0 B12R0.5 C/C=C/C=C/COCCCCCC 34a_100016283227_100000210314 [0,0,0,0,0,0|2,0,1]=3 1 B12R0.5 C/C=C/C=C/COCCCCCF 34a_100016283227_100000729378 [0,0,0,0,0,0|3,0,1]=4 2 B12R0.5 C/C=C/C=C/COCCCCCO 34a_100016283227_100000746330 [0,0,0,0,0,0|3,0,1]=4 3 B12R0.5 C/C=C/C=C/COCCCCOC 34a_100016283227_100000755781 [0,0,0,0,0,0|3,0,1]=4 4 B12R0.5 C/C=C/C=C/COCCCOCC 34a_100016283227_100012232248 [0,0,0,0,0,0|3,0,1]=4 5 B12R0.5 C/C=C/C=C/COCCOCCC 34a_100016283227_100011215938 [0,0,0,0,0,0|3,0,1]=4 6 B12R0.5 C/C=C/C=C/COCOCCCC 34a_100016283227_100011995733 [0,0,0,0,0,0|3,0,1]=4 7 B12R0.5 C/C=C/CCOCCCCCCC 34a_100016278192_100000210614 [0,0,0,0,0,0|2,0,2]=4 8 B12R0.5 C/C=C/CNCCCCCCCC 34a_100000229939_100102629194 [0,0,0,0,0,0|2,0,2]=4 9 B12R0.5 C/C=C/COCCCCCCCC 34a_100000210232_100102629194 [0,0,0,0,0,0|2,0,2]=4 10 B12R0.5 C/C=C/COCCCCCCCC 34a_100016270725_100000210759 [0,0,0,0,0,0|2,0,2]=4 11 B12R0.5 C/C=C/COCCCCCCCC 7a_100000210232_100102629194 [0,0,0,0,0,0|2,0,2]=4 12 B12R0.5 C/C=C/CSCCCCCCCC 62a_100000210759_100102629194 [0,0,0,0,0,0|2,0,2]=4 13 B12R0.5 C/C=C/CSCCCCCCCC 62a_100102629194_100000210317 [0,0,0,0,0,0|2,0,2]=4 14 B12R0.5 CC/C=C\CNCCCCCCC 2230a_100000229938_100103147603 [0,0,0,0,0,0|2,0,2]=4 15 B12R0.5 CC/C=C\COCCCCCCC 34a_100000210272_100103147603 [0,0,0,0,0,0|2,0,2]=4 16 B12R0.5 CC/C=C\COCCCCCCC 34a_100016268518_100000210614 [0,0,0,0,0,0|2,0,2]=4 17 B12R0.5 CC/C=C\COCCCCCCC 7a_100000210272_100103147603 [0,0,0,0,0,0|2,0,2]=4 18 B12R0.5 CC/C=C\CSCCCCCCC 62a_100000210614_100103147603 [0,0,0,0,0,0|2,0,2]=4 19 B12R0.5 CC/C=C\CSCCCCCCC 62a_100103147603_100000210316 [0,0,0,0,0,0|2,0,2]=4 20 B12R0.5 CC=CC=CC=NNCCCCC 4a_100000694160_100000691131 [0,0,0,0,0,0|3,0,0]=3 21 B12R0.5 CC=CC=CC=NNCCOCC 4a_100000732670_100000691131 [0,0,0,0,0,0|4,0,0]=4 22 B12R0.5 CC=CCNCCCCCCCC 2230a_100000229939_100000070051 [0,0,0,0,0,0|2,0,2]=4 23 B12R0.5 CC=CCNCCCCCCCC 34a_100000229939_100000070051 [0,0,0,0,0,0|2,0,2]=4 24 B12R0.5 CC=CCOCCCCCCCC 34a_100000210232_100000070051 [0,0,0,0,0,0|2,0,2]=4 25 B12R0.5 CC=CCOCCCCCCCC 7a_100000210232_100000070051 [0,0,0,0,0,0|2,0,2]=4 26 B12R0.5 CC=CCSCCCCCCCC 62a_100000070051_100000210317 [0,0,0,0,0,0|2,0,2]=4 27 B12R0.5 CC=CCSCCCCCCCC 62a_100000210759_100000070051 [0,0,0,0,0,0|2,0,2]=4 28 B12R0.5 CCCCCC/C=C/C=C/COC 34a_200028454808_200000210301 [0,0,0,0,0,0|2,0,2]=4 29 B12R0.5 CCCCCC/C=C/C=C/COC 7a_200028454808_200000210301 [0,0,0,0,0,0|2,0,2]=4 30 B12R0.5 CCCCCC/C=C/C=C/CO[13CH3] 34a_200028454808_200025704644 [0,0,0,0,0,0|2,0,2]=4 31 B12R0.5 CCCCCC/C=C/C=C/CO[13CH3] 7a_200028454808_200025704644 [0,0,0,0,0,0|2,0,2]=4 32 B12R0.5 CCCCCC/C=C/COCC=O 34a_200016276170_200009817547 [0,0,0,0,0,0|1,0,3]=4 33 B12R0.5 CCCCCC/C=C/COCC=O 7a_200016276170_200015260668 [0,0,0,0,0,0|1,0,3]=4 34 B12R0.5 CCCCCCCC/C=C/COC 34a_200020667288_200000210301 [0,0,0,0,0,0|2,0,2]=4 35 B12R0.5 CCCCCCCC/C=C/COC 7a_200020667288_200000210301 [0,0,0,0,0,0|2,0,2]=4 36 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 34a_200020667288_200025704644 [0,0,0,0,0,0|2,0,2]=4 37 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 7a_200020667288_200025704644 [0,0,0,0,0,0|2,0,2]=4 38 B12R0.5 CCCCCCCCCNCC=O 2230a_100000212291_200015260668 [0,0,0,0,0,0|1,0,3]=4 39 B12R0.5 CCCCCCCCCNCC=O 34a_100000212291_200009817547 [0,0,0,0,0,0|1,0,3]=4 40 B12R0.5 CCCCCCCCCOCC=O 34a_100000210712_200009817547 [0,0,0,0,0,0|1,0,3]=4 41 B12R0.5 CCCCCCCCCOCC=O 7a_100000210712_200015260668 [0,0,0,0,0,0|1,0,3]=4 42 B12R0.5 CCCCCCCCCSCC=O 62a_200015260668_100000210670 [0,0,0,0,0,0|1,0,3]=4 43 B12R0.5 CCCCCCCNCCCC=O 2230a_100000229938_200011292268 [0,0,0,0,0,0|1,0,3]=4 44 B12R0.5 CCCCCCCOCCCC=O 7a_100000210272_200011292268 [0,0,0,0,0,0|1,0,3]=4 45 B12R0.5 CCCCCCCSCCCC=O 62a_100000210614_200011292268 [0,0,0,0,0,0|1,0,3]=4 46 B12R0.5 CCCCCCCSCCCC=O 62a_200011292268_100000210316 [0,0,0,0,0,0|1,0,3]=4 47 B11R0.3 C/C=C/C=C/COCCCCC 34a_100016283227_100000718602 [1,0,0,0,0,0|1,0,1]=3 48 B11R0.3 C/C=C/C=C/COCCCCF 34a_100016283227_100000729493 [1,0,0,0,0,0|2,0,1]=4 49 B11R0.3 C/C=C/C=C/COCCCCO 34a_100016283227_100011216708 [1,0,0,0,0,0|2,0,1]=4 50 B11R0.3 C/C=C/C=C/COCCCOC 34a_100016283227_100000740836 [1,0,0,0,0,0|2,0,1]=4 51 B11R0.3 C/C=C/C=C/COCCOCC 34a_100016283227_100000210147 [1,0,0,0,0,0|2,0,1]=4 52 B11R0.3 C/C=C/C=C/COCCSCC 34a_100016283227_100000757381 [1,0,0,0,0,0|2,0,1]=4 53 B11R0.3 C/C=C/COCCCCCCC 34a_100000210272_100102629194 [1,0,0,0,0,0|1,0,2]=4 54 B11R0.3 C/C=C/COCCCCCCC 34a_100016270725_100000210614 [1,0,0,0,0,0|1,0,2]=4 55 B11R0.3 C/C=C/COCCCCCCC 7a_100000210272_100102629194 [1,0,0,0,0,0|1,0,2]=4 56 B11R0.3 C/C=C/CSCCCCCCC 62a_100000210614_100102629194 [1,0,0,0,0,0|1,0,2]=4 57 B11R0.3 C/C=C/CSCCCCCCC 62a_100102629194_100000210316 [1,0,0,0,0,0|1,0,2]=4 58 B11R0.3 C=CCCNCCCCCCC 2230a_100000229938_100000754431 [1,0,0,0,0,0|1,0,2]=4 59 B11R0.3 C=CCCNCCCCCCC 2230a_100015191253_100000210681 [1,0,0,0,0,0|1,0,2]=4 60 B11R0.3 C=CCCOCCCCCCC 34a_100000210272_100000754431 [1,0,0,0,0,0|1,0,2]=4 61 B11R0.3 C=CCCOCCCCCCC 34a_100011205117_100000210614 [1,0,0,0,0,0|1,0,2]=4 62 B11R0.3 C=CCCOCCCCCCC 7a_100000210272_100000754431 [1,0,0,0,0,0|1,0,2]=4 63 B11R0.3 C=CCCSCCCCCCC 62a_100000210614_100000754431 [1,0,0,0,0,0|1,0,2]=4 64 B11R0.3 C=CCCSCCCCCCC 62a_100000754431_100000210316 [1,0,0,0,0,0|1,0,2]=4 65 B11R0.3 C=CCNCCCCCCCC 2230a_100000229939_100000210623 [1,0,0,0,0,0|1,0,2]=4 66 B11R0.3 C=CCNCCCCCCCC 2230a_100020586998_100000210759 [1,0,0,0,0,0|1,0,2]=4 67 B11R0.3 C=CCNCCCCCCCC 34a_100000229939_100015514636 [1,0,0,0,0,0|1,0,2]=4 68 B11R0.3 C=CCOCCCCCCCC 34a_100000210232_100015514636 [1,0,0,0,0,0|1,0,2]=4 69 B11R0.3 C=CCOCCCCCCCC 34a_200000210373_100000210759 [1,0,0,0,0,0|1,0,2]=4 70 B11R0.3 C=CCOCCCCCCCC 7a_100000210232_100015514636 [1,0,0,0,0,0|1,0,2]=4 71 B11R0.3 C=CCSCCCCCCCC 62a_100000210623_100000210317 [1,0,0,0,0,0|1,0,2]=4 72 B11R0.3 C=CCSCCCCCCCC 62a_100000210759_100000210623 [1,0,0,0,0,0|1,0,2]=4 73 B11R0.3 CC=CC=CC=NNCCCC 4a_100025702795_100000691131 [1,0,0,0,0,0|3,0,0]=4 74 B11R0.3 CC=CCNCCCCCCC 2230a_100000229938_100000070051 [1,0,0,0,0,0|1,0,2]=4 75 B11R0.3 CC=CCOCCCCCCC 34a_100000210272_100000070051 [1,0,0,0,0,0|1,0,2]=4 76 B11R0.3 CC=CCOCCCCCCC 7a_100000210272_100000070051 [1,0,0,0,0,0|1,0,2]=4 77 B11R0.3 CC=CCSCCCCCCC 62a_100000070051_100000210316 [1,0,0,0,0,0|1,0,2]=4 78 B11R0.3 CC=CCSCCCCCCC 62a_100000210614_100000070051 [1,0,0,0,0,0|1,0,2]=4 79 B11R0.3 CCCCCCCCNCC=O 2230a_100000229939_200015260668 [1,0,0,0,0,0|1,0,2]=4 80 B11R0.3 CCCCCCCCNCC=O 34a_100000229939_200009817547 [1,0,0,0,0,0|1,0,2]=4 81 B11R0.3 CCCCCCCCOCC=O 34a_100000210232_200009817547 [1,0,0,0,0,0|1,0,2]=4 82 B11R0.3 CCCCCCCCOCC=O 7a_100000210232_200015260668 [1,0,0,0,0,0|1,0,2]=4 83 B11R0.3 CCCCCCCCSCC=O 62a_100000210759_200015260668 [1,0,0,0,0,0|1,0,2]=4 84 B11R0.3 CCCCCCCCSCC=O 62a_200015260668_100000210317 [1,0,0,0,0,0|1,0,2]=4 85 B13R0.2 C#CCC(=O)C=CCCCCCCC 1458a_200015332781_100000184674 [0,1,0,0,0,0|1,0,2]=4 86 B13R0.2 C=CCC(=O)C=CCCCCCCC 1458a_200015332781_100000210623 [0,1,0,0,0,0|1,0,1]=3 87 B13R0.2 CC=CC(=O)CCCCCCCCC 1458a_100000210699_100000210670 [0,1,0,0,0,0|1,0,2]=4 88 B13R0.2 CC=CC(=O)NCCCCCCCC 11a_100000229939_100000210699 [0,1,0,0,0,0|2,0,1]=4 89 B13R0.2 CC=CC(=O)NCCCCCCCC 1626a_100000229939_100000210699 [0,1,0,0,0,0|2,0,1]=4 90 B13R0.2 CC=CC(=O)NCCCCCCCC 240690a_100000229939_100000210699 [0,1,0,0,0,0|2,0,1]=4 91 B13R0.2 CCCCCCCC=CC(=O)CC#N 1458a_200015332781_100011214920 [0,1,0,0,0,0|1,0,2]=4 92 B13R0.2 CCCCCCCC=CC(=O)CCC 1458a_200015332781_100000210303 [0,1,0,0,0,0|1,0,2]=4 93 B13R0.2 CCCCCCCC=CC(=O)CCF 1458a_200015332781_100011217306 [0,1,0,0,0,0|1,0,2]=4 94 B13R0.2 CCCCCCCC=CC(=O)CCO 1458a_200015332781_100000211926 [0,1,0,0,0,0|0,0,3]=4 95 B13R0.2 CCCCCCCC=CC(=O)NCC 11a_100015525214_200015332781 [0,1,0,0,0,0|2,0,1]=4 96 B13R0.2 CCCCCCCC=CC(=O)NCC 240690a_100015525214_200015332781 [0,1,0,0,0,0|2,0,1]=4 97 B13R0.2 CCCCCCCC=CC(=O)NNC 22a_100016993582_200015332781 [0,1,0,0,0,0|3,0,0]=4 98 B13R0.2 CCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000210670 [0,1,0,0,0,0|1,0,2]=4 99 B13R0.2 CCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000210670 [0,1,0,0,0,0|1,0,2]=4 100 B13R0.2 CCCCCCCCCC(=O)C=CI 1458a_100016256311_100000210670 [0,1,0,0,0,0|1,0,2]=4 101 B13R0.2 CCCCCCCCNC(=O)C=CBr 1626a_100000229939_100016273825 [0,1,0,0,0,0|2,0,1]=4 102 B13R0.2 CCCCCCCCNC(=O)C=CBr 240690a_100000229939_100016273825 [0,1,0,0,0,0|2,0,1]=4 103 B13R0.2 CCCCCCCCNC(=O)C=CCl 11a_100000229939_200016279998 [0,1,0,0,0,0|2,0,1]=4 104 B13R0.2 CCCCCCCCNC(=O)C=CCl 1626a_100000229939_200016279998 [0,1,0,0,0,0|2,0,1]=4 105 B13R0.2 CCCCCCCCNC(=O)C=CCl 240690a_100000229939_200016279998 [0,1,0,0,0,0|2,0,1]=4 106 B13R0.2 CCCCCCCCNC(=O)C=CI 1626a_100000229939_100016256311 [0,1,0,0,0,0|2,0,1]=4 107 B13R0.54 C/C=C/C=C/COCCCCC(C)C 34a_100016283227_100011216152 [0,1,0,0,0,0|2,0,1]=4 108 B13R0.54 CCCCCCC=CC=NNC(=O)C 4a_100000189765_100016264548 [0,1,0,0,0,0|2,0,1]=4 109 B13R0.54 CCCCCCCCC=NNC(=O)C 4a_100000189765_100011218696 [0,1,0,0,0,0|2,0,1]=4 110 B13R0.54 CCCCCCCCCC=CC(=O)C 1458a_200015352897_200000210301 [0,1,0,0,0,0|0,0,2]=3 111 B13R0.54 CCCCCCCCCC=CC(=O)[13CH3] 1458a_200015352897_200025704644 [0,1,0,0,0,0|0,0,2]=3 112 B13R0.66 C/C=C/CC(=O)C=CCCCCCC 1458a_200015324643_100102629194 [0,1,0,0,0,0|1,0,2]=4 113 B13R0.66 C/C=C/CC(=O)CCCCCCCC 1458a_100000210188_100102629194 [0,1,0,0,0,0|1,0,2]=4 114 B13R0.66 C=CC=CC(=O)CCCCCCCC 1458a_100016291481_100000210759 [0,1,0,0,0,0|1,0,1]=3 115 B13R0.66 C=CC=CC(=O)CCCCCCCO 1458a_100016291481_100000760002 [0,1,0,0,0,0|2,0,1]=4 116 B13R0.66 C=CC=CC(=O)CCCCCCOC 1458a_100016291481_100011998445 [0,1,0,0,0,0|2,0,1]=4 117 B13R0.66 C=CC=CC(=O)NCCCCCCC 1626a_100000229938_100016291481 [0,1,0,0,0,0|2,0,0]=3 118 B13R0.66 C=CC=CC(=O)NCCCCCOC 1626a_100000747528_100016291481 [0,1,0,0,0,0|3,0,0]=4 119 B13R0.66 C=CC=CC(=O)NCCCOCCC 1626a_100011217757_100016291481 [0,1,0,0,0,0|3,0,0]=4 120 B13R0.66 C=CC=CC(=O)NCCSCCCC 1626a_100025743550_100016291481 [0,1,0,0,0,0|3,0,0]=4 121 B13R0.66 CC=CCC(=O)C=CCCCCCC 1458a_200015324643_100000070051 [0,1,0,0,0,0|1,0,2]=4 122 B13R0.66 CC=CCC(=O)CCCCCCCC 1458a_100000210188_100000070051 [0,1,0,0,0,0|1,0,2]=4 123 B13R0.66 CC=CCC(=O)CCCCCCCC 1458a_100121576822_100000210759 [0,1,0,0,0,0|1,0,2]=4 124 B13R0.66 CC=CCC(=O)NCCCCCCC 11a_100000229938_100121576822 [0,1,0,0,0,0|2,0,1]=4 125 B13R0.66 CC=CCC(=O)NCCCCCCC 1626a_100000229938_100121576822 [0,1,0,0,0,0|2,0,1]=4 126 B13R0.66 CC=CCC(=O)NCCCCCCC 240690a_100000229938_100121576822 [0,1,0,0,0,0|2,0,1]=4 127 B13R0.66 CC=CCC(=O)NCCCCCCC 527a_100000229938_100121576822 [0,1,0,0,0,0|2,0,1]=4 128 B13R0.66 CCC=CC(=O)CCCCCCCC 1458a_100000212282_100000210759 [0,1,0,0,0,0|1,0,2]=4 129 B13R0.66 CCC=CC(=O)NCCCCCCC 11a_100000229938_100000212282 [0,1,0,0,0,0|2,0,1]=4 130 B13R0.66 CCC=CC(=O)NCCCCCCC 1626a_100000229938_100000212282 [0,1,0,0,0,0|2,0,1]=4 131 B13R0.66 CCC=CC(=O)NCCCCCCC 240690a_100000229938_100000212282 [0,1,0,0,0,0|2,0,1]=4 132 B13R0.66 CCCCCCCCC(=O)C=COC 1458a_100016268678_100000210759 [0,1,0,0,0,0|2,0,1]=4 133 B13R0.66 CCCCCCCNC(=O)C=COC 1626a_100000229938_100016268678 [0,1,0,0,0,0|3,0,0]=4 134 B13R0.66 CCCCCCCNC(=O)C=COC 240690a_100000229938_100016268678 [0,1,0,0,0,0|3,0,0]=4 135 B13R0.147 CCCCCCCCC=CC(=O)CC 1458a_100015345288_100000210202 [0,1,0,0,0,0|1,0,2]=4 136 B13R0.147 CCCCCCCCC=CC(=O)CF 1458a_100015345288_100015361967 [0,1,0,0,0,0|1,0,2]=4 137 B13R0.147 CCCCCCCCC=CC(=O)NC 11a_106832991635_100015345288 [0,1,0,0,0,0|2,0,1]=4 138 B13R0.147 CCCCCCCCC=CC(=O)NC 1626a_100102657272_100015345288 [0,1,0,0,0,0|2,0,1]=4 139 B13R0.147 CCCCCCCCC=CC(=O)NC 240690a_100102657272_100015345288 [0,1,0,0,0,0|2,0,1]=4 140 B13R0.336 C/C=C/C=C/CCCCCCCOC 34a_100020681108_200000210301 [0,1,0,0,0,0|1,0,1]=3 141 B13R0.336 C/C=C/C=C/CCCCCCCOC 7a_100020681108_200000210301 [0,1,0,0,0,0|1,0,1]=3 142 B13R0.336 C/C=C/C=C/CCCCCCCO[13CH3] 34a_100020681108_200025704644 [0,1,0,0,0,0|1,0,1]=3 143 B13R0.336 C/C=C/C=C/CCCCCCCO[13CH3] 7a_100020681108_200025704644 [0,1,0,0,0,0|1,0,1]=3 144 B13R0.336 C/C=C/C=C/COCCCCCCC 34a_100016283227_100000210614 [0,1,0,0,0,0|1,0,1]=3 145 B13R0.336 C/C=C/C=C/COCCCCCCF 34a_100016283227_100015922095 [0,1,0,0,0,0|2,0,1]=4 146 B13R0.336 C/C=C/C=C/COCCCCCCO 34a_100016283227_100000766143 [0,1,0,0,0,0|2,0,1]=4 147 B13R0.336 C/C=C/C=C/COCCOCCCC 34a_100016283227_100000743108 [0,1,0,0,0,0|2,0,1]=4 148 B13R0.336 CC/C=C/C/C=C/CCOCCCC 34a_200016273837_100000210210 [0,1,0,0,0,0|2,0,1]=4 149 B13R0.336 CC/C=C/C/C=C/CCOCCCC 7a_200016273837_100000210211 [0,1,0,0,0,0|2,0,1]=4 150 B13R0.336 CCC/C=C/C=C/COCCCCC 34a_100016294078_100000718602 [0,1,0,0,0,0|2,0,1]=4 151 B13R0.336 CCC=CC=CC=NNCCCCC 4a_100000694160_100103038579 [0,1,0,0,0,0|3,0,0]=4 152 B13R0.336 CCCCCCC/C=C/C=C/COC 34a_200025756345_200000210301 [0,1,0,0,0,0|0,0,2]=3 153 B13R0.336 CCCCCCC/C=C/C=C/COC 7a_200025756345_200000210301 [0,1,0,0,0,0|0,0,2]=3 154 B13R0.336 CCCCCCC/C=C/C=C/CO[13CH3] 34a_200025756345_200025704644 [0,1,0,0,0,0|0,0,2]=3 155 B13R0.336 CCCCCCC/C=C/C=C/CO[13CH3] 7a_200025756345_200025704644 [0,1,0,0,0,0|0,0,2]=3 156 B13R0.336 CCCCCCCC=CC=NNCC 4a_100000756455_200016991098 [0,1,0,0,0,0|2,0,1]=4 157 B13R0.338 C#CCCCCCC(=O)C=C/C=C/C 1458a_100000185730_100012094781 [0,1,0,0,0,0|1,0,2]=4 158 B13R0.338 C/C=C/C=C/COC(C)CCCCC 34a_100016283227_200011218191 [0,1,0,0,0,0|2,0,1]=4 159 B13R0.338 C/C=C/C=CC(=NNCCCCC)C 4a_100000694160_100016268696 [0,1,0,0,0,0|3,0,0]=4 160 B13R0.338 C/C=C/C=CC(=O)CCCCCC#N 1458a_100000185730_100009813376 [0,1,0,0,0,0|2,0,1]=4 161 B13R0.338 C/C=C/C=CC(=O)CCCCCCC 1458a_100000185730_100000210614 [0,1,0,0,0,0|1,0,0]=2 162 B13R0.338 C/C=C/C=CC(=O)CCCCCCF 1458a_100000185730_100015922095 [0,1,0,0,0,0|2,0,0]=3 163 B13R0.338 C/C=C/C=CC(=O)CCCCCCO 1458a_100000185730_100000766143 [0,1,0,0,0,0|2,0,0]=3 164 B13R0.338 C/C=C/C=CC(=O)CCOCCCC 1458a_100000185730_100000743108 [0,1,0,0,0,0|2,0,0]=3 165 B13R0.338 C/C=C/C=CC(=O)CCOCCOC 1458a_100000185730_100000695917 [0,1,0,0,0,0|3,0,0]=4 166 B13R0.338 C/C=C/C=CC(=O)NCCCCCC 11a_100000210581_100000185730 [0,1,0,0,0,0|2,0,0]=3 167 B13R0.338 C/C=C/C=CC(=O)NCCCCCC 1626a_100000210581_100000185730 [0,1,0,0,0,0|2,0,0]=3 168 B13R0.338 C/C=C/C=CC(=O)NCCCCCC 240690a_100000210581_100000185730 [0,1,0,0,0,0|2,0,0]=3 169 B13R0.338 C/C=C/C=CC(=O)NCCCCCO 240690a_100000762737_100000185730 [0,1,0,0,0,0|3,0,0]=4 170 B13R0.338 C/C=C/C=CC(=O)NCCCOCC 11a_100000210961_100000185730 [0,1,0,0,0,0|3,0,0]=4 171 B13R0.338 C/C=C/C=CC(=O)NCCCOCC 1626a_100000210961_100000185730 [0,1,0,0,0,0|3,0,0]=4 172 B13R0.338 C/C=C/C=CC(=O)NCCCOCC 240690a_100000210961_100000185730 [0,1,0,0,0,0|3,0,0]=4 173 B13R0.338 C/C=C/C=CC(=O)NCCOCCC 1626a_100161115042_100000185730 [0,1,0,0,0,0|3,0,0]=4 174 B13R0.338 C/C=C/C=CC(=O)NCCOCCC 240690a_100161115042_100000185730 [0,1,0,0,0,0|3,0,0]=4 175 B13R0.338 C/C=C/C=CC(=O)NCCSCCC 11a_100020603323_100000185730 [0,1,0,0,0,0|3,0,0]=4 176 B13R0.338 C/C=C/C=CC(=O)NCCSCCC 240690a_100020603323_100000185730 [0,1,0,0,0,0|3,0,0]=4 177 B13R0.338 C/C=C/C=CC(=O)NNCCCCC 22a_100000694160_100000185730 [0,1,0,0,0,0|3,0,0]=4 178 B13R0.338 C=CCCCCCC(=O)C=C/C=C/C 1458a_100000185730_100000700193 [0,1,0,0,0,0|1,0,2]=4 179 B13R0.338 CC/C=C/CC(=O)CCCCCCC 1458a_100016274230_100000210614 [0,1,0,0,0,0|1,0,2]=4 180 B13R0.338 CC/C=C\CC(=O)CCCCCCC 1458a_100000211969_100103147603 [0,1,0,0,0,0|1,0,2]=4 181 B13R0.338 CCCC=CC(=O)CCCCCCC 1458a_100000212230_100000210614 [0,1,0,0,0,0|1,0,2]=4 182 B13R0.338 CCCCCCCC(=O)C=CCOC 1458a_100016285016_100000210614 [0,1,0,0,0,0|2,0,1]=4 183 B13R0.338 CCCCCCCC(=O)C=COCC 1458a_100016266692_100000210614 [0,1,0,0,0,0|2,0,1]=4 184 B13R1.28 BrCCCCOCc1ccccc1 34a_100011216708_100015291786 [0,0,0,1,0,0|3,0,0]=4 185 B13R1.28 BrCCCCOCc1ccccn1 34a_100011216708_100000721315 [0,0,0,1,0,0|3,0,0]=4 186 B13R1.28 BrCCCOCCc1ccccc1 34a_100011217188_100000765856 [0,0,0,1,0,0|3,0,0]=4 187 B13R1.28 BrCCOCCCc1ccccc1 34a_100000211926_100000211621 [0,0,0,1,0,0|3,0,0]=4 188 B13R1.28 C/C=C/C=C/COC1CCCCC1 34a_100016283227_100000210327 [0,0,0,1,0,0|2,0,1]=4 189 B13R1.28 CCCCCC=Cc1ccccc1 271570a_100000062253_100000210277 [0,0,0,1,0,0|1,0,2]=4 190 B13R1.28 CCCCCC=Cc1ccccn1 271570a_100000062253_100011216584 [0,0,0,1,0,0|1,0,2]=4 191 B13R1.28 CCCCCCNc1ccccc1 34a_100000106764_100000210314 [0,0,0,1,0,0|2,0,0]=3 192 B13R1.28 CCCCCCNc1cccnn1 27a_100000210581_100016991348 [0,0,0,1,0,0|3,0,0]=4 193 B13R1.28 CCCCCCNc1ccncn1 27a_100000210581_100000703185 [0,0,0,1,0,0|3,0,0]=4 194 B13R1.28 CCCCCCNc1cnccn1 27a_100000210581_100000211759 [0,0,0,1,0,0|3,0,0]=4 195 B13R1.28 CCCCCCNc1ncccn1 27a_100000210581_100000211032 [0,0,0,1,0,0|3,0,0]=4 196 B13R1.28 CCCCCCOc1ccccc1 34a_100000210340_100000210314 [0,0,0,1,0,0|2,0,0]=3 197 B13R1.28 CCCCCCOc1ccccc1 7a_100000210340_100000210314 [0,0,0,1,0,0|2,0,0]=3 198 B13R1.28 CCCCCCOc1cccnc1 34a_100000210849_100000210314 [0,0,0,1,0,0|3,0,0]=4 199 B13R1.28 CCCCCCOc1cccnc1 7a_100000210849_100000210314 [0,0,0,1,0,0|3,0,0]=4 200 B13R1.28 CCCCCCOc1ccncc1 34a_100000212176_100000210314 [0,0,0,1,0,0|3,0,0]=4 201 B13R1.28 CCCCCCSc1ccccc1 62a_100000210314_100000041952 [0,0,0,1,0,0|2,0,0]=3 202 B13R1.28 CCCCCCSc1ccccc1 62a_100000719477_100000210757 [0,0,0,1,0,0|2,0,0]=3 203 B13R1.28 CCCCCCSc1ccccn1 62a_100000210314_100011216584 [0,0,0,1,0,0|2,0,0]=3 204 B13R1.28 CCCCCCSc1ccccn1 62a_100011216584_100000210757 [0,0,0,1,0,0|2,0,0]=3 205 B13R1.28 CCCCCCSc1cccnc1 62a_100000210063_100000210757 [0,0,0,1,0,0|3,0,0]=4 206 B13R1.28 CCCCCCSc1cccnc1 62a_100000210314_100000210063 [0,0,0,1,0,0|3,0,0]=4 207 B13R1.28 CCCCCCSc1cccnn1 62a_100000210314_100016991348 [0,0,0,1,0,0|3,0,0]=4 208 B13R1.28 CCCCCCSc1cccnn1 62a_100016991348_100000210757 [0,0,0,1,0,0|3,0,0]=4 209 B13R1.28 CCCCCCSc1ccncc1 62a_100000210314_100000728582 [0,0,0,1,0,0|3,0,0]=4 210 B13R1.28 CCCCCCSc1ccncc1 62a_100000728582_100000210757 [0,0,0,1,0,0|3,0,0]=4 211 B13R1.28 CCCCCCSc1ccncn1 62a_100000210314_100000703185 [0,0,0,1,0,0|3,0,0]=4 212 B13R1.28 CCCCCCSc1ccncn1 62a_100000703185_100000210757 [0,0,0,1,0,0|3,0,0]=4 213 B13R1.28 CCCCCCSc1cnccn1 62a_100000210314_100000211759 [0,0,0,1,0,0|3,0,0]=4 214 B13R1.28 CCCCCCSc1cnccn1 62a_100000211759_100000210757 [0,0,0,1,0,0|3,0,0]=4 215 B13R1.28 CCCCCCSc1ncccn1 62a_100000210314_100000211032 [0,0,0,1,0,0|3,0,0]=4 216 B13R1.28 CCCCCCSc1ncccn1 62a_100000211032_100000210757 [0,0,0,1,0,0|3,0,0]=4 217 B13R1.28 CCCCCNCc1ccccc1 207a_100000209983_100015611070 [0,0,0,1,0,0|2,0,0]=3 218 B13R1.28 CCCCCNCc1ccccc1 2230a_100000209983_100015291786 [0,0,0,1,0,0|2,0,0]=3 219 B13R1.28 CCCCCNCc1ccccc1 2230a_100015324214_100000210326 [0,0,0,1,0,0|2,0,0]=3 220 B13R1.28 CCCCCNCc1ccccc1 270004a_100000209983_100015611070 [0,0,0,1,0,0|2,0,0]=3 221 B13R1.28 CCCCCNCc1ccccc1 34a_100015324214_100000718602 [0,0,0,1,0,0|2,0,0]=3 222 B13R1.28 CCCCCNCc1ccccn1 207a_100000209983_100000209966 [0,0,0,1,0,0|2,0,0]=3 223 B13R1.28 CCCCCNCc1ccccn1 2230a_100000209983_100000721315 [0,0,0,1,0,0|2,0,0]=3 224 B13R1.28 CCCCCNCc1ccccn1 270004a_100000209983_100000209966 [0,0,0,1,0,0|2,0,0]=3 225 B13R1.28 CCCCCNCc1cccnc1 207a_100000209983_100000209961 [0,0,0,1,0,0|3,0,0]=4 226 B13R1.28 CCCCCNCc1cccnc1 2230a_100000209983_100000741622 [0,0,0,1,0,0|3,0,0]=4 227 B13R1.28 CCCCCNCc1cccnc1 270004a_100000209983_100000209961 [0,0,0,1,0,0|3,0,0]=4 228 B13R1.28 CCCCCNCc1cccnn1 2230a_100000209983_100016990269 [0,0,0,1,0,0|3,0,0]=4 229 B13R1.28 CCCCCNCc1cccnn1 2230a_100159270163_100000210326 [0,0,0,1,0,0|3,0,0]=4 230 B13R1.28 CCCCCNCc1ccncc1 207a_100000209983_100000186114 [0,0,0,1,0,0|3,0,0]=4 231 B13R1.28 CCCCCNCc1ccncc1 2230a_100000209983_100015193705 [0,0,0,1,0,0|3,0,0]=4 232 B13R1.28 CCCCCNCc1cnccn1 2230a_100000209983_100016995436 [0,0,0,1,0,0|3,0,0]=4 233 B13R1.28 CCCCCNCc1cnccn1 270004a_100000209983_100000749867 [0,0,0,1,0,0|3,0,0]=4 234 B13R1.28 CCCCCNCc1ncccn1 2230a_100000209983_100000703007 [0,0,0,1,0,0|3,0,0]=4 235 B13R1.28 CCCCCNCc1ncccn1 270004a_100000209983_100011532527 [0,0,0,1,0,0|3,0,0]=4 236 B13R1.28 CCCCCOCc1ccccc1 34a_100000210253_100015291786 [0,0,0,1,0,0|2,0,0]=3 237 B13R1.28 CCCCCOCc1ccccc1 34a_100000210790_100000718602 [0,0,0,1,0,0|2,0,0]=3 238 B13R1.28 CCCCCOCc1ccccc1 7a_100000210253_100000211182 [0,0,0,1,0,0|2,0,0]=3 239 B13R1.28 CCCCCOCc1ccccc1 7a_100000210790_100000210326 [0,0,0,1,0,0|2,0,0]=3 240 B13R1.28 CCCCCOCc1ccccn1 34a_100000210253_100000721315 [0,0,0,1,0,0|2,0,0]=3 241 B13R1.28 CCCCCOCc1ccccn1 7a_100000210253_100000721315 [0,0,0,1,0,0|2,0,0]=3 242 B13R1.28 CCCCCOCc1cccnc1 34a_100000210253_100000733263 [0,0,0,1,0,0|3,0,0]=4 243 B13R1.28 CCCCCOCc1cccnc1 7a_100000210253_100000741622 [0,0,0,1,0,0|3,0,0]=4 244 B13R1.28 CCCCCOCc1cccnn1 34a_100000210253_100016990269 [0,0,0,1,0,0|3,0,0]=4 245 B13R1.28 CCCCCOCc1cccnn1 7a_100000210253_100016990269 [0,0,0,1,0,0|3,0,0]=4 246 B13R1.28 CCCCCOCc1ccncc1 7a_100000210253_100015193705 [0,0,0,1,0,0|3,0,0]=4 247 B13R1.28 CCCCCOCc1cnccn1 34a_100000210253_100016995436 [0,0,0,1,0,0|3,0,0]=4 248 B13R1.28 CCCCCOCc1cnccn1 7a_100000210253_100016995436 [0,0,0,1,0,0|3,0,0]=4 249 B13R1.28 CCCCCOCc1ncccn1 34a_100000210253_100000703007 [0,0,0,1,0,0|3,0,0]=4 250 B13R1.28 CCCCCOCc1ncccn1 7a_100000210253_100000703007 [0,0,0,1,0,0|3,0,0]=4 251 B13R1.28 CCCCCSCc1ccccc1 62a_100000210326_100015291786 [0,0,0,1,0,0|2,0,0]=3 252 B13R1.28 CCCCCSCc1ccccc1 62a_100000211182_100000210326 [0,0,0,1,0,0|2,0,0]=3 253 B13R1.28 CCCCCSCc1ccccn1 62a_100000210326_100000721315 [0,0,0,1,0,0|2,0,0]=3 254 B13R1.28 CCCCCSCc1ccccn1 62a_100000721315_100000210326 [0,0,0,1,0,0|2,0,0]=3 255 B13R1.28 CCCCCSCc1cccnc1 62a_100000210326_100000741622 [0,0,0,1,0,0|3,0,0]=4 256 B13R1.28 CCCCCSCc1cccnc1 62a_100000741622_100000210326 [0,0,0,1,0,0|3,0,0]=4 257 B13R1.28 CCCCCSCc1cccnn1 62a_100000210326_100016990269 [0,0,0,1,0,0|3,0,0]=4 258 B13R1.28 CCCCCSCc1cccnn1 62a_100016990269_100000210326 [0,0,0,1,0,0|3,0,0]=4 259 B13R1.28 CCCCCSCc1ccncc1 62a_100000210326_100015193705 [0,0,0,1,0,0|3,0,0]=4 260 B13R1.28 CCCCCSCc1ccncc1 62a_100015193705_100000210326 [0,0,0,1,0,0|3,0,0]=4 261 B13R1.28 CCCCCSCc1cnccn1 62a_100000210326_100016995436 [0,0,0,1,0,0|3,0,0]=4 262 B13R1.28 CCCCCSCc1cnccn1 62a_100016995436_100000210326 [0,0,0,1,0,0|3,0,0]=4 263 B13R1.28 CCCCCSCc1ncccn1 62a_100000210326_100000703007 [0,0,0,1,0,0|3,0,0]=4 264 B13R1.28 CCCCCSCc1ncccn1 62a_100000703007_100000210326 [0,0,0,1,0,0|3,0,0]=4 265 B13R1.28 CCCCNCCc1ccccc1 2230a_100000102301_100000765856 [0,0,0,1,0,0|2,0,0]=3 266 B13R1.28 CCCCNCCc1ccccc1 2230a_100000106460_100000210211 [0,0,0,1,0,0|2,0,0]=3 267 B13R1.28 CCCCNCCc1ccccc1 34a_100000106460_100000210210 [0,0,0,1,0,0|2,0,0]=3 268 B13R1.28 CCCCNCCc1ccccc1 7a_106832991798_100000765856 [0,0,0,1,0,0|2,0,0]=3 269 B13R1.28 CCCCNCCc1ccccn1 2230a_100000102301_100015183660 [0,0,0,1,0,0|2,0,0]=3 270 B13R1.28 CCCCNCCc1ccccn1 7a_106832991798_100015183660 [0,0,0,1,0,0|2,0,0]=3 271 B13R1.28 CCCCNCCc1cccnc1 2230a_100000102301_200011713674 [0,0,0,1,0,0|3,0,0]=4 272 B13R1.28 CCCCNCCc1cccnc1 2230a_100000736294_100000210211 [0,0,0,1,0,0|3,0,0]=4 273 B13R1.28 CCCCNCCc1cccnc1 7a_106832991798_200011713674 [0,0,0,1,0,0|3,0,0]=4 274 B13R1.28 CCCCNCCc1ccncc1 2230a_100000102301_100000723409 [0,0,0,1,0,0|3,0,0]=4 275 B13R1.28 CCCCNCCc1ccncc1 7a_106832991798_100000723409 [0,0,0,1,0,0|3,0,0]=4 276 B13R1.28 CCCCNCSc1ccccc1 2230a_100000102301_100011218342 [0,0,0,1,0,0|3,0,0]=4 277 B13R1.28 CCCCOCCc1ccccc1 34a_100000210227_100000765856 [0,0,0,1,0,0|2,0,0]=3 278 B13R1.28 CCCCOCCc1ccccc1 34a_100000210268_100000210210 [0,0,0,1,0,0|2,0,0]=3 279 B13R1.28 CCCCOCCc1ccccc1 7a_100000210227_100000765856 [0,0,0,1,0,0|2,0,0]=3 280 B13R1.28 CCCCOCCc1ccccc1 7a_100000210268_100000210211 [0,0,0,1,0,0|2,0,0]=3 281 B13R1.28 CCCCOCCc1ccccn1 34a_100000210271_100000210210 [0,0,0,1,0,0|2,0,0]=3 282 B13R1.28 CCCCOCCc1ccccn1 7a_100000210227_100015183660 [0,0,0,1,0,0|2,0,0]=3 283 B13R1.28 CCCCOCCc1cccnc1 34a_100011217484_100000210210 [0,0,0,1,0,0|3,0,0]=4 284 B13R1.28 CCCCOCCc1cccnc1 7a_100000210227_200011713674 [0,0,0,1,0,0|3,0,0]=4 285 B13R1.28 CCCCOCCc1ccncc1 34a_100011216225_100000210210 [0,0,0,1,0,0|3,0,0]=4 286 B13R1.28 CCCCOCCc1ccncc1 7a_100000210227_100000723409 [0,0,0,1,0,0|3,0,0]=4 287 B13R1.28 CCCCOCCc1cnccn1 34a_100011349526_100000210210 [0,0,0,1,0,0|3,0,0]=4 288 B13R1.28 CCCCOCNc1ccccc1 34a_100000106764_100011995733 [0,0,0,1,0,0|3,0,0]=4 289 B13R1.28 CCCCOCOc1ccccc1 34a_100000210340_100011995733 [0,0,0,1,0,0|3,0,0]=4 290 B13R1.28 CCCCOCSc1ccccc1 62a_100000719477_100011995733 [0,0,0,1,0,0|3,0,0]=4 291 B13R1.28 CCCCOCSc1ccccc1 62a_100011995733_100000041952 [0,0,0,1,0,0|3,0,0]=4 292 B13R1.28 CCCCOCSc1ccccn1 62a_100011216584_100011995733 [0,0,0,1,0,0|3,0,0]=4 293 B13R1.28 CCCCOCSc1ccccn1 62a_100011995733_100011216584 [0,0,0,1,0,0|3,0,0]=4 294 B13R1.28 CCCCSCCc1ccccc1 62a_100000210211_100011218657 [0,0,0,1,0,0|2,0,0]=3 295 B13R1.28 CCCCSCCc1ccccc1 62a_100000765856_100000210210 [0,0,0,1,0,0|2,0,0]=3 296 B13R1.28 CCCCSCCc1ccccn1 62a_100000210211_100015183660 [0,0,0,1,0,0|2,0,0]=3 297 B13R1.28 CCCCSCCc1ccccn1 62a_100015183660_100000210210 [0,0,0,1,0,0|2,0,0]=3 298 B13R1.28 CCCCSCCc1cccnc1 62a_100000210211_200011713674 [0,0,0,1,0,0|3,0,0]=4 299 B13R1.28 CCCCSCCc1cccnc1 62a_200011713674_100000210210 [0,0,0,1,0,0|3,0,0]=4 300 B13R1.28 CCCCSCCc1ccncc1 62a_100000210211_100000723409 [0,0,0,1,0,0|3,0,0]=4 301 B13R1.28 CCCCSCCc1ccncc1 62a_100000723409_100000210210 [0,0,0,1,0,0|3,0,0]=4 302 B13R1.28 CCCCSCSc1ccccc1 62a_100000210211_100011218342 [0,0,0,1,0,0|3,0,0]=4 303 B13R1.28 CCCCSCSc1ccccc1 62a_100011218342_100000210210 [0,0,0,1,0,0|3,0,0]=4 304 B13R1.28 CCCNCCCc1ccccc1 2230a_100000211184_100000210303 [0,0,0,1,0,0|2,0,0]=3 305 B13R1.28 CCCNCCCc1ccccc1 34a_100000211184_100000210303 [0,0,0,1,0,0|2,0,0]=3 306 B13R1.28 CCCNCCCc1cccnc1 2230a_100011532358_100000210303 [0,0,0,1,0,0|3,0,0]=4 307 B13R1.28 CCCNCCCc1cccnc1 34a_100011532358_100000210303 [0,0,0,1,0,0|3,0,0]=4 308 B13R1.28 CCCNCCCc1ccncc1 2230a_100011275580_100000210303 [0,0,0,1,0,0|3,0,0]=4 309 B13R1.28 CCCNCCOc1ccccc1 2230a_100000174943_100000210303 [0,0,0,1,0,0|3,0,0]=4 310 B13R1.28 CCCNCCOc1ccccc1 270004a_100020643023_100000758736 [0,0,0,1,0,0|3,0,0]=4 311 B13R1.28 CCCNCCOc1ccccc1 34a_100000174943_100000210303 [0,0,0,1,0,0|3,0,0]=4 312 B13R1.28 CCCNCCOc1ccccn1 2230a_106741647558_100000210303 [0,0,0,1,0,0|3,0,0]=4 313 B13R1.28 CCCNCCSc1ccccc1 2230a_100000189519_100000210303 [0,0,0,1,0,0|3,0,0]=4 314 B13R1.28 CCCOCCCC1=CCC=CC1 34a_100020667889_100000210303 [0,0,0,1,0,0|2,0,1]=4 315 B13R1.28 CCCOCCCc1ccccc1 34a_100000210258_100000211621 [0,0,0,1,0,0|2,0,0]=3 316 B13R1.28 CCCOCCCc1ccccc1 34a_100000210828_100000210303 [0,0,0,1,0,0|2,0,0]=3 317 B13R1.28 CCCOCCCc1ccccc1 7a_100000210828_100000210303 [0,0,0,1,0,0|2,0,0]=3 318 B13R1.28 CCCOCCCc1ccccn1 34a_100011215068_100000210303 [0,0,0,1,0,0|2,0,0]=3 319 B13R1.28 CCCOCCCc1cccnc1 34a_100000211284_100000210303 [0,0,0,1,0,0|3,0,0]=4 320 B13R1.28 CCCOCCCc1ccncc1 34a_100000210659_100000210303 [0,0,0,1,0,0|3,0,0]=4 321 B13R1.28 CCCOCCNc1ccccc1 34a_100000106764_100011215938 [0,0,0,1,0,0|3,0,0]=4 322 B13R1.28 CCCOCCNc1ccccc1 34a_100000211345_100000210303 [0,0,0,1,0,0|3,0,0]=4 323 B13R1.28 CCCOCCOc1ccccc1 34a_100000210258_100000184471 [0,0,0,1,0,0|3,0,0]=4 324 B13R1.28 CCCOCCOc1ccccc1 34a_100000210260_100000210303 [0,0,0,1,0,0|3,0,0]=4 325 B13R1.28 CCCOCCOc1ccccc1 34a_100000210340_100011215938 [0,0,0,1,0,0|3,0,0]=4 326 B13R1.28 CCCOCCOc1ccccc1 7a_100000210260_100000210303 [0,0,0,1,0,0|3,0,0]=4 327 B13R1.28 CCCOCCOc1ccccc1 7a_100000210340_100011215938 [0,0,0,1,0,0|3,0,0]=4 328 B13R1.28 CCCOCCSc1ccccc1 34a_100000210258_100000246102 [0,0,0,1,0,0|3,0,0]=4 329 B13R1.28 CCCOCCSc1ccccc1 62a_100000719477_100011215938 [0,0,0,1,0,0|3,0,0]=4 330 B13R1.28 CCCOCCSc1ccccc1 62a_100011215938_100000041952 [0,0,0,1,0,0|3,0,0]=4 331 B13R1.28 CCCOCCSc1ccccc1 7a_100000230494_100000210303 [0,0,0,1,0,0|3,0,0]=4 332 B13R1.28 CCCOCCSc1ccccn1 62a_100011215938_100011216584 [0,0,0,1,0,0|3,0,0]=4 333 B13R1.28 CCCOCCSc1ccccn1 62a_100011216584_100011215938 [0,0,0,1,0,0|3,0,0]=4 334 B13R1.28 CCCOCCSc1ccccn1 7a_100000156319_100000210303 [0,0,0,1,0,0|3,0,0]=4 335 B13R1.28 CCCOCOCc1ccccc1 34a_100000210258_100000763385 [0,0,0,1,0,0|3,0,0]=4 336 B13R1.28 CCCOCSCc1ccccc1 34a_100000210258_200011217039 [0,0,0,1,0,0|3,0,0]=4 337 B13R1.28 CCCSCCCc1ccccc1 62a_100000210303_100000211621 [0,0,0,1,0,0|2,0,0]=3 338 B13R1.28 CCCSCCCc1ccccc1 62a_100000211621_100000210303 [0,0,0,1,0,0|2,0,0]=3 339 B13R1.28 CCCSCCOc1ccccc1 62a_100000184471_100000210303 [0,0,0,1,0,0|3,0,0]=4 340 B13R1.28 CCCSCCOc1ccccc1 62a_100000210303_100000184471 [0,0,0,1,0,0|3,0,0]=4 341 B13R1.28 CCCSCCSc1ccccc1 62a_100000210303_100000246102 [0,0,0,1,0,0|3,0,0]=4 342 B13R1.28 CCCSCCSc1ccccc1 62a_100000246102_100000210303 [0,0,0,1,0,0|3,0,0]=4 343 B13R1.28 CCCSCOCc1ccccc1 62a_100000210303_100000763385 [0,0,0,1,0,0|3,0,0]=4 344 B13R1.28 CCCSCOCc1ccccc1 62a_100000763385_100000210303 [0,0,0,1,0,0|3,0,0]=4 345 B13R1.28 CCCSCSCc1ccccc1 62a_100000210303_200011217039 [0,0,0,1,0,0|3,0,0]=4 346 B13R1.28 CCCSCSCc1ccccc1 62a_200011217039_100000210303 [0,0,0,1,0,0|3,0,0]=4 347 B13R1.28 CCNCCCCc1ccccc1 2230a_100015280158_100000210202 [0,0,0,1,0,0|2,0,0]=3 348 B13R1.28 CCNCCCCc1ccccc1 2230a_100015525214_100000701786 [0,0,0,1,0,0|2,0,0]=3 349 B13R1.28 CCNCCCCc1ccccc1 34a_100015280158_100000210202 [0,0,0,1,0,0|2,0,0]=3 350 B13R1.28 CCNCCCCc1ccncc1 2230a_100015525214_100020630000 [0,0,0,1,0,0|3,0,0]=4 351 B13R1.28 CCNCCCOc1ccccc1 2230a_100000216521_100000210202 [0,0,0,1,0,0|3,0,0]=4 352 B13R1.28 CCNCCCOc1ccccc1 2230a_100015525214_100000199009 [0,0,0,1,0,0|3,0,0]=4 353 B13R1.28 CCNCCCOc1ccccc1 34a_100000216521_100000210202 [0,0,0,1,0,0|3,0,0]=4 354 B13R1.28 CCNCCCSc1ccccc1 2230a_100000184639_100000210202 [0,0,0,1,0,0|3,0,0]=4 355 B13R1.28 CCNCCCSc1ccccc1 2230a_100015525214_200011203293 [0,0,0,1,0,0|3,0,0]=4 356 B13R1.28 CCNCCOCc1ccccc1 2230a_100000753106_100000210202 [0,0,0,1,0,0|3,0,0]=4 357 B13R1.28 CCNCCOCc1ccccc1 2230a_100015525214_100000234347 [0,0,0,1,0,0|3,0,0]=4 358 B13R1.28 CCNCCOCc1ccccc1 34a_100000753106_100000210202 [0,0,0,1,0,0|3,0,0]=4 359 B13R1.28 CCNCCSCc1ccccc1 2230a_100000189534_100000210202 [0,0,0,1,0,0|3,0,0]=4 360 B13R1.28 CCNCCSCc1ccccc1 2230a_100015525214_200011297719 [0,0,0,1,0,0|3,0,0]=4 361 B13R1.28 CCNCCSCc1ccccc1 34a_100000189534_100000210202 [0,0,0,1,0,0|3,0,0]=4 362 B13R1.28 CCNCCSCc1ccccc1 7a_100000189534_100000210202 [0,0,0,1,0,0|3,0,0]=4 363 B13R1.28 CCOCCCCc1ccccc1 34a_100000703073_100000210202 [0,0,0,1,0,0|2,0,0]=3 364 B13R1.28 CCOCCCCc1ccccc1 34a_100121572206_100000701786 [0,0,0,1,0,0|2,0,0]=3 365 B13R1.28 CCOCCCCc1ccccc1 7a_100000703073_100000210202 [0,0,0,1,0,0|2,0,0]=3 366 B13R1.28 CCOCCCCc1ccccn1 34a_100012186994_100000210202 [0,0,0,1,0,0|2,0,0]=3 367 B13R1.28 CCOCCCCc1cccnc1 34a_100012039607_100000210202 [0,0,0,1,0,0|3,0,0]=4 368 B13R1.28 CCOCCCCc1cccnc1 7a_100012039607_100000210202 [0,0,0,1,0,0|3,0,0]=4 369 B13R1.28 CCOCCCCc1ccncc1 34a_100011787716_100000210202 [0,0,0,1,0,0|3,0,0]=4 