0,0,0|1,0,1]=4 493 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)C)/C)C 34a_100011998709_100016991246 [1,1,0,0,0,0|1,0,1]=4 494 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)C)/C)C 7a_100011998709_100016991246 [1,1,0,0,0,0|1,0,1]=4 495 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)Cl)/C)C 34a_100000092867_100016991246 [1,1,0,0,0,0|1,0,1]=4 496 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)Cl)/C)C 7a_100000092867_100016991246 [1,1,0,0,0,0|1,0,1]=4 497 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)F)/C)C 34a_100011962875_100016991246 [1,1,0,0,0,0|1,0,1]=4 498 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)F)/C)C 7a_100011962875_100016991246 [1,1,0,0,0,0|1,0,1]=4 499 B19R1.10251 CC(=CCC/C(=C/COCc1cncc(c1)N)/C)C 34a_100000085308_100016991246 [1,1,0,0,0,0|1,0,1]=4 500 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)C)/C)C 62a_100000211840_100016991246 [1,1,0,0,0,0|0,1,1]=4 501 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)C)/C)C 62a_100016991246_100000211840 [1,1,0,0,0,0|0,1,1]=4 502 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)F)/C)C 62a_100000230114_100016991246 [1,1,0,0,0,0|0,1,1]=4 503 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)F)/C)C 62a_100016991246_100000230114 [1,1,0,0,0,0|0,1,1]=4 504 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)O)/C)C 62a_100011660834_100016991246 [1,1,0,0,0,0|0,1,1]=4 505 B19R1.10251 CC(=CCC/C(=C/CSCc1cccc(c1)O)/C)C 62a_100016991246_100011660834 [1,1,0,0,0,0|0,1,1]=4 506 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)Br)/C)C 34a_100016990311_100010173614 [1,1,0,0,0,0|1,0,1]=4 507 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)Br)/C)C 7a_100016990311_100010173614 [1,1,0,0,0,0|1,0,1]=4 508 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)C)/C)C 34a_100016990311_100000718516 [1,1,0,0,0,0|1,0,1]=4 509 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)C)/C)C 7a_100016990311_100000718516 [1,1,0,0,0,0|1,0,1]=4 510 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)Cl)/C)C 34a_100016990311_100016988179 [1,1,0,0,0,0|1,0,1]=4 511 B19R1.10251 CC(=CCC/C(=C\COCc1cc(ccn1)Cl)/C)C 7a_100016990311_100016988179 [1,1,0,0,0,0|1,0,1]=4 512 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)Br)/C)C 34a_100016990311_100000698116 [1,1,0,0,0,0|0,0,1]=3 513 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)Br)/C)C 7a_100016990311_100000211773 [1,1,0,0,0,0|0,0,1]=3 514 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)C)/C)C 34a_100016990311_100000211840 [1,1,0,0,0,0|0,0,1]=3 515 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)C)/C)C 7a_100016990311_100000211840 [1,1,0,0,0,0|0,0,1]=3 516 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)Cl)/C)C 34a_100016990311_100000187163 [1,1,0,0,0,0|0,0,1]=3 517 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)Cl)/C)C 7a_100016990311_100000187163 [1,1,0,0,0,0|0,0,1]=3 518 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)F)/C)C 34a_100016990311_100000187166 [1,1,0,0,0,0|0,0,1]=3 519 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)F)/C)C 7a_100016990311_100000230114 [1,1,0,0,0,0|0,0,1]=3 520 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)I)/C)C 34a_100016990311_100011218688 [1,1,0,0,0,0|0,0,1]=3 521 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)I)/C)C 7a_100016990311_100011218688 [1,1,0,0,0,0|0,0,1]=3 522 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)O)/C)C 34a_100016990311_100011660834 [1,1,0,0,0,0|0,0,1]=3 523 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(c1)O)/C)C 7a_100016990311_100000084143 [1,1,0,0,0,0|0,0,1]=3 524 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)Br)/C)C 34a_100016990311_100009889011 [1,1,0,0,0,0|1,0,1]=4 525 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)Br)/C)C 7a_100016990311_100009889011 [1,1,0,0,0,0|1,0,1]=4 526 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)C)/C)C 34a_100016990311_100000757606 [1,1,0,0,0,0|1,0,1]=4 527 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)C)/C)C 7a_100016990311_100000757606 [1,1,0,0,0,0|1,0,1]=4 528 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)Cl)/C)C 34a_100016990311_100000086093 [1,1,0,0,0,0|1,0,1]=4 529 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)Cl)/C)C 7a_100016990311_100000086093 [1,1,0,0,0,0|1,0,1]=4 530 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)F)/C)C 34a_100016990311_100009819644 [1,1,0,0,0,0|1,0,1]=4 531 B19R1.10251 CC(=CCC/C(=C\COCc1cccc(n1)F)/C)C 7a_100016990311_100009819644 [1,1,0,0,0,0|1,0,1]=4 532 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)Br)/C)C 34a_100016990311_100010243470 [1,1,0,0,0,0|1,0,1]=4 533 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)Br)/C)C 7a_100016990311_100010254460 [1,1,0,0,0,0|1,0,1]=4 534 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)C)/C)C 34a_100016990311_200020672517 [1,1,0,0,0,0|1,0,1]=4 535 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)C)/C)C 7a_100016990311_200020672517 [1,1,0,0,0,0|1,0,1]=4 536 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)Cl)/C)C 34a_100016990311_100000764220 [1,1,0,0,0,0|1,0,1]=4 537 B19R1.10251 CC(=CCC/C(=C\COCc1ccnc(c1)Cl)/C)C 7a_100016990311_100000764220 [1,1,0,0,0,0|1,0,1]=4 538 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)Br)/C)C 34a_100016990311_100000738771 [1,1,0,0,0,0|1,0,1]=4 539 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)Br)/C)C 7a_100016990311_100000738771 [1,1,0,0,0,0|1,0,1]=4 540 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)C)/C)C 34a_100016990311_100000716715 [1,1,0,0,0,0|1,0,1]=4 541 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)C)/C)C 7a_100016990311_100000716715 [1,1,0,0,0,0|1,0,1]=4 542 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)Cl)/C)C 34a_100016990311_100016992070 [1,1,0,0,0,0|1,0,1]=4 543 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)Cl)/C)C 7a_100016990311_100016992070 [1,1,0,0,0,0|1,0,1]=4 544 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)F)/C)C 34a_100016990311_100000725299 [1,1,0,0,0,0|1,0,1]=4 545 B19R1.10251 CC(=CCC/C(=C\COCc1cncc(c1)F)/C)C 7a_100016990311_100000725299 [1,1,0,0,0,0|1,0,1]=4 546 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Br)/C)C 2230a_100000689332_100016991246 [1,1,0,0,0,0|1,0,1]=4 547 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Br)/C)C 2230a_200020676162_100000184730 [1,1,0,0,0,0|1,0,1]=4 548 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Br)/C)C 270004a_200020676162_100000211189 [1,1,0,0,0,0|1,0,1]=4 549 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Br)/C)C 34a_100000689332_100016991246 [1,1,0,0,0,0|1,0,1]=4 550 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Br)/C)C 34a_200020676162_100000184730 [1,1,0,0,0,0|1,0,1]=4 551 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1C)/C)C 2230a_200020676162_100000211839 [1,1,0,0,0,0|1,0,1]=4 552 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1C)/C)C 270004a_200020676162_100000211143 [1,1,0,0,0,0|1,0,1]=4 553 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1C)/C)C 34a_100000174972_100016991246 [1,1,0,0,0,0|1,0,1]=4 554 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1C)/C)C 34a_200020676162_100000211839 [1,1,0,0,0,0|1,0,1]=4 555 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Cl)/C)C 2230a_100000174879_100016991246 [1,1,0,0,0,0|1,0,1]=4 556 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Cl)/C)C 2230a_200020676162_100000187162 [1,1,0,0,0,0|1,0,1]=4 557 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Cl)/C)C 270004a_200020676162_100000210073 [1,1,0,0,0,0|1,0,1]=4 558 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Cl)/C)C 34a_100000174879_100016991246 [1,1,0,0,0,0|1,0,1]=4 559 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1Cl)/C)C 34a_200020676162_100000187162 [1,1,0,0,0,0|1,0,1]=4 560 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1F)/C)C 2230a_200020676162_100000211605 [1,1,0,0,0,0|1,0,1]=4 561 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1F)/C)C 270004a_200020676162_100000210811 [1,1,0,0,0,0|1,0,1]=4 562 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1F)/C)C 34a_100000174869_100016991246 [1,1,0,0,0,0|1,0,1]=4 563 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1F)/C)C 34a_200020676162_100000211605 [1,1,0,0,0,0|1,0,1]=4 564 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1I)/C)C 2230a_200020676162_100011215278 [1,1,0,0,0,0|1,0,1]=4 565 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1I)/C)C 270004a_200020676162_100000010305 [1,1,0,0,0,0|1,0,1]=4 566 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1I)/C)C 34a_200020676162_100011215278 [1,1,0,0,0,0|1,0,1]=4 567 B19R1.10598 CC(=CCC/C(=C/CNCc1ccccc1O)/C)C 34a_100000185550_100016991246 [1,1,0,0,0,0|1,0,1]=4 568 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1Br)/C)C 34a_100000756307_100016991246 [1,1,0,0,0,0|0,0,1]=3 569 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1Br)/C)C 7a_100000756307_100016991246 [1,1,0,0,0,0|0,0,1]=3 570 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1C)/C)C 34a_100000698903_100016991246 [1,1,0,0,0,0|0,0,1]=3 571 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1C)/C)C 7a_100000698903_100016991246 [1,1,0,0,0,0|0,0,1]=3 572 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1Cl)/C)C 34a_100000210847_100016991246 [1,1,0,0,0,0|0,0,1]=3 573 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1Cl)/C)C 7a_100000210847_100016991246 [1,1,0,0,0,0|0,0,1]=3 574 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1F)/C)C 34a_100000211962_100016991246 [1,1,0,0,0,0|0,0,1]=3 575 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1F)/C)C 7a_100000211962_100016991246 [1,1,0,0,0,0|0,0,1]=3 576 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1I)/C)C 34a_100000187465_100016991246 [1,1,0,0,0,0|0,0,1]=3 577 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1I)/C)C 7a_100000187465_100016991246 [1,1,0,0,0,0|0,0,1]=3 578 B19R1.10598 CC(=CCC/C(=C/COCc1ccccc1N)/C)C 34a_100000212039_100016991246 [1,1,0,0,0,0|0,0,1]=3 579 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1Br)/C)C 34a_100000719692_100016991246 [1,1,0,0,0,0|1,0,1]=4 580 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1Br)/C)C 7a_100000719692_100016991246 [1,1,0,0,0,0|1,0,1]=4 581 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1C)/C)C 34a_100000729262_100016991246 [1,1,0,0,0,0|1,0,1]=4 582 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1C)/C)C 7a_100000729262_100016991246 [1,1,0,0,0,0|1,0,1]=4 583 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1Cl)/C)C 34a_100000748726_100016991246 [1,1,0,0,0,0|1,0,1]=4 584 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1Cl)/C)C 7a_100000748726_100016991246 [1,1,0,0,0,0|1,0,1]=4 585 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1F)/C)C 34a_100000079888_100016991246 [1,1,0,0,0,0|1,0,1]=4 586 B19R1.10598 CC(=CCC/C(=C/COCc1cccnc1F)/C)C 7a_100000079888_100016991246 [1,1,0,0,0,0|1,0,1]=4 587 B19R1.10598 CC(=CCC/C(=C/COCc1ccncc1C)/C)C 34a_100011997032_100016991246 [1,1,0,0,0,0|1,0,1]=4 588 B19R1.10598 CC(=CCC/C(=C/COCc1ccncc1F)/C)C 34a_100012172863_100016991246 [1,1,0,0,0,0|1,0,1]=4 589 B19R1.10598 CC(=CCC/C(=C/COCc1cnccc1C)/C)C 34a_100011996381_100016991246 [1,1,0,0,0,0|1,0,1]=4 590 B19R1.10598 CC(=CCC/C(=C/COCc1cnccc1Cl)/C)C 34a_100000117392_100016991246 [1,1,0,0,0,0|1,0,1]=4 591 B19R1.10598 CC(=CCC/C(=C/COCc1ncccc1Br)/C)C 34a_100011996772_100016991246 [1,1,0,0,0,0|1,0,1]=4 592 B19R1.10598 CC(=CCC/C(=C/COCc1ncccc1C)/C)C 34a_100000698912_100016991246 [1,1,0,0,0,0|1,0,1]=4 593 B19R1.10598 CC(=CCC/C(=C/COCc1ncccc1Cl)/C)C 34a_100012002383_100016991246 [1,1,0,0,0,0|1,0,1]=4 594 B19R1.10598 CC(=CCC/C(=C/COCc1ncccc1F)/C)C 34a_100011934865_100016991246 [1,1,0,0,0,0|1,0,1]=4 595 B19R1.10598 CC(=CCC/C(=C/COCc1ncccc1N)/C)C 34a_114873767017_100016991246 [1,1,0,0,0,0|1,0,1]=4 596 B19R1.10598 CC(=CCC/C(=C/CSCc1ccccc1C)/C)C 62a_100000211839_100016991246 [1,1,0,0,0,0|0,1,1]=4 597 B19R1.10598 CC(=CCC/C(=C/CSCc1ccccc1C)/C)C 62a_100016991246_100000211839 [1,1,0,0,0,0|0,1,1]=4 598 B19R1.10598 CC(=CCC/C(=C/CSCc1ccccc1F)/C)C 62a_100000211605_100016991246 [1,1,0,0,0,0|0,1,1]=4 599 B19R1.10598 CC(=CCC/C(=C/CSCc1ccccc1F)/C)C 62a_100016991246_100000211605 [1,1,0,0,0,0|0,1,1]=4 600 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1Br)/C)C 34a_100016990311_100000184730 [1,1,0,0,0,0|0,0,1]=3 601 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1Br)/C)C 7a_100016990311_100000184730 [1,1,0,0,0,0|0,0,1]=3 602 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1C)/C)C 34a_100016990311_100000211839 [1,1,0,0,0,0|0,0,1]=3 603 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1C)/C)C 7a_100016990311_100000211839 [1,1,0,0,0,0|0,0,1]=3 604 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1Cl)/C)C 34a_100016990311_100000187162 [1,1,0,0,0,0|0,0,1]=3 605 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1Cl)/C)C 7a_100016990311_100000187162 [1,1,0,0,0,0|0,0,1]=3 606 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1F)/C)C 34a_100016990311_100000211605 [1,1,0,0,0,0|0,0,1]=3 607 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1F)/C)C 7a_100016990311_100000211605 [1,1,0,0,0,0|0,0,1]=3 608 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1I)/C)C 34a_100016990311_100011215278 [1,1,0,0,0,0|0,0,1]=3 609 B19R1.10598 CC(=CCC/C(=C\COCc1ccccc1I)/C)C 7a_100016990311_100011215278 [1,1,0,0,0,0|0,0,1]=3 610 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1Br)/C)C 34a_100016990311_100010140945 [1,1,0,0,0,0|1,0,1]=4 611 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1Br)/C)C 7a_100016990311_100010140945 [1,1,0,0,0,0|1,0,1]=4 612 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1C)/C)C 34a_100016990311_100000732876 [1,1,0,0,0,0|1,0,1]=4 613 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1C)/C)C 7a_100016990311_100000732876 [1,1,0,0,0,0|1,0,1]=4 614 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1Cl)/C)C 34a_100016990311_100000045678 [1,1,0,0,0,0|1,0,1]=4 615 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1Cl)/C)C 7a_100016990311_100000045678 [1,1,0,0,0,0|1,0,1]=4 616 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1F)/C)C 34a_100016990311_100000099810 [1,1,0,0,0,0|1,0,1]=4 617 B19R1.10598 CC(=CCC/C(=C\COCc1cccnc1F)/C)C 7a_100016990311_100000099810 [1,1,0,0,0,0|1,0,1]=4 618 B19R1.10598 CC(=CCC/C(=C\COCc1ccncc1C)/C)C 34a_100016990311_100020672809 [1,1,0,0,0,0|1,0,1]=4 619 B19R1.10598 CC(=CCC/C(=C\COCc1ccncc1C)/C)C 7a_100016990311_100020672808 [1,1,0,0,0,0|1,0,1]=4 620 B19R1.10598 CC(=CCC/C(=C\COCc1ccncc1Cl)/C)C 7a_100016990311_100000763264 [1,1,0,0,0,0|1,0,1]=4 621 B19R1.10598 CC(=CCC/C(=C\COCc1cnccc1C)/C)C 34a_100016990311_100000690890 [1,1,0,0,0,0|1,0,1]=4 622 B19R1.10598 CC(=CCC/C(=C\COCc1cnccc1C)/C)C 7a_100016990311_100000690890 [1,1,0,0,0,0|1,0,1]=4 623 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1Br)/C)C 34a_100016990311_100025702911 [1,1,0,0,0,0|1,0,1]=4 624 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1Br)/C)C 7a_100016990311_100025702911 [1,1,0,0,0,0|1,0,1]=4 625 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1C)/C)C 34a_100016990311_100000696600 [1,1,0,0,0,0|1,0,1]=4 626 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1C)/C)C 7a_100016990311_100000696600 [1,1,0,0,0,0|1,0,1]=4 627 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1Cl)/C)C 7a_100016990311_100000099807 [1,1,0,0,0,0|1,0,1]=4 628 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1F)/C)C 34a_100016990311_100000104219 [1,1,0,0,0,0|1,0,1]=4 629 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1F)/C)C 7a_100016990311_100000104219 [1,1,0,0,0,0|1,0,1]=4 630 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1O)/C)C 34a_100016990311_200020655725 [1,1,0,0,0,0|1,0,1]=4 631 B19R1.10598 CC(=CCC/C(=C\COCc1ncccc1O)/C)C 7a_100016990311_200020655725 [1,1,0,0,0,0|1,0,1]=4 632 B19R1.26150 CC(=CCC/C(=C/CN(C)Cc1ccccc1)/C)C 2230a_100000186898_100016991246 [1,1,0,0,0,0|1,0,1]=4 633 B19R1.26150 CC(=CCC/C(=C/CN(C)Cc1ccccc1)/C)C 269982a_100000186898_100016991246 [1,1,0,0,0,0|1,0,1]=4 634 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Br)/C)C 2230a_100000174875_100016991246 [1,1,0,0,0,0|1,0,1]=4 635 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Br)/C)C 2230a_200020676162_100011217064 [1,1,0,0,0,0|1,0,1]=4 636 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Br)/C)C 270004a_200020676162_100000186029 [1,1,0,0,0,0|1,0,1]=4 637 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Br)/C)C 34a_100000174875_100016991246 [1,1,0,0,0,0|1,0,1]=4 638 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Br)/C)C 34a_200020676162_100000189115 [1,1,0,0,0,0|1,0,1]=4 639 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)C)/C)C 2230a_100000174908_100016991246 [1,1,0,0,0,0|1,0,1]=4 640 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)C)/C)C 2230a_200020676162_100000210814 [1,1,0,0,0,0|1,0,1]=4 641 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)C)/C)C 270004a_200020676162_100000211033 [1,1,0,0,0,0|1,0,1]=4 642 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)C)/C)C 34a_100000174908_100016991246 [1,1,0,0,0,0|1,0,1]=4 643 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)C)/C)C 34a_200020676162_100000210814 [1,1,0,0,0,0|1,0,1]=4 644 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Cl)/C)C 2230a_100000174871_100016991246 [1,1,0,0,0,0|1,0,1]=4 645 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Cl)/C)C 2230a_200020676162_100000694040 [1,1,0,0,0,0|1,0,1]=4 646 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Cl)/C)C 270004a_200020676162_100000189385 [1,1,0,0,0,0|1,0,1]=4 647 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Cl)/C)C 34a_100000174871_100016991246 [1,1,0,0,0,0|1,0,1]=4 648 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)Cl)/C)C 34a_200020676162_100000694040 [1,1,0,0,0,0|1,0,1]=4 649 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)F)/C)C 2230a_100000174882_100016991246 [1,1,0,0,0,0|1,0,1]=4 650 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)F)/C)C 2230a_200020676162_100000198546 [1,1,0,0,0,0|1,0,1]=4 651 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)F)/C)C 270004a_200020676162_100000210084 [1,1,0,0,0,0|1,0,1]=4 652 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)F)/C)C 34a_100000174882_100016991246 [1,1,0,0,0,0|1,0,1]=4 653 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)F)/C)C 34a_200020676162_100000198546 [1,1,0,0,0,0|1,0,1]=4 654 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)I)/C)C 2230a_100016989417_100016991246 [1,1,0,0,0,0|1,0,1]=4 655 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)I)/C)C 2230a_200020676162_100000189116 [1,1,0,0,0,0|1,0,1]=4 656 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)I)/C)C 34a_100016989417_100016991246 [1,1,0,0,0,0|1,0,1]=4 657 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)I)/C)C 34a_200020676162_100000189116 [1,1,0,0,0,0|1,0,1]=4 658 B19R1.42618 CC(=CCC/C(=C/CNCc1ccc(cc1)O)/C)C 34a_100000185549_100016991246 [1,1,0,0,0,0|1,0,1]=4 659 B19R1.42618 CC(=CCC/C(=C/COCc1cc[n+](cc1)C)/C)C 34a_100009831711_100016991246 [1,1,0,0,0,0|1,0,1]=4 660 B19R1.42618 CC(=CCC/C(=C/COCc1cc[n+](cc1)[O-])/C)C 34a_100000031831_100016991246 [1,1,0,0,0,0|1,0,1]=4 661 B19R1.42618 CC(=CCC/C(=C/COCc1cc[n+](cc1)[O-])/C)C 7a_100000031831_100016991246 [1,1,0,0,0,0|1,0,1]=4 662 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(=O)[nH]c1)/C)C 34a_100011999846_100016991246 [1,1,0,0,0,0|1,0,1]=4 663 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)Br)/C)C 34a_100000695286_100016991246 [1,1,0,0,0,0|0,0,1]=3 664 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)C)/C)C 34a_100011215236_100016991246 [1,1,0,0,0,0|0,0,1]=3 665 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)C)/C)C 7a_100011215236_100016991246 [1,1,0,0,0,0|0,0,1]=3 666 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)Cl)/C)C 34a_100000211118_100016991246 [1,1,0,0,0,0|0,0,1]=3 667 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)Cl)/C)C 7a_100000211118_100016991246 [1,1,0,0,0,0|0,0,1]=3 668 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)F)/C)C 34a_100000210977_100016991246 [1,1,0,0,0,0|0,0,1]=3 669 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)F)/C)C 7a_100000210977_100016991246 [1,1,0,0,0,0|0,0,1]=3 670 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)I)/C)C 34a_100000690907_100016991246 [1,1,0,0,0,0|0,0,1]=3 671 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)I)/C)C 7a_100000690907_100016991246 [1,1,0,0,0,0|0,0,1]=3 672 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cc1)N)/C)C 34a_100011215238_100016991246 [1,1,0,0,0,0|0,0,1]=3 673 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cn1)Br)/C)C 34a_100000754261_100016991246 [1,1,0,0,0,0|1,0,1]=4 674 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cn1)C)/C)C 34a_100012001401_100016991246 [1,1,0,0,0,0|1,0,1]=4 675 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cn1)Cl)/C)C 34a_100000703999_100016991246 [1,1,0,0,0,0|1,0,1]=4 676 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cn1)F)/C)C 34a_100011999454_100016991246 [1,1,0,0,0,0|1,0,1]=4 677 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(cn1)N)/C)C 34a_100011998161_100016991246 [1,1,0,0,0,0|1,0,1]=4 678 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)Br)/C)C 34a_100009816760_100016991246 [1,1,0,0,0,0|1,0,1]=4 679 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)Br)/C)C 7a_100009816760_100016991246 [1,1,0,0,0,0|1,0,1]=4 680 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)C)/C)C 34a_100011248133_100016991246 [1,1,0,0,0,0|1,0,1]=4 681 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)Cl)/C)C 34a_100000755211_100016991246 [1,1,0,0,0,0|1,0,1]=4 682 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)Cl)/C)C 7a_100000755211_100016991246 [1,1,0,0,0,0|1,0,1]=4 683 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)F)/C)C 34a_100000079959_100016991246 [1,1,0,0,0,0|1,0,1]=4 684 B19R1.42618 CC(=CCC/C(=C/COCc1ccc(nc1)N)/C)C 