370 B13R1.28 CCOCCCNc1ccccc1 34a_100000106764_100012232248 [0,0,0,1,0,0|3,0,0]=4 371 B13R1.28 CCOCCCNc1ccccc1 34a_100000212590_100000210202 [0,0,0,1,0,0|3,0,0]=4 372 B13R1.28 CCOCCCOc1ccccc1 34a_100000210340_100012232248 [0,0,0,1,0,0|3,0,0]=4 373 B13R1.28 CCOCCCOc1ccccc1 34a_100011215863_100000210202 [0,0,0,1,0,0|3,0,0]=4 374 B13R1.28 CCOCCCOc1ccccc1 34a_100121572206_100000199009 [0,0,0,1,0,0|3,0,0]=4 375 B13R1.28 CCOCCCOc1ccccc1 7a_100000210340_100012232248 [0,0,0,1,0,0|3,0,0]=4 376 B13R1.28 CCOCCCOc1ccccc1 7a_100011215863_100000210202 [0,0,0,1,0,0|3,0,0]=4 377 B13R1.28 CCOCCCSc1ccccc1 34a_100121572206_200011203293 [0,0,0,1,0,0|3,0,0]=4 378 B13R1.28 CCOCCCSc1ccccc1 62a_100000719477_100012232248 [0,0,0,1,0,0|3,0,0]=4 379 B13R1.28 CCOCCCSc1ccccc1 62a_100012232248_100000041952 [0,0,0,1,0,0|3,0,0]=4 380 B13R1.28 CCOCCCSc1ccccn1 62a_100011216584_100012232248 [0,0,0,1,0,0|3,0,0]=4 381 B13R1.28 CCOCCCSc1ccccn1 62a_100012232248_100011216584 [0,0,0,1,0,0|3,0,0]=4 382 B13R1.28 CCOCCNCc1ccccc1 207a_100011200944_100015611070 [0,0,0,1,0,0|3,0,0]=4 383 B13R1.28 CCOCCNCc1ccccc1 2230a_100015324214_100011215890 [0,0,0,1,0,0|3,0,0]=4 384 B13R1.28 CCOCCNCc1ccccc1 2230a_102516460346_100015291786 [0,0,0,1,0,0|3,0,0]=4 385 B13R1.28 CCOCCNCc1ccccc1 270004a_102516460346_100015611070 [0,0,0,1,0,0|3,0,0]=4 386 B13R1.28 CCOCCNCc1ccccc1 34a_100000180844_100000210202 [0,0,0,1,0,0|3,0,0]=4 387 B13R1.28 CCOCCNCc1ccccc1 34a_100015324214_100000210147 [0,0,0,1,0,0|3,0,0]=4 388 B13R1.28 CCOCCNCc1ccccc1 34a_102516460346_100015291786 [0,0,0,1,0,0|3,0,0]=4 389 B13R1.28 CCOCCNCc1ccccn1 207a_100011200944_100000209966 [0,0,0,1,0,0|3,0,0]=4 390 B13R1.28 CCOCCNCc1ccccn1 2230a_102516460346_100000721315 [0,0,0,1,0,0|3,0,0]=4 391 B13R1.28 CCOCCNCc1ccccn1 270004a_102516460346_100000209966 [0,0,0,1,0,0|3,0,0]=4 392 B13R1.28 CCOCCNCc1ccccn1 34a_102516460346_100000721315 [0,0,0,1,0,0|3,0,0]=4 393 B13R1.28 CCOCCOCc1ccccc1 34a_100000210136_100015291786 [0,0,0,1,0,0|3,0,0]=4 394 B13R1.28 CCOCCOCc1ccccc1 34a_100000210790_100000210147 [0,0,0,1,0,0|3,0,0]=4 395 B13R1.28 CCOCCOCc1ccccc1 34a_100000759325_100000210202 [0,0,0,1,0,0|3,0,0]=4 396 B13R1.28 CCOCCOCc1ccccc1 34a_100121572206_100000234347 [0,0,0,1,0,0|3,0,0]=4 397 B13R1.28 CCOCCOCc1ccccc1 7a_100000210136_100000211182 [0,0,0,1,0,0|3,0,0]=4 398 B13R1.28 CCOCCOCc1ccccc1 7a_100000210790_100011215890 [0,0,0,1,0,0|3,0,0]=4 399 B13R1.28 CCOCCOCc1ccccc1 7a_100000759325_100000210202 [0,0,0,1,0,0|3,0,0]=4 400 B13R1.28 CCOCCOCc1ccccn1 34a_100000210136_100000721315 [0,0,0,1,0,0|3,0,0]=4 401 B13R1.28 CCOCCOCc1ccccn1 7a_100000210136_100000721315 [0,0,0,1,0,0|3,0,0]=4 402 B13R1.28 CCOCCSCc1ccccc1 34a_100011205989_100000210202 [0,0,0,1,0,0|3,0,0]=4 403 B13R1.28 CCOCCSCc1ccccc1 34a_100121572206_200011297719 [0,0,0,1,0,0|3,0,0]=4 404 B13R1.28 CCOCCSCc1ccccc1 62a_100000210147_100015291786 [0,0,0,1,0,0|3,0,0]=4 405 B13R1.28 CCOCCSCc1ccccc1 62a_100000211182_100011215890 [0,0,0,1,0,0|3,0,0]=4 406 B13R1.28 CCOCCSCc1ccccc1 7a_100011205989_100000210202 [0,0,0,1,0,0|3,0,0]=4 407 B13R1.28 CCOCCSCc1ccccn1 62a_100000210147_100000721315 [0,0,0,1,0,0|3,0,0]=4 408 B13R1.28 CCOCCSCc1ccccn1 62a_100000721315_100011215890 [0,0,0,1,0,0|3,0,0]=4 409 B13R1.28 CCOCSCCc1ccccc1 62a_100000739092_100011218657 [0,0,0,1,0,0|3,0,0]=4 410 B13R1.28 CCOCSCCc1ccccc1 62a_100000765856_100000739092 [0,0,0,1,0,0|3,0,0]=4 411 B13R1.28 CCOCSCCc1ccccn1 62a_100000739092_100015183660 [0,0,0,1,0,0|3,0,0]=4 412 B13R1.28 CCOCSCCc1ccccn1 62a_100015183660_100000739092 [0,0,0,1,0,0|3,0,0]=4 413 B13R1.28 CCSCCCCc1ccccc1 62a_100000210202_100000701786 [0,0,0,1,0,0|2,0,0]=3 414 B13R1.28 CCSCCCCc1ccccc1 62a_100000701786_100000210202 [0,0,0,1,0,0|2,0,0]=3 415 B13R1.28 CCSCCCCc1ccncc1 62a_100000210202_100020630000 [0,0,0,1,0,0|3,0,0]=4 416 B13R1.28 CCSCCCCc1ccncc1 62a_100020630000_100000210202 [0,0,0,1,0,0|3,0,0]=4 417 B13R1.28 CCSCCCOc1ccccc1 62a_100000199009_100000210202 [0,0,0,1,0,0|3,0,0]=4 418 B13R1.28 CCSCCCOc1ccccc1 62a_100000210202_100000199009 [0,0,0,1,0,0|3,0,0]=4 419 B13R1.28 CCSCCCSc1ccccc1 62a_100000210202_200011203293 [0,0,0,1,0,0|3,0,0]=4 420 B13R1.28 CCSCCCSc1ccccc1 62a_200011203293_100000210202 [0,0,0,1,0,0|3,0,0]=4 421 B13R1.28 CCSCCNCc1ccccc1 207a_100000106463_100015611070 [0,0,0,1,0,0|3,0,0]=4 422 B13R1.28 CCSCCNCc1ccccc1 2230a_100000106463_100015291786 [0,0,0,1,0,0|3,0,0]=4 423 B13R1.28 CCSCCNCc1ccccc1 2230a_100015324214_100000757381 [0,0,0,1,0,0|3,0,0]=4 424 B13R1.28 CCSCCNCc1ccccc1 270004a_100000106463_100015611070 [0,0,0,1,0,0|3,0,0]=4 425 B13R1.28 CCSCCNCc1ccccc1 34a_100015324214_100000757381 [0,0,0,1,0,0|3,0,0]=4 426 B13R1.28 CCSCCNCc1ccccn1 207a_100000106463_100000209966 [0,0,0,1,0,0|3,0,0]=4 427 B13R1.28 CCSCCNCc1ccccn1 2230a_100000106463_100000721315 [0,0,0,1,0,0|3,0,0]=4 428 B13R1.28 CCSCCNCc1ccccn1 270004a_100000106463_100000209966 [0,0,0,1,0,0|3,0,0]=4 429 B13R1.28 CCSCCOCc1ccccc1 34a_100000210790_100000757381 [0,0,0,1,0,0|3,0,0]=4 430 B13R1.28 CCSCCOCc1ccccc1 34a_100000212035_100015291786 [0,0,0,1,0,0|3,0,0]=4 431 B13R1.28 CCSCCOCc1ccccc1 62a_100000210202_100000234347 [0,0,0,1,0,0|3,0,0]=4 432 B13R1.28 CCSCCOCc1ccccc1 62a_100000234347_100000210202 [0,0,0,1,0,0|3,0,0]=4 433 B13R1.28 CCSCCOCc1ccccc1 7a_100000210790_100000757381 [0,0,0,1,0,0|3,0,0]=4 434 B13R1.28 CCSCCOCc1ccccc1 7a_100000212035_100000211182 [0,0,0,1,0,0|3,0,0]=4 435 B13R1.28 CCSCCOCc1ccccn1 34a_100000212035_100000721315 [0,0,0,1,0,0|3,0,0]=4 436 B13R1.28 CCSCCOCc1ccccn1 7a_100000212035_100000721315 [0,0,0,1,0,0|3,0,0]=4 437 B13R1.28 CCSCCSCc1ccccc1 62a_100000210202_200011297719 [0,0,0,1,0,0|3,0,0]=4 438 B13R1.28 CCSCCSCc1ccccc1 62a_100000211182_100000757381 [0,0,0,1,0,0|3,0,0]=4 439 B13R1.28 CCSCCSCc1ccccc1 62a_100000757381_100015291786 [0,0,0,1,0,0|3,0,0]=4 440 B13R1.28 CCSCCSCc1ccccc1 62a_200011297719_100000210202 [0,0,0,1,0,0|3,0,0]=4 441 B13R1.28 CCSCCSCc1ccccn1 62a_100000721315_100000757381 [0,0,0,1,0,0|3,0,0]=4 442 B13R1.28 CCSCCSCc1ccccn1 62a_100000757381_100000721315 [0,0,0,1,0,0|3,0,0]=4 443 B13R1.28 CNCCCCCc1ccccc1 2230a_100000750932_200000210301 [0,0,0,1,0,0|2,0,0]=3 444 B13R1.28 CNCCCCCc1ccccc1 2230a_106832991635_200011217138 [0,0,0,1,0,0|2,0,0]=3 445 B13R1.28 CNCCCCCc1ccccc1 34a_100000750932_200000210301 [0,0,0,1,0,0|2,0,0]=3 446 B13R1.28 CNCCCCCc1ccccc1 34a_100102657272_200011217138 [0,0,0,1,0,0|2,0,0]=3 447 B13R1.28 CNCCCCCc1ccccc1 7a_106832991635_200011217138 [0,0,0,1,0,0|2,0,0]=3 448 B13R1.28 CNCCCCOc1ccccc1 2230a_106832991635_100011215240 [0,0,0,1,0,0|3,0,0]=4 449 B13R1.28 CNCCCCOc1ccccc1 34a_100102657272_100011215240 [0,0,0,1,0,0|3,0,0]=4 450 B13R1.28 CNCCCCOc1ccccc1 7a_106832991635_100011215240 [0,0,0,1,0,0|3,0,0]=4 451 B13R1.28 CNCCCOCc1ccccc1 2230a_106832991635_100011215529 [0,0,0,1,0,0|3,0,0]=4 452 B13R1.28 CNCCCOCc1ccccc1 2230a_200000206031_200000210301 [0,0,0,1,0,0|3,0,0]=4 453 B13R1.28 CNCCCOCc1ccccc1 34a_100000213112_100015291786 [0,0,0,1,0,0|3,0,0]=4 454 B13R1.28 CNCCCOCc1ccccc1 34a_100102657272_100011215529 [0,0,0,1,0,0|3,0,0]=4 455 B13R1.28 CNCCCOCc1ccccc1 34a_200000206031_200000210301 [0,0,0,1,0,0|3,0,0]=4 456 B13R1.28 CNCCCOCc1ccccc1 7a_106832991635_100011215529 [0,0,0,1,0,0|3,0,0]=4 457 B13R1.28 CNCCCOCc1ccccn1 34a_100000213112_100000721315 [0,0,0,1,0,0|3,0,0]=4 458 B13R1.28 COCCCCCc1ccccc1 34a_100138415774_200011217138 [0,0,0,1,0,0|2,0,0]=3 459 B13R1.28 COCCCCCc1ccccc1 34a_200011219639_200000210301 [0,0,0,1,0,0|2,0,0]=3 460 B13R1.28 COCCCCCc1ccccc1 7a_200011219639_200000210301 [0,0,0,1,0,0|2,0,0]=3 461 B13R1.28 COCCCCNc1ccccc1 34a_100000106764_100000755781 [0,0,0,1,0,0|3,0,0]=4 462 B13R1.28 COCCCCOc1ccccc1 34a_100000210340_100000755781 [0,0,0,1,0,0|3,0,0]=4 463 B13R1.28 COCCCCOc1ccccc1 34a_100000752354_200000210301 [0,0,0,1,0,0|3,0,0]=4 464 B13R1.28 COCCCCOc1ccccc1 34a_100138415774_100011215240 [0,0,0,1,0,0|3,0,0]=4 465 B13R1.28 COCCCCOc1ccccc1 7a_100000210340_100000730899 [0,0,0,1,0,0|3,0,0]=4 466 B13R1.28 COCCCCOc1ccccc1 7a_100000752354_200000210301 [0,0,0,1,0,0|3,0,0]=4 467 B13R1.28 COCCCCSc1ccccc1 62a_100000719477_100000730899 [0,0,0,1,0,0|3,0,0]=4 468 B13R1.28 COCCCCSc1ccccc1 62a_100000730899_100000041952 [0,0,0,1,0,0|3,0,0]=4 469 B13R1.28 COCCCCSc1ccccn1 62a_100000730899_100011216584 [0,0,0,1,0,0|3,0,0]=4 470 B13R1.28 COCCCCSc1ccccn1 62a_100011216584_100000730899 [0,0,0,1,0,0|3,0,0]=4 471 B13R1.28 COCCCNCc1ccccc1 207a_100150723488_100015611070 [0,0,0,1,0,0|3,0,0]=4 472 B13R1.28 COCCCNCc1ccccc1 2230a_100015324214_100000740836 [0,0,0,1,0,0|3,0,0]=4 473 B13R1.28 COCCCNCc1ccccc1 270004a_100150723488_100015611070 [0,0,0,1,0,0|3,0,0]=4 474 B13R1.28 COCCCNCc1ccccc1 34a_100000185501_200000210301 [0,0,0,1,0,0|3,0,0]=4 475 B13R1.28 COCCCNCc1ccccc1 34a_100015324214_100000740836 [0,0,0,1,0,0|3,0,0]=4 476 B13R1.28 COCCCNCc1ccccc1 34a_100150723488_100015291786 [0,0,0,1,0,0|3,0,0]=4 477 B13R1.28 COCCCNCc1ccccn1 207a_100150723488_100000209966 [0,0,0,1,0,0|3,0,0]=4 478 B13R1.28 COCCCNCc1ccccn1 270004a_100150723488_100000209966 [0,0,0,1,0,0|3,0,0]=4 479 B13R1.28 COCCCNCc1ccccn1 34a_100150723488_100000721315 [0,0,0,1,0,0|3,0,0]=4 480 B13R1.28 COCCCOCc1ccccc1 34a_100000210790_100000740836 [0,0,0,1,0,0|3,0,0]=4 481 B13R1.28 COCCCOCc1ccccc1 34a_100000691849_200000210301 [0,0,0,1,0,0|3,0,0]=4 482 B13R1.28 COCCCOCc1ccccc1 34a_100000740835_100015291786 [0,0,0,1,0,0|3,0,0]=4 483 B13R1.28 COCCCOCc1ccccc1 34a_100138415774_100011215529 [0,0,0,1,0,0|3,0,0]=4 484 B13R1.28 COCCCOCc1ccccc1 7a_100000210790_100000740836 [0,0,0,1,0,0|3,0,0]=4 485 B13R1.28 COCCCOCc1ccccc1 7a_100000691849_200000210301 [0,0,0,1,0,0|3,0,0]=4 486 B13R1.28 COCCCOCc1ccccn1 34a_100000740835_100000721315 [0,0,0,1,0,0|3,0,0]=4 487 B13R1.28 COCCCSCc1ccccc1 62a_100000211182_100000709357 [0,0,0,1,0,0|3,0,0]=4 488 B13R1.28 COCCCSCc1ccccc1 62a_100000709357_100015291786 [0,0,0,1,0,0|3,0,0]=4 489 B13R1.28 COCCCSCc1ccccn1 62a_100000709357_100000721315 [0,0,0,1,0,0|3,0,0]=4 490 B13R1.28 COCCCSCc1ccccn1 62a_100000721315_100000709357 [0,0,0,1,0,0|3,0,0]=4 491 B13R1.28 COCCNCCc1ccccc1 2230a_100000106460_100011201679 [0,0,0,1,0,0|3,0,0]=4 492 B13R1.28 COCCNCCc1ccccc1 2230a_100000209980_100000765856 [0,0,0,1,0,0|3,0,0]=4 493 B13R1.28 COCCNCCc1ccccc1 34a_100000106460_100011201679 [0,0,0,1,0,0|3,0,0]=4 494 B13R1.28 COCCNCCc1ccccn1 2230a_100000209980_100015183660 [0,0,0,1,0,0|3,0,0]=4 495 B13R1.28 COCCOCCc1ccccc1 34a_100000210237_100000765856 [0,0,0,1,0,0|3,0,0]=4 496 B13R1.28 COCCOCCc1ccccc1 34a_100000210268_100011201679 [0,0,0,1,0,0|3,0,0]=4 497 B13R1.28 COCCOCCc1ccccc1 7a_100000210268_100000233755 [0,0,0,1,0,0|3,0,0]=4 498 B13R1.28 COCCOCCc1ccccn1 34a_100000210271_100011201679 [0,0,0,1,0,0|3,0,0]=4 499 B13R1.28 COCCSCCc1ccccc1 62a_100000233755_100011218657 [0,0,0,1,0,0|3,0,0]=4 500 B13R1.28 COCCSCCc1ccccc1 62a_100000765856_100000233755 [0,0,0,1,0,0|3,0,0]=4 501 B13R1.28 COCCSCCc1ccccn1 34a_100011362645_200000210301 [0,0,0,1,0,0|3,0,0]=4 502 B13R1.28 COCCSCCc1ccccn1 62a_100000233755_100015183660 [0,0,0,1,0,0|3,0,0]=4 503 B13R1.28 COCCSCCc1ccccn1 62a_100015183660_100000233755 [0,0,0,1,0,0|3,0,0]=4 504 B13R1.28 COCCSCCc1ccccn1 7a_100011362645_200000210301 [0,0,0,1,0,0|3,0,0]=4 505 B13R1.28 COCNCCCc1ccccc1 2230a_100000211184_100000766300 [0,0,0,1,0,0|3,0,0]=4 506 B13R1.28 COCSCCCc1ccccc1 62a_100000211621_100000766300 [0,0,0,1,0,0|3,0,0]=4 507 B13R1.28 COCSCCCc1ccccc1 62a_100000766300_100000211621 [0,0,0,1,0,0|3,0,0]=4 508 B13R1.28 CSCCCCCc1ccccc1 62a_200000210301_200011217138 [0,0,0,1,0,0|2,0,0]=3 509 B13R1.28 CSCCCCCc1ccccc1 62a_200011217138_200000210301 [0,0,0,1,0,0|2,0,0]=3 510 B13R1.28 CSCCCCOc1ccccc1 62a_100011215240_200000210301 [0,0,0,1,0,0|3,0,0]=4 511 B13R1.28 CSCCCCOc1ccccc1 62a_200000210301_100011215240 [0,0,0,1,0,0|3,0,0]=4 512 B13R1.28 CSCCCNCc1ccccc1 207a_100000749238_100015611070 [0,0,0,1,0,0|3,0,0]=4 513 B13R1.28 CSCCCNCc1ccccc1 2230a_100000749238_100015291786 [0,0,0,1,0,0|3,0,0]=4 514 B13R1.28 CSCCCNCc1ccccc1 270004a_100000749238_100015611070 [0,0,0,1,0,0|3,0,0]=4 515 B13R1.28 CSCCCNCc1ccccn1 207a_100000749238_100000209966 [0,0,0,1,0,0|3,0,0]=4 516 B13R1.28 CSCCCNCc1ccccn1 2230a_100000749238_100000721315 [0,0,0,1,0,0|3,0,0]=4 517 B13R1.28 CSCCCNCc1ccccn1 270004a_100000749238_100000209966 [0,0,0,1,0,0|3,0,0]=4 518 B13R1.28 CSCCCOCc1ccccc1 34a_100000690336_100015291786 [0,0,0,1,0,0|3,0,0]=4 519 B13R1.28 CSCCCOCc1ccccc1 62a_100011215529_200000210301 [0,0,0,1,0,0|3,0,0]=4 520 B13R1.28 CSCCCOCc1ccccc1 62a_200000210301_100011215529 [0,0,0,1,0,0|3,0,0]=4 521 B13R1.28 CSCCCOCc1ccccc1 7a_100000690336_100000211182 [0,0,0,1,0,0|3,0,0]=4 522 B13R1.28 CSCCCOCc1ccccn1 34a_100000690336_100000721315 [0,0,0,1,0,0|3,0,0]=4 523 B13R1.28 CSCCCOCc1ccccn1 7a_100000690336_100000721315 [0,0,0,1,0,0|3,0,0]=4 524 B13R1.28 CSCCNCCc1ccccc1 2230a_100000106460_100000751147 [0,0,0,1,0,0|3,0,0]=4 525 B13R1.28 CSCCNCCc1ccccc1 2230a_100020590264_100000765856 [0,0,0,1,0,0|3,0,0]=4 526 B13R1.28 CSCCNCCc1ccccc1 34a_100000106460_100000212216 [0,0,0,1,0,0|3,0,0]=4 527 B13R1.28 CSCCNCCc1ccccn1 2230a_100020590264_100015183660 [0,0,0,1,0,0|3,0,0]=4 528 B13R1.28 CSCCOCCc1ccccc1 34a_100000210268_100000212216 [0,0,0,1,0,0|3,0,0]=4 529 B13R1.28 CSCCOCCc1ccccc1 34a_100000230434_100000765856 [0,0,0,1,0,0|3,0,0]=4 530 B13R1.28 CSCCOCCc1ccccc1 7a_100000210268_100000212216 [0,0,0,1,0,0|3,0,0]=4 531 B13R1.28 CSCCOCCc1ccccc1 7a_100000230434_100000765856 [0,0,0,1,0,0|3,0,0]=4 532 B13R1.28 CSCCOCCc1ccccn1 34a_100000210271_100000212216 [0,0,0,1,0,0|3,0,0]=4 533 B13R1.28 CSCCOCCc1ccccn1 7a_100000230434_100015183660 [0,0,0,1,0,0|3,0,0]=4 534 B13R1.28 CSCCSCCc1ccccc1 62a_100000212216_100011218657 [0,0,0,1,0,0|3,0,0]=4 535 B13R1.28 CSCCSCCc1ccccc1 62a_100000765856_100000751147 [0,0,0,1,0,0|3,0,0]=4 536 B13R1.28 CSCCSCCc1ccccn1 62a_100000212216_100015183660 [0,0,0,1,0,0|3,0,0]=4 537 B13R1.28 CSCCSCCc1ccccn1 62a_100015183660_100000751147 [0,0,0,1,0,0|3,0,0]=4 538 B13R1.28 CSCNCCCc1ccccc1 2230a_100000211184_100011218213 [0,0,0,1,0,0|3,0,0]=4 539 B13R1.28 CSCNCCCc1ccccc1 34a_100000211184_100011218213 [0,0,0,1,0,0|3,0,0]=4 540 B13R1.28 CSCOCCCc1ccccc1 34a_100000210828_100011218213 [0,0,0,1,0,0|3,0,0]=4 541 B13R1.28 CSCOCCCc1ccccn1 34a_100011215068_100011218213 [0,0,0,1,0,0|3,0,0]=4 542 B13R1.28 CSCSCCCc1ccccc1 62a_100000211621_100011218213 [0,0,0,1,0,0|3,0,0]=4 543 B13R1.28 CSCSCCCc1ccccc1 62a_100011218213_100000211621 [0,0,0,1,0,0|3,0,0]=4 544 B13R1.28 ClCCCCOCc1ccccc1 34a_100000210776_100015291786 [0,0,0,1,0,0|3,0,0]=4 545 B13R1.28 ClCCCCOCc1ccccc1 7a_100000210776_100000211182 [0,0,0,1,0,0|3,0,0]=4 546 B13R1.28 ClCCCCOCc1ccccn1 34a_100000210776_100000721315 [0,0,0,1,0,0|3,0,0]=4 547 B13R1.28 ClCCCCOCc1ccccn1 7a_100000210776_100000721315 [0,0,0,1,0,0|3,0,0]=4 548 B13R1.28 ClCCCOCCc1ccccc1 34a_100000230001_100000765856 [0,0,0,1,0,0|3,0,0]=4 549 B13R1.28 FCCCCCNc1ccccc1 34a_100000106764_100000729378 [0,0,0,1,0,0|3,0,0]=4 550 B13R1.28 FCCCCCOc1ccccc1 34a_100000210340_100000729378 [0,0,0,1,0,0|3,0,0]=4 551 B13R1.28 FCCCCCOc1ccccc1 7a_100000210340_100000729378 [0,0,0,1,0,0|3,0,0]=4 552 B13R1.28 FCCCCCSc1ccccc1 62a_100000719477_100000729378 [0,0,0,1,0,0|3,0,0]=4 553 B13R1.28 FCCCCCSc1ccccc1 62a_100000729378_100000041952 [0,0,0,1,0,0|3,0,0]=4 554 B13R1.28 FCCCCCSc1ccccn1 62a_100000729378_100011216584 [0,0,0,1,0,0|3,0,0]=4 555 B13R1.28 FCCCCCSc1ccccn1 62a_100011216584_100000729378 [0,0,0,1,0,0|3,0,0]=4 556 B13R1.28 FCCCCNCc1ccccc1 2230a_100015324214_100000729493 [0,0,0,1,0,0|3,0,0]=4 557 B13R1.28 FCCCCNCc1ccccc1 34a_100015324214_100000729493 [0,0,0,1,0,0|3,0,0]=4 558 B13R1.28 FCCCCOCc1ccccc1 34a_100000210790_100000729493 [0,0,0,1,0,0|3,0,0]=4 559 B13R1.28 FCCCCOCc1ccccc1 34a_100011995726_100015291786 [0,0,0,1,0,0|3,0,0]=4 560 B13R1.28 FCCCCOCc1ccccc1 7a_100000210790_100000729493 [0,0,0,1,0,0|3,0,0]=4 561 B13R1.28 FCCCCOCc1ccccc1 7a_100011995726_100000211182 [0,0,0,1,0,0|3,0,0]=4 562 B13R1.28 FCCCCOCc1ccccn1 34a_100011995726_100000721315 [0,0,0,1,0,0|3,0,0]=4 563 B13R1.28 FCCCCOCc1ccccn1 7a_100011995726_100000721315 [0,0,0,1,0,0|3,0,0]=4 564 B13R1.28 FCCCCSCc1ccccc1 62a_100000211182_100000729493 [0,0,0,1,0,0|3,0,0]=4 565 B13R1.28 FCCCCSCc1ccccc1 62a_100000729493_100015291786 [0,0,0,1,0,0|3,0,0]=4 566 B13R1.28 FCCCCSCc1ccccn1 62a_100000721315_100000729493 [0,0,0,1,0,0|3,0,0]=4 567 B13R1.28 FCCCCSCc1ccccn1 62a_100000729493_100000721315 [0,0,0,1,0,0|3,0,0]=4 568 B13R1.28 FCCCNCCc1ccccc1 2230a_100000106460_100011934791 [0,0,0,1,0,0|3,0,0]=4 569 B13R1.28 FCCCNCCc1ccccc1 2230a_100015189416_100000765856 [0,0,0,1,0,0|3,0,0]=4 570 B13R1.28 FCCCNCCc1ccccc1 34a_100000106460_100011934791 [0,0,0,1,0,0|3,0,0]=4 571 B13R1.28 FCCCNCCc1ccccc1 34a_100015189416_100000765856 [0,0,0,1,0,0|3,0,0]=4 572 B13R1.28 FCCCNCCc1ccccn1 2230a_100015189416_100015183660 [0,0,0,1,0,0|3,0,0]=4 573 B13R1.28 FCCCOCCc1ccccc1 34a_100000210268_100011934791 [0,0,0,1,0,0|3,0,0]=4 574 B13R1.28 FCCCOCCc1ccccc1 34a_100000759539_100000765856 [0,0,0,1,0,0|3,0,0]=4 575 B13R1.28 FCCCOCCc1ccccc1 7a_100000210268_100011934791 [0,0,0,1,0,0|3,0,0]=4 576 B13R1.28 FCCCOCCc1ccccn1 34a_100000210271_100011934791 [0,0,0,1,0,0|3,0,0]=4 577 B13R1.28 FCCCSCCc1ccccc1 62a_100000765856_100011934791 [0,0,0,1,0,0|3,0,0]=4 578 B13R1.28 FCCCSCCc1ccccc1 62a_100011934791_100011218657 [0,0,0,1,0,0|3,0,0]=4 579 B13R1.28 FCCCSCCc1ccccn1 62a_100011934791_100015183660 [0,0,0,1,0,0|3,0,0]=4 580 B13R1.28 FCCCSCCc1ccccn1 62a_100015183660_100011934791 [0,0,0,1,0,0|3,0,0]=4 581 B13R1.28 FCCNCCCc1ccccc1 2230a_100000211184_100011217306 [0,0,0,1,0,0|3,0,0]=4 582 B13R1.28 FCCNCCCc1ccccc1 34a_100000211184_100011217306 [0,0,0,1,0,0|3,0,0]=4 583 B13R1.28 FCCNCCCc1ccccc1 34a_100000724931_100000211621 [0,0,0,1,0,0|3,0,0]=4 584 B13R1.28 FCCOCCCc1ccccc1 34a_100000210828_100011217306 [0,0,0,1,0,0|3,0,0]=4 585 B13R1.28 FCCOCCCc1ccccc1 7a_100000210828_100011217306 [0,0,0,1,0,0|3,0,0]=4 586 B13R1.28 FCCOCCCc1ccccn1 34a_100011215068_100011217306 [0,0,0,1,0,0|3,0,0]=4 587 B13R1.28 FCCSCCCc1ccccc1 62a_100000211621_100011217306 [0,0,0,1,0,0|3,0,0]=4 588 B13R1.28 FCCSCCCc1ccccc1 62a_100011217306_100000211621 [0,0,0,1,0,0|3,0,0]=4 589 B13R1.28 FCNCCCCc1ccccc1 34a_100015280158_100015361967 [0,0,0,1,0,0|3,0,0]=4 590 B13R1.28 FCOCCCCc1ccccc1 34a_100000703073_100015361967 [0,0,0,1,0,0|3,0,0]=4 591 B13R1.28 FCOCCCCc1ccccc1 7a_100000703073_100015361967 [0,0,0,1,0,0|3,0,0]=4 592 B13R1.28 FCOCCCCc1ccccn1 34a_100012186994_100015361967 [0,0,0,1,0,0|3,0,0]=4 593 B13R1.28 FCSCCCCc1ccccc1 62a_100000701786_100015361967 [0,0,0,1,0,0|3,0,0]=4 594 B13R1.28 FCSCCCCc1ccccc1 62a_100015361967_100000701786 [0,0,0,1,0,0|3,0,0]=4 595 B13R1.28 ICCCCOCc1ccccc1 34a_200012148704_100015291786 [0,0,0,1,0,0|3,0,0]=4 596 B13R1.28 ICCCCOCc1ccccn1 34a_200012148704_100000721315 [0,0,0,1,0,0|3,0,0]=4 597 B13R1.28 NCCCCOCc1ccccc1 34a_100000750430_100015291786 [0,0,0,1,0,0|3,0,0]=4 598 B13R1.28 NCCCCOCc1ccccn1 34a_100000750430_100000721315 [0,0,0,1,0,0|3,0,0]=4 599 B13R1.28 NCCCOCCc1ccccc1 34a_100000182051_100000765856 [0,0,0,1,0,0|3,0,0]=4 600 B13R1.28 NCCOCCCc1ccccc1 34a_100000210304_100000211621 [0,0,0,1,0,0|3,0,0]=4 601 B13R1.28 OCCCCCNc1ccccc1 34a_100000106764_100000746330 [0,0,0,1,0,0|3,0,0]=4 602 B13R1.28 OCCCCCOc1ccccc1 34a_100000210340_100000746330 [0,0,0,1,0,0|3,0,0]=4 603 B13R1.28 OCCCCCOc1ccccc1 7a_100000210340_100000746330 [0,0,0,1,0,0|3,0,0]=4 604 B13R1.28 OCCCCCSc1ccccc1 62a_100000719477_100000746330 [0,0,0,1,0,0|3,0,0]=4 605 B13R1.28 OCCCCCSc1ccccc1 62a_100000746330_100000041952 [0,0,0,1,0,0|3,0,0]=4 606 B13R1.28 OCCCCCSc1ccccn1 62a_100000746330_100011216584 [0,0,0,1,0,0|3,0,0]=4 607 B13R1.28 OCCCCCSc1ccccn1 62a_100011216584_100000746330 [0,0,0,1,0,0|3,0,0]=4 608 B13R1.28 OCCCCNCc1ccccc1 207a_100000750430_100015611070 [0,0,0,1,0,0|3,0,0]=4 609 B13R1.28 OCCCCNCc1ccccc1 2230a_100000750430_100015291786 [0,0,0,1,0,0|3,0,0]=4 610 B13R1.28 OCCCCNCc1ccccc1 2230a_100015324214_100000210776 [0,0,0,1,0,0|3,0,0]=4 611 B13R1.28 OCCCCNCc1ccccc1 270004a_100000750430_100015611070 [0,0,0,1,0,0|3,0,0]=4 612 B13R1.28 OCCCCNCc1ccccc1 34a_100000750430_100015291786 [0,0,0,1,0,0|3,0,0]=4 613 B13R1.28 OCCCCNCc1ccccc1 34a_100015324214_100011216708 [0,0,0,1,0,0|3,0,0]=4 614 B13R1.28 OCCCCNCc1ccccn1 207a_100000750430_100000209966 [0,0,0,1,0,0|3,0,0]=4 615 B13R1.28 OCCCCNCc1ccccn1 2230a_100000750430_100000721315 [0,0,0,1,0,0|3,0,0]=4 616 B13R1.28 OCCCCNCc1ccccn1 270004a_100000750430_100000209966 [0,0,0,1,0,0|3,0,0]=4 617 B13R1.28 OCCCCNCc1ccccn1 34a_100000750430_100000721315 [0,0,0,1,0,0|3,0,0]=4 618 B13R1.28 OCCCCOCc1ccccc1 34a_100000210790_100011216708 [0,0,0,1,0,0|3,0,0]=4 619 B13R1.28 OCCCCOCc1ccccc1 7a_100000210790_100000210776 [0,0,0,1,0,0|3,0,0]=4 620 B13R1.28 OCCCCSCc1ccccc1 62a_100000210776_100015291786 [0,0,0,1,0,0|3,0,0]=4 621 B13R1.28 OCCCCSCc1ccccc1 62a_100000211182_100000210776 [0,0,0,1,0,0|3,0,0]=4 622 B13R1.28 OCCCCSCc1ccccn1 62a_100000210776_100000721315 [0,0,0,1,0,0|3,0,0]=4 623 B13R1.28 OCCCCSCc1ccccn1 62a_100000721315_100000210776 [0,0,0,1,0,0|3,0,0]=4 624 B13R1.28 OCCCNCCc1ccccc1 2230a_100000106460_100000230001 [0,0,0,1,0,0|3,0,0]=4 625 B13R1.28 OCCCNCCc1ccccc1 34a_100000106460_100000230001 [0,0,0,1,0,0|3,0,0]=4 626 B13R1.28 OCCCOCCc1ccccc1 34a_100000210268_100000230001 [0,0,0,1,0,0|3,0,0]=4 627 B13R1.28 OCCCOCCc1ccccc1 7a_100000210268_100011215043 [0,0,0,1,0,0|3,0,0]=4 628 B13R1.28 OCCCOCCc1ccccn1 34a_100000210271_100000230001 [0,0,0,1,0,0|3,0,0]=4 629 B13R1.28 OCCCSCCc1ccccc1 62a_100000765856_100011215043 [0,0,0,1,0,0|3,0,0]=4 630 B13R1.28 OCCCSCCc1ccccc1 62a_100011215043_100011218657 [0,0,0,1,0,0|3,0,0]=4 631 B13R1.28 OCCCSCCc1ccccn1 62a_100011215043_100015183660 [0,0,0,1,0,0|3,0,0]=4 632 B13R1.28 OCCCSCCc1ccccn1 62a_100015183660_100011215043 [0,0,0,1,0,0|3,0,0]=4 633 B13R1.28 OCCNCCCc1ccccc1 2230a_100000211184_100000211926 [0,0,0,1,0,0|3,0,0]=4 634 B13R1.28 OCCNCCCc1ccccc1 2230a_100016997473_100000211621 [0,0,0,1,0,0|3,0,0]=4 635 B13R1.28 OCCNCCCc1ccccc1 34a_100000211184_100000211926 [0,0,0,1,0,0|3,0,0]=4 636 B13R1.28 OCCNCCCc1ccccc1 34a_100016990907_100000211621 [0,0,0,1,0,0|3,0,0]=4 637 B13R1.28 OCCOCCCc1ccccc1 34a_100000210828_100000211926 [0,0,0,1,0,0|3,0,0]=4 638 B13R1.28 OCCOCCCc1ccccc1 7a_100000210828_100000211926 [0,0,0,1,0,0|3,0,0]=4 639 B13R1.28 OCCOCCCc1ccccn1 34a_100011215068_100000211926 [0,0,0,1,0,0|3,0,0]=4 640 B13R1.28 OCCSCCCc1ccccc1 62a_100000211621_100000211926 [0,0,0,1,0,0|3,0,0]=4 641 B13R1.28 OCCSCCCc1ccccc1 62a_100000211926_100000211621 [0,0,0,1,0,0|3,0,0]=4 642 B13R1.28 [13CH3]NCCCCCc1ccccc1 2230a_100000750932_200025704644 [0,0,0,1,0,0|2,0,0]=3 643 B13R1.28 [13CH3]NCCCCCc1ccccc1 34a_100000750932_200025704644 [0,0,0,1,0,0|2,0,0]=3 644 B13R1.28 [13CH3]NCCCOCc1ccccc1 2230a_200000206031_200025704644 [0,0,0,1,0,0|3,0,0]=4 645 B13R1.28 [13CH3]NCCCOCc1ccccc1 34a_200000206031_200025704644 [0,0,0,1,0,0|3,0,0]=4 646 B13R1.28 [13CH3]OCCCCCc1ccccc1 34a_200011219639_200025704644 [0,0,0,1,0,0|2,0,0]=3 647 B13R1.28 [13CH3]OCCCCCc1ccccc1 7a_200011219639_200025704644 [0,0,0,1,0,0|2,0,0]=3 648 B13R1.28 [13CH3]OCCCCOc1ccccc1 34a_100000752354_200025704644 [0,0,0,1,0,0|3,0,0]=4 649 B13R1.28 [13CH3]OCCCCOc1ccccc1 7a_100000752354_200025704644 [0,0,0,1,0,0|3,0,0]=4 650 B13R1.28 [13CH3]OCCCNCc1ccccc1 34a_100000185501_200025704644 [0,0,0,1,0,0|3,0,0]=4 651 B13R1.28 [13CH3]OCCCOCc1ccccc1 34a_100000691849_200025704644 [0,0,0,1,0,0|3,0,0]=4 652 B13R1.28 [13CH3]OCCCOCc1ccccc1 7a_100000691849_200025704644 [0,0,0,1,0,0|3,0,0]=4 653 B13R1.28 [13CH3]OCCSCCc1ccccn1 34a_100011362645_200025704644 [0,0,0,1,0,0|3,0,0]=4 654 B13R1.28 [13CH3]OCCSCCc1ccccn1 7a_100011362645_200025704644 [0,0,0,1,0,0|3,0,0]=4 655 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200011217138_200025704644 [0,0,0,1,0,0|2,0,0]=3 656 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200025704644_200011217138 [0,0,0,1,0,0|2,0,0]=3 657 B13R1.28 [13CH3]SCCCCOc1ccccc1 62a_100011215240_200025704644 [0,0,0,1,0,0|3,0,0]=4 658 B13R1.28 [13CH3]SCCCCOc1ccccc1 62a_200025704644_100011215240 [0,0,0,1,0,0|3,0,0]=4 659 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_100011215529_200025704644 [0,0,0,1,0,0|3,0,0]=4 660 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_200025704644_100011215529 [0,0,0,1,0,0|3,0,0]=4 661 B13R1.34 CCCCOc1cccccc1=O 34a_100000036025_100000210210 [0,0,0,1,0,0|1,0,2]=4 662 B13R1.34 CCCCOc1cccccc1=O 7a_100000036025_100000210211 [0,0,0,1,0,0|1,0,2]=4 663 B13R1.84 CCCCSc1ccccc1C=O 62a_100000210073_100000210210 [0,0,0,1,0,0|1,0,2]=4 664 B13R1.84 CCCCSc1ccccc1C=O 62a_100000210211_100000210073 [0,0,0,1,0,0|1,0,2]=4 665 B13R1.84 CCCCSc1ncccc1C=O 62a_100000210211_100009816751 [0,0,0,1,0,0|2,0,1]=4 666 B13R1.84 CCCCSc1ncccc1C=O 62a_100009816751_100000210210 [0,0,0,1,0,0|2,0,1]=4 667 B13R1.84 CCCOCc1ccccc1C=O 34a_100000210258_200009853537 [0,0,0,1,0,0|1,0,2]=4 668 B13R1.84 CCCSCc1ccccc1C=O 62a_100000210303_200009853537 [0,0,0,1,0,0|1,0,2]=4 669 B13R1.84 CCCSCc1ccccc1C=O 62a_200009853537_100000210303 [0,0,0,1,0,0|1,0,2]=4 670 B13R1.84 CCNCCc1ccccc1C=O 2230a_100015525214_100010186698 [0,0,0,1,0,0|1,0,2]=4 671 B13R1.84 CCOCCc1ccccc1C=O 34a_100121572206_100010186698 [0,0,0,1,0,0|1,0,2]=4 672 B13R1.84 CCSCCc1ccccc1C=O 62a_100000210202_100010186698 [0,0,0,1,0,0|1,0,2]=4 673 B13R1.84 CCSCCc1ccccc1C=O 62a_100010186698_100000210202 [0,0,0,1,0,0|1,0,2]=4 674 B13R1.119 C/C=C/C=C/COCC1CCCC1 34a_100016283227_100000740388 [0,0,0,1,0,0|2,0,1]=4 675 B13R1.119 CC=CC=CC=NNC1CCCC1 4a_100000737850_100000691131 [0,0,0,1,0,0|3,0,0]=4 676 B13R1.119 CCCCCCC=Cc1c[nH]cn1 271570a_200015348155_100000756875 [0,0,0,1,0,0|2,0,1]=4 677 B13R1.119 CCCCCCC=Cc1cc[nH]n1 271570a_200015348155_100000062575 [0,0,0,1,0,0|2,0,1]=4 678 B13R1.119 CCCCCCC=Cc1ccco1 271570a_200015348155_100009814098 [0,0,0,1,0,0|0,0,2]=3 679 B13R1.119 CCCCCCC=Cc1cccs1 271570a_200015348155_100011215356 [0,0,0,1,0,0|0,1,1]=3 680 B13R1.119 CCCCCCC=Cc1ccoc1 271570a_200015348155_100011215275 [0,0,0,1,0,0|2,0,1]=4 681 B13R1.119 CCCCCCC=Cc1ccsc1 271570a_200015348155_100000738268 [0,0,0,1,0,0|2,0,1]=4 682 B13R1.119 CCCCCCC=Cc1ccsn1 271570a_200015348155_100009818082 [0,0,0,1,0,0|2,0,1]=4 683 B13R1.119 CCCCCCC=Cc1cnco1 271570a_200015348155_100020591547 [0,0,0,1,0,0|1,0,2]=4 684 B13R1.119 CCCCCCC=Cc1cncs1 271570a_200015348155_100011934649 [0,0,0,1,0,0|1,1,1]=4 685 B13R1.119 CCCCCCC=Cc1cscn1 271570a_200015348155_100000751502 [0,0,0,1,0,0|2,0,1]=4 686 B13R1.119 CCCCCCC=Cc1ncc[nH]1 271570a_200015348155_100025796157 [0,0,0,1,0,0|2,0,1]=4 687 B13R1.119 CCCCCCC=Cc1ncco1 271570a_200015348155_100011787736 [0,0,0,1,0,0|1,0,2]=4 688 B13R1.119 CCCCCCC=Cc1nccs1 271570a_200015348155_100000211983 [0,0,0,1,0,0|1,1,1]=4 689 B13R1.119 CCCCCCCOc1ccsc1 34a_100000106738_100000210614 [0,0,0,1,0,0|3,0,0]=4 690 B13R1.119 CCCCCCCOc1ccsc1 7a_100000106738_100000210614 [0,0,0,1,0,0|3,0,0]=4 691 B13R1.119 CCCCCCCSc1c[nH]cn1 62a_100000210614_100000756875 [0,0,0,1,0,0|3,0,0]=4 692 B13R1.119 CCCCCCCSc1c[nH]cn1 62a_100000756875_100000210316 [0,0,0,1,0,0|3,0,0]=4 693 B13R1.119 CCCCCCCSc1cc[nH]n1 62a_100000062575_100000210316 [0,0,0,1,0,0|3,0,0]=4 694 B13R1.119 CCCCCCCSc1cc[nH]n1 62a_100000210614_100000062575 [0,0,0,1,0,0|3,0,0]=4 695 B13R1.119 CCCCCCCSc1ccco1 62a_100000210614_100009814098 [0,0,0,1,0,0|1,0,1]=3 696 B13R1.119 CCCCCCCSc1ccco1 62a_100009814098_100000210316 [0,0,0,1,0,0|1,0,1]=3 697 B13R1.119 CCCCCCCSc1cccs1 62a_100000210614_100011215356 [0,0,0,1,0,0|1,1,0]=3 698 B13R1.119 CCCCCCCSc1cccs1 62a_100011215356_100000210316 [0,0,0,1,0,0|1,1,0]=3 699 B13R1.119 CCCCCCCSc1ccoc1 62a_100000210614_100011215275 [0,0,0,1,0,0|3,0,0]=4 700 B13R1.119 CCCCCCCSc1ccoc1 62a_100011215275_100000210316 [0,0,0,1,0,0|3,0,0]=4 701 B13R1.119 CCCCCCCSc1ccon1 62a_100000210614_100009818083 [0,0,0,1,0,0|3,0,0]=4 702 B13R1.119 CCCCCCCSc1ccon1 62a_100009818083_100000210316 [0,0,0,1,0,0|3,0,0]=4 703 B13R1.119 CCCCCCCSc1ccsc1 62a_100000210614_100000738268 [0,0,0,1,0,0|3,0,0]=4 704 B13R1.119 CCCCCCCSc1ccsc1 62a_100000738268_100000210316 [0,0,0,1,0,0|3,0,0]=4 705 B13R1.119 CCCCCCCSc1ccsn1 62a_100000210614_100009818082 [0,0,0,1,0,0|3,0,0]=4 706 B13R1.119 CCCCCCCSc1ccsn1 62a_100009818082_100000210316 [0,0,0,1,0,0|3,0,0]=4 707 B13R1.119 CCCCCCCSc1cnco1 62a_100000210614_100020591547 [0,0,0,1,0,0|2,0,1]=4 708 B13R1.119 CCCCCCCSc1cnco1 62a_100020591547_100000210316 [0,0,0,1,0,0|2,0,1]=4 709 B13R1.119 CCCCCCCSc1cncs1 62a_100000210614_100011934649 [0,0,0,1,0,0|2,1,0]=4 710 B13R1.119 CCCCCCCSc1cncs1 62a_100011934649_100000210316 [0,0,0,1,0,0|2,1,0]=4 711 B13R1.119 CCCCCCCSc1cscn1 62a_100000210614_100000751502 [0,0,0,1,0,0|3,0,0]=4 712 B13R1.119 CCCCCCCSc1cscn1 62a_100000751502_100000210316 [0,0,0,1,0,0|3,0,0]=4 713 B13R1.119 CCCCCCCSc1ncc[nH]1 62a_100000210614_100025796157 [0,0,0,1,0,0|3,0,0]=4 714 B13R1.119 CCCCCCCSc1ncc[nH]1 62a_100025796157_100000210316 [0,0,0,1,0,0|3,0,0]=4 715 B13R1.119 CCCCCCCSc1ncco1 62a_100000210614_100011787736 [0,0,0,1,0,0|2,0,1]=4 716 B13R1.119 CCCCCCCSc1ncco1 62a_100011787736_100000210316 [0,0,0,1,0,0|2,0,1]=4 717 B13R1.119 CCCCCCCSc1nccs1 62a_100000210614_100000211983 [0,0,0,1,0,0|2,1,0]=4 718 B13R1.119 CCCCCCCSc1nccs1 62a_100000211983_100000210316 [0,0,0,1,0,0|2,1,0]=4 719 B13R1.119 CCCCCCNCc1ccco1 207a_100000210581_100000186105 [0,0,0,1,0,0|1,0,2]=4 720 B13R1.119 CCCCCCNCc1ccco1 2230a_100000185738_100000210314 [0,0,0,1,0,0|1,0,2]=4 721 B13R1.119 CCCCCCNCc1ccco1 270004a_100000210581_100000186105 [0,0,0,1,0,0|1,0,2]=4 722 B13R1.119 CCCCCCNCc1ccco1 34a_100000185738_100000210314 [0,0,0,1,0,0|1,0,2]=4 723 B13R1.119 CCCCCCNCc1cccs1 207a_100000210581_100000209959 [0,0,0,1,0,0|1,1,1]=4 724 B13R1.119 CCCCCCNCc1cccs1 2230a_100000211653_100000210314 [0,0,0,1,0,0|1,1,1]=4 725 B13R1.119 CCCCCCNCc1cccs1 270004a_100000210581_100000209959 [0,0,0,1,0,0|1,1,1]=4 726 B13R1.119 CCCCCCOCc1ccco1 34a_100000210059_100000210314 [0,0,0,1,0,0|1,0,2]=4 727 B13R1.119 CCCCCCOCc1cccs1 34a_100000211240_100000210314 [0,0,0,1,0,0|1,1,1]=4 728 B13R1.119 CCCCCNCCc1ccco1 2230a_100000694680_100000210326 [0,0,0,1,0,0|1,0,2]=4 729 B13R1.119 CCCCCNCCc1ccco1 34a_100000694680_100000718602 [0,0,0,1,0,0|1,0,2]=4 730 B13R1.119 CCCCCNCCc1cccs1 2230a_100000203755_100000210326 [0,0,0,1,0,0|1,1,1]=4 731 B13R1.119 CCCCCNCCc1cccs1 2230a_100000209983_100000748579 [0,0,0,1,0,0|1,1,1]=4 732 B13R1.119 CCCCCNCCc1cccs1 34a_100000203755_100000718602 [0,0,0,1,0,0|1,1,1]=4 733 B13R1.119 CCCCCNN=Cc1ccc[nH]1 4a_100000694160_100000211237 [0,0,0,1,0,0|3,0,0]=4 734 B13R1.119 CCCCCNN=Cc1ccco1 4a_100000694160_100000186105 [0,0,0,1,0,0|2,0,1]=4 735 B13R1.119 CCCCCNN=Cc1cccs1 4a_100000694160_100000209959 [0,0,0,1,0,0|2,1,0]=4 736 B13R1.119 CCCCCOCCc1cccs1 34a_100000210253_100000748579 [0,0,0,1,0,0|1,1,1]=4 737 B13R1.119 CCCCCOCCc1cccs1 34a_100011216825_100000718602 [0,0,0,1,0,0|1,1,1]=4 738 B13R1.119 CCCCCOCCc1cccs1 7a_100000210253_100000748579 [0,0,0,1,0,0|1,1,1]=4 739 B13R1.119 CCCCCOCCc1cccs1 7a_100011216825_100000210326 [0,0,0,1,0,0|1,1,1]=4 740 B13R1.119 CCCCCSCCc1cccs1 62a_100000210326_100000748579 [0,0,0,1,0,0|1,1,1]=4 741 B13R1.119 CCCCCSCCc1cccs1 62a_100000748579_100000210326 [0,0,0,1,0,0|1,1,1]=4 742 B13R1.119 CCCCNCC=Cc1ccco1 270004a_100000102301_100000185671 [0,0,0,1,0,0|1,0,2]=4 743 B13R1.119 CCCCNCCCc1cccs1 2230a_100000102301_100010992444 [0,0,0,1,0,0|1,1,1]=4 744 B13R1.119 CCCCNCCCc1cccs1 7a_106832991798_100010992444 [0,0,0,1,0,0|1,1,1]=4 745 B13R1.119 CCCCOCCCc1cccs1 34a_100000210227_100010992444 [0,0,0,1,0,0|1,1,1]=4 746 B13R1.119 CCCCOCCCc1cccs1 34a_100011713143_100000210210 [0,0,0,1,0,0|1,1,1]=4 747 B13R1.119 CCCCOCCCc1cccs1 7a_100000210227_100010992444 [0,0,0,1,0,0|1,1,1]=4 748 B13R1.119 CCCCOCCCc1cccs1 7a_100011713143_100000210211 [0,0,0,1,0,0|1,1,1]=4 749 B13R1.119 CCCCOCCSc1ccco1 62a_100000743108_100009814098 [0,0,0,1,0,0|2,0,1]=4 750 B13R1.119 CCCCOCCSc1ccco1 62a_100009814098_100000743108 [0,0,0,1,0,0|2,0,1]=4 751 B13R1.119 CCCCOCCSc1cccs1 62a_100000743108_100011215356 [0,0,0,1,0,0|2,1,0]=4 752 B13R1.119 CCCCOCCSc1cccs1 62a_100011215356_100000743108 [0,0,0,1,0,0|2,1,0]=4 753 B13R1.119 CCCCSCCCc1cccs1 62a_100000210211_100010992444 [0,0,0,1,0,0|1,1,1]=4 754 B13R1.119 CCCCSCCCc1cccs1 62a_100010992444_100000210210 [0,0,0,1,0,0|1,1,1]=4 755 B13R1.119 FCCCCCCSc1ccco1 62a_100009814098_100015922095 [0,0,0,1,0,0|2,0,1]=4 756 B13R1.119 FCCCCCCSc1ccco1 62a_100015922095_100009814098 [0,0,0,1,0,0|2,0,1]=4 757 B13R1.119 FCCCCCCSc1cccs1 62a_100011215356_100015922095 [0,0,0,1,0,0|2,1,0]=4 758 B13R1.119 FCCCCCCSc1cccs1 62a_100015922095_100011215356 [0,0,0,1,0,0|2,1,0]=4 759 B13R1.119 OCCCCCCSc1ccco1 62a_100000766143_100009814098 [0,0,0,1,0,0|2,0,1]=4 760 B13R1.119 OCCCCCCSc1ccco1 62a_100009814098_100000766143 [0,0,0,1,0,0|2,0,1]=4 761 B13R1.119 OCCCCCCSc1cccs1 62a_100000766143_100011215356 [0,0,0,1,0,0|2,1,0]=4 762 B13R1.119 OCCCCCCSc1cccs1 62a_100011215356_100000766143 [0,0,0,1,0,0|2,1,0]=4 763 B13R1.137 C=Cc1sccc1CCCCCC 271570a_100011290941_100009817158 [0,0,0,1,0,0|2,0,1]=4 764 B13R1.137 CCCCCSc1ccoc1C=O 62a_100000210326_100000756499 [0,0,0,1,0,0|2,0,1]=4 765 B13R1.137 CCCCCSc1ccoc1C=O 62a_100000756499_100000210326 [0,0,0,1,0,0|2,0,1]=4 766 B13R1.137 CCCCCSc1ccsc1C=O 62a_100000210326_100000766043 [0,0,0,1,0,0|2,0,1]=4 767 B13R1.137 CCCCCSc1ccsc1C=O 62a_100000766043_100000210326 [0,0,0,1,0,0|2,0,1]=4 768 B13R1.137 CCCCCSc1cscc1C=O 62a_100000210326_100000685484 [0,0,0,1,0,0|2,0,1]=4 769 B13R1.137 CCCCCSc1cscc1C=O 62a_100000685484_100000210326 [0,0,0,1,0,0|2,0,1]=4 770 B13R1.137 CCCCCSc1sccc1C=O 62a_100000210326_100009816921 [0,0,0,1,0,0|2,0,1]=4 771 B13R1.137 CCCCCSc1sccc1C=O 62a_100009816921_100000210326 [0,0,0,1,0,0|2,0,1]=4 772 B13R1.555 CCCCCNc1ccccc1Br 34a_100000210017_100000718602 [0,0,0,1,0,0|2,0,1]=4 773 B13R1.555 CCCCCNc1ccccc1C 34a_100015192222_100000718602 [0,0,0,1,0,0|2,0,1]=4 774 B13R1.555 CCCCCNc1ccccc1Cl 34a_100000185783_100000718602 [0,0,0,1,0,0|2,0,1]=4 775 B13R1.555 CCCCCNc1ccccc1F 34a_100000210422_100000718602 [0,0,0,1,0,0|2,0,1]=4 776 B13R1.555 CCCCCNc1ccccc1I 34a_100000210053_100000718602 [0,0,0,1,0,0|2,0,1]=4 777 B13R1.555 CCCCCNc1ccccc1O 34a_100000185747_100000718602 [0,0,0,1,0,0|1,0,2]=4 778 B13R1.555 CCCCCOc1ccccc1Br 34a_100000181306_100000718602 [0,0,0,1,0,0|2,0,1]=4 779 B13R1.555 CCCCCOc1ccccc1Br 7a_100000181306_100000210326 [0,0,0,1,0,0|2,0,1]=4 780 B13R1.555 CCCCCOc1ccccc1C 34a_100000210338_100000718602 [0,0,0,1,0,0|2,0,1]=4 781 B13R1.555 CCCCCOc1ccccc1C 7a_100000210338_100000210326 [0,0,0,1,0,0|2,0,1]=4 782 B13R1.555 CCCCCOc1ccccc1Cl 34a_100000210172_100000718602 [0,0,0,1,0,0|2,0,1]=4 783 B13R1.555 CCCCCOc1ccccc1Cl 7a_100000210172_100000210326 [0,0,0,1,0,0|2,0,1]=4 784 B13R1.555 CCCCCOc1ccccc1F 34a_100000210171_100000718602 [0,0,0,1,0,0|2,0,1]=4 785 B13R1.555 CCCCCOc1ccccc1F 7a_100000210171_100000210326 [0,0,0,1,0,0|2,0,1]=4 786 B13R1.555 CCCCCOc1ccccc1I 34a_100000739446_100000718602 [0,0,0,1,0,0|2,0,1]=4 787 B13R1.555 CCCCCOc1ccccc1I 7a_100000739446_100000210326 [0,0,0,1,0,0|2,0,1]=4 788 B13R1.555 CCCCCOc1ccccc1N 34a_100000185747_100000718602 [0,0,0,1,0,0|2,0,1]=4 789 B13R1.555 CCCCCOc1ccccc1N 7a_100000185747_100000210326 [0,0,0,1,0,0|2,0,1]=4 790 B13R1.555 CCCCCOc1cccoc1=O 34a_100000077404_100000718602 [0,0,0,1,0,0|2,0,1]=4 791 B13R1.555 CCCCCOc1cccoc1=O 7a_100000077404_100000210326 [0,0,0,1,0,0|2,0,1]=4 792 B13R1.555 CCCCCOc1coccc1=O 34a_100000060831_100000718602 [0,0,0,1,0,0|2,0,1]=4 793 B13R1.555 CCCCCSc1c[nH]ccc1=O 62a_100000210326_100009998708 [0,0,0,1,0,0|2,0,1]=4 794 B13R1.555 CCCCCSc1c[nH]ccc1=O 62a_100009998708_100000210326 [0,0,0,1,0,0|2,0,1]=4 795 B13R1.555 CCCCCSc1ccccc1Br 62a_100000210326_100000695589 [0,0,0,1,0,0|2,0,1]=4 796 B13R1.555 CCCCCSc1ccccc1Br 62a_100000695589_100000210326 [0,0,0,1,0,0|2,0,1]=4 797 B13R1.555 CCCCCSc1ccccc1C 62a_100000210326_100000210755 [0,0,0,1,0,0|2,0,1]=4 798 B13R1.555 CCCCCSc1ccccc1C 62a_100000210755_100000210326 [0,0,0,1,0,0|2,0,1]=4 799 B13R1.555 CCCCCSc1ccccc1Cl 62a_100000210326_100000764095 [0,0,0,1,0,0|2,0,1]=4 800 B13R1.555 CCCCCSc1ccccc1Cl 62a_100000764095_100000210326 [0,0,0,1,0,0|2,0,1]=4 801 B13R1.555 CCCCCSc1ccccc1F 62a_100000210326_100011215700 [0,0,0,1,0,0|2,0,1]=4 802 B13R1.555 CCCCCSc1ccccc1F 62a_100011215700_100000210326 [0,0,0,1,0,0|2,0,1]=4 803 B13R1.555 CCCCCSc1ccccc1N 62a_100000210017_100000210326 [0,0,0,1,0,0|2,0,1]=4 804 B13R1.555 CCCCCSc1ccccc1N 62a_100000210326_100000210017 [0,0,0,1,0,0|2,0,1]=4 805 B13R1.555 CCCCCSc1ccccc1O 62a_100000210326_100000739446 [0,0,0,1,0,0|1,0,2]=4 806 B13R1.555 CCCCCSc1ccccc1O 62a_100000739446_100000210326 [0,0,0,1,0,0|1,0,2]=4 807 B13R1.555 CCCCNCc1ccccc1Br 207a_100000102301_100000211189 [0,0,0,1,0,0|2,0,1]=4 808 B13R1.555 CCCCNCc1ccccc1Br 2230a_100000102301_100000184730 [0,0,0,1,0,0|2,0,1]=4 809 B13R1.555 CCCCNCc1ccccc1Br 2230a_100000689332_100000210211 [0,0,0,1,0,0|2,0,1]=4 810 B13R1.555 CCCCNCc1ccccc1Br 270004a_100000102301_100000211189 [0,0,0,1,0,0|2,0,1]=4 811 B13R1.555 CCCCNCc1ccccc1Br 34a_100000689332_100000210210 [0,0,0,1,0,0|2,0,1]=4 812 B13R1.555 CCCCNCc1ccccc1Br 7a_106832991798_100000184730 [0,0,0,1,0,0|2,0,1]=4 813 B13R1.555 CCCCNCc1ccccc1C 207a_100000102301_100000211143 [0,0,0,1,0,0|2,0,1]=4 814 B13R1.555 CCCCNCc1ccccc1C 2230a_100000102301_100000211839 [0,0,0,1,0,0|2,0,1]=4 815 B13R1.555 CCCCNCc1ccccc1C 270004a_100000102301_100000211143 [0,0,0,1,0,0|2,0,1]=4 816 B13R1.555 CCCCNCc1ccccc1C 34a_100000174972_100000210210 [0,0,0,1,0,0|2,0,1]=4 817 B13R1.555 CCCCNCc1ccccc1C 7a_106832991798_100000211839 [0,0,0,1,0,0|2,0,1]=4 818 B13R1.555 CCCCNCc1ccccc1Cl 207a_100000102301_100000210073 [0,0,0,1,0,0|2,0,1]=4 819 B13R1.555 CCCCNCc1ccccc1Cl 2230a_100000102301_100000187162 [0,0,0,1,0,0|2,0,1]=4 820 B13R1.555 CCCCNCc1ccccc1Cl 2230a_100000174879_100000210211 [0,0,0,1,0,0|2,0,1]=4 821 B13R1.555 CCCCNCc1ccccc1Cl 270004a_100000102301_100000210073 [0,0,0,1,0,0|2,0,1]=4 822 B13R1.555 CCCCNCc1ccccc1Cl 34a_100000174879_100000210210 [0,0,0,1,0,0|2,0,1]=4 823 B13R1.555 CCCCNCc1ccccc1Cl 7a_106832991798_100000187162 [0,0,0,1,0,0|2,0,1]=4 824 B13R1.555 CCCCNCc1ccccc1F 207a_100000102301_100000210811 [0,0,0,1,0,0|2,0,1]=4 825 B13R1.555 CCCCNCc1ccccc1F 2230a_100000102301_100000211605 [0,0,0,1,0,0|2,0,1]=4 826 B13R1.555 CCCCNCc1ccccc1F 270004a_100000102301_100000210811 [0,0,0,1,0,0|2,0,1]=4 827 B13R1.555 CCCCNCc1ccccc1F 34a_100000174869_100000210210 [0,0,0,1,0,0|2,0,1]=4 828 B13R1.555 CCCCNCc1ccccc1F 7a_106832991798_100000211605 [0,0,0,1,0,0|2,0,1]=4 829 B13R1.555 CCCCNCc1ccccc1I 207a_100000102301_100000010305 [0,0,0,1,0,0|2,0,1]=4 830 B13R1.555 CCCCNCc1ccccc1I 2230a_100000102301_100011215278 [0,0,0,1,0,0|2,0,1]=4 831 B13R1.555 CCCCNCc1ccccc1I 270004a_100000102301_100000010305 [0,0,0,1,0,0|2,0,1]=4 832 B13R1.555 CCCCNCc1ccccc1I 7a_106832991798_100011215278 [0,0,0,1,0,0|2,0,1]=4 833 B13R1.555 CCCCNCc1ccccc1O 34a_100000185550_100000210210 [0,0,0,1,0,0|1,0,2]=4 834 B13R1.555 CCCCOCc1ccccc1Br 34a_100000210227_100000184730 [0,0,0,1,0,0|2,0,1]=4 835 B13R1.555 CCCCOCc1ccccc1Br 34a_100000756307_100000210210 [0,0,0,1,0,0|2,0,1]=4 836 B13R1.555 CCCCOCc1ccccc1Br 7a_100000210227_100000184730 [0,0,0,1,0,0|2,0,1]=4 837 B13R1.555 CCCCOCc1ccccc1Br 7a_100000756307_100000210211 [0,0,0,1,0,0|2,0,1]=4 838 B13R1.555 CCCCOCc1ccccc1C 34a_100000210227_100000211839 [0,0,0,1,0,0|2,0,1]=4 839 B13R1.555 CCCCOCc1ccccc1C 34a_100000698903_100000210210 [0,0,0,1,0,0|2,0,1]=4 840 B13R1.555 CCCCOCc1ccccc1C 7a_100000210227_100000211839 [0,0,0,1,0,0|2,0,1]=4 841 B13R1.555 CCCCOCc1ccccc1C 7a_100000698903_100000210211 [0,0,0,1,0,0|2,0,1]=4 842 B13R1.555 CCCCOCc1ccccc1Cl 34a_100000210227_100000187162 [0,0,0,1,0,0|2,0,1]=4 843 B13R1.555 CCCCOCc1ccccc1Cl 34a_100000210847_100000210210 [0,0,0,1,0,0|2,0,1]=4 844 B13R1.555 CCCCOCc1ccccc1Cl 7a_100000210227_100000187162 [0,0,0,1,0,0|2,0,1]=4 845 B13R1.555 CCCCOCc1ccccc1Cl 7a_100000210847_100000210211 [0,0,0,1,0,0|2,0,1]=4 846 B13R1.555 CCCCOCc1ccccc1F 34a_100000210227_100000211605 [0,0,0,1,0,0|2,0,1]=4 847 B13R1.555 CCCCOCc1ccccc1F 34a_100000211962_100000210210 [0,0,0,1,0,0|2,0,1]=4 848 B13R1.555 CCCCOCc1ccccc1F 7a_100000210227_100000211605 [0,0,0,1,0,0|2,0,1]=4 849 B13R1.555 CCCCOCc1ccccc1F 7a_100000211962_100000210211 [0,0,0,1,0,0|2,0,1]=4 850 B13R1.555 CCCCOCc1ccccc1I 34a_100000187465_100000210210 [0,0,0,1,0,0|2,0,1]=4 851 B13R1.555 CCCCOCc1ccccc1I 34a_100000210227_100011215278 [0,0,0,1,0,0|2,0,1]=4 852 B13R1.555 CCCCOCc1ccccc1I 7a_100000187465_100000210211 [0,0,0,1,0,0|2,0,1]=4 853 B13R1.555 CCCCOCc1ccccc1I 7a_100000210227_100011215278 [0,0,0,1,0,0|2,0,1]=4 854 B13R1.555 CCCCOCc1ccccc1N 34a_100000212039_100000210210 [0,0,0,1,0,0|2,0,1]=4 855 B13R1.555 CCCCSCc1ccccc1Br 62a_100000184730_100000210210 [0,0,0,1,0,0|2,0,1]=4 856 B13R1.555 CCCCSCc1ccccc1Br 62a_100000210211_100000184730 [0,0,0,1,0,0|2,0,1]=4 857 B13R1.555 CCCCSCc1ccccc1C 62a_100000210211_100000211839 [0,0,0,1,0,0|2,0,1]=4 858 B13R1.555 CCCCSCc1ccccc1C 62a_100000211839_100000210210 [0,0,0,1,0,0|2,0,1]=4 859 B13R1.555 CCCCSCc1ccccc1Cl 62a_100000187162_100000210210 [0,0,0,1,0,0|2,0,1]=4 860 B13R1.555 CCCCSCc1ccccc1Cl 62a_100000210211_100000187162 [0,0,0,1,0,0|2,0,1]=4 861 B13R1.555 CCCCSCc1ccccc1F 62a_100000210211_100000211605 [0,0,0,1,0,0|2,0,1]=4 862 B13R1.555 CCCCSCc1ccccc1F 62a_100000211605_100000210210 [0,0,0,1,0,0|2,0,1]=4 863 B13R1.555 CCCCSCc1ccccc1I 62a_100000210211_100011216222 [0,0,0,1,0,0|2,0,1]=4 864 B13R1.555 CCCCSCc1ccccc1I 62a_100011216222_100000210210 [0,0,0,1,0,0|2,0,1]=4 865 B13R1.555 CCCCSCc1ccccc1O 271570a_203496583355_200011870348 [0,0,0,1,0,0|1,0,2]=4 866 B13R1.555 CCCNCCc1ccccc1Br 2230a_100000747383_100000210303 [0,0,0,1,0,0|2,0,1]=4 867 B13R1.555 CCCNCCc1ccccc1Br 34a_100000747383_100000210303 [0,0,0,1,0,0|2,0,1]=4 868 B13R1.555 CCCNCCc1ccccc1C 2230a_100000685071_100000210303 [0,0,0,1,0,0|2,0,1]=4 869 B13R1.555 CCCNCCc1ccccc1C 34a_100000685071_100000210303 [0,0,0,1,0,0|2,0,1]=4 870 B13R1.555 CCCNCCc1ccccc1Cl 2230a_100011207228_100000210303 [0,0,0,1,0,0|2,0,1]=4 871 B13R1.555 CCCNCCc1ccccc1Cl 270004a_100020643023_200011713468 [0,0,0,1,0,0|2,0,1]=4 872 B13R1.555 CCCNCCc1ccccc1Cl 34a_100011207228_100000210303 [0,0,0,1,0,0|2,0,1]=4 873 B13R1.555 CCCNCCc1ccccc1F 2230a_100000185272_100000210303 [0,0,0,1,0,0|2,0,1]=4 874 B13R1.555 CCCNCCc1ccccc1F 34a_100000185272_100000210303 [0,0,0,1,0,0|2,0,1]=4 875 B13R1.555 CCCNCCc1ccccc1O 34a_100011207237_100000210303 [0,0,0,1,0,0|1,0,2]=4 876 B13R1.555 CCCNCCn1ccccc1=O 2230a_100000687133_100000210303 [0,0,0,1,0,0|2,0,0]=3 877 B13R1.555 CCCOCCc1ccccc1Br 34a_100000210258_100012161201 [0,0,0,1,0,0|2,0,1]=4 878 B13R1.555 CCCOCCc1ccccc1Br 34a_100000731337_100000210303 [0,0,0,1,0,0|2,0,1]=4 879 B13R1.555 CCCOCCc1ccccc1Br 7a_100000731337_100000210303 [0,0,0,1,0,0|2,0,1]=4 880 B13R1.555 CCCOCCc1ccccc1C 34a_100000210258_100011713688 [0,0,0,1,0,0|2,0,1]=4 881 B13R1.555 CCCOCCc1ccccc1C 34a_100011220023_100000210303 [0,0,0,1,0,0|2,0,1]=4 882 B13R1.555 CCCOCCc1ccccc1C 7a_100011220023_100000210303 [0,0,0,1,0,0|2,0,1]=4 883 B13R1.555 CCCOCCc1ccccc1Cl 34a_100000210258_100011713703 [0,0,0,1,0,0|2,0,1]=4 884 B13R1.555 CCCOCCc1ccccc1Cl 34a_100011215284_100000210303 [0,0,0,1,0,0|2,0,1]=4 885 B13R1.555 CCCOCCc1ccccc1Cl 7a_100011215284_100000210303 [0,0,0,1,0,0|2,0,1]=4 886 B13R1.555 CCCOCCc1ccccc1F 34a_100000210258_100000720011 [0,0,0,1,0,0|2,0,1]=4 887 B13R1.555 CCCOCCc1ccccc1F 34a_100000753711_100000210303 [0,0,0,1,0,0|2,0,1]=4 888 B13R1.555 CCCOCCc1ccccc1F 7a_100000753711_100000210303 [0,0,0,1,0,0|2,0,1]=4 889 B13R1.555 CCCOCCc1ccccc1I 34a_100010255290_100000210303 [0,0,0,1,0,0|2,0,1]=4 890 B13R1.555 CCCOCCc1ccccc1I 7a_100010255290_100000210303 [0,0,0,1,0,0|2,0,1]=4 891 B13R1.555 CCCOCCc1ccccc1N 34a_100011215289_100000210303 [0,0,0,1,0,0|2,0,1]=4 892 B13R1.555 CCCOCCc1ccccc1O 34a_100000210258_100000722297 [0,0,0,1,0,0|1,0,2]=4 893 B13R1.555 CCCSCCc1ccccc1Br 62a_100000210303_100012161201 [0,0,0,1,0,0|2,0,1]=4 894 B13R1.555 CCCSCCc1ccccc1Br 62a_100012161201_100000210303 [0,0,0,1,0,0|2,0,1]=4 895 B13R1.555 CCCSCCc1ccccc1C 62a_100000210303_100011713688 [0,0,0,1,0,0|2,0,1]=4 896 B13R1.555 CCCSCCc1ccccc1C 62a_100011713688_100000210303 [0,0,0,1,0,0|2,0,1]=4 897 B13R1.555 CCCSCCc1ccccc1Cl 62a_100000210303_100011713703 [0,0,0,1,0,0|2,0,1]=4 898 B13R1.555 CCCSCCc1ccccc1Cl 62a_100011713703_100000210303 [0,0,0,1,0,0|2,0,1]=4 899 B13R1.555 CCCSCCc1ccccc1F 62a_100000210303_100011713696 [0,0,0,1,0,0|2,0,1]=4 900 B13R1.555 CCCSCCc1ccccc1F 62a_100011713696_100000210303 [0,0,0,1,0,0|2,0,1]=4 901 B13R1.555 CCCSCCc1ccccc1O 62a_100000210303_100000722297 [0,0,0,1,0,0|1,0,2]=4 902 B13R1.555 CCCSCCc1ccccc1O 62a_100000722297_100000210303 [0,0,0,1,0,0|1,0,2]=4 903 B13R1.555 CCNCCCc1ccccc1Br 2230a_100015525214_200011713681 [0,0,0,1,0,0|2,0,1]=4 904 B13R1.555 CCNCCCc1ccccc1F 2230a_100000724733_100000210202 [0,0,0,1,0,0|2,0,1]=4 905 B13R1.555 CCNCCCc1ccccc1F 34a_100000724733_100000210202 [0,0,0,1,0,0|2,0,1]=4 906 B13R1.555 CCOCCCc1ccccc1Br 34a_100000699526_100000210202 [0,0,0,1,0,0|2,0,1]=4 907 B13R1.555 CCOCCCc1ccccc1Br 34a_100121572206_200011713681 [0,0,0,1,0,0|2,0,1]=4 908 B13R1.555 CCOCCCc1ccccc1Br 7a_100000699526_100000210202 [0,0,0,1,0,0|2,0,1]=4 909 B13R1.555 CCOCCCc1ccccc1Cl 34a_100011709251_100000210202 [0,0,0,1,0,0|2,0,1]=4 910 B13R1.555 CCOCCCc1ccccc1Cl 7a_100011709251_100000210202 [0,0,0,1,0,0|2,0,1]=4 911 B13R1.555 CCOCCCc1ccccc1F 34a_100011709249_100000210202 [0,0,0,1,0,0|2,0,1]=4 912 B13R1.555 CCOCCCc1ccccc1F 7a_100011709249_100000210202 [0,0,0,1,0,0|2,0,1]=4 913 B13R1.555 CCSCCCc1ccccc1Br 62a_100000210202_200011713681 [0,0,0,1,0,0|2,0,1]=4 914 B13R1.555 CCSCCCc1ccccc1Br 62a_200011713681_100000210202 [0,0,0,1,0,0|2,0,1]=4 915 B13R1.555 COCCCCc1ccccc1Br 34a_100012092669_200000210301 [0,0,0,1,0,0|2,0,1]=4 916 B13R1.555 COCCCCc1ccccc1Br 7a_100012092669_200000210301 [0,0,0,1,0,0|2,0,1]=4 917 B13R1.555 COCNCCn1ccccc1=O 2230a_100000687133_100000766300 [0,0,0,1,0,0|3,0,0]=4 918 B13R1.555 CSCNCCn1ccccc1=O 2230a_100000687133_100011218213 [0,0,0,1,0,0|3,0,0]=4 919 B13R1.555 O=c1ccccn1CCNCCF 2230a_100000687133_100011217306 [0,0,0,1,0,0|3,0,0]=4 920 B13R1.555 O=c1ccccn1CCNCCO 2230a_100000687133_100000211926 [0,0,0,1,0,0|3,0,0]=4 921 B13R1.555 [13CH3]OCCCCc1ccccc1Br 34a_100012092669_200025704644 [0,0,0,1,0,0|2,0,1]=4 922 B13R1.555 [13CH3]OCCCCc1ccccc1Br 7a_100012092669_200025704644 [0,0,0,1,0,0|2,0,1]=4 923 B13R1.560 CC=CC=CC=NNCC1CCC1 4a_200020586977_100000691131 [0,0,0,1,0,0|3,0,0]=4 924 B13R1.654 CCCCCCSc1ccsc1C 62a_100000210314_100000684487 [0,0,0,1,0,0|3,0,0]=4 925 B13R1.654 CCCCCCSc1ccsc1C 62a_100000684487_100000210757 [0,0,0,1,0,0|3,0,0]=4 926 B13R1.654 CCCCCCSc1cscc1Br 62a_100000210314_100010143727 [0,0,0,1,0,0|3,0,0]=4 927 B13R1.654 CCCCCCSc1cscc1Br 62a_100010143727_100000210757 [0,0,0,1,0,0|3,0,0]=4 928 B13R1.654 CCCCCCSc1cscc1C 62a_100000210314_100000759966 [0,0,0,1,0,0|3,0,0]=4 929 B13R1.654 CCCCCCSc1cscc1C 62a_100000759966_100000210757 [0,0,0,1,0,0|3,0,0]=4 930 B13R1.654 CCCCCCSc1sccc1Br 62a_100000210314_100012361411 [0,0,0,1,0,0|3,0,0]=4 931 B13R1.654 CCCCCCSc1sccc1Br 62a_100012361411_100000210757 [0,0,0,1,0,0|3,0,0]=4 932 B13R1.654 CCCCCCSc1sccc1C 62a_100000210314_100010247149 [0,0,0,1,0,0|3,0,0]=4 933 B13R1.654 CCCCCCSc1sccc1C 62a_100010247149_100000210757 [0,0,0,1,0,0|3,0,0]=4 934 B13R1.654 CCCCCNCc1cccn1C 270004a_100000209983_100000211633 [0,0,0,1,0,0|3,0,0]=4 935 B13R1.654 CCCCCNCc1cccn1C 34a_100011219357_100000718602 [0,0,0,1,0,0|3,0,0]=4 936 B13R1.654 CCCCCNCc1ccsc1Br 207a_100000209983_100009816921 [0,0,0,1,0,0|3,0,0]=4 937 B13R1.654 CCCCCNCc1ccsc1Br 2230a_100000209983_100009814289 [0,0,0,1,0,0|3,0,0]=4 938 B13R1.654 CCCCCNCc1ccsc1Br 2230a_100000727803_100000210326 [0,0,0,1,0,0|3,0,0]=4 939 B13R1.654 CCCCCNCc1ccsc1Br 270004a_100000209983_100009816921 [0,0,0,1,0,0|3,0,0]=4 940 B13R1.654 CCCCCNCc1ccsc1Br 34a_100000727803_100000718602 [0,0,0,1,0,0|3,0,0]=4 941 B13R1.654 CCCCCNCc1ccsc1Cl 207a_100000209983_100000089901 [0,0,0,1,0,0|3,0,0]=4 942 B13R1.654 CCCCCNCc1ccsc1Cl 2230a_100000209983_100010167017 [0,0,0,1,0,0|3,0,0]=4 943 B13R1.654 CCCCCNCc1ccsc1Cl 270004a_100000209983_100000089901 [0,0,0,1,0,0|3,0,0]=4 944 B13R1.654 CCCCCNCc1cscc1Br 207a_100000209983_100000685484 [0,0,0,1,0,0|3,0,0]=4 945 B13R1.654 CCCCCNCc1cscc1Br 270004a_100000209983_100000685484 [0,0,0,1,0,0|3,0,0]=4 946 B13R1.654 CCCCCNCc1occc1Br 270004a_100000209983_100000756499 [0,0,0,1,0,0|3,0,0]=4 947 B13R1.654 CCCCCNCc1occc1C 207a_100000209983_100000763527 [0,0,0,1,0,0|3,0,0]=4 948 B13R1.654 CCCCCNCc1occc1C 270004a_100000209983_100000763527 [0,0,0,1,0,0|3,0,0]=4 949 B13R1.654 CCCCCNCc1sccc1Br 207a_100000209983_100000766043 [0,0,0,1,0,0|3,0,0]=4 950 B13R1.654 CCCCCNCc1sccc1Br 270004a_100000209983_100000766043 [0,0,0,1,0,0|3,0,0]=4 951 B13R1.654 CCCCCNCc1sccc1C 207a_100000209983_100000210881 [0,0,0,1,0,0|3,0,0]=4 952 B13R1.654 CCCCCNCc1sccc1C 2230a_100000238519_100000210326 [0,0,0,1,0,0|3,0,0]=4 953 B13R1.654 CCCCCNCc1sccc1C 270004a_100000209983_100000210881 [0,0,0,1,0,0|3,0,0]=4 954 B13R1.654 CCCCCNCc1sccc1C 34a_100000238519_100000718602 [0,0,0,1,0,0|3,0,0]=4 955 B13R1.654 CCCCCNCc1sccc1Cl 207a_100000209983_100000722334 [0,0,0,1,0,0|3,0,0]=4 956 B13R1.654 CCCCCNCc1sccc1Cl 2230a_100011934584_100000210326 [0,0,0,1,0,0|3,0,0]=4 957 B13R1.654 CCCCCNCc1sccc1Cl 270004a_100000209983_100000722334 [0,0,0,1,0,0|3,0,0]=4 958 B13R1.654 CCCCCNCc1sccc1Cl 34a_100011934584_100000718602 [0,0,0,1,0,0|3,0,0]=4 959 B13R1.654 CCCCCOCC1=CCCC1=O 34a_100000087531_100000718602 [0,0,0,1,0,0|1,0,2]=4 960 B13R1.654 CCCCCOCc1ccoc1C 34a_100011219433_100000718602 [0,0,0,1,0,0|3,0,0]=4 961 B13R1.654 CCCCCOCc1ccoc1C 7a_100011219433_100000210326 [0,0,0,1,0,0|3,0,0]=4 962 B13R1.654 CCCCCOCc1ccsc1Br 34a_100000210253_100009814289 [0,0,0,1,0,0|3,0,0]=4 963 B13R1.654 CCCCCOCc1ccsc1Br 34a_100009816922_100000718602 [0,0,0,1,0,0|3,0,0]=4 964 B13R1.654 CCCCCOCc1ccsc1Br 7a_100000210253_100009814289 [0,0,0,1,0,0|3,0,0]=4 965 B13R1.654 CCCCCOCc1ccsc1Br 7a_100009816922_100000210326 [0,0,0,1,0,0|3,0,0]=4 966 B13R1.654 CCCCCOCc1ccsc1Cl 34a_100000210253_100010167017 [0,0,0,1,0,0|3,0,0]=4 967 B13R1.654 CCCCCOCc1ccsc1Cl 7a_100000210253_100010167017 [0,0,0,1,0,0|3,0,0]=4 968 B13R1.654 CCCCCOCc1cscc1Br 34a_100000724555_100000718602 [0,0,0,1,0,0|3,0,0]=4 969 B13R1.654 CCCCCOCc1occc1C 34a_100011273948_100000718602 [0,0,0,1,0,0|3,0,0]=4 970 B13R1.654 CCCCCOCc1occc1C 7a_100011273948_100000210326 [0,0,0,1,0,0|3,0,0]=4 971 B13R1.654 CCCCCOCc1sccc1Br 34a_100000702026_100000718602 [0,0,0,1,0,0|3,0,0]=4 972 B13R1.654 CCCCCOCc1sccc1C 34a_100000238368_100000718602 [0,0,0,1,0,0|3,0,0]=4 973 B13R1.654 CCCCCOCc1sccc1C 7a_100000238368_100000210326 [0,0,0,1,0,0|3,0,0]=4 974 B13R1.654 CCCCCOCc1sccc1Cl 34a_100000722387_100000718602 [0,0,0,1,0,0|3,0,0]=4 975 B13R1.654 CCCCCOCc1sccc1Cl 7a_100000722387_100000210326 [0,0,0,1,0,0|3,0,0]=4 976 B13R1.654 CCCCCSCc1ccsc1Br 62a_100000210326_100009814289 [0,0,0,1,0,0|3,0,0]=4 977 B13R1.654 CCCCCSCc1ccsc1Br 62a_100009814289_100000210326 [0,0,0,1,0,0|3,0,0]=4 978 B13R1.654 CCCCCSCc1ccsc1Cl 62a_100000210326_100010167017 [0,0,0,1,0,0|3,0,0]=4 979 B13R1.654 CCCCCSCc1ccsc1Cl 62a_100010167017_100000210326 [0,0,0,1,0,0|3,0,0]=4 980 B13R1.654 CCCCNCCc1cccn1C 2230a_100011251756_100000210211 [0,0,0,1,0,0|3,0,0]=4 981 B13R1.654 CCCCNCCc1cccn1C 34a_100011251756_100000210210 [0,0,0,1,0,0|3,0,0]=4 982 B10R0.71 C/C=C/C=C/COCCCC 34a_100016283227_100000210210 [2,0,0,0,0,0|1,0,1]=4 983 B10R0.71 C=CCNCCCCCCC 2230a_100000229938_100000210623 [2,0,0,0,0,0|1,0,1]=4 984 B10R0.71 C=CCNCCCCCCC 2230a_100020586998_100000210681 [2,0,0,0,0,0|1,0,1]=4 985 B10R0.71 C=CCOCCCCCCC 34a_100000210272_100015514636 [2,0,0,0,0,0|1,0,1]=4 986 B10R0.71 C=CCOCCCCCCC 34a_200000210373_100000210614 [2,0,0,0,0,0|1,0,1]=4 987 B10R0.71 C=CCOCCCCCCC 7a_100000210272_100015514636 [2,0,0,0,0,0|1,0,1]=4 988 B10R0.71 C=CCSCCCCCCC 62a_100000210614_100000210623 [2,0,0,0,0,0|1,0,1]=4 989 B10R0.71 C=CCSCCCCCCC 62a_100000210623_100000210316 [2,0,0,0,0,0|1,0,1]=4 990 B10R0.71 CCCCCCCNCC=O 2230a_100000229938_200015260668 [2,0,0,0,0,0|1,0,1]=4 991 B10R0.71 CCCCCCCOCC=O 34a_100000210272_200009817547 [2,0,0,0,0,0|1,0,1]=4 992 B10R0.71 CCCCCCCOCC=O 7a_100000210272_200015260668 [2,0,0,0,0,0|1,0,1]=4 993 B10R0.71 CCCCCCCSCC=O 62a_100000210614_200015260668 [2,0,0,0,0,0|1,0,1]=4 994 B10R0.71 CCCCCCCSCC=O 62a_200015260668_100000210316 [2,0,0,0,0,0|1,0,1]=4 995 B12R0.1 C/C=C/C=C/COCC(C)CCC 34a_100016283227_100011216630 [1,1,0,0,0,0|1,0,1]=4 996 B12R0.1 C=CCC(=O)C=CCCCCCC 1458a_200015324643_100000210623 [1,1,0,0,0,0|0,0,2]=4 997 B12R0.1 C=CCC(=O)CCCCCCCC 1458a_100000210188_100000210623 [1,1,0,0,0,0|0,0,2]=4 998 B12R0.1 C=CCC(=O)CCCCCCCC 1458a_100000210193_100000210759 [1,1,0,0,0,0|0,0,2]=4 999 B12R0.1 C=CCC(=O)NCCCCCCC 11a_100000229938_100000210193 [1,1,0,0,0,0|1,0,1]=4 1000 B12R0.1 C=CCC(=O)NCCCCCCC 1626a_100000229938_100000210193 [1,1,0,0,0,0|1,0,1]=4 1001 B12R0.1 C=CCC(=O)NCCCCCCC 240690a_100000229938_100000210193 [1,1,0,0,0,0|1,0,1]=4 1002 B12R0.1 C=CCC(=O)NCCCCCCC 527a_100000229938_100000210193 [1,1,0,0,0,0|1,0,1]=4 1003 B12R0.1 CC=CC(=O)CCCCCCCC 1458a_100000210699_100000210759 [1,1,0,0,0,0|0,0,2]=4 1004 B12R0.1 CC=CC(=O)NCCCCCCC 11a_100000229938_100000210699 [1,1,0,0,0,0|1,0,1]=4 1005 B12R0.1 CC=CC(=O)NCCCCCCC 1626a_100000229938_100000210699 [1,1,0,0,0,0|1,0,1]=4 1006 B12R0.1 CC=CC(=O)NCCCCCCC 240690a_100000229938_100000210699 [1,1,0,0,0,0|1,0,1]=4 1007 B12R0.1 CCCCCCCCC(=O)C=CBr 1458a_100016273825_100000210759 [1,1,0,0,0,0|1,0,1]=4 1008 B12R0.1 CCCCCCCCC(=O)C=CCl 1458a_200016279998_100000210759 [1,1,0,0,0,0|1,0,1]=4 1009 B12R0.1 CCCCCCCCC(=O)C=CI 1458a_100016256311_100000210759 [1,1,0,0,0,0|1,0,1]=4 1010 B12R0.1 CCCCCCCNC(=O)C=CBr 1626a_100000229938_100016273825 [1,1,0,0,0,0|2,0,0]=4 1011 B12R0.1 CCCCCCCNC(=O)C=CBr 240690a_100000229938_100016273825 [1,1,0,0,0,0|2,0,0]=4 1012 B12R0.1 CCCCCCCNC(=O)C=CCl 11a_100000229938_200016279998 [1,1,0,0,0,0|2,0,0]=4 1013 B12R0.1 CCCCCCCNC(=O)C=CCl 1626a_100000229938_200016279998 [1,1,0,0,0,0|2,0,0]=4 1014 B12R0.1 CCCCCCCNC(=O)C=CCl 240690a_100000229938_200016279998 [1,1,0,0,0,0|2,0,0]=4 1015 B12R0.1 CCCCCCCNC(=O)C=CI 1626a_100000229938_100016256311 [1,1,0,0,0,0|2,0,0]=4 1016 B12R0.47 C/C=C/C=CC(=O)CCCCCC 1458a_100000185730_100000210757 [1,1,0,0,0,0|1,0,0]=3 1017 B12R0.47 C/C=C/C=CC(=O)CCCCCF 1458a_100000185730_100000729378 [1,1,0,0,0,0|2,0,0]=4 1018 B12R0.47 C/C=C/C=CC(=O)CCCCCO 1458a_100000185730_100000746330 [1,1,0,0,0,0|2,0,0]=4 1019 B12R0.47 C/C=C/C=CC(=O)CCCCOC 1458a_100000185730_100000755781 [1,1,0,0,0,0|2,0,0]=4 1020 B12R0.47 C/C=C/C=CC(=O)CCCOCC 1458a_100000185730_100012232248 [1,1,0,0,0,0|2,0,0]=4 1021 B12R0.47 C/C=C/C=CC(=O)CCOCCC 1458a_100000185730_100011215938 [1,1,0,0,0,0|2,0,0]=4 1022 B12R0.47 C/C=C/C=CC(=O)COCCCC 1458a_100000185730_100011995733 [1,1,0,0,0,0|2,0,0]=4 1023 B12R0.47 C/C=C/C=CC(=O)NCCCCC 11a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1024 B12R0.47 C/C=C/C=CC(=O)NCCCCC 1626a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1025 B12R0.47 C/C=C/C=CC(=O)NCCCCC 240690a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1026 B12R0.206 C#CCCCCCC(=O)C=CC=C 1458a_100016291481_100012094781 [1,1,0,0,0,0|0,0,2]=4 1027 B12R0.206 C/C=C/C=C/COC(C)CCCC 34a_100016283227_200011215066 [1,1,0,0,0,0|1,0,1]=4 1028 B12R0.206 C/C=C/CC(=O)CCCCCCC 1458a_100000211969_100102629194 [1,1,0,0,0,0|0,0,2]=4 1029 B12R0.206 C=CC=CC(=O)CCCCCC#N 1458a_100016291481_100009813376 [1,1,0,0,0,0|1,0,1]=4 1030 B12R0.206 C=CC=CC(=O)CCCCCC=C 1458a_100016291481_100000700193 [1,1,0,0,0,0|0,0,2]=4 1031 B12R0.206 C=CC=CC(=O)CCCCCCC 1458a_100016291481_100000210614 [1,1,0,0,0,0|0,0,0]=2 1032 B12R0.206 C=CC=CC(=O)CCCCCCF 1458a_100016291481_100015922095 [1,1,0,0,0,0|1,0,0]=3 1033 B12R0.206 C=CC=CC(=O)CCCCCCO 1458a_100016291481_100000766143 [1,1,0,0,0,0|1,0,0]=3 1034 B12R0.206 C=CC=CC(=O)CCOCCCC 1458a_100016291481_100000743108 [1,1,0,0,0,0|1,0,0]=3 1035 B12R0.206 C=CC=CC(=O)CCOCCOC 1458a_100016291481_100000695917 [1,1,0,0,0,0|2,0,0]=4 1036 B12R0.206 C=CC=CC(=O)NCCCCCC 1626a_100000210581_100016291481 [1,1,0,0,0,0|1,0,0]=3 1037 B12R0.206 C=CC=CC(=O)NCCCOCC 1626a_100000210961_100016291481 [1,1,0,0,0,0|2,0,0]=4 1038 B12R0.206 C=CC=CC(=O)NCCOCCC 1626a_100161115042_100016291481 [1,1,0,0,0,0|2,0,0]=4 1039 B12R0.206 C=CC=CC(=O)NNCCCCC 22a_100000694160_100016291481 [1,1,0,0,0,0|2,0,0]=4 1040 B12R0.206 C=CCCC(=O)CCCCCCC 1458a_100000211969_100000754431 [1,1,0,0,0,0|0,0,2]=4 1041 B12R0.206 C=CCCC(=O)CCCCCCC 1458a_100000749702_100000210614 [1,1,0,0,0,0|0,0,2]=4 1042 B12R0.206 C=CCNC(=O)CCCCCCC 1626a_100020586998_100000211969 [1,1,0,0,0,0|1,0,1]=4 1043 B12R0.206 C=CCNC(=O)CCCCCCC 240690a_100020586998_100000211969 [1,1,0,0,0,0|1,0,1]=4 1044 B12R0.206 C=CCNC(=O)CCCCCCC 527a_100020586998_100000211969 [1,1,0,0,0,0|1,0,1]=4 1045 B12R0.206 CC=CCC(=O)CCCCCCC 1458a_100000211969_100000070051 [1,1,0,0,0,0|0,0,2]=4 1046 B12R0.206 CC=CCC(=O)CCCCCCC 1458a_100121576822_100000210614 [1,1,0,0,0,0|0,0,2]=4 1047 B12R0.206 CCC=CC(=O)CCCCCCC 1458a_100000212282_100000210614 [1,1,0,0,0,0|0,0,2]=4 1048 B12R0.206 CCCCCCCC(=O)C=COC 1458a_100016268678_100000210614 [1,1,0,0,0,0|1,0,1]=4 1049 B12R0.234 C/C=C/C=C/COCCCC(C)C 34a_100016283227_100011214892 [1,1,0,0,0,0|1,0,1]=4 1050 B12R0.234 C/C=C/C=C/COCCCC(C)O 34a_100016283227_200000718107 [1,1,0,0,0,0|1,0,1]=4 1051 B12R0.234 CCCCCCCC=NNC(=O)C 4a_100000189765_100000210592 [1,1,0,0,0,0|2,0,0]=4 1052 B12R0.234 CCCCCCCCC=CC(=O)C 1458a_100015345288_200000210301 [1,1,0,0,0,0|0,0,1]=3 1053 B12R0.234 CCCCCCCCC=CC(=O)[13CH3] 1458a_100015345288_200025704644 [1,1,0,0,0,0|0,0,1]=3 1054 B12R0.248 C=CC(=O)CCCCCCCCC 1458a_100000185746_100000210670 [1,1,0,0,0,0|0,0,2]=4 1055 B12R0.248 C=CC(=O)NCCCCCCCC 1626a_100000229939_100000185746 [1,1,0,0,0,0|1,0,1]=4 1056 B12R0.248 C=CC(=O)NCCCCCCCC 240690a_100000229939_200121576911 [1,1,0,0,0,0|1,0,1]=4 1057 B12R0.248 CCCCCCCC=CC(=O)CC 1458a_200015332781_100000210202 [1,1,0,0,0,0|0,0,2]=4 1058 B12R0.248 CCCCCCCC=CC(=O)CF 1458a_200015332781_100015361967 [1,1,0,0,0,0|1,0,1]=4 1059 B12R0.248 CCCCCCCC=CC(=O)NC 11a_106832991635_200015332781 [1,1,0,0,0,0|1,0,1]=4 1060 B12R0.248 CCCCCCCC=CC(=O)NC 1626a_100102657272_200015332781 [1,1,0,0,0,0|1,0,1]=4 1061 B12R0.248 CCCCCCCC=CC(=O)NC 240690a_100102657272_200015332781 [1,1,0,0,0,0|1,0,1]=4 1062 B14R0.391 C=C(C)CC(=O)C=CCCCCCCC 1458a_200015332781_100000748629 [0,2,0,0,0,0|1,0,1]=4 1063 B14R0.391 C=C(F)CC(=O)C=CCCCCCCC 1458a_200015332781_100009893438 [0,2,0,0,0,0|1,0,1]=4 1064 B14R0.391 CCCCCCCC=CC(=O)CC(=O)N 1458a_200015332781_100000187820 [0,2,0,0,0,0|0,0,1]=3 1065 B14R0.391 CCCCCCCC=CC(=O)CC(=O)[O-] 1458a_200015332781_100020667443 [0,2,0,0,0,0|0,0,1]=3 1066 B14R0.391 CCCCCCCC=CC(=O)C[N+](=O)[O-] 1458a_200015332781_100000761209 [0,2,0,0,0,0|1,0,1]=4 1067 B14R0.393 C=CCC(=O)C=CCCCCCCCC 1458a_100015345288_100000210623 [0,2,0,0,0,0|1,0,1]=4 1068 B14R0.493 C/C=C/CC(=O)C=CCCCCCCC 1458a_200015332781_100102629194 [0,2,0,0,0,0|1,0,0]=3 1069 B14R0.493 C=CC=CC(=O)CCCCCCCCC 1458a_100016291481_100000210670 [0,2,0,0,0,0|1,0,1]=4 1070 B14R0.493 C=CC=CC(=O)CCCCCCCCO 1458a_100016291481_100000033203 [0,2,0,0,0,0|1,0,1]=4 1071 B14R0.493 C=CC=CC(=O)NCCCCCCCC 1626a_100000229939_100016291481 [0,2,0,0,0,0|1,0,1]=4 1072 B14R0.493 C=CC=CC(=O)NCCCOCCCC 1626a_200000211371_100016291481 [0,2,0,0,0,0|2,0,0]=4 1073 B14R0.493 C=CCCC(=O)C=CCCCCCCC 1458a_200015332781_100000754431 [0,2,0,0,0,0|1,0,1]=4 1074 B14R0.493 C=CCNC(=O)C=CCCCCCCC 1626a_100020586998_200015332781 [0,2,0,0,0,0|1,0,1]=4 1075 B14R0.493 C=CCNC(=O)C=CCCCCCCC 240690a_100020586998_200015332781 [0,2,0,0,0,0|1,0,1]=4 1076 B14R0.493 CC=CCC(=O)C=CCCCCCCC 1458a_200015332781_100000070051 [0,2,0,0,0,0|1,0,0]=3 1077 B14R0.153 C=CC=CC(=O)NCCCCCC(C)C 1626a_100011290863_100016291481 [0,2,0,0,0,0|2,0,0]=4 1078 B14R0.231 C/C=C/C=CC(=O)CCCCCC(C)C 1458a_100000185730_100000210682 [0,2,0,0,0,0|1,0,0]=3 1079 B14R0.337 CCCCCCCCCC=CC(=O)CC 1458a_200015352897_100000210202 [0,2,0,0,0,0|0,0,2]=4 1080 B14R0.337 CCCCCCCCCC=CC(=O)CF 1458a_200015352897_100015361967 [0,2,0,0,0,0|0,0,2]=4 1081 B14R0.337 CCCCCCCCCC=CC(=O)NC 11a_106832991635_200015352897 [0,2,0,0,0,0|0,0,2]=4 1082 B14R0.337 CCCCCCCCCC=CC(=O)NC 1626a_100102657272_200015352897 [0,2,0,0,0,0|0,0,2]=4 1083 B14R0.337 CCCCCCCCCC=CC(=O)NC 240690a_100102657272_200015352897 [0,2,0,0,0,0|0,0,2]=4 1084 B14R0.337 CCCCCCCNC/C=C/C(=O)OC 2230a_100000229938_100000742655 [0,2,0,0,0,0|1,0,1]=4 1085 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 34a_100000210272_100000742655 [0,2,0,0,0,0|1,0,1]=4 1086 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 7a_100000210272_100000742655 [0,2,0,0,0,0|1,0,1]=4 1087 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000210614_100000742655 [0,2,0,0,0,0|1,0,1]=4 1088 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210316 [0,2,0,0,0,0|1,0,1]=4 1089 B14R0.340 CCCCCCCC=NNC(=O)C(=O)N 4a_100000211141_100000210592 [0,2,0,0,0,0|2,0,0]=4 1090 B14R0.394 C/C=C/C=C/COCCCCCC(C)C 34a_100016283227_100000210682 [0,2,0,0,0,0|1,0,1]=4 1091 B14R0.394 CCCCCCCC=CC=NNC(=O)C 4a_100000189765_200016991098 [0,2,0,0,0,0|1,0,0]=3 1092 B14R0.179 C#CCCCCCCC(=O)C=C/C=C/C 1458a_100000185730_100012276617 [0,2,0,0,0,0|1,0,1]=4 1093 B14R0.179 C/C=C/C=CC(=O)CC#CCCCCC 1458a_100000185730_100009816472 [0,2,0,0,0,0|1,0,1]=4 1094 B14R0.179 C/C=C/C=CC(=O)CCCCCCC#N 1458a_100000185730_100009813337 [0,2,0,0,0,0|1,0,1]=4 1095 B14R0.179 C/C=C/C=CC(=O)CCCCCCCC 1458a_100000185730_100000210759 [0,2,0,0,0,0|1,0,0]=3 1096 B14R0.179 C/C=C/C=CC(=O)CCCCCCCO 1458a_100000185730_100000760002 [0,2,0,0,0,0|1,0,0]=3 1097 B14R0.179 C/C=C/C=CC(=O)CCCCCCOC 1458a_100000185730_100011998445 [0,2,0,0,0,0|1,0,0]=3 1098 B14R0.179 C/C=C/C=CC(=O)CCCOCCOC 1458a_100000185730_100011216529 [0,2,0,0,0,0|2,0,0]=4 1099 B14R0.179 C/C=C/C=CC(=O)CCOCCOCC 1458a_100000185730_100011211534 [0,2,0,0,0,0|2,0,0]=4 1100 B14R0.179 C/C=C/C=CC(=O)NCCCCCCC 11a_100000229938_100000185730 [0,2,0,0,0,0|1,0,0]=3 1101 B14R0.179 C/C=C/C=CC(=O)NCCCCCCC 1626a_100000229938_100000185730 [0,2,0,0,0,0|1,0,0]=3 1102 B14R0.179 C/C=C/C=CC(=O)NCCCCCCC 240690a_100000229938_100000185730 [0,2,0,0,0,0|1,0,0]=3 1103 B14R0.179 C/C=C/C=CC(=O)NCCCCCCO 240690a_100000686447_100000185730 [0,2,0,0,0,0|2,0,0]=4 1104 B14R0.179 C/C=C/C=CC(=O)NCCCCCOC 11a_100000747528_100000185730 [0,2,0,0,0,0|2,0,0]=4 1105 B14R0.179 C/C=C/C=CC(=O)NCCCCCOC 1626a_100000747528_100000185730 [0,2,0,0,0,0|2,0,0]=4 1106 B14R0.179 C/C=C/C=CC(=O)NCCCCCOC 240690a_100000747528_100000185730 [0,2,0,0,0,0|2,0,0]=4 1107 B14R0.179 C/C=C/C=CC(=O)NCCCOCCC 1626a_100011217757_100000185730 [0,2,0,0,0,0|2,0,0]=4 1108 B14R0.179 C/C=C/C=CC(=O)NCCCOCCC 240690a_100011217757_100000185730 [0,2,0,0,0,0|2,0,0]=4 1109 B14R0.179 C/C=C/C=CC(=O)NCCSCCCC 11a_100025743550_100000185730 [0,2,0,0,0,0|2,0,0]=4 1110 B14R0.179 C/C=C/C=CC(=O)NCCSCCCC 1626a_100025743550_100000185730 [0,2,0,0,0,0|2,0,0]=4 1111 B14R0.179 C/C=C/C=CC(=O)NCCSCCCC 240690a_100025743550_100000185730 [0,2,0,0,0,0|2,0,0]=4 1112 B14R0.179 C=CCCCCCCC(=O)C=C/C=C/C 1458a_100000185730_100011215473 [0,2,0,0,0,0|1,0,1]=4 1113 B14R0.203 C=CC=CC(=O)NC(C)CCCCCC 1626a_100000210919_100016291481 [0,2,0,0,0,0|2,0,0]=4 1114 B14R0.1095 C=CC=CC(=O)C(C)CCCCCCC 1458a_100016291481_200011218727 [0,2,0,0,0,0|1,0,1]=4 1115 B14R0.1095 C=CC=CC(=O)N(C)CCCCCCC 1626a_100000228206_100016291481 [0,2,0,0,0,0|2,0,0]=4 1116 B14R0.140 CC=C(C)C=CC(=O)CCCCCCC 1458a_100000692105_100000210614 [0,2,0,0,0,0|1,0,0]=3 1117 B14R0.140 CC=C(C)C=CC(=O)CCCCCCF 1458a_100000692105_100015922095 [0,2,0,0,0,0|2,0,0]=4 1118 B14R0.140 CC=C(C)C=CC(=O)CCCCCCO 1458a_100000692105_100000766143 [0,2,0,0,0,0|2,0,0]=4 1119 B14R0.140 CC=C(C)C=CC(=O)CCOCCCC 1458a_100000692105_100000743108 [0,2,0,0,0,0|2,0,0]=4 1120 B14R0.140 CC=C(C)C=CC(=O)NCCCCCC 1626a_100000210581_100000692105 [0,2,0,0,0,0|2,0,0]=4 1121 B14R0.140 CCCCCCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210614 [0,2,0,0,0,0|2,0,0]=4 1122 B14R0.145 C/C=C/C=C/COC(C)CCCCCC 34a_100016283227_100011215978 [0,2,0,0,0,0|1,0,1]=4 1123 B14R0.2256 C/C=C/C=CC(=O)C(C)CCCCCC 1458a_100000185730_100011215978 [0,2,0,0,0,0|1,0,0]=3 1124 B14R0.2256 C/C=C/C=CC(=O)N(C)CCCCCC 11a_106256046315_100000185730 [0,2,0,0,0,0|2,0,0]=4 1125 B14R0.2256 C/C=C/C=CC(=O)N(C)CCCCCC 1626a_106256046315_100000185730 [0,2,0,0,0,0|2,0,0]=4 1126 B14R0.2256 C/C=C/C=CC(=O)N(C)CCCCCC 240690a_106256046315_100000185730 [0,2,0,0,0,0|2,0,0]=4 1127 B14R0.392 C/C=C/C=C/CCCCCCCOCC 34a_100020681108_100000210202 [0,2,0,0,0,0|1,0,1]=4 1128 B14R0.392 C/C=C/C=C/CCCCCCCOCC 7a_100020681108_100000210202 [0,2,0,0,0,0|1,0,1]=4 1129 B14R0.392 C/C=C/C=C/CCCCCCCOCF 34a_100020681108_100015361967 [0,2,0,0,0,0|1,0,1]=4 1130 B14R0.392 C/C=C/C=C/CCCCCCCOCF 7a_100020681108_100015361967 [0,2,0,0,0,0|1,0,1]=4 1131 B14R0.392 C/C=C/C=C/COCCCCCCCC 34a_100016283227_100000210759 [0,2,0,0,0,0|1,0,1]=4 1132 B14R0.392 C/C=C/C=C/COCCCCCCCO 34a_100016283227_100000760002 [0,2,0,0,0,0|1,0,1]=4 1133 B14R0.392 C/C=C/C=C/COCCCCCCOC 34a_100016283227_100011998445 [0,2,0,0,0,0|1,0,1]=4 1134 B14R0.392 CC/C=C/C/C=C/CCOCCCCC 34a_200016273837_100000718602 [0,2,0,0,0,0|1,0,1]=4 1135 B14R0.392 CC/C=C/C/C=C/CCOCCCCC 7a_200016273837_100000210326 [0,2,0,0,0,0|1,0,1]=4 1136 B14R0.392 CCC/C=C/C=C/COCCCCCC 34a_100016294078_100000210314 [0,2,0,0,0,0|1,0,1]=4 1137 B14R0.392 CCCCCC/C=C/C=C/COCC=O 34a_200028454808_200009817547 [0,2,0,0,0,0|0,0,2]=4 1138 B14R0.392 CCCCCC/C=C/C=C/COCC=O 7a_200028454808_200015260668 [0,2,0,0,0,0|0,0,2]=4 1139 B14R0.392 CCCCCCC/C=C/C=C/COCC 34a_200025756345_100000210202 [0,2,0,0,0,0|0,0,2]=4 1140 B14R0.392 CCCCCCC/C=C/C=C/COCC 7a_200025756345_100000210202 [0,2,0,0,0,0|0,0,2]=4 1141 B14R0.392 CCCCCCC/C=C/C=C/COCF 34a_200025756345_100015361967 [0,2,0,0,0,0|0,0,2]=4 1142 B14R0.392 CCCCCCC/C=C/C=C/COCF 7a_200025756345_100015361967 [0,2,0,0,0,0|0,0,2]=4 1143 B14R0.392 CCCCCCCC/C=C/COCC=O 34a_200020667288_200009817547 [0,2,0,0,0,0|0,0,2]=4 1144 B14R0.392 CCCCCCCC/C=C/COCC=O 7a_200020667288_200015260668 [0,2,0,0,0,0|0,0,2]=4 1145 B14R0.1444 C/C=C/C=CC(=O)CC(=O)CCCCC 1458a_100000185730_200012276598 [0,2,0,0,0,0|1,0,1]=4 1146 B14R0.1444 C/C=C/C=CC(=O)NC(C)CCCCC 11a_100000211957_100000185730 [0,2,0,0,0,0|2,0,0]=4 1147 B14R0.1444 C/C=C/C=CC(=O)NC(C)CCCCC 1626a_100000211957_100000185730 [0,2,0,0,0,0|2,0,0]=4 1148 B14R0.1444 C/C=C/C=CC(=O)NC(C)CCCCC 240690a_100000211957_100000185730 [0,2,0,0,0,0|2,0,0]=4 1149 B12R1.8 CCCCCNc1ccccc1 34a_100000106764_100000718602 [1,0,0,1,0,0|1,0,1]=4 1150 B12R1.8 CCCCCOc1ccccc1 34a_100000210340_100000718602 [1,0,0,1,0,0|1,0,1]=4 1151 B12R1.8 CCCCCOc1ccccc1 7a_100000210340_100000210326 [1,0,0,1,0,0|1,0,1]=4 1152 B12R1.8 CCCCCSc1ccccc1 62a_100000210326_100000041952 [1,0,0,1,0,0|1,0,1]=4 1153 B12R1.8 CCCCCSc1ccccc1 62a_100000719477_100000210326 [1,0,0,1,0,0|1,0,1]=4 1154 B12R1.8 CCCCCSc1ccccn1 62a_100000210326_100011216584 [1,0,0,1,0,0|2,0,0]=4 1155 B12R1.8 CCCCCSc1ccccn1 62a_100011216584_100000210326 [1,0,0,1,0,0|2,0,0]=4 1156 B12R1.8 CCCCNCc1ccccc1 207a_100000102301_100015611070 [1,0,0,1,0,0|1,0,1]=4 1157 B12R1.8 CCCCNCc1ccccc1 2230a_100000102301_100015291786 [1,0,0,1,0,0|1,0,1]=4 1158 B12R1.8 CCCCNCc1ccccc1 2230a_100015324214_100000210211 [1,0,0,1,0,0|1,0,1]=4 1159 B12R1.8 CCCCNCc1ccccc1 270004a_100000102301_100015611070 [1,0,0,1,0,0|1,0,1]=4 1160 B12R1.8 CCCCNCc1ccccc1 34a_100015324214_100000210210 [1,0,0,1,0,0|1,0,1]=4 1161 B12R1.8 CCCCNCc1ccccc1 7a_106832991798_100000211182 [1,0,0,1,0,0|1,0,1]=4 1162 B12R1.8 CCCCNCc1ccccn1 207a_100000102301_100000209966 [1,0,0,1,0,0|2,0,0]=4 1163 B12R1.8 CCCCNCc1ccccn1 2230a_100000102301_100000721315 [1,0,0,1,0,0|2,0,0]=4 1164 B12R1.8 CCCCNCc1ccccn1 270004a_100000102301_100000209966 [1,0,0,1,0,0|2,0,0]=4 1165 B12R1.8 CCCCNCc1ccccn1 7a_106832991798_100000721315 [1,0,0,1,0,0|2,0,0]=4 1166 B12R1.8 CCCCOCc1ccccc1 34a_100000210227_100015291786 [1,0,0,1,0,0|1,0,1]=4 1167 B12R1.8 CCCCOCc1ccccc1 34a_100000210790_100000210210 [1,0,0,1,0,0|1,0,1]=4 1168 B12R1.8 CCCCOCc1ccccc1 7a_100000210227_100000211182 [1,0,0,1,0,0|1,0,1]=4 1169 B12R1.8 CCCCOCc1ccccc1 7a_100000210790_100000210211 [1,0,0,1,0,0|1,0,1]=4 1170 B12R1.8 CCCCOCc1ccccn1 34a_100000210227_100000721315 [1,0,0,1,0,0|2,0,0]=4 1171 B12R1.8 CCCCOCc1ccccn1 7a_100000210227_100000721315 [1,0,0,1,0,0|2,0,0]=4 1172 B12R1.8 CCCCSCc1ccccc1 62a_100000210211_100015291786 [1,0,0,1,0,0|1,0,1]=4 1173 B12R1.8 CCCCSCc1ccccc1 62a_100000211182_100000210210 [1,0,0,1,0,0|1,0,1]=4 1174 B12R1.8 CCCCSCc1ccccn1 62a_100000210211_100000721315 [1,0,0,1,0,0|2,0,0]=4 1175 B12R1.8 CCCCSCc1ccccn1 62a_100000721315_100000210210 [1,0,0,1,0,0|2,0,0]=4 1176 B12R1.8 CCCNCCc1ccccc1 2230a_100000106460_100000210303 [1,0,0,1,0,0|1,0,1]=4 1177 B12R1.8 CCCNCCc1ccccc1 34a_100000106460_100000210303 [1,0,0,1,0,0|1,0,1]=4 1178 B12R1.8 CCCOCCc1ccccc1 34a_100000210258_100000765856 [1,0,0,1,0,0|1,0,1]=4 1179 B12R1.8 CCCOCCc1ccccc1 34a_100000210268_100000210303 [1,0,0,1,0,0|1,0,1]=4 1180 B12R1.8 CCCOCCc1ccccc1 7a_100000210268_100000210303 [1,0,0,1,0,0|1,0,1]=4 1181 B12R1.8 CCCOCCc1ccccn1 34a_100000210271_100000210303 [1,0,0,1,0,0|2,0,0]=4 1182 B12R1.8 CCCSCCc1ccccc1 62a_100000210303_100011218657 [1,0,0,1,0,0|1,0,1]=4 1183 B12R1.8 CCCSCCc1ccccc1 62a_100000765856_100000210303 [1,0,0,1,0,0|1,0,1]=4 1184 B12R1.8 CCCSCCc1ccccn1 62a_100000210303_100015183660 [1,0,0,1,0,0|2,0,0]=4 1185 B12R1.8 CCCSCCc1ccccn1 62a_100015183660_100000210303 [1,0,0,1,0,0|2,0,0]=4 1186 B12R1.8 CCNCCCc1ccccc1 2230a_100000211184_100000210202 [1,0,0,1,0,0|1,0,1]=4 1187 B12R1.8 CCNCCCc1ccccc1 2230a_100015525214_100000211621 [1,0,0,1,0,0|1,0,1]=4 1188 B12R1.8 CCNCCCc1ccccc1 34a_100000211184_100000210202 [1,0,0,1,0,0|1,0,1]=4 1189 B12R1.8 CCOCCCc1ccccc1 34a_100000210828_100000210202 [1,0,0,1,0,0|1,0,1]=4 1190 B12R1.8 CCOCCCc1ccccc1 34a_100121572206_100000211621 [1,0,0,1,0,0|1,0,1]=4 1191 B12R1.8 CCOCCCc1ccccc1 7a_100000210828_100000210202 [1,0,0,1,0,0|1,0,1]=4 1192 B12R1.8 CCOCCCc1ccccn1 34a_100011215068_100000210202 [1,0,0,1,0,0|2,0,0]=4 1193 B12R1.8 CCSCCCc1ccccc1 62a_100000210202_100000211621 [1,0,0,1,0,0|1,0,1]=4 1194 B12R1.8 CCSCCCc1ccccc1 62a_100000211621_100000210202 [1,0,0,1,0,0|1,0,1]=4 1195 B12R1.8 CNCCCCc1ccccc1 2230a_100015280158_200000210301 [1,0,0,1,0,0|1,0,1]=4 1196 B12R1.8 CNCCCCc1ccccc1 2230a_106832991635_100000701786 [1,0,0,1,0,0|1,0,1]=4 1197 B12R1.8 CNCCCCc1ccccc1 34a_100015280158_200000210301 [1,0,0,1,0,0|1,0,1]=4 1198 B12R1.8 CNCCCCc1ccccc1 34a_100102657272_100000701786 [1,0,0,1,0,0|1,0,1]=4 1199 B12R1.8 CNCCCCc1ccccc1 7a_106832991635_100000701786 [1,0,0,1,0,0|1,0,1]=4 1200 B12R1.8 COCCCCc1ccccc1 34a_100000703073_200000210301 [1,0,0,1,0,0|1,0,1]=4 1201 B12R1.8 COCCCCc1ccccc1 34a_100138415774_100000701786 [1,0,0,1,0,0|1,0,1]=4 1202 B12R1.8 COCCCCc1ccccc1 7a_100000703073_200000210301 [1,0,0,1,0,0|1,0,1]=4 1203 B12R1.8 COCCCCc1ccccn1 34a_100012186994_200000210301 [1,0,0,1,0,0|2,0,0]=4 1204 B12R1.8 CSCCCCc1ccccc1 62a_100000701786_200000210301 [1,0,0,1,0,0|1,0,1]=4 1205 B12R1.8 CSCCCCc1ccccc1 62a_200000210301_100000701786 [1,0,0,1,0,0|1,0,1]=4 1206 B12R1.8 [13CH3]NCCCCc1ccccc1 2230a_100015280158_200025704644 [1,0,0,1,0,0|1,0,1]=4 1207 B12R1.8 [13CH3]NCCCCc1ccccc1 34a_100015280158_200025704644 [1,0,0,1,0,0|1,0,1]=4 1208 B12R1.8 [13CH3]OCCCCc1ccccc1 34a_100000703073_200025704644 [1,0,0,1,0,0|1,0,1]=4 1209 B12R1.8 [13CH3]OCCCCc1ccccc1 7a_100000703073_200025704644 [1,0,0,1,0,0|1,0,1]=4 1210 B12R1.8 [13CH3]OCCCCc1ccccn1 34a_100012186994_200025704644 [1,0,0,1,0,0|2,0,0]=4 1211 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_100000701786_200025704644 [1,0,0,1,0,0|1,0,1]=4 1212 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_200025704644_100000701786 [1,0,0,1,0,0|1,0,1]=4 1213 B12R1.37 C/C=C/C=C/COC1CCCC1 34a_100016283227_100000179811 [1,0,0,1,0,0|1,0,1]=4 1214 B12R1.37 CCCCCC=Cc1ccco1 271570a_100000062253_100009814098 [1,0,0,1,0,0|0,0,2]=4 1215 B12R1.37 CCCCCC=Cc1cccs1 271570a_100000062253_100011215356 [1,0,0,1,0,0|0,1,1]=4 1216 B12R1.37 CCCCCCOc1ccsc1 34a_100000106738_100000210314 [1,0,0,1,0,0|2,0,0]=4 1217 B12R1.37 CCCCCCOc1ccsc1 7a_100000106738_100000210314 [1,0,0,1,0,0|2,0,0]=4 1218 B12R1.37 CCCCCCSc1ccco1 62a_100000210314_100009814098 [1,0,0,1,0,0|1,0,1]=4 1219 B12R1.37 CCCCCCSc1ccco1 62a_100009814098_100000210757 [1,0,0,1,0,0|1,0,1]=4 1220 B12R1.37 CCCCCCSc1cccs1 62a_100000210314_100011215356 [1,0,0,1,0,0|1,1,0]=4 1221 B12R1.37 CCCCCCSc1cccs1 62a_100011215356_100000210757 [1,0,0,1,0,0|1,1,0]=4 1222 B12R1.37 CCCCCCSc1ccoc1 62a_100000210314_100011215275 [1,0,0,1,0,0|2,0,0]=4 1223 B12R1.37 CCCCCCSc1ccoc1 62a_100011215275_100000210757 [1,0,0,1,0,0|2,0,0]=4 1224 B12R1.37 CCCCCCSc1ccsc1 62a_100000210314_100000738268 [1,0,0,1,0,0|2,0,0]=4 1225 B12R1.37 CCCCCCSc1ccsc1 62a_100000738268_100000210757 [1,0,0,1,0,0|2,0,0]=4 1226 B12R1.37 CCCCCNCc1ccco1 207a_100000209983_100000186105 [1,0,0,1,0,0|1,0,1]=4 1227 B12R1.37 CCCCCNCc1ccco1 2230a_100000185738_100000210326 [1,0,0,1,0,0|1,0,1]=4 1228 B12R1.37 CCCCCNCc1ccco1 270004a_100000209983_100000186105 [1,0,0,1,0,0|1,0,1]=4 1229 B12R1.37 CCCCCNCc1ccco1 34a_100000185738_100000718602 [1,0,0,1,0,0|1,0,1]=4 1230 B12R1.37 CCCCCNCc1cccs1 207a_100000209983_100000209959 [1,0,0,1,0,0|1,1,0]=4 1231 B12R1.37 CCCCCNCc1cccs1 2230a_100000211653_100000210326 [1,0,0,1,0,0|1,1,0]=4 1232 B12R1.37 CCCCCNCc1cccs1 270004a_100000209983_100000209959 [1,0,0,1,0,0|1,1,0]=4 1233 B12R1.37 CCCCCNCc1ccoc1 207a_100000209983_100011215517 [1,0,0,1,0,0|2,0,0]=4 1234 B12R1.37 CCCCCNCc1ccoc1 2230a_100015206860_100000210326 [1,0,0,1,0,0|2,0,0]=4 1235 B12R1.37 CCCCCNCc1ccoc1 270004a_100000209983_100011215517 [1,0,0,1,0,0|2,0,0]=4 1236 B12R1.37 CCCCCNCc1ccoc1 34a_100015206860_100000718602 [1,0,0,1,0,0|2,0,0]=4 1237 B12R1.37 CCCCCNCc1ccsc1 207a_100000209983_100000188534 [1,0,0,1,0,0|2,0,0]=4 1238 B12R1.37 CCCCCNCc1ccsc1 2230a_100000186416_100000210326 [1,0,0,1,0,0|2,0,0]=4 1239 B12R1.37 CCCCCNCc1ccsc1 2230a_100000209983_100011261437 [1,0,0,1,0,0|2,0,0]=4 1240 B12R1.37 CCCCCNCc1ccsc1 270004a_100000209983_100000188534 [1,0,0,1,0,0|2,0,0]=4 1241 B12R1.37 CCCCCNCc1ccsc1 34a_100000186416_100000718602 [1,0,0,1,0,0|2,0,0]=4 1242 B12R1.37 CCCCCOCc1ccco1 34a_100000210059_100000718602 [1,0,0,1,0,0|1,0,1]=4 1243 B12R1.37 CCCCCOCc1cccs1 34a_100000211240_100000718602 [1,0,0,1,0,0|1,1,0]=4 1244 B12R1.37 CCCCCOCc1ccoc1 34a_100011215357_100000718602 [1,0,0,1,0,0|2,0,0]=4 1245 B12R1.37 CCCCCOCc1ccsc1 34a_100000210253_100011261437 [1,0,0,1,0,0|2,0,0]=4 1246 B12R1.37 CCCCCOCc1ccsc1 34a_100011215551_100000718602 [1,0,0,1,0,0|2,0,0]=4 1247 B12R1.37 CCCCCOCc1ccsc1 7a_100000210253_100011261437 [1,0,0,1,0,0|2,0,0]=4 1248 B12R1.37 CCCCCSCc1ccsc1 62a_100000210326_100011233845 [1,0,0,1,0,0|2,0,0]=4 1249 B12R1.37 CCCCCSCc1ccsc1 62a_100011261437_100000210326 [1,0,0,1,0,0|2,0,0]=4 1250 B12R1.37 CCCCNCCc1ccco1 2230a_100000694680_100000210211 [1,0,0,1,0,0|1,0,1]=4 1251 B12R1.37 CCCCNCCc1ccco1 34a_100000694680_100000210210 [1,0,0,1,0,0|1,0,1]=4 1252 B12R1.37 CCCCNCCc1cccs1 2230a_100000102301_100000748579 [1,0,0,1,0,0|1,1,0]=4 1253 B12R1.37 CCCCNCCc1cccs1 2230a_100000203755_100000210211 [1,0,0,1,0,0|1,1,0]=4 1254 B12R1.37 CCCCNCCc1cccs1 34a_100000203755_100000210210 [1,0,0,1,0,0|1,1,0]=4 1255 B12R1.37 CCCCNCCc1cccs1 7a_106832991798_100000748579 [1,0,0,1,0,0|1,1,0]=4 1256 B12R1.37 CCCCNCCc1ccsc1 2230a_100000692642_100000210211 [1,0,0,1,0,0|2,0,0]=4 1257 B12R1.37 CCCCNCCc1ccsc1 34a_100000692642_100000210210 [1,0,0,1,0,0|2,0,0]=4 1258 B12R1.37 CCCCNCCn1cccc1 2230a_100000102301_200009811947 [1,0,0,1,0,0|2,0,0]=4 1259 B12R1.37 CCCCNCCn1cccc1 34a_100011368172_100000210210 [1,0,0,1,0,0|2,0,0]=4 1260 B12R1.37 CCCCNCCn1cccc1 7a_106832991798_200000035178 [1,0,0,1,0,0|2,0,0]=4 1261 B12R1.37 CCCCOCCc1cccs1 34a_100000210227_100000748579 [1,0,0,1,0,0|1,1,0]=4 1262 B12R1.37 CCCCOCCc1cccs1 34a_100011216825_100000210210 [1,0,0,1,0,0|1,1,0]=4 1263 B12R1.37 CCCCOCCc1cccs1 7a_100000210227_100000748579 [1,0,0,1,0,0|1,1,0]=4 1264 B12R1.37 CCCCOCCc1cccs1 7a_100011216825_100000210211 [1,0,0,1,0,0|1,1,0]=4 1265 B12R1.37 CCCCOCCc1ccsc1 34a_100000748821_100000210210 [1,0,0,1,0,0|2,0,0]=4 1266 B12R1.37 CCCCOCCn1cccc1 34a_100000179382_100000210210 [1,0,0,1,0,0|2,0,0]=4 1267 B12R1.37 CCCCOCCn1cccc1 7a_100000210227_200000035178 [1,0,0,1,0,0|2,0,0]=4 1268 B12R1.37 CCCCSCCc1cccs1 62a_100000210211_100000748579 [1,0,0,1,0,0|1,1,0]=4 1269 B12R1.37 CCCCSCCc1cccs1 62a_100000748579_100000210210 [1,0,0,1,0,0|1,1,0]=4 1270 B12R1.37 CCCCSCCn1cccc1 62a_100000210211_200000035178 [1,0,0,1,0,0|2,0,0]=4 1271 B12R1.37 CCCCSCCn1cccc1 62a_200009811947_100000210210 [1,0,0,1,0,0|2,0,0]=4 1272 B12R1.37 CCCOCCCc1cccs1 34a_100000210258_100010992444 [1,0,0,1,0,0|1,1,0]=4 1273 B12R1.37 CCCOCCCc1cccs1 34a_100011713143_100000210303 [1,0,0,1,0,0|1,1,0]=4 1274 B12R1.37 CCCOCCCc1cccs1 7a_100011713143_100000210303 [1,0,0,1,0,0|1,1,0]=4 1275 B12R1.37 CCCOCCCc1ccsc1 34a_200000699776_100000210303 [1,0,0,1,0,0|2,0,0]=4 1276 B12R1.37 CCCOCCCc1ccsc1 7a_200000699776_100000210303 [1,0,0,1,0,0|2,0,0]=4 1277 B12R1.37 CCCOCCCn1cccc1 34a_100000179399_100000210303 [1,0,0,1,0,0|2,0,0]=4 1278 B12R1.37 CCCOCCCn1cccc1 34a_100000210258_200009814367 [1,0,0,1,0,0|2,0,0]=4 1279 B12R1.37 CCCOCCCn1cccc1 7a_100000179399_100000210303 [1,0,0,1,0,0|2,0,0]=4 1280 B12R1.37 CCCSCCCc1cccs1 62a_100000210303_100010992444 [1,0,0,1,0,0|1,1,0]=4 1281 B12R1.37 CCCSCCCc1cccs1 62a_100010992444_100000210303 [1,0,0,1,0,0|1,1,0]=4 1282 B12R1.37 CCCSCCCn1cccc1 62a_100000210303_200009814367 [1,0,0,1,0,0|2,0,0]=4 1283 B12R1.37 CCCSCCCn1cccc1 62a_200009814367_100000210303 [1,0,0,1,0,0|2,0,0]=4 1284 B12R1.121 CCCCc1ccccc1C=O 271570a_100020621405_100000211189 [1,0,0,1,0,0|0,0,2]=4 1285 B12R1.121 CCCCc1ncccc1C=O 271570a_100020621405_100009816751 [1,0,0,1,0,0|1,0,1]=4 1286 B12R1.267 CCNCCn1ccccc1=O 2230a_100000687133_100000210202 [1,0,0,1,0,0|2,0,0]=4 1287 B12R1.272 C/C=C/C=C/COCC1CCC1 34a_100016283227_100000763275 [1,0,0,1,0,0|1,0,1]=4 1288 B12R1.372 CCCCCCc1ccsc1O 271570a_203496583355_100009817158 [1,0,0,1,0,0|1,0,1]=4 1289 B12R1.375 C/C=C/C=C/COCCC1CC1 34a_100016283227_100000694398 [1,0,0,1,0,0|1,0,1]=4 1290 B14R1.26 CCCCCC=Cc1cccc(=O)[nH]1 271570a_100000062253_100000761760 [0,1,0,1,0,0|0,0,2]=4 1291 B14R1.26 CCCCCCNc1cc(ccn1)F 27a_100000210581_100000764206 [0,1,0,1,0,0|2,0,0]=4 1292 B14R1.26 CCCCCCNc1cc[nH]c(=O)c1 27a_100000210581_100000061649 [0,1,0,1,0,0|2,0,0]=4 1293 B14R1.26 CCCCCCNc1cc[nH]c(=O)n1 27a_100000210581_200000134032 [0,1,0,1,0,0|2,0,0]=4 1294 B14R1.26 CCCCCCNc1cccc(c1)Br 34a_100000210019_100000210314 [0,1,0,1,0,0|2,0,0]=4 1295 B14R1.26 CCCCCCNc1cccc(c1)C 2230a_100000188690_100000210314 [0,1,0,1,0,0|2,0,0]=4 1296 B14R1.26 CCCCCCNc1cccc(c1)C 34a_100000188690_100000210314 [0,1,0,1,0,0|2,0,0]=4 1297 B14R1.26 CCCCCCNc1cccc(c1)Cl 34a_100000185859_100000210314 [0,1,0,1,0,0|2,0,0]=4 1298 B14R1.26 CCCCCCNc1cccc(c1)F 34a_100000210047_100000210314 [0,1,0,1,0,0|2,0,0]=4 1299 B14R1.26 CCCCCCNc1cccc(c1)I 34a_100000211102_100000210314 [0,1,0,1,0,0|2,0,0]=4 1300 B14R1.26 CCCCCCNc1cccc(c1)O 34a_100000210217_100000210314 [0,1,0,1,0,0|1,0,1]=4 1301 B14R1.26 CCCCCCNc1cccc(n1)F 27a_100000210581_100009815982 [0,1,0,1,0,0|2,0,0]=4 1302 B14R1.26 CCCCCCOc1cc[nH]c(=O)c1 34a_100000032262_100000210314 [0,1,0,1,0,0|2,0,0]=4 1303 B14R1.26 CCCCCCOc1cccc(=O)[nH]1 34a_100000033347_100000210314 [0,1,0,1,0,0|1,0,0]=3 1304 B14R1.26 CCCCCCOc1cccc(c1)Br 34a_100000210342_100000210314 [0,1,0,1,0,0|2,0,0]=4 1305 B14R1.26 CCCCCCOc1cccc(c1)Br 7a_100000210342_100000210314 [0,1,0,1,0,0|2,0,0]=4 1306 B14R1.26 CCCCCCOc1cccc(c1)C 34a_100000210337_100000210314 [0,1,0,1,0,0|2,0,0]=4 1307 B14R1.26 CCCCCCOc1cccc(c1)C 7a_100000210337_100000210314 [0,1,0,1,0,0|2,0,0]=4 1308 B14R1.26 CCCCCCOc1cccc(c1)Cl 34a_100000210295_100000210314 [0,1,0,1,0,0|2,0,0]=4 1309 B14R1.26 CCCCCCOc1cccc(c1)Cl 7a_100000210295_100000210314 [0,1,0,1,0,0|2,0,0]=4 1310 B14R1.26 CCCCCCOc1cccc(c1)F 34a_100000210426_100000210314 [0,1,0,1,0,0|2,0,0]=4 1311 B14R1.26 CCCCCCOc1cccc(c1)F 7a_100000210426_100000210314 [0,1,0,1,0,0|2,0,0]=4 1312 B14R1.26 CCCCCCOc1cccc(c1)I 34a_100000211634_100000210314 [0,1,0,1,0,0|2,0,0]=4 1313 B14R1.26 CCCCCCOc1cccc(c1)I 7a_100000211634_100000210314 [0,1,0,1,0,0|2,0,0]=4 1314 B14R1.26 CCCCCCOc1cccc(c1)N 34a_100000210217_100000210314 [0,1,0,1,0,0|2,0,0]=4 1315 B14R1.26 CCCCCCOc1cccc(n1)F 34a_100011432558_100000210314 [0,1,0,1,0,0|2,0,0]=4 1316 B14R1.26 CCCCCCSc1cc(=O)cc[nH]1 62a_100009817434_100000210757 [0,1,0,1,0,0|2,0,0]=4 1317 B14R1.26 CCCCCCSc1cc(ccn1)C 62a_100000210314_100000750283 [0,1,0,1,0,0|2,0,0]=4 1318 B14R1.26 CCCCCCSc1cc(ccn1)C 62a_100000750283_100000210757 [0,1,0,1,0,0|2,0,0]=4 1319 B14R1.26 CCCCCCSc1cc(ccn1)Cl 62a_100000210314_100010167805 [0,1,0,1,0,0|2,0,0]=4 1320 B14R1.26 CCCCCCSc1cc(ccn1)Cl 62a_100010167805_100000210757 [0,1,0,1,0,0|2,0,0]=4 1321 B14R1.26 CCCCCCSc1cc(ccn1)F 62a_100000210314_100000764206 [0,1,0,1,0,0|2,0,0]=4 1322 B14R1.26 CCCCCCSc1cc(ccn1)F 62a_100000764206_100000210757 [0,1,0,1,0,0|2,0,0]=4 1323 B14R1.26 CCCCCCSc1cc(ccn1)N 62a_100000210314_100009814236 [0,1,0,1,0,0|2,0,0]=4 1324 B14R1.26 CCCCCCSc1cc(ccn1)N 62a_100009814236_100000210757 [0,1,0,1,0,0|2,0,0]=4 1325 B14R1.26 CCCCCCSc1cc(ccn1)O 62a_100000210314_100000762945 [0,1,0,1,0,0|2,0,0]=4 1326 B14R1.26 CCCCCCSc1cc[nH]c(=O)c1 62a_100000210314_100009816521 [0,1,0,1,0,0|2,0,0]=4 1327 B14R1.26 CCCCCCSc1cc[nH]c(=O)c1 62a_100009816521_100000210757 [0,1,0,1,0,0|2,0,0]=4 1328 B14R1.26 CCCCCCSc1cc[nH]c(=O)n1 62a_100000210314_200000134032 [0,1,0,1,0,0|2,0,0]=4 1329 B14R1.26 CCCCCCSc1cccc(=O)[nH]1 62a_100000210314_100000752884 [0,1,0,1,0,0|1,0,0]=3 1330 B14R1.26 CCCCCCSc1cccc(c1)Br 62a_100000210314_100000691529 [0,1,0,1,0,0|2,0,0]=4 1331 B14R1.26 CCCCCCSc1cccc(c1)Br 62a_100000691529_100000210757 [0,1,0,1,0,0|2,0,0]=4 1332 B14R1.26 CCCCCCSc1cccc(c1)C 62a_100000210314_100011215228 [0,1,0,1,0,0|2,0,0]=4 1333 B14R1.26 CCCCCCSc1cccc(c1)C 62a_100011215228_100000210757 [0,1,0,1,0,0|2,0,0]=4 1334 B14R1.26 CCCCCCSc1cccc(c1)Cl 62a_100000210314_100000699651 [0,1,0,1,0,0|2,0,0]=4 1335 B14R1.26 CCCCCCSc1cccc(c1)Cl 62a_100000699651_100000210757 [0,1,0,1,0,0|2,0,0]=4 1336 B14R1.26 CCCCCCSc1cccc(c1)F 62a_100000210314_100000685547 [0,1,0,1,0,0|2,0,0]=4 1337 B14R1.26 CCCCCCSc1cccc(c1)F 62a_100000685547_100000210757 [0,1,0,1,0,0|2,0,0]=4 1338 B14R1.26 CCCCCCSc1cccc(c1)N 62a_100000210019_100000210757 [0,1,0,1,0,0|2,0,0]=4 1339 B14R1.26 CCCCCCSc1cccc(c1)N 62a_100000210314_100000210019 [0,1,0,1,0,0|2,0,0]=4 1340 B14R1.26 CCCCCCSc1cccc(c1)O 62a_100000210314_100000211634 [0,1,0,1,0,0|1,0,1]=4 1341 B14R1.26 CCCCCCSc1cccc(c1)[S] 62a_100000210314_114929384022 [0,1,0,1,0,0|1,1,0]=4 1342 B14R1.26 CCCCCCSc1cccc(c1)[S] 62a_114929384022_100000210757 [0,1,0,1,0,0|1,1,0]=4 1343 B14R1.26 CCCCCCSc1cccc(n1)Br 62a_100000210314_100000684672 [0,1,0,1,0,0|2,0,0]=4 1344 B14R1.26 CCCCCCSc1cccc(n1)Br 62a_100000684672_100000210757 [0,1,0,1,0,0|2,0,0]=4 1345 B14R1.26 CCCCCCSc1cccc(n1)C 62a_100000210314_100000742759 [0,1,0,1,0,0|2,0,0]=4 1346 B14R1.26 CCCCCCSc1cccc(n1)C 62a_100000742759_100000210757 [0,1,0,1,0,0|2,0,0]=4 1347 B14R1.26 CCCCCCSc1cccc(n1)Cl 62a_100000051397_100000210757 [0,1,0,1,0,0|2,0,0]=4 1348 B14R1.26 CCCCCCSc1cccc(n1)Cl 62a_100000210314_100000051397 [0,1,0,1,0,0|2,0,0]=4 1349 B14R1.26 CCCCCCSc1cccc(n1)F 62a_100000210314_100009815982 [0,1,0,1,0,0|2,0,0]=4 1350 B14R1.26 CCCCCCSc1cccc(n1)F 62a_100009815982_100000210757 [0,1,0,1,0,0|2,0,0]=4 1351 B14R1.26 CCCCCCSc1cccc(n1)N 62a_100000210314_100000740741 [0,1,0,1,0,0|2,0,0]=4 1352 B14R1.26 CCCCCCSc1cccc(n1)N 62a_100000740741_100000210757 [0,1,0,1,0,0|2,0,0]=4 1353 B14R1.26 CCCCCNCc1cc(ccn1)Br 2230a_100000209983_100010173614 [0,1,0,1,0,0|2,0,0]=4 1354 B14R1.26 CCCCCNCc1cc(ccn1)Br 270004a_100000209983_100009818557 [0,1,0,1,0,0|2,0,0]=4 1355 B14R1.26 CCCCCNCc1cc(ccn1)C 207a_100000209983_100011361488 [0,1,0,1,0,0|2,0,0]=4 1356 B14R1.26 CCCCCNCc1cc(ccn1)C 2230a_100000209983_100000718516 [0,1,0,1,0,0|2,0,0]=4 1357 B14R1.26 CCCCCNCc1cc(ccn1)C 270004a_100000209983_100011361488 [0,1,0,1,0,0|2,0,0]=4 1358 B14R1.26 CCCCCNCc1cc(ccn1)Cl 2230a_100000209983_100016988179 [0,1,0,1,0,0|2,0,0]=4 1359 B14R1.26 CCCCCNCc1cc(ccn1)Cl 270004a_100000209983_100011998288 [0,1,0,1,0,0|2,0,0]=4 1360 B14R1.26 CCCCCNCc1cccc(=O)[nH]1 207a_100000209983_100011935257 [0,1,0,1,0,0|1,0,0]=3 1361 B14R1.26 CCCCCNCc1cccc(=O)[nH]1 2230a_100000696482_100000210326 [0,1,0,1,0,0|1,0,0]=3 1362 B14R1.26 CCCCCNCc1cccc(c1)Br 207a_100000209983_100000210085 [0,1,0,1,0,0|2,0,0]=4 1363 B14R1.26 CCCCCNCc1cccc(c1)Br 2230a_100000174977_100000210326 [0,1,0,1,0,0|2,0,0]=4 1364 B14R1.26 CCCCCNCc1cccc(c1)Br 2230a_100000209983_100000698116 [0,1,0,1,0,0|2,0,0]=4 1365 B14R1.26 CCCCCNCc1cccc(c1)Br 270004a_100000209983_100000210085 [0,1,0,1,0,0|2,0,0]=4 1366 B14R1.26 CCCCCNCc1cccc(c1)Br 34a_100000174977_100000718602 [0,1,0,1,0,0|2,0,0]=4 1367 B14R1.26 CCCCCNCc1cccc(c1)C 207a_100000209983_100000211157 [0,1,0,1,0,0|2,0,0]=4 1368 B14R1.26 CCCCCNCc1cccc(c1)C 2230a_100000185548_100000210326 [0,1,0,1,0,0|2,0,0]=4 1369 B14R1.26 CCCCCNCc1cccc(c1)C 2230a_100000209983_100000211840 [0,1,0,1,0,0|2,0,0]=4 1370 B14R1.26 CCCCCNCc1cccc(c1)C 270004a_100000209983_100000211157 [0,1,0,1,0,0|2,0,0]=4 1371 B14R1.26 CCCCCNCc1cccc(c1)C 34a_100000185548_100000718602 [0,1,0,1,0,0|2,0,0]=4 1372 B14R1.26 CCCCCNCc1cccc(c1)Cl 207a_100000209983_100000210801 [0,1,0,1,0,0|2,0,0]=4 1373 B14R1.26 CCCCCNCc1cccc(c1)Cl 2230a_100000174878_100000210326 [0,1,0,1,0,0|2,0,0]=4 1374 B14R1.26 CCCCCNCc1cccc(c1)Cl 2230a_100000209983_100000181238 [0,1,0,1,0,0|2,0,0]=4 1375 B14R1.26 CCCCCNCc1cccc(c1)Cl 270004a_100000209983_100000210801 [0,1,0,1,0,0|2,0,0]=4 1376 B14R1.26 CCCCCNCc1cccc(c1)Cl 34a_100000174878_100000718602 [0,1,0,1,0,0|2,0,0]=4 1377 B14R1.26 CCCCCNCc1cccc(c1)F 207a_100000209983_100000210812 [0,1,0,1,0,0|2,0,0]=4 1378 B14R1.26 CCCCCNCc1cccc(c1)F 2230a_100000174948_100000210326 [0,1,0,1,0,0|2,0,0]=4 1379 B14R1.26 CCCCCNCc1cccc(c1)F 2230a_100000209983_100000230114 [0,1,0,1,0,0|2,0,0]=4 1380 B14R1.26 CCCCCNCc1cccc(c1)F 270004a_100000209983_100000210812 [0,1,0,1,0,0|2,0,0]=4 1381 B14R1.26 CCCCCNCc1cccc(c1)F 34a_100000174948_100000718602 [0,1,0,1,0,0|2,0,0]=4 1382 B14R1.26 CCCCCNCc1cccc(c1)I 207a_100000209983_100000014684 [0,1,0,1,0,0|2,0,0]=4 1383 B14R1.26 CCCCCNCc1cccc(c1)I 2230a_100000106179_100000210326 [0,1,0,1,0,0|2,0,0]=4 1384 B14R1.26 CCCCCNCc1cccc(c1)I 2230a_100000209983_100011218688 [0,1,0,1,0,0|2,0,0]=4 1385 B14R1.26 CCCCCNCc1cccc(c1)I 270004a_100000209983_100000014684 [0,1,0,1,0,0|2,0,0]=4 1386 B14R1.26 CCCCCNCc1cccc(c1)I 34a_100000106179_100000718602 [0,1,0,1,0,0|2,0,0]=4 1387 B14R1.26 CCCCCNCc1cccc(c1)O 207a_100000209983_100000188321 [0,1,0,1,0,0|1,0,1]=4 1388 B14R1.26 CCCCCNCc1cccc(c1)O 2230a_100000209983_100011660834 [0,1,0,1,0,0|1,0,1]=4 1389 B14R1.26 CCCCCNCc1cccc(c1)O 2230a_100000743036_100000210326 [0,1,0,1,0,0|1,0,1]=4 1390 B14R1.26 CCCCCNCc1cccc(c1)O 270004a_100000209983_100000188321 [0,1,0,1,0,0|1,0,1]=4 1391 B14R1.26 CCCCCNCc1cccc(c1)O 34a_100000743036_100000718602 [0,1,0,1,0,0|1,0,1]=4 1392 B14R1.26 CCCCCNCc1cccc(n1)Br 2230a_100000209983_100009889011 [0,1,0,1,0,0|2,0,0]=4 1393 B14R1.26 CCCCCNCc1cccc(n1)Br 2230a_100016987751_100000210326 [0,1,0,1,0,0|2,0,0]=4 1394 B14R1.26 CCCCCNCc1cccc(n1)Br 270004a_100000209983_100000688028 [0,1,0,1,0,0|2,0,0]=4 1395 B14R1.26 CCCCCNCc1cccc(n1)C 207a_100000209983_100011215050 [0,1,0,1,0,0|2,0,0]=4 1396 B14R1.26 CCCCCNCc1cccc(n1)C 2230a_100000209983_100000757606 [0,1,0,1,0,0|2,0,0]=4 1397 B14R1.26 CCCCCNCc1cccc(n1)C 270004a_100000209983_100011215050 [0,1,0,1,0,0|2,0,0]=4 1398 B14R1.26 CCCCCNCc1cccc(n1)C 34a_100000701342_100000718602 [0,1,0,1,0,0|2,0,0]=4 1399 B14R1.26 CCCCCNCc1cccc(n1)Cl 2230a_100000209983_100000086093 [0,1,0,1,0,0|2,0,0]=4 1400 B14R1.26 CCCCCNCc1cccc(n1)Cl 2230a_100016990191_100000210326 [0,1,0,1,0,0|2,0,0]=4 1401 B14R1.26 CCCCCNCc1cccc(n1)Cl 270004a_100000209983_100011361687 [0,1,0,1,0,0|2,0,0]=4 1402 B14R1.26 CCCCCNCc1cccc(n1)F 2230a_100000209983_100009819644 [0,1,0,1,0,0|2,0,0]=4 1403 B14R1.26 CCCCCNCc1cccc(n1)F 2230a_100015188798_100000210326 [0,1,0,1,0,0|2,0,0]=4 1404 B14R1.26 CCCCCNCc1cccc(n1)F 270004a_100000209983_100000050434 [0,1,0,1,0,0|2,0,0]=4 1405 B14R1.26 CCCCCNCc1cccc(n1)F 34a_100015188798_100000718602 [0,1,0,1,0,0|2,0,0]=4 1406 B14R1.26 CCCCCOCc1cc(ccn1)Br 34a_100000210253_100010173614 [0,1,0,1,0,0|2,0,0]=4 1407 B14R1.26 CCCCCOCc1cc(ccn1)Br 7a_100000210253_100010173614 [0,1,0,1,0,0|2,0,0]=4 1408 B14R1.26 CCCCCOCc1cc(ccn1)C 34a_100000210253_100000718516 [0,1,0,1,0,0|2,0,0]=4 1409 B14R1.26 CCCCCOCc1cc(ccn1)C 34a_100011998357_100000718602 [0,1,0,1,0,0|2,0,0]=4 1410 B14R1.26 CCCCCOCc1cc(ccn1)C 7a_100000210253_100000718516 [0,1,0,1,0,0|2,0,0]=4 1411 B14R1.26 CCCCCOCc1cc(ccn1)Cl 34a_100000210253_100016988179 [0,1,0,1,0,0|2,0,0]=4 1412 B14R1.26 CCCCCOCc1cc(ccn1)Cl 34a_100000748867_100000718602 [0,1,0,1,0,0|2,0,0]=4 1413 B14R1.26 CCCCCOCc1cc(ccn1)Cl 7a_100000210253_100016988179 [0,1,0,1,0,0|2,0,0]=4 1414 B14R1.26 CCCCCOCc1cc(ccn1)N 34a_100000692640_100000718602 [0,1,0,1,0,0|2,0,0]=4 1415 B14R1.26 CCCCCOCc1cccc(c1)Br 34a_100000210253_100000698116 [0,1,0,1,0,0|2,0,0]=4 1416 B14R1.26 CCCCCOCc1cccc(c1)Br 34a_100000687537_100000718602 [0,1,0,1,0,0|2,0,0]=4 1417 B14R1.26 CCCCCOCc1cccc(c1)Br 7a_100000210253_100000211773 [0,1,0,1,0,0|2,0,0]=4 1418 B14R1.26 CCCCCOCc1cccc(c1)Br 7a_100000687537_100000210326 [0,1,0,1,0,0|2,0,0]=4 1419 B14R1.26 CCCCCOCc1cccc(c1)C 34a_100000210253_100000211840 [0,1,0,1,0,0|2,0,0]=4 1420 B14R1.26 CCCCCOCc1cccc(c1)C 34a_100011217746_100000718602 [0,1,0,1,0,0|2,0,0]=4 1421 B14R1.26 CCCCCOCc1cccc(c1)C 7a_100000210253_100000211840 [0,1,0,1,0,0|2,0,0]=4 1422 B14R1.26 CCCCCOCc1cccc(c1)C 7a_100011217746_100000210326 [0,1,0,1,0,0|2,0,0]=4 1423 B14R1.26 CCCCCOCc1cccc(c1)Cl 34a_100000210253_100000187163 [0,1,0,1,0,0|2,0,0]=4 1424 B14R1.26 CCCCCOCc1cccc(c1)Cl 34a_100000241301_100000718602 [0,1,0,1,0,0|2,0,0]=4 1425 B14R1.26 CCCCCOCc1cccc(c1)Cl 7a_100000210253_100000187163 [0,1,0,1,0,0|2,0,0]=4 1426 B14R1.26 CCCCCOCc1cccc(c1)Cl 7a_100000241301_100000210326 [0,1,0,1,0,0|2,0,0]=4 1427 B14R1.26 CCCCCOCc1cccc(c1)F 34a_100000210253_100000187166 [0,1,0,1,0,0|2,0,0]=4 1428 B14R1.26 CCCCCOCc1cccc(c1)F 34a_100000210976_100000718602 [0,1,0,1,0,0|2,0,0]=4 1429 B14R1.26 CCCCCOCc1cccc(c1)F 7a_100000210253_100000230114 [0,1,0,1,0,0|2,0,0]=4 1430 B14R1.26 CCCCCOCc1cccc(c1)F 7a_100000210976_100000210326 [0,1,0,1,0,0|2,0,0]=4 1431 B14R1.26 CCCCCOCc1cccc(c1)I 34a_100000210253_100011218688 [0,1,0,1,0,0|2,0,0]=4 1432 B14R1.26 CCCCCOCc1cccc(c1)I 34a_100011215336_100000718602 [0,1,0,1,0,0|2,0,0]=4 1433 B14R1.26 CCCCCOCc1cccc(c1)I 7a_100000210253_100011218688 [0,1,0,1,0,0|2,0,0]=4 1434 B14R1.26 CCCCCOCc1cccc(c1)I 7a_100011215336_100000210326 [0,1,0,1,0,0|2,0,0]=4 1435 B14R1.26 CCCCCOCc1cccc(c1)N 34a_100000211919_100000718602 [0,1,0,1,0,0|2,0,0]=4 1436 B14R1.26 CCCCCOCc1cccc(c1)O 34a_100000210253_100011660834 [0,1,0,1,0,0|1,0,1]=4 1437 B14R1.26 CCCCCOCc1cccc(c1)O 7a_100000210253_100000084143 [0,1,0,1,0,0|1,0,1]=4 1438 B14R1.26 CCCCCOCc1cccc(n1)Br 34a_100000210253_100009889011 [0,1,0,1,0,0|2,0,0]=4 1439 B14R1.26 CCCCCOCc1cccc(n1)Br 34a_100000694195_100000718602 [0,1,0,1,0,0|2,0,0]=4 1440 B14R1.26 CCCCCOCc1cccc(n1)Br 7a_100000210253_100009889011 [0,1,0,1,0,0|2,0,0]=4 1441 B14R1.26 CCCCCOCc1cccc(n1)C 34a_100000210253_100000757606 [0,1,0,1,0,0|2,0,0]=4 1442 B14R1.26 CCCCCOCc1cccc(n1)C 34a_100000690600_100000718602 [0,1,0,1,0,0|2,0,0]=4 1443 B14R1.26 CCCCCOCc1cccc(n1)C 7a_100000210253_100000757606 [0,1,0,1,0,0|2,0,0]=4 1444 B14R1.26 CCCCCOCc1cccc(n1)Cl 34a_100000210253_100000086093 [0,1,0,1,0,0|2,0,0]=4 1445 B14R1.26 CCCCCOCc1cccc(n1)Cl 34a_100011998359_100000718602 [0,1,0,1,0,0|2,0,0]=4 1446 B14R1.26 CCCCCOCc1cccc(n1)Cl 7a_100000210253_100000086093 [0,1,0,1,0,0|2,0,0]=4 1447 B14R1.26 CCCCCOCc1cccc(n1)F 34a_100000086748_100000718602 [0,1,0,1,0,0|2,0,0]=4 1448 B14R1.26 CCCCCOCc1cccc(n1)F 34a_100000210253_100009819644 [0,1,0,1,0,0|2,0,0]=4 1449 B14R1.26 CCCCCOCc1cccc(n1)F 7a_100000210253_100009819644 [0,1,0,1,0,0|2,0,0]=4 1450 B14R1.26 CCCCCSCc1cc(ccn1)Br 62a_100000210326_100010173614 [0,1,0,1,0,0|2,0,0]=4 1451 B14R1.26 CCCCCSCc1cc(ccn1)Br 62a_100010173614_100000210326 [0,1,0,1,0,0|2,0,0]=4 1452 B14R1.26 CCCCCSCc1cc(ccn1)C 62a_100000210326_100000718516 [0,1,0,1,0,0|2,0,0]=4 1453 B14R1.26 CCCCCSCc1cc(ccn1)C 62a_100000718516_100000210326 [0,1,0,1,0,0|2,0,0]=4 1454 B14R1.26 CCCCCSCc1cc(ccn1)Cl 62a_100000210326_100016988179 [0,1,0,1,0,0|2,0,0]=4 1455 B14R1.26 CCCCCSCc1cc(ccn1)Cl 62a_100016988179_100000210326 [0,1,0,1,0,0|2,0,0]=4 1456 B14R1.26 CCCCCSCc1cccc(c1)Br 62a_100000210326_100000211773 [0,1,0,1,0,0|2,0,0]=4 1457 B14R1.26 CCCCCSCc1cccc(c1)Br 62a_100000211773_100000210326 [0,1,0,1,0,0|2,0,0]=4 1458 B14R1.26 CCCCCSCc1cccc(c1)C 62a_100000210326_100000211840 [0,1,0,1,0,0|2,0,0]=4 1459 B14R1.26 CCCCCSCc1cccc(c1)C 62a_100000211840_100000210326 [0,1,0,1,0,0|2,0,0]=4 1460 B14R1.26 CCCCCSCc1cccc(c1)Cl 62a_100000187163_100000210326 [0,1,0,1,0,0|2,0,0]=4 1461 B14R1.26 CCCCCSCc1cccc(c1)Cl 62a_100000210326_100000187163 [0,1,0,1,0,0|2,0,0]=4 