34a_100000704267_100016991246 [1,1,0,0,0,0|1,0,1]=4 685 B19R1.42618 CC(=CCC/C(=C/CSCc1ccc(cc1)C)/C)C 62a_100000210814_100016991246 [1,1,0,0,0,0|0,1,1]=4 686 B19R1.42618 CC(=CCC/C(=C/CSCc1ccc(cc1)C)/C)C 62a_100016991246_100000210814 [1,1,0,0,0,0|0,1,1]=4 687 B19R1.42618 CC(=CCC/C(=C/CSCc1ccc(cc1)F)/C)C 62a_100000198546_100016991246 [1,1,0,0,0,0|0,1,1]=4 688 B19R1.42618 CC(=CCC/C(=C/CSCc1ccc(cc1)F)/C)C 62a_100016991246_100000187164 [1,1,0,0,0,0|0,1,1]=4 689 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)Br)/C)C 34a_100016990311_100000189115 [1,1,0,0,0,0|0,0,1]=3 690 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)Br)/C)C 7a_100016990311_100011217064 [1,1,0,0,0,0|0,0,1]=3 691 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)C)/C)C 34a_100016990311_100000210814 [1,1,0,0,0,0|0,0,1]=3 692 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)C)/C)C 7a_100016990311_100000210814 [1,1,0,0,0,0|0,0,1]=3 693 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)Cl)/C)C 34a_100016990311_100000694040 [1,1,0,0,0,0|0,0,1]=3 694 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)Cl)/C)C 7a_100016990311_100000187161 [1,1,0,0,0,0|0,0,1]=3 695 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)F)/C)C 34a_100016990311_100000198546 [1,1,0,0,0,0|0,0,1]=3 696 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)F)/C)C 7a_100016990311_100000198546 [1,1,0,0,0,0|0,0,1]=3 697 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)I)/C)C 34a_100016990311_100000189116 [1,1,0,0,0,0|0,0,1]=3 698 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cc1)I)/C)C 7a_100016990311_100000189116 [1,1,0,0,0,0|0,0,1]=3 699 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)Br)/C)C 34a_100016990311_100000702658 [1,1,0,0,0,0|1,0,1]=4 700 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)Br)/C)C 7a_100016990311_100000702658 [1,1,0,0,0,0|1,0,1]=4 701 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)C)/C)C 34a_100016990311_100000691093 [1,1,0,0,0,0|1,0,1]=4 702 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)C)/C)C 7a_100016990311_100000691093 [1,1,0,0,0,0|1,0,1]=4 703 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)Cl)/C)C 34a_100016990311_100012066911 [1,1,0,0,0,0|1,0,1]=4 704 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)Cl)/C)C 7a_100016990311_100012066911 [1,1,0,0,0,0|1,0,1]=4 705 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)F)/C)C 34a_100016990311_100000703193 [1,1,0,0,0,0|1,0,1]=4 706 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(cn1)F)/C)C 7a_100016990311_100000703193 [1,1,0,0,0,0|1,0,1]=4 707 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)Br)/C)C 34a_100016990311_100009831999 [1,1,0,0,0,0|1,0,1]=4 708 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)Br)/C)C 7a_100016990311_100009831999 [1,1,0,0,0,0|1,0,1]=4 709 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)C)/C)C 34a_100016990311_100016987292 [1,1,0,0,0,0|1,0,1]=4 710 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)C)/C)C 7a_100016990311_100016987292 [1,1,0,0,0,0|1,0,1]=4 711 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)Cl)/C)C 34a_100016990311_100000735431 [1,1,0,0,0,0|1,0,1]=4 712 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)Cl)/C)C 7a_100016990311_100000735431 [1,1,0,0,0,0|1,0,1]=4 713 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)F)/C)C 34a_100016990311_100000099788 [1,1,0,0,0,0|1,0,1]=4 714 B19R1.42618 CC(=CCC/C(=C\COCc1ccc(nc1)F)/C)C 7a_100016990311_100009820150 [1,1,0,0,0,0|1,0,1]=4 715 B19R1.4104 CN(C)C(=O)CCC(=O)COC(=O)c1ccccc1 1458a_100011200748_100000073877 [0,1,0,0,1,0|2,0,0]=4 716 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)Br)/C)C 1458a_100000210664_100016991246 [0,1,0,0,1,0|0,0,0]=2 717 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)C)/C)C 1458a_100000189346_100016991246 [0,1,0,0,1,0|0,0,0]=2 718 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)Cl)/C)C 1458a_100000210390_100016991246 [0,1,0,0,1,0|0,0,0]=2 719 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)F)/C)C 1458a_100000210950_100016991246 [0,1,0,0,1,0|0,0,0]=2 720 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)I)/C)C 1458a_100000184098_100016991246 [0,1,0,0,1,0|0,0,0]=2 721 B19R1.10259 CC(=CCC/C(=C/CC(=O)c1cccc(c1)O)/C)C 1458a_100000183914_100016991246 [0,1,0,0,1,0|0,0,0]=2 722 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Br)/C)C 2230a_100000219648_100016991246 [0,1,0,0,1,0|2,0,0]=4 723 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Br)/C)C 269982a_100000219648_100016991246 [0,1,0,0,1,0|2,0,0]=4 724 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Br)/C)C 34a_100000219648_100016991246 [0,1,0,0,1,0|2,0,0]=4 725 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)C)/C)C 2230a_100000219674_100016991246 [0,1,0,0,1,0|2,0,0]=4 726 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)C)/C)C 269982a_100000219674_100016991246 [0,1,0,0,1,0|2,0,0]=4 727 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)C)/C)C 34a_100000219674_100016991246 [0,1,0,0,1,0|2,0,0]=4 728 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Cl)/C)C 2230a_100000220044_100016991246 [0,1,0,0,1,0|2,0,0]=4 729 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Cl)/C)C 269982a_100000220044_100016991246 [0,1,0,0,1,0|2,0,0]=4 730 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)Cl)/C)C 34a_100000220044_100016991246 [0,1,0,0,1,0|2,0,0]=4 731 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)F)/C)C 2230a_100020633736_100016991246 [0,1,0,0,1,0|2,0,0]=4 732 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)F)/C)C 269982a_100020633736_100016991246 [0,1,0,0,1,0|2,0,0]=4 733 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)F)/C)C 34a_100020633736_100016991246 [0,1,0,0,1,0|2,0,0]=4 734 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)I)/C)C 2230a_100000221217_100016991246 [0,1,0,0,1,0|2,0,0]=4 735 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)I)/C)C 269982a_100000221217_100016991246 [0,1,0,0,1,0|2,0,0]=4 736 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)I)/C)C 34a_100000221217_100016991246 [0,1,0,0,1,0|2,0,0]=4 737 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)O)/C)C 2230a_100000756613_100016991246 [0,1,0,0,1,0|2,0,0]=4 738 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)O)/C)C 269982a_100000756613_100016991246 [0,1,0,0,1,0|2,0,0]=4 739 B19R1.10259 CC(=CCC/C(=C/CN(C)c1cccc(c1)O)/C)C 34a_100000756613_100016991246 [0,1,0,0,1,0|2,0,0]=4 740 B19R1.10259 CC(=CCCC(=NNC(=O)c1cccc(c1)Br)C)C 4a_100000189783_100000765506 [0,1,0,0,1,0|2,0,0]=4 741 B19R1.10259 CC(=CCCC(=NNC(=O)c1cccc(c1)C)C)C 4a_100000189845_100000765506 [0,1,0,0,1,0|2,0,0]=4 742 B19R1.10259 CC(=CCCC(=NNC(=O)c1cccc(c1)Cl)C)C 4a_100000183659_100000765506 [0,1,0,0,1,0|2,0,0]=4 743 B19R1.10259 CC(=CCCC(=NNC(=O)c1cccc(c1)F)C)C 4a_100000189798_100000765506 [0,1,0,0,1,0|2,0,0]=4 744 B19R1.10259 CC(=CCCC(=NNC(=O)c1cccc(c1)I)C)C 4a_100000186306_100000765506 [0,1,0,0,1,0|2,0,0]=4 745 B19R1.10259 CC(=CCCC(=O)CNC(=O)c1cccc(c1)Br)C 1458a_100000179737_100011217483 [0,1,0,0,1,0|2,0,0]=4 746 B19R1.10259 CC(=CCCC(=O)CNC(=O)c1cccc(c1)C)C 1458a_100000182573_100011217483 [0,1,0,0,1,0|2,0,0]=4 747 B19R1.10259 CC(=CCCC(=O)CNC(=O)c1cccc(c1)Cl)C 1458a_100000182572_100011217483 [0,1,0,0,1,0|2,0,0]=4 748 B19R1.10259 CC(=CCCC(=O)CNC(=O)c1cccc(c1)F)C 1458a_100000183068_100011217483 [0,1,0,0,1,0|2,0,0]=4 749 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)Br)C 1458a_100000210664_100009814015 [0,1,0,0,1,0|0,0,2]=4 750 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)C)C 1458a_100000189346_100009814015 [0,1,0,0,1,0|0,0,2]=4 751 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)Cl)C 1458a_100000210390_100009814015 [0,1,0,0,1,0|0,0,2]=4 752 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)F)C 1458a_100000210950_100009814015 [0,1,0,0,1,0|0,0,2]=4 753 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)I)C 1458a_100000184098_100009814015 [0,1,0,0,1,0|0,0,2]=4 754 B19R1.10259 CC(=CCCC(C)CCC(=O)c1cccc(c1)O)C 1458a_100000183914_100009814015 [0,1,0,0,1,0|0,0,2]=4 755 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)Br)C 34a_100102619829_100000212080 [0,1,0,0,1,0|1,0,1]=4 756 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)Br)C 7a_100102619829_100000212080 [0,1,0,0,1,0|1,0,1]=4 757 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)C)C 34a_100102619829_100000739480 [0,1,0,0,1,0|1,0,1]=4 758 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)C)C 7a_100102619829_100000739480 [0,1,0,0,1,0|1,0,1]=4 759 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)Cl)C 34a_100102619829_100000211444 [0,1,0,0,1,0|1,0,1]=4 760 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)Cl)C 7a_100102619829_100000211444 [0,1,0,0,1,0|1,0,1]=4 761 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)F)C 34a_100102619829_100000215616 [0,1,0,0,1,0|1,0,1]=4 762 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)O)C 34a_100102619829_100009813753 [0,1,0,0,1,0|1,0,1]=4 763 B19R1.10259 CC(=CCCC(C)OCC(=O)c1cccc(c1)O)C 7a_100102619829_100009813753 [0,1,0,0,1,0|1,0,1]=4 764 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1Br)/C)C 1458a_100000188424_100016991246 [0,1,0,0,1,0|0,0,0]=2 765 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1C)/C)C 1458a_100000212026_100016991246 [0,1,0,0,1,0|0,0,0]=2 766 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1Cl)/C)C 1458a_100000185844_100016991246 [0,1,0,0,1,0|0,0,0]=2 767 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1F)/C)C 1458a_100000188656_100016991246 [0,1,0,0,1,0|0,0,0]=2 768 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1I)/C)C 1458a_100000187884_100016991246 [0,1,0,0,1,0|0,0,0]=2 769 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1O)/C)C 1458a_100015234032_100016991246 [0,1,0,0,1,0|0,0,0]=2 770 B19R1.10606 CC(=CCC/C(=C/CC(=O)c1ccccc1[O-])/C)C 1458a_100009911694_100016991246 [0,1,0,0,1,0|0,0,0]=2 771 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Br)/C)C 2230a_100020606079_100016991246 [0,1,0,0,1,0|2,0,0]=4 772 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Br)/C)C 269982a_100020606079_100016991246 [0,1,0,0,1,0|2,0,0]=4 773 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Br)/C)C 34a_100020606079_100016991246 [0,1,0,0,1,0|2,0,0]=4 774 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1C)/C)C 2230a_100000219699_100016991246 [0,1,0,0,1,0|2,0,0]=4 775 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1C)/C)C 269982a_100000219699_100016991246 [0,1,0,0,1,0|2,0,0]=4 776 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1C)/C)C 34a_100000219699_100016991246 [0,1,0,0,1,0|2,0,0]=4 777 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Cl)/C)C 2230a_100000219374_100016991246 [0,1,0,0,1,0|2,0,0]=4 778 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Cl)/C)C 269982a_100000219374_100016991246 [0,1,0,0,1,0|2,0,0]=4 779 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1Cl)/C)C 34a_100000219374_100016991246 [0,1,0,0,1,0|2,0,0]=4 780 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1F)/C)C 2230a_100000220357_100016991246 [0,1,0,0,1,0|2,0,0]=4 781 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1F)/C)C 269982a_100000220357_100016991246 [0,1,0,0,1,0|2,0,0]=4 782 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1F)/C)C 34a_100000220357_100016991246 [0,1,0,0,1,0|2,0,0]=4 783 B19R1.10606 CC(=CCC/C(=C/CN(C)c1ccccc1O)/C)C 269982a_100000033821_100016991246 [0,1,0,0,1,0|2,0,0]=4 784 B19R1.10606 CC(=CCCC(=NNC(=O)c1ccccc1Br)C)C 4a_100000183644_100000765506 [0,1,0,0,1,0|2,0,0]=4 785 B19R1.10606 CC(=CCCC(=NNC(=O)c1ccccc1C)C)C 4a_100000181371_100000765506 [0,1,0,0,1,0|2,0,0]=4 786 B19R1.10606 CC(=CCCC(=NNC(=O)c1ccccc1Cl)C)C 4a_100000186534_100000765506 [0,1,0,0,1,0|2,0,0]=4 787 B19R1.10606 CC(=CCCC(=NNC(=O)c1ccccc1F)C)C 4a_100000183521_100000765506 [0,1,0,0,1,0|2,0,0]=4 788 B19R1.10606 CC(=CCCC(=NNC(=O)c1ccccc1I)C)C 4a_100000190081_100000765506 [0,1,0,0,1,0|2,0,0]=4 789 B19R1.10606 CC(=CCCC(=O)CNC(=O)c1ccccc1C)C 1458a_100000184812_100011217483 [0,1,0,0,1,0|2,0,0]=4 790 B19R1.10606 CC(=CCCC(=O)CNC(=O)c1ccccc1Cl)C 1458a_100000182550_100011217483 [0,1,0,0,1,0|2,0,0]=4 791 B19R1.10606 CC(=CCCC(=O)CNC(=O)c1ccccc1F)C 1458a_100000182453_100011217483 [0,1,0,0,1,0|2,0,0]=4 792 B19R1.10606 CC(=CCCC(=O)CNC(=O)c1ccccc1I)C 1458a_100000194700_100011217483 [0,1,0,0,1,0|2,0,0]=4 793 B19R1.10606 CC(=CCCC(=O)CNC(=O)c1ccccc1O)C 1458a_100011193979_100011217483 [0,1,0,0,1,0|2,0,0]=4 794 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1Br)C 1458a_100000188424_100009814015 [0,1,0,0,1,0|0,0,2]=4 795 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1C)C 1458a_100000212026_100009814015 [0,1,0,0,1,0|0,0,2]=4 796 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1Cl)C 1458a_100000185844_100009814015 [0,1,0,0,1,0|0,0,2]=4 797 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1F)C 1458a_100000188656_100009814015 [0,1,0,0,1,0|0,0,2]=4 798 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1I)C 1458a_100000187884_100009814015 [0,1,0,0,1,0|0,0,2]=4 799 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1O)C 1458a_100015234032_100009814015 [0,1,0,0,1,0|0,0,2]=4 800 B19R1.10606 CC(=CCCC(C)CCC(=O)c1ccccc1[O-])C 1458a_100009911694_100009814015 [0,1,0,0,1,0|0,0,2]=4 801 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1Br)C 34a_100102619829_100000199116 [0,1,0,0,1,0|1,0,1]=4 802 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1C)C 34a_100102619829_100000741374 [0,1,0,0,1,0|1,0,1]=4 803 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1C)C 7a_100102619829_100000741374 [0,1,0,0,1,0|1,0,1]=4 804 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1Cl)C 34a_100102619829_100000211432 [0,1,0,0,1,0|1,0,1]=4 805 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1F)C 34a_100102619829_100000204681 [0,1,0,0,1,0|1,0,1]=4 806 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1F)C 7a_100102619829_100000204681 [0,1,0,0,1,0|1,0,1]=4 807 B19R1.10606 CC(=CCCC(C)OCC(=O)c1ccccc1O)C 7a_100102619829_100000188908 [0,1,0,0,1,0|1,0,1]=4 808 B19R1.10606 CC(=CCNC(C)COC(=O)c1ccccc1Br)C 270004a_100000718196_201991511838 [0,1,0,0,1,0|1,0,1]=4 809 B19R1.26141 CC(=CCCC(=O)C(O)NC(=O)c1ccccc1)C 1458a_100000067094_100011217483 [0,1,0,0,1,0|2,0,0]=4 810 B19R1.26141 CC(=CCCC(=O)[C@@H](C)NC(=O)c1ccccc1)C 1458a_100011504567_100011217483 [0,1,0,0,1,0|2,0,0]=4 811 B19R1.26141 CC(=CCCC(=O)[C@@H](C)OC(=O)c1ccccc1)C 1458a_200035542198_100011217483 [0,1,0,0,1,0|1,0,0]=3 812 B19R1.26141 CC(=CCNC(=O)[C@@H](C)OC(=O)c1ccccc1)C 11a_100000718196_200035542198 [0,1,0,0,1,0|2,0,0]=4 813 B19R1.26141 CC(=CCNC(=O)[C@@H](C)OC(=O)c1ccccc1)C 1626a_100000718196_200035542198 [0,1,0,0,1,0|2,0,0]=4 814 B19R1.26141 CC(=CCNC(=O)[C@@H](C)OC(=O)c1ccccc1)C 527a_100000718196_200035542198 [0,1,0,0,1,0|2,0,0]=4 815 B19R1.26143 CC(=CCCC(=O)CN(C)C(=O)c1ccccc1)C 1458a_100000194983_100011217483 [0,1,0,0,1,0|2,0,0]=4 816 B19R1.26143 CC(=CCCC(C)OC(C)C(=O)c1ccccc1)C 7a_100102619829_100000239700 [0,1,0,0,1,0|1,0,1]=4 817 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)Br)/C)C 1458a_100000185839_100016991246 [0,1,0,0,1,0|0,0,0]=2 818 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)C)/C)C 1458a_100000188618_100016991246 [0,1,0,0,1,0|0,0,0]=2 819 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)Cl)/C)C 1458a_100000210187_100016991246 [0,1,0,0,1,0|0,0,0]=2 820 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)F)/C)C 1458a_100000187176_100016991246 [0,1,0,0,1,0|0,0,0]=2 821 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)I)/C)C 1458a_100000187904_100016991246 [0,1,0,0,1,0|0,0,0]=2 822 B19R1.42624 CC(=CCC/C(=C/CC(=O)c1ccc(cc1)O)/C)C 1458a_100000212099_100016991246 [0,1,0,0,1,0|0,0,0]=2 823 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Br)/C)C 2230a_100000219623_100016991246 [0,1,0,0,1,0|2,0,0]=4 824 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Br)/C)C 269982a_100000219623_100016991246 [0,1,0,0,1,0|2,0,0]=4 825 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Br)/C)C 34a_100000219623_100016991246 [0,1,0,0,1,0|2,0,0]=4 826 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)C)/C)C 2230a_100000219977_100016991246 [0,1,0,0,1,0|2,0,0]=4 827 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)C)/C)C 269982a_100000219977_100016991246 [0,1,0,0,1,0|2,0,0]=4 828 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)C)/C)C 34a_100000219977_100016991246 [0,1,0,0,1,0|2,0,0]=4 829 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Cl)/C)C 2230a_100020629279_100016991246 [0,1,0,0,1,0|2,0,0]=4 830 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Cl)/C)C 269982a_100020629279_100016991246 [0,1,0,0,1,0|2,0,0]=4 831 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)Cl)/C)C 34a_100020629279_100016991246 [0,1,0,0,1,0|2,0,0]=4 832 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)F)/C)C 2230a_100000219829_100016991246 [0,1,0,0,1,0|2,0,0]=4 833 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)F)/C)C 269982a_100000219829_100016991246 [0,1,0,0,1,0|2,0,0]=4 834 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)F)/C)C 34a_100000219829_100016991246 [0,1,0,0,1,0|2,0,0]=4 835 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)I)/C)C 2230a_100000743151_100016991246 [0,1,0,0,1,0|2,0,0]=4 836 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)I)/C)C 269982a_100000743151_100016991246 [0,1,0,0,1,0|2,0,0]=4 837 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)I)/C)C 34a_100000743151_100016991246 [0,1,0,0,1,0|2,0,0]=4 838 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)O)/C)C 269982a_100000182112_100016991246 [0,1,0,0,1,0|2,0,0]=4 839 B19R1.42624 CC(=CCC/C(=C/CN(C)c1ccc(cc1)O)/C)C 34a_100000182112_100016991246 [0,1,0,0,1,0|2,0,0]=4 840 B19R1.42624 CC(=CCCC(=NNC(=O)c1ccc(cc1)Br)C)C 4a_100000183614_100000765506 [0,1,0,0,1,0|2,0,0]=4 841 B19R1.42624 CC(=CCCC(=NNC(=O)c1ccc(cc1)C)C)C 4a_100000189790_100000765506 [0,1,0,0,1,0|2,0,0]=4 842 B19R1.42624 CC(=CCCC(=NNC(=O)c1ccc(cc1)Cl)C)C 4a_100000184390_100000765506 [0,1,0,0,1,0|2,0,0]=4 843 B19R1.42624 CC(=CCCC(=NNC(=O)c1ccc(cc1)F)C)C 4a_100000182866_100000765506 [0,1,0,0,1,0|2,0,0]=4 844 B19R1.42624 CC(=CCCC(=NNC(=O)c1ccc(cc1)I)C)C 4a_100000189773_100000765506 [0,1,0,0,1,0|2,0,0]=4 845 B19R1.42624 CC(=CCCC(=O)CNC(=O)c1ccc(cc1)C)C 1458a_100000183637_100011217483 [0,1,0,0,1,0|2,0,0]=4 846 B19R1.42624 CC(=CCCC(=O)CNC(=O)c1ccc(cc1)Cl)C 1458a_100000182666_100011217483 [0,1,0,0,1,0|2,0,0]=4 847 B19R1.42624 CC(=CCCC(=O)CNC(=O)c1ccc(cc1)F)C 1458a_100000183488_100011217483 [0,1,0,0,1,0|2,0,0]=4 848 B19R1.42624 CC(=CCCC(=O)CNC(=O)c1ccc(cc1)O)C 1458a_100000205570_100011217483 [0,1,0,0,1,0|2,0,0]=4 849 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)Br)C 1458a_100000185839_100009814015 [0,1,0,0,1,0|0,0,2]=4 850 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)C)C 1458a_100000188618_100009814015 [0,1,0,0,1,0|0,0,2]=4 851 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)Cl)C 1458a_100000210187_100009814015 [0,1,0,0,1,0|0,0,2]=4 852 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)F)C 1458a_100000187176_100009814015 [0,1,0,0,1,0|0,0,2]=4 853 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)I)C 1458a_100000187904_100009814015 [0,1,0,0,1,0|0,0,2]=4 854 B19R1.42624 CC(=CCCC(C)CCC(=O)c1ccc(cc1)O)C 1458a_100000212099_100009814015 [0,1,0,0,1,0|0,0,2]=4 855 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)Br)C 34a_100102619829_100000188085 [0,1,0,0,1,0|1,0,1]=4 856 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)Br)C 7a_100102619829_100000188085 [0,1,0,0,1,0|1,0,1]=4 857 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)C)C 34a_100102619829_100000211441 [0,1,0,0,1,0|1,0,1]=4 858 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)C)C 7a_100102619829_100000211441 [0,1,0,0,1,0|1,0,1]=4 859 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)Cl)C 7a_100102619829_100000211071 [0,1,0,0,1,0|1,0,1]=4 860 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)F)C 7a_100102619829_100000211279 [0,1,0,0,1,0|1,0,1]=4 861 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)I)C 34a_100102619829_100011216261 [0,1,0,0,1,0|1,0,1]=4 862 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)I)C 7a_100102619829_100011216261 [0,1,0,0,1,0|1,0,1]=4 863 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)O)C 34a_100102619829_100009814261 [0,1,0,0,1,0|1,0,1]=4 864 B19R1.42624 CC(=CCCC(C)OCC(=O)c1ccc(cc1)O)C 7a_100102619829_100000018856 [0,1,0,0,1,0|1,0,1]=4 865 B19R1.42624 CC(=CCNC(C)COC(=O)c1ccc(cc1)Br)C 270004a_100000718196_200027936475 [0,1,0,0,1,0|1,0,1]=4 866 B19R1.86136 CCN(C/C=C(\C)/CCC=C(C)C)c1ccccc1 2230a_100000210013_100016991246 [0,1,0,0,1,0|2,0,0]=4 867 B19R1.86136 CCN(C/C=C(\C)/CCC=C(C)C)c1ccccc1 269982a_100000210013_100016991246 [0,1,0,0,1,0|2,0,0]=4 868 B19R1.86136 CCN(C/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100000210013_100016991246 [0,1,0,0,1,0|2,0,0]=4 869 B21R1.35005 CC(=CCCC(=CC(=O)CCC(=O)c1ccccc1)C)C 1458a_100016995320_100000750707 [0,1,0,0,0,1|1,0,0]=3 870 B21R1.35005 CC(=CCCC(=CC(=O)COC(=O)c1ccccc1)C)C 1458a_100016995320_100000073877 [0,1,0,0,0,1|0,0,0]=2 871 B21R1.35005 CC(=CCCC(=CC(=O)NNC(=O)c1ccccc1)C)C 22a_100000184135_100016995320 [0,1,0,0,0,1|1,0,1]=4 872 B21R1.35005 CC(=CCCC(C)CC(=O)CCC(=O)c1ccccc1)C 1458a_100000043202_100000750707 [0,1,0,0,0,1|1,0,1]=4 873 B21R1.35005 CC(=CCCC(C)CC(=O)COC(=O)c1ccccc1)C 1458a_100000043202_100000073877 [0,1,0,0,0,1|0,0,1]=3 874 B21R1.35007 C=C(C(=O)NC/C=C(\C)/CCC=C(C)C)c1ccccc1 1626a_200020676162_100000065200 [0,1,0,0,0,1|2,0,0]=4 875 B21R1.35007 CC(=CCC/C(=C/CNC(C)C(=O)c1ccccc1)/C)C 2230a_200020676162_100000239700 [0,1,0,0,0,1|1,0,0]=3 876 B21R1.35007 CC(=CCC/C(=C/CO[C@@H](C)[C@@H](N)c1ccccc1)/C)C 34a_100134616770_100016991246 [0,1,0,0,0,1|1,0,1]=4 877 B21R1.35007 CC(=CCC/C(=C/CSC(C)C(=O)c1ccccc1)/C)C 62a_100000239700_100016991246 [0,1,0,0,0,1|0,1,0]=3 878 B21R1.35007 CC(=CCC/C(=C/CSC(C)C(=O)c1ccccc1)/C)C 62a_100016991246_100000239700 [0,1,0,0,0,1|0,1,0]=3 879 B21R1.35007 CC(=CCC/C(=C\COC(C)C(=O)c1ccccc1)/C)C 7a_100016990311_100000239700 [0,1,0,0,0,1|0,0,0]=2 880 B21R1.35007 CC(=CCCC(C)CCOC(C)C(=O)c1ccccc1)C 7a_100000017536_100000239700 [0,1,0,0,0,1|0,0,2]=4 881 B21R1.35164 CC(=CCC/C(=C/CC(=O)C=C(C)c1ccccc1)/C)C 1458a_100000743005_100016991246 [0,1,0,0,0,1|2,0,0]=4 882 B21R1.45386 CCC(COC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100000752371_100016991246 [0,1,0,0,0,1|1,0,1]=4 883 B21R1.45386 CCC(COC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100000752371_100016991246 [0,1,0,0,0,1|1,0,1]=4 884 B21R1.45386 COC(COC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100011215540_100016991246 [0,1,0,0,0,1|0,0,2]=4 885 B21R1.45386 COC(COC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100011215540_100016991246 [0,1,0,0,0,1|0,0,2]=4 886 B21R1.60280 CC(=CCC/C(=C/CNCC(=O)c1ccc(cc1)Br)/C)C 34a_200020676162_100000188085 [0,1,0,0,0,1|1,0,0]=3 887 B21R1.60280 CC(=CCC/C(=C/CNCC(=O)c1ccc(cc1)C)/C)C 2230a_200020676162_100000211441 [0,1,0,0,0,1|1,0,0]=3 888 B21R1.60280 CC(=CCC/C(=C/CNCC(=O)c1ccc(cc1)C)/C)C 34a_200020676162_100000211441 [0,1,0,0,0,1|1,0,0]=3 889 B21R1.60280 CC(=CCC/C(=C/CNCC(=O)c1ccc(cc1)I)/C)C 34a_200020676162_100011216261 [0,1,0,0,0,1|1,0,0]=3 890 B21R1.60280 CC(=CCC/C(=C/CNCC(=O)c1ccc(cc1)O)/C)C 34a_200020676162_100009814261 [0,1,0,0,0,1|1,0,0]=3 891 B21R1.60280 CC(=CCC/C(=C/COCC(=O)c1ccc(cc1)F)/C)C 34a_100000246311_100016991246 [0,1,0,0,0,1|0,0,0]=2 892 B21R1.60280 CC(=CCC/C(=C/COCC(N)c1ccc(cc1)Br)/C)C 34a_100000734186_100016991246 [0,1,0,0,0,1|1,0,1]=4 893 B21R1.60280 CC(=CCC/C(=C/COCC(N)c1ccc(cc1)F)/C)C 34a_100000705410_100016991246 [0,1,0,0,0,1|1,0,1]=4 894 B21R1.60280 CC(=CCC/C(=C/COC[C@@H](N)c1ccc(cc1)Cl)/C)C 34a_100009818818_100016991246 [0,1,0,0,0,1|1,0,1]=4 895 B21R1.60280 CC(=CCC/C(=C/COC[C@H](N)c1ccc(cc1)C)/C)C 34a_100009818840_100016991246 [0,1,0,0,0,1|1,0,1]=4 896 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)C)/C)C 62a_100000211441_100016991246 [0,1,0,0,0,1|0,1,0]=3 897 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)C)/C)C 62a_100016991246_100000211441 [0,1,0,0,0,1|0,1,0]=3 898 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)Cl)/C)C 62a_100000211071_100016991246 [0,1,0,0,0,1|0,1,0]=3 899 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)Cl)/C)C 62a_100016991246_100000211071 [0,1,0,0,0,1|0,1,0]=3 900 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)F)/C)C 62a_100000211279_100016991246 [0,1,0,0,0,1|0,1,0]=3 901 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)F)/C)C 62a_100016991246_100000211279 [0,1,0,0,0,1|0,1,0]=3 902 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)I)/C)C 62a_100011216261_100016991246 [0,1,0,0,0,1|0,1,0]=3 903 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)I)/C)C 62a_100016991246_100011216261 [0,1,0,0,0,1|0,1,0]=3 904 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)O)/C)C 62a_100009814261_100016991246 [0,1,0,0,0,1|0,1,0]=3 905 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cc1)O)/C)C 62a_100016991246_100009814261 [0,1,0,0,0,1|0,1,0]=3 906 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cn1)Cl)/C)C 62a_100016989621_100016991246 [0,1,0,0,0,1|1,1,0]=4 907 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(cn1)Cl)/C)C 62a_100016991246_100016989621 [0,1,0,0,0,1|1,1,0]=4 908 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(nc1)C)/C)C 62a_100012027583_100016991246 [0,1,0,0,0,1|1,1,0]=4 909 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(nc1)C)/C)C 62a_100016991246_100012027583 [0,1,0,0,0,1|1,1,0]=4 910 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(nc1)Cl)/C)C 62a_100009864725_100016991246 [0,1,0,0,0,1|1,1,0]=4 911 B21R1.60280 CC(=CCC/C(=C/CSCC(=O)c1ccc(nc1)Cl)/C)C 62a_100016991246_100009864725 [0,1,0,0,0,1|1,1,0]=4 912 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)Br)/C)C 34a_100016990311_100000188085 [0,1,0,0,0,1|0,0,0]=2 913 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)Br)/C)C 7a_100016990311_100000188085 [0,1,0,0,0,1|0,0,0]=2 914 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)C)/C)C 34a_100016990311_100000211441 [0,1,0,0,0,1|0,0,0]=2 915 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)C)/C)C 7a_100016990311_100000211441 [0,1,0,0,0,1|0,0,0]=2 916 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)Cl)/C)C 7a_100016990311_100000211071 [0,1,0,0,0,1|0,0,0]=2 917 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)F)/C)C 7a_100016990311_100000211279 [0,1,0,0,0,1|0,0,0]=2 918 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)I)/C)C 34a_100016990311_100011216261 [0,1,0,0,0,1|0,0,0]=2 919 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)I)/C)C 7a_100016990311_100011216261 [0,1,0,0,0,1|0,0,0]=2 920 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)O)/C)C 34a_100016990311_100009814261 [0,1,0,0,0,1|0,0,0]=2 921 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cc1)O)/C)C 7a_100016990311_100000018856 [0,1,0,0,0,1|0,0,0]=2 922 B21R1.60280 CC(=CCC/C(=C\COCC(=O)c1ccc(cn1)Cl)/C)C 7a_100016990311_100016989621 [0,1,0,0,0,1|1,0,0]=3 923 B21R1.60280 CC(=CCC/C(=C\COCC(O)c1ccc(cc1)Cl)/C)C 34a_100016990311_200011996143 [0,1,0,0,0,1|0,0,2]=4 924 B21R1.60280 CC(=CCC/C(=C\COCC(O)c1ccc(cc1)Cl)/C)C 7a_100016990311_200011996143 [0,1,0,0,0,1|0,0,2]=4 925 B21R1.60280 CC(=CCC/C(=C\COC[C@H](O)c1ccc(cc1)F)/C)C 34a_100016990311_100000720402 [0,1,0,0,0,1|0,0,2]=4 926 B21R1.60280 CC(=CCC/C(=C\COC[C@H](O)c1ccc(cc1)F)/C)C 7a_100016990311_100000720402 [0,1,0,0,0,1|0,0,2]=4 927 B21R1.60280 CC(=CCCC(=CC=NNC(=O)c1ccc(cc1)Br)C)C 4a_100000183614_100000211119 [0,1,0,0,0,1|1,0,1]=4 928 B21R1.60280 CC(=CCCC(=CC=NNC(=O)c1ccc(cc1)C)C)C 4a_100000189790_100000211119 [0,1,0,0,0,1|1,0,1]=4 929 B21R1.60280 CC(=CCCC(=CC=NNC(=O)c1ccc(cc1)Cl)C)C 4a_100000184390_100000211119 [0,1,0,0,0,1|1,0,1]=4 930 B21R1.60280 CC(=CCCC(=CC=NNC(=O)c1ccc(cc1)F)C)C 4a_100000182866_100000211119 [0,1,0,0,0,1|1,0,1]=4 931 B21R1.60280 CC(=CCCC(=CC=NNC(=O)c1ccc(cc1)I)C)C 4a_100000189773_100000211119 [0,1,0,0,0,1|1,0,1]=4 932 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)Br)C 34a_100000017536_100000188085 [0,1,0,0,0,1|0,0,2]=4 933 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)Br)C 7a_100000017536_100000188085 [0,1,0,0,0,1|0,0,2]=4 934 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)C)C 34a_100000017536_100000211441 [0,1,0,0,0,1|0,0,2]=4 935 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)C)C 7a_100000017536_100000211441 [0,1,0,0,0,1|0,0,2]=4 936 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)Cl)C 7a_100000017536_100000211071 [0,1,0,0,0,1|0,0,2]=4 937 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)F)C 34a_100000246311_100009814015 [0,1,0,0,0,1|0,0,2]=4 938 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)F)C 7a_100000017536_100000211279 [0,1,0,0,0,1|0,0,2]=4 939 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)I)C 34a_100000017536_100011216261 [0,1,0,0,0,1|0,0,2]=4 940 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)I)C 7a_100000017536_100011216261 [0,1,0,0,0,1|0,0,2]=4 941 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)O)C 34a_100000017536_100009814261 [0,1,0,0,0,1|0,0,2]=4 942 B21R1.60280 CC(=CCCC(C)CCOCC(=O)c1ccc(cc1)O)C 7a_100000017536_100000018856 [0,1,0,0,0,1|0,0,2]=4 943 B21R1.71004 CC(=CCC/C(=C/CNCS(=O)(=O)c1ccccc1)/C)C 34a_200020676162_200009813291 [0,1,0,0,0,1|2,0,0]=4 944 B21R1.71004 CC(=CCC/C(=C/COCC(C)(C)c1ccccc1)/C)C 7a_100000747608_100016991246 [0,1,0,0,0,1|1,0,1]=4 945 B21R1.71004 CC(=CCC/C(=C/CSCS(=O)(=O)c1ccccc1)/C)C 62a_100000240042_100016991246 [0,1,0,0,0,1|1,1,0]=4 946 B21R1.71004 CC(=CCC/C(=C/CSCS(=O)(=O)c1ccccc1)/C)C 62a_100016991246_100000240042 [0,1,0,0,0,1|1,1,0]=4 947 B21R1.71004 CC(=CCC/C(=C\COCC(F)(F)c1ccccc1)/C)C 34a_100016990311_100009875531 [0,1,0,0,0,1|1,0,1]=4 948 B21R1.71004 CC(=CCC/C(=C\COCS(=O)(=O)c1ccccc1)/C)C 34a_100016990311_200009813291 [0,1,0,0,0,1|1,0,0]=3 949 B21R1.71004 CC(=CCC/C(=C\COC[Si](C)(C)c1ccccc1)/C)C 7a_100016990311_100000038972 [0,1,0,0,0,1|1,1,0]=4 950 B21R1.522294 CC(=CCC/C(=C/CNCC(=O)c1ccccc1Br)/C)C 34a_200020676162_100000199116 [0,1,0,0,0,1|1,0,0]=3 951 B21R1.522294 CC(=CCC/C(=C/CNCC(=O)c1ccccc1C)/C)C 2230a_200020676162_100000741374 [0,1,0,0,0,1|1,0,0]=3 952 B21R1.522294 CC(=CCC/C(=C/CNCC(=O)c1ccccc1C)/C)C 34a_200020676162_100000741374 [0,1,0,0,0,1|1,0,0]=3 953 B21R1.522294 CC(=CCC/C(=C/CNCC(=O)c1ccccc1Cl)/C)C 34a_200020676162_100000211432 [0,1,0,0,0,1|1,0,0]=3 954 B21R1.522294 CC(=CCC/C(=C/CNCC(=O)c1ccccc1F)/C)C 34a_200020676162_100000204681 [0,1,0,0,0,1|1,0,0]=3 955 B21R1.522294 CC(=CCC/C(=C/COCC(N)c1ccccc1Cl)/C)C 34a_100138412506_100016991246 [0,1,0,0,0,1|1,0,1]=4 956 B21R1.522294 CC(=CCC/C(=C/COC[C@@H](N)c1ccccc1Br)/C)C 34a_100161155918_100016991246 [0,1,0,0,0,1|1,0,1]=4 957 B21R1.522294 CC(=CCC/C(=C/COC[C@H](N)c1ccccc1F)/C)C 34a_100009818778_100016991246 [0,1,0,0,0,1|1,0,1]=4 958 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1C)/C)C 62a_100000741374_100016991246 [0,1,0,0,0,1|0,1,0]=3 959 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1C)/C)C 62a_100016991246_100000741374 [0,1,0,0,0,1|0,1,0]=3 960 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1Cl)/C)C 62a_100000211432_100016991246 [0,1,0,0,0,1|0,1,0]=3 961 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1Cl)/C)C 62a_100016991246_100000211432 [0,1,0,0,0,1|0,1,0]=3 962 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1F)/C)C 62a_100000204681_100016991246 [0,1,0,0,0,1|0,1,0]=3 963 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1F)/C)C 62a_100016991246_100000204681 [0,1,0,0,0,1|0,1,0]=3 964 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1O)/C)C 62a_100000188908_100016991246 [0,1,0,0,0,1|0,1,0]=3 965 B21R1.522294 CC(=CCC/C(=C/CSCC(=O)c1ccccc1O)/C)C 62a_100016991246_100000188908 [0,1,0,0,0,1|0,1,0]=3 966 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1Br)/C)C 34a_100016990311_100000199116 [0,1,0,0,0,1|0,0,0]=2 967 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1C)/C)C 34a_100016990311_100000741374 [0,1,0,0,0,1|0,0,0]=2 968 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1C)/C)C 7a_100016990311_100000741374 [0,1,0,0,0,1|0,0,0]=2 969 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1Cl)/C)C 34a_100016990311_100000211432 [0,1,0,0,0,1|0,0,0]=2 970 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1F)/C)C 34a_100016990311_100000204681 [0,1,0,0,0,1|0,0,0]=2 971 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1F)/C)C 7a_100016990311_100000204681 [0,1,0,0,0,1|0,0,0]=2 972 B21R1.522294 CC(=CCC/C(=C\COCC(=O)c1ccccc1O)/C)C 7a_100016990311_100000188908 [0,1,0,0,0,1|0,0,0]=2 973 B21R1.522294 CC(=CCCC(=CC=NNC(=O)c1ccccc1Br)C)C 4a_100000183644_100000211119 [0,1,0,0,0,1|1,0,1]=4 974 B21R1.522294 CC(=CCCC(=CC=NNC(=O)c1ccccc1C)C)C 4a_100000181371_100000211119 [0,1,0,0,0,1|1,0,1]=4 975 B21R1.522294 CC(=CCCC(=CC=NNC(=O)c1ccccc1Cl)C)C 4a_100000186534_100000211119 [0,1,0,0,0,1|1,0,1]=4 976 B21R1.522294 CC(=CCCC(=CC=NNC(=O)c1ccccc1F)C)C 4a_100000183521_100000211119 [0,1,0,0,0,1|1,0,1]=4 977 B21R1.522294 CC(=CCCC(=CC=NNC(=O)c1ccccc1I)C)C 4a_100000190081_100000211119 [0,1,0,0,0,1|1,0,1]=4 978 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1Br)C 34a_100000017536_100000199116 [0,1,0,0,0,1|0,0,2]=4 979 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1C)C 34a_100000017536_100000741374 [0,1,0,0,0,1|0,0,2]=4 980 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1C)C 7a_100000017536_100000741374 [0,1,0,0,0,1|0,0,2]=4 981 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1Cl)C 34a_100000017536_100000211432 [0,1,0,0,0,1|0,0,2]=4 982 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1F)C 34a_100000017536_100000204681 [0,1,0,0,0,1|0,0,2]=4 983 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1F)C 7a_100000017536_100000204681 [0,1,0,0,0,1|0,0,2]=4 984 B21R1.522294 CC(=CCCC(C)CCOCC(=O)c1ccccc1O)C 7a_100000017536_100000188908 [0,1,0,0,0,1|0,0,2]=4 985 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)Br)/C)C 2230a_200020676162_100000212080 [0,1,0,0,0,1|1,0,0]=3 986 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)Br)/C)C 34a_200020676162_100000212080 [0,1,0,0,0,1|1,0,0]=3 987 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)C)/C)C 2230a_200020676162_100000739480 [0,1,0,0,0,1|1,0,0]=3 988 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)C)/C)C 34a_200020676162_100000739480 [0,1,0,0,0,1|1,0,0]=3 989 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)Cl)/C)C 2230a_200020676162_100000211444 [0,1,0,0,0,1|1,0,0]=3 990 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)Cl)/C)C 34a_200020676162_100000211444 [0,1,0,0,0,1|1,0,0]=3 991 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)F)/C)C 2230a_200020676162_100000215616 [0,1,0,0,0,1|1,0,0]=3 992 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)F)/C)C 34a_200020676162_100000215616 [0,1,0,0,0,1|1,0,0]=3 993 B21R1.535023 CC(=CCC/C(=C/CNCC(=O)c1cccc(c1)O)/C)C 34a_200020676162_100009813753 [0,1,0,0,0,1|1,0,0]=3 994 B21R1.535023 CC(=CCC/C(=C/COCC(=O)c1cccc(c1)Cl)/C)C 7a_200011592804_100016991246 [0,1,0,0,0,1|0,0,0]=2 995 B21R1.535023 CC(=CCC/C(=C/COCC(=O)c1cccc(c1)F)/C)C 34a_100011592800_100016991246 [0,1,0,0,0,1|0,0,0]=2 996 B21R1.535023 CC(=CCC/C(=C/COCC(=O)c1cccc(c1)F)/C)C 7a_100011592800_100016991246 [0,1,0,0,0,1|0,0,0]=2 997 B21R1.535023 CC(=CCC/C(=C/COCC(N)c1cccc(c1)Br)/C)C 34a_100000690078_100016991246 [0,1,0,0,0,1|1,0,1]=4 998 B21R1.535023 CC(=CCC/C(=C/COC[C@@H](N)c1cccc(c1)C)/C)C 34a_100009818812_100016991246 [0,1,0,0,0,1|1,0,1]=4 999 B21R1.535023 CC(=CCC/C(=C/COC[C@@H](N)c1cccc(c1)F)/C)C 34a_100020641251_100016991246 [0,1,0,0,0,1|1,0,1]=4 1000 B21R1.535023 CC(=CCC/C(=C/COC[C@H](N)c1cccc(c1)Cl)/C)C 34a_100032004910_100016991246 [0,1,0,0,0,1|1,0,1]=4 1001 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)C)/C)C 62a_100000739480_100016991246 [0,1,0,0,0,1|0,1,0]=3 1002 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)C)/C)C 62a_100016991246_100000739480 [0,1,0,0,0,1|0,1,0]=3 1003 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)Cl)/C)C 62a_100000211444_100016991246 [0,1,0,0,0,1|0,1,0]=3 1004 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)Cl)/C)C 62a_100016991246_100000211444 [0,1,0,0,0,1|0,1,0]=3 1005 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)F)/C)C 62a_100000215616_100016991246 [0,1,0,0,0,1|0,1,0]=3 1006 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)F)/C)C 62a_100016991246_100000215616 [0,1,0,0,0,1|0,1,0]=3 1007 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)O)/C)C 62a_100009813753_100016991246 [0,1,0,0,0,1|0,1,0]=3 1008 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1cccc(c1)O)/C)C 62a_100016991246_100009813753 [0,1,0,0,0,1|0,1,0]=3 1009 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1ccnc(c1)Cl)/C)C 62a_100009817076_100016991246 [0,1,0,0,0,1|1,1,0]=4 1010 B21R1.535023 CC(=CCC/C(=C/CSCC(=O)c1ccnc(c1)Cl)/C)C 62a_100016991246_100009817076 [0,1,0,0,0,1|1,1,0]=4 1011 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)Br)/C)C 34a_100016990311_100000212080 [0,1,0,0,0,1|0,0,0]=2 1012 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)Br)/C)C 7a_100016990311_100000212080 [0,1,0,0,0,1|0,0,0]=2 1013 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)C)/C)C 34a_100016990311_100000739480 [0,1,0,0,0,1|0,0,0]=2 1014 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)C)/C)C 7a_100016990311_100000739480 [0,1,0,0,0,1|0,0,0]=2 1015 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)Cl)/C)C 34a_100016990311_100000211444 [0,1,0,0,0,1|0,0,0]=2 1016 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)Cl)/C)C 7a_100016990311_100000211444 [0,1,0,0,0,1|0,0,0]=2 1017 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)F)/C)C 34a_100016990311_100000215616 [0,1,0,0,0,1|0,0,0]=2 1018 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)O)/C)C 34a_100016990311_100009813753 [0,1,0,0,0,1|0,0,0]=2 1019 B21R1.535023 CC(=CCC/C(=C\COCC(=O)c1cccc(c1)O)/C)C 7a_100016990311_100009813753 [0,1,0,0,0,1|0,0,0]=2 1020 B21R1.535023 CC(=CCCC(=CC=NNC(=O)c1cccc(c1)Br)C)C 4a_100000189783_100000211119 [0,1,0,0,0,1|1,0,1]=4 1021 B21R1.535023 CC(=CCCC(=CC=NNC(=O)c1cccc(c1)C)C)C 4a_100000189845_100000211119 [0,1,0,0,0,1|1,0,1]=4 1022 B21R1.535023 CC(=CCCC(=CC=NNC(=O)c1cccc(c1)Cl)C)C 4a_100000183659_100000211119 [0,1,0,0,0,1|1,0,1]=4 1023 B21R1.535023 CC(=CCCC(=CC=NNC(=O)c1cccc(c1)F)C)C 4a_100000189798_100000211119 [0,1,0,0,0,1|1,0,1]=4 1024 B21R1.535023 CC(=CCCC(=CC=NNC(=O)c1cccc(c1)I)C)C 4a_100000186306_100000211119 [0,1,0,0,0,1|1,0,1]=4 1025 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)Br)C 34a_100000017536_100000212080 [0,1,0,0,0,1|0,0,2]=4 1026 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)Br)C 7a_100000017536_100000212080 [0,1,0,0,0,1|0,0,2]=4 1027 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)C)C 34a_100000017536_100000739480 [0,1,0,0,0,1|0,0,2]=4 1028 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)C)C 7a_100000017536_100000739480 [0,1,0,0,0,1|0,0,2]=4 1029 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)Cl)C 34a_100000017536_100000211444 [0,1,0,0,0,1|0,0,2]=4 1030 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)Cl)C 7a_100000017536_100000211444 [0,1,0,0,0,1|0,0,2]=4 1031 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)Cl)C 7a_200011592804_100009814015 [0,1,0,0,0,1|0,0,2]=4 1032 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)F)C 34a_100000017536_100000215616 [0,1,0,0,0,1|0,0,2]=4 1033 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)F)C 34a_100011592800_100009814015 [0,1,0,0,0,1|0,0,2]=4 1034 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)F)C 7a_100011592800_100009814015 [0,1,0,0,0,1|0,0,2]=4 1035 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)O)C 34a_100000017536_100009813753 [0,1,0,0,0,1|0,0,2]=4 1036 B21R1.535023 CC(=CCCC(C)CCOCC(=O)c1cccc(c1)O)C 7a_100000017536_100009813753 [0,1,0,0,0,1|0,0,2]=4 1037 B21R1.34860 CC(=CCCC(=CC(=O)CC(=O)Cc1ccccc1)C)C 1458a_100016995320_100000233483 [0,1,0,0,0,1|1,0,1]=4 1038 B21R1.34860 CC(=CCCC(=CC(=O)CC(=O)Nc1ccccc1)C)C 1458a_100016995320_100000182850 [0,1,0,0,0,1|1,0,1]=4 1039 B21R1.34860 CC(=CCCC(=CC(=O)CC(=O)Oc1ccccc1)C)C 1458a_100016995320_100009813826 [0,1,0,0,0,1|1,0,1]=4 1040 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)Br)/C)C 11a_200020676162_100000198978 [0,1,0,0,0,1|1,0,0]=3 1041 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)Br)/C)C 527a_200020676162_100000198978 [0,1,0,0,0,1|1,0,0]=3 1042 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)C)/C)C 11a_200020676162_100000212244 [0,1,0,0,0,1|1,0,0]=3 1043 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)C)/C)C 527a_200020676162_100000212244 [0,1,0,0,0,1|1,0,0]=3 1044 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)Cl)/C)C 11a_200020676162_100000211027 [0,1,0,0,0,1|1,0,0]=3 1045 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)Cl)/C)C 527a_200020676162_100000211027 [0,1,0,0,0,1|1,0,0]=3 1046 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)F)/C)C 11a_200020676162_100000210951 [0,1,0,0,0,1|1,0,0]=3 1047 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)F)/C)C 1626a_200020676162_100000210951 [0,1,0,0,0,1|1,0,0]=3 1048 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)F)/C)C 527a_200020676162_100000210951 [0,1,0,0,0,1|1,0,0]=3 1049 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)I)/C)C 11a_200020676162_100000688869 [0,1,0,0,0,1|1,0,0]=3 1050 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)I)/C)C 1626a_200020676162_100000688869 [0,1,0,0,0,1|1,0,0]=3 1051 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)I)/C)C 527a_200020676162_100000688869 [0,1,0,0,0,1|1,0,0]=3 1052 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)O)/C)C 1626a_200020676162_100000198540 [0,1,0,0,0,1|1,0,0]=3 1053 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cc1)O)/C)C 527a_200020676162_100000198540 [0,1,0,0,0,1|1,0,0]=3 1054 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)Br)/C)C 11a_200020676162_100020629044 [0,1,0,0,0,1|2,0,0]=4 1055 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)C)/C)C 11a_200020676162_100025705728 [0,1,0,0,0,1|2,0,0]=4 1056 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)C)/C)C 1626a_200020676162_100025705728 [0,1,0,0,0,1|2,0,0]=4 1057 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)Cl)/C)C 11a_200020676162_100000728320 [0,1,0,0,0,1|2,0,0]=4 1058 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)Cl)/C)C 1626a_200020676162_100000728320 [0,1,0,0,0,1|2,0,0]=4 1059 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(cn1)Cl)/C)C 527a_200020676162_100000728320 [0,1,0,0,0,1|2,0,0]=4 1060 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)Br)/C)C 11a_200020676162_100010067268 [0,1,0,0,0,1|2,0,0]=4 1061 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)Br)/C)C 527a_200020676162_100010067268 [0,1,0,0,0,1|2,0,0]=4 1062 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)C)/C)C 11a_200020676162_100000740413 [0,1,0,0,0,1|2,0,0]=4 1063 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)C)/C)C 1626a_200020676162_100000740413 [0,1,0,0,0,1|2,0,0]=4 1064 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)C)/C)C 527a_200020676162_100000740413 [0,1,0,0,0,1|2,0,0]=4 1065 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)Cl)/C)C 11a_200020676162_100000061944 [0,1,0,0,0,1|2,0,0]=4 1066 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)Cl)/C)C 1626a_200020676162_100000061944 [0,1,0,0,0,1|2,0,0]=4 1067 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cc1ccc(nc1)Cl)/C)C 527a_200020676162_100000061944 [0,1,0,0,0,1|2,0,0]=4 1068 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cn1ccc(=O)cc1)/C)C 11a_200020676162_200000238563 [0,1,0,0,0,1|2,0,0]=4 1069 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cn1ccc(=O)cc1)/C)C 1626a_200020676162_200000238563 [0,1,0,0,0,1|2,0,0]=4 1070 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Cn1ccc(=O)cc1)/C)C 527a_200020676162_200000238563 [0,1,0,0,0,1|2,0,0]=4 1071 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)Br)/C)C 2430a_100000210018_200020676162 [0,1,0,0,0,1|1,0,0]=3 1072 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)C)/C)C 2430a_100000124888_200020676162 [0,1,0,0,0,1|1,0,0]=3 1073 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)Cl)/C)C 2430a_100000210052_200020676162 [0,1,0,0,0,1|1,0,0]=3 1074 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)F)/C)C 2430a_100000185862_200020676162 [0,1,0,0,0,1|1,0,0]=3 1075 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)I)/C)C 2430a_100000185761_200020676162 [0,1,0,0,0,1|1,0,0]=3 1076 B21R1.61418 CC(=CCC/C(=C/CNC(=O)Nc1ccc(cc1)O)/C)C 2430a_100000185829_200020676162 [0,1,0,0,0,1|1,0,0]=3 1077 B21R1.61418 CC(=CCC/C(=C/COC(C)Cc1ccc(cc1)F)/C)C 34a_100011351027_100016991246 [0,1,0,0,0,1|1,0,1]=4 1078 B21R1.61418 CC(=CCC/C(=C/COC(C)Cc1ccc(cc1)F)/C)C 7a_100011351027_100016991246 [0,1,0,0,0,1|1,0,1]=4 1079 B21R1.71012 CC(=CCC/C(=C/CC(=O)/C(=C/c1ccccc1)/C)/C)C 1458a_100016990649_100016991246 [0,1,0,0,0,1|2,0,0]=4 1080 B21R1.71012 CC(=CCC/C(=C/CC(=O)/C(=C/c1ccccc1)/Cl)/C)C 1458a_200020598536_100016991246 [0,1,0,0,0,1|2,0,0]=4 1081 B21R1.71012 CC(=CCC/C(=C/CC(=O)/C(=C\c1ccccc1)/F)/C)C 1458a_100020889036_100016991246 [0,1,0,0,0,1|2,0,0]=4 1082 B21R1.71012 CC(=CCC/C(=C/CC(=O)C(=O)Nc1ccccc1)/C)C 1458a_100000738435_100016991246 [0,1,0,0,0,1|1,0,0]=3 1083 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1Br)/C)C 11a_200020676162_100000751119 [0,1,0,0,0,1|1,0,0]=3 1084 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1Br)/C)C 527a_200020676162_100000751119 [0,1,0,0,0,1|1,0,0]=3 1085 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1C)/C)C 11a_200020676162_100000212180 [0,1,0,0,0,1|1,0,0]=3 1086 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1C)/C)C 1626a_200020676162_100000212180 [0,1,0,0,0,1|1,0,0]=3 1087 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1C)/C)C 527a_200020676162_100000212180 [0,1,0,0,0,1|1,0,0]=3 1088 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1Cl)/C)C 11a_200020676162_100000183793 [0,1,0,0,0,1|1,0,0]=3 1089 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1Cl)/C)C 1626a_200020676162_100000183793 [0,1,0,0,0,1|1,0,0]=3 1090 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1Cl)/C)C 527a_200020676162_100000183793 [0,1,0,0,0,1|1,0,0]=3 1091 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1F)/C)C 11a_200020676162_100000212012 [0,1,0,0,0,1|1,0,0]=3 1092 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1F)/C)C 1626a_200020676162_100000212012 [0,1,0,0,0,1|1,0,0]=3 1093 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1F)/C)C 527a_200020676162_100000212012 [0,1,0,0,0,1|1,0,0]=3 1094 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1I)/C)C 11a_200020676162_100000036491 [0,1,0,0,0,1|1,0,0]=3 1095 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1I)/C)C 1626a_200020676162_100000036491 [0,1,0,0,0,1|1,0,0]=3 1096 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1I)/C)C 527a_200020676162_100000036491 [0,1,0,0,0,1|1,0,0]=3 1097 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ccccc1O)/C)C 527a_200020676162_100000743006 [0,1,0,0,0,1|1,0,0]=3 1098 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1cccnc1Cl)/C)C 11a_200020676162_100000093521 [0,1,0,0,0,1|2,0,0]=4 1099 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1cccnc1Cl)/C)C 1626a_200020676162_100000093521 [0,1,0,0,0,1|2,0,0]=4 1100 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1cccnc1Cl)/C)C 527a_200020676162_100000093521 [0,1,0,0,0,1|2,0,0]=4 1101 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ncccc1Br)/C)C 11a_200020676162_200012357574 [0,1,0,0,0,1|2,0,0]=4 1102 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ncccc1C)/C)C 11a_200020676162_200000722269 [0,1,0,0,0,1|2,0,0]=4 1103 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ncccc1C)/C)C 1626a_200020676162_200000722269 [0,1,0,0,0,1|2,0,0]=4 1104 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ncccc1Cl)/C)C 11a_200020676162_100011998755 [0,1,0,0,0,1|2,0,0]=4 1105 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cc1ncccc1Cl)/C)C 527a_200020676162_100011998755 [0,1,0,0,0,1|2,0,0]=4 1106 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cn1ccccc1=O)/C)C 1626a_200020676162_100000189665 [0,1,0,0,0,1|2,0,0]=4 1107 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Cn1ccccc1=O)/C)C 527a_200020676162_100000189665 [0,1,0,0,0,1|2,0,0]=4 1108 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1Br)/C)C 2430a_100000210017_200020676162 [0,1,0,0,0,1|1,0,0]=3 1109 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1C)/C)C 2430a_100015192222_200020676162 [0,1,0,0,0,1|1,0,0]=3 1110 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1Cl)/C)C 2430a_100000185783_200020676162 [0,1,0,0,0,1|1,0,0]=3 1111 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1F)/C)C 2430a_100000210422_200020676162 [0,1,0,0,0,1|1,0,0]=3 1112 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1I)/C)C 2430a_100000210053_200020676162 [0,1,0,0,0,1|1,0,0]=3 1113 B21R1.306653 CC(=CCC/C(=C/CNC(=O)Nc1ccccc1O)/C)C 2430a_100000185747_200020676162 [0,1,0,0,0,1|1,0,0]=3 1114 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)Br)/C)C 11a_200020676162_100000747190 [0,1,0,0,0,1|1,0,0]=3 1115 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)Br)/C)C 527a_200020676162_100000747190 [0,1,0,0,0,1|1,0,0]=3 1116 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)C)/C)C 11a_200020676162_100011206899 [0,1,0,0,0,1|1,0,0]=3 1117 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)C)/C)C 1626a_200020676162_100011206899 [0,1,0,0,0,1|1,0,0]=3 1118 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)C)/C)C 527a_200020676162_100011206899 [0,1,0,0,0,1|1,0,0]=3 1119 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)Cl)/C)C 11a_200020676162_100000749307 [0,1,0,0,0,1|1,0,0]=3 1120 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)Cl)/C)C 1626a_200020676162_100000749307 [0,1,0,0,0,1|1,0,0]=3 1121 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)Cl)/C)C 527a_200020676162_100000749307 [0,1,0,0,0,1|1,0,0]=3 1122 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)F)/C)C 11a_200020676162_100000211661 [0,1,0,0,0,1|1,0,0]=3 1123 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)F)/C)C 1626a_200020676162_100000211661 [0,1,0,0,0,1|1,0,0]=3 1124 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)F)/C)C 527a_200020676162_100000211661 [0,1,0,0,0,1|1,0,0]=3 1125 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)I)/C)C 11a_200020676162_100000238430 [0,1,0,0,0,1|1,0,0]=3 1126 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)I)/C)C 1626a_200020676162_100000238430 [0,1,0,0,0,1|1,0,0]=3 1127 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)I)/C)C 527a_200020676162_100000238430 [0,1,0,0,0,1|1,0,0]=3 1128 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(c1)O)/C)C 527a_200020676162_100000745134 [0,1,0,0,0,1|1,0,0]=3 1129 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)Br)/C)C 11a_200020676162_100010201708 [0,1,0,0,0,1|2,0,0]=4 1130 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)Br)/C)C 527a_200020676162_100010201708 [0,1,0,0,0,1|2,0,0]=4 1131 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)C)/C)C 11a_200020676162_100012001110 [0,1,0,0,0,1|2,0,0]=4 1132 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)C)/C)C 1626a_200020676162_100012001110 [0,1,0,0,0,1|2,0,0]=4 1133 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)C)/C)C 527a_200020676162_100012001110 [0,1,0,0,0,1|2,0,0]=4 1134 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)Cl)/C)C 11a_200020676162_100000090259 [0,1,0,0,0,1|2,0,0]=4 1135 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)Cl)/C)C 1626a_200020676162_100000090259 [0,1,0,0,0,1|2,0,0]=4 1136 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)F)/C)C 11a_200020676162_100000096803 [0,1,0,0,0,1|2,0,0]=4 1137 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cccc(n1)F)/C)C 1626a_200020676162_100000096803 [0,1,0,0,0,1|2,0,0]=4 1138 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1ccnc(c1)Br)/C)C 11a_200020676162_100010126891 [0,1,0,0,0,1|2,0,0]=4 1139 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1ccnc(c1)Br)/C)C 527a_200020676162_100010126891 [0,1,0,0,0,1|2,0,0]=4 1140 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1ccnc(c1)Cl)/C)C 11a_200020676162_100000085289 [0,1,0,0,0,1|2,0,0]=4 1141 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1ccnc(c1)Cl)/C)C 1626a_200020676162_100000085289 [0,1,0,0,0,1|2,0,0]=4 1142 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1ccnc(c1)Cl)/C)C 527a_200020676162_100000085289 [0,1,0,0,0,1|2,0,0]=4 1143 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cncc(c1)Br)/C)C 11a_200020676162_100000239331 [0,1,0,0,0,1|2,0,0]=4 1144 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cncc(c1)Br)/C)C 527a_200020676162_100000239331 [0,1,0,0,0,1|2,0,0]=4 1145 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cncc(c1)F)/C)C 11a_200020676162_100011667516 [0,1,0,0,0,1|2,0,0]=4 1146 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Cc1cncc(c1)F)/C)C 527a_200020676162_100011667516 [0,1,0,0,0,1|2,0,0]=4 1147 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)Br)/C)C 2430a_100000210019_200020676162 [0,1,0,0,0,1|1,0,0]=3 1148 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)Br)/C)C 512a_100000210019_200020676162 [0,1,0,0,0,1|1,0,0]=3 1149 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)C)/C)C 2430a_100000188690_200020676162 [0,1,0,0,0,1|1,0,0]=3 1150 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)C)/C)C 512a_100000188690_200020676162 [0,1,0,0,0,1|1,0,0]=3 1151 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)Cl)/C)C 2430a_100000185859_200020676162 [0,1,0,0,0,1|1,0,0]=3 1152 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)F)/C)C 2430a_100000210047_200020676162 [0,1,0,0,0,1|1,0,0]=3 1153 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)F)/C)C 512a_100000210047_200020676162 [0,1,0,0,0,1|1,0,0]=3 1154 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)I)/C)C 2430a_100000211102_200020676162 [0,1,0,0,0,1|1,0,0]=3 1155 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)I)/C)C 512a_100000211102_200020676162 [0,1,0,0,0,1|1,0,0]=3 1156 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)O)/C)C 2430a_100000210217_200020676162 [0,1,0,0,0,1|1,0,0]=3 1157 B21R1.536200 CC(=CCC/C(=C/CNC(=O)Nc1cccc(c1)O)/C)C 512a_100000210217_200020676162 [0,1,0,0,0,1|1,0,0]=3 1158 B21R1.608534 CC(=CCC/C(=C/CNS(=O)(=O)Cc1ccccc1)/C)C 270084a_200020676162_100000211737 [0,1,0,0,0,1|2,0,0]=4 1159 B21R1.608534 CC(=CCC/C(=C/CNS(=O)(=O)Cc1ccccc1)/C)C 274078a_200020676162_100000211737 [0,1,0,0,0,1|2,0,0]=4 1160 B21R1.608534 CC(=CCC/C(=C/CNS(=O)(=O)Cc1ccccc1)/C)C 40a_200020676162_100000235865 [0,1,0,0,0,1|2,0,0]=4 1161 B21R1.608534 CC(=CCC/C(=C/COC(C)(C)Cc1ccccc1)/C)C 7a_100011215222_100016991246 [0,1,0,0,0,1|1,0,1]=4 1162 B21R1.608534 CC(=CCC/C(=C\COC(F)(F)Oc1ccccc1)/C)C 7a_100016990311_200000057402 [0,1,0,0,0,1|1,0,1]=4 1163 B21R1.1325279 C#CC(Cc1ccccc1)OC/C=C(\C)/CCC=C(C)C 34a_100000685211_100016991246 [0,1,0,0,0,1|1,0,1]=4 1164 B21R1.1325279 C#CC(Cc1ccccc1)OC/C=C(\C)/CCC=C(C)C 7a_100000685211_100016991246 [0,1,0,0,0,1|1,0,1]=4 1165 B21R1.1325279 CC(=CCC/C(=C/COC(CN)Cc1ccccc1)/C)C 34a_100000752270_100016991246 [0,1,0,0,0,1|1,0,1]=4 1166 B21R1.1325279 CC(=CCC/C(=C/CO[C@H](CCl)Cc1ccccc1)/C)C 7a_100000729385_100016991246 [0,1,0,0,0,1|1,0,1]=4 1167 B21R1.1325279 CC(=CCC/C(=C\COC(C#N)Cc1ccccc1)/C)C 7a_100016990311_100000183401 [0,1,0,0,0,1|1,0,1]=4 1168 B21R1.1325279 CCC(Cc1ccccc1)OC/C=C(\C)/CCC=C(C)C 7a_100000760156_100016991246 [0,1,0,0,0,1|1,0,1]=4 1169 B21R1.3889456 C#CC(C)(CCC=C(C)C)OCOC(=O)c1ccccc1 7a_100102524899_100000073877 [0,2,0,0,0,0|1,0,1]=4 1170 B21R1.3889456 C=CC(C)(CCC=C(C)C)OCOC(=O)c1ccccc1 7a_100000033386_100000073877 [0,2,0,0,0,0|1,0,1]=4 1171 B21R1.3889456 CCC(C)(CCC=C(C)C)OCOC(=O)c1ccccc1 7a_100000035081_100000073877 [0,2,0,0,0,0|1,0,1]=4 1172 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Br)/C)C 270084a_200020676162_100000182491 [0,2,0,0,0,0|2,0,0]=4 1173 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Br)/C)C 274078a_200020676162_100000182491 [0,2,0,0,0,0|2,0,0]=4 1174 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Br)/C)C 40a_200020676162_100010306709 [0,2,0,0,0,0|2,0,0]=4 1175 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)C)/C)C 270084a_200020676162_100000211267 [0,2,0,0,0,0|2,0,0]=4 1176 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)C)/C)C 274078a_200020676162_100000211267 [0,2,0,0,0,0|2,0,0]=4 1177 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)C)/C)C 40a_200020676162_100000039673 [0,2,0,0,0,0|2,0,0]=4 1178 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Cl)/C)C 270084a_200020676162_100000209962 [0,2,0,0,0,0|2,0,0]=4 1179 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Cl)/C)C 274078a_200020676162_100000209962 [0,2,0,0,0,0|2,0,0]=4 1180 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)Cl)/C)C 40a_200020676162_100000077732 [0,2,0,0,0,0|2,0,0]=4 1181 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)F)/C)C 270084a_200020676162_100000184267 [0,2,0,0,0,0|2,0,0]=4 1182 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)F)/C)C 274078a_200020676162_100000184267 [0,2,0,0,0,0|2,0,0]=4 1183 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)F)/C)C 40a_200020676162_100000081159 [0,2,0,0,0,0|2,0,0]=4 1184 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)I)/C)C 270084a_200020676162_100011205396 [0,2,0,0,0,0|2,0,0]=4 1185 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)I)/C)C 274078a_200020676162_100011205396 [0,2,0,0,0,0|2,0,0]=4 1186 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)N)/C)C 40a_200020676162_100000054796 [0,2,0,0,0,0|2,0,0]=4 1187 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)O)/C)C 270084a_200020676162_100020667864 [0,2,0,0,0,0|2,0,0]=4 1188 B21R1.60908 CC(=CCC/C(=C/CNS(=O)(=O)c1ccc(cc1)O)/C)C 274078a_200020676162_100020667864 [0,2,0,0,0,0|2,0,0]=4 1189 B21R1.60908 CC(=CCC/C(=C/COC(C)(C)c1ccc(cc1)C)/C)C 34a_200011345916_100016991246 [0,2,0,0,0,0|1,0,1]=4 1190 B21R1.60908 CC(=CCC/C(=C/COC(C)(C)c1ccc(cc1)C)/C)C 7a_200011345916_100016991246 [0,2,0,0,0,0|1,0,1]=4 1191 B21R1.60908 CC(=CCC/C(=C/COC(C)(C)c1ccc(cc1)F)/C)C 34a_100011219992_100016991246 [0,2,0,0,0,0|1,0,1]=4 1192 B21R1.60908 CC(=CCC/C(=C/COC(C)(C)c1ccc(cc1)F)/C)C 7a_100011219992_100016991246 [0,2,0,0,0,0|1,0,1]=4 1193 B21R1.204620 C#CC(C)(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 34a_100000198054_100016991246 [0,2,0,0,0,0|1,0,1]=4 1194 B21R1.204620 C#CC(C)(OC/C=C(\C)/CCC=C(C)C)c1ccccc1 7a_100000198054_100016991246 [0,2,0,0,0,0|1,0,1]=4 1195 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1Br)/C)C 270084a_200020676162_100000184729 [0,2,0,0,0,0|2,0,0]=4 1196 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1Br)/C)C 274078a_200020676162_100000184729 [0,2,0,0,0,0|2,0,0]=4 1197 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1Br)/C)C 40a_200020676162_100010380725 [0,2,0,0,0,0|2,0,0]=4 1198 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1C)/C)C 270084a_200020676162_100000750907 [0,2,0,0,0,0|2,0,0]=4 1199 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1C)/C)C 274078a_200020676162_100000750907 [0,2,0,0,0,0|2,0,0]=4 1200 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1C)/C)C 40a_200020676162_100010269479 [0,2,0,0,0,0|2,0,0]=4 1201 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1Cl)/C)C 270084a_200020676162_100000184199 [0,2,0,0,0,0|2,0,0]=4 1202 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1Cl)/C)C 274078a_200020676162_100000184199 [0,2,0,0,0,0|2,0,0]=4 1203 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1F)/C)C 270084a_200020676162_100000184916 [0,2,0,0,0,0|2,0,0]=4 1204 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1F)/C)C 274078a_200020676162_100000184916 [0,2,0,0,0,0|2,0,0]=4 1205 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1I)/C)C 270084a_200020676162_100011191325 [0,2,0,0,0,0|2,0,0]=4 1206 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1I)/C)C 274078a_200020676162_100011191325 [0,2,0,0,0,0|2,0,0]=4 1207 B21R1.307193 CC(=CCC/C(=C/CNS(=O)(=O)c1ccccc1N)/C)C 40a_200020676162_100000703237 [0,2,0,0,0,0|2,0,0]=4 1208 B21R1.307193 CC(=CCC/C(=C/COC(C)(C)c1ccccc1F)/C)C 34a_100011345963_100016991246 [0,2,0,0,0,0|1,0,1]=4 1209 B21R1.307193 CC(=CCC/C(=C/COC(C)(C)c1ccccc1F)/C)C 7a_100011345963_100016991246 [0,2,0,0,0,0|1,0,1]=4 1210 B21R1.307193 CC(=CCC/C(=C/COC(C)(C)c1ccccc1N)/C)C 7a_100000081495_100016991246 [0,2,0,0,0,0|1,0,1]=4 1211 B21R1.307193 CC(=CCC/C(=C\COC(F)(F)c1ccccc1F)/C)C 34a_100016990311_100000070671 [0,2,0,0,0,0|1,0,1]=4 1212 B21R1.307193 CC(=CCC/C(=C\COC(F)(F)c1ccccc1F)/C)C 7a_100016990311_100000070671 [0,2,0,0,0,0|1,0,1]=4 1213 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)Br)/C)C 270084a_200020676162_100000184224 [0,2,0,0,0,0|2,0,0]=4 1214 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)Br)/C)C 274078a_200020676162_100000184224 [0,2,0,0,0,0|2,0,0]=4 1215 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)Br)/C)C 40a_200020676162_100010340488 [0,2,0,0,0,0|2,0,0]=4 1216 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)C)/C)C 270084a_200020676162_100000182797 [0,2,0,0,0,0|2,0,0]=4 1217 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)C)/C)C 274078a_200020676162_100000182797 [0,2,0,0,0,0|2,0,0]=4 1218 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)C)/C)C 40a_200020676162_100010983817 [0,2,0,0,0,0|2,0,0]=4 1219 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)Cl)/C)C 270084a_200020676162_100000182923 [0,2,0,0,0,0|2,0,0]=4 1220 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)Cl)/C)C 274078a_200020676162_100000182923 [0,2,0,0,0,0|2,0,0]=4 1221 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)F)/C)C 270084a_200020676162_100000184201 [0,2,0,0,0,0|2,0,0]=4 1222 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)F)/C)C 274078a_200020676162_100000184201 [0,2,0,0,0,0|2,0,0]=4 1223 B21R1.535614 CC(=CCC/C(=C/CNS(=O)(=O)c1cccc(c1)N)/C)C 40a_200020676162_100000034547 [0,2,0,0,0,0|2,0,0]=4 1224 B21R1.535614 CC(=CCC/C(=C/COC(C)(C)c1cccc(c1)F)/C)C 34a_200011345953_100016991246 [0,2,0,0,0,0|1,0,1]=4 1225 B21R1.535614 CC(=CCC/C(=C/COC(C)(C)c1cccc(c1)F)/C)C 7a_200011345953_100016991246 [0,2,0,0,0,0|1,0,1]=4 1226 B21R1.16623 C#Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100011217615 [0,2,0,0,0,0|1,0,0]=3 1227 B21R1.16623 C#Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011217615 [0,2,0,0,0,0|1,0,0]=3 1228 B21R1.16623 C#Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011217615 [0,2,0,0,0,0|1,0,0]=3 1229 B21R1.16623 C=Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000687532 [0,2,0,0,0,0|1,0,0]=3 1230 B21R1.16623 C=Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000687532 [0,2,0,0,0,0|1,0,0]=3 1231 B21R1.16623 C=Cc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000687532 [0,2,0,0,0,0|1,0,0]=3 1232 B21R1.16623 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C#N)/C)C 11a_200020676162_100000210717 [0,2,0,0,0,0|1,0,0]=3 1233 B21R1.16623 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C#N)/C)C 1626a_200020676162_100000210717 [0,2,0,0,0,0|1,0,0]=3 1234 B21R1.16623 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)C#N)/C)C 527a_200020676162_100000210717 [0,2,0,0,0,0|1,0,0]=3 1235 B21R1.16623 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1)CO)/C)C 1626a_200020676162_100000183892 [0,2,0,0,0,0|1,0,0]=3 1236 B21R1.16623 CC(=CCC/C(=C/COC(C)c1ccc(cc1)CN)/C)C 34a_200000048501_100016991246 [0,2,0,0,0,0|1,0,1]=4 1237 B21R1.16623 CC(=CCC/C(=C/CO[C@@H](C)c1ccc(cc1)C#N)/C)C 34a_100011852132_100016991246 [0,2,0,0,0,0|1,0,1]=4 1238 B21R1.16623 CC(=CCC/C(=C/CO[C@@H](C)c1ccc(cc1)C#N)/C)C 7a_100011852132_100016991246 [0,2,0,0,0,0|1,0,1]=4 1239 B21R1.16623 CCc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000211226 [0,2,0,0,0,0|1,0,0]=3 1240 B21R1.16623 CCc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000211226 [0,2,0,0,0,0|1,0,0]=3 1241 B21R1.16623 CCc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000211226 [0,2,0,0,0,0|1,0,0]=3 1242 B21R1.16623 COc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000184203 [0,2,0,0,0,0|1,0,0]=3 1243 B21R1.16623 COc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000184203 [0,2,0,0,0,0|1,0,0]=3 1244 B21R1.16623 COc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000184203 [0,2,0,0,0,0|1,0,0]=3 1245 B21R1.16623 COc1ccc(cc1)C(C)OC/C=C(\C)/CCC=C(C)C 34a_100000742907_100016991246 [0,2,0,0,0,0|1,0,1]=4 1246 B21R1.16623 COc1ccc(cc1)C(C)OC/C=C(\C)/CCC=C(C)C 7a_100000742907_100016991246 [0,2,0,0,0,0|1,0,1]=4 1247 B21R1.16623 CSc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000189692 [0,2,0,0,0,0|1,0,0]=3 1248 B21R1.16623 CSc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000189692 [0,2,0,0,0,0|1,0,0]=3 1249 B21R1.16623 CSc1ccc(cc1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000189692 [0,2,0,0,0,0|1,0,0]=3 1250 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)Br)C)C 1458a_100016995320_100000188085 [0,2,0,0,0,0|1,0,1]=4 1251 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)C)C)C 1458a_100016995320_100000211441 [0,2,0,0,0,0|1,0,1]=4 1252 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)Cl)C)C 1458a_100016995320_100000211071 [0,2,0,0,0,0|1,0,1]=4 1253 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)F)C)C 1458a_100016995320_100000211279 [0,2,0,0,0,0|1,0,1]=4 1254 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)I)C)C 1458a_100016995320_100011216261 [0,2,0,0,0,0|1,0,1]=4 1255 B21R1.60509 CC(=CCCC(=CC(=O)CC(=O)c1ccc(cc1)O)C)C 1458a_100016995320_100009814261 [0,2,0,0,0,0|1,0,1]=4 1256 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Br)/C)C 11a_200020676162_100012339404 [0,2,0,0,0,0|1,0,0]=3 1257 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Br)/C)C 1626a_200020676162_100012339404 [0,2,0,0,0,0|1,0,0]=3 1258 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Br)/C)C 527a_200020676162_100012339404 [0,2,0,0,0,0|1,0,0]=3 1259 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)C)/C)C 11a_200020676162_100000186397 [0,2,0,0,0,0|1,0,0]=3 1260 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)C)/C)C 1626a_200020676162_100000186397 [0,2,0,0,0,0|1,0,0]=3 1261 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)C)/C)C 527a_200020676162_100000186397 [0,2,0,0,0,0|1,0,0]=3 1262 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Cl)/C)C 11a_200020676162_100000691181 [0,2,0,0,0,0|1,0,0]=3 1263 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Cl)/C)C 1626a_200020676162_100000691181 [0,2,0,0,0,0|1,0,0]=3 1264 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)Cl)/C)C 527a_200020676162_100000691181 [0,2,0,0,0,0|1,0,0]=3 1265 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)F)/C)C 11a_200020676162_100000760357 [0,2,0,0,0,0|1,0,0]=3 1266 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)F)/C)C 1626a_200020676162_100000760357 [0,2,0,0,0,0|1,0,0]=3 1267 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)F)/C)C 527a_200020676162_100000760357 [0,2,0,0,0,0|1,0,0]=3 1268 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)I)/C)C 11a_200020676162_100000739115 [0,2,0,0,0,0|1,0,0]=3 1269 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)I)/C)C 1626a_200020676162_100000739115 [0,2,0,0,0,0|1,0,0]=3 1270 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Br)I)/C)C 527a_200020676162_100000739115 [0,2,0,0,0,0|1,0,0]=3 1271 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Br)/C)C 11a_200020676162_100000692631 [0,2,0,0,0,0|1,0,0]=3 1272 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Br)/C)C 1626a_200020676162_100000692631 [0,2,0,0,0,0|1,0,0]=3 1273 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Br)/C)C 527a_200020676162_100000692631 [0,2,0,0,0,0|1,0,0]=3 1274 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)C)/C)C 11a_200020676162_100000210898 [0,2,0,0,0,0|1,0,0]=3 1275 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)C)/C)C 1626a_200020676162_100000210898 [0,2,0,0,0,0|1,0,0]=3 1276 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)C)/C)C 527a_200020676162_100000210898 [0,2,0,0,0,0|1,0,0]=3 1277 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Cl)/C)C 11a_200020676162_100000686306 [0,2,0,0,0,0|1,0,0]=3 1278 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Cl)/C)C 1626a_200020676162_100000686306 [0,2,0,0,0,0|1,0,0]=3 1279 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)Cl)/C)C 527a_200020676162_100000686306 [0,2,0,0,0,0|1,0,0]=3 1280 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)F)/C)C 11a_200020676162_100000751819 [0,2,0,0,0,0|1,0,0]=3 1281 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)F)/C)C 1626a_200020676162_100000751819 [0,2,0,0,0,0|1,0,0]=3 1282 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)F)/C)C 527a_200020676162_100000751819 [0,2,0,0,0,0|1,0,0]=3 1283 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)I)/C)C 11a_200020676162_100000751300 [0,2,0,0,0,0|1,0,0]=3 1284 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)I)/C)C 1626a_200020676162_100000751300 [0,2,0,0,0,0|1,0,0]=3 1285 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)C)I)/C)C 527a_200020676162_100000751300 [0,2,0,0,0,0|1,0,0]=3 1286 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Br)/C)C 11a_200020676162_100000687082 [0,2,0,0,0,0|1,0,0]=3 1287 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Br)/C)C 1626a_200020676162_100000687082 [0,2,0,0,0,0|1,0,0]=3 1288 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Br)/C)C 527a_200020676162_100000687082 [0,2,0,0,0,0|1,0,0]=3 1289 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)C)/C)C 11a_200020676162_100000751740 [0,2,0,0,0,0|1,0,0]=3 1290 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)C)/C)C 1626a_200020676162_100000751740 [0,2,0,0,0,0|1,0,0]=3 1291 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)C)/C)C 527a_200020676162_100000751740 [0,2,0,0,0,0|1,0,0]=3 1292 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Cl)/C)C 11a_200020676162_100000210401 [0,2,0,0,0,0|1,0,0]=3 1293 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Cl)/C)C 1626a_200020676162_100000210401 [0,2,0,0,0,0|1,0,0]=3 1294 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)Cl)/C)C 527a_200020676162_100000210401 [0,2,0,0,0,0|1,0,0]=3 1295 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)F)/C)C 11a_200020676162_100000686462 [0,2,0,0,0,0|1,0,0]=3 1296 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)F)/C)C 1626a_200020676162_100000686462 [0,2,0,0,0,0|1,0,0]=3 1297 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)F)/C)C 527a_200020676162_100000686462 [0,2,0,0,0,0|1,0,0]=3 1298 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)I)/C)C 11a_200020676162_100000684831 [0,2,0,0,0,0|1,0,0]=3 1299 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)I)/C)C 1626a_200020676162_100000684831 [0,2,0,0,0,0|1,0,0]=3 1300 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)I)/C)C 527a_200020676162_100000684831 [0,2,0,0,0,0|1,0,0]=3 1301 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)Cl)O)/C)C 527a_200020676162_100000212196 [0,2,0,0,0,0|1,0,0]=3 1302 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Br)/C)C 11a_200020676162_100000743946 [0,2,0,0,0,0|1,0,0]=3 1303 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Br)/C)C 1626a_200020676162_100000743946 [0,2,0,0,0,0|1,0,0]=3 1304 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Br)/C)C 527a_200020676162_100000743946 [0,2,0,0,0,0|1,0,0]=3 1305 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)C)/C)C 11a_200020676162_100000212313 [0,2,0,0,0,0|1,0,0]=3 1306 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)C)/C)C 1626a_200020676162_100000212313 [0,2,0,0,0,0|1,0,0]=3 1307 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)C)/C)C 527a_200020676162_100000212313 [0,2,0,0,0,0|1,0,0]=3 1308 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Cl)/C)C 11a_200020676162_100000743183 [0,2,0,0,0,0|1,0,0]=3 1309 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Cl)/C)C 1626a_200020676162_100000743183 [0,2,0,0,0,0|1,0,0]=3 1310 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)Cl)/C)C 527a_200020676162_100000743183 [0,2,0,0,0,0|1,0,0]=3 1311 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)F)/C)C 11a_200020676162_100000209822 [0,2,0,0,0,0|1,0,0]=3 1312 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)F)/C)C 1626a_200020676162_100000209822 [0,2,0,0,0,0|1,0,0]=3 1313 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)F)/C)C 527a_200020676162_100000209822 [0,2,0,0,0,0|1,0,0]=3 1314 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)I)/C)C 11a_200020676162_100000062624 [0,2,0,0,0,0|1,0,0]=3 1315 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)I)/C)C 1626a_200020676162_100000062624 [0,2,0,0,0,0|1,0,0]=3 1316 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)I)/C)C 527a_200020676162_100000062624 [0,2,0,0,0,0|1,0,0]=3 1317 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)F)O)/C)C 527a_200020676162_100000185466 [0,2,0,0,0,0|1,0,0]=3 1318 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Br)/C)C 11a_200020676162_100012343876 [0,2,0,0,0,0|1,0,0]=3 1319 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Br)/C)C 1626a_200020676162_100012343876 [0,2,0,0,0,0|1,0,0]=3 1320 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Br)/C)C 527a_200020676162_100012343876 [0,2,0,0,0,0|1,0,0]=3 1321 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)C)/C)C 11a_200020676162_100000751299 [0,2,0,0,0,0|1,0,0]=3 1322 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)C)/C)C 1626a_200020676162_100000751299 [0,2,0,0,0,0|1,0,0]=3 1323 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)C)/C)C 527a_200020676162_100000751299 [0,2,0,0,0,0|1,0,0]=3 1324 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Cl)/C)C 11a_200020676162_100000739381 [0,2,0,0,0,0|1,0,0]=3 1325 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Cl)/C)C 1626a_200020676162_100000739381 [0,2,0,0,0,0|1,0,0]=3 1326 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)Cl)/C)C 527a_200020676162_100000739381 [0,2,0,0,0,0|1,0,0]=3 1327 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)F)/C)C 11a_200020676162_100000688015 [0,2,0,0,0,0|1,0,0]=3 1328 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)F)/C)C 1626a_200020676162_100000688015 [0,2,0,0,0,0|1,0,0]=3 1329 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)F)/C)C 527a_200020676162_100000688015 [0,2,0,0,0,0|1,0,0]=3 1330 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)I)/C)C 11a_200020676162_100000725830 [0,2,0,0,0,0|1,0,0]=3 1331 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)I)/C)C 1626a_200020676162_100000725830 [0,2,0,0,0,0|1,0,0]=3 1332 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)I)/C)C 527a_200020676162_100000725830 [0,2,0,0,0,0|1,0,0]=3 1333 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)I)O)/C)C 1626a_200020676162_100000037485 [0,2,0,0,0,0|1,0,0]=3 1334 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)O)Br)/C)C 527a_200020676162_100000689001 [0,2,0,0,0,0|1,0,0]=3 1335 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)O)Cl)/C)C 527a_200020676162_100011933997 [0,2,0,0,0,0|1,0,0]=3 1336 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)O)F)/C)C 527a_200020676162_100000035894 [0,2,0,0,0,0|1,0,0]=3 1337 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)O)I)/C)C 1626a_200020676162_100000239334 [0,2,0,0,0,0|1,0,0]=3 1338 B21R1.61995 CC(=CCC/C(=C/CNC(=O)c1ccc(c(c1)O)I)/C)C 527a_200020676162_100000239334 [0,2,0,0,0,0|1,0,0]=3 1339 B21R1.61995 CC(=CCC/C(=C/COC(C)c1ccc(c(c1)F)F)/C)C 34a_100000246517_100016991246 [0,2,0,0,0,0|1,0,1]=4 1340 B21R1.61995 CC(=CCC/C(=C/COC(C)c1ccc(c(c1)F)F)/C)C 7a_100000246517_100016991246 [0,2,0,0,0,0|1,0,1]=4 1341 B21R1.94366 C#CC(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)Cl 34a_100011470666_100016991246 [0,2,0,0,0,0|1,0,1]=4 1342 B21R1.94366 C#CC(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)Cl 7a_100011470666_100016991246 [0,2,0,0,0,0|1,0,1]=4 1343 B21R1.94366 CC(=CCC/C(=C/COC(CN)c1ccc(cc1)Br)/C)C 34a_100020626992_100016991246 [0,2,0,0,0,0|1,0,1]=4 1344 B21R1.94366 CC(=CCC/C(=C/COC(CN)c1ccc(cc1)Cl)/C)C 34a_100000736658_100016991246 [0,2,0,0,0,0|1,0,1]=4 1345 B21R1.94366 CC(=CCC/C(=C/CO[C@@H](C#N)c1ccc(cc1)C)/C)C 34a_200009814964_100016991246 [0,2,0,0,0,0|1,0,1]=4 1346 B21R1.94366 CC(=CCC/C(=C/CO[C@@H](C#N)c1ccc(cc1)C)/C)C 7a_200009814964_100016991246 [0,2,0,0,0,0|1,0,1]=4 1347 B21R1.94366 CC(=CCC/C(=C/CO[C@@H](CCl)c1ccc(cc1)F)/C)C 34a_100000720402_100016991246 [0,2,0,0,0,0|1,0,1]=4 1348 B21R1.94366 CC(=CCC/C(=C/CO[C@@H](CCl)c1ccc(cc1)F)/C)C 7a_100000720402_100016991246 [0,2,0,0,0,0|1,0,1]=4 1349 B21R1.94366 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)F 34a_100000246474_100016991246 [0,2,0,0,0,0|1,0,1]=4 1350 B21R1.94366 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccc(cc1)F 7a_100000246474_100016991246 [0,2,0,0,0,0|1,0,1]=4 1351 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Br)/C)C 11a_200020676162_100000762965 [0,2,0,0,0,0|1,0,0]=3 1352 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Br)/C)C 1626a_200020676162_100000762965 [0,2,0,0,0,0|1,0,0]=3 1353 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Br)/C)C 527a_200020676162_100000762965 [0,2,0,0,0,0|1,0,0]=3 1354 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)C)/C)C 11a_200020676162_100000685072 [0,2,0,0,0,0|1,0,0]=3 1355 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)C)/C)C 1626a_200020676162_100000685072 [0,2,0,0,0,0|1,0,0]=3 1356 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)C)/C)C 527a_200020676162_100000685072 [0,2,0,0,0,0|1,0,0]=3 1357 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Cl)/C)C 11a_200020676162_100000766353 [0,2,0,0,0,0|1,0,0]=3 1358 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Cl)/C)C 1626a_200020676162_100000766353 [0,2,0,0,0,0|1,0,0]=3 1359 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)Cl)/C)C 527a_200020676162_100000766353 [0,2,0,0,0,0|1,0,0]=3 1360 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)F)/C)C 11a_200020676162_100000212304 [0,2,0,0,0,0|1,0,0]=3 1361 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)F)/C)C 1626a_200020676162_100000212304 [0,2,0,0,0,0|1,0,0]=3 1362 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)F)/C)C 527a_200020676162_100000212304 [0,2,0,0,0,0|1,0,0]=3 1363 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)I)/C)C 11a_200020676162_100012360512 [0,2,0,0,0,0|1,0,0]=3 1364 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)I)/C)C 1626a_200020676162_100012360512 [0,2,0,0,0,0|1,0,0]=3 1365 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)I)/C)C 527a_200020676162_100012360512 [0,2,0,0,0,0|1,0,0]=3 1366 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Br)O)/C)C 527a_200020676162_100012344906 [0,2,0,0,0,0|1,0,0]=3 1367 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Br)/C)C 11a_200020676162_100000741311 [0,2,0,0,0,0|1,0,0]=3 1368 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Br)/C)C 1626a_200020676162_100000741311 [0,2,0,0,0,0|1,0,0]=3 1369 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Br)/C)C 527a_200020676162_100000741311 [0,2,0,0,0,0|1,0,0]=3 1370 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)C)/C)C 11a_200020676162_100000211164 [0,2,0,0,0,0|1,0,0]=3 1371 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)C)/C)C 1626a_200020676162_100000211164 [0,2,0,0,0,0|1,0,0]=3 1372 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)C)/C)C 527a_200020676162_100000211164 [0,2,0,0,0,0|1,0,0]=3 1373 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Cl)/C)C 11a_200020676162_100000688705 [0,2,0,0,0,0|1,0,0]=3 1374 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Cl)/C)C 1626a_200020676162_100000688705 [0,2,0,0,0,0|1,0,0]=3 1375 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)Cl)/C)C 527a_200020676162_100000688705 [0,2,0,0,0,0|1,0,0]=3 1376 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)F)/C)C 11a_200020676162_100000686989 [0,2,0,0,0,0|1,0,0]=3 1377 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)F)/C)C 1626a_200020676162_100000686989 [0,2,0,0,0,0|1,0,0]=3 1378 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)F)/C)C 527a_200020676162_100000686989 [0,2,0,0,0,0|1,0,0]=3 1379 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)I)/C)C 11a_200020676162_100010189873 [0,2,0,0,0,0|1,0,0]=3 1380 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)I)/C)C 1626a_200020676162_100010189873 [0,2,0,0,0,0|1,0,0]=3 1381 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)I)/C)C 527a_200020676162_100010189873 [0,2,0,0,0,0|1,0,0]=3 1382 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1C)O)/C)C 527a_200020676162_100000692822 [0,2,0,0,0,0|1,0,0]=3 1383 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Br)/C)C 11a_200020676162_100000741628 [0,2,0,0,0,0|1,0,0]=3 1384 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Br)/C)C 1626a_200020676162_100000741628 [0,2,0,0,0,0|1,0,0]=3 1385 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Br)/C)C 527a_200020676162_100000741628 [0,2,0,0,0,0|1,0,0]=3 1386 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)C)/C)C 11a_200020676162_100000766932 [0,2,0,0,0,0|1,0,0]=3 1387 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)C)/C)C 1626a_200020676162_100000766932 [0,2,0,0,0,0|1,0,0]=3 1388 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)C)/C)C 527a_200020676162_100000766932 [0,2,0,0,0,0|1,0,0]=3 1389 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Cl)/C)C 11a_200020676162_100000185840 [0,2,0,0,0,0|1,0,0]=3 1390 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Cl)/C)C 1626a_200020676162_100000185840 [0,2,0,0,0,0|1,0,0]=3 1391 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)Cl)/C)C 527a_200020676162_100000185840 [0,2,0,0,0,0|1,0,0]=3 1392 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)F)/C)C 11a_200020676162_100000211397 [0,2,0,0,0,0|1,0,0]=3 1393 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)F)/C)C 1626a_200020676162_100000211397 [0,2,0,0,0,0|1,0,0]=3 1394 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)F)/C)C 527a_200020676162_100000211397 [0,2,0,0,0,0|1,0,0]=3 1395 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)I)/C)C 11a_200020676162_100000751301 [0,2,0,0,0,0|1,0,0]=3 1396 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)I)/C)C 1626a_200020676162_100000751301 [0,2,0,0,0,0|1,0,0]=3 1397 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)I)/C)C 527a_200020676162_100000751301 [0,2,0,0,0,0|1,0,0]=3 1398 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1Cl)O)/C)C 527a_200020676162_100000702456 [0,2,0,0,0,0|1,0,0]=3 1399 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Br)/C)C 11a_200020676162_100000214689 [0,2,0,0,0,0|1,0,0]=3 1400 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Br)/C)C 1626a_200020676162_100000214689 [0,2,0,0,0,0|1,0,0]=3 1401 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Br)/C)C 527a_200020676162_100000214689 [0,2,0,0,0,0|1,0,0]=3 1402 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)C)/C)C 11a_200020676162_100000766033 [0,2,0,0,0,0|1,0,0]=3 1403 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)C)/C)C 1626a_200020676162_100000766033 [0,2,0,0,0,0|1,0,0]=3 1404 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)C)/C)C 527a_200020676162_100000766033 [0,2,0,0,0,0|1,0,0]=3 1405 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Cl)/C)C 11a_200020676162_100000212326 [0,2,0,0,0,0|1,0,0]=3 1406 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Cl)/C)C 1626a_200020676162_100000212326 [0,2,0,0,0,0|1,0,0]=3 1407 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)Cl)/C)C 527a_200020676162_100000212326 [0,2,0,0,0,0|1,0,0]=3 1408 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)F)/C)C 11a_200020676162_100000211022 [0,2,0,0,0,0|1,0,0]=3 1409 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)F)/C)C 1626a_200020676162_100000211022 [0,2,0,0,0,0|1,0,0]=3 1410 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)F)/C)C 527a_200020676162_100000211022 [0,2,0,0,0,0|1,0,0]=3 1411 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)I)/C)C 11a_200020676162_100000037189 [0,2,0,0,0,0|1,0,0]=3 1412 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)I)/C)C 1626a_200020676162_100000037189 [0,2,0,0,0,0|1,0,0]=3 1413 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)I)/C)C 527a_200020676162_100000037189 [0,2,0,0,0,0|1,0,0]=3 1414 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1F)O)/C)C 527a_200020676162_100000689029 [0,2,0,0,0,0|1,0,0]=3 1415 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Br)/C)C 11a_200020676162_100000751167 [0,2,0,0,0,0|1,0,0]=3 1416 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Br)/C)C 1626a_200020676162_100000751167 [0,2,0,0,0,0|1,0,0]=3 1417 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Br)/C)C 527a_200020676162_100000751167 [0,2,0,0,0,0|1,0,0]=3 1418 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)C)/C)C 11a_200020676162_100009999607 [0,2,0,0,0,0|1,0,0]=3 1419 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)C)/C)C 1626a_200020676162_100009999607 [0,2,0,0,0,0|1,0,0]=3 1420 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)C)/C)C 527a_200020676162_100009999607 [0,2,0,0,0,0|1,0,0]=3 1421 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Cl)/C)C 11a_200020676162_100000739380 [0,2,0,0,0,0|1,0,0]=3 1422 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Cl)/C)C 1626a_200020676162_100000739380 [0,2,0,0,0,0|1,0,0]=3 1423 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)Cl)/C)C 527a_200020676162_100000739380 [0,2,0,0,0,0|1,0,0]=3 1424 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)F)/C)C 11a_200020676162_100000739341 [0,2,0,0,0,0|1,0,0]=3 1425 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)F)/C)C 1626a_200020676162_100000739341 [0,2,0,0,0,0|1,0,0]=3 1426 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1I)F)/C)C 527a_200020676162_100000739341 [0,2,0,0,0,0|1,0,0]=3 1427 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)Br)/C)C 527a_200020676162_100000744433 [0,2,0,0,0,0|1,0,0]=3 1428 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)C)/C)C 1626a_200020676162_100000212137 [0,2,0,0,0,0|1,0,0]=3 1429 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)C)/C)C 527a_200020676162_100000212137 [0,2,0,0,0,0|1,0,0]=3 1430 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)Cl)/C)C 11a_200020676162_100000188622 [0,2,0,0,0,0|1,0,0]=3 1431 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)Cl)/C)C 527a_200020676162_100000188622 [0,2,0,0,0,0|1,0,0]=3 1432 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)F)/C)C 527a_200020676162_100000746061 [0,2,0,0,0,0|1,0,0]=3 1433 B21R1.542099 CC(=CCC/C(=C/CNC(=O)c1ccc(cc1O)I)/C)C 527a_200020676162_100000091984 [0,2,0,0,0,0|1,0,0]=3 1434 B21R1.542099 CC(=CCC/C(=C/COC(C)c1ccc(cc1F)F)/C)C 34a_200000246518_100016991246 [0,2,0,0,0,0|1,0,1]=4 1435 B21R1.542099 CC(=CCC/C(=C/COC(C)c1ccc(cc1F)F)/C)C 7a_200000246518_100016991246 [0,2,0,0,0,0|1,0,1]=4 1436 B21R1.71018 CC(=CCCC(=CC(=O)C(C)C(=O)c1ccccc1)C)C 1458a_100016995320_100000239700 [0,2,0,0,0,0|1,0,1]=4 1437 B21R1.307252 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1Br)C)C 1458a_100016995320_100000199116 [0,2,0,0,0,0|1,0,1]=4 1438 B21R1.307252 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1C)C)C 1458a_100016995320_100000741374 [0,2,0,0,0,0|1,0,1]=4 1439 B21R1.307252 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1Cl)C)C 1458a_100016995320_100000211432 [0,2,0,0,0,0|1,0,1]=4 1440 B21R1.307252 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1F)C)C 1458a_100016995320_100000204681 [0,2,0,0,0,0|1,0,1]=4 1441 B21R1.307252 CC(=CCCC(=CC(=O)CC(=O)c1ccccc1O)C)C 1458a_100016995320_100000188908 [0,2,0,0,0,0|1,0,1]=4 1442 B21R1.535156 CC(=CCCC(=CC(=O)CC(=O)c1cccc(c1)Br)C)C 1458a_100016995320_100000212080 [0,2,0,0,0,0|1,0,1]=4 