1462 B14R1.26 CCCCCSCc1cccc(c1)F 62a_100000210326_100000230114 [0,1,0,1,0,0|2,0,0]=4 1463 B14R1.26 CCCCCSCc1cccc(c1)F 62a_100000230114_100000210326 [0,1,0,1,0,0|2,0,0]=4 1464 B14R1.26 CCCCCSCc1cccc(c1)I 62a_100000210326_100011218688 [0,1,0,1,0,0|2,0,0]=4 1465 B14R1.26 CCCCCSCc1cccc(c1)I 62a_100011218688_100000210326 [0,1,0,1,0,0|2,0,0]=4 1466 B14R1.26 CCCCCSCc1cccc(c1)O 62a_100000210326_100011660834 [0,1,0,1,0,0|1,0,1]=4 1467 B14R1.26 CCCCCSCc1cccc(c1)O 62a_100011660834_100000210326 [0,1,0,1,0,0|1,0,1]=4 1468 B14R1.26 CCCCCSCc1cccc(n1)Br 62a_100000210326_100009889011 [0,1,0,1,0,0|2,0,0]=4 1469 B14R1.26 CCCCCSCc1cccc(n1)Br 62a_100009889011_100000210326 [0,1,0,1,0,0|2,0,0]=4 1470 B14R1.26 CCCCCSCc1cccc(n1)C 62a_100000210326_100000757606 [0,1,0,1,0,0|2,0,0]=4 1471 B14R1.26 CCCCCSCc1cccc(n1)C 62a_100000757606_100000210326 [0,1,0,1,0,0|2,0,0]=4 1472 B14R1.26 CCCCCSCc1cccc(n1)Cl 62a_100000086093_100000210326 [0,1,0,1,0,0|2,0,0]=4 1473 B14R1.26 CCCCCSCc1cccc(n1)Cl 62a_100000210326_100000086093 [0,1,0,1,0,0|2,0,0]=4 1474 B14R1.26 CCCCCSCc1cccc(n1)F 62a_100000210326_100009819644 [0,1,0,1,0,0|2,0,0]=4 1475 B14R1.26 CCCCCSCc1cccc(n1)F 62a_100009819644_100000210326 [0,1,0,1,0,0|2,0,0]=4 1476 B14R1.26 CCCCNCCc1cccc(c1)Br 2230a_100000102301_100011740638 [0,1,0,1,0,0|2,0,0]=4 1477 B14R1.26 CCCCNCCc1cccc(c1)Br 2230a_100011207229_100000210211 [0,1,0,1,0,0|2,0,0]=4 1478 B14R1.26 CCCCNCCc1cccc(c1)Br 34a_100011207229_100000210210 [0,1,0,1,0,0|2,0,0]=4 1479 B14R1.26 CCCCNCCc1cccc(c1)Br 7a_106832991798_100011740638 [0,1,0,1,0,0|2,0,0]=4 1480 B14R1.26 CCCCNCCc1cccc(c1)C 2230a_100000102301_100011713685 [0,1,0,1,0,0|2,0,0]=4 1481 B14R1.26 CCCCNCCc1cccc(c1)C 2230a_100000749837_100000210211 [0,1,0,1,0,0|2,0,0]=4 1482 B14R1.26 CCCCNCCc1cccc(c1)C 34a_100000749837_100000210210 [0,1,0,1,0,0|2,0,0]=4 1483 B14R1.26 CCCCNCCc1cccc(c1)C 7a_106832991798_100011713685 [0,1,0,1,0,0|2,0,0]=4 1484 B14R1.26 CCCCNCCc1cccc(c1)Cl 2230a_100000102301_100011713710 [0,1,0,1,0,0|2,0,0]=4 1485 B14R1.26 CCCCNCCc1cccc(c1)Cl 2230a_100000185263_100000210211 [0,1,0,1,0,0|2,0,0]=4 1486 B14R1.26 CCCCNCCc1cccc(c1)Cl 34a_100000185263_100000210210 [0,1,0,1,0,0|2,0,0]=4 1487 B14R1.26 CCCCNCCc1cccc(c1)Cl 7a_106832991798_100011713710 [0,1,0,1,0,0|2,0,0]=4 1488 B14R1.26 CCCCNCCc1cccc(c1)F 2230a_100000102301_100011217235 [0,1,0,1,0,0|2,0,0]=4 1489 B14R1.26 CCCCNCCc1cccc(c1)F 2230a_100000205154_100000210211 [0,1,0,1,0,0|2,0,0]=4 1490 B14R1.26 CCCCNCCc1cccc(c1)F 34a_100000205154_100000210210 [0,1,0,1,0,0|2,0,0]=4 1491 B14R1.26 CCCCNCCc1cccc(c1)F 7a_106832991798_100011217235 [0,1,0,1,0,0|2,0,0]=4 1492 B14R1.26 CCCCNCCc1cccc(c1)O 2230a_100000747277_100000210211 [0,1,0,1,0,0|1,0,1]=4 1493 B14R1.26 CCCCNCCc1cccc(c1)O 34a_100000747277_100000210210 [0,1,0,1,0,0|1,0,1]=4 1494 B14R1.26 CCCCNCCc1cccc(n1)C 2230a_100011824523_100000210211 [0,1,0,1,0,0|2,0,0]=4 1495 B14R1.26 CCCCNCCc1cccc(n1)C 34a_100011824523_100000210210 [0,1,0,1,0,0|2,0,0]=4 1496 B14R1.26 CCCCOCCc1cccc(c1)Br 34a_100000210227_100011740638 [0,1,0,1,0,0|2,0,0]=4 1497 B14R1.26 CCCCOCCc1cccc(c1)Br 34a_100011217444_100000210210 [0,1,0,1,0,0|2,0,0]=4 1498 B14R1.26 CCCCOCCc1cccc(c1)Br 7a_100000210227_100011740638 [0,1,0,1,0,0|2,0,0]=4 1499 B14R1.26 CCCCOCCc1cccc(c1)Br 7a_100011217444_100000210211 [0,1,0,1,0,0|2,0,0]=4 1500 B14R1.26 CCCCOCCc1cccc(c1)C 34a_100000210227_100011713685 [0,1,0,1,0,0|2,0,0]=4 1501 B14R1.26 CCCCOCCc1cccc(c1)C 34a_100011217157_100000210210 [0,1,0,1,0,0|2,0,0]=4 1502 B14R1.26 CCCCOCCc1cccc(c1)C 7a_100000210227_100011713685 [0,1,0,1,0,0|2,0,0]=4 1503 B14R1.26 CCCCOCCc1cccc(c1)C 7a_100011217157_100000210211 [0,1,0,1,0,0|2,0,0]=4 1504 B14R1.26 CCCCOCCc1cccc(c1)Cl 34a_100000210227_100011713710 [0,1,0,1,0,0|2,0,0]=4 1505 B14R1.26 CCCCOCCc1cccc(c1)Cl 34a_100000754733_100000210210 [0,1,0,1,0,0|2,0,0]=4 1506 B14R1.26 CCCCOCCc1cccc(c1)Cl 7a_100000210227_100011713710 [0,1,0,1,0,0|2,0,0]=4 1507 B14R1.26 CCCCOCCc1cccc(c1)Cl 7a_100000754733_100000210211 [0,1,0,1,0,0|2,0,0]=4 1508 B14R1.26 CCCCOCCc1cccc(c1)F 34a_100000210227_100011217235 [0,1,0,1,0,0|2,0,0]=4 1509 B14R1.26 CCCCOCCc1cccc(c1)F 34a_100000763591_100000210210 [0,1,0,1,0,0|2,0,0]=4 1510 B14R1.26 CCCCOCCc1cccc(c1)F 7a_100000210227_100011217235 [0,1,0,1,0,0|2,0,0]=4 1511 B14R1.26 CCCCOCCc1cccc(c1)F 7a_100000763591_100000210211 [0,1,0,1,0,0|2,0,0]=4 1512 B14R1.26 CCCCOCCc1cccc(c1)N 34a_100011996697_100000210210 [0,1,0,1,0,0|2,0,0]=4 1513 B14R1.26 CCCCOCCc1cccc(n1)Br 34a_100010221043_100000210210 [0,1,0,1,0,0|2,0,0]=4 1514 B14R1.26 CCCCOCCc1cccc(n1)Br 7a_100010221043_100000210211 [0,1,0,1,0,0|2,0,0]=4 1515 B14R1.26 CCCCOCOc1cccc(=O)[nH]1 34a_100000033347_100011995733 [0,1,0,1,0,0|2,0,0]=4 1516 B14R1.26 CCCCOCSc1cccc(=O)[nH]1 62a_100011995733_100000752884 [0,1,0,1,0,0|2,0,0]=4 1517 B14R1.26 CCCCSCCc1cccc(c1)Br 62a_100000210211_100011740638 [0,1,0,1,0,0|2,0,0]=4 1518 B14R1.26 CCCCSCCc1cccc(c1)Br 62a_100011740638_100000210210 [0,1,0,1,0,0|2,0,0]=4 1519 B14R1.26 CCCCSCCc1cccc(c1)C 62a_100000210211_100011713685 [0,1,0,1,0,0|2,0,0]=4 1520 B14R1.26 CCCCSCCc1cccc(c1)C 62a_100011713685_100000210210 [0,1,0,1,0,0|2,0,0]=4 1521 B14R1.26 CCCCSCCc1cccc(c1)Cl 62a_100000210211_100011713710 [0,1,0,1,0,0|2,0,0]=4 1522 B14R1.26 CCCCSCCc1cccc(c1)Cl 62a_100011713710_100000210210 [0,1,0,1,0,0|2,0,0]=4 1523 B14R1.26 CCCCSCCc1cccc(c1)F 62a_100000210211_100011217235 [0,1,0,1,0,0|2,0,0]=4 1524 B14R1.26 CCCCSCCc1cccc(c1)F 62a_100011217235_100000210210 [0,1,0,1,0,0|2,0,0]=4 1525 B14R1.26 CCCNCCCc1cccc(c1)Br 2230a_100000753791_100000210303 [0,1,0,1,0,0|2,0,0]=4 1526 B14R1.26 CCCNCCCc1cccc(c1)Br 34a_100000753791_100000210303 [0,1,0,1,0,0|2,0,0]=4 1527 B14R1.26 CCCNCCCc1cccc(c1)C 2230a_103496528808_100000210303 [0,1,0,1,0,0|2,0,0]=4 1528 B14R1.26 CCCNCCCc1cccc(c1)C 34a_103496528808_100000210303 [0,1,0,1,0,0|2,0,0]=4 1529 B14R1.26 CCCNCCCc1cccc(c1)Cl 2230a_100000704586_100000210303 [0,1,0,1,0,0|2,0,0]=4 1530 B14R1.26 CCCNCCCc1cccc(c1)Cl 34a_100000704586_100000210303 [0,1,0,1,0,0|2,0,0]=4 1531 B14R1.26 CCCNCCCc1cccc(c1)F 2230a_100000754185_100000210303 [0,1,0,1,0,0|2,0,0]=4 1532 B14R1.26 CCCNCCCc1cccc(c1)F 34a_100000754185_100000210303 [0,1,0,1,0,0|2,0,0]=4 1533 B14R1.26 CCCOCCCc1cccc(c1)Br 34a_100000210258_100011713683 [0,1,0,1,0,0|2,0,0]=4 1534 B14R1.26 CCCOCCCc1cccc(c1)Br 34a_100011709248_100000210303 [0,1,0,1,0,0|2,0,0]=4 1535 B14R1.26 CCCOCCCc1cccc(c1)Br 7a_100011709248_100000210303 [0,1,0,1,0,0|2,0,0]=4 1536 B14R1.26 CCCOCCCc1cccc(c1)Cl 34a_100011709246_100000210303 [0,1,0,1,0,0|2,0,0]=4 1537 B14R1.26 CCCOCCCc1cccc(c1)Cl 7a_100011709246_100000210303 [0,1,0,1,0,0|2,0,0]=4 1538 B14R1.26 CCCOCCCc1cccc(c1)F 34a_100000210258_200000698031 [0,1,0,1,0,0|2,0,0]=4 1539 B14R1.26 CCCOCCCc1cccc(c1)N 34a_200000698965_100000210303 [0,1,0,1,0,0|2,0,0]=4 1540 B14R1.26 CCCOCCCc1cccc(c1)N 7a_200000698965_100000210303 [0,1,0,1,0,0|2,0,0]=4 1541 B14R1.26 CCCOCCCc1cccc(n1)C 34a_100000211354_100000210303 [0,1,0,1,0,0|2,0,0]=4 1542 B14R1.26 CCCOCCOc1cccc(=O)[nH]1 34a_100000033347_100011215938 [0,1,0,1,0,0|2,0,0]=4 1543 B14R1.26 CCCOCCSc1cccc(=O)[nH]1 62a_100011215938_100000752884 [0,1,0,1,0,0|2,0,0]=4 1544 B14R1.26 CCCSCCCc1cccc(c1)Br 62a_100000210303_100011713683 [0,1,0,1,0,0|2,0,0]=4 1545 B14R1.26 CCCSCCCc1cccc(c1)Br 62a_100011713683_100000210303 [0,1,0,1,0,0|2,0,0]=4 1546 B14R1.26 CCCSCCCc1cccc(c1)F 62a_100000210303_200000698031 [0,1,0,1,0,0|2,0,0]=4 1547 B14R1.26 CCCSCCCc1cccc(c1)F 62a_200000698031_100000210303 [0,1,0,1,0,0|2,0,0]=4 1548 B14R1.26 CCOCCCOc1cccc(=O)[nH]1 34a_100000033347_100012232248 [0,1,0,1,0,0|2,0,0]=4 1549 B14R1.26 CCOCCCSc1cccc(=O)[nH]1 62a_100012232248_100000752884 [0,1,0,1,0,0|2,0,0]=4 1550 B14R1.26 CCOCCNCc1cccc(=O)[nH]1 207a_100011200944_100011935257 [0,1,0,1,0,0|2,0,0]=4 1551 B14R1.26 CCOCCNCc1cccc(=O)[nH]1 2230a_100000696482_100011215890 [0,1,0,1,0,0|2,0,0]=4 1552 B14R1.26 CCSCCNCc1cccc(=O)[nH]1 207a_100000106463_100011935257 [0,1,0,1,0,0|2,0,0]=4 1553 B14R1.26 CCSCCNCc1cccc(=O)[nH]1 2230a_100000696482_100000757381 [0,1,0,1,0,0|2,0,0]=4 1554 B14R1.26 COCCCCOc1cccc(=O)[nH]1 34a_100000033347_100000755781 [0,1,0,1,0,0|2,0,0]=4 1555 B14R1.26 COCCCCSc1cccc(=O)[nH]1 62a_100000730899_100000752884 [0,1,0,1,0,0|2,0,0]=4 1556 B14R1.26 COCCCNCc1cccc(=O)[nH]1 207a_100150723488_100011935257 [0,1,0,1,0,0|2,0,0]=4 1557 B14R1.26 COCCCNCc1cccc(=O)[nH]1 2230a_100000696482_100000740836 [0,1,0,1,0,0|2,0,0]=4 1558 B14R1.26 CSCCCNCc1cccc(=O)[nH]1 207a_100000749238_100011935257 [0,1,0,1,0,0|2,0,0]=4 1559 B14R1.26 O=c1cccc([nH]1)CNCCCCF 2230a_100000696482_100000729493 [0,1,0,1,0,0|2,0,0]=4 1560 B14R1.26 O=c1cccc([nH]1)CNCCCCO 207a_100000750430_100011935257 [0,1,0,1,0,0|2,0,0]=4 1561 B14R1.26 O=c1cccc([nH]1)CNCCCCO 2230a_100000696482_100000210776 [0,1,0,1,0,0|2,0,0]=4 1562 B14R1.26 O=c1cccc([nH]1)OCCCCCF 34a_100000033347_100000729378 [0,1,0,1,0,0|2,0,0]=4 1563 B14R1.26 O=c1cccc([nH]1)OCCCCCO 34a_100000033347_100000746330 [0,1,0,1,0,0|2,0,0]=4 1564 B14R1.26 O=c1cccc([nH]1)SCCCCCF 62a_100000729378_100000752884 [0,1,0,1,0,0|2,0,0]=4 1565 B14R1.26 O=c1cccc([nH]1)SCCCCCO 62a_100000746330_100000752884 [0,1,0,1,0,0|2,0,0]=4 1566 B14R1.40 C/C=C/C=C/COCCC1CCCC1 34a_100016283227_100000760354 [0,1,0,1,0,0|1,0,1]=4 1567 B14R1.40 CCCCCCCC=Cc1c[nH]cn1 271570a_100134823654_100000756875 [0,1,0,1,0,0|1,0,0]=3 1568 B14R1.40 CCCCCCCC=Cc1cc[nH]n1 271570a_100134823654_100000062575 [0,1,0,1,0,0|1,0,0]=3 1569 B14R1.40 CCCCCCCC=Cc1ccco1 271570a_100134823654_100009814098 [0,1,0,1,0,0|0,0,1]=3 1570 B14R1.40 CCCCCCCC=Cc1cccs1 271570a_100134823654_100011215356 [0,1,0,1,0,0|0,1,0]=3 1571 B14R1.40 CCCCCCCC=Cc1ccoc1 271570a_100134823654_100011215275 [0,1,0,1,0,0|0,0,1]=3 1572 B14R1.40 CCCCCCCC=Cc1ccsc1 271570a_100134823654_100000738268 [0,1,0,1,0,0|0,1,0]=3 1573 B14R1.40 CCCCCCCC=Cc1ccsn1 271570a_100134823654_100009818082 [0,1,0,1,0,0|0,1,0]=3 1574 B14R1.40 CCCCCCCC=Cc1cn[nH]c1 271570a_100134823654_100000238712 [0,1,0,1,0,0|2,0,0]=4 1575 B14R1.40 CCCCCCCC=Cc1cnco1 271570a_100134823654_100020591547 [0,1,0,1,0,0|0,0,1]=3 1576 B14R1.40 CCCCCCCC=Cc1cncs1 271570a_100134823654_100011934649 [0,1,0,1,0,0|0,1,0]=3 1577 B14R1.40 CCCCCCCC=Cc1cnoc1 271570a_100134823654_100009815712 [0,1,0,1,0,0|1,0,1]=4 1578 B14R1.40 CCCCCCCC=Cc1cnsc1 271570a_100134823654_100009815736 [0,1,0,1,0,0|1,1,0]=4 1579 B14R1.40 CCCCCCCC=Cc1cscn1 271570a_100134823654_100000751502 [0,1,0,1,0,0|1,0,0]=3 1580 B14R1.40 CCCCCCCC=Cc1nc[nH]n1 271570a_100134823654_100000761765 [0,1,0,1,0,0|2,0,0]=4 1581 B14R1.40 CCCCCCCC=Cc1ncc[nH]1 271570a_100134823654_100025796157 [0,1,0,1,0,0|1,0,0]=3 1582 B14R1.40 CCCCCCCC=Cc1ncco1 271570a_100134823654_100011787736 [0,1,0,1,0,0|0,0,1]=3 1583 B14R1.40 CCCCCCCC=Cc1nccs1 271570a_100134823654_100000211983 [0,1,0,1,0,0|0,1,0]=3 1584 B14R1.40 CCCCCCCC=Cc1ncns1 271570a_100134823654_100000693119 [0,1,0,1,0,0|1,1,0]=4 1585 B14R1.40 CCCCCCCC=Cc1nncs1 271570a_100134823654_100000739804 [0,1,0,1,0,0|1,1,0]=4 1586 B14R1.40 CCCCCCCCSc1ccco1 62a_100000210759_100009814098 [0,1,0,1,0,0|0,0,2]=4 1587 B14R1.40 CCCCCCCCSc1ccco1 62a_100009814098_100000210317 [0,1,0,1,0,0|0,0,2]=4 1588 B14R1.40 CCCCCCCCSc1cccs1 62a_100000210759_100011215356 [0,1,0,1,0,0|0,1,1]=4 1589 B14R1.40 CCCCCCCCSc1cccs1 62a_100011215356_100000210317 [0,1,0,1,0,0|0,1,1]=4 1590 B14R1.40 CCCCCCCNCc1ccco1 207a_100000229938_100000186105 [0,1,0,1,0,0|0,0,2]=4 1591 B14R1.40 CCCCCCCNCc1ccco1 2230a_100000185738_100000210681 [0,1,0,1,0,0|0,0,2]=4 1592 B14R1.40 CCCCCCCNCc1ccco1 270004a_100000229938_100000186105 [0,1,0,1,0,0|0,0,2]=4 1593 B14R1.40 CCCCCCCNCc1ccco1 34a_100000185738_100000210614 [0,1,0,1,0,0|0,0,2]=4 1594 B14R1.40 CCCCCCCNCc1cccs1 207a_100000229938_100000209959 [0,1,0,1,0,0|0,1,1]=4 1595 B14R1.40 CCCCCCCNCc1cccs1 2230a_100000211653_100000210681 [0,1,0,1,0,0|0,1,1]=4 1596 B14R1.40 CCCCCCCNCc1cccs1 270004a_100000229938_100000209959 [0,1,0,1,0,0|0,1,1]=4 1597 B14R1.40 CCCCCCCOCc1ccco1 34a_100000210059_100000210614 [0,1,0,1,0,0|0,0,2]=4 1598 B14R1.40 CCCCCCCOCc1cccs1 34a_100000211240_100000210614 [0,1,0,1,0,0|0,1,1]=4 1599 B14R1.40 CCCCCCNCCc1ccco1 2230a_100000694680_100000210314 [0,1,0,1,0,0|0,0,2]=4 1600 B14R1.40 CCCCCCNCCc1ccco1 34a_100000694680_100000210314 [0,1,0,1,0,0|0,0,2]=4 1601 B14R1.40 CCCCCCNCCc1cccs1 2230a_100000203755_100000210314 [0,1,0,1,0,0|0,1,1]=4 1602 B14R1.40 CCCCCCNCCc1cccs1 2230a_100000210581_100000748579 [0,1,0,1,0,0|0,1,1]=4 1603 B14R1.40 CCCCCCNCCc1cccs1 34a_100000203755_100000210314 [0,1,0,1,0,0|0,1,1]=4 1604 B14R1.40 CCCCCCOCCc1cccs1 34a_100000210259_100000748579 [0,1,0,1,0,0|0,1,1]=4 1605 B14R1.40 CCCCCCOCCc1cccs1 34a_100011216825_100000210314 [0,1,0,1,0,0|0,1,1]=4 1606 B14R1.40 CCCCCCOCCc1cccs1 7a_100000210259_100000748579 [0,1,0,1,0,0|0,1,1]=4 1607 B14R1.40 CCCCCCOCCc1cccs1 7a_100011216825_100000210314 [0,1,0,1,0,0|0,1,1]=4 1608 B14R1.40 CCCCCCSCCc1cccs1 62a_100000210314_100000748579 [0,1,0,1,0,0|0,1,1]=4 1609 B14R1.40 CCCCCCSCCc1cccs1 62a_100000748579_100000210757 [0,1,0,1,0,0|0,1,1]=4 1610 B14R1.40 CCCCCNCC=Cc1ccco1 270004a_100000209983_100000185671 [0,1,0,1,0,0|0,0,2]=4 1611 B14R1.40 CCCCCNCCCc1cccs1 2230a_100000209983_100010992444 [0,1,0,1,0,0|0,1,1]=4 1612 B14R1.40 CCCCCOCCCc1cccs1 34a_100000210253_100010992444 [0,1,0,1,0,0|0,1,1]=4 1613 B14R1.40 CCCCCOCCCc1cccs1 34a_100011713143_100000718602 [0,1,0,1,0,0|0,1,1]=4 1614 B14R1.40 CCCCCOCCCc1cccs1 7a_100000210253_100010992444 [0,1,0,1,0,0|0,1,1]=4 1615 B14R1.40 CCCCCOCCCc1cccs1 7a_100011713143_100000210326 [0,1,0,1,0,0|0,1,1]=4 1616 B14R1.40 CCCCCSCCCc1cccs1 62a_100000210326_100010992444 [0,1,0,1,0,0|0,1,1]=4 1617 B14R1.40 CCCCCSCCCc1cccs1 62a_100010992444_100000210326 [0,1,0,1,0,0|0,1,1]=4 1618 B14R1.40 COCCCCCCSc1ccco1 62a_100009814098_100011998445 [0,1,0,1,0,0|1,0,1]=4 1619 B14R1.40 COCCCCCCSc1ccco1 62a_100011998445_100009814098 [0,1,0,1,0,0|1,0,1]=4 1620 B14R1.40 COCCCCCCSc1cccs1 62a_100011215356_100011998445 [0,1,0,1,0,0|1,1,0]=4 1621 B14R1.40 COCCCCCCSc1cccs1 62a_100011998445_100011215356 [0,1,0,1,0,0|1,1,0]=4 1622 B14R1.40 OCCCCCCCSc1ccco1 62a_100000760002_100009814098 [0,1,0,1,0,0|1,0,1]=4 1623 B14R1.40 OCCCCCCCSc1ccco1 62a_100009814098_100000760002 [0,1,0,1,0,0|1,0,1]=4 1624 B14R1.40 OCCCCCCCSc1cccs1 62a_100000760002_100011215356 [0,1,0,1,0,0|1,1,0]=4 1625 B14R1.40 OCCCCCCCSc1cccs1 62a_100011215356_100000760002 [0,1,0,1,0,0|1,1,0]=4 1626 B14R1.216 CCCCCCC=Cc1ccsc1C 271570a_200015348155_100000684487 [0,1,0,1,0,0|1,0,1]=4 1627 B14R1.216 CCCCCCC=Cc1cscc1Br 271570a_200015348155_100010143727 [0,1,0,1,0,0|1,0,1]=4 1628 B14R1.216 CCCCCCC=Cc1cscc1C 271570a_200015348155_100000759966 [0,1,0,1,0,0|1,0,1]=4 1629 B14R1.216 CCCCCCC=Cc1sccc1Br 271570a_200015348155_100012361411 [0,1,0,1,0,0|0,1,1]=4 1630 B14R1.216 CCCCCCC=Cc1sccc1C 271570a_200015348155_100000742657 [0,1,0,1,0,0|0,1,1]=4 1631 B14R1.216 CCCCCCCCc1ccsc1O 271570a_203496583355_100010174799 [0,1,0,1,0,0|0,0,2]=4 1632 B14R1.216 CCCCCCCSc1ccsc1C 62a_100000210614_100000684487 [0,1,0,1,0,0|2,0,0]=4 1633 B14R1.216 CCCCCCCSc1ccsc1C 62a_100000684487_100000210316 [0,1,0,1,0,0|2,0,0]=4 1634 B14R1.216 CCCCCCCSc1cscc1Br 62a_100000210614_100010143727 [0,1,0,1,0,0|2,0,0]=4 1635 B14R1.216 CCCCCCCSc1cscc1Br 62a_100010143727_100000210316 [0,1,0,1,0,0|2,0,0]=4 1636 B14R1.216 CCCCCCCSc1cscc1C 62a_100000210614_100000759966 [0,1,0,1,0,0|2,0,0]=4 1637 B14R1.216 CCCCCCCSc1cscc1C 62a_100000759966_100000210316 [0,1,0,1,0,0|2,0,0]=4 1638 B14R1.216 CCCCCCCSc1sccc1Br 62a_100000210614_100012361411 [0,1,0,1,0,0|1,1,0]=4 1639 B14R1.216 CCCCCCCSc1sccc1Br 62a_100012361411_100000210316 [0,1,0,1,0,0|1,1,0]=4 1640 B14R1.216 CCCCCCCSc1sccc1C 62a_100000210614_100010247149 [0,1,0,1,0,0|1,1,0]=4 1641 B14R1.216 CCCCCCCSc1sccc1C 62a_100010247149_100000210316 [0,1,0,1,0,0|1,1,0]=4 1642 B14R1.216 CCCCCCNCc1cccn1C 270004a_100000210581_100000211633 [0,1,0,1,0,0|2,0,0]=4 1643 B14R1.216 CCCCCCNCc1cccn1C 34a_100011219357_100000210314 [0,1,0,1,0,0|2,0,0]=4 1644 B14R1.216 CCCCCCNCc1ccsc1Br 207a_100000210581_100009816921 [0,1,0,1,0,0|2,0,0]=4 1645 B14R1.216 CCCCCCNCc1ccsc1Br 2230a_100000210581_100009814289 [0,1,0,1,0,0|2,0,0]=4 1646 B14R1.216 CCCCCCNCc1ccsc1Br 2230a_100000727803_100000210314 [0,1,0,1,0,0|2,0,0]=4 1647 B14R1.216 CCCCCCNCc1ccsc1Br 270004a_100000210581_100009816921 [0,1,0,1,0,0|2,0,0]=4 1648 B14R1.216 CCCCCCNCc1ccsc1Br 34a_100000727803_100000210314 [0,1,0,1,0,0|2,0,0]=4 1649 B14R1.216 CCCCCCNCc1ccsc1Cl 207a_100000210581_100000089901 [0,1,0,1,0,0|2,0,0]=4 1650 B14R1.216 CCCCCCNCc1ccsc1Cl 2230a_100000210581_100010167017 [0,1,0,1,0,0|2,0,0]=4 1651 B14R1.216 CCCCCCNCc1ccsc1Cl 270004a_100000210581_100000089901 [0,1,0,1,0,0|2,0,0]=4 1652 B14R1.216 CCCCCCNCc1cscc1Br 207a_100000210581_100000685484 [0,1,0,1,0,0|2,0,0]=4 1653 B14R1.216 CCCCCCNCc1cscc1Br 270004a_100000210581_100000685484 [0,1,0,1,0,0|2,0,0]=4 1654 B14R1.216 CCCCCCNCc1occc1Br 270004a_100000210581_100000756499 [0,1,0,1,0,0|2,0,0]=4 1655 B14R1.216 CCCCCCNCc1occc1C 207a_100000210581_100000763527 [0,1,0,1,0,0|2,0,0]=4 1656 B14R1.216 CCCCCCNCc1occc1C 270004a_100000210581_100000763527 [0,1,0,1,0,0|2,0,0]=4 1657 B14R1.216 CCCCCCNCc1sccc1Br 207a_100000210581_100000766043 [0,1,0,1,0,0|2,0,0]=4 1658 B14R1.216 CCCCCCNCc1sccc1Br 270004a_100000210581_100000766043 [0,1,0,1,0,0|2,0,0]=4 1659 B14R1.216 CCCCCCNCc1sccc1C 207a_100000210581_100000210881 [0,1,0,1,0,0|2,0,0]=4 1660 B14R1.216 CCCCCCNCc1sccc1C 2230a_100000238519_100000210314 [0,1,0,1,0,0|2,0,0]=4 1661 B14R1.216 CCCCCCNCc1sccc1C 270004a_100000210581_100000210881 [0,1,0,1,0,0|2,0,0]=4 1662 B14R1.216 CCCCCCNCc1sccc1C 34a_100000238519_100000210314 [0,1,0,1,0,0|2,0,0]=4 1663 B14R1.216 CCCCCCNCc1sccc1Cl 207a_100000210581_100000722334 [0,1,0,1,0,0|2,0,0]=4 1664 B14R1.216 CCCCCCNCc1sccc1Cl 2230a_100011934584_100000210314 [0,1,0,1,0,0|2,0,0]=4 1665 B14R1.216 CCCCCCNCc1sccc1Cl 270004a_100000210581_100000722334 [0,1,0,1,0,0|2,0,0]=4 1666 B14R1.216 CCCCCCNCc1sccc1Cl 34a_100011934584_100000210314 [0,1,0,1,0,0|2,0,0]=4 1667 B14R1.216 CCCCCCOCC1=CCCC1=O 34a_100000087531_100000210314 [0,1,0,1,0,0|0,0,2]=4 1668 B14R1.216 CCCCCCOCc1ccoc1C 34a_100011219433_100000210314 [0,1,0,1,0,0|2,0,0]=4 1669 B14R1.216 CCCCCCOCc1ccoc1C 7a_100011219433_100000210314 [0,1,0,1,0,0|2,0,0]=4 1670 B14R1.216 CCCCCCOCc1ccsc1Br 34a_100000210259_100009814289 [0,1,0,1,0,0|2,0,0]=4 1671 B14R1.216 CCCCCCOCc1ccsc1Br 34a_100009816922_100000210314 [0,1,0,1,0,0|2,0,0]=4 1672 B14R1.216 CCCCCCOCc1ccsc1Br 7a_100000210259_100009814289 [0,1,0,1,0,0|2,0,0]=4 1673 B14R1.216 CCCCCCOCc1ccsc1Br 7a_100009816922_100000210314 [0,1,0,1,0,0|2,0,0]=4 1674 B14R1.216 CCCCCCOCc1ccsc1Cl 34a_100000210259_100010167017 [0,1,0,1,0,0|2,0,0]=4 1675 B14R1.216 CCCCCCOCc1ccsc1Cl 7a_100000210259_100010167017 [0,1,0,1,0,0|2,0,0]=4 1676 B14R1.216 CCCCCCOCc1cscc1Br 34a_100000724555_100000210314 [0,1,0,1,0,0|2,0,0]=4 1677 B14R1.216 CCCCCCOCc1occc1C 34a_100011273948_100000210314 [0,1,0,1,0,0|2,0,0]=4 1678 B14R1.216 CCCCCCOCc1occc1C 7a_100011273948_100000210314 [0,1,0,1,0,0|2,0,0]=4 1679 B14R1.216 CCCCCCOCc1sccc1Br 34a_100000702026_100000210314 [0,1,0,1,0,0|2,0,0]=4 1680 B14R1.216 CCCCCCOCc1sccc1C 34a_100000238368_100000210314 [0,1,0,1,0,0|2,0,0]=4 1681 B14R1.216 CCCCCCOCc1sccc1C 7a_100000238368_100000210314 [0,1,0,1,0,0|2,0,0]=4 1682 B14R1.216 CCCCCCOCc1sccc1Cl 34a_100000722387_100000210314 [0,1,0,1,0,0|2,0,0]=4 1683 B14R1.216 CCCCCCOCc1sccc1Cl 7a_100000722387_100000210314 [0,1,0,1,0,0|2,0,0]=4 1684 B14R1.216 CCCCCCSCc1ccsc1Br 62a_100000210314_100009814289 [0,1,0,1,0,0|2,0,0]=4 1685 B14R1.216 CCCCCCSCc1ccsc1Br 62a_100009814289_100000210757 [0,1,0,1,0,0|2,0,0]=4 1686 B14R1.216 CCCCCCSCc1ccsc1Cl 62a_100000210314_100010167017 [0,1,0,1,0,0|2,0,0]=4 1687 B14R1.216 CCCCCCSCc1ccsc1Cl 62a_100010167017_100000210757 [0,1,0,1,0,0|2,0,0]=4 1688 B14R1.216 CCCCCNCCc1cccn1C 2230a_100011251756_100000210326 [0,1,0,1,0,0|2,0,0]=4 1689 B14R1.216 CCCCCNCCc1cccn1C 34a_100011251756_100000718602 [0,1,0,1,0,0|2,0,0]=4 1690 B14R1.219 CC=Cc1ccc(s1)CCCCCC 271570a_100016259895_100009817186 [0,1,0,1,0,0|1,0,1]=4 1691 B14R1.520 CCCC(=O)CCCc1ccccc1 1458a_100000211992_100000211621 [0,1,0,1,0,0|1,0,1]=4 1692 B14R1.520 CCCC(=O)CCCc1ccccc1 1458a_100011207963_100000210303 [0,1,0,1,0,0|1,0,1]=4 1693 B14R1.520 CCCC(=O)CCCc1ccccn1 1458a_100000752327_100000210303 [0,1,0,1,0,0|1,0,1]=4 1694 B14R1.520 CCCC(C)CNCc1ccccc1 2230a_100015324214_100011216630 [0,1,0,1,0,0|2,0,0]=4 1695 B14R1.520 CCCC(C)CNCc1ccccc1 270004a_100015324214_100000243154 [0,1,0,1,0,0|2,0,0]=4 1696 B14R1.520 CCCC(C)CNCc1ccccc1 34a_100015324214_100011216630 [0,1,0,1,0,0|2,0,0]=4 1697 B14R1.520 CCCC(C)CNCc1ccccn1 270004a_100000210449_100000243154 [0,1,0,1,0,0|2,0,0]=4 1698 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000210790_100011216630 [0,1,0,1,0,0|2,0,0]=4 1699 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000688023_100015291786 [0,1,0,1,0,0|2,0,0]=4 1700 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000210790_100011216630 [0,1,0,1,0,0|2,0,0]=4 1701 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000688023_100000211182 [0,1,0,1,0,0|2,0,0]=4 1702 B14R1.520 CCCC(C)COCc1ccccn1 34a_100000688023_100000721315 [0,1,0,1,0,0|2,0,0]=4 1703 B14R1.520 CCCC(C)COCc1ccccn1 7a_100000688023_100000721315 [0,1,0,1,0,0|2,0,0]=4 1704 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100000211182_100011216630 [0,1,0,1,0,0|2,0,0]=4 1705 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100011216630_100015291786 [0,1,0,1,0,0|2,0,0]=4 1706 B14R1.520 CCCC(C)CSCc1ccccn1 62a_100000721315_100011216630 [0,1,0,1,0,0|2,0,0]=4 1707 B14R1.520 CCCC(C)CSCc1ccccn1 62a_100011216630_100000721315 [0,1,0,1,0,0|2,0,0]=4 1708 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000106460_100000766640 [0,1,0,1,0,0|2,0,0]=4 1709 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000741246_100000765856 [0,1,0,1,0,0|2,0,0]=4 1710 B14R1.520 CCCC(C)NCCc1ccccc1 270004a_100000106460_100000211909 [0,1,0,1,0,0|2,0,0]=4 1711 B14R1.520 CCCC(C)NCCc1ccccc1 34a_100000106460_100000766640 [0,1,0,1,0,0|2,0,0]=4 1712 B14R1.520 CCCC(C)NCCc1ccccn1 2230a_100000741246_100015183660 [0,1,0,1,0,0|2,0,0]=4 1713 B14R1.520 CCCC(C)NCCc1ccccn1 270004a_100000211156_100000211909 [0,1,0,1,0,0|2,0,0]=4 1714 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000210268_100000766640 [0,1,0,1,0,0|2,0,0]=4 1715 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000764384_100000765856 [0,1,0,1,0,0|2,0,0]=4 1716 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000210268_100000766640 [0,1,0,1,0,0|2,0,0]=4 1717 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000764384_100000765856 [0,1,0,1,0,0|2,0,0]=4 1718 B14R1.520 CCCC(C)OCCc1ccccn1 34a_100000210271_100000766640 [0,1,0,1,0,0|2,0,0]=4 1719 B14R1.520 CCCC(C)OCCc1ccccn1 7a_100000764384_100015183660 [0,1,0,1,0,0|2,0,0]=4 1720 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000765856_100000766640 [0,1,0,1,0,0|2,0,0]=4 1721 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000766640_100011218657 [0,1,0,1,0,0|2,0,0]=4 1722 B14R1.520 CCCC(C)SCCc1ccccn1 62a_100000766640_100015183660 [0,1,0,1,0,0|2,0,0]=4 1723 B14R1.520 CCCC(C)SCCc1ccccn1 62a_100015183660_100000766640 [0,1,0,1,0,0|2,0,0]=4 1724 B14R1.520 CCCN(C)CCCc1ccccc1 2230a_100000693637_100000210303 [0,1,0,1,0,0|2,0,0]=4 1725 B14R1.520 CCCN(C)CCCc1ccccc1 2230a_100000747261_100000211621 [0,1,0,1,0,0|2,0,0]=4 1726 B14R1.520 CCCN(C)CCCc1ccccc1 269982a_100000693637_100000210303 [0,1,0,1,0,0|2,0,0]=4 1727 B14R1.520 CCCN(C)CCCc1ccccc1 269982a_100000747261_100000211621 [0,1,0,1,0,0|2,0,0]=4 1728 B14R1.520 CCC[C@H](N)COCc1ccccc1 34a_100000732646_100015291786 [0,1,0,1,0,0|2,0,0]=4 1729 B14R1.520 CCC[C@H](N)COCc1ccccn1 34a_100000732646_100000721315 [0,1,0,1,0,0|2,0,0]=4 1730 B14R1.520 CCNC(C)CCCc1ccccc1 2230a_100015525214_200010759516 [0,1,0,1,0,0|2,0,0]=4 1731 B14R1.520 CCOC(C)CCCc1ccccc1 34a_100121572206_200010759516 [0,1,0,1,0,0|2,0,0]=4 1732 B14R1.520 CCSC(C)CCCc1ccccc1 62a_100000210202_200010759516 [0,1,0,1,0,0|2,0,0]=4 1733 B14R1.520 CCSC(C)CCCc1ccccc1 62a_200010759516_100000210202 [0,1,0,1,0,0|2,0,0]=4 1734 B14R1.598 CCCC(=O)CCn1ccccc1=O 1458a_100000738505_100000210303 [0,1,0,1,0,0|1,0,1]=4 1735 B14R1.122 CCCCCCC=Cc1cc(cs1)C 271570a_200015348155_100009876951 [0,1,0,1,0,0|0,1,1]=4 1736 B14R1.122 CCCCCCC=Cc1ccc(s1)Br 271570a_200015348155_100010197418 [0,1,0,1,0,0|0,1,1]=4 1737 B14R1.122 CCCCCCC=Cc1ccc(s1)C 271570a_200015348155_100000761539 [0,1,0,1,0,0|0,1,1]=4 1738 B14R1.122 CCCCCCCSc1cc(cs1)C 62a_100000210614_100009876951 [0,1,0,1,0,0|1,1,0]=4 1739 B14R1.122 CCCCCCCSc1cc(cs1)C 62a_100009876951_100000210316 [0,1,0,1,0,0|1,1,0]=4 1740 B14R1.122 CCCCCCCSc1ccc(s1)Br 62a_100000210614_100010197418 [0,1,0,1,0,0|1,1,0]=4 1741 B14R1.122 CCCCCCCSc1ccc(s1)Br 62a_100010197418_100000210316 [0,1,0,1,0,0|1,1,0]=4 1742 B14R1.122 CCCCCCCSc1ccc(s1)C 62a_100000031368_100000210316 [0,1,0,1,0,0|1,1,0]=4 1743 B14R1.122 CCCCCCCSc1ccc(s1)C 62a_100000210614_100000031368 [0,1,0,1,0,0|1,1,0]=4 1744 B14R1.159 CC(C)CNCCn1ccccc1=O 2230a_100000687133_100000210760 [0,1,0,1,0,0|2,0,0]=4 1745 B14R1.159 CC(O)CNCCn1ccccc1=O 2230a_100000687133_100011218427 [0,1,0,1,0,0|2,0,0]=4 1746 B14R1.159 C[C@@H](O)CNCCn1ccccc1=O 2230a_100000687133_100009817552 [0,1,0,1,0,0|2,0,0]=4 1747 B14R1.422 CC(=O)CCCCCc1ccccc1 1458a_100000070787_200011217138 [0,1,0,1,0,0|1,0,1]=4 1748 B14R1.422 CC(=O)CCCCCc1ccccc1 1458a_100011216832_200000210301 [0,1,0,1,0,0|1,0,1]=4 1749 B14R1.422 CC(Br)CCOCCc1ccccc1 34a_100009893172_100000765856 [0,1,0,1,0,0|2,0,0]=4 1750 B14R1.422 CC(Br)COCCCc1ccccc1 34a_100012180447_100000211621 [0,1,0,1,0,0|2,0,0]=4 1751 B14R1.422 CC(C)CCCCNc1ccccc1 34a_100000106764_100011216152 [0,1,0,1,0,0|2,0,0]=4 1752 B14R1.422 CC(C)CCCCOc1ccccc1 34a_100000210340_100011216152 [0,1,0,1,0,0|2,0,0]=4 1753 B14R1.422 CC(C)CCCCOc1ccccc1 7a_100000210340_100011216152 [0,1,0,1,0,0|2,0,0]=4 1754 B14R1.422 CC(C)CCCCSc1ccccc1 62a_100000719477_100011216152 [0,1,0,1,0,0|2,0,0]=4 1755 B14R1.422 CC(C)CCCCSc1ccccc1 62a_100011216152_100000041952 [0,1,0,1,0,0|2,0,0]=4 1756 B14R1.422 CC(C)CCCCSc1ccccn1 62a_100011216152_100011216584 [0,1,0,1,0,0|2,0,0]=4 1757 B14R1.422 CC(C)CCCCSc1ccccn1 62a_100011216584_100011216152 [0,1,0,1,0,0|2,0,0]=4 1758 B14R1.422 CC(C)CCCNCc1ccccc1 207a_200000737386_100015611070 [0,1,0,1,0,0|2,0,0]=4 1759 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_100015324214_100011214892 [0,1,0,1,0,0|2,0,0]=4 1760 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_200000737386_100015291786 [0,1,0,1,0,0|2,0,0]=4 1761 B14R1.422 CC(C)CCCNCc1ccccc1 270004a_200000737386_100015611070 [0,1,0,1,0,0|2,0,0]=4 1762 B14R1.422 CC(C)CCCNCc1ccccc1 34a_100015324214_100011214892 [0,1,0,1,0,0|2,0,0]=4 1763 B14R1.422 CC(C)CCCNCc1ccccc1 34a_200000737386_100015291786 [0,1,0,1,0,0|2,0,0]=4 1764 B14R1.422 CC(C)CCCNCc1ccccn1 207a_200000737386_100000209966 [0,1,0,1,0,0|2,0,0]=4 1765 B14R1.422 CC(C)CCCNCc1ccccn1 2230a_200000737386_100000721315 [0,1,0,1,0,0|2,0,0]=4 1766 B14R1.422 CC(C)CCCNCc1ccccn1 270004a_200000737386_100000209966 [0,1,0,1,0,0|2,0,0]=4 1767 B14R1.422 CC(C)CCCNCc1ccccn1 34a_200000737386_100000721315 [0,1,0,1,0,0|2,0,0]=4 1768 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210774_100015291786 [0,1,0,1,0,0|2,0,0]=4 1769 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210790_100011214892 [0,1,0,1,0,0|2,0,0]=4 1770 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210774_100000211182 [0,1,0,1,0,0|2,0,0]=4 1771 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210790_100011214892 [0,1,0,1,0,0|2,0,0]=4 1772 B14R1.422 CC(C)CCCOCc1ccccn1 34a_100000210774_100000721315 [0,1,0,1,0,0|2,0,0]=4 1773 B14R1.422 CC(C)CCCOCc1ccccn1 7a_100000210774_100000721315 [0,1,0,1,0,0|2,0,0]=4 1774 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100000211182_100011214892 [0,1,0,1,0,0|2,0,0]=4 1775 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100011214892_100015291786 [0,1,0,1,0,0|2,0,0]=4 1776 B14R1.422 CC(C)CCCSCc1ccccn1 62a_100000721315_100011214892 [0,1,0,1,0,0|2,0,0]=4 1777 B14R1.422 CC(C)CCCSCc1ccccn1 62a_100011214892_100000721315 [0,1,0,1,0,0|2,0,0]=4 1778 B14R1.422 CC(C)CCNCCc1ccccc1 2230a_100000106460_100000210312 [0,1,0,1,0,0|2,0,0]=4 1779 B14R1.422 CC(C)CCNCCc1ccccc1 269862a_100000106460_100000185833 [0,1,0,1,0,0|2,0,0]=4 1780 B14R1.422 CC(C)CCNCCc1ccccc1 34a_100000106460_100000210312 [0,1,0,1,0,0|2,0,0]=4 1781 B14R1.422 CC(C)CCNCCc1ccccn1 269862a_100000211156_100000185833 [0,1,0,1,0,0|2,0,0]=4 1782 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210254_100000765856 [0,1,0,1,0,0|2,0,0]=4 1783 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210268_100000210312 [0,1,0,1,0,0|2,0,0]=4 1784 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210254_100000765856 [0,1,0,1,0,0|2,0,0]=4 1785 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210268_100000210626 [0,1,0,1,0,0|2,0,0]=4 1786 B14R1.422 CC(C)CCOCCc1ccccn1 34a_100000210271_100000210312 [0,1,0,1,0,0|2,0,0]=4 1787 B14R1.422 CC(C)CCOCCc1ccccn1 7a_100000210254_100015183660 [0,1,0,1,0,0|2,0,0]=4 1788 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000210312_100011218657 [0,1,0,1,0,0|2,0,0]=4 1789 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000765856_100000210312 [0,1,0,1,0,0|2,0,0]=4 1790 B14R1.422 CC(C)CCSCCc1ccccn1 62a_100000210312_100015183660 [0,1,0,1,0,0|2,0,0]=4 1791 B14R1.422 CC(C)CCSCCc1ccccn1 62a_100015183660_100000210312 [0,1,0,1,0,0|2,0,0]=4 1792 B14R1.422 CC(C)CNCCCc1ccccc1 2230a_100000210953_100000211621 [0,1,0,1,0,0|2,0,0]=4 1793 B14R1.422 CC(C)CNCCCc1ccccc1 2230a_100000211184_100000210760 [0,1,0,1,0,0|2,0,0]=4 1794 B14R1.422 CC(C)CNCCCc1ccccc1 270004a_100000211184_100000210432 [0,1,0,1,0,0|2,0,0]=4 1795 B14R1.422 CC(C)CNCCCc1ccccc1 34a_100000210953_100000211621 [0,1,0,1,0,0|2,0,0]=4 1796 B14R1.422 CC(C)CNCCCc1ccccc1 34a_100000211184_100000210624 [0,1,0,1,0,0|2,0,0]=4 1797 B14R1.422 CC(C)CNCCCc1ccccn1 270004a_100000689020_100000210432 [0,1,0,1,0,0|2,0,0]=4 1798 B14R1.422 CC(C)COCCCc1ccccc1 34a_100000210257_100000211621 [0,1,0,1,0,0|2,0,0]=4 1799 B14R1.422 CC(C)COCCCc1ccccc1 34a_100000210828_100000210624 [0,1,0,1,0,0|2,0,0]=4 1800 B14R1.422 CC(C)COCCCc1ccccc1 7a_100000210828_100000210760 [0,1,0,1,0,0|2,0,0]=4 1801 B14R1.422 CC(C)COCCCc1ccccn1 34a_100011215068_100000210624 [0,1,0,1,0,0|2,0,0]=4 1802 B14R1.422 CC(C)CSCCCc1ccccc1 62a_100000210624_100000211621 [0,1,0,1,0,0|2,0,0]=4 1803 B14R1.422 CC(C)CSCCCc1ccccc1 62a_100000211621_100000210760 [0,1,0,1,0,0|2,0,0]=4 1804 B14R1.422 CC(C)NCCCCc1ccccc1 2230a_100015280158_100000210206 [0,1,0,1,0,0|2,0,0]=4 1805 B14R1.422 CC(C)NCCCCc1ccccc1 2230a_100138425928_100000701786 [0,1,0,1,0,0|2,0,0]=4 1806 B14R1.422 CC(C)NCCCCc1ccccc1 34a_100015280158_100000210206 [0,1,0,1,0,0|2,0,0]=4 1807 B14R1.422 CC(C)NCCCCc1ccccc1 34a_100138425928_100000701786 [0,1,0,1,0,0|2,0,0]=4 1808 B14R1.422 CC(C)OCCCCc1ccccc1 34a_100000212225_100000701786 [0,1,0,1,0,0|2,0,0]=4 1809 B14R1.422 CC(C)OCCCCc1ccccc1 34a_100000703073_100000210206 [0,1,0,1,0,0|2,0,0]=4 1810 B14R1.422 CC(C)OCCCCc1ccccc1 