1443 B21R1.535156 CC(=CCCC(=CC(=O)CC(=O)c1cccc(c1)C)C)C 1458a_100016995320_100000739480 [0,2,0,0,0,0|1,0,1]=4 1444 B21R1.535156 CC(=CCCC(=CC(=O)CC(=O)c1cccc(c1)Cl)C)C 1458a_100016995320_100000211444 [0,2,0,0,0,0|1,0,1]=4 1445 B21R1.535156 CC(=CCCC(=CC(=O)CC(=O)c1cccc(c1)F)C)C 1458a_100016995320_100000215616 [0,2,0,0,0,0|1,0,1]=4 1446 B21R1.535156 CC(=CCCC(=CC(=O)CC(=O)c1cccc(c1)O)C)C 1458a_100016995320_100009813753 [0,2,0,0,0,0|1,0,1]=4 1447 B21R1.43177 CC(=CCC/C(=C/COC(CCN)c1ccccc1)/C)C 34a_100000763605_100016991246 [0,2,0,0,0,0|1,0,1]=4 1448 B21R1.43177 CC(=CCC/C(=C/CO[C@H](CC#N)c1ccccc1)/C)C 7a_100009817555_100016991246 [0,2,0,0,0,0|1,0,1]=4 1449 B21R1.94367 CCC(OC/C=C(\C)/CCC=C(C)C)c1cccc(c1)F 34a_100011350881_100016991246 [0,2,0,0,0,0|1,0,1]=4 1450 B21R1.94367 CCC(OC/C=C(\C)/CCC=C(C)C)c1cccc(c1)F 7a_100011350881_100016991246 [0,2,0,0,0,0|1,0,1]=4 1451 B21R1.608831 CC(=CCC/C(=C/CNC(C(=O)N)c1ccccc1)/C)C 2230a_200020676162_100000188848 [0,2,0,0,0,0|1,0,1]=4 1452 B21R1.608831 CC(=CCC/C(=C/CNC(C(=O)O)c1ccccc1)/C)C 269956a_100000230147_100016991246 [0,2,0,0,0,0|1,0,1]=4 1453 B21R1.608831 CC(=CCC/C(=C/CN[C@@H](C(=O)N)c1ccccc1)/C)C 2230a_100011423151_100016991246 [0,2,0,0,0,0|1,0,1]=4 1454 B21R1.608831 CC(=CCC/C(=C/COC(C(=O)N)c1ccccc1)/C)C 34a_100011200849_100016991246 [0,2,0,0,0,0|0,0,1]=3 1455 B21R1.608831 CC(=CCC/C(=C/COC(C(=O)N)c1ccccc1)/C)C 7a_100011200849_100016991246 [0,2,0,0,0,0|0,0,1]=3 1456 B21R1.608831 CC(=CCC/C(=C/CSC(C(=O)N)c1ccccc1)/C)C 62a_100000188848_100016991246 [0,2,0,0,0,0|0,1,1]=4 1457 B21R1.608831 CC(=CCC/C(=C/CSC(C(=O)N)c1ccccc1)/C)C 62a_100016991246_100000188848 [0,2,0,0,0,0|0,1,1]=4 1458 B21R1.608831 CC(=CCC/C(=C\COC(C(=O)N)c1ccccc1)/C)C 7a_100016990311_100000188848 [0,2,0,0,0,0|0,0,1]=3 1459 B21R1.608831 CC(=O)C(NC/C=C(\C)/CCC=C(C)C)c1ccccc1 2230a_200020676162_100009888967 [0,2,0,0,0,0|1,0,1]=4 1460 B21R1.608831 CC(=O)C(OC/C=C(/C)\CCC=C(C)C)c1ccccc1 7a_100016990311_100009888967 [0,2,0,0,0,0|0,0,1]=3 1461 B21R1.608831 CC(=O)C(SC/C=C(\C)/CCC=C(C)C)c1ccccc1 62a_100009888967_100016991246 [0,2,0,0,0,0|0,1,1]=4 1462 B21R1.608831 CC(=O)C(SC/C=C(\C)/CCC=C(C)C)c1ccccc1 62a_100016991246_100009888967 [0,2,0,0,0,0|0,1,1]=4 1463 B21R1.1329234 CC(=CCC/C(=C/COC(C#N)c1ccccc1Cl)/C)C 7a_200011294979_100016991246 [0,2,0,0,0,0|1,0,1]=4 1464 B21R1.1329234 CC(=CCC/C(=C/COC(CN)c1ccccc1Br)/C)C 34a_100011236429_100016991246 [0,2,0,0,0,0|1,0,1]=4 1465 B21R1.1329234 CC(=CCC/C(=C/COC(CN)c1ccccc1Cl)/C)C 34a_200000759403_100016991246 [0,2,0,0,0,0|1,0,1]=4 1466 B21R1.1329234 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1F 34a_200011689290_100016991246 [0,2,0,0,0,0|1,0,1]=4 1467 B21R1.1329234 CCC(OC/C=C(\C)/CCC=C(C)C)c1ccccc1F 7a_200011689290_100016991246 [0,2,0,0,0,0|1,0,1]=4 1468 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Br)/C)C 11a_200020676162_100000690891 [0,2,0,0,0,0|1,0,0]=3 1469 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Br)/C)C 1626a_200020676162_100000690891 [0,2,0,0,0,0|1,0,0]=3 1470 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Br)/C)C 527a_200020676162_100000690891 [0,2,0,0,0,0|1,0,0]=3 1471 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)C)/C)C 11a_200020676162_100000701904 [0,2,0,0,0,0|1,0,0]=3 1472 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)C)/C)C 1626a_200020676162_100000701904 [0,2,0,0,0,0|1,0,0]=3 1473 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)C)/C)C 527a_200020676162_100000701904 [0,2,0,0,0,0|1,0,0]=3 1474 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Cl)/C)C 11a_200020676162_100011253703 [0,2,0,0,0,0|1,0,0]=3 1475 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Cl)/C)C 1626a_200020676162_100011253703 [0,2,0,0,0,0|1,0,0]=3 1476 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)Cl)/C)C 527a_200020676162_100011253703 [0,2,0,0,0,0|1,0,0]=3 1477 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)F)/C)C 11a_200020676162_100000752694 [0,2,0,0,0,0|1,0,0]=3 1478 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)F)/C)C 1626a_200020676162_100000752694 [0,2,0,0,0,0|1,0,0]=3 1479 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)F)/C)C 527a_200020676162_100000752694 [0,2,0,0,0,0|1,0,0]=3 1480 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Br)O)/C)C 527a_200020676162_100011935254 [0,2,0,0,0,0|1,0,0]=3 1481 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1C)C)/C)C 11a_200020676162_100000758298 [0,2,0,0,0,0|1,0,0]=3 1482 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1C)C)/C)C 1626a_200020676162_100000758298 [0,2,0,0,0,0|1,0,0]=3 1483 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)C)/C)C 11a_200020676162_100000692601 [0,2,0,0,0,0|1,0,0]=3 1484 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)C)/C)C 1626a_200020676162_100000692601 [0,2,0,0,0,0|1,0,0]=3 1485 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)Cl)/C)C 11a_200020676162_100000210656 [0,2,0,0,0,0|1,0,0]=3 1486 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)Cl)/C)C 1626a_200020676162_100000210656 [0,2,0,0,0,0|1,0,0]=3 1487 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)F)/C)C 11a_200020676162_100000210369 [0,2,0,0,0,0|1,0,0]=3 1488 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)F)/C)C 1626a_200020676162_100000210369 [0,2,0,0,0,0|1,0,0]=3 1489 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)F)/C)C 527a_200020676162_100000210369 [0,2,0,0,0,0|1,0,0]=3 1490 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1Cl)O)/C)C 527a_200020676162_100000745519 [0,2,0,0,0,0|1,0,0]=3 1491 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)C)/C)C 11a_200020676162_100000762013 [0,2,0,0,0,0|1,0,0]=3 1492 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)C)/C)C 1626a_200020676162_100000762013 [0,2,0,0,0,0|1,0,0]=3 1493 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)C)/C)C 527a_200020676162_100000762013 [0,2,0,0,0,0|1,0,0]=3 1494 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)F)/C)C 11a_200020676162_100000210804 [0,2,0,0,0,0|1,0,0]=3 1495 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)F)/C)C 1626a_200020676162_100000210804 [0,2,0,0,0,0|1,0,0]=3 1496 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)F)/C)C 527a_200020676162_100000210804 [0,2,0,0,0,0|1,0,0]=3 1497 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1F)O)/C)C 527a_200020676162_100000763259 [0,2,0,0,0,0|1,0,0]=3 1498 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Br)/C)C 11a_200020676162_100010232521 [0,2,0,0,0,0|1,0,0]=3 1499 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Br)/C)C 1626a_200020676162_100010232521 [0,2,0,0,0,0|1,0,0]=3 1500 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Br)/C)C 527a_200020676162_100010232521 [0,2,0,0,0,0|1,0,0]=3 1501 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)C)/C)C 11a_200020676162_100000688020 [0,2,0,0,0,0|1,0,0]=3 1502 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)C)/C)C 1626a_200020676162_100000688020 [0,2,0,0,0,0|1,0,0]=3 1503 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Cl)/C)C 11a_200020676162_100000702859 [0,2,0,0,0,0|1,0,0]=3 1504 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Cl)/C)C 1626a_200020676162_100000702859 [0,2,0,0,0,0|1,0,0]=3 1505 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)Cl)/C)C 527a_200020676162_100000702859 [0,2,0,0,0,0|1,0,0]=3 1506 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)F)/C)C 11a_200020676162_100000023732 [0,2,0,0,0,0|1,0,0]=3 1507 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1I)F)/C)C 1626a_200020676162_100000023732 [0,2,0,0,0,0|1,0,0]=3 1508 B21R1.534788 CC(=CCC/C(=C/CNC(=O)c1c(cccc1O)O)/C)C 527a_200020676162_100000755285 [0,2,0,0,0,0|1,0,0]=3 1509 B21R1.534788 CC(=CCC/C(=C/COC(C)c1c(cccc1F)F)/C)C 34a_100000742607_100016991246 [0,2,0,0,0,0|1,0,1]=4 1510 B21R1.534788 CC(=CCC/C(=C/COC(C)c1c(cccc1F)F)/C)C 7a_100000742607_100016991246 [0,2,0,0,0,0|1,0,1]=4 1511 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Br)/C)C 11a_200020676162_100012360534 [0,2,0,0,0,0|1,0,0]=3 1512 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Br)/C)C 1626a_200020676162_100012360534 [0,2,0,0,0,0|1,0,0]=3 1513 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Br)/C)C 527a_200020676162_100012360534 [0,2,0,0,0,0|1,0,0]=3 1514 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)C)/C)C 11a_200020676162_100000692419 [0,2,0,0,0,0|1,0,0]=3 1515 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)C)/C)C 1626a_200020676162_100000692419 [0,2,0,0,0,0|1,0,0]=3 1516 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)C)/C)C 527a_200020676162_100000692419 [0,2,0,0,0,0|1,0,0]=3 1517 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Cl)/C)C 11a_200020676162_100012339722 [0,2,0,0,0,0|1,0,0]=3 1518 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Cl)/C)C 1626a_200020676162_100012339722 [0,2,0,0,0,0|1,0,0]=3 1519 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)Cl)/C)C 527a_200020676162_100012339722 [0,2,0,0,0,0|1,0,0]=3 1520 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)F)/C)C 11a_200020676162_100011217547 [0,2,0,0,0,0|1,0,0]=3 1521 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)F)/C)C 1626a_200020676162_100011217547 [0,2,0,0,0,0|1,0,0]=3 1522 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)F)/C)C 527a_200020676162_100011217547 [0,2,0,0,0,0|1,0,0]=3 1523 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)I)/C)C 11a_200020676162_100010232522 [0,2,0,0,0,0|1,0,0]=3 1524 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)I)/C)C 1626a_200020676162_100010232522 [0,2,0,0,0,0|1,0,0]=3 1525 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)I)/C)C 527a_200020676162_100010232522 [0,2,0,0,0,0|1,0,0]=3 1526 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Br)O)/C)C 527a_200020676162_100010230362 [0,2,0,0,0,0|1,0,0]=3 1527 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Br)/C)C 11a_200020676162_100000760464 [0,2,0,0,0,0|1,0,0]=3 1528 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Br)/C)C 1626a_200020676162_100000760464 [0,2,0,0,0,0|1,0,0]=3 1529 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Br)/C)C 527a_200020676162_100000760464 [0,2,0,0,0,0|1,0,0]=3 1530 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)C)/C)C 11a_200020676162_100000183679 [0,2,0,0,0,0|1,0,0]=3 1531 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)C)/C)C 1626a_200020676162_100000183679 [0,2,0,0,0,0|1,0,0]=3 1532 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)C)/C)C 527a_200020676162_100000183679 [0,2,0,0,0,0|1,0,0]=3 1533 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Cl)/C)C 11a_200020676162_100000690184 [0,2,0,0,0,0|1,0,0]=3 1534 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Cl)/C)C 1626a_200020676162_100000690184 [0,2,0,0,0,0|1,0,0]=3 1535 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)Cl)/C)C 527a_200020676162_100000690184 [0,2,0,0,0,0|1,0,0]=3 1536 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)F)/C)C 11a_200020676162_100011218272 [0,2,0,0,0,0|1,0,0]=3 1537 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)F)/C)C 1626a_200020676162_100011218272 [0,2,0,0,0,0|1,0,0]=3 1538 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)F)/C)C 527a_200020676162_100011218272 [0,2,0,0,0,0|1,0,0]=3 1539 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)I)/C)C 11a_200020676162_100000751865 [0,2,0,0,0,0|1,0,0]=3 1540 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)I)/C)C 1626a_200020676162_100000751865 [0,2,0,0,0,0|1,0,0]=3 1541 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)I)/C)C 527a_200020676162_100000751865 [0,2,0,0,0,0|1,0,0]=3 1542 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1C)O)/C)C 527a_200020676162_100000766327 [0,2,0,0,0,0|1,0,0]=3 1543 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Br)/C)C 11a_200020676162_100000760540 [0,2,0,0,0,0|1,0,0]=3 1544 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Br)/C)C 1626a_200020676162_100000760540 [0,2,0,0,0,0|1,0,0]=3 1545 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Br)/C)C 527a_200020676162_100000760540 [0,2,0,0,0,0|1,0,0]=3 1546 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)C)/C)C 11a_200020676162_100000693142 [0,2,0,0,0,0|1,0,0]=3 1547 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)C)/C)C 1626a_200020676162_100000693142 [0,2,0,0,0,0|1,0,0]=3 1548 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)C)/C)C 527a_200020676162_100000693142 [0,2,0,0,0,0|1,0,0]=3 1549 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Cl)/C)C 11a_200020676162_100000183631 [0,2,0,0,0,0|1,0,0]=3 1550 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Cl)/C)C 1626a_200020676162_100000183631 [0,2,0,0,0,0|1,0,0]=3 1551 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)Cl)/C)C 527a_200020676162_100000183631 [0,2,0,0,0,0|1,0,0]=3 1552 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)F)/C)C 11a_200020676162_100000759904 [0,2,0,0,0,0|1,0,0]=3 1553 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)F)/C)C 1626a_200020676162_100000759904 [0,2,0,0,0,0|1,0,0]=3 1554 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)F)/C)C 527a_200020676162_100000759904 [0,2,0,0,0,0|1,0,0]=3 1555 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)I)/C)C 11a_200020676162_100010176783 [0,2,0,0,0,0|1,0,0]=3 1556 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)I)/C)C 1626a_200020676162_100010176783 [0,2,0,0,0,0|1,0,0]=3 1557 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)I)/C)C 527a_200020676162_100010176783 [0,2,0,0,0,0|1,0,0]=3 1558 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1Cl)O)/C)C 527a_200020676162_100000092362 [0,2,0,0,0,0|1,0,0]=3 1559 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Br)/C)C 11a_200020676162_100000756403 [0,2,0,0,0,0|1,0,0]=3 1560 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Br)/C)C 1626a_200020676162_100000756403 [0,2,0,0,0,0|1,0,0]=3 1561 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Br)/C)C 527a_200020676162_100000756403 [0,2,0,0,0,0|1,0,0]=3 1562 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)C)/C)C 11a_200020676162_100000766181 [0,2,0,0,0,0|1,0,0]=3 1563 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)C)/C)C 1626a_200020676162_100000766181 [0,2,0,0,0,0|1,0,0]=3 1564 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)C)/C)C 527a_200020676162_100000766181 [0,2,0,0,0,0|1,0,0]=3 1565 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Cl)/C)C 11a_200020676162_100000688816 [0,2,0,0,0,0|1,0,0]=3 1566 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Cl)/C)C 1626a_200020676162_100000688816 [0,2,0,0,0,0|1,0,0]=3 1567 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)Cl)/C)C 527a_200020676162_100000688816 [0,2,0,0,0,0|1,0,0]=3 1568 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)F)/C)C 11a_200020676162_100000748134 [0,2,0,0,0,0|1,0,0]=3 1569 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)F)/C)C 1626a_200020676162_100000748134 [0,2,0,0,0,0|1,0,0]=3 1570 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)F)/C)C 527a_200020676162_100000748134 [0,2,0,0,0,0|1,0,0]=3 1571 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)I)/C)C 11a_200020676162_100010185205 [0,2,0,0,0,0|1,0,0]=3 1572 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)I)/C)C 1626a_200020676162_100010185205 [0,2,0,0,0,0|1,0,0]=3 1573 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)I)/C)C 527a_200020676162_100010185205 [0,2,0,0,0,0|1,0,0]=3 1574 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1F)O)/C)C 527a_200020676162_100000037433 [0,2,0,0,0,0|1,0,0]=3 1575 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Br)/C)C 11a_200020676162_100000688019 [0,2,0,0,0,0|1,0,0]=3 1576 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Br)/C)C 1626a_200020676162_100000688019 [0,2,0,0,0,0|1,0,0]=3 1577 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Br)/C)C 527a_200020676162_100000688019 [0,2,0,0,0,0|1,0,0]=3 1578 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)C)/C)C 11a_200020676162_100000739377 [0,2,0,0,0,0|1,0,0]=3 1579 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)C)/C)C 1626a_200020676162_100000739377 [0,2,0,0,0,0|1,0,0]=3 1580 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)C)/C)C 527a_200020676162_100000739377 [0,2,0,0,0,0|1,0,0]=3 1581 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Cl)/C)C 11a_200020676162_100010176784 [0,2,0,0,0,0|1,0,0]=3 1582 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Cl)/C)C 1626a_200020676162_100010176784 [0,2,0,0,0,0|1,0,0]=3 1583 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)Cl)/C)C 527a_200020676162_100010176784 [0,2,0,0,0,0|1,0,0]=3 1584 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)F)/C)C 11a_200020676162_100000690930 [0,2,0,0,0,0|1,0,0]=3 1585 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)F)/C)C 1626a_200020676162_100000690930 [0,2,0,0,0,0|1,0,0]=3 1586 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)F)/C)C 527a_200020676162_100000690930 [0,2,0,0,0,0|1,0,0]=3 1587 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1I)O)/C)C 527a_200020676162_100010084636 [0,2,0,0,0,0|1,0,0]=3 1588 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1O)Br)/C)C 527a_200020676162_100000752940 [0,2,0,0,0,0|1,0,0]=3 1589 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1O)C)/C)C 527a_200020676162_100000183896 [0,2,0,0,0,0|1,0,0]=3 1590 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1O)Cl)/C)C 527a_200020676162_100000742801 [0,2,0,0,0,0|1,0,0]=3 1591 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1O)F)/C)C 527a_200020676162_100011217230 [0,2,0,0,0,0|1,0,0]=3 1592 B21R1.536841 CC(=CCC/C(=C/CNC(=O)c1cccc(c1O)O)/C)C 527a_200020676162_100000690420 [0,2,0,0,0,0|1,0,0]=3 1593 B21R1.536841 CC(=CCC/C(=C/COC(C)c1cccc(c1F)F)/C)C 34a_100011944069_100016991246 [0,2,0,0,0,0|1,0,1]=4 1594 B21R1.536841 CC(=CCC/C(=C/COC(C)c1cccc(c1F)F)/C)C 7a_100011944069_100016991246 [0,2,0,0,0,0|1,0,1]=4 1595 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Br)/C)C 11a_200020676162_100000690610 [0,2,0,0,0,0|1,0,0]=3 1596 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Br)/C)C 1626a_200020676162_100000690610 [0,2,0,0,0,0|1,0,0]=3 1597 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Br)/C)C 527a_200020676162_100000690610 [0,2,0,0,0,0|1,0,0]=3 1598 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)C)/C)C 11a_200020676162_100000689033 [0,2,0,0,0,0|1,0,0]=3 1599 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)C)/C)C 1626a_200020676162_100000689033 [0,2,0,0,0,0|1,0,0]=3 1600 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)C)/C)C 527a_200020676162_100000689033 [0,2,0,0,0,0|1,0,0]=3 1601 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Cl)/C)C 11a_200020676162_100000736951 [0,2,0,0,0,0|1,0,0]=3 1602 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Cl)/C)C 1626a_200020676162_100000736951 [0,2,0,0,0,0|1,0,0]=3 1603 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)Cl)/C)C 527a_200020676162_100000736951 [0,2,0,0,0,0|1,0,0]=3 1604 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)F)/C)C 11a_200020676162_100000212315 [0,2,0,0,0,0|1,0,0]=3 1605 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)F)/C)C 1626a_200020676162_100000212315 [0,2,0,0,0,0|1,0,0]=3 1606 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)F)/C)C 527a_200020676162_100000212315 [0,2,0,0,0,0|1,0,0]=3 1607 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)I)/C)C 11a_200020676162_100000698340 [0,2,0,0,0,0|1,0,0]=3 1608 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)I)/C)C 1626a_200020676162_100000698340 [0,2,0,0,0,0|1,0,0]=3 1609 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)I)/C)C 527a_200020676162_100000698340 [0,2,0,0,0,0|1,0,0]=3 1610 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Br)O)/C)C 527a_200020676162_100012352043 [0,2,0,0,0,0|1,0,0]=3 1611 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Br)/C)C 11a_200020676162_100000759961 [0,2,0,0,0,0|1,0,0]=3 1612 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Br)/C)C 1626a_200020676162_100000759961 [0,2,0,0,0,0|1,0,0]=3 1613 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Br)/C)C 527a_200020676162_100000759961 [0,2,0,0,0,0|1,0,0]=3 1614 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)C)/C)C 11a_200020676162_100000195421 [0,2,0,0,0,0|1,0,0]=3 1615 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)C)/C)C 1626a_200020676162_100000195421 [0,2,0,0,0,0|1,0,0]=3 1616 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)C)/C)C 527a_200020676162_100000195421 [0,2,0,0,0,0|1,0,0]=3 1617 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Cl)/C)C 11a_200020676162_100000692595 [0,2,0,0,0,0|1,0,0]=3 1618 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Cl)/C)C 1626a_200020676162_100000692595 [0,2,0,0,0,0|1,0,0]=3 1619 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)Cl)/C)C 527a_200020676162_100000692595 [0,2,0,0,0,0|1,0,0]=3 1620 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)F)/C)C 11a_200020676162_100000240043 [0,2,0,0,0,0|1,0,0]=3 1621 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)F)/C)C 1626a_200020676162_100000240043 [0,2,0,0,0,0|1,0,0]=3 1622 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)F)/C)C 527a_200020676162_100000240043 [0,2,0,0,0,0|1,0,0]=3 1623 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)I)/C)C 11a_200020676162_100000688012 [0,2,0,0,0,0|1,0,0]=3 1624 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)I)/C)C 1626a_200020676162_100000688012 [0,2,0,0,0,0|1,0,0]=3 1625 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1C)I)/C)C 527a_200020676162_100000688012 [0,2,0,0,0,0|1,0,0]=3 1626 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Br)/C)C 11a_200020676162_100000211212 [0,2,0,0,0,0|1,0,0]=3 1627 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Br)/C)C 1626a_200020676162_100000211212 [0,2,0,0,0,0|1,0,0]=3 1628 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Br)/C)C 527a_200020676162_100000211212 [0,2,0,0,0,0|1,0,0]=3 1629 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)C)/C)C 11a_200020676162_100011290873 [0,2,0,0,0,0|1,0,0]=3 1630 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)C)/C)C 1626a_200020676162_100011290873 [0,2,0,0,0,0|1,0,0]=3 1631 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)C)/C)C 527a_200020676162_100011290873 [0,2,0,0,0,0|1,0,0]=3 1632 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Cl)/C)C 11a_200020676162_100000210642 [0,2,0,0,0,0|1,0,0]=3 1633 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Cl)/C)C 1626a_200020676162_100000210642 [0,2,0,0,0,0|1,0,0]=3 1634 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)Cl)/C)C 527a_200020676162_100000210642 [0,2,0,0,0,0|1,0,0]=3 1635 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)F)/C)C 11a_200020676162_100011219680 [0,2,0,0,0,0|1,0,0]=3 1636 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)F)/C)C 1626a_200020676162_100011219680 [0,2,0,0,0,0|1,0,0]=3 1637 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)F)/C)C 527a_200020676162_100011219680 [0,2,0,0,0,0|1,0,0]=3 1638 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)I)/C)C 11a_200020676162_100000688013 [0,2,0,0,0,0|1,0,0]=3 1639 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)I)/C)C 1626a_200020676162_100000688013 [0,2,0,0,0,0|1,0,0]=3 1640 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)I)/C)C 527a_200020676162_100000688013 [0,2,0,0,0,0|1,0,0]=3 1641 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1Cl)O)/C)C 527a_200020676162_100000719527 [0,2,0,0,0,0|1,0,0]=3 1642 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Br)/C)C 11a_200020676162_100000212322 [0,2,0,0,0,0|1,0,0]=3 1643 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Br)/C)C 1626a_200020676162_100000212322 [0,2,0,0,0,0|1,0,0]=3 1644 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Br)/C)C 527a_200020676162_100000212322 [0,2,0,0,0,0|1,0,0]=3 1645 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)C)/C)C 11a_200020676162_100000749327 [0,2,0,0,0,0|1,0,0]=3 1646 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)C)/C)C 1626a_200020676162_100000749327 [0,2,0,0,0,0|1,0,0]=3 1647 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)C)/C)C 527a_200020676162_100000749327 [0,2,0,0,0,0|1,0,0]=3 1648 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Cl)/C)C 11a_200020676162_100000214954 [0,2,0,0,0,0|1,0,0]=3 1649 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Cl)/C)C 1626a_200020676162_100000214954 [0,2,0,0,0,0|1,0,0]=3 1650 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)Cl)/C)C 527a_200020676162_100000214954 [0,2,0,0,0,0|1,0,0]=3 1651 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)F)/C)C 11a_200020676162_100000198512 [0,2,0,0,0,0|1,0,0]=3 1652 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)F)/C)C 1626a_200020676162_100000198512 [0,2,0,0,0,0|1,0,0]=3 1653 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)F)/C)C 527a_200020676162_100000198512 [0,2,0,0,0,0|1,0,0]=3 1654 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)I)/C)C 11a_200020676162_100000688014 [0,2,0,0,0,0|1,0,0]=3 1655 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)I)/C)C 1626a_200020676162_100000688014 [0,2,0,0,0,0|1,0,0]=3 1656 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)I)/C)C 527a_200020676162_100000688014 [0,2,0,0,0,0|1,0,0]=3 1657 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1F)O)/C)C 527a_200020676162_100000037260 [0,2,0,0,0,0|1,0,0]=3 1658 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)Br)/C)C 11a_200020676162_100000183945 [0,2,0,0,0,0|1,0,0]=3 1659 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)Br)/C)C 1626a_200020676162_100000183945 [0,2,0,0,0,0|1,0,0]=3 1660 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)C)/C)C 11a_200020676162_100000057929 [0,2,0,0,0,0|1,0,0]=3 1661 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)C)/C)C 1626a_200020676162_100000057929 [0,2,0,0,0,0|1,0,0]=3 1662 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)C)/C)C 527a_200020676162_100000057929 [0,2,0,0,0,0|1,0,0]=3 1663 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)Cl)/C)C 11a_200020676162_100000739379 [0,2,0,0,0,0|1,0,0]=3 1664 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)Cl)/C)C 1626a_200020676162_100000739379 [0,2,0,0,0,0|1,0,0]=3 1665 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)Cl)/C)C 527a_200020676162_100000739379 [0,2,0,0,0,0|1,0,0]=3 1666 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)F)/C)C 11a_200020676162_100000748905 [0,2,0,0,0,0|1,0,0]=3 1667 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)F)/C)C 1626a_200020676162_100000748905 [0,2,0,0,0,0|1,0,0]=3 1668 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)F)/C)C 527a_200020676162_100000748905 [0,2,0,0,0,0|1,0,0]=3 1669 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)I)/C)C 11a_200020676162_100000750460 [0,2,0,0,0,0|1,0,0]=3 1670 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)I)/C)C 1626a_200020676162_100000750460 [0,2,0,0,0,0|1,0,0]=3 1671 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)I)/C)C 527a_200020676162_100000750460 [0,2,0,0,0,0|1,0,0]=3 1672 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)O)/C)C 1626a_200020676162_200009995701 [0,2,0,0,0,0|1,0,0]=3 1673 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1I)O)/C)C 527a_200020676162_200009995701 [0,2,0,0,0,0|1,0,0]=3 1674 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)Br)/C)C 1626a_200020676162_100000212140 [0,2,0,0,0,0|1,0,0]=3 1675 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)Br)/C)C 527a_200020676162_100000212140 [0,2,0,0,0,0|1,0,0]=3 1676 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)C)/C)C 527a_200020676162_100000229998 [0,2,0,0,0,0|1,0,0]=3 1677 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)Cl)/C)C 11a_200020676162_100000212143 [0,2,0,0,0,0|1,0,0]=3 1678 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)Cl)/C)C 1626a_200020676162_100000212143 [0,2,0,0,0,0|1,0,0]=3 1679 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)Cl)/C)C 527a_200020676162_100000212143 [0,2,0,0,0,0|1,0,0]=3 1680 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)F)/C)C 527a_200020676162_100000742286 [0,2,0,0,0,0|1,0,0]=3 1681 B21R1.540615 CC(=CCC/C(=C/CNC(=O)c1cc(ccc1O)I)/C)C 527a_200020676162_100000212111 [0,2,0,0,0,0|1,0,0]=3 1682 B21R1.540615 CC(=CCC/C(=C/COC(C)c1cc(ccc1F)F)/C)C 34a_100000246540_100016991246 [0,2,0,0,0,0|1,0,1]=4 1683 B21R1.540615 CC(=CCC/C(=C/COC(C)c1cc(ccc1F)F)/C)C 7a_100000246540_100016991246 [0,2,0,0,0,0|1,0,1]=4 1684 B21R1.1071361 C#Cc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011243808 [0,2,0,0,0,0|1,0,0]=3 1685 B21R1.1071361 C=Cc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011830265 [0,2,0,0,0,0|1,0,0]=3 1686 B21R1.1071361 CC(=CCC/C(=C/CNC(=O)c1ccccc1C#N)/C)C 11a_200020676162_100000742908 [0,2,0,0,0,0|1,0,0]=3 1687 B21R1.1071361 CC(=CCC/C(=C/CNC(=O)c1ccccc1C#N)/C)C 1626a_200020676162_100000742908 [0,2,0,0,0,0|1,0,0]=3 1688 B21R1.1071361 CC(=CCC/C(=C/CNC(=O)c1ccccc1C#N)/C)C 527a_200020676162_100000742908 [0,2,0,0,0,0|1,0,0]=3 1689 B21R1.1071361 CC(=CCC/C(=C/CNC(=O)c1ccccc1I=O)/C)C 1626a_200020676162_100000032414 [0,2,0,0,0,0|1,0,0]=3 1690 B21R1.1071361 CC(=CCC/C(=C/CNC(=O)c1ccccc1I=O)/C)C 527a_200020676162_100000032414 [0,2,0,0,0,0|1,0,0]=3 1691 B21R1.1071361 CCc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000689120 [0,2,0,0,0,0|1,0,0]=3 1692 B21R1.1071361 CCc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000689120 [0,2,0,0,0,0|1,0,0]=3 1693 B21R1.1071361 CCc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000689120 [0,2,0,0,0,0|1,0,0]=3 1694 B21R1.1071361 COc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000185835 [0,2,0,0,0,0|1,0,0]=3 1695 B21R1.1071361 COc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000185835 [0,2,0,0,0,0|1,0,0]=3 1696 B21R1.1071361 COc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000185835 [0,2,0,0,0,0|1,0,0]=3 1697 B21R1.1071361 COc1ccccc1C(C)OC/C=C(\C)/CCC=C(C)C 7a_100000742714_100016991246 [0,2,0,0,0,0|1,0,1]=4 1698 B21R1.1071361 CSc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000183967 [0,2,0,0,0,0|1,0,0]=3 1699 B21R1.1071361 CSc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000183967 [0,2,0,0,0,0|1,0,0]=3 1700 B21R1.1071361 CSc1ccccc1C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000183967 [0,2,0,0,0,0|1,0,0]=3 1701 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Br)/C)C 11a_200020676162_100000687083 [0,2,0,0,0,0|1,0,0]=3 1702 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Br)/C)C 1626a_200020676162_100000687083 [0,2,0,0,0,0|1,0,0]=3 1703 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Br)/C)C 527a_200020676162_100000687083 [0,2,0,0,0,0|1,0,0]=3 1704 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)C)/C)C 11a_200020676162_100000760426 [0,2,0,0,0,0|1,0,0]=3 1705 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)C)/C)C 1626a_200020676162_100000760426 [0,2,0,0,0,0|1,0,0]=3 1706 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)C)/C)C 527a_200020676162_100000760426 [0,2,0,0,0,0|1,0,0]=3 1707 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Cl)/C)C 11a_200020676162_100000687899 [0,2,0,0,0,0|1,0,0]=3 1708 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Cl)/C)C 1626a_200020676162_100000687899 [0,2,0,0,0,0|1,0,0]=3 1709 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)Cl)/C)C 527a_200020676162_100000687899 [0,2,0,0,0,0|1,0,0]=3 1710 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)F)/C)C 11a_200020676162_100000739618 [0,2,0,0,0,0|1,0,0]=3 1711 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)F)/C)C 1626a_200020676162_100000739618 [0,2,0,0,0,0|1,0,0]=3 1712 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)F)/C)C 527a_200020676162_100000739618 [0,2,0,0,0,0|1,0,0]=3 1713 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Br)O)/C)C 527a_200020676162_100011934545 [0,2,0,0,0,0|1,0,0]=3 1714 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)C)C)/C)C 11a_200020676162_100000210874 [0,2,0,0,0,0|1,0,0]=3 1715 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)C)C)/C)C 1626a_200020676162_100000210874 [0,2,0,0,0,0|1,0,0]=3 1716 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)C)C)/C)C 527a_200020676162_100000210874 [0,2,0,0,0,0|1,0,0]=3 1717 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)C)/C)C 11a_200020676162_100000684526 [0,2,0,0,0,0|1,0,0]=3 1718 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)C)/C)C 1626a_200020676162_100000684526 [0,2,0,0,0,0|1,0,0]=3 1719 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)C)/C)C 527a_200020676162_100000684526 [0,2,0,0,0,0|1,0,0]=3 1720 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)Cl)/C)C 11a_200020676162_100000210701 [0,2,0,0,0,0|1,0,0]=3 1721 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)Cl)/C)C 1626a_200020676162_100000210701 [0,2,0,0,0,0|1,0,0]=3 1722 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)Cl)/C)C 527a_200020676162_100000210701 [0,2,0,0,0,0|1,0,0]=3 1723 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)F)/C)C 11a_200020676162_100000685768 [0,2,0,0,0,0|1,0,0]=3 1724 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)F)/C)C 1626a_200020676162_100000685768 [0,2,0,0,0,0|1,0,0]=3 1725 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)F)/C)C 527a_200020676162_100000685768 [0,2,0,0,0,0|1,0,0]=3 1726 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)Cl)O)/C)C 527a_200020676162_100011997059 [0,2,0,0,0,0|1,0,0]=3 1727 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)C)/C)C 11a_200020676162_100000763163 [0,2,0,0,0,0|1,0,0]=3 1728 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)C)/C)C 1626a_200020676162_100000763163 [0,2,0,0,0,0|1,0,0]=3 1729 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)C)/C)C 527a_200020676162_100000763163 [0,2,0,0,0,0|1,0,0]=3 1730 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)F)/C)C 11a_200020676162_100000211655 [0,2,0,0,0,0|1,0,0]=3 1731 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)F)/C)C 1626a_200020676162_100000211655 [0,2,0,0,0,0|1,0,0]=3 1732 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)F)/C)C 527a_200020676162_100000211655 [0,2,0,0,0,0|1,0,0]=3 1733 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)O)/C)C 11a_200020676162_100012017291 [0,2,0,0,0,0|1,0,0]=3 1734 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)F)O)/C)C 527a_200020676162_100012017291 [0,2,0,0,0,0|1,0,0]=3 1735 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Br)/C)C 11a_200020676162_100000689235 [0,2,0,0,0,0|1,0,0]=3 1736 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Br)/C)C 1626a_200020676162_100000689235 [0,2,0,0,0,0|1,0,0]=3 1737 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Br)/C)C 527a_200020676162_100000689235 [0,2,0,0,0,0|1,0,0]=3 1738 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)C)/C)C 11a_200020676162_100000729426 [0,2,0,0,0,0|1,0,0]=3 1739 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)C)/C)C 1626a_200020676162_100000729426 [0,2,0,0,0,0|1,0,0]=3 1740 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)C)/C)C 527a_200020676162_100000729426 [0,2,0,0,0,0|1,0,0]=3 1741 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Cl)/C)C 11a_200020676162_100012047205 [0,2,0,0,0,0|1,0,0]=3 1742 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Cl)/C)C 1626a_200020676162_100012047205 [0,2,0,0,0,0|1,0,0]=3 1743 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)Cl)/C)C 527a_200020676162_100012047205 [0,2,0,0,0,0|1,0,0]=3 1744 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)F)/C)C 11a_200020676162_100012047268 [0,2,0,0,0,0|1,0,0]=3 1745 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)F)/C)C 1626a_200020676162_100012047268 [0,2,0,0,0,0|1,0,0]=3 1746 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)F)/C)C 527a_200020676162_100012047268 [0,2,0,0,0,0|1,0,0]=3 1747 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)I)/C)C 11a_200020676162_100011204819 [0,2,0,0,0,0|1,0,0]=3 1748 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)I)/C)C 1626a_200020676162_100011204819 [0,2,0,0,0,0|1,0,0]=3 1749 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)I)I)/C)C 527a_200020676162_100011204819 [0,2,0,0,0,0|1,0,0]=3 1750 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)O)C)/C)C 527a_200020676162_100000094094 [0,2,0,0,0,0|1,0,0]=3 1751 B21R1.279054 CC(=CCC/C(=C/CNC(=O)c1cc(cc(c1)O)O)/C)C 527a_200020676162_100000690292 [0,2,0,0,0,0|1,0,0]=3 1752 B21R1.279054 CC(=CCC/C(=C/CO[C@@H](C)c1cc(cc(c1)F)F)/C)C 34a_100012136759_100016991246 [0,2,0,0,0,0|1,0,1]=4 1753 B21R1.279054 CC(=CCC/C(=C/CO[C@@H](C)c1cc(cc(c1)F)F)/C)C 7a_100012136759_100016991246 [0,2,0,0,0,0|1,0,1]=4 1754 B21R1.1122183 C#Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100011997762 [0,2,0,0,0,0|1,0,0]=3 1755 B21R1.1122183 C#Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011997762 [0,2,0,0,0,0|1,0,0]=3 1756 B21R1.1122183 C#Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011997762 [0,2,0,0,0,0|1,0,0]=3 1757 B21R1.1122183 C=Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100011215009 [0,2,0,0,0,0|1,0,0]=3 1758 B21R1.1122183 C=Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011215009 [0,2,0,0,0,0|1,0,0]=3 1759 B21R1.1122183 C=Cc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011215009 [0,2,0,0,0,0|1,0,0]=3 1760 B21R1.1122183 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C#N)/C)C 11a_200020676162_100000183950 [0,2,0,0,0,0|1,0,0]=3 1761 B21R1.1122183 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C#N)/C)C 1626a_200020676162_100000183950 [0,2,0,0,0,0|1,0,0]=3 1762 B21R1.1122183 CC(=CCC/C(=C/CNC(=O)c1cccc(c1)C#N)/C)C 527a_200020676162_100000183950 [0,2,0,0,0,0|1,0,0]=3 1763 B21R1.1122183 CCc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100011933908 [0,2,0,0,0,0|1,0,0]=3 1764 B21R1.1122183 CCc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011933908 [0,2,0,0,0,0|1,0,0]=3 1765 B21R1.1122183 CCc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011933908 [0,2,0,0,0,0|1,0,0]=3 1766 B21R1.1122183 COc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100000188888 [0,2,0,0,0,0|1,0,0]=3 1767 B21R1.1122183 COc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100000188888 [0,2,0,0,0,0|1,0,0]=3 1768 B21R1.1122183 COc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100000188888 [0,2,0,0,0,0|1,0,0]=3 1769 B21R1.1122183 COc1cccc(c1)C(C)OC/C=C(\C)/CCC=C(C)C 34a_100000246466_100016991246 [0,2,0,0,0,0|1,0,1]=4 1770 B21R1.1122183 COc1cccc(c1)C(C)OC/C=C(\C)/CCC=C(C)C 7a_100000246466_100016991246 [0,2,0,0,0,0|1,0,1]=4 1771 B21R1.1122183 CSc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 11a_200020676162_100011217804 [0,2,0,0,0,0|1,0,0]=3 1772 B21R1.1122183 CSc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 1626a_200020676162_100011217804 [0,2,0,0,0,0|1,0,0]=3 1773 B21R1.1122183 CSc1cccc(c1)C(=O)NC/C=C(\C)/CCC=C(C)C 527a_200020676162_100011217804 [0,2,0,0,0,0|1,0,0]=3 1774 B19R1.6901 C=Cc1cccc(c1)NC/C=C(\C)/CCC=C(C)C 34a_100011827668_100016991246 [0,0,1,1,0,0|2,0,0]=4 1775 B19R1.6901 C=Cc1cccc(c1)OC/C=C(\C)/CCC=C(C)C 34a_100011309434_100016991246 [0,0,1,1,0,0|1,0,0]=3 1776 B19R1.6901 C=Cc1cccc(c1)OC/C=C(\C)/CCC=C(C)C 7a_100011309434_100016991246 [0,0,1,1,0,0|1,0,0]=3 1777 B19R1.20521 CC(=CCC/C(=C/COc1cccccc1=O)/C)C 34a_100000036025_100016991246 [0,0,1,1,0,0|2,0,0]=4 1778 B19R1.20521 CC(=CCC/C(=C/COc1cccccc1=O)/C)C 7a_100000036025_100016991246 [0,0,1,1,0,0|2,0,0]=4 1779 B19R1.7516 C=Cc1ccccc1NC/C=C(\C)/CCC=C(C)C 34a_100012022501_100016991246 [0,0,1,1,0,0|2,0,0]=4 1780 B19R2.4369 CC1=CCCN(C1)CCOC(=O)c2ccccc2 269982a_100000725631_100009812718 [1,0,0,1,0,0|1,0,1]=4 1781 B19R2.4369 CC1=CCCN(C1)CCOC(=O)c2ccccc2 34a_100000725631_100009812718 [1,0,0,1,0,0|1,0,1]=4 1782 B19R2.113830 O=C(OCCC(=O)C1CC=CC1)c2ccccc2 1458a_100000759439_100000184176 [1,0,0,1,0,0|1,0,1]=4 1783 B19R2.11850 CC1=CCN(CC1)CCOC(=O)c2ccccc2 269982a_100000693516_100009812718 [0,0,0,1,1,0|1,0,1]=4 1784 B19R2.11850 CC1=CCN(CC1)CCOC(=O)c2ccccc2 34a_100000693516_100009812718 [0,0,0,1,1,0|1,0,1]=4 1785 B19R2.216776 CC(=CCC(=O)C=C1OC(=O)c2c1cccc2)C 1458a_200000693922_100000761012 [0,0,0,1,1,0|1,0,1]=4 1786 B19R2.216776 CC(=CCC(=O)CC1OC(=O)c2c1cccc2)C 1458a_100000185305_100000761012 [0,0,0,1,1,0|1,0,1]=4 1787 B21R2.22435 CC(=CCCC(=Cc1noc(n1)c2ccccc2)C)C 270196a_200016990163_100000185807 [0,0,0,1,0,1|1,0,1]=4 1788 B21R2.26604530 CC(=CCC/C(=C/COCC1Cc2c1cccc2)/C)C 34a_100012476685_100016991246 [0,0,0,1,0,1|1,0,1]=4 1789 B21R2.26604530 CC(=CCC/C(=C/COCC1Cc2c1cccc2)/C)C 7a_100012476685_100016991246 [0,0,0,1,0,1|1,0,1]=4 1790 B21R2.255285 CC(=CCC/C(=C/CNc1nc2ccccc2[nH]1)/C)C 27a_200020676162_100009814255 [0,0,0,1,0,1|2,0,0]=4 1791 B21R2.255285 CC(=CCC/C(=C/CNc1nc2ccccc2s1)/C)C 27a_200020676162_100000751744 [0,0,0,1,0,1|1,1,0]=4 1792 B21R2.255285 CC(=CCC/C(=C/COC1Cc2ccccc2C1)/C)C 34a_100011215286_100016991246 [0,0,0,1,0,1|1,0,1]=4 1793 B21R2.255285 CC(=CCC/C(=C/CSc1cc2ccccc2[nH]1)/C)C 62a_100016991246_100010232065 [0,0,0,1,0,1|1,1,0]=4 1794 B21R2.255285 CC(=CCC/C(=C/CSc1nc2ccccc2[nH]1)/C)C 62a_100016991246_100009814255 [0,0,0,1,0,1|1,1,0]=4 1795 B21R2.255285 CC(=CCC/C(=C\COC1Cc2ccccc2C1)/C)C 34a_100016990311_100000753484 [0,0,0,1,0,1|1,0,1]=4 1796 B21R2.255285 CC(=CCC/C(=C\COC1Cc2ccccc2C1)/C)C 7a_100016990311_100000753484 [0,0,0,1,0,1|1,0,1]=4 1797 B21R2.19161 CC1=CCC(CC1)C(=O)CCOC(=O)c2ccccc2 1458a_100000137427_100000184176 [0,1,0,1,0,0|1,0,1]=4 1798 B21R2.181 CC(=CCC/C(=C/COC1CCc2c1cccc2)/C)C 34a_100000212247_100016991246 [0,1,0,1,0,0|1,0,1]=4 1799 B21R2.181 CC(=CCC/C(=C/COC1CCc2c1cccc2)/C)C 7a_100000212247_100016991246 [0,1,0,1,0,0|1,0,1]=4 1800 B21R2.181 CC(=CCC/C(=C/COc1csc2c1cccc2)/C)C 34a_100000077758_100016991246 [0,1,0,1,0,0|0,1,0]=3 1801 B21R2.181 CC(=CCC/C(=C/COc1csc2c1cccc2)/C)C 7a_100000077758_100016991246 [0,1,0,1,0,0|0,1,0]=3 1802 B21R2.181 CC(=CCC/C(=C/CSc1n[nH]c2c1cccc2)/C)C 62a_100016991246_100000050141 [0,1,0,1,0,0|1,1,0]=4 1803 B21R2.181 CC(=CCC/C(=C/CSc1noc2c1cccc2)/C)C 62a_100016991246_200000703156 [0,1,0,1,0,0|0,1,1]=4 1804 B21R2.181 CC(=CCC/C(=C/CSc1noc2c1cccc2)/C)C 62a_200000703156_100016991246 [0,1,0,1,0,0|0,1,1]=4 1805 B17R1.679 CC(=CCCSCCC(=O)c1ccccc1)C 62a_100000750707_100011217483 [1,0,0,0,1,0|1,0,1]=4 1806 B17R1.679 CC(=CCCSCCC(=O)c1ccccc1)C 62a_100011217483_100000750707 [1,0,0,0,1,0|1,0,1]=4 1807 B17R1.679 CC(=CCCSCOC(=O)c1ccccc1)C 62a_100000073877_100011217483 [1,0,0,0,1,0|1,0,0]=3 1808 B17R1.679 CC(=CCCSCOC(=O)c1ccccc1)C 62a_100011217483_100000073877 [1,0,0,0,1,0|1,0,0]=3 1809 B17R1.679 CC(=CCNCCOC(=O)c1ccccc1)C 34a_100000718196_100009812718 [1,0,0,0,1,0|1,0,1]=4 1810 B17R1.679 CC(=CCOCCOC(=O)c1ccccc1)C 34a_100000753907_100009812718 [1,0,0,0,1,0|1,0,1]=4 1811 B17R1.679 CC(=CCOCCOC(=O)c1ccccc1)C 7a_100000025465_100000761012 [1,0,0,0,1,0|1,0,1]=4 1812 B17R1.679 CC(=CCSCCOC(=O)c1ccccc1)C 62a_100000761012_100009812718 [1,0,0,0,1,0|1,0,1]=4 1813 B17R1.679 CC(=CCSCCOC(=O)c1ccccc1)C 62a_100009812718_100000761012 [1,0,0,0,1,0|1,0,1]=4 1814 B17R1.16379 CC(=CCC/C(=C/COCc1ccco1)/C)C 34a_100000210059_100016991246 [1,0,0,0,1,0|1,0,1]=4 1815 B17R1.16379 CC(=CCC/C(=C/COCc1cccs1)/C)C 34a_100000211240_100016991246 [1,0,0,0,1,0|1,0,1]=4 1816 B17R1.16379 CC(=CCC/C(=C/COCc1ccoc1)/C)C 34a_100011215357_100016991246 [1,0,0,0,1,0|1,0,1]=4 1817 B17R1.16379 CC(=CCC/C(=C/COCc1ccsc1)/C)C 34a_100011215551_100016991246 [1,0,0,0,1,0|1,0,1]=4 1818 B17R1.16379 CC(=CCC/C(=C\COCc1ccsc1)/C)C 34a_100016990311_100011261437 [1,0,0,0,1,0|1,0,1]=4 1819 B17R1.16379 CC(=CCC/C(=C\COCc1ccsc1)/C)C 7a_100016990311_100011261437 [1,0,0,0,1,0|1,0,1]=4 1820 B17R1.16611 CC(=CCC/C(=C/CNc1ccccc1)/C)C 34a_100000106764_100016991246 [1,0,0,0,1,0|1,0,0]=3 1821 B17R1.16611 CC(=CCC/C(=C/COc1ccccc1)/C)C 34a_100000210340_100016991246 [1,0,0,0,1,0|0,0,0]=2 1822 B17R1.16611 CC(=CCC/C(=C/COc1ccccc1)/C)C 7a_100000210340_100016991246 [1,0,0,0,1,0|0,0,0]=2 1823 B17R1.16611 CC(=CCC/C(=C/COc1cccnc1)/C)C 34a_100000210849_100016991246 [1,0,0,0,1,0|1,0,0]=3 1824 B17R1.16611 CC(=CCC/C(=C/COc1cccnc1)/C)C 7a_100000210849_100016991246 [1,0,0,0,1,0|1,0,0]=3 1825 B17R1.16611 CC(=CCC/C(=C/COc1ccncc1)/C)C 34a_100000212176_100016991246 [1,0,0,0,1,0|1,0,0]=3 1826 B17R1.16611 CC(=CCC/C(=C/COc1ccnnc1)/C)C 34a_100015204005_100016991246 [1,0,0,0,1,0|2,0,0]=4 1827 B17R1.16611 CC(=CCC/C(=C/COc1cncnc1)/C)C 7a_100000754086_100016991246 [1,0,0,0,1,0|2,0,0]=4 1828 B17R1.16611 CC(=CCC/C(=C/CSc1ccccc1)/C)C 62a_100000719477_100016991246 [1,0,0,0,1,0|0,1,0]=3 1829 B17R1.16611 CC(=CCC/C(=C/CSc1ccccc1)/C)C 62a_100016991246_100000041952 [1,0,0,0,1,0|0,1,0]=3 1830 B17R1.16611 CC(=CCC/C(=C/CSc1ccccn1)/C)C 62a_100011216584_100016991246 [1,0,0,0,1,0|1,1,0]=4 1831 B17R1.16611 CC(=CCC/C(=C/CSc1ccccn1)/C)C 62a_100016991246_100011216584 [1,0,0,0,1,0|1,1,0]=4 1832 B17R1.16611 CC(=CCC/C(=C/CSc1cccnc1)/C)C 62a_100000210063_100016991246 [1,0,0,0,1,0|1,1,0]=4 1833 B17R1.16611 CC(=CCC/C(=C/CSc1cccnc1)/C)C 62a_100016991246_100000210063 [1,0,0,0,1,0|1,1,0]=4 1834 B17R1.16611 CC(=CCC/C(=C/CSc1ccncc1)/C)C 62a_100000728582_100016991246 [1,0,0,0,1,0|1,1,0]=4 1835 B17R1.16611 CC(=CCC/C(=C/CSc1ccncc1)/C)C 62a_100016991246_100000728582 [1,0,0,0,1,0|1,1,0]=4 1836 B17R1.16611 CC(=CCCC(=O)C/C=C/c1ccccc1)C 1458a_100011219626_100011217483 [1,0,0,0,1,0|2,0,0]=4 1837 B17R1.16611 CC(=CCCC(=O)CCOc1ccccc1)C 1458a_100000182761_100011217483 [1,0,0,0,1,0|1,0,1]=4 1838 B17R1.16611 CC(=CCCC(=O)COCc1ccccc1)C 1458a_100000230186_100011217483 [1,0,0,0,1,0|1,0,1]=4 1839 B17R1.16611 CC(=CCCC(C)CCOc1ccccc1)C 34a_100000210340_100009814015 [1,0,0,0,1,0|0,0,2]=4 1840 B17R1.16611 CC(=CCCC(C)CCOc1ccccc1)C 7a_100000210340_100009814015 [1,0,0,0,1,0|0,0,2]=4 1841 B17R1.16611 CC(=CCCN(C)CCOc1ccccc1)C 2230a_100000184383_100011217483 [1,0,0,0,1,0|1,0,1]=4 1842 B17R1.16611 CC(=CCCN(C)CCOc1ccccc1)C 269982a_100000184383_100011217483 [1,0,0,0,1,0|1,0,1]=4 1843 B17R1.1327 C=C(C)CCC(=O)COC(=O)c1ccccc1 1458a_200000688413_100000073877 [0,0,0,0,2,0|1,0,1]=4 1844 B17R1.1327 CC(=CCC(=O)CCC(=O)c1ccccc1)C 1458a_100011220947_100000750707 [0,0,0,0,2,0|1,0,1]=4 1845 B17R1.1327 CC(=CCC(=O)CNC(=O)c1ccccc1)C 1458a_100000182045_100000761012 [0,0,0,0,2,0|2,0,0]=4 1846 B17R1.1327 CC(=CCC(=O)COC(=O)c1ccccc1)C 1458a_100011220947_100000073877 [0,0,0,0,2,0|1,0,0]=3 1847 B17R1.1327 CC(C)CCC(=O)COC(=O)c1ccccc1 1458a_100000181311_100000073877 [0,0,0,0,2,0|1,0,1]=4 1848 B17R1.1327 CC(C)CCN(C)COC(=O)c1ccccc1 269982a_100000742789_100000073877 [0,0,0,0,2,0|1,0,1]=4 1849 B17R1.1327 CN(C)CCN(C)COC(=O)c1ccccc1 269982a_100000225618_100000073877 [0,0,0,0,2,0|2,0,0]=4 1850 B17R1.1327 C[S+](C)CCC(=O)COC(=O)c1ccccc1 1458a_100009452791_100000073877 [0,0,0,0,2,0|2,0,0]=4 1851 B17R1.8305 CC(=CC(=O)CCOC(=O)c1ccccc1)C 1458a_100000211388_100000184176 [0,0,0,0,2,0|1,0,1]=4 1852 B17R1.675 CC(=CCCC(=O)C=C(C)c1ccccc1)C 1458a_100000743005_100011217483 [0,0,0,0,2,0|2,0,0]=4 1853 B19R1.11067 CC(=CCCSCCCOC(=O)c1ccccc1)C 62a_100011217483_200009892979 [1,0,0,0,0,1|0,0,2]=4 1854 B19R1.11067 CC(=CCCSCCCOC(=O)c1ccccc1)C 62a_200009892979_100011217483 [1,0,0,0,0,1|0,0,2]=4 1855 B19R1.11067 CC(=CCNCCCCOC(=O)c1ccccc1)C 34a_100000718196_100000039408 [1,0,0,0,0,1|0,0,2]=4 1856 B19R1.11067 CC(=CCOCCCCOC(=O)c1ccccc1)C 34a_100000753907_100000039408 [1,0,0,0,0,1|0,0,2]=4 1857 B19R1.11067 CC(=CCSCCCCOC(=O)c1ccccc1)C 62a_100000039408_100000761012 [1,0,0,0,0,1|0,0,2]=4 1858 B19R1.11067 CC(=CCSCCCCOC(=O)c1ccccc1)C 62a_100000761012_100000039408 [1,0,0,0,0,1|0,0,2]=4 1859 B19R1.26149 CC(=CCC/C(=C/CNCCc1ccccc1)/C)C 2230a_100000106460_100016991246 [1,0,0,0,0,1|1,0,1]=4 1860 B19R1.26149 CC(=CCC/C(=C/CNCCc1ccccc1)/C)C 2230a_200020676162_100000765856 [1,0,0,0,0,1|1,0,1]=4 1861 B19R1.26149 CC(=CCC/C(=C/CNCCc1ccccc1)/C)C 34a_100000106460_100016991246 [1,0,0,0,0,1|1,0,1]=4 1862 B19R1.26149 CC(=CCC/C(=C/CNCCc1ccccc1)/C)C 34a_200020676162_100000765856 [1,0,0,0,0,1|1,0,1]=4 1863 B19R1.26149 CC(=CCC/C(=C/CNCSc1ccccc1)/C)C 2230a_200020676162_100011218342 [1,0,0,0,0,1|1,0,1]=4 1864 B19R1.26149 CC(=CCC/C(=C/COCCc1ccccc1)/C)C 34a_100000210268_100016991246 [1,0,0,0,0,1|0,0,1]=3 1865 B19R1.26149 CC(=CCC/C(=C/COCCc1ccccc1)/C)C 7a_100000210268_100016991246 [1,0,0,0,0,1|0,0,1]=3 1866 B19R1.26149 CC(=CCC/C(=C/COCCc1ccccn1)/C)C 34a_100000210271_100016991246 [1,0,0,0,0,1|1,0,1]=4 1867 B19R1.26149 CC(=CCC/C(=C/COCCc1cccnc1)/C)C 34a_100011217484_100016991246 [1,0,0,0,0,1|1,0,1]=4 1868 B19R1.26149 CC(=CCC/C(=C/COCCc1ccncc1)/C)C 34a_100011216225_100016991246 [1,0,0,0,0,1|1,0,1]=4 1869 B19R1.26149 CC(=CCC/C(=C/CSCCc1ccccc1)/C)C 62a_100000765856_100016991246 [1,0,0,0,0,1|0,1,1]=4 1870 B19R1.26149 CC(=CCC/C(=C/CSCCc1ccccc1)/C)C 62a_100016991246_100011218657 [1,0,0,0,0,1|0,1,1]=4 1871 B19R1.26149 CC(=CCC/C(=C\COCCc1ccccc1)/C)C 34a_100016990311_100000765856 [1,0,0,0,0,1|0,0,1]=3 1872 B19R1.26149 CC(=CCC/C(=C\COCCc1ccccc1)/C)C 7a_100016990311_100000765856 [1,0,0,0,0,1|0,0,1]=3 1873 B19R1.26149 CC(=CCC/C(=C\COCCc1ccccn1)/C)C 7a_100016990311_100015183660 [1,0,0,0,0,1|1,0,1]=4 1874 B19R1.26149 CC(=CCC/C(=C\COCCc1cccnc1)/C)C 7a_100016990311_200011713674 [1,0,0,0,0,1|1,0,1]=4 1875 B19R1.26149 CC(=CCC/C(=C\COCCc1ccncc1)/C)C 7a_100016990311_100000723409 [1,0,0,0,0,1|1,0,1]=4 1876 B19R1.26144 CC(=CCC/C(=C/CNCC(=O)c1cccs1)/C)C 2230a_200020676162_100000211436 [0,0,0,0,1,1|2,0,0]=4 1877 B19R1.26144 CC(=CCC/C(=C/CNCC(=O)c1ccsc1)/C)C 2230a_200020676162_100011219462 [0,0,0,0,1,1|2,0,0]=4 1878 B19R1.26144 CC(=CCC/C(=C/CNCC(=O)c1ccsc1)/C)C 34a_200020676162_100011219462 [0,0,0,0,1,1|2,0,0]=4 1879 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccc[nH]1)/C)C 62a_100016991246_200011262396 [0,0,0,0,1,1|1,1,0]=4 1880 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccc[nH]1)/C)C 62a_200011262396_100016991246 [0,0,0,0,1,1|1,1,0]=4 1881 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccco1)/C)C 62a_100000211439_100016991246 [0,0,0,0,1,1|1,1,0]=4 1882 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccco1)/C)C 62a_100016991246_100000211439 [0,0,0,0,1,1|1,1,0]=4 1883 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1cccs1)/C)C 62a_100000211436_100016991246 [0,0,0,0,1,1|1,1,0]=4 1884 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1cccs1)/C)C 62a_100016991246_100000211436 [0,0,0,0,1,1|1,1,0]=4 1885 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccsc1)/C)C 62a_100011219462_100016991246 [0,0,0,0,1,1|1,1,0]=4 1886 B19R1.26144 CC(=CCC/C(=C/CSCC(=O)c1ccsc1)/C)C 62a_100016991246_100011219462 [0,0,0,0,1,1|1,1,0]=4 1887 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1ccc[nH]1)/C)C 7a_100016990311_200011262396 [0,0,0,0,1,1|1,0,0]=3 1888 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1ccco1)/C)C 7a_100016990311_100000211439 [0,0,0,0,1,1|1,0,0]=3 1889 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1cccs1)/C)C 7a_100016990311_100000211436 [0,0,0,0,1,1|1,0,0]=3 1890 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1ccsc1)/C)C 34a_100016990311_100011219462 [0,0,0,0,1,1|1,0,0]=3 1891 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1ccsc1)/C)C 7a_100016990311_100011219462 [0,0,0,0,1,1|1,0,0]=3 1892 B19R1.26144 CC(=CCC/C(=C\COCC(=O)c1nccs1)/C)C 7a_100016990311_100000718653 [0,0,0,0,1,1|2,0,0]=4 1893 B19R1.26144 CC(=CCC/C(=C\COCC(=O)n1cccn1)/C)C 7a_100016990311_100000077511 [0,0,0,0,1,1|2,0,0]=4 1894 B21R1.35001 CC(=CCC/C(=C/CNCCC(=O)c1ccccc1)/C)C 2230a_200020676162_100000750707 [0,0,0,0,0,2|1,0,0]=3 1895 B21R1.35001 CC(=CCC/C(=C/CNCCS(=O)c1ccccc1)/C)C 2230a_200020676162_100000740319 [0,0,0,0,0,2|2,0,0]=4 1896 B21R1.35001 CC(=CCC/C(=C/COCC[C@H](N)c1ccccc1)/C)C 34a_100025705951_100016991246 [0,0,0,0,0,2|1,0,1]=4 1897 B21R1.35001 CC(=CCC/C(=C/CSCCC(=O)c1ccccc1)/C)C 62a_100000750707_100016991246 [0,0,0,0,0,2|0,1,0]=3 1898 B21R1.35001 CC(=CCC/C(=C/CSCCC(=O)c1ccccc1)/C)C 62a_100016991246_100000750707 [0,0,0,0,0,2|0,1,0]=3 1899 B21R1.35001 CC(=CCC/C(=C/CSCCS(=O)c1ccccc1)/C)C 62a_100016991246_100000740319 [0,0,0,0,0,2|1,1,0]=4 1900 B21R1.35001 CC(=CCC/C(=C/CSCOC(=O)c1ccccc1)/C)C 62a_100000073877_100016991246 [0,0,0,0,0,2|0,0,0]=2 1901 B21R1.35001 CC(=CCC/C(=C/CSCOC(=O)c1ccccc1)/C)C 62a_100016991246_100000073877 [0,0,0,0,0,2|0,0,0]=2 1902 B21R1.35001 CC(=CCC/C(=C\COCCC(=O)c1ccccc1)/C)C 7a_100016990311_100000750707 [0,0,0,0,0,2|0,0,0]=2 1903 B21R1.35001 CC(=CCC/C(=C\COCCS(=O)c1ccccc1)/C)C 7a_100016990311_100000740319 [0,0,0,0,0,2|1,0,0]=3 1904 B21R1.35001 CC(=CCC/C(=C\COCC[C@@H](O)c1ccccc1)/C)C 34a_100016990311_100000729684 [0,0,0,0,0,2|0,0,2]=4 1905 B21R1.35001 CC(=CCC/C(=C\COCC[C@@H](O)c1ccccc1)/C)C 7a_100016990311_100000729684 [0,0,0,0,0,2|0,0,2]=4 1906 B21R1.35001 CC(=CCC/C(=C\COCOC(=O)c1ccccc1)/C)C 7a_100016990311_100000073877 [0,0,0,0,0,2|0,0,0]=2 1907 B21R1.35001 CC(=CCCC(C)CCOCCC(=O)c1ccccc1)C 7a_100000017536_100000750707 [0,0,0,0,0,2|0,0,2]=4 1908 B21R1.35001 CC(=CCCC(C)CCOCOC(=O)c1ccccc1)C 7a_100000017536_100000073877 [0,0,0,0,0,2|0,0,2]=4 1909 B21R1.35001 CC(=CCCC(C)CCSCOC(=O)c1ccccc1)C 62a_100000073877_100009814015 [0,0,0,0,0,2|0,0,2]=4 1910 B21R1.35001 CC(=CCCC(C)CCSCOC(=O)c1ccccc1)C 62a_100009814015_100000073877 [0,0,0,0,0,2|0,0,2]=4 1911 B21R1.35001 CC(=CCCC(C)OCCCOC(=O)c1ccccc1)C 34a_100102619829_200009892979 [0,0,0,0,0,2|0,0,2]=4 1912 B21R1.35001 CC(=CCCC(C)OCCCOC(=O)c1ccccc1)C 7a_100102619829_200009892979 [0,0,0,0,0,2|0,0,2]=4 1913 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Cc1ccccc1)/C)C 2230a_200020676162_100000233483 [0,0,0,0,0,2|1,0,0]=3 1914 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Nc1ccccc1)/C)C 2230a_200020676162_100000182850 [0,0,0,0,0,2|1,0,0]=3 1915 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Nc1ccccc1)/C)C 34a_200020676162_100000182850 [0,0,0,0,0,2|1,0,0]=3 1916 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Nc1ccccn1)/C)C 2230a_200020676162_100020662008 [0,0,0,0,0,2|2,0,0]=4 1917 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Nc1ccncc1)/C)C 2230a_200020676162_100000754145 [0,0,0,0,0,2|2,0,0]=4 1918 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Oc1ccccc1)/C)C 2230a_200020676162_100009813826 [0,0,0,0,0,2|1,0,0]=3 1919 B21R1.35002 CC(=CCC/C(=C/CNCC(=O)Oc1ccccc1)/C)C 34a_200020676162_100009813826 [0,0,0,0,0,2|1,0,0]=3 1920 B21R1.35002 CC(=CCC/C(=C/COC/C(=C/c1ccccc1)/C)/C)C 34a_200025717232_100016991246 [0,0,0,0,0,2|1,0,0]=3 1921 B21R1.35002 CC(=CCC/C(=C/COC/C(=C/c1ccccc1)/C)/C)C 7a_200025717232_100016991246 [0,0,0,0,0,2|1,0,0]=3 1922 B21R1.35002 CC(=CCC/C(=C/COCC(=O)Nc1ccccc1)/C)C 34a_100000246334_100016991246 [0,0,0,0,0,2|0,0,0]=2 1923 B21R1.35002 CC(=CCC/C(=C/COCC(C)Cc1ccccc1)/C)C 34a_100012125295_100016991246 [0,0,0,0,0,2|1,0,1]=4 1924 B21R1.35002 CC(=CCC/C(=C/COCC(C)Cc1ccccc1)/C)C 7a_100012125295_100016991246 [0,0,0,0,0,2|1,0,1]=4 1925 B21R1.35002 CC(=CCC/C(=C/COCC(C)Oc1ccccc1)/C)C 34a_200000036796_100016991246 [0,0,0,0,0,2|1,0,1]=4 1926 B21R1.35002 CC(=CCC/C(=C/COCC(C)Oc1ccccc1)/C)C 7a_200000036796_100016991246 [0,0,0,0,0,2|1,0,1]=4 1927 B21R1.35002 CC(=CCC/C(=C/COCC(N)Cc1ccccc1)/C)C 34a_100000739027_100016991246 [0,0,0,0,0,2|1,0,1]=4 1928 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Cc1ccccc1)/C)C 62a_100000233483_100016991246 [0,0,0,0,0,2|0,1,0]=3 1929 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Cc1ccccc1)/C)C 62a_100016991246_100000233483 [0,0,0,0,0,2|0,1,0]=3 1930 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Nc1ccccc1)/C)C 62a_100012148978_100016991246 [0,0,0,0,0,2|0,1,0]=3 1931 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Nc1ccccc1)/C)C 62a_100016991246_100000182850 [0,0,0,0,0,2|0,1,0]=3 1932 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Nc1ccccn1)/C)C 62a_100016991246_100020662008 [0,0,0,0,0,2|1,1,0]=4 1933 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Nc1ccccn1)/C)C 62a_100020662008_100016991246 [0,0,0,0,0,2|1,1,0]=4 1934 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Nc1ccncc1)/C)C 62a_100016991246_100000754145 [0,0,0,0,0,2|1,1,0]=4 1935 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Oc1ccccc1)/C)C 62a_100009813826_100016991246 [0,0,0,0,0,2|0,1,0]=3 1936 B21R1.35002 CC(=CCC/C(=C/CSCC(=O)Oc1ccccc1)/C)C 62a_100016991246_100009813826 [0,0,0,0,0,2|0,1,0]=3 1937 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Cc1ccccc1)/C)C 7a_100016990311_100000233483 [0,0,0,0,0,2|0,0,0]=2 1938 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Nc1ccccc1)/C)C 34a_100016990311_100000182850 [0,0,0,0,0,2|0,0,0]=2 1939 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Nc1ccccc1)/C)C 7a_100016990311_100000182850 [0,0,0,0,0,2|0,0,0]=2 1940 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Nc1ccccn1)/C)C 7a_100016990311_100020662008 [0,0,0,0,0,2|1,0,0]=3 1941 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Nc1ccncc1)/C)C 7a_100016990311_100000754145 [0,0,0,0,0,2|1,0,0]=3 1942 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Nc1ncccn1)/C)C 7a_100016990311_100000183248 [0,0,0,0,0,2|2,0,0]=4 1943 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Oc1ccccc1)/C)C 34a_100016990311_100009813826 [0,0,0,0,0,2|0,0,0]=2 1944 B21R1.35002 CC(=CCC/C(=C\COCC(=O)Oc1ccccc1)/C)C 7a_100016990311_100009813826 [0,0,0,0,0,2|0,0,0]=2 1945 B21R1.35002 CC(=CCC/C(=C\COC[C@@H](O)Cc1ccccc1)/C)C 34a_100016990311_100000729385 [0,0,0,0,0,2|0,0,2]=4 1946 B21R1.35002 CC(=CCC/C(=C\COC[C@@H](O)Cc1ccccc1)/C)C 7a_100016990311_100000729385 [0,0,0,0,0,2|0,0,2]=4 1947 B21R1.35002 CC(=CCCC(=CC=NNC(=O)Cc1ccccc1)C)C 4a_100000182964_100000211119 [0,0,0,0,0,2|1,0,1]=4 1948 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Cc1ccccc1)C 7a_100000017536_100000233483 [0,0,0,0,0,2|0,0,2]=4 1949 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Nc1ccccc1)C 34a_100000017536_100000182850 [0,0,0,0,0,2|0,0,2]=4 1950 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Nc1ccccc1)C 34a_100000246334_100009814015 [0,0,0,0,0,2|0,0,2]=4 1951 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Nc1ccccc1)C 7a_100000017536_100000182850 [0,0,0,0,0,2|0,0,2]=4 1952 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Oc1ccccc1)C 34a_100000017536_100009813826 [0,0,0,0,0,2|0,0,2]=4 1953 B21R1.35002 CC(=CCCC(C)CCOCC(=O)Oc1ccccc1)C 7a_100000017536_100009813826 [0,0,0,0,0,2|0,0,2]=4 1954 B21R1.35000 CC(=CCC/C(=C/CNC(=O)C=Cc1ccccc1)/C)C 11a_200020676162_100000210462 [0,0,0,0,0,2|1,0,0]=3 1955 B21R1.35000 CC(=CCC/C(=C/CNC(=O)C=Cc1ccccc1)/C)C 1626a_200020676162_100000210462 [0,0,0,0,0,2|1,0,0]=3 1956 B21R1.35000 CC(=CCC/C(=C/CNC(=O)C=Cc1ccccn1)/C)C 11a_200020676162_100000740811 [0,0,0,0,0,2|2,0,0]=4 1957 B21R1.35000 CC(=CCC/C(=C/CNC(=O)C=Cc1cccnc1)/C)C 11a_200020676162_100000735890 [0,0,0,0,0,2|2,0,0]=4 1958 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccccc1)/C)C 11a_200020676162_100000185753 [0,0,0,0,0,2|1,0,0]=3 1959 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccccc1)/C)C 1626a_200020676162_100000185753 [0,0,0,0,0,2|1,0,0]=3 1960 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccccc1)/C)C 527a_200020676162_100000185753 [0,0,0,0,0,2|1,0,0]=3 1961 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccccn1)/C)C 11a_200020676162_100015195070 [0,0,0,0,0,2|2,0,0]=4 1962 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccccn1)/C)C 527a_200020676162_100015195070 [0,0,0,0,0,2|2,0,0]=4 1963 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1cccnc1)/C)C 11a_200020676162_100000198484 [0,0,0,0,0,2|2,0,0]=4 1964 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1cccnc1)/C)C 1626a_200020676162_100000198484 [0,0,0,0,0,2|2,0,0]=4 1965 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1cccnc1)/C)C 527a_200020676162_100000198484 [0,0,0,0,0,2|2,0,0]=4 1966 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccncc1)/C)C 11a_200020676162_100011225043 [0,0,0,0,0,2|2,0,0]=4 1967 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CCc1ccncc1)/C)C 527a_200020676162_100011225043 [0,0,0,0,0,2|2,0,0]=4 1968 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1ccccc1)/C)C 11a_200020676162_100000186222 [0,0,0,0,0,2|1,0,0]=3 1969 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1ccccc1)/C)C 1626a_200020676162_100000186222 [0,0,0,0,0,2|1,0,0]=3 1970 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1ccccc1)/C)C 527a_200020676162_100000186222 [0,0,0,0,0,2|1,0,0]=3 1971 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1ccccn1)/C)C 1626a_200020676162_100102699861 [0,0,0,0,0,2|2,0,0]=4 1972 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1ccccn1)/C)C 527a_200020676162_100102699861 [0,0,0,0,0,2|2,0,0]=4 1973 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1cccnc1)/C)C 11a_200020676162_100015207166 [0,0,0,0,0,2|2,0,0]=4 1974 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1cccnc1)/C)C 1626a_200020676162_100015207166 [0,0,0,0,0,2|2,0,0]=4 1975 B21R1.35000 CC(=CCC/C(=C/CNC(=O)COc1cccnc1)/C)C 527a_200020676162_100015207166 [0,0,0,0,0,2|2,0,0]=4 1976 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccccc1)/C)C 11a_200020676162_100000211596 [0,0,0,0,0,2|1,0,0]=3 1977 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccccc1)/C)C 1626a_200020676162_100000211596 [0,0,0,0,0,2|1,0,0]=3 1978 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccccc1)/C)C 527a_200020676162_100000211596 [0,0,0,0,0,2|1,0,0]=3 1979 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccccn1)/C)C 11a_200020676162_100000156281 [0,0,0,0,0,2|2,0,0]=4 1980 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccccn1)/C)C 527a_200020676162_100000156281 [0,0,0,0,0,2|2,0,0]=4 1981 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccncc1)/C)C 11a_200020676162_100000211328 [0,0,0,0,0,2|2,0,0]=4 1982 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccncc1)/C)C 1626a_200020676162_100000211328 [0,0,0,0,0,2|2,0,0]=4 1983 B21R1.35000 CC(=CCC/C(=C/CNC(=O)CSc1ccncc1)/C)C 527a_200020676162_100000211328 [0,0,0,0,0,2|2,0,0]=4 1984 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 2708a_100015324214_200020676162 [0,0,0,0,0,2|1,0,0]=3 1985 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 2708a_200020676162_100015324214 [0,0,0,0,0,2|1,0,0]=3 1986 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 273464a_100015324214_200020676162 [0,0,0,0,0,2|1,0,0]=3 1987 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 273464a_200020676162_100015324214 [0,0,0,0,0,2|1,0,0]=3 1988 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 512a_100015324214_200020676162 [0,0,0,0,0,2|1,0,0]=3 1989 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccc1)/C)C 512a_200020676162_100015324214 [0,0,0,0,0,2|1,0,0]=3 1990 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccn1)/C)C 2708a_100000210449_200020676162 [0,0,0,0,0,2|2,0,0]=4 1991 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccn1)/C)C 2708a_200020676162_100000210449 [0,0,0,0,0,2|2,0,0]=4 1992 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccn1)/C)C 273464a_100000210449_200020676162 [0,0,0,0,0,2|2,0,0]=4 1993 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccn1)/C)C 273464a_200020676162_100000210449 [0,0,0,0,0,2|2,0,0]=4 1994 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccccn1)/C)C 512a_200020676162_100000210449 [0,0,0,0,0,2|2,0,0]=4 1995 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 2708a_100000210453_200020676162 [0,0,0,0,0,2|2,0,0]=4 1996 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 2708a_200020676162_100000210453 [0,0,0,0,0,2|2,0,0]=4 1997 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 273464a_100000210453_200020676162 [0,0,0,0,0,2|2,0,0]=4 1998 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 273464a_200020676162_100000210453 [0,0,0,0,0,2|2,0,0]=4 1999 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 512a_100000210453_200020676162 [0,0,0,0,0,2|2,0,0]=4 2000 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1cccnc1)/C)C 512a_200020676162_100000210453 [0,0,0,0,0,2|2,0,0]=4 2001 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccncc1)/C)C 2708a_100000210450_200020676162 [0,0,0,0,0,2|2,0,0]=4 2002 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccncc1)/C)C 2708a_200020676162_100000210450 [0,0,0,0,0,2|2,0,0]=4 2003 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccncc1)/C)C 273464a_100000210450_200020676162 [0,0,0,0,0,2|2,0,0]=4 2004 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccncc1)/C)C 273464a_200020676162_100000210450 [0,0,0,0,0,2|2,0,0]=4 2005 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NCc1ccncc1)/C)C 512a_200020676162_100000210450 [0,0,0,0,0,2|2,0,0]=4 2006 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccccc1)/C)C 273464a_200020676162_100015195140 [0,0,0,0,0,2|1,0,0]=3 2007 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccccc1)/C)C 512a_200020676162_100015195140 [0,0,0,0,0,2|1,0,0]=3 2008 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccccn1)/C)C 273464a_200020676162_100000183288 [0,0,0,0,0,2|2,0,0]=4 2009 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccccn1)/C)C 512a_200020676162_100000183288 [0,0,0,0,0,2|2,0,0]=4 2010 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1cccnc1)/C)C 273464a_200020676162_100000728903 [0,0,0,0,0,2|2,0,0]=4 2011 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1cccnc1)/C)C 512a_200020676162_100000728903 [0,0,0,0,0,2|2,0,0]=4 2012 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccncc1)/C)C 273464a_200020676162_100000698918 [0,0,0,0,0,2|2,0,0]=4 2013 B21R1.35000 CC(=CCC/C(=C/CNC(=O)NNc1ccncc1)/C)C 512a_200020676162_100000698918 [0,0,0,0,0,2|2,0,0]=4 2014 B21R1.35000 CC(=CCC/C(=C/COC(C)C#Cc1ccccc1)/C)C 34a_200000065209_100016991246 [0,0,0,0,0,2|1,0,1]=4 2015 B21R1.35000 CC(=CCC/C(=C/COC(C)C#Cc1ccccc1)/C)C 7a_200000065209_100016991246 [0,0,0,0,0,2|1,0,1]=4 2016 B21R1.35000 CC(=CCC/C(=C/COC(C)COc1ccccc1)/C)C 34a_100000210911_100016991246 [0,0,0,0,0,2|1,0,1]=4 2017 B21R1.35000 CC(=CCC/C(=C/COC(C)COc1ccccc1)/C)C 7a_100000210911_100016991246 [0,0,0,0,0,2|1,0,1]=4 2018 B21R1.35000 CC(=CCC/C(=C/CO[C@@H](C)CCc1ccccc1)/C)C 34a_100009815974_100016991246 [0,0,0,0,0,2|1,0,1]=4 2019 B21R1.35000 CC(=CCC/C(=C/CO[C@@H](C)CCc1ccccc1)/C)C 7a_100009815974_100016991246 [0,0,0,0,0,2|1,0,1]=4 2020 B21R1.35000 CC(=CCCC(=CCCC(=NNc1ccccc1)C)C)C 4a_100015195140_100020644987 [0,0,0,0,0,2|2,0,0]=4