7a_100000703073_100000210206 [0,1,0,1,0,0|2,0,0]=4 1811 B14R1.422 CC(C)OCCCCc1ccccn1 34a_100012186994_100000210206 [0,1,0,1,0,0|2,0,0]=4 1812 B14R1.422 CC(C)SCCCCc1ccccc1 62a_100000210206_100000701786 [0,1,0,1,0,0|2,0,0]=4 1813 B14R1.422 CC(C)SCCCCc1ccccc1 62a_100000701786_100000210206 [0,1,0,1,0,0|2,0,0]=4 1814 B14R1.422 CC(F)COCCCc1ccccc1 34a_100015925927_100000211621 [0,1,0,1,0,0|2,0,0]=4 1815 B14R1.422 CC(O)CCCNCc1ccccc1 2230a_100015324214_200000718107 [0,1,0,1,0,0|2,0,0]=4 1816 B14R1.422 CC(O)CCCNCc1ccccc1 34a_100015324214_200000718107 [0,1,0,1,0,0|2,0,0]=4 1817 B14R1.422 CC(O)CCCOCc1ccccc1 34a_100000210790_200000718107 [0,1,0,1,0,0|2,0,0]=4 1818 B14R1.422 CC(O)CCCOCc1ccccc1 7a_100000210790_200000718107 [0,1,0,1,0,0|2,0,0]=4 1819 B14R1.422 CC(O)CCCSCc1ccccc1 62a_100000211182_200000718107 [0,1,0,1,0,0|2,0,0]=4 1820 B14R1.422 CC(O)CCCSCc1ccccc1 62a_200000718107_100015291786 [0,1,0,1,0,0|2,0,0]=4 1821 B14R1.422 CC(O)CCCSCc1ccccn1 62a_100000721315_200000718107 [0,1,0,1,0,0|2,0,0]=4 1822 B14R1.422 CC(O)CCCSCc1ccccn1 62a_200000718107_100000721315 [0,1,0,1,0,0|2,0,0]=4 1823 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_100000106460_100012276601 [0,1,0,1,0,0|2,0,0]=4 1824 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_200000755665_100000765856 [0,1,0,1,0,0|2,0,0]=4 1825 B14R1.422 CC(O)CCNCCc1ccccc1 34a_100000106460_100012276601 [0,1,0,1,0,0|2,0,0]=4 1826 B14R1.422 CC(O)CCNCCc1ccccn1 2230a_200000755665_100015183660 [0,1,0,1,0,0|2,0,0]=4 1827 B14R1.422 CC(O)CCOCCc1ccccc1 34a_100000210268_100012276601 [0,1,0,1,0,0|2,0,0]=4 1828 B14R1.422 CC(O)CCOCCc1ccccc1 7a_100000210268_100012276601 [0,1,0,1,0,0|2,0,0]=4 1829 B14R1.422 CC(O)CCOCCc1ccccn1 34a_100000210271_100012276601 [0,1,0,1,0,0|2,0,0]=4 1830 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100000765856_100012276601 [0,1,0,1,0,0|2,0,0]=4 1831 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100012276601_100011218657 [0,1,0,1,0,0|2,0,0]=4 1832 B14R1.422 CC(O)CCSCCc1ccccn1 62a_100012276601_100015183660 [0,1,0,1,0,0|2,0,0]=4 1833 B14R1.422 CC(O)CCSCCc1ccccn1 62a_100015183660_100012276601 [0,1,0,1,0,0|2,0,0]=4 1834 B14R1.422 CC(O)CNCCCc1ccccc1 2230a_100000210904_100000211621 [0,1,0,1,0,0|2,0,0]=4 1835 B14R1.422 CC(O)CNCCCc1ccccc1 2230a_100000211184_100011218427 [0,1,0,1,0,0|2,0,0]=4 1836 B14R1.422 CC(O)CNCCCc1ccccc1 34a_100000210904_100000211621 [0,1,0,1,0,0|2,0,0]=4 1837 B14R1.422 CC(O)CNCCCc1ccccc1 34a_100000211184_100011218427 [0,1,0,1,0,0|2,0,0]=4 1838 B14R1.422 CC(O)COCCCc1ccccc1 34a_100000210828_100011218427 [0,1,0,1,0,0|2,0,0]=4 1839 B14R1.422 CC(O)COCCCc1ccccc1 7a_100000210828_100011218427 [0,1,0,1,0,0|2,0,0]=4 1840 B14R1.422 CC(O)COCCCc1ccccn1 34a_100011215068_100011218427 [0,1,0,1,0,0|2,0,0]=4 1841 B14R1.422 CC(O)CSCCCc1ccccc1 62a_100000211621_100011218427 [0,1,0,1,0,0|2,0,0]=4 1842 B14R1.422 CC(O)CSCCCc1ccccc1 62a_100011218427_100000211621 [0,1,0,1,0,0|2,0,0]=4 1843 B14R1.422 CN(C)CCCCCc1ccccc1 2230a_100102631434_200011217138 [0,1,0,1,0,0|2,0,0]=4 1844 B14R1.422 CN(C)CCCCCc1ccccc1 269982a_100102631434_200011217138 [0,1,0,1,0,0|2,0,0]=4 1845 B14R1.422 C[C@@H](Cl)COCCCc1ccccc1 34a_100016084084_100000211621 [0,1,0,1,0,0|2,0,0]=4 1846 B14R1.422 C[C@@H](N)CCOCCc1ccccc1 34a_100000706166_100000765856 [0,1,0,1,0,0|2,0,0]=4 1847 B14R1.422 C[C@@H](N)COCCCc1ccccc1 34a_100000737577_100000211621 [0,1,0,1,0,0|2,0,0]=4 1848 B14R1.422 C[C@@H](O)CNCCCc1ccccc1 2230a_100000211184_100009817552 [0,1,0,1,0,0|2,0,0]=4 1849 B14R1.422 C[C@@H](O)CNCCCc1ccccc1 34a_100000211184_100009817552 [0,1,0,1,0,0|2,0,0]=4 1850 B14R1.422 C[C@@H](O)COCCCc1ccccc1 34a_100000210828_100009817552 [0,1,0,1,0,0|2,0,0]=4 1851 B14R1.422 C[C@@H](O)COCCCc1ccccc1 7a_100000210828_100009817552 [0,1,0,1,0,0|2,0,0]=4 1852 B14R1.422 C[C@@H](O)COCCCc1ccccn1 34a_100011215068_100009817552 [0,1,0,1,0,0|2,0,0]=4 1853 B14R1.422 C[C@@H](O)CSCCCc1ccccc1 62a_100000211621_100009817552 [0,1,0,1,0,0|2,0,0]=4 1854 B14R1.422 C[C@@H](O)CSCCCc1ccccc1 62a_100009817552_100000211621 [0,1,0,1,0,0|2,0,0]=4 1855 B14R1.422 [13CH3]C(=O)CCCCCc1ccccc1 1458a_100011216832_200025704644 [0,1,0,1,0,0|1,0,1]=4 1856 B14R1.427 CC(C)CCCCCSc1ccco1 62a_100000210682_100009814098 [0,1,0,1,0,0|1,0,1]=4 1857 B14R1.427 CC(C)CCCCCSc1ccco1 62a_100009814098_100000210682 [0,1,0,1,0,0|1,0,1]=4 1858 B14R1.427 CC(C)CCCCCSc1cccs1 62a_100000210682_100011215356 [0,1,0,1,0,0|1,1,0]=4 1859 B14R1.427 CC(C)CCCCCSc1cccs1 62a_100011215356_100000210682 [0,1,0,1,0,0|1,1,0]=4 1860 B14R1.123 BrCCCCCOCc1ccccc1 34a_100000746331_100015291786 [0,1,0,1,0,0|2,0,0]=4 1861 B14R1.123 BrCCCCCOCc1ccccc1 7a_100000746331_100000211182 [0,1,0,1,0,0|2,0,0]=4 1862 B14R1.123 BrCCCCCOCc1ccccn1 34a_100000746331_100000721315 [0,1,0,1,0,0|2,0,0]=4 1863 B14R1.123 BrCCCCCOCc1ccccn1 7a_100000746331_100000721315 [0,1,0,1,0,0|2,0,0]=4 1864 B14R1.123 BrCCCCOCCc1ccccc1 34a_100011216708_100000765856 [0,1,0,1,0,0|2,0,0]=4 1865 B14R1.123 BrCCCOCCCc1ccccc1 34a_100011217188_100000211621 [0,1,0,1,0,0|2,0,0]=4 1866 B14R1.123 BrCCOCCCCc1ccccc1 34a_100000211926_100000701786 [0,1,0,1,0,0|2,0,0]=4 1867 B14R1.123 C/C=C/C=C/COCC1CCCCC1 34a_100016283227_100000211423 [0,1,0,1,0,0|1,0,1]=4 1868 B14R1.123 CC=CC=CC=NNC1CCCCC1 4a_100000709804_100000691131 [0,1,0,1,0,0|2,0,0]=4 1869 B14R1.123 CCCCCCC=Cc1ccccc1 271570a_200015348155_100000210277 [0,1,0,1,0,0|1,0,1]=4 1870 B14R1.123 CCCCCCC=Cc1ccccn1 271570a_200015348155_100011216584 [0,1,0,1,0,0|1,0,1]=4 1871 B14R1.123 CCCCCCC=Cc1cccnc1 271570a_200015348155_100000752921 [0,1,0,1,0,0|1,0,1]=4 1872 B14R1.123 CCCCCCC=Cc1cccnn1 271570a_200015348155_100016991348 [0,1,0,1,0,0|1,0,1]=4 1873 B14R1.123 CCCCCCC=Cc1ccncc1 271570a_200015348155_100000035832 [0,1,0,1,0,0|1,0,1]=4 1874 B14R1.123 CCCCCCC=Cc1ccncn1 271570a_200015348155_100000703185 [0,1,0,1,0,0|1,0,1]=4 1875 B14R1.123 CCCCCCC=Cc1cnccn1 271570a_200015348155_100000758340 [0,1,0,1,0,0|1,0,1]=4 1876 B14R1.123 CCCCCCC=Cc1ncccn1 271570a_200015348155_100000211032 [0,1,0,1,0,0|1,0,1]=4 1877 B14R1.123 CCCCCCCNc1ccccc1 34a_100000106764_100000210614 [0,1,0,1,0,0|1,0,0]=3 1878 B14R1.123 CCCCCCCNc1cccnn1 27a_100000229938_100016991348 [0,1,0,1,0,0|2,0,0]=4 1879 B14R1.123 CCCCCCCNc1ccncn1 27a_100000229938_100000703185 [0,1,0,1,0,0|2,0,0]=4 1880 B14R1.123 CCCCCCCNc1cnccn1 27a_100000229938_100000211759 [0,1,0,1,0,0|2,0,0]=4 1881 B14R1.123 CCCCCCCNc1ncccn1 27a_100000229938_100000211032 [0,1,0,1,0,0|2,0,0]=4 1882 B14R1.123 CCCCCCCOc1ccccc1 34a_100000210340_100000210614 [0,1,0,1,0,0|1,0,0]=3 1883 B14R1.123 CCCCCCCOc1ccccc1 7a_100000210340_100000210614 [0,1,0,1,0,0|1,0,0]=3 1884 B14R1.123 CCCCCCCOc1cccnc1 34a_100000210849_100000210614 [0,1,0,1,0,0|2,0,0]=4 1885 B14R1.123 CCCCCCCOc1cccnc1 7a_100000210849_100000210614 [0,1,0,1,0,0|2,0,0]=4 1886 B14R1.123 CCCCCCCOc1ccncc1 34a_100000212176_100000210614 [0,1,0,1,0,0|2,0,0]=4 1887 B14R1.123 CCCCCCCSc1ccccc1 62a_100000210614_100000041952 [0,1,0,1,0,0|1,0,0]=3 1888 B14R1.123 CCCCCCCSc1ccccc1 62a_100000719477_100000210316 [0,1,0,1,0,0|1,0,0]=3 1889 B14R1.123 CCCCCCCSc1ccccn1 62a_100000210614_100011216584 [0,1,0,1,0,0|1,0,0]=3 1890 B14R1.123 CCCCCCCSc1ccccn1 62a_100011216584_100000210316 [0,1,0,1,0,0|1,0,0]=3 1891 B14R1.123 CCCCCCCSc1cccnc1 62a_100000210063_100000210316 [0,1,0,1,0,0|2,0,0]=4 1892 B14R1.123 CCCCCCCSc1cccnc1 62a_100000210614_100000210063 [0,1,0,1,0,0|2,0,0]=4 1893 B14R1.123 CCCCCCCSc1cccnn1 62a_100000210614_100016991348 [0,1,0,1,0,0|2,0,0]=4 1894 B14R1.123 CCCCCCCSc1cccnn1 62a_100016991348_100000210316 [0,1,0,1,0,0|2,0,0]=4 1895 B14R1.123 CCCCCCCSc1ccncc1 62a_100000210614_100000728582 [0,1,0,1,0,0|2,0,0]=4 1896 B14R1.123 CCCCCCCSc1ccncc1 62a_100000728582_100000210316 [0,1,0,1,0,0|2,0,0]=4 1897 B14R1.123 CCCCCCCSc1ccncn1 62a_100000210614_100000703185 [0,1,0,1,0,0|2,0,0]=4 1898 B14R1.123 CCCCCCCSc1ccncn1 62a_100000703185_100000210316 [0,1,0,1,0,0|2,0,0]=4 1899 B14R1.123 CCCCCCCSc1cnccn1 62a_100000210614_100000211759 [0,1,0,1,0,0|2,0,0]=4 1900 B14R1.123 CCCCCCCSc1cnccn1 62a_100000211759_100000210316 [0,1,0,1,0,0|2,0,0]=4 1901 B14R1.123 CCCCCCCSc1ncccn1 62a_100000210614_100000211032 [0,1,0,1,0,0|2,0,0]=4 1902 B14R1.123 CCCCCCCSc1ncccn1 62a_100000211032_100000210316 [0,1,0,1,0,0|2,0,0]=4 1903 B14R1.123 CCCCCCNCc1ccccc1 207a_100000210581_100015611070 [0,1,0,1,0,0|1,0,0]=3 1904 B14R1.123 CCCCCCNCc1ccccc1 2230a_100000210581_100015291786 [0,1,0,1,0,0|1,0,0]=3 1905 B14R1.123 CCCCCCNCc1ccccc1 2230a_100015324214_100000210314 [0,1,0,1,0,0|1,0,0]=3 1906 B14R1.123 CCCCCCNCc1ccccc1 270004a_100000210581_100015611070 [0,1,0,1,0,0|1,0,0]=3 1907 B14R1.123 CCCCCCNCc1ccccc1 34a_100015324214_100000210314 [0,1,0,1,0,0|1,0,0]=3 1908 B14R1.123 CCCCCCNCc1ccccn1 207a_100000210581_100000209966 [0,1,0,1,0,0|1,0,0]=3 1909 B14R1.123 CCCCCCNCc1ccccn1 2230a_100000210581_100000721315 [0,1,0,1,0,0|1,0,0]=3 1910 B14R1.123 CCCCCCNCc1ccccn1 270004a_100000210581_100000209966 [0,1,0,1,0,0|1,0,0]=3 1911 B14R1.123 CCCCCCNCc1cccnc1 207a_100000210581_100000209961 [0,1,0,1,0,0|2,0,0]=4 1912 B14R1.123 CCCCCCNCc1cccnc1 2230a_100000210581_100000741622 [0,1,0,1,0,0|2,0,0]=4 1913 B14R1.123 CCCCCCNCc1cccnc1 270004a_100000210581_100000209961 [0,1,0,1,0,0|2,0,0]=4 1914 B14R1.123 CCCCCCNCc1cccnn1 2230a_100000210581_100016990269 [0,1,0,1,0,0|2,0,0]=4 1915 B14R1.123 CCCCCCNCc1cccnn1 2230a_100159270163_100000210314 [0,1,0,1,0,0|2,0,0]=4 1916 B14R1.123 CCCCCCNCc1ccncc1 207a_100000210581_100000186114 [0,1,0,1,0,0|2,0,0]=4 1917 B14R1.123 CCCCCCNCc1ccncc1 2230a_100000210581_100015193705 [0,1,0,1,0,0|2,0,0]=4 1918 B14R1.123 CCCCCCNCc1cnccn1 2230a_100000210581_100016995436 [0,1,0,1,0,0|2,0,0]=4 1919 B14R1.123 CCCCCCNCc1cnccn1 270004a_100000210581_100000749867 [0,1,0,1,0,0|2,0,0]=4 1920 B14R1.123 CCCCCCNCc1ncccn1 2230a_100000210581_100000703007 [0,1,0,1,0,0|2,0,0]=4 1921 B14R1.123 CCCCCCNCc1ncccn1 270004a_100000210581_100011532527 [0,1,0,1,0,0|2,0,0]=4 1922 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210259_100015291786 [0,1,0,1,0,0|1,0,0]=3 1923 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210790_100000210314 [0,1,0,1,0,0|1,0,0]=3 1924 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210259_100000211182 [0,1,0,1,0,0|1,0,0]=3 1925 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210790_100000210314 [0,1,0,1,0,0|1,0,0]=3 1926 B14R1.123 CCCCCCOCc1ccccn1 34a_100000210259_100000721315 [0,1,0,1,0,0|1,0,0]=3 1927 B14R1.123 CCCCCCOCc1ccccn1 7a_100000210259_100000721315 [0,1,0,1,0,0|1,0,0]=3 1928 B14R1.123 CCCCCCOCc1cccnc1 34a_100000210259_100000733263 [0,1,0,1,0,0|2,0,0]=4 1929 B14R1.123 CCCCCCOCc1cccnc1 7a_100000210259_100000741622 [0,1,0,1,0,0|2,0,0]=4 1930 B14R1.123 CCCCCCOCc1cccnn1 34a_100000210259_100016990269 [0,1,0,1,0,0|2,0,0]=4 1931 B14R1.123 CCCCCCOCc1cccnn1 7a_100000210259_100016990269 [0,1,0,1,0,0|2,0,0]=4 1932 B14R1.123 CCCCCCOCc1ccncc1 7a_100000210259_100015193705 [0,1,0,1,0,0|2,0,0]=4 1933 B14R1.123 CCCCCCOCc1cnccn1 34a_100000210259_100016995436 [0,1,0,1,0,0|2,0,0]=4 1934 B14R1.123 CCCCCCOCc1cnccn1 7a_100000210259_100016995436 [0,1,0,1,0,0|2,0,0]=4 1935 B14R1.123 CCCCCCOCc1ncccn1 34a_100000210259_100000703007 [0,1,0,1,0,0|2,0,0]=4 1936 B14R1.123 CCCCCCOCc1ncccn1 7a_100000210259_100000703007 [0,1,0,1,0,0|2,0,0]=4 1937 B14R1.123 CCCCCCSCc1ccccc1 62a_100000210314_100015291786 [0,1,0,1,0,0|1,0,0]=3 1938 B14R1.123 CCCCCCSCc1ccccc1 62a_100000211182_100000210757 [0,1,0,1,0,0|1,0,0]=3 1939 B14R1.123 CCCCCCSCc1ccccn1 62a_100000210314_100000721315 [0,1,0,1,0,0|1,0,0]=3 1940 B14R1.123 CCCCCCSCc1ccccn1 62a_100000721315_100000210757 [0,1,0,1,0,0|1,0,0]=3 1941 B14R1.123 CCCCCCSCc1cccnc1 62a_100000210314_100000741622 [0,1,0,1,0,0|2,0,0]=4 1942 B14R1.123 CCCCCCSCc1cccnc1 62a_100000741622_100000210757 [0,1,0,1,0,0|2,0,0]=4 1943 B14R1.123 CCCCCCSCc1cccnn1 62a_100000210314_100016990269 [0,1,0,1,0,0|2,0,0]=4 1944 B14R1.123 CCCCCCSCc1cccnn1 62a_100016990269_100000210757 [0,1,0,1,0,0|2,0,0]=4 1945 B14R1.123 CCCCCCSCc1ccncc1 62a_100000210314_100015193705 [0,1,0,1,0,0|2,0,0]=4 1946 B14R1.123 CCCCCCSCc1ccncc1 62a_100015193705_100000210757 [0,1,0,1,0,0|2,0,0]=4 1947 B14R1.123 CCCCCCSCc1cnccn1 62a_100000210314_100016995436 [0,1,0,1,0,0|2,0,0]=4 1948 B14R1.123 CCCCCCSCc1cnccn1 62a_100016995436_100000210757 [0,1,0,1,0,0|2,0,0]=4 1949 B14R1.123 CCCCCCSCc1ncccn1 62a_100000210314_100000703007 [0,1,0,1,0,0|2,0,0]=4 1950 B14R1.123 CCCCCCSCc1ncccn1 62a_100000703007_100000210757 [0,1,0,1,0,0|2,0,0]=4 1951 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000106460_100000210326 [0,1,0,1,0,0|1,0,0]=3 1952 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000209983_100000765856 [0,1,0,1,0,0|1,0,0]=3 1953 B14R1.123 CCCCCNCCc1ccccc1 34a_100000106460_100000718602 [0,1,0,1,0,0|1,0,0]=3 1954 B14R1.123 CCCCCNCCc1ccccn1 2230a_100000209983_100015183660 [0,1,0,1,0,0|1,0,0]=3 1955 B14R1.123 CCCCCNCCc1cccnc1 2230a_100000209983_200011713674 [0,1,0,1,0,0|2,0,0]=4 1956 B14R1.123 CCCCCNCCc1cccnc1 2230a_100000736294_100000210326 [0,1,0,1,0,0|2,0,0]=4 1957 B14R1.123 CCCCCNCCc1ccncc1 2230a_100000209983_100000723409 [0,1,0,1,0,0|2,0,0]=4 1958 B14R1.123 CCCCCNCSc1ccccc1 2230a_100000209983_100011218342 [0,1,0,1,0,0|2,0,0]=4 1959 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210253_100000765856 [0,1,0,1,0,0|1,0,0]=3 1960 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210268_100000718602 [0,1,0,1,0,0|1,0,0]=3 1961 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210253_100000765856 [0,1,0,1,0,0|1,0,0]=3 1962 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210268_100000210326 [0,1,0,1,0,0|1,0,0]=3 1963 B14R1.123 CCCCCOCCc1ccccn1 34a_100000210271_100000718602 [0,1,0,1,0,0|1,0,0]=3 1964 B14R1.123 CCCCCOCCc1ccccn1 7a_100000210253_100015183660 [0,1,0,1,0,0|1,0,0]=3 1965 B14R1.123 CCCCCOCCc1cccnc1 34a_100011217484_100000718602 [0,1,0,1,0,0|2,0,0]=4 1966 B14R1.123 CCCCCOCCc1cccnc1 7a_100000210253_200011713674 [0,1,0,1,0,0|2,0,0]=4 1967 B14R1.123 CCCCCOCCc1ccncc1 34a_100011216225_100000718602 [0,1,0,1,0,0|2,0,0]=4 1968 B14R1.123 CCCCCOCCc1ccncc1 7a_100000210253_100000723409 [0,1,0,1,0,0|2,0,0]=4 1969 B14R1.123 CCCCCOCCc1cnccn1 34a_100011349526_100000718602 [0,1,0,1,0,0|2,0,0]=4 1970 B14R1.123 CCCCCSCCc1ccccc1 62a_100000210326_100011218657 [0,1,0,1,0,0|1,0,0]=3 1971 B14R1.123 CCCCCSCCc1ccccc1 62a_100000765856_100000210326 [0,1,0,1,0,0|1,0,0]=3 1972 B14R1.123 CCCCCSCCc1ccccn1 62a_100000210326_100015183660 [0,1,0,1,0,0|1,0,0]=3 1973 B14R1.123 CCCCCSCCc1ccccn1 62a_100015183660_100000210326 [0,1,0,1,0,0|1,0,0]=3 1974 B14R1.123 CCCCCSCCc1cccnc1 62a_100000210326_200011713674 [0,1,0,1,0,0|2,0,0]=4 1975 B14R1.123 CCCCCSCCc1cccnc1 62a_200011713674_100000210326 [0,1,0,1,0,0|2,0,0]=4 1976 B14R1.123 CCCCCSCCc1ccncc1 62a_100000210326_100000723409 [0,1,0,1,0,0|2,0,0]=4 1977 B14R1.123 CCCCCSCCc1ccncc1 62a_100000723409_100000210326 [0,1,0,1,0,0|2,0,0]=4 1978 B14R1.123 CCCCCSCSc1ccccc1 62a_100000210326_100011218342 [0,1,0,1,0,0|2,0,0]=4 1979 B14R1.123 CCCCCSCSc1ccccc1 62a_100011218342_100000210326 [0,1,0,1,0,0|2,0,0]=4 1980 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000102301_100000211621 [0,1,0,1,0,0|1,0,0]=3 1981 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000211184_100000210211 [0,1,0,1,0,0|1,0,0]=3 1982 B14R1.123 CCCCNCCCc1ccccc1 34a_100000211184_100000210210 [0,1,0,1,0,0|1,0,0]=3 1983 B14R1.123 CCCCNCCCc1ccccc1 7a_106832991798_100000211621 [0,1,0,1,0,0|1,0,0]=3 1984 B14R1.123 CCCCNCCCc1cccnc1 2230a_100011532358_100000210211 [0,1,0,1,0,0|2,0,0]=4 1985 B14R1.123 CCCCNCCCc1cccnc1 34a_100011532358_100000210210 [0,1,0,1,0,0|2,0,0]=4 1986 B14R1.123 CCCCNCCCc1ccncc1 2230a_100011275580_100000210211 [0,1,0,1,0,0|2,0,0]=4 1987 B14R1.123 CCCCNCCOc1ccccc1 2230a_100000102301_100000184471 [0,1,0,1,0,0|2,0,0]=4 1988 B14R1.123 CCCCNCCOc1ccccc1 2230a_100000174943_100000210211 [0,1,0,1,0,0|2,0,0]=4 1989 B14R1.123 CCCCNCCOc1ccccc1 270004a_100000102301_100000758736 [0,1,0,1,0,0|2,0,0]=4 1990 B14R1.123 CCCCNCCOc1ccccc1 34a_100000174943_100000210210 [0,1,0,1,0,0|2,0,0]=4 1991 B14R1.123 CCCCNCCOc1ccccc1 7a_106832991798_100000184471 [0,1,0,1,0,0|2,0,0]=4 1992 B14R1.123 CCCCNCCOc1ccccn1 2230a_106741647558_100000210211 [0,1,0,1,0,0|2,0,0]=4 1993 B14R1.123 CCCCNCCSc1ccccc1 2230a_100000102301_100000246102 [0,1,0,1,0,0|2,0,0]=4 1994 B14R1.123 CCCCNCCSc1ccccc1 2230a_100000189519_100000210211 [0,1,0,1,0,0|2,0,0]=4 1995 B14R1.123 CCCCNCCSc1ccccc1 7a_106832991798_100000246102 [0,1,0,1,0,0|2,0,0]=4 1996 B14R1.123 CCCCNCOCc1ccccc1 2230a_100000102301_100000763385 [0,1,0,1,0,0|2,0,0]=4 1997 B14R1.123 CCCCNCSCc1ccccc1 2230a_100000102301_200011217039 [0,1,0,1,0,0|2,0,0]=4 1998 B14R1.123 CCCCOCCCC1=CCC=CC1 34a_100020667889_100000210210 [0,1,0,1,0,0|1,0,1]=4 1999 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210227_100000211621 [0,1,0,1,0,0|1,0,0]=3 2000 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210828_100000210210 [0,1,0,1,0,0|1,0,0]=3 2001 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210227_100000211621 [0,1,0,1,0,0|1,0,0]=3 2002 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210828_100000210211 [0,1,0,1,0,0|1,0,0]=3 2003 B14R1.123 CCCCOCCCc1ccccn1 34a_100011215068_100000210210 [0,1,0,1,0,0|1,0,0]=3 2004 B14R1.123 CCCCOCCCc1cccnc1 34a_100000211284_100000210210 [0,1,0,1,0,0|2,0,0]=4 2005 B14R1.123 CCCCOCCCc1ccncc1 34a_100000210659_100000210210 [0,1,0,1,0,0|2,0,0]=4 2006 B14R1.123 CCCCOCCNc1ccccc1 34a_100000106764_100000743108 [0,1,0,1,0,0|2,0,0]=4 2007 B14R1.123 CCCCOCCNc1ccccc1 34a_100000211345_100000210210 [0,1,0,1,0,0|2,0,0]=4 2008 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210227_100000184471 [0,1,0,1,0,0|2,0,0]=4 2009 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210260_100000210210 [0,1,0,1,0,0|2,0,0]=4 2010 B14R1.123 CCCCOCCOc1ccccc1 34a_100000210340_100000743108 [0,1,0,1,0,0|2,0,0]=4 2011 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210227_100000184471 [0,1,0,1,0,0|2,0,0]=4 2012 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210260_100000210211 [0,1,0,1,0,0|2,0,0]=4 2013 B14R1.123 CCCCOCCOc1ccccc1 7a_100000210340_100000743108 [0,1,0,1,0,0|2,0,0]=4 2014 B14R1.123 CCCCOCCSc1ccccc1 34a_100000210227_100000246102 [0,1,0,1,0,0|2,0,0]=4 2015 B14R1.123 CCCCOCCSc1ccccc1 62a_100000719477_100000743108 [0,1,0,1,0,0|2,0,0]=4 2016 B14R1.123 CCCCOCCSc1ccccc1 62a_100000743108_100000041952 [0,1,0,1,0,0|2,0,0]=4 2017 B14R1.123 CCCCOCCSc1ccccc1 7a_100000210227_100000246102 [0,1,0,1,0,0|2,0,0]=4 2018 B14R1.123 CCCCOCCSc1ccccc1 7a_100000230494_100000210211 [0,1,0,1,0,0|2,0,0]=4 2019 B14R1.123 CCCCOCCSc1ccccn1 62a_100000743108_100011216584 [0,1,0,1,0,0|2,0,0]=4 2020 B14R1.123 CCCCOCCSc1ccccn1 62a_100011216584_100000743108 [0,1,0,1,0,0|2,0,0]=4 2021 B14R1.123 CCCCOCCSc1ccccn1 7a_100000156319_100000210211 [0,1,0,1,0,0|2,0,0]=4 2022 B14R1.123 CCCCOCNCc1ccccc1 2230a_100015324214_100011995733 [0,1,0,1,0,0|2,0,0]=4 2023 B14R1.123 CCCCOCNCc1ccccc1 34a_100015324214_100011995733 [0,1,0,1,0,0|2,0,0]=4 2024 B14R1.123 CCCCOCOCc1ccccc1 34a_100000210227_100000763385 [0,1,0,1,0,0|2,0,0]=4 2025 B14R1.123 CCCCOCOCc1ccccc1 34a_100000210790_100011995733 [0,1,0,1,0,0|2,0,0]=4 2026 B14R1.123 CCCCOCSCc1ccccc1 34a_100000210227_200011217039 [0,1,0,1,0,0|2,0,0]=4 2027 B14R1.123 CCCCOCSCc1ccccc1 62a_100000211182_100011995733 [0,1,0,1,0,0|2,0,0]=4 2028 B14R1.123 CCCCOCSCc1ccccc1 62a_100011995733_100015291786 [0,1,0,1,0,0|2,0,0]=4 2029 B14R1.123 CCCCOCSCc1ccccn1 62a_100000721315_100011995733 [0,1,0,1,0,0|2,0,0]=4 2030 B14R1.123 CCCCOCSCc1ccccn1 62a_100011995733_100000721315 [0,1,0,1,0,0|2,0,0]=4 2031 B14R1.123 CCCCSCCCc1ccccc1 62a_100000210211_100000211621 [0,1,0,1,0,0|1,0,0]=3 2032 B14R1.123 CCCCSCCCc1ccccc1 62a_100000211621_100000210210 [0,1,0,1,0,0|1,0,0]=3 2033 B14R1.123 CCCCSCCOc1ccccc1 62a_100000184471_100000210210 [0,1,0,1,0,0|2,0,0]=4 2034 B14R1.123 CCCCSCCOc1ccccc1 62a_100000210211_100000184471 [0,1,0,1,0,0|2,0,0]=4 2035 B14R1.123 CCCCSCCSc1ccccc1 62a_100000210211_100000246102 [0,1,0,1,0,0|2,0,0]=4 2036 B14R1.123 CCCCSCCSc1ccccc1 62a_100000246102_100000210210 [0,1,0,1,0,0|2,0,0]=4 2037 B14R1.123 CCCCSCOCc1ccccc1 62a_100000210211_100000763385 [0,1,0,1,0,0|2,0,0]=4 2038 B14R1.123 CCCCSCOCc1ccccc1 62a_100000763385_100000210210 [0,1,0,1,0,0|2,0,0]=4 2039 B14R1.123 CCCCSCSCc1ccccc1 62a_100000210211_200011217039 [0,1,0,1,0,0|2,0,0]=4 2040 B14R1.123 CCCCSCSCc1ccccc1 62a_200011217039_100000210210 [0,1,0,1,0,0|2,0,0]=4 2041 B14R1.123 CCCNCCCCc1ccccc1 2230a_100015280158_100000210303 [0,1,0,1,0,0|1,0,0]=3 2042 B14R1.123 CCCNCCCCc1ccccc1 34a_100015280158_100000210303 [0,1,0,1,0,0|1,0,0]=3 2043 B14R1.123 CCCNCCCOc1ccccc1 2230a_100000216521_100000210303 [0,1,0,1,0,0|2,0,0]=4 2044 B14R1.123 CCCNCCCOc1ccccc1 34a_100000216521_100000210303 [0,1,0,1,0,0|2,0,0]=4 2045 B14R1.123 CCCNCCCSc1ccccc1 2230a_100000184639_100000210303 [0,1,0,1,0,0|2,0,0]=4 2046 B14R1.123 CCCNCCOCc1ccccc1 2230a_100000753106_100000210303 [0,1,0,1,0,0|2,0,0]=4 2047 B14R1.123 CCCNCCOCc1ccccc1 34a_100000753106_100000210303 [0,1,0,1,0,0|2,0,0]=4 2048 B14R1.123 CCCNCCSCc1ccccc1 2230a_100000189534_100000210303 [0,1,0,1,0,0|2,0,0]=4 2049 B14R1.123 CCCNCCSCc1ccccc1 34a_100000189534_100000210303 [0,1,0,1,0,0|2,0,0]=4 2050 B14R1.123 CCCNCCSCc1ccccc1 7a_100000189534_100000210303 [0,1,0,1,0,0|2,0,0]=4 2051 B14R1.123 CCCOCCCCc1ccccc1 34a_100000210258_100000701786 [0,1,0,1,0,0|1,0,0]=3 2052 B14R1.123 CCCOCCCCc1ccccc1 34a_100000703073_100000210303 [0,1,0,1,0,0|1,0,0]=3 2053 B14R1.123 CCCOCCCCc1ccccc1 7a_100000703073_100000210303 [0,1,0,1,0,0|1,0,0]=3 2054 B14R1.123 CCCOCCCCc1ccccn1 34a_100012186994_100000210303 [0,1,0,1,0,0|1,0,0]=3 2055 B14R1.123 CCCOCCCCc1cccnc1 34a_100012039607_100000210303 [0,1,0,1,0,0|2,0,0]=4 2056 B14R1.123 CCCOCCCCc1cccnc1 7a_100012039607_100000210303 [0,1,0,1,0,0|2,0,0]=4 2057 B14R1.123 CCCOCCCCc1ccncc1 34a_100011787716_100000210303 [0,1,0,1,0,0|2,0,0]=4 2058 B14R1.123 CCCOCCCNc1ccccc1 34a_100000212590_100000210303 [0,1,0,1,0,0|2,0,0]=4 2059 B14R1.123 CCCOCCCOc1ccccc1 34a_100000210258_100000199009 [0,1,0,1,0,0|2,0,0]=4 2060 B14R1.123 CCCOCCCOc1ccccc1 34a_100011215863_100000210303 [0,1,0,1,0,0|2,0,0]=4 2061 B14R1.123 CCCOCCCOc1ccccc1 7a_100011215863_100000210303 [0,1,0,1,0,0|2,0,0]=4 2062 B14R1.123 CCCOCCCSc1ccccc1 34a_100000210258_200011203293 [0,1,0,1,0,0|2,0,0]=4 2063 B14R1.123 CCCOCCNCc1ccccc1 207a_100161115042_100015611070 [0,1,0,1,0,0|2,0,0]=4 2064 B14R1.123 CCCOCCNCc1ccccc1 2230a_100015324214_100011215938 [0,1,0,1,0,0|2,0,0]=4 2065 B14R1.123 CCCOCCNCc1ccccc1 2230a_100161115042_100015291786 [0,1,0,1,0,0|2,0,0]=4 2066 B14R1.123 CCCOCCNCc1ccccc1 270004a_100161115042_100015611070 [0,1,0,1,0,0|2,0,0]=4 2067 B14R1.123 CCCOCCNCc1ccccc1 34a_100000180844_100000210303 [0,1,0,1,0,0|2,0,0]=4 2068 B14R1.123 CCCOCCNCc1ccccc1 34a_100015324214_100011215938 [0,1,0,1,0,0|2,0,0]=4 2069 B14R1.123 CCCOCCNCc1ccccc1 34a_100161115042_100015291786 [0,1,0,1,0,0|2,0,0]=4 2070 B14R1.123 CCCOCCNCc1ccccn1 207a_100161115042_100000209966 [0,1,0,1,0,0|2,0,0]=4 2071 B14R1.123 CCCOCCNCc1ccccn1 2230a_100161115042_100000721315 [0,1,0,1,0,0|2,0,0]=4 2072 B14R1.123 CCCOCCNCc1ccccn1 270004a_100161115042_100000209966 [0,1,0,1,0,0|2,0,0]=4 2073 B14R1.123 CCCOCCNCc1ccccn1 34a_100161115042_100000721315 [0,1,0,1,0,0|2,0,0]=4 2074 B14R1.123 CCCOCCOCc1ccccc1 34a_100000210258_100000234347 [0,1,0,1,0,0|2,0,0]=4 2075 B14R1.123 CCCOCCOCc1ccccc1 34a_100000210790_100011215938 [0,1,0,1,0,0|2,0,0]=4 2076 B14R1.123 CCCOCCOCc1ccccc1 34a_100000752267_100015291786 [0,1,0,1,0,0|2,0,0]=4 2077 B14R1.123 CCCOCCOCc1ccccc1 34a_100000759325_100000210303 [0,1,0,1,0,0|2,0,0]=4 2078 B14R1.123 CCCOCCOCc1ccccc1 7a_100000210790_100011215938 [0,1,0,1,0,0|2,0,0]=4 2079 B14R1.123 CCCOCCOCc1ccccc1 7a_100000752267_100000211182 [0,1,0,1,0,0|2,0,0]=4 2080 B14R1.123 CCCOCCOCc1ccccc1 7a_100000759325_100000210303 [0,1,0,1,0,0|2,0,0]=4 2081 B14R1.123 CCCOCCOCc1ccccn1 34a_100000752267_100000721315 [0,1,0,1,0,0|2,0,0]=4 2082 B14R1.123 CCCOCCOCc1ccccn1 7a_100000752267_100000721315 [0,1,0,1,0,0|2,0,0]=4 2083 B14R1.123 CCCOCCSCc1ccccc1 34a_100000210258_200011297719 [0,1,0,1,0,0|2,0,0]=4 2084 B14R1.123 CCCOCCSCc1ccccc1 34a_100011205989_100000210303 [0,1,0,1,0,0|2,0,0]=4 2085 B14R1.123 CCCOCCSCc1ccccc1 62a_100000211182_100011215938 [0,1,0,1,0,0|2,0,0]=4 2086 B14R1.123 CCCOCCSCc1ccccc1 62a_100011215938_100015291786 [0,1,0,1,0,0|2,0,0]=4 2087 B14R1.123 CCCOCCSCc1ccccc1 7a_100011205989_100000210303 [0,1,0,1,0,0|2,0,0]=4 2088 B14R1.123 CCCOCCSCc1ccccn1 62a_100000721315_100011215938 [0,1,0,1,0,0|2,0,0]=4 2089 B14R1.123 CCCOCCSCc1ccccn1 62a_100011215938_100000721315 [0,1,0,1,0,0|2,0,0]=4 2090 B14R1.123 CCCSCCCCc1ccccc1 62a_100000210303_100000701786 [0,1,0,1,0,0|1,0,0]=3 2091 B14R1.123 CCCSCCCCc1ccccc1 62a_100000701786_100000210303 [0,1,0,1,0,0|1,0,0]=3 2092 B14R1.123 CCCSCCCCc1ccncc1 62a_100000210303_100020630000 [0,1,0,1,0,0|2,0,0]=4 2093 B14R1.123 CCCSCCCCc1ccncc1 62a_100020630000_100000210303 [0,1,0,1,0,0|2,0,0]=4 2094 B14R1.123 CCCSCCCOc1ccccc1 62a_100000199009_100000210303 [0,1,0,1,0,0|2,0,0]=4 2095 B14R1.123 CCCSCCCOc1ccccc1 62a_100000210303_100000199009 [0,1,0,1,0,0|2,0,0]=4 2096 B14R1.123 CCCSCCCSc1ccccc1 62a_100000210303_200011203293 [0,1,0,1,0,0|2,0,0]=4 2097 B14R1.123 CCCSCCCSc1ccccc1 62a_200011203293_100000210303 [0,1,0,1,0,0|2,0,0]=4 2098 B14R1.123 CCCSCCNCc1ccccc1 207a_100020603323_100015611070 [0,1,0,1,0,0|2,0,0]=4 2099 B14R1.123 CCCSCCNCc1ccccc1 2230a_100020603323_100015291786 [0,1,0,1,0,0|2,0,0]=4 2100 B14R1.123 CCCSCCNCc1ccccc1 270004a_100020603323_100015611070 [0,1,0,1,0,0|2,0,0]=4 2101 B14R1.123 CCCSCCNCc1ccccn1 207a_100020603323_100000209966 [0,1,0,1,0,0|2,0,0]=4 2102 B14R1.123 CCCSCCNCc1ccccn1 2230a_100020603323_100000721315 [0,1,0,1,0,0|2,0,0]=4 2103 B14R1.123 CCCSCCNCc1ccccn1 270004a_100020603323_100000209966 [0,1,0,1,0,0|2,0,0]=4 2104 B14R1.123 CCCSCCOCc1ccccc1 34a_200000230433_100015291786 [0,1,0,1,0,0|2,0,0]=4 2105 B14R1.123 CCCSCCOCc1ccccc1 62a_100000210303_100000234347 [0,1,0,1,0,0|2,0,0]=4 2106 B14R1.123 CCCSCCOCc1ccccc1 62a_100000234347_100000210303 [0,1,0,1,0,0|2,0,0]=4 2107 B14R1.123 CCCSCCOCc1ccccc1 7a_200000230433_100000211182 [0,1,0,1,0,0|2,0,0]=4 2108 B14R1.123 CCCSCCOCc1ccccn1 34a_200000230433_100000721315 [0,1,0,1,0,0|2,0,0]=4 2109 B14R1.123 CCCSCCOCc1ccccn1 7a_200000230433_100000721315 [0,1,0,1,0,0|2,0,0]=4 2110 B14R1.123 CCCSCCSCc1ccccc1 62a_100000210303_200011297719 [0,1,0,1,0,0|2,0,0]=4 2111 B14R1.123 CCCSCCSCc1ccccc1 62a_200011297719_100000210303 [0,1,0,1,0,0|2,0,0]=4 2112 B14R1.123 CCNCCCCCc1ccccc1 2230a_100000750932_100000210202 [0,1,0,1,0,0|1,0,0]=3 2113 B14R1.123 CCNCCCCCc1ccccc1 2230a_100015525214_200011217138 [0,1,0,1,0,0|1,0,0]=3 2114 B14R1.123 CCNCCCCCc1ccccc1 34a_100000750932_100000210202 [0,1,0,1,0,0|1,0,0]=3 2115 B14R1.123 CCNCCCCOc1ccccc1 2230a_100015525214_100011215240 [0,1,0,1,0,0|2,0,0]=4 2116 B14R1.123 CCNCCCOCc1ccccc1 2230a_100015525214_100011215529 [0,1,0,1,0,0|2,0,0]=4 2117 B14R1.123 CCNCCCOCc1ccccc1 2230a_200000206031_100000210202 [0,1,0,1,0,0|2,0,0]=4 2118 B14R1.123 CCNCCCOCc1ccccc1 34a_200000206031_100000210202 [0,1,0,1,0,0|2,0,0]=4 2119 B14R1.123 CCOCCCCCc1ccccc1 34a_100121572206_200011217138 [0,1,0,1,0,0|1,0,0]=3 2120 B14R1.123 CCOCCCCCc1ccccc1 34a_200011219639_100000210202 [0,1,0,1,0,0|1,0,0]=3 2121 B14R1.123 CCOCCCCCc1ccccc1 7a_200011219639_100000210202 [0,1,0,1,0,0|1,0,0]=3 2122 B14R1.123 CCOCCCCOc1ccccc1 34a_100000752354_100000210202 [0,1,0,1,0,0|2,0,0]=4 2123 B14R1.123 CCOCCCCOc1ccccc1 34a_100121572206_100011215240 [0,1,0,1,0,0|2,0,0]=4 2124 B14R1.123 CCOCCCCOc1ccccc1 7a_100000752354_100000210202 [0,1,0,1,0,0|2,0,0]=4 2125 B14R1.123 CCOCCCNCc1ccccc1 207a_100000210961_100015611070 [0,1,0,1,0,0|2,0,0]=4 2126 B14R1.123 CCOCCCNCc1ccccc1 2230a_100000210961_100015291786 [0,1,0,1,0,0|2,0,0]=4 2127 B14R1.123 CCOCCCNCc1ccccc1 2230a_100015324214_100012232248 [0,1,0,1,0,0|2,0,0]=4 2128 B14R1.123 CCOCCCNCc1ccccc1 270004a_100000210961_100015611070 [0,1,0,1,0,0|2,0,0]=4 2129 B14R1.123 CCOCCCNCc1ccccc1 34a_100000185501_100000210202 [0,1,0,1,0,0|2,0,0]=4 2130 B14R1.123 CCOCCCNCc1ccccc1 34a_100000210961_100015291786 [0,1,0,1,0,0|2,0,0]=4 2131 B14R1.123 CCOCCCNCc1ccccc1 34a_100015324214_100012232248 [0,1,0,1,0,0|2,0,0]=4 2132 B14R1.123 CCOCCCNCc1ccccn1 207a_100000210961_100000209966 [0,1,0,1,0,0|2,0,0]=4 2133 B14R1.123 CCOCCCNCc1ccccn1 2230a_100000210961_100000721315 [0,1,0,1,0,0|2,0,0]=4 2134 B14R1.123 CCOCCCNCc1ccccn1 270004a_100000210961_100000209966 [0,1,0,1,0,0|2,0,0]=4 2135 B14R1.123 CCOCCCNCc1ccccn1 34a_100000210961_100000721315 [0,1,0,1,0,0|2,0,0]=4 2136 B14R1.123 CCOCCCOCc1ccccc1 34a_100000210790_100012232248 [0,1,0,1,0,0|2,0,0]=4 2137 B14R1.123 CCOCCCOCc1ccccc1 34a_100000691849_100000210202 [0,1,0,1,0,0|2,0,0]=4 2138 B14R1.123 CCOCCCOCc1ccccc1 34a_100000757476_100015291786 [0,1,0,1,0,0|2,0,0]=4 2139 B14R1.123 CCOCCCOCc1ccccc1 34a_100121572206_100011215529 [0,1,0,1,0,0|2,0,0]=4 2140 B14R1.123 CCOCCCOCc1ccccc1 7a_100000210790_100012232248 [0,1,0,1,0,0|2,0,0]=4 2141 B14R1.123 CCOCCCOCc1ccccc1 7a_100000691849_100000210202 [0,1,0,1,0,0|2,0,0]=4 2142 B14R1.123 CCOCCCOCc1ccccc1 7a_100000757476_100000211182 [0,1,0,1,0,0|2,0,0]=4 2143 B14R1.123 CCOCCCOCc1ccccn1 34a_100000757476_100000721315 [0,1,0,1,0,0|2,0,0]=4 2144 B14R1.123 CCOCCCOCc1ccccn1 7a_100000757476_100000721315 [0,1,0,1,0,0|2,0,0]=4 2145 B14R1.123 CCOCCCSCc1ccccc1 62a_100000211182_100012232248 [0,1,0,1,0,0|2,0,0]=4 2146 B14R1.123 CCOCCCSCc1ccccc1 62a_100012232248_100015291786 [0,1,0,1,0,0|2,0,0]=4 2147 B14R1.123 CCOCCCSCc1ccccn1 62a_100000721315_100012232248 [0,1,0,1,0,0|2,0,0]=4 2148 B14R1.123 CCOCCCSCc1ccccn1 62a_100012232248_100000721315 [0,1,0,1,0,0|2,0,0]=4 2149 B14R1.123 CCOCCNCCc1ccccc1 2230a_100000106460_100011215890 [0,1,0,1,0,0|2,0,0]=4 2150 B14R1.123 CCOCCNCCc1ccccc1 2230a_102516460346_100000765856 [0,1,0,1,0,0|2,0,0]=4 2151 B14R1.123 CCOCCNCCc1ccccc1 34a_100000106460_100000210147 [0,1,0,1,0,0|2,0,0]=4 2152 B14R1.123 CCOCCNCCc1ccccc1 34a_102516460346_100000765856 [0,1,0,1,0,0|2,0,0]=4 2153 B14R1.123 CCOCCNCCc1ccccn1 2230a_102516460346_100015183660 [0,1,0,1,0,0|2,0,0]=4 2154 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210136_100000765856 [0,1,0,1,0,0|2,0,0]=4 2155 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210268_100000210147 [0,1,0,1,0,0|2,0,0]=4 2156 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210136_100000765856 [0,1,0,1,0,0|2,0,0]=4 2157 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210268_100011215890 [0,1,0,1,0,0|2,0,0]=4 2158 B14R1.123 CCOCCOCCc1ccccn1 34a_100000210271_100000210147 [0,1,0,1,0,0|2,0,0]=4 2159 B14R1.123 CCOCCOCCc1ccccn1 7a_100000210136_100015183660 [0,1,0,1,0,0|2,0,0]=4 2160 B14R1.123 CCOCCSCCc1ccccc1 62a_100000210147_100011218657 [0,1,0,1,0,0|2,0,0]=4 2161 B14R1.123 CCOCCSCCc1ccccc1 62a_100000765856_100011215890 [0,1,0,1,0,0|2,0,0]=4 2162 B14R1.123 CCOCCSCCc1ccccn1 34a_100011362645_100000210202 [0,1,0,1,0,0|2,0,0]=4 2163 B14R1.123 CCOCCSCCc1ccccn1 62a_100000210147_100015183660 [0,1,0,1,0,0|2,0,0]=4 2164 B14R1.123 CCOCCSCCc1ccccn1 62a_100015183660_100011215890 [0,1,0,1,0,0|2,0,0]=4 2165 B14R1.123 CCOCCSCCc1ccccn1 7a_100011362645_100000210202 [0,1,0,1,0,0|2,0,0]=4 2166 B14R1.123 CCOCSCCCc1ccccc1 62a_100000211621_100000739092 [0,1,0,1,0,0|2,0,0]=4 2167 B14R1.123 CCOCSCCCc1ccccc1 62a_100000739092_100000211621 [0,1,0,1,0,0|2,0,0]=4 2168 B14R1.123 CCSCCCCCc1ccccc1 62a_100000210202_200011217138 [0,1,0,1,0,0|1,0,0]=3 2169 B14R1.123 CCSCCCCCc1ccccc1 62a_200011217138_100000210202 [0,1,0,1,0,0|1,0,0]=3 2170 B14R1.123 CCSCCCCOc1ccccc1 62a_100000210202_100011215240 [0,1,0,1,0,0|2,0,0]=4 2171 B14R1.123 CCSCCCCOc1ccccc1 62a_100011215240_100000210202 [0,1,0,1,0,0|2,0,0]=4 2172 B14R1.123 CCSCCCOCc1ccccc1 34a_100011216438_100015291786 [0,1,0,1,0,0|2,0,0]=4 2173 B14R1.123 CCSCCCOCc1ccccc1 62a_100000210202_100011215529 [0,1,0,1,0,0|2,0,0]=4 2174 B14R1.123 CCSCCCOCc1ccccc1 62a_100011215529_100000210202 [0,1,0,1,0,0|2,0,0]=4 2175 B14R1.123 CCSCCCOCc1ccccc1 7a_100011216438_100000211182 [0,1,0,1,0,0|2,0,0]=4 2176 B14R1.123 CCSCCCOCc1ccccn1 34a_100011216438_100000721315 [0,1,0,1,0,0|2,0,0]=4 2177 B14R1.123 CCSCCCOCc1ccccn1 7a_100011216438_100000721315 [0,1,0,1,0,0|2,0,0]=4 2178 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106460_100000757381 [0,1,0,1,0,0|2,0,0]=4 2179 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106463_100000765856 [0,1,0,1,0,0|2,0,0]=4 2180 B14R1.123 CCSCCNCCc1ccccc1 34a_100000106460_100000757381 [0,1,0,1,0,0|2,0,0]=4 2181 B14R1.123 CCSCCNCCc1ccccn1 2230a_100000106463_100015183660 [0,1,0,1,0,0|2,0,0]=4 2182 B14R1.123 CCSCCOCCc1ccccc1 34a_100000210268_100000757381 [0,1,0,1,0,0|2,0,0]=4 2183 B14R1.123 CCSCCOCCc1ccccc1 34a_100000212035_100000765856 [0,1,0,1,0,0|2,0,0]=4 2184 B14R1.123 CCSCCOCCc1ccccc1 7a_100000210268_100000757381 [0,1,0,1,0,0|2,0,0]=4 2185 B14R1.123 CCSCCOCCc1ccccc1 7a_100000212035_100000765856 [0,1,0,1,0,0|2,0,0]=4 2186 B14R1.123 CCSCCOCCc1ccccn1 34a_100000210271_100000757381 [0,1,0,1,0,0|2,0,0]=4 2187 B14R1.123 CCSCCOCCc1ccccn1 7a_100000212035_100015183660 [0,1,0,1,0,0|2,0,0]=4 2188 B14R1.123 CCSCCSCCc1ccccc1 62a_100000757381_100011218657 [0,1,0,1,0,0|2,0,0]=4 2189 B14R1.123 CCSCCSCCc1ccccc1 62a_100000765856_100000757381 [0,1,0,1,0,0|2,0,0]=4 2190 B14R1.123 CCSCCSCCc1ccccn1 62a_100000757381_100015183660 [0,1,0,1,0,0|2,0,0]=4 2191 B14R1.123 CCSCCSCCc1ccccn1 62a_100015183660_100000757381 [0,1,0,1,0,0|2,0,0]=4 2192 B14R1.123 CNCCCCCCc1ccccc1 2230a_106832991635_100011218729 [0,1,0,1,0,0|1,0,0]=3 2193 B14R1.123 CNCCCCCCc1ccccc1 34a_100102657272_100011218729 [0,1,0,1,0,0|1,0,0]=3 2194 B14R1.123 CNCCCCCCc1ccccc1 7a_106832991635_100011218729 [0,1,0,1,0,0|1,0,0]=3 2195 B14R1.123 CNCCCCCOc1ccccc1 2230a_106832991635_200011777167 [0,1,0,1,0,0|2,0,0]=4 2196 B14R1.123 CNCCCCCOc1ccccc1 34a_100102657272_200011777167 [0,1,0,1,0,0|2,0,0]=4 2197 B14R1.123 CNCCCCCOc1ccccc1 7a_106832991635_200011777167 [0,1,0,1,0,0|2,0,0]=4 2198 B14R1.123 CNCCCCOCc1ccccc1 2230a_100000748060_200000210301 [0,1,0,1,0,0|2,0,0]=4 2199 B14R1.123 CNCCCCOCc1ccccc1 2230a_106832991635_100011219843 [0,1,0,1,0,0|2,0,0]=4 2200 B14R1.123 CNCCCCOCc1ccccc1 34a_100000748060_200000210301 [0,1,0,1,0,0|2,0,0]=4 2201 B14R1.123 CNCCCCOCc1ccccc1 34a_100102657272_100011219843 [0,1,0,1,0,0|2,0,0]=4 2202 B14R1.123 CNCCCCOCc1ccccc1 7a_106832991635_100011219843 [0,1,0,1,0,0|2,0,0]=4 2203 B14R1.123 CNCCCOCCc1ccccc1 34a_100000213112_100000765856 [0,1,0,1,0,0|2,0,0]=4 2204 B14R1.123 COCCCCCCc1ccccc1 34a_100011215581_200000210301 [0,1,0,1,0,0|1,0,0]=3 2205 B14R1.123 COCCCCCCc1ccccc1 34a_100138415774_100011218729 [0,1,0,1,0,0|1,0,0]=3 2206 B14R1.123 COCCCCCCc1ccccc1 7a_100011215581_200000210301 [0,1,0,1,0,0|1,0,0]=3 2207 B14R1.123 COCCCCCOc1ccccc1 34a_100138415774_200011777167 [0,1,0,1,0,0|2,0,0]=4 2208 B14R1.123 COCCCCNCc1ccccc1 2230a_100015324214_100000730899 [0,1,0,1,0,0|2,0,0]=4 2209 B14R1.123 COCCCCNCc1ccccc1 34a_100000186360_200000210301 [0,1,0,1,0,0|2,0,0]=4 2210 B14R1.123 COCCCCNCc1ccccc1 34a_100015324214_100000755781 [0,1,0,1,0,0|2,0,0]=4 2211 B14R1.123 COCCCCOCc1ccccc1 34a_100000210790_100000755781 [0,1,0,1,0,0|2,0,0]=4 2212 B14R1.123 COCCCCOCc1ccccc1 34a_100000740925_100015291786 [0,1,0,1,0,0|2,0,0]=4 2213 B14R1.123 COCCCCOCc1ccccc1 34a_100011215074_200000210301 [0,1,0,1,0,0|2,0,0]=4 2214 B14R1.123 COCCCCOCc1ccccc1 34a_100138415774_100011219843 [0,1,0,1,0,0|2,0,0]=4 2215 B14R1.123 COCCCCOCc1ccccc1 7a_100000210790_100000730899 [0,1,0,1,0,0|2,0,0]=4 2216 B14R1.123 COCCCCOCc1ccccc1 7a_100011215074_200000210301 [0,1,0,1,0,0|2,0,0]=4 2217 B14R1.123 COCCCCOCc1ccccn1 34a_100000740925_100000721315 [0,1,0,1,0,0|2,0,0]=4 2218 B14R1.123 COCCCCSCc1ccccc1 62a_100000211182_100000730899 [0,1,0,1,0,0|2,0,0]=4 2219 B14R1.123 COCCCCSCc1ccccc1 62a_100000730899_100015291786 [0,1,0,1,0,0|2,0,0]=4 2220 B14R1.123 COCCCCSCc1ccccn1 62a_100000721315_100000730899 [0,1,0,1,0,0|2,0,0]=4 2221 B14R1.123 COCCCCSCc1ccccn1 62a_100000730899_100000721315 [0,1,0,1,0,0|2,0,0]=4 2222 B14R1.123 COCCCNCCc1ccccc1 2230a_100000106460_100000740836 [0,1,0,1,0,0|2,0,0]=4 2223 B14R1.123 COCCCNCCc1ccccc1 34a_100000106460_100000740836 [0,1,0,1,0,0|2,0,0]=4 2224 B14R1.123 COCCCNCCc1ccccc1 34a_100150723488_100000765856 [0,1,0,1,0,0|2,0,0]=4 2225 B14R1.123 COCCCOCCc1ccccc1 34a_100000210268_100000740836 [0,1,0,1,0,0|2,0,0]=4 2226 B14R1.123 COCCCOCCc1ccccc1 34a_100000740835_100000765856 [0,1,0,1,0,0|2,0,0]=4 2227 B14R1.123 COCCCOCCc1ccccc1 7a_100000210268_100000740836 [0,1,0,1,0,0|2,0,0]=4 2228 B14R1.123 COCCCOCCc1ccccn1 34a_100000210271_100000740836 [0,1,0,1,0,0|2,0,0]=4 2229 B14R1.123 COCCCSCCc1ccccc1 62a_100000709357_100011218657 [0,1,0,1,0,0|2,0,0]=4 2230 B14R1.123 COCCCSCCc1ccccc1 62a_100000765856_100000709357 [0,1,0,1,0,0|2,0,0]=4 2231 B14R1.123 COCCCSCCc1ccccn1 62a_100000709357_100015183660 [0,1,0,1,0,0|2,0,0]=4 2232 B14R1.123 COCCCSCCc1ccccn1 62a_100015183660_100000709357 [0,1,0,1,0,0|2,0,0]=4 2233 B14R1.123 COCCNCCCc1ccccc1 2230a_100000209980_100000211621 [0,1,0,1,0,0|2,0,0]=4 2234 B14R1.123 COCCNCCCc1ccccc1 2230a_100000211184_100011201679 [0,1,0,1,0,0|2,0,0]=4 2235 B14R1.123 COCCNCCCc1ccccc1 34a_100000211184_100011201679 [0,1,0,1,0,0|2,0,0]=4 2236 B14R1.123 COCCOCCCc1ccccc1 34a_100000210237_100000211621 [0,1,0,1,0,0|2,0,0]=4 2237 B14R1.123 COCCOCCCc1ccccc1 34a_100000210828_100011201679 [0,1,0,1,0,0|2,0,0]=4 2238 B14R1.123 COCCOCCCc1ccccc1 7a_100000210828_100000233755 [0,1,0,1,0,0|2,0,0]=4 2239 B14R1.123 COCCOCCCc1ccccn1 34a_100011215068_100011201679 [0,1,0,1,0,0|2,0,0]=4 2240 B14R1.123 COCCSCCCc1ccccc1 62a_100000211621_100000233755 [0,1,0,1,0,0|2,0,0]=4 2241 B14R1.123 COCCSCCCc1ccccc1 62a_100000233755_100000211621 [0,1,0,1,0,0|2,0,0]=4 2242 B14R1.123 COCNCCCCc1ccccc1 2230a_100015280158_100000766300 [0,1,0,1,0,0|2,0,0]=4 2243 B14R1.123 COCSCCCCc1ccccc1 62a_100000701786_100000766300 [0,1,0,1,0,0|2,0,0]=4 2244 B14R1.123 COCSCCCCc1ccccc1 62a_100000766300_100000701786 [0,1,0,1,0,0|2,0,0]=4 2245 B14R1.123 CSCCCCCCc1ccccc1 62a_100011218729_200000210301 [0,1,0,1,0,0|1,0,0]=3 2246 B14R1.123 CSCCCCCCc1ccccc1 62a_200000210301_100011218729 [0,1,0,1,0,0|1,0,0]=3 2247 B14R1.123 CSCCCCCOc1ccccc1 62a_200000210301_200011777167 [0,1,0,1,0,0|2,0,0]=4 2248 B14R1.123 CSCCCCCOc1ccccc1 62a_200011777167_200000210301 [0,1,0,1,0,0|2,0,0]=4 2249 B14R1.123 CSCCCCOCc1ccccc1 34a_100011217163_100015291786 [0,1,0,1,0,0|2,0,0]=4 2250 B14R1.123 CSCCCCOCc1ccccc1 62a_100011219843_200000210301 [0,1,0,1,0,0|2,0,0]=4 2251 B14R1.123 CSCCCCOCc1ccccc1 62a_200000210301_100011219843 [0,1,0,1,0,0|2,0,0]=4 2252 B14R1.123 CSCCCCOCc1ccccc1 7a_100011217163_100000211182 [0,1,0,1,0,0|2,0,0]=4 2253 B14R1.123 CSCCCCOCc1ccccn1 34a_100011217163_100000721315 [0,1,0,1,0,0|2,0,0]=4 2254 B14R1.123 CSCCCCOCc1ccccn1 7a_100011217163_100000721315 [0,1,0,1,0,0|2,0,0]=4 2255 B14R1.123 CSCCCNCCc1ccccc1 2230a_100000749238_100000765856 [0,1,0,1,0,0|2,0,0]=4 2256 B14R1.123 CSCCCNCCc1ccccn1 2230a_100000749238_100015183660 [0,1,0,1,0,0|2,0,0]=4 2257 B14R1.123 CSCCCOCCc1ccccc1 34a_100000690336_100000765856 [0,1,0,1,0,0|2,0,0]=4 2258 B14R1.123 CSCCCOCCc1ccccc1 7a_100000690336_100000765856 [0,1,0,1,0,0|2,0,0]=4 2259 B14R1.123 CSCCCOCCc1ccccn1 7a_100000690336_100015183660 [0,1,0,1,0,0|2,0,0]=4 2260 B14R1.123 CSCCNCCCc1ccccc1 2230a_100000211184_100000751147 [0,1,0,1,0,0|2,0,0]=4 2261 B14R1.123 CSCCNCCCc1ccccc1 2230a_100020590264_100000211621 [0,1,0,1,0,0|2,0,0]=4 2262 B14R1.123 CSCCNCCCc1ccccc1 34a_100000211184_100000212216 [0,1,0,1,0,0|2,0,0]=4 2263 B14R1.123 CSCCOCCCc1ccccc1 34a_100000210828_100000212216 [0,1,0,1,0,0|2,0,0]=4 2264 B14R1.123 CSCCOCCCc1ccccc1 34a_100000230434_100000211621 [0,1,0,1,0,0|2,0,0]=4 2265 B14R1.123 CSCCOCCCc1ccccc1 7a_100000210828_100000212216 [0,1,0,1,0,0|2,0,0]=4 2266 B14R1.123 CSCCOCCCc1ccccc1 7a_100000230434_100000211621 [0,1,0,1,0,0|2,0,0]=4 2267 B14R1.123 CSCCOCCCc1ccccn1 34a_100011215068_100000212216 [0,1,0,1,0,0|2,0,0]=4 2268 B14R1.123 CSCCSCCCc1ccccc1 62a_100000211621_100000751147 [0,1,0,1,0,0|2,0,0]=4 2269 B14R1.123 CSCCSCCCc1ccccc1 62a_100000212216_100000211621 [0,1,0,1,0,0|2,0,0]=4 2270 B14R1.123 CSCNCCCCc1ccccc1 2230a_100015280158_100011218213 [0,1,0,1,0,0|2,0,0]=4 2271 B14R1.123 CSCNCCCCc1ccccc1 34a_100015280158_100011218213 [0,1,0,1,0,0|2,0,0]=4 2272 B14R1.123 CSCOCCCCc1ccccc1 34a_100000703073_100011218213 [0,1,0,1,0,0|2,0,0]=4 2273 B14R1.123 CSCOCCCCc1ccccn1 34a_100012186994_100011218213 [0,1,0,1,0,0|2,0,0]=4 2274 B14R1.123 CSCSCCCCc1ccccc1 62a_100000701786_100011218213 [0,1,0,1,0,0|2,0,0]=4 2275 B14R1.123 CSCSCCCCc1ccccc1 62a_100011218213_100000701786 [0,1,0,1,0,0|2,0,0]=4 2276 B14R1.123 ClCCCCCOCc1ccccc1 34a_100000746330_100015291786 [0,1,0,1,0,0|2,0,0]=4 2277 B14R1.123 ClCCCCCOCc1ccccc1 7a_100000746330_100000211182 [0,1,0,1,0,0|2,0,0]=4 2278 B14R1.123 ClCCCCCOCc1ccccn1 34a_100000746330_100000721315 [0,1,0,1,0,0|2,0,0]=4 2279 B14R1.123 ClCCCCCOCc1ccccn1 7a_100000746330_100000721315 [0,1,0,1,0,0|2,0,0]=4 2280 B14R1.123 ClCCCCOCCc1ccccc1 34a_100000210776_100000765856 [0,1,0,1,0,0|2,0,0]=4 2281 B14R1.123 ClCCCCOCCc1ccccc1 7a_100000210776_100000765856 [0,1,0,1,0,0|2,0,0]=4 2282 B14R1.123 ClCCCCOCCc1ccccn1 7a_100000210776_100015183660 [0,1,0,1,0,0|2,0,0]=4 2283 B14R1.123 ClCCCOCCCc1ccccc1 34a_100000230001_100000211621 [0,1,0,1,0,0|2,0,0]=4 2284 B14R1.123 FCCCCCCNc1ccccc1 34a_100000106764_100015922095 [0,1,0,1,0,0|2,0,0]=4 2285 B14R1.123 FCCCCCCOc1ccccc1 34a_100000210340_100015922095 [0,1,0,1,0,0|2,0,0]=4 2286 B14R1.123 FCCCCCCOc1ccccc1 7a_100000210340_100015922095 [0,1,0,1,0,0|2,0,0]=4 2287 B14R1.123 FCCCCCCSc1ccccc1 62a_100000719477_100015922095 [0,1,0,1,0,0|2,0,0]=4 2288 B14R1.123 FCCCCCCSc1ccccc1 62a_100015922095_100000041952 [0,1,0,1,0,0|2,0,0]=4 2289 B14R1.123 FCCCCCCSc1ccccn1 62a_100011216584_100015922095 [0,1,0,1,0,0|2,0,0]=4 2290 B14R1.123 FCCCCCCSc1ccccn1 62a_100015922095_100011216584 [0,1,0,1,0,0|2,0,0]=4 2291 B14R1.123 FCCCCCNCc1ccccc1 2230a_100015324214_100000729378 [0,1,0,1,0,0|2,0,0]=4 2292 B14R1.123 FCCCCCNCc1ccccc1 34a_100015324214_100000729378 [0,1,0,1,0,0|2,0,0]=4 2293 B14R1.123 FCCCCCOCc1ccccc1 34a_100000210790_100000729378 [0,1,0,1,0,0|2,0,0]=4 2294 B14R1.123 FCCCCCOCc1ccccc1 7a_100000210790_100000729378 [0,1,0,1,0,0|2,0,0]=4 2295 B14R1.123 FCCCCCSCc1ccccc1 62a_100000211182_100000729378 [0,1,0,1,0,0|2,0,0]=4 2296 B14R1.123 FCCCCCSCc1ccccc1 62a_100000729378_100015291786 [0,1,0,1,0,0|2,0,0]=4 2297 B14R1.123 FCCCCCSCc1ccccn1 62a_100000721315_100000729378 [0,1,0,1,0,0|2,0,0]=4 2298 B14R1.123 FCCCCCSCc1ccccn1 62a_100000729378_100000721315 [0,1,0,1,0,0|2,0,0]=4 2299 B14R1.123 FCCCCNCCc1ccccc1 2230a_100000106460_100000729493 [0,1,0,1,0,0|2,0,0]=4 2300 B14R1.123 FCCCCNCCc1ccccc1 34a_100000106460_100000729493 [0,1,0,1,0,0|2,0,0]=4 2301 B14R1.123 FCCCCOCCc1ccccc1 34a_100000210268_100000729493 [0,1,0,1,0,0|2,0,0]=4 2302 B14R1.123 FCCCCOCCc1ccccc1 34a_100011995726_100000765856 [0,1,0,1,0,0|2,0,0]=4 2303 B14R1.123 FCCCCOCCc1ccccc1 7a_100000210268_100000729493 [0,1,0,1,0,0|2,0,0]=4 2304 B14R1.123 FCCCCOCCc1ccccc1 7a_100011995726_100000765856 [0,1,0,1,0,0|2,0,0]=4 2305 B14R1.123 FCCCCOCCc1ccccn1 34a_100000210271_100000729493 [0,1,0,1,0,0|2,0,0]=4 2306 B14R1.123 FCCCCOCCc1ccccn1 7a_100011995726_100015183660 [0,1,0,1,0,0|2,0,0]=4 2307 B14R1.123 FCCCCSCCc1ccccc1 62a_100000729493_100011218657 [0,1,0,1,0,0|2,0,0]=4 2308 B14R1.123 FCCCCSCCc1ccccc1 62a_100000765856_100000729493 [0,1,0,1,0,0|2,0,0]=4 2309 B14R1.123 FCCCCSCCc1ccccn1 62a_100000729493_100015183660 [0,1,0,1,0,0|2,0,0]=4 2310 B14R1.123 FCCCCSCCc1ccccn1 62a_100015183660_100000729493 [0,1,0,1,0,0|2,0,0]=4 2311 B14R1.123 FCCCNCCCc1ccccc1 2230a_100000211184_100011934791 [0,1,0,1,0,0|2,0,0]=4 2312 B14R1.123 FCCCNCCCc1ccccc1 2230a_100015189416_100000211621 [0,1,0,1,0,0|2,0,0]=4 2313 B14R1.123 FCCCNCCCc1ccccc1 34a_100000211184_100011934791 [0,1,0,1,0,0|2,0,0]=4 2314 B14R1.123 FCCCNCCCc1ccccc1 34a_100015189416_100000211621 [0,1,0,1,0,0|2,0,0]=4 2315 B14R1.123 FCCCOCCCc1ccccc1 34a_100000210828_100011934791 [0,1,0,1,0,0|2,0,0]=4 2316 B14R1.123 FCCCOCCCc1ccccc1 34a_100000759539_100000211621 [0,1,0,1,0,0|2,0,0]=4 2317 B14R1.123 FCCCOCCCc1ccccc1 7a_100000210828_100011934791 [0,1,0,1,0,0|2,0,0]=4 2318 B14R1.123 FCCCOCCCc1ccccn1 34a_100011215068_100011934791 [0,1,0,1,0,0|2,0,0]=4 2319 B14R1.123 FCCCSCCCc1ccccc1 62a_100000211621_100011934791 [0,1,0,1,0,0|2,0,0]=4 2320 B14R1.123 FCCCSCCCc1ccccc1 62a_100011934791_100000211621 [0,1,0,1,0,0|2,0,0]=4 2321 B14R1.123 FCCNCCCCc1ccccc1 2230a_100015280158_100011217306 [0,1,0,1,0,0|2,0,0]=4 2322 B14R1.123 FCCNCCCCc1ccccc1 34a_100000724931_100000701786 [0,1,0,1,0,0|2,0,0]=4 2323 B14R1.123 FCCNCCCCc1ccccc1 34a_100015280158_100011217306 [0,1,0,1,0,0|2,0,0]=4 2324 B14R1.123 FCCOCCCCc1ccccc1 34a_100000703073_100011217306 [0,1,0,1,0,0|2,0,0]=4 2325 B14R1.123 FCCOCCCCc1ccccc1 7a_100000703073_100011217306 [0,1,0,1,0,0|2,0,0]=4 2326 B14R1.123 FCCOCCCCc1ccccn1 34a_100012186994_100011217306 [0,1,0,1,0,0|2,0,0]=4 2327 B14R1.123 FCCSCCCCc1ccccc1 62a_100000701786_100011217306 [0,1,0,1,0,0|2,0,0]=4 2328 B14R1.123 FCCSCCCCc1ccccc1 62a_100011217306_100000701786 [0,1,0,1,0,0|2,0,0]=4 2329 B14R1.123 FCNCCCCCc1ccccc1 34a_100000750932_100015361967 [0,1,0,1,0,0|2,0,0]=4 2330 B14R1.123 FCOCCCCCc1ccccc1 34a_200011219639_100015361967 [0,1,0,1,0,0|2,0,0]=4 2331 B14R1.123 FCOCCCCCc1ccccc1 7a_200011219639_100015361967 [0,1,0,1,0,0|2,0,0]=4 2332 B14R1.123 FCSCCCCCc1ccccc1 62a_100015361967_200011217138 [0,1,0,1,0,0|2,0,0]=4 2333 B14R1.123 FCSCCCCCc1ccccc1 62a_200011217138_100015361967 [0,1,0,1,0,0|2,0,0]=4 2334 B14R1.123 ICCCCCOCc1ccccc1 34a_200012148887_100015291786 [0,1,0,1,0,0|2,0,0]=4 2335 B14R1.123 ICCCCCOCc1ccccc1 7a_200012148887_100000211182 [0,1,0,1,0,0|2,0,0]=4 2336 B14R1.123 ICCCCCOCc1ccccn1 34a_200012148887_100000721315 [0,1,0,1,0,0|2,0,0]=4 2337 B14R1.123 ICCCCCOCc1ccccn1 7a_200012148887_100000721315 [0,1,0,1,0,0|2,0,0]=4 2338 B14R1.123 ICCCCOCCc1ccccc1 34a_200012148704_100000765856 [0,1,0,1,0,0|2,0,0]=4 2339 B14R1.123 NCCCCCOCc1ccccc1 34a_100000762737_100015291786 [0,1,0,1,0,0|2,0,0]=4 2340 B14R1.123 NCCCCCOCc1ccccn1 34a_100000762737_100000721315 [0,1,0,1,0,0|2,0,0]=4 2341 B14R1.123 NCCCCOCCc1ccccc1 34a_100000750430_100000765856 [0,1,0,1,0,0|2,0,0]=4 2342 B14R1.123 NCCCOCCCc1ccccc1 34a_100000182051_100000211621 [0,1,0,1,0,0|2,0,0]=4 2343 B14R1.123 NCCOCCCCc1ccccc1 34a_100000210304_100000701786 [0,1,0,1,0,0|2,0,0]=4 2344 B14R1.123 OCCCCCCNc1ccccc1 34a_100000106764_100000766143 [0,1,0,1,0,0|2,0,0]=4 2345 B14R1.123 OCCCCCCOc1ccccc1 34a_100000210340_100000766143 [0,1,0,1,0,0|2,0,0]=4 2346 B14R1.123 OCCCCCCOc1ccccc1 7a_100000210340_100000766143 [0,1,0,1,0,0|2,0,0]=4 2347 B14R1.123 OCCCCCCSc1ccccc1 62a_100000719477_100000766143 [0,1,0,1,0,0|2,0,0]=4 2348 B14R1.123 OCCCCCCSc1ccccc1 62a_100000766143_100000041952 [0,1,0,1,0,0|2,0,0]=4 2349 B14R1.123 OCCCCCCSc1ccccn1 62a_100000766143_100011216584 [0,1,0,1,0,0|2,0,0]=4 2350 B14R1.123 OCCCCCCSc1ccccn1 62a_100011216584_100000766143 [0,1,0,1,0,0|2,0,0]=4 2351 B14R1.123 OCCCCCNCc1ccccc1 207a_100000762737_100015611070 [0,1,0,1,0,0|2,0,0]=4 2352 B14R1.123 OCCCCCNCc1ccccc1 2230a_100000762737_100015291786 [0,1,0,1,0,0|2,0,0]=4 2353 B14R1.123 OCCCCCNCc1ccccc1 2230a_100015324214_100000746330 [0,1,0,1,0,0|2,0,0]=4 2354 B14R1.123 OCCCCCNCc1ccccc1 270004a_100000762737_100015611070 [0,1,0,1,0,0|2,0,0]=4 2355 B14R1.123 OCCCCCNCc1ccccc1 34a_100000762737_100015291786 [0,1,0,1,0,0|2,0,0]=4 2356 B14R1.123 OCCCCCNCc1ccccc1 34a_100015324214_100000746330 [0,1,0,1,0,0|2,0,0]=4 2357 B14R1.123 OCCCCCNCc1ccccn1 207a_100000762737_100000209966 [0,1,0,1,0,0|2,0,0]=4 2358 B14R1.123 OCCCCCNCc1ccccn1 2230a_100000762737_100000721315 [0,1,0,1,0,0|2,0,0]=4 2359 B14R1.123 OCCCCCNCc1ccccn1 270004a_100000762737_100000209966 [0,1,0,1,0,0|2,0,0]=4 2360 B14R1.123 OCCCCCNCc1ccccn1 34a_100000762737_100000721315 [0,1,0,1,0,0|2,0,0]=4 2361 B14R1.123 OCCCCCOCc1ccccc1 34a_100000210790_100000746330 [0,1,0,1,0,0|2,0,0]=4 2362 B14R1.123 OCCCCCOCc1ccccc1 7a_100000210790_100000746330 [0,1,0,1,0,0|2,0,0]=4 2363 B14R1.123 OCCCCCSCc1ccccc1 62a_100000211182_100000746330 [0,1,0,1,0,0|2,0,0]=4 2364 B14R1.123 OCCCCCSCc1ccccc1 62a_100000746330_100015291786 [0,1,0,1,0,0|2,0,0]=4 2365 B14R1.123 OCCCCCSCc1ccccn1 62a_100000721315_100000746330 [0,1,0,1,0,0|2,0,0]=4 2366 B14R1.123 OCCCCCSCc1ccccn1 62a_100000746330_100000721315 [0,1,0,1,0,0|2,0,0]=4 2367 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000106460_100000210776 [0,1,0,1,0,0|2,0,0]=4 2368 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000750430_100000765856 [0,1,0,1,0,0|2,0,0]=4 2369 B14R1.123 OCCCCNCCc1ccccc1 34a_100000106460_100011216708 [0,1,0,1,0,0|2,0,0]=4 2370 B14R1.123 OCCCCNCCc1ccccc1 34a_100000750430_100000765856 [0,1,0,1,0,0|2,0,0]=4 2371 B14R1.123 OCCCCNCCc1ccccn1 2230a_100000750430_100015183660 [0,1,0,1,0,0|2,0,0]=4 2372 B14R1.123 OCCCCOCCc1ccccc1 34a_100000210268_100011216708 [0,1,0,1,0,0|2,0,0]=4 2373 B14R1.123 OCCCCOCCc1ccccc1 7a_100000210268_100000210776 [0,1,0,1,0,0|2,0,0]=4 2374 B14R1.123 OCCCCOCCc1ccccn1 34a_100000210271_100011216708 [0,1,0,1,0,0|2,0,0]=4 2375 B14R1.123 OCCCCSCCc1ccccc1 62a_100000210776_100011218657 [0,1,0,1,0,0|2,0,0]=4 2376 B14R1.123 OCCCCSCCc1ccccc1 62a_100000765856_100000210776 [0,1,0,1,0,0|2,0,0]=4 2377 B14R1.123 OCCCCSCCc1ccccn1 62a_100000210776_100015183660 [0,1,0,1,0,0|2,0,0]=4 2378 B14R1.123 OCCCCSCCc1ccccn1 62a_100015183660_100000210776 [0,1,0,1,0,0|2,0,0]=4 2379 B14R1.123 OCCCNCCCc1ccccc1 2230a_100000211184_100000230001 [0,1,0,1,0,0|2,0,0]=4 2380 B14R1.123 OCCCNCCCc1ccccc1 34a_100000211184_100000230001 [0,1,0,1,0,0|2,0,0]=4 2381 B14R1.123 OCCCOCCCc1ccccc1 34a_100000210828_100000230001 [0,1,0,1,0,0|2,0,0]=4 2382 B14R1.123 OCCCOCCCc1ccccc1 7a_100000210828_100011215043 [0,1,0,1,0,0|2,0,0]=4 2383 B14R1.123 OCCCOCCCc1ccccn1 34a_100011215068_100000230001 [0,1,0,1,0,0|2,0,0]=4 2384 B14R1.123 OCCCSCCCc1ccccc1 62a_100000211621_100011215043 [0,1,0,1,0,0|2,0,0]=4 2385 B14R1.123 OCCCSCCCc1ccccc1 62a_100011215043_100000211621 [0,1,0,1,0,0|2,0,0]=4 2386 B14R1.123 OCCNCCCCc1ccccc1 2230a_100015280158_100000211926 [0,1,0,1,0,0|2,0,0]=4 2387 B14R1.123 OCCNCCCCc1ccccc1 2230a_100016997473_100000701786 [0,1,0,1,0,0|2,0,0]=4 2388 B14R1.123 OCCNCCCCc1ccccc1 34a_100015280158_100000211926 [0,1,0,1,0,0|2,0,0]=4 2389 B14R1.123 OCCNCCCCc1ccccc1 34a_100016990907_100000701786 [0,1,0,1,0,0|2,0,0]=4 2390 B14R1.123 OCCOCCCCc1ccccc1 34a_100000703073_100000211926 [0,1,0,1,0,0|2,0,0]=4 2391 B14R1.123 OCCOCCCCc1ccccc1 7a_100000703073_100000211926 [0,1,0,1,0,0|2,0,0]=4 2392 B14R1.123 OCCOCCCCc1ccccn1 34a_100012186994_100000211926 [0,1,0,1,0,0|2,0,0]=4 2393 B14R1.123 OCCSCCCCc1ccccc1 62a_100000211926_100000701786 [0,1,0,1,0,0|2,0,0]=4 2394 B14R1.123 OCCSCCCCc1ccccc1 62a_100000701786_100000211926 [0,1,0,1,0,0|2,0,0]=4 2395 B14R1.123 [13CH3]NCCCCOCc1ccccc1 2230a_100000748060_200025704644 [0,1,0,1,0,0|2,0,0]=4 2396 B14R1.123 [13CH3]NCCCCOCc1ccccc1 34a_100000748060_200025704644 [0,1,0,1,0,0|2,0,0]=4 2397 B14R1.123 [13CH3]OCCCCCCc1ccccc1 34a_100011215581_200025704644 [0,1,0,1,0,0|1,0,0]=3 2398 B14R1.123 [13CH3]OCCCCCCc1ccccc1 7a_100011215581_200025704644 [0,1,0,1,0,0|1,0,0]=3 2399 B14R1.123 [13CH3]OCCCCNCc1ccccc1 34a_100000186360_200025704644 [0,1,0,1,0,0|2,0,0]=4 2400 B14R1.123 [13CH3]OCCCCOCc1ccccc1 34a_100011215074_200025704644 [0,1,0,1,0,0|2,0,0]=4 2401 B14R1.123 [13CH3]OCCCCOCc1ccccc1 7a_100011215074_200025704644 [0,1,0,1,0,0|2,0,0]=4 2402 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_100011218729_200025704644 [0,1,0,1,0,0|1,0,0]=3 2403 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_200025704644_100011218729 [0,1,0,1,0,0|1,0,0]=3 2404 B14R1.123 [13CH3]SCCCCCOc1ccccc1 62a_200011777167_200025704644 [0,1,0,1,0,0|2,0,0]=4 2405 B14R1.123 [13CH3]SCCCCCOc1ccccc1 62a_200025704644_200011777167 [0,1,0,1,0,0|2,0,0]=4 2406 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_100011219843_200025704644 [0,1,0,1,0,0|2,0,0]=4 2407 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_200025704644_100011219843 [0,1,0,1,0,0|2,0,0]=4 2408 B14R1.156 C=CC=CC(=O)CCC1CCCCC1 1458a_100016291481_100011273959 [0,1,0,1,0,0|1,0,1]=4 2409 B14R1.156 C=CC=CC(=O)NCC1CCCCC1 1626a_100000210473_100016291481 [0,1,0,1,0,0|2,0,0]=4 2410 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000185753_100000210211 [0,1,0,1,0,0|1,0,1]=4 2411 B14R1.156 CCCCC(=O)CCc1ccccc1 1458a_100000210183_100000765856 [0,1,0,1,0,0|1,0,1]=4 2412 B14R1.156 CCCCC(=O)CCc1ccccn1 1458a_100000210183_100015183660 [0,1,0,1,0,0|1,0,1]=4 2413 B14R1.156 CCCCC(=O)CCc1ccccn1 1458a_100015195070_100000210211 [0,1,0,1,0,0|1,0,1]=4 2414 B14R1.156 CCCCC(C)NCc1ccccc1 207a_100000126638_100015611070 [0,1,0,1,0,0|2,0,0]=4 2415 B14R1.156 CCCCC(C)NCc1ccccc1 2230a_100000126638_100015291786 [0,1,0,1,0,0|2,0,0]=4 2416 B14R1.156 CCCCC(C)NCc1ccccc1 2230a_100015324214_200011215066 [0,1,0,1,0,0|2,0,0]=4 2417 B14R1.156 CCCCC(C)NCc1ccccc1 270004a_100000126638_100015611070 [0,1,0,1,0,0|2,0,0]=4 2418 B14R1.156 CCCCC(C)NCc1ccccc1 270004a_100015324214_100000210087 [0,1,0,1,0,0|2,0,0]=4 2419 B14R1.156 CCCCC(C)NCc1ccccc1 34a_100015324214_200011215066 [0,1,0,1,0,0|2,0,0]=4 2420 B14R1.156 CCCCC(C)NCc1ccccn1 207a_100000126638_100000209966 [0,1,0,1,0,0|2,0,0]=4 2421 B14R1.156 CCCCC(C)NCc1ccccn1 2230a_100000126638_100000721315 [0,1,0,1,0,0|2,0,0]=4 2422 B14R1.156 CCCCC(C)NCc1ccccn1 270004a_100000126638_100000209966 [0,1,0,1,0,0|2,0,0]=4 2423 B14R1.156 CCCCC(C)NCc1ccccn1 270004a_100000210449_100000210087 [0,1,0,1,0,0|2,0,0]=4 2424 B14R1.156 CCCCC(C)OCc1ccccc1 34a_100000210790_200011215066 [0,1,0,1,0,0|2,0,0]=4 2425 B14R1.156 CCCCC(C)OCc1ccccc1 34a_100000687866_100015291786 [0,1,0,1,0,0|2,0,0]=4 2426 B14R1.156 CCCCC(C)OCc1ccccc1 7a_100000210790_200011215066 [0,1,0,1,0,0|2,0,0]=4 2427 B14R1.156 CCCCC(C)OCc1ccccc1 7a_100000687866_100000211182 [0,1,0,1,0,0|2,0,0]=4 2428 B14R1.156 CCCCC(C)OCc1ccccn1 34a_100000687866_100000721315 [0,1,0,1,0,0|2,0,0]=4 2429 B14R1.156 CCCCC(C)OCc1ccccn1 7a_100000687866_100000721315 [0,1,0,1,0,0|2,0,0]=4 2430 B14R1.156 CCCCC(C)SCc1ccccc1 62a_100000211182_200011215066 [0,1,0,1,0,0|2,0,0]=4 2431 B14R1.156 CCCCC(C)SCc1ccccc1 62a_200011215066_100015291786 [0,1,0,1,0,0|2,0,0]=4 2432 B14R1.156 CCCCC(C)SCc1ccccn1 62a_100000721315_200011215066 [0,1,0,1,0,0|2,0,0]=4 2433 B14R1.156 CCCCC(C)SCc1ccccn1 62a_200011215066_100000721315 [0,1,0,1,0,0|2,0,0]=4 2434 B14R1.156 CCCCN(C)CCc1ccccc1 2230a_100000207497_100000210211 [0,1,0,1,0,0|2,0,0]=4 2435 B14R1.156 CCCCN(C)CCc1ccccc1 2230a_100000207549_100000765856 [0,1,0,1,0,0|2,0,0]=4 2436 B14R1.156 CCCCN(C)CCc1ccccc1 269982a_100000207497_100000210211 [0,1,0,1,0,0|2,0,0]=4 2437 B14R1.156 CCCCN(C)CCc1ccccc1 269982a_100000207549_100000765856 [0,1,0,1,0,0|2,0,0]=4 2438 B14R1.156 CCCCN(C)CCc1ccccn1 2230a_100000207549_100015183660 [0,1,0,1,0,0|2,0,0]=4 2439 B14R1.156 CCCCN(C)CCc1ccccn1 2230a_100000737206_100000210211 [0,1,0,1,0,0|2,0,0]=4 2440 B14R1.156 CCCCN(C)CCc1ccccn1 269982a_100000207549_100015183660 [0,1,0,1,0,0|2,0,0]=4 2441 B14R1.156 CCCCN(C)CCc1ccccn1 269982a_100000737206_100000210211 [0,1,0,1,0,0|2,0,0]=4 2442 B14R1.156 CCCNC(C)CCc1ccccc1 2230a_100000210798_100000210303 [0,1,0,1,0,0|2,0,0]=4 2443 B14R1.156 CCCNC(C)CCc1ccccc1 270004a_100020643023_100000210092 [0,1,0,1,0,0|2,0,0]=4 2444 B14R1.156 CCCNC(C)CCc1ccccc1 34a_100000210798_100000210303 [0,1,0,1,0,0|2,0,0]=4 2445 B14R1.156 CCCO[C@@H](C)CCc1ccccc1 34a_100009815974_100000210303 [0,1,0,1,0,0|2,0,0]=4 2446 B14R1.156 CCCO[C@@H](C)CCc1ccccc1 7a_100009815974_100000210303 [0,1,0,1,0,0|2,0,0]=4 2447 B14R1.156 CNCCC(C)CCc1ccccc1 269862a_106832991636_200000075208 [0,1,0,1,0,0|2,0,0]=4 2448 B14R1.177 C=CC=CC(=O)CCCC1CCCC1 1458a_100016291481_100011713738 [0,1,0,1,0,0|1,0,1]=4 2449 B14R1.177 C=CC=CC(=O)NCCC1CCCC1 1626a_100000739158_100016291481 [0,1,0,1,0,0|2,0,0]=4 2450 B14R1.882 CCCCCC=Cc1c[nH]ccc1=O 271570a_100000062253_100009998708 [0,1,0,1,0,0|0,0,2]=4 2451 B14R1.882 CCCCCC=Cc1ccc[nH]c1=O 271570a_100000062253_100000050042 [0,1,0,1,0,0|0,0,2]=4 2452 B14R1.882 CCCCCCCc1ncncc1O 271570a_203496583355_200010208268 [0,1,0,1,0,0|1,0,1]=4 2453 B14R1.882 CCCCCCNc1ccccc1Br 34a_100000210017_100000210314 [0,1,0,1,0,0|1,0,1]=4 2454 B14R1.882 CCCCCCNc1ccccc1C 34a_100015192222_100000210314 [0,1,0,1,0,0|1,0,1]=4 2455 B14R1.882 CCCCCCNc1ccccc1Cl 34a_100000185783_100000210314 [0,1,0,1,0,0|1,0,1]=4 2456 B14R1.882 CCCCCCNc1ccccc1F 34a_100000210422_100000210314 [0,1,0,1,0,0|1,0,1]=4 2457 B14R1.882 CCCCCCNc1ccccc1I 34a_100000210053_100000210314 [0,1,0,1,0,0|1,0,1]=4 2458 B14R1.882 CCCCCCNc1ccccc1O 34a_100000185747_100000210314 [0,1,0,1,0,0|0,0,2]=4 2459 B14R1.882 CCCCCCNc1ccn[nH]c1=O 27a_100000210581_100000087129 [0,1,0,1,0,0|2,0,0]=4 2460 B14R1.882 CCCCCCNc1ccncc1Br 27a_100000210581_100000726257 [0,1,0,1,0,0|2,0,0]=4 2461 B14R1.882 CCCCCCNc1ccncc1C 27a_100000210581_100000765111 [0,1,0,1,0,0|2,0,0]=4 2462 B14R1.882 CCCCCCNc1ccncc1F 27a_100000210581_100000035921 [0,1,0,1,0,0|2,0,0]=4 2463 B14R1.882 CCCCCCNc1ncccc1Br 27a_100000210581_100000696092 [0,1,0,1,0,0|2,0,0]=4 2464 B14R1.882 CCCCCCOc1cccc[n+]1[O-] 7a_100000211761_100000210314 [0,1,0,1,0,0|1,0,1]=4 2465 B14R1.882 CCCCCCOc1ccccc1Br 34a_100000181306_100000210314 [0,1,0,1,0,0|1,0,1]=4 2466 B14R1.882 CCCCCCOc1ccccc1Br 7a_100000181306_100000210314 [0,1,0,1,0,0|1,0,1]=4 2467 B14R1.882 CCCCCCOc1ccccc1C 34a_100000210338_100000210314 [0,1,0,1,0,0|1,0,1]=4 2468 B14R1.882 CCCCCCOc1ccccc1C 7a_100000210338_100000210314 [0,1,0,1,0,0|1,0,1]=4 2469 B14R1.882 CCCCCCOc1ccccc1Cl 34a_100000210172_100000210314 [0,1,0,1,0,0|1,0,1]=4 2470 B14R1.882 CCCCCCOc1ccccc1Cl 7a_100000210172_100000210314 [0,1,0,1,0,0|1,0,1]=4 2471 B14R1.882 CCCCCCOc1ccccc1F 34a_100000210171_100000210314 [0,1,0,1,0,0|1,0,1]=4 2472 B14R1.882 CCCCCCOc1ccccc1F 7a_100000210171_100000210314 [0,1,0,1,0,0|1,0,1]=4 2473 B14R1.882 CCCCCCOc1ccccc1I 34a_100000739446_100000210314 [0,1,0,1,0,0|1,0,1]=4 2474 B14R1.882 CCCCCCOc1ccccc1I 7a_100000739446_100000210314 [0,1,0,1,0,0|1,0,1]=4 2475 B14R1.882 CCCCCCOc1ccccc1N 34a_100000185747_100000210314 [0,1,0,1,0,0|1,0,1]=4 2476 B14R1.882 CCCCCCOc1ccccc1N 7a_100000185747_100000210314 [0,1,0,1,0,0|1,0,1]=4 2477 B14R1.882 CCCCCCOc1cccnc1Br 34a_100000744436_100000210314 [0,1,0,1,0,0|2,0,0]=4 2478 B14R1.882 CCCCCCOc1cccnc1Br 7a_100000744436_100000210314 [0,1,0,1,0,0|2,0,0]=4 2479 B14R1.882 CCCCCCOc1cccnc1C 34a_100000745507_100000210314 [0,1,0,1,0,0|2,0,0]=4 2480 B14R1.882 CCCCCCOc1cccnc1C 7a_100000745507_100000210314 [0,1,0,1,0,0|2,0,0]=4 2481 B14R1.882 CCCCCCOc1cccnc1Cl 34a_100000757616_100000210314 [0,1,0,1,0,0|2,0,0]=4 2482 B14R1.882 CCCCCCOc1cccnc1Cl 7a_100000757616_100000210314 [0,1,0,1,0,0|2,0,0]=4 2483 B14R1.882 CCCCCCOc1cccnc1F 34a_100000061740_100000210314 [0,1,0,1,0,0|2,0,0]=4 2484 B14R1.882 CCCCCCOc1cccnc1F 7a_100000061740_100000210314 [0,1,0,1,0,0|2,0,0]=4 2485 B14R1.882 CCCCCCOc1cccnc1I 34a_100000034122_100000210314 [0,1,0,1,0,0|2,0,0]=4 2486 B14R1.882 CCCCCCOc1cccnc1I 7a_100000034122_100000210314 [0,1,0,1,0,0|2,0,0]=4 2487 B14R1.882 CCCCCCOc1cccnc1N 34a_100000211975_100000210314 [0,1,0,1,0,0|2,0,0]=4 2488 B14R1.882 CCCCCCOc1cccnc1N 7a_100000211975_100000210314 [0,1,0,1,0,0|2,0,0]=4 2489 B14R1.882 CCCCCCOc1cccoc1=O 34a_100000077404_100000210314 [0,1,0,1,0,0|1,0,0]=3 2490 B14R1.882 CCCCCCOc1cccoc1=O 7a_100000077404_100000210314 [0,1,0,1,0,0|1,0,0]=3 2491 B14R1.882 CCCCCCOc1ccncc1Br 34a_100011996408_100000210314 [0,1,0,1,0,0|2,0,0]=4 2492 B14R1.882 CCCCCCOc1ccncc1C 34a_100000694293_100000210314 [0,1,0,1,0,0|2,0,0]=4 2493 B14R1.882 CCCCCCOc1ccncc1Cl 34a_100011997054_100000210314 [0,1,0,1,0,0|2,0,0]=4 2494 B14R1.882 CCCCCCOc1ccncc1F 34a_200000081243_100000210314 [0,1,0,1,0,0|2,0,0]=4 2495 B14R1.882 CCCCCCOc1cnccc1C 34a_100011997053_100000210314 [0,1,0,1,0,0|2,0,0]=4 2496 B14R1.882 CCCCCCOc1cnccc1C 7a_100011997053_100000210314 [0,1,0,1,0,0|2,0,0]=4 2497 B14R1.882 CCCCCCOc1cnccc1Cl 34a_100011996695_100000210314 [0,1,0,1,0,0|2,0,0]=4 2498 B14R1.882 CCCCCCOc1cnccc1I 34a_100000050107_100000210314 [0,1,0,1,0,0|2,0,0]=4 2499 B14R1.882 CCCCCCOc1cnccc1N 34a_100000753702_100000210314 [0,1,0,1,0,0|2,0,0]=4 2500 B14R1.882 CCCCCCOc1coccc1=O 34a_100000060831_100000210314 [0,1,0,1,0,0|1,0,0]=3 2501 B14R1.882 CCCCCCOc1ncccc1Cl 34a_100011290957_100000210314 [0,1,0,1,0,0|2,0,0]=4 2502 B14R1.882 CCCCCCOc1ncccc1F 34a_100011219419_100000210314 [0,1,0,1,0,0|2,0,0]=4 2503 B14R1.882 CCCCCCOc1ncccc1N 34a_100000746358_100000210314 [0,1,0,1,0,0|2,0,0]=4 2504 B14R1.882 CCCCCCSc1c[nH]ccc1=O 62a_100000210314_100009998708 [0,1,0,1,0,0|1,0,0]=3 2505 B14R1.882 CCCCCCSc1c[nH]ccc1=O 62a_100009998708_100000210757 [0,1,0,1,0,0|1,0,0]=3 2506 B14R1.882 CCCCCCSc1c[nH]ccc1=S 62a_100000210314_200012280681 [0,1,0,1,0,0|1,1,0]=4 2507 B14R1.882 CCCCCCSc1c[nH]ccc1=S 62a_200012280681_100000210757 [0,1,0,1,0,0|1,1,0]=4 2508 B14R1.882 CCCCCCSc1cccc[n+]1C 62a_100000210314_100000212160 [0,1,0,1,0,0|2,0,0]=4 2509 B14R1.882 CCCCCCSc1cccc[n+]1[O-] 62a_100000210314_200000042595 [0,1,0,1,0,0|1,0,1]=4 2510 B14R1.882 CCCCCCSc1ccccc1Br 62a_100000210314_100000695589 [0,1,0,1,0,0|1,0,1]=4 2511 B14R1.882 CCCCCCSc1ccccc1Br 62a_100000695589_100000210757 [0,1,0,1,0,0|1,0,1]=4 2512 B14R1.882 CCCCCCSc1ccccc1C 62a_100000210314_100000210755 [0,1,0,1,0,0|1,0,1]=4 2513 B14R1.882 CCCCCCSc1ccccc1C 62a_100000210755_100000210757 [0,1,0,1,0,0|1,0,1]=4 2514 B14R1.882 CCCCCCSc1ccccc1Cl 62a_100000210314_100000764095 [0,1,0,1,0,0|1,0,1]=4 2515 B14R1.882 CCCCCCSc1ccccc1Cl 62a_100000764095_100000210757 [0,1,0,1,0,0|1,0,1]=4 2516 B14R1.882 CCCCCCSc1ccccc1F 62a_100000210314_100011215700 [0,1,0,1,0,0|1,0,1]=4 2517 B14R1.882 CCCCCCSc1ccccc1F 62a_100011215700_100000210757 [0,1,0,1,0,0|1,0,1]=4 2518 B14R1.882 CCCCCCSc1ccccc1N 62a_100000210017_100000210757 [0,1,0,1,0,0|1,0,1]=4 2519 B14R1.882 CCCCCCSc1ccccc1N 62a_100000210314_100000210017 [0,1,0,1,0,0|1,0,1]=4 2520 B14R1.882 CCCCCCSc1ccccc1O 62a_100000210314_100000739446 [0,1,0,1,0,0|0,0,2]=4 2521 B14R1.882 CCCCCCSc1ccccc1O 62a_100000739446_100000210757 [0,1,0,1,0,0|0,0,2]=4 2522 B14R1.882 CCCCCCSc1cccnc1Br 62a_100000210314_100010202626 [0,1,0,1,0,0|2,0,0]=4 2523 B14R1.882 CCCCCCSc1cccnc1Br 62a_100010202626_100000210757 [0,1,0,1,0,0|2,0,0]=4 2524 B14R1.882 CCCCCCSc1cccnc1C 62a_100000210314_100000751574 [0,1,0,1,0,0|2,0,0]=4 2525 B14R1.882 CCCCCCSc1cccnc1C 62a_100000751574_100000210757 [0,1,0,1,0,0|2,0,0]=4 2526 B14R1.882 CCCCCCSc1cccnc1Cl 62a_100000036424_100000210757 [0,1,0,1,0,0|2,0,0]=4 2527 B14R1.882 CCCCCCSc1cccnc1Cl 62a_100000210314_100000036424 [0,1,0,1,0,0|2,0,0]=4 2528 B14R1.882 CCCCCCSc1cccnc1F 62a_100000210314_100009816115 [0,1,0,1,0,0|2,0,0]=4 2529 B14R1.882 CCCCCCSc1cccnc1F 62a_100009816115_100000210757 [0,1,0,1,0,0|2,0,0]=4 2530 B14R1.882 CCCCCCSc1cccnc1N 62a_100000045569_100000210757 [0,1,0,1,0,0|2,0,0]=4 2531 B14R1.882 CCCCCCSc1cccnc1N 62a_100000210314_100000045569 [0,1,0,1,0,0|2,0,0]=4 2532 B14R1.882 CCCCCCSc1cccnc1O 62a_100000210314_100000760158 [0,1,0,1,0,0|1,0,1]=4 2533 B14R1.882 CCCCCCSc1cccnc1O 62a_100000760158_100000210757 [0,1,0,1,0,0|1,0,1]=4 2534 B14R1.882 CCCCCCSc1ccn[nH]c1=O 62a_100000210314_100000087129 [0,1,0,1,0,0|2,0,0]=4 2535 B14R1.882 CCCCCCSc1ccncc1Br 62a_100000210314_100000726257 [0,1,0,1,0,0|2,0,0]=4 2536 B14R1.882 CCCCCCSc1ccncc1Br 62a_100000726257_100000210757 [0,1,0,1,0,0|2,0,0]=4 2537 B14R1.882 CCCCCCSc1ccncc1C 62a_100000210314_100000765111 [0,1,0,1,0,0|2,0,0]=4 2538 B14R1.882 CCCCCCSc1ccncc1C 62a_100000765111_100000210757 [0,1,0,1,0,0|2,0,0]=4 2539 B14R1.882 CCCCCCSc1ccncc1Cl 62a_100000210314_100000708259 [0,1,0,1,0,0|2,0,0]=4 2540 B14R1.882 CCCCCCSc1ccncc1Cl 62a_100000708259_100000210757 [0,1,0,1,0,0|2,0,0]=4 2541 B14R1.882 CCCCCCSc1ccncc1F 62a_100000047030_100000210757 [0,1,0,1,0,0|2,0,0]=4 2542 B14R1.882 CCCCCCSc1ccncc1F 62a_100000210314_100000047030 [0,1,0,1,0,0|2,0,0]=4 2543 B14R1.882 CCCCCCSc1ccncc1N 62a_100000210314_100000756074 [0,1,0,1,0,0|2,0,0]=4 2544 B14R1.882 CCCCCCSc1ccncc1N 62a_100000756074_100000210757 [0,1,0,1,0,0|2,0,0]=4 2545 B14R1.882 CCCCCCSc1ccncc1O 62a_100000210314_100009817591 [0,1,0,1,0,0|1,0,1]=4 2546 B14R1.882 CCCCCCSc1ccncc1O 62a_100009817591_100000210757 [0,1,0,1,0,0|1,0,1]=4 2547 B14R1.882 CCCCCCSc1cnccc1Br 62a_100000210314_100010138639 [0,1,0,1,0,0|2,0,0]=4 2548 B14R1.882 CCCCCCSc1cnccc1Br 62a_100010138639_100000210757 [0,1,0,1,0,0|2,0,0]=4 2549 B14R1.882 CCCCCCSc1cnccc1C 62a_100000210314_100000761580 [0,1,0,1,0,0|2,0,0]=4 2550 B14R1.882 CCCCCCSc1cnccc1C 62a_100000761580_100000210757 [0,1,0,1,0,0|2,0,0]=4 2551 B14R1.882 CCCCCCSc1cnccc1Cl 62a_100000210314_100009995489 [0,1,0,1,0,0|2,0,0]=4 2552 B14R1.882 CCCCCCSc1cnccc1Cl 62a_100009995489_100000210757 [0,1,0,1,0,0|2,0,0]=4 2553 B14R1.882 CCCCCCSc1cnccc1F 62a_100000210314_100009820683 [0,1,0,1,0,0|2,0,0]=4 2554 B14R1.882 CCCCCCSc1cnccc1F 62a_100009820683_100000210757 [0,1,0,1,0,0|2,0,0]=4 2555 B14R1.882 CCCCCCSc1cnccc1N 62a_100000047001_100000210757 [0,1,0,1,0,0|2,0,0]=4 2556 B14R1.882 CCCCCCSc1cnccc1N 62a_100000210314_100000047001 [0,1,0,1,0,0|2,0,0]=4 2557 B14R1.882 CCCCCCSc1ncc[nH]c1=O 62a_100000210314_100000763361 [0,1,0,1,0,0|2,0,0]=4 2558 B14R1.882 CCCCCCSc1ncccc1Br 62a_100000210314_100000696092 [0,1,0,1,0,0|2,0,0]=4 2559 B14R1.882 CCCCCCSc1ncccc1Br 62a_100000696092_100000210757 [0,1,0,1,0,0|2,0,0]=4 2560 B14R1.882 CCCCCCSc1ncccc1C 62a_100000210314_100000751373 [0,1,0,1,0,0|2,0,0]=4 2561 B14R1.882 CCCCCCSc1ncccc1C 62a_100000751373_100000210757 [0,1,0,1,0,0|2,0,0]=4 2562 B14R1.882 CCCCCCSc1ncccc1Cl 62a_100000210314_100011356963 [0,1,0,1,0,0|2,0,0]=4 2563 B14R1.882 CCCCCCSc1ncccc1Cl 62a_100011356963_100000210757 [0,1,0,1,0,0|2,0,0]=4 2564 B14R1.882 CCCCCCSc1ncccc1F 62a_100000210314_100000685392 [0,1,0,1,0,0|2,0,0]=4 2565 B14R1.882 CCCCCCSc1ncccc1F 62a_100000685392_100000210757 [0,1,0,1,0,0|2,0,0]=4 2566 B14R1.882 CCCCCCSc1ncccc1N 62a_100000210314_100000688686 [0,1,0,1,0,0|2,0,0]=4 2567 B14R1.882 CCCCCCSc1ncccc1N 62a_100000688686_100000210757 [0,1,0,1,0,0|2,0,0]=4 2568 B14R1.882 CCCCCCSc1ncccc1O 62a_100000034122_100000210757 [0,1,0,1,0,0|1,0,1]=4 2569 B14R1.882 CCCCCCSc1ncccc1O 62a_100000210314_100000034122 [0,1,0,1,0,0|1,0,1]=4 2570 B14R1.882 CCCCCNCc1ccccc1Br 207a_100000209983_100000211189 [0,1,0,1,0,0|1,0,1]=4 2571 B14R1.882 CCCCCNCc1ccccc1Br 2230a_100000209983_100000184730 [0,1,0,1,0,0|1,0,1]=4 2572 B14R1.882 CCCCCNCc1ccccc1Br 2230a_100000689332_100000210326 [0,1,0,1,0,0|1,0,1]=4 2573 B14R1.882 CCCCCNCc1ccccc1Br 270004a_100000209983_100000211189 [0,1,0,1,0,0|1,0,1]=4 2574 B14R1.882 CCCCCNCc1ccccc1Br 34a_100000689332_100000718602 [0,1,0,1,0,0|1,0,1]=4 2575 B14R1.882 CCCCCNCc1ccccc1C 207a_100000209983_100000211143 [0,1,0,1,0,0|1,0,1]=4 2576 B14R1.882 CCCCCNCc1ccccc1C 2230a_100000209983_100000211839 [0,1,0,1,0,0|1,0,1]=4 2577 B14R1.882 CCCCCNCc1ccccc1C 270004a_100000209983_100000211143 [0,1,0,1,0,0|1,0,1]=4 2578 B14R1.882 CCCCCNCc1ccccc1C 34a_100000174972_100000718602 [0,1,0,1,0,0|1,0,1]=4 2579 B14R1.882 CCCCCNCc1ccccc1Cl 207a_100000209983_100000210073 [0,1,0,1,0,0|1,0,1]=4 2580 B14R1.882 CCCCCNCc1ccccc1Cl 2230a_100000174879_100000210326 [0,1,0,1,0,0|1,0,1]=4 2581 B14R1.882 CCCCCNCc1ccccc1Cl 2230a_100000209983_100000187162 [0,1,0,1,0,0|1,0,1]=4 2582 B14R1.882 CCCCCNCc1ccccc1Cl 270004a_100000209983_100000210073 [0,1,0,1,0,0|1,0,1]=4 2583 B14R1.882 CCCCCNCc1ccccc1Cl 34a_100000174879_100000718602 [0,1,0,1,0,0|1,0,1]=4 2584 B14R1.882 CCCCCNCc1ccccc1F 207a_100000209983_100000210811 [0,1,0,1,0,0|1,0,1]=4 2585 B14R1.882 CCCCCNCc1ccccc1F 2230a_100000209983_100000211605 [0,1,0,1,0,0|1,0,1]=4 2586 B14R1.882 CCCCCNCc1ccccc1F 270004a_100000209983_100000210811 [0,1,0,1,0,0|1,0,1]=4 2587 B14R1.882 CCCCCNCc1ccccc1F 34a_100000174869_100000718602 [0,1,0,1,0,0|1,0,1]=4 2588 B14R1.882 CCCCCNCc1ccccc1I 207a_100000209983_100000010305 [0,1,0,1,0,0|1,0,1]=4 2589 B14R1.882 CCCCCNCc1ccccc1I 2230a_100000209983_100011215278 [0,1,0,1,0,0|1,0,1]=4 2590 B14R1.882 CCCCCNCc1ccccc1I 270004a_100000209983_100000010305 [0,1,0,1,0,0|1,0,1]=4 2591 B14R1.882 CCCCCNCc1ccccc1O 34a_100000185550_100000718602 [0,1,0,1,0,0|0,0,2]=4 2592 B14R1.882 CCCCCNCc1cccnc1Br 2230a_100000209983_100010140945 [0,1,0,1,0,0|2,0,0]=4 2593 B14R1.882 CCCCCNCc1cccnc1Br 2230a_100009818023_100000210326 [0,1,0,1,0,0|2,0,0]=4 2594 B14R1.882 CCCCCNCc1cccnc1Br 34a_100009818023_100000718602 [0,1,0,1,0,0|2,0,0]=4 2595 B14R1.882 CCCCCNCc1cccnc1C 207a_100000209983_100000751968 [0,1,0,1,0,0|2,0,0]=4 2596 B14R1.882 CCCCCNCc1cccnc1C 2230a_100000209983_100000732876 [0,1,0,1,0,0|2,0,0]=4 2597 B14R1.882 CCCCCNCc1cccnc1C 270004a_100000209983_100000751968 [0,1,0,1,0,0|2,0,0]=4 2598 B14R1.882 CCCCCNCc1cccnc1Cl 2230a_100000209983_100000045678 [0,1,0,1,0,0|2,0,0]=4 2599 B14R1.882 CCCCCNCc1cccnc1Cl 2230a_100015189234_100000210326 [0,1,0,1,0,0|2,0,0]=4 2600 B14R1.882 CCCCCNCc1cccnc1Cl 34a_100015189234_100000718602 [0,1,0,1,0,0|2,0,0]=4 2601 B14R1.882 CCCCCNCc1cccnc1F 2230a_100000209983_100000099810 [0,1,0,1,0,0|2,0,0]=4 2602 B14R1.882 CCCCCNCc1cccnc1F 34a_100000724633_100000718602 [0,1,0,1,0,0|2,0,0]=4 2603 B14R1.882 CCCCCNCc1cccnc1O 207a_100000209983_100011998315 [0,1,0,1,0,0|1,0,1]=4 2604 B14R1.882 CCCCCNCc1cccnc1O 270004a_100000209983_100011998315 [0,1,0,1,0,0|1,0,1]=4 2605 B14R1.882 CCCCCNCc1ccncc1Br 270004a_100000209983_100000755692 [0,1,0,1,0,0|2,0,0]=4 2606 B14R1.882 CCCCCNCc1ccncc1C 2230a_100000209983_100020672808 [0,1,0,1,0,0|2,0,0]=4 2607 B14R1.882 CCCCCNCc1ccncc1Cl 207a_100000209983_100011934409 [0,1,0,1,0,0|2,0,0]=4 2608 B14R1.882 CCCCCNCc1ccncc1Cl 2230a_100000209983_100000763264 [0,1,0,1,0,0|2,0,0]=4 2609 B14R1.882 CCCCCNCc1ccncc1Cl 270004a_100000209983_100011934409 [0,1,0,1,0,0|2,0,0]=4 2610 B14R1.882 CCCCCNCc1ccncc1F 34a_100011935246_100000718602 [0,1,0,1,0,0|2,0,0]=4 2611 B14R1.882 CCCCCNCc1cnccc1Br 270004a_100000209983_100009816821 [0,1,0,1,0,0|2,0,0]=4 2612 B14R1.882 CCCCCNCc1cnccc1C 207a_100000209983_100000685662 [0,1,0,1,0,0|2,0,0]=4 2613 B14R1.882 CCCCCNCc1cnccc1C 2230a_100000209983_100000690890 [0,1,0,1,0,0|2,0,0]=4 2614 B14R1.882 CCCCCNCc1cnccc1C 270004a_100000209983_100000685662 [0,1,0,1,0,0|2,0,0]=4 2615 B14R1.882 CCCCCNCc1cnccc1Cl 270004a_100000209983_100000050567 [0,1,0,1,0,0|2,0,0]=4 2616 B14R1.882 CCCCCNCc1ncccc1Br 207a_100000209983_100011934733 [0,1,0,1,0,0|2,0,0]=4 2617 B14R1.882 CCCCCNCc1ncccc1Br 2230a_100000209983_100025702911 [0,1,0,1,0,0|2,0,0]=4 2618 B14R1.882 CCCCCNCc1ncccc1Br 270004a_100000209983_100011934733 [0,1,0,1,0,0|2,0,0]=4 2619 B14R1.882 CCCCCNCc1ncccc1C 207a_100000209983_100000698913 [0,1,0,1,0,0|2,0,0]=4 2620 B14R1.882 CCCCCNCc1ncccc1C 2230a_100000209983_100000696600 [0,1,0,1,0,0|2,0,0]=4 2621 B14R1.882 CCCCCNCc1ncccc1C 270004a_100000209983_100000698913 [0,1,0,1,0,0|2,0,0]=4 2622 B14R1.882 CCCCCNCc1ncccc1C 34a_100011223789_100000718602 [0,1,0,1,0,0|2,0,0]=4 2623 B14R1.882 CCCCCNCc1ncccc1Cl 207a_100000209983_100012001307 [0,1,0,1,0,0|2,0,0]=4 2624 B14R1.882 CCCCCNCc1ncccc1Cl 2230a_100000209983_100000099807 [0,1,0,1,0,0|2,0,0]=4 2625 B14R1.882 CCCCCNCc1ncccc1Cl 2230a_100015189233_100000210326 [0,1,0,1,0,0|2,0,0]=4 2626 B14R1.882 CCCCCNCc1ncccc1Cl 270004a_100000209983_100012001307 [0,1,0,1,0,0|2,0,0]=4 2627 B14R1.882 CCCCCNCc1ncccc1F 207a_100000209983_100011934734 [0,1,0,1,0,0|2,0,0]=4 2628 B14R1.882 CCCCCNCc1ncccc1F 2230a_100000209983_100000104219 [0,1,0,1,0,0|2,0,0]=4 2629 B14R1.882 CCCCCNCc1ncccc1F 270004a_100000209983_100011934734 [0,1,0,1,0,0|2,0,0]=4 2630 B14R1.882 CCCCCNCc1ncccc1F 34a_100000690088_100000718602 [0,1,0,1,0,0|2,0,0]=4 2631 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000210253_100000184730 [0,1,0,1,0,0|1,0,1]=4 2632 B14R1.882 CCCCCOCc1ccccc1Br 34a_100000756307_100000718602 [0,1,0,1,0,0|1,0,1]=4 2633 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000210253_100000184730 [0,1,0,1,0,0|1,0,1]=4 2634 B14R1.882 CCCCCOCc1ccccc1Br 7a_100000756307_100000210326 [0,1,0,1,0,0|1,0,1]=4 2635 B14R1.882 CCCCCOCc1ccccc1C 34a_100000210253_100000211839 [0,1,0,1,0,0|1,0,1]=4 2636 B14R1.882 CCCCCOCc1ccccc1C 34a_100000698903_100000718602 [0,1,0,1,0,0|1,0,1]=4 2637 B14R1.882 CCCCCOCc1ccccc1C 7a_100000210253_100000211839 [0,1,0,1,0,0|1,0,1]=4 2638 B14R1.882 CCCCCOCc1ccccc1C 7a_100000698903_100000210326 [0,1,0,1,0,0|1,0,1]=4 2639 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210253_100000187162 [0,1,0,1,0,0|1,0,1]=4 2640 B14R1.882 CCCCCOCc1ccccc1Cl 34a_100000210847_100000718602 [0,1,0,1,0,0|1,0,1]=4 2641 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210253_100000187162 [0,1,0,1,0,0|1,0,1]=4 2642 B14R1.882 CCCCCOCc1ccccc1Cl 7a_100000210847_100000210326 [0,1,0,1,0,0|1,0,1]=4 2643 B14R1.882 CCCCCOCc1ccccc1F 34a_100000210253_100000211605 [0,1,0,1,0,0|1,0,1]=4 2644 B14R1.882 CCCCCOCc1ccccc1F 34a_100000211962_100000718602 [0,1,0,1,0,0|1,0,1]=4 2645 B14R1.882 CCCCCOCc1ccccc1F 7a_100000210253_100000211605 [0,1,0,1,0,0|1,0,1]=4 2646 B14R1.882 CCCCCOCc1ccccc1F 7a_100000211962_100000210326 [0,1,0,1,0,0|1,0,1]=4 2647 B14R1.882 CCCCCOCc1ccccc1I 34a_100000187465_100000718602 [0,1,0,1,0,0|1,0,1]=4 2648 B14R1.882 CCCCCOCc1ccccc1I 34a_100000210253_100011215278 [0,1,0,1,0,0|1,0,1]=4 2649 B14R1.882 CCCCCOCc1ccccc1I 7a_100000187465_100000210326 [0,1,0,1,0,0|1,0,1]=4 2650 B14R1.882 CCCCCOCc1ccccc1I 7a_100000210253_100011215278 [0,1,0,1,0,0|1,0,1]=4 2651 B14R1.882 CCCCCOCc1ccccc1N 34a_100000212039_100000718602 [0,1,0,1,0,0|1,0,1]=4 2652 B14R1.882 CCCCCOCc1cccnc1Br 34a_100000210253_100010140945 [0,1,0,1,0,0|2,0,0]=4 2653 B14R1.882 CCCCCOCc1cccnc1Br 34a_100000719692_100000718602 [0,1,0,1,0,0|2,0,0]=4 2654 B14R1.882 CCCCCOCc1cccnc1Br 7a_100000210253_100010140945 [0,1,0,1,0,0|2,0,0]=4 2655 B14R1.882 CCCCCOCc1cccnc1Br 7a_100000719692_100000210326 [0,1,0,1,0,0|2,0,0]=4 2656 B14R1.882 CCCCCOCc1cccnc1C 34a_100000210253_100000732876 [0,1,0,1,0,0|2,0,0]=4 2657 B14R1.882 CCCCCOCc1cccnc1C 34a_100000729262_100000718602 [0,1,0,1,0,0|2,0,0]=4 2658 B14R1.882 CCCCCOCc1cccnc1C 7a_100000210253_100000732876 [0,1,0,1,0,0|2,0,0]=4 2659 B14R1.882 CCCCCOCc1cccnc1C 7a_100000729262_100000210326 [0,1,0,1,0,0|2,0,0]=4 2660 B14R1.882 CCCCCOCc1cccnc1Cl 34a_100000210253_100000045678 [0,1,0,1,0,0|2,0,0]=4 2661 B14R1.882 CCCCCOCc1cccnc1Cl 34a_100000748726_100000718602 [0,1,0,1,0,0|2,0,0]=4 2662 B14R1.882 CCCCCOCc1cccnc1Cl 7a_100000210253_100000045678 [0,1,0,1,0,0|2,0,0]=4 2663 B14R1.882 CCCCCOCc1cccnc1Cl 7a_100000748726_100000210326 [0,1,0,1,0,0|2,0,0]=4 2664 B14R1.882 CCCCCOCc1cccnc1F 34a_100000079888_100000718602 [0,1,0,1,0,0|2,0,0]=4 2665 B14R1.882 CCCCCOCc1cccnc1F 34a_100000210253_100000099810 [0,1,0,1,0,0|2,0,0]=4 2666 B14R1.882 CCCCCOCc1cccnc1F 7a_100000079888_100000210326 [0,1,0,1,0,0|2,0,0]=4 2667 B14R1.882 CCCCCOCc1cccnc1F 7a_100000210253_100000099810 [0,1,0,1,0,0|2,0,0]=4 2668 B14R1.882 CCCCCOCc1ccncc1C 34a_100000210253_100020672809 [0,1,0,1,0,0|2,0,0]=4 2669 B14R1.882 CCCCCOCc1ccncc1C 34a_100011997032_100000718602 [0,1,0,1,0,0|2,0,0]=4 2670 B14R1.882 CCCCCOCc1ccncc1C 7a_100000210253_100020672808 [0,1,0,1,0,0|2,0,0]=4 2671 B14R1.882 CCCCCOCc1ccncc1Cl 7a_100000210253_100000763264 [0,1,0,1,0,0|2,0,0]=4 2672 B14R1.882 CCCCCOCc1ccncc1F 34a_100012172863_100000718602 [0,1,0,1,0,0|2,0,0]=4 2673 B14R1.882 CCCCCOCc1cnccc1C 34a_100000210253_100000690890 [0,1,0,1,0,0|2,0,0]=4 2674 B14R1.882 CCCCCOCc1cnccc1C 34a_100011996381_100000718602 [0,1,0,1,0,0|2,0,0]=4 2675 B14R1.882 CCCCCOCc1cnccc1C 7a_100000210253_100000690890 [0,1,0,1,0,0|2,0,0]=4 2676 B14R1.882 CCCCCOCc1cnccc1Cl 34a_100000117392_100000718602 [0,1,0,1,0,0|2,0,0]=4 2677 B14R1.882 CCCCCOCc1ncccc1Br 34a_100000210253_100025702911 [0,1,0,1,0,0|2,0,0]=4 2678 B14R1.882 CCCCCOCc1ncccc1Br 34a_100011996772_100000718602 [0,1,0,1,0,0|2,0,0]=4 2679 B14R1.882 CCCCCOCc1ncccc1Br 7a_100000210253_100025702911 [0,1,0,1,0,0|2,0,0]=4 2680 B14R1.882 CCCCCOCc1ncccc1C 34a_100000210253_100000696600 [0,1,0,1,0,0|2,0,0]=4 2681 B14R1.882 CCCCCOCc1ncccc1C 34a_100000698912_100000718602 [0,1,0,1,0,0|2,0,0]=4 2682 B14R1.882 CCCCCOCc1ncccc1C 7a_100000210253_100000696600 [0,1,0,1,0,0|2,0,0]=4 2683 B14R1.882 CCCCCOCc1ncccc1Cl 34a_100012002383_100000718602 [0,1,0,1,0,0|2,0,0]=4 2684 B14R1.882 CCCCCOCc1ncccc1Cl 7a_100000210253_100000099807 [0,1,0,1,0,0|2,0,0]=4 2685 B14R1.882 CCCCCOCc1ncccc1F 34a_100000210253_100000104219 [0,1,0,1,0,0|2,0,0]=4 2686 B14R1.882 CCCCCOCc1ncccc1F 34a_100011934865_100000718602 [0,1,0,1,0,0|2,0,0]=4 2687 B14R1.882 CCCCCOCc1ncccc1F 7a_100000210253_100000104219 [0,1,0,1,0,0|2,0,0]=4 2688 B14R1.882 CCCCCOCc1ncccc1N 34a_114873767017_100000718602 [0,1,0,1,0,0|2,0,0]=4 2689 B14R1.882 CCCCCOCc1ncccc1O 34a_100000210253_200020655725 [0,1,0,1,0,0|1,0,1]=4 2690 B14R1.882 CCCCCOCc1ncccc1O 7a_100000210253_200020655725 [0,1,0,1,0,0|1,0,1]=4 2691 B14R1.882 CCCCCSCc1ccccc1Br 62a_100000184730_100000210326 [0,1,0,1,0,0|1,0,1]=4 2692 B14R1.882 CCCCCSCc1ccccc1Br 62a_100000210326_100000184730 [0,1,0,1,0,0|1,0,1]=4 2693 B14R1.882 CCCCCSCc1ccccc1C 62a_100000210326_100000211839 [0,1,0,1,0,0|1,0,1]=4 2694 B14R1.882 CCCCCSCc1ccccc1C 62a_100000211839_100000210326 [0,1,0,1,0,0|1,0,1]=4 2695 B14R1.882 CCCCCSCc1ccccc1Cl 62a_100000187162_100000210326 [0,1,0,1,0,0|1,0,1]=4 2696 B14R1.882 CCCCCSCc1ccccc1Cl 62a_100000210326_100000187162 [0,1,0,1,0,0|1,0,1]=4 2697 B14R1.882 CCCCCSCc1ccccc1F 62a_100000210326_100000211605 [0,1,0,1,0,0|1,0,1]=4 2698 B14R1.882 CCCCCSCc1ccccc1F 62a_100000211605_100000210326 [0,1,0,1,0,0|1,0,1]=4 2699 B14R1.882 CCCCCSCc1ccccc1I 62a_100000210326_100011216222 [0,1,0,1,0,0|1,0,1]=4 2700 B14R1.882 CCCCCSCc1ccccc1I 62a_100011216222_100000210326 [0,1,0,1,0,0|1,0,1]=4 2701 B14R1.882 CCCCCSCc1cccnc1Br 62a_100000210326_100010140945 [0,1,0,1,0,0|2,0,0]=4 2702 B14R1.882 CCCCCSCc1cccnc1Br 62a_100010140945_100000210326 [0,1,0,1,0,0|2,0,0]=4 2703 B14R1.882 CCCCCSCc1cccnc1C 62a_100000210326_100000732876 [0,1,0,1,0,0|2,0,0]=4 2704 B14R1.882 CCCCCSCc1cccnc1C 62a_100000732876_100000210326 [0,1,0,1,0,0|2,0,0]=4 2705 B14R1.882 CCCCCSCc1cccnc1Cl 62a_100000045678_100000210326 [0,1,0,1,0,0|2,0,0]=4 2706 B14R1.882 CCCCCSCc1cccnc1Cl 62a_100000210326_100000045678 [0,1,0,1,0,0|2,0,0]=4 2707 B14R1.882 CCCCCSCc1cccnc1F 62a_100000099810_100000210326 [0,1,0,1,0,0|2,0,0]=4 2708 B14R1.882 CCCCCSCc1cccnc1F 62a_100000210326_100000099810 [0,1,0,1,0,0|2,0,0]=4 2709 B14R1.882 CCCCCSCc1ccncc1C 62a_100000210326_100020672808 [0,1,0,1,0,0|2,0,0]=4 2710 B14R1.882 CCCCCSCc1ccncc1C 62a_100020672808_100000210326 [0,1,0,1,0,0|2,0,0]=4 2711 B14R1.882 CCCCCSCc1ccncc1Cl 62a_100000210326_100000763264 [0,1,0,1,0,0|2,0,0]=4 2712 B14R1.882 CCCCCSCc1ccncc1Cl 62a_100000763264_100000210326 [0,1,0,1,0,0|2,0,0]=4 2713 B14R1.882 CCCCCSCc1cnccc1C 62a_100000210326_100000690890 [0,1,0,1,0,0|2,0,0]=4 2714 B14R1.882 CCCCCSCc1cnccc1C 62a_100000690890_100000210326 [0,1,0,1,0,0|2,0,0]=4 2715 B14R1.882 CCCCCSCc1ncccc1Br 62a_100000210326_100025702911 [0,1,0,1,0,0|2,0,0]=4 2716 B14R1.882 CCCCCSCc1ncccc1Br 62a_100025702911_100000210326 [0,1,0,1,0,0|2,0,0]=4 2717 B14R1.882 CCCCCSCc1ncccc1C 62a_100000210326_100000696600 [0,1,0,1,0,0|2,0,0]=4 2718 B14R1.882 CCCCCSCc1ncccc1C 62a_100000696600_100000210326 [0,1,0,1,0,0|2,0,0]=4 2719 B14R1.882 CCCCCSCc1ncccc1Cl 62a_100000099807_100000210326 [0,1,0,1,0,0|2,0,0]=4 2720 B14R1.882 CCCCCSCc1ncccc1Cl 62a_100000210326_100000099807 [0,1,0,1,0,0|2,0,0]=4 2721 B14R1.882 CCCCCSCc1ncccc1F 62a_100000104219_100000210326 [0,1,0,1,0,0|2,0,0]=4 2722 B14R1.882 CCCCCSCc1ncccc1F 62a_100000210326_100000104219 [0,1,0,1,0,0|2,0,0]=4 2723 B14R1.882 CCCCCSCc1ncccc1O 62a_100000210326_200020655725 [0,1,0,1,0,0|1,0,1]=4 2724 B14R1.882 CCCCCSCc1ncccc1O 62a_200020655725_100000210326 [0,1,0,1,0,0|1,0,1]=4 2725 B14R1.882 CCCCNCCc1ccccc1Br 2230a_100000102301_100012161201 [0,1,0,1,0,0|1,0,1]=4 2726 B14R1.882 CCCCNCCc1ccccc1Br 2230a_100000747383_100000210211 [0,1,0,1,0,0|1,0,1]=4 2727 B14R1.882 CCCCNCCc1ccccc1Br 34a_100000747383_100000210210 [0,1,0,1,0,0|1,0,1]=4 2728 B14R1.882 CCCCNCCc1ccccc1Br 7a_106832991798_100012161201 [0,1,0,1,0,0|1,0,1]=4 2729 B14R1.882 CCCCNCCc1ccccc1C 2230a_100000102301_100011713688 [0,1,0,1,0,0|1,0,1]=4 2730 B14R1.882 CCCCNCCc1ccccc1C 2230a_100000685071_100000210211 [0,1,0,1,0,0|1,0,1]=4 2731 B14R1.882 CCCCNCCc1ccccc1C 34a_100000685071_100000210210 [0,1,0,1,0,0|1,0,1]=4 2732 B14R1.882 CCCCNCCc1ccccc1C 7a_106832991798_100011713688 [0,1,0,1,0,0|1,0,1]=4 2733 B14R1.882 CCCCNCCc1ccccc1Cl 2230a_100000102301_100011713703 [0,1,0,1,0,0|1,0,1]=4 2734 B14R1.882 CCCCNCCc1ccccc1Cl 2230a_100011207228_100000210211 [0,1,0,1,0,0|1,0,1]=4 2735 B14R1.882 CCCCNCCc1ccccc1Cl 270004a_100000102301_200011713468 [0,1,0,1,0,0|1,0,1]=4 2736 B14R1.882 CCCCNCCc1ccccc1Cl 34a_100011207228_100000210210 [0,1,0,1,0,0|1,0,1]=4 2737 B14R1.882 CCCCNCCc1ccccc1Cl 7a_106832991798_100011713703 [0,1,0,1,0,0|1,0,1]=4 2738 B14R1.882 CCCCNCCc1ccccc1F 2230a_100000102301_100011713696 [0,1,0,1,0,0|1,0,1]=4 2739 B14R1.882 CCCCNCCc1ccccc1F 2230a_100000185272_100000210211 [0,1,0,1,0,0|1,0,1]=4 2740 B14R1.882 CCCCNCCc1ccccc1F 34a_100000185272_100000210210 [0,1,0,1,0,0|1,0,1]=4 2741 B14R1.882 CCCCNCCc1ccccc1F 7a_106832991798_100000720011 [0,1,0,1,0,0|1,0,1]=4 2742 B14R1.882 CCCCNCCc1ccccc1O 34a_100011207237_100000210210 [0,1,0,1,0,0|0,0,2]=4 2743 B14R1.882 CCCCNCCc1ccccc1O 7a_106832991798_100000722297 [0,1,0,1,0,0|0,0,2]=4 2744 B14R1.882 CCCCNCCn1ccccc1=O 2230a_100000687133_100000210211 [0,1,0,1,0,0|1,0,0]=3 2745 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000210227_100012161201 [0,1,0,1,0,0|1,0,1]=4 2746 B14R1.882 CCCCOCCc1ccccc1Br 34a_100000731337_100000210210 [0,1,0,1,0,0|1,0,1]=4 2747 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000210227_100012161201 [0,1,0,1,0,0|1,0,1]=4 2748 B14R1.882 CCCCOCCc1ccccc1Br 7a_100000731337_100000210211 [0,1,0,1,0,0|1,0,1]=4 2749 B14R1.882 CCCCOCCc1ccccc1C 34a_100000210227_100011713688 [0,1,0,1,0,0|1,0,1]=4 2750 B14R1.882 CCCCOCCc1ccccc1C 34a_100011220023_100000210210 [0,1,0,1,0,0|1,0,1]=4 2751 B14R1.882 CCCCOCCc1ccccc1C 7a_100000210227_100011713688 [0,1,0,1,0,0|1,0,1]=4 2752 B14R1.882 CCCCOCCc1ccccc1C 7a_100011220023_100000210211 [0,1,0,1,0,0|1,0,1]=4 2753 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100000210227_100011713703 [0,1,0,1,0,0|1,0,1]=4 2754 B14R1.882 CCCCOCCc1ccccc1Cl 34a_100011215284_100000210210 [0,1,0,1,0,0|1,0,1]=4 2755 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100000210227_100011713703 [0,1,0,1,0,0|1,0,1]=4 2756 B14R1.882 CCCCOCCc1ccccc1Cl 7a_100011215284_100000210211 [0,1,0,1,0,0|1,0,1]=4 2757 B14R1.882 CCCCOCCc1ccccc1F 34a_100000210227_100000720011 [0,1,0,1,0,0|1,0,1]=4 2758 B14R1.882 CCCCOCCc1ccccc1F 34a_100000753711_100000210210 [0,1,0,1,0,0|1,0,1]=4 2759 B14R1.882 CCCCOCCc1ccccc1F 7a_100000210227_100000720011 [0,1,0,1,0,0|1,0,1]=4 2760 B14R1.882 CCCCOCCc1ccccc1F 7a_100000753711_100000210211 [0,1,0,1,0,0|1,0,1]=4 2761 B14R1.882 CCCCOCCc1ccccc1I 34a_100010255290_100000210210 [0,1,0,1,0,0|1,0,1]=4 2762 B14R1.882 CCCCOCCc1ccccc1I 7a_100010255290_100000210211 [0,1,0,1,0,0|1,0,1]=4 2763 B14R1.882 CCCCOCCc1ccccc1N 34a_100011215289_100000210210 [0,1,0,1,0,0|1,0,1]=4 2764 B14R1.882 CCCCOCCc1ccccc1O 34a_100000210227_100000722297 [0,1,0,1,0,0|0,0,2]=4 2765 B14R1.882 CCCCOCCc1ccccc1O 7a_100000210227_100000722297 [0,1,0,1,0,0|0,0,2]=4 2766 B14R1.882 CCCCOCCc1ncccc1C 34a_100011997706_100000210210 [0,1,0,1,0,0|2,0,0]=4 2767 B14R1.882 CCCCOCCc1ncccc1C 7a_100011997706_100000210211 [0,1,0,1,0,0|2,0,0]=4 2768 B14R1.882 CCCCOCOc1cccoc1=O 34a_100000077404_100011995733 [0,1,0,1,0,0|2,0,0]=4 2769 B14R1.882 CCCCOCOc1coccc1=O 34a_100000060831_100011995733 [0,1,0,1,0,0|2,0,0]=4 2770 B14R1.882 CCCCOCSc1c[nH]ccc1=O 62a_100009998708_100011995733 [0,1,0,1,0,0|2,0,0]=4 2771 B14R1.882 CCCCOCSc1c[nH]ccc1=O 62a_100011995733_100009998708 [0,1,0,1,0,0|2,0,0]=4 2772 B14R1.882 CCCCSCCc1ccccc1Br 62a_100000210211_100012161201 [0,1,0,1,0,0|1,0,1]=4 2773 B14R1.882 CCCCSCCc1ccccc1Br 62a_100012161201_100000210210 [0,1,0,1,0,0|1,0,1]=4 2774 B14R1.882 CCCCSCCc1ccccc1C 62a_100000210211_100011713688 [0,1,0,1,0,0|1,0,1]=4 2775 B14R1.882 CCCCSCCc1ccccc1C 62a_100011713688_100000210210 [0,1,0,1,0,0|1,0,1]=4 2776 B14R1.882 CCCCSCCc1ccccc1Cl 62a_100000210211_100011713703 [0,1,0,1,0,0|1,0,1]=4 2777 B14R1.882 CCCCSCCc1ccccc1Cl 62a_100011713703_100000210210 [0,1,0,1,0,0|1,0,1]=4 2778 B14R1.882 CCCCSCCc1ccccc1F 62a_100000210211_100011713696 [0,1,0,1,0,0|1,0,1]=4 2779 B14R1.882 CCCCSCCc1ccccc1F 62a_100011713696_100000210210 [0,1,0,1,0,0|1,0,1]=4 2780 B14R1.882 CCCCSCCc1ccccc1O 62a_100000210211_100000722297 [0,1,0,1,0,0|0,0,2]=4 2781 B14R1.882 CCCCSCCc1ccccc1O 62a_100000722297_100000210210 [0,1,0,1,0,0|0,0,2]=4 2782 B14R1.882 CCCNCCCc1ccccc1F 2230a_100000724733_100000210303 [0,1,0,1,0,0|1,0,1]=4 2783 B14R1.882 CCCNCCCc1ccccc1F 34a_100000724733_100000210303 [0,1,0,1,0,0|1,0,1]=4 2784 B14R1.882 CCCOCCCc1ccccc1Br 34a_100000210258_200011713681 [0,1,0,1,0,0|1,0,1]=4 2785 B14R1.882 CCCOCCCc1ccccc1Br 34a_100000699526_100000210303 [0,1,0,1,0,0|1,0,1]=4 2786 B14R1.882 CCCOCCCc1ccccc1Br 7a_100000699526_100000210303 [0,1,0,1,0,0|1,0,1]=4 2787 B14R1.882 CCCOCCCc1ccccc1Cl 34a_100011709251_100000210303 [0,1,0,1,0,0|1,0,1]=4 2788 B14R1.882 CCCOCCCc1ccccc1Cl 7a_100011709251_100000210303 [0,1,0,1,0,0|1,0,1]=4 2789 B14R1.882 CCCOCCCc1ccccc1F 34a_100011709249_100000210303 [0,1,0,1,0,0|1,0,1]=4 2790 B14R1.882 CCCOCCCc1ccccc1F 7a_100011709249_100000210303 [0,1,0,1,0,0|1,0,1]=4 2791 B14R1.882 CCCOCCOc1cccoc1=O 34a_100000077404_100011215938 [0,1,0,1,0,0|2,0,0]=4 2792 B14R1.882 CCCOCCOc1cccoc1=O 7a_100000077404_100011215938 [0,1,0,1,0,0|2,0,0]=4 2793 B14R1.882 CCCOCCOc1coccc1=O 34a_100000060831_100011215938 [0,1,0,1,0,0|2,0,0]=4 2794 B14R1.882 CCCOCCSc1c[nH]ccc1=O 62a_100009998708_100011215938 [0,1,0,1,0,0|2,0,0]=4 2795 B14R1.882 CCCOCCSc1c[nH]ccc1=O 62a_100011215938_100009998708 [0,1,0,1,0,0|2,0,0]=4 2796 B14R1.882 CCCSCCCc1ccccc1Br 62a_100000210303_200011713681 [0,1,0,1,0,0|1,0,1]=4 2797 B14R1.882 CCCSCCCc1ccccc1Br 62a_200011713681_100000210303 [0,1,0,1,0,0|1,0,1]=4 2798 B14R1.882 CCOCCCCc1ccccc1Br 34a_100012092669_100000210202 [0,1,0,1,0,0|1,0,1]=4 2799 B14R1.882 CCOCCCCc1ccccc1Br 7a_100012092669_100000210202 [0,1,0,1,0,0|1,0,1]=4 2800 B14R1.882 CCOCCCOc1cccoc1=O 34a_100000077404_100012232248 [0,1,0,1,0,0|2,0,0]=4 2801 B14R1.882 CCOCCCOc1cccoc1=O 7a_100000077404_100012232248 [0,1,0,1,0,0|2,0,0]=4 2802 B14R1.882 CCOCCCOc1coccc1=O 34a_100000060831_100012232248 [0,1,0,1,0,0|2,0,0]=4 2803 B14R1.882 CCOCCCSc1c[nH]ccc1=O 62a_100009998708_100012232248 [0,1,0,1,0,0|2,0,0]=4 2804 B14R1.882 CCOCCCSc1c[nH]ccc1=O 62a_100012232248_100009998708 [0,1,0,1,0,0|2,0,0]=4 2805 B14R1.882 COCCCCOc1cccoc1=O 34a_100000077404_100000755781 [0,1,0,1,0,0|2,0,0]=4 2806 B14R1.882 COCCCCOc1cccoc1=O 7a_100000077404_100000730899 [0,1,0,1,0,0|2,0,0]=4 2807 B14R1.882 COCCCCOc1coccc1=O 34a_100000060831_100000755781 [0,1,0,1,0,0|2,0,0]=4 2808 B14R1.882 COCCCCSc1c[nH]ccc1=O 62a_100000730899_100009998708 [0,1,0,1,0,0|2,0,0]=4 2809 B14R1.882 COCCCCSc1c[nH]ccc1=O 62a_100009998708_100000730899 [0,1,0,1,0,0|2,0,0]=4 2810 B14R1.882 COCCNCCn1ccccc1=O 2230a_100000687133_100011201679 [0,1,0,1,0,0|2,0,0]=4 2811 B14R1.882 CSCCNCCn1ccccc1=O 2230a_100000687133_100000751147 [0,1,0,1,0,0|2,0,0]=4 2812 B14R1.882 O=c1cc[nH]cc1SCCCCCF 62a_100000729378_100009998708 [0,1,0,1,0,0|2,0,0]=4 2813 B14R1.882 O=c1cc[nH]cc1SCCCCCF 62a_100009998708_100000729378 [0,1,0,1,0,0|2,0,0]=4 2814 B14R1.882 O=c1cc[nH]cc1SCCCCCO 62a_100000746330_100009998708 [0,1,0,1,0,0|2,0,0]=4 2815 B14R1.882 O=c1cc[nH]cc1SCCCCCO 62a_100009998708_100000746330 [0,1,0,1,0,0|2,0,0]=4 2816 B14R1.882 O=c1ccccn1CCNCCCF 2230a_100000687133_100011934791 [0,1,0,1,0,0|2,0,0]=4 2817 B14R1.882 O=c1ccccn1CCNCCCO 2230a_100000687133_100000230001 [0,1,0,1,0,0|2,0,0]=4 2818 B14R1.882 O=c1ccocc1OCCCCCF 34a_100000060831_100000729378 [0,1,0,1,0,0|2,0,0]=4 2819 B14R1.882 O=c1ccocc1OCCCCCO 34a_100000060831_100000746330 [0,1,0,1,0,0|2,0,0]=4 2820 B14R1.882 O=c1occcc1OCCCCCF 34a_100000077404_100000729378 [0,1,0,1,0,0|2,0,0]=4 2821 B14R1.882 O=c1occcc1OCCCCCF 7a_100000077404_100000729378 [0,1,0,1,0,0|2,0,0]=4 2822 B14R1.882 O=c1occcc1OCCCCCO 34a_100000077404_100000746330 [0,1,0,1,0,0|2,0,0]=4 2823 B14R1.882 O=c1occcc1OCCCCCO 7a_100000077404_100000746330 [0,1,0,1,0,0|2,0,0]=4 2824 B14R1.939 C=CC=CC(=O)N1CCCCC1CC 1626a_100000210034_100016291481 [0,1,0,1,0,0|2,0,0]=4 2825 B14R1.946 C=CC=CC(=O)NC1CCCCC1C 1626a_100000211402_100016291481 [0,1,0,1,0,0|2,0,0]=4 2826 B14R1.946 CCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210211 [0,1,0,1,0,0|1,0,1]=4 2827 B14R1.2470 C=CC=CC(=O)N1CCCCCCC1 1626a_100000211400_100016291481 [0,1,0,1,0,0|2,0,0]=4 2828 B14R1.2596 C=CC=CC(=O)CC1CCCCCC1 1458a_100016291481_200000696569 [0,1,0,1,0,0|1,0,1]=4 2829 B14R1.2596 C=CC=CC(=O)NC1CCCCCC1 1626a_100000210984_100016291481 [0,1,0,1,0,0|2,0,0]=4 2830 B14R1.14 CCCCCCCc1ccc(cc1)O 271570a_203496583355_100009813667 [0,1,0,1,0,0|1,0,0]=3 2831 B14R1.14 CCCCCCNc1ccc(cc1)Br 2230a_100000210018_100000210314 [0,1,0,1,0,0|2,0,0]=4 2832 B14R1.14 CCCCCCNc1ccc(cc1)Br 34a_100000210018_100000210314 [0,1,0,1,0,0|2,0,0]=4 2833 B14R1.14 CCCCCCNc1ccc(cc1)C 34a_100000124888_100000210314 [0,1,0,1,0,0|2,0,0]=4 2834 B14R1.14 CCCCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210314 [0,1,0,1,0,0|2,0,0]=4 2835 B14R1.14 CCCCCCNc1ccc(cc1)Cl 34a_100000210052_100000210314 [0,1,0,1,0,0|2,0,0]=4 2836 B14R1.14 CCCCCCNc1ccc(cc1)F 34a_100000185862_100000210314 [0,1,0,1,0,0|2,0,0]=4 2837 B14R1.14 CCCCCCNc1ccc(cc1)I 34a_100000185761_100000210314 [0,1,0,1,0,0|2,0,0]=4 2838 B14R1.14 CCCCCCNc1ccc(cc1)O 34a_100000185829_100000210314 [0,1,0,1,0,0|2,0,0]=4 2839 B14R1.14 CCCCCCNc1ccc(cn1)Br 27a_100000210581_100000686858 [0,1,0,1,0,0|2,0,0]=4 2840 B14R1.14 CCCCCCOc1ccc(cc1)Br 34a_100000185759_100000210314 [0,1,0,1,0,0|2,0,0]=4 2841 B14R1.14 CCCCCCOc1ccc(cc1)Br 7a_100000185759_100000210314 [0,1,0,1,0,0|2,0,0]=4 2842 B14R1.14 CCCCCCOc1ccc(cc1)C 34a_100000210336_100000210314 [0,1,0,1,0,0|2,0,0]=4 2843 B14R1.14 CCCCCCOc1ccc(cc1)C 7a_100000210336_100000210314 [0,1,0,1,0,0|2,0,0]=4 2844 B14R1.14 CCCCCCOc1ccc(cc1)Cl 34a_100000210216_100000210314 [0,1,0,1,0,0|2,0,0]=4 2845 B14R1.14 CCCCCCOc1ccc(cc1)Cl 7a_100000210216_100000210314 [0,1,0,1,0,0|2,0,0]=4 2846 B14R1.14 CCCCCCOc1ccc(cc1)F 34a_100000210339_100000210314 [0,1,0,1,0,0|2,0,0]=4 2847 B14R1.14 CCCCCCOc1ccc(cc1)I 34a_100000212066_100000210314 [0,1,0,1,0,0|2,0,0]=4 2848 B14R1.14 CCCCCCOc1ccc(cc1)I 7a_100000212066_100000210314 [0,1,0,1,0,0|2,0,0]=4 2849 B14R1.14 CCCCCCOc1ccc(cc1)N 34a_100000185829_100000210314 [0,1,0,1,0,0|2,0,0]=4 2850 B14R1.14 CCCCCCOc1ccc(cc1)O 271570a_203496583355_100011216197 [0,1,0,1,0,0|2,0,0]=4 2851 B14R1.14 CCCCCCOc1ccc(cn1)C 34a_100000759353_100000210314 [0,1,0,1,0,0|2,0,0]=4 2852 B14R1.14 CCCCCCOc1ccc(cn1)Cl 34a_100011215309_100000210314 [0,1,0,1,0,0|2,0,0]=4 2853 B14R1.14 CCCCCCOc1ccc(cn1)F 34a_100000742473_100000210314 [0,1,0,1,0,0|2,0,0]=4 2854 B14R1.14 CCCCCCOc1ccc(cn1)N 34a_100000729260_100000210314 [0,1,0,1,0,0|2,0,0]=4 2855 B14R1.14 CCCCCCSc1ccc(cc1)Br 62a_100000210314_100000752885 [0,1,0,1,0,0|2,0,0]=4 2856 B14R1.14 CCCCCCSc1ccc(cc1)Br 62a_100000752885_100000210757 [0,1,0,1,0,0|2,0,0]=4 2857 B14R1.14 CCCCCCSc1ccc(cc1)C 62a_100000186775_100000210757 [0,1,0,1,0,0|2,0,0]=4 2858 B14R1.14 CCCCCCSc1ccc(cc1)C 62a_100000210314_100000186775 [0,1,0,1,0,0|2,0,0]=4 2859 B14R1.14 CCCCCCSc1ccc(cc1)Cl 62a_100000210314_100000755918 [0,1,0,1,0,0|2,0,0]=4 2860 B14R1.14 CCCCCCSc1ccc(cc1)Cl 62a_100000755918_100000210757 [0,1,0,1,0,0|2,0,0]=4 2861 B14R1.14 CCCCCCSc1ccc(cc1)F 62a_100000210314_100000211213 [0,1,0,1,0,0|2,0,0]=4 2862 B14R1.14 CCCCCCSc1ccc(cc1)F 62a_100000211213_100000210757 [0,1,0,1,0,0|2,0,0]=4 2863 B14R1.14 CCCCCCSc1ccc(cc1)N 62a_100000185761_100000210757 [0,1,0,1,0,0|2,0,0]=4 2864 B14R1.14 CCCCCCSc1ccc(cc1)N 62a_100000210314_100000185761 [0,1,0,1,0,0|2,0,0]=4 2865 B14R1.14 CCCCCCSc1ccc(cc1)O 62a_100000210314_100000185759 [0,1,0,1,0,0|2,0,0]=4 2866 B14R1.14 CCCCCCSc1ccc(cn1)Br 62a_100000210314_100000686858 [0,1,0,1,0,0|2,0,0]=4 2867 B14R1.14 CCCCCCSc1ccc(cn1)Br 62a_100000686858_100000210757 [0,1,0,1,0,0|2,0,0]=4 2868 B14R1.14 CCCCCCSc1ccc(cn1)C 62a_100000210314_100000754016 [0,1,0,1,0,0|2,0,0]=4 2869 B14R1.14 CCCCCCSc1ccc(cn1)C 62a_100011192072_100000210757 [0,1,0,1,0,0|2,0,0]=4 2870 B14R1.14 CCCCCCSc1ccc(cn1)Cl 62a_100000210314_100011356976 [0,1,0,1,0,0|2,0,0]=4 2871 B14R1.14 CCCCCCSc1ccc(cn1)Cl 62a_100011356976_100000210757 [0,1,0,1,0,0|2,0,0]=4 2872 B14R1.14 CCCCCCSc1ccc(cn1)F 62a_100000210314_100000744514 [0,1,0,1,0,0|2,0,0]=4 2873 B14R1.14 CCCCCCSc1ccc(cn1)F 62a_100000744514_100000210757 [0,1,0,1,0,0|2,0,0]=4 2874 B14R1.14 CCCCCCSc1ccc(cn1)N 62a_100000210314_100000737798 [0,1,0,1,0,0|2,0,0]=4 2875 B14R1.14 CCCCCCSc1ccc(cn1)N 62a_100000737798_100000210757 [0,1,0,1,0,0|2,0,0]=4 2876 B14R1.14 CCCCCCSc1ccc(cn1)O 62a_100000210314_100000744096 [0,1,0,1,0,0|2,0,0]=4 2877 B14R1.14 CCCCCCSc1ccc(cn1)O 62a_100000685995_100000210757 [0,1,0,1,0,0|2,0,0]=4 2878 B14R1.14 CCCCCNCc1ccc(cc1)Br 207a_100000209983_100000186029 [0,1,0,1,0,0|2,0,0]=4 2879 B14R1.14 CCCCCNCc1ccc(cc1)Br 2230a_100000174875_100000210326 [0,1,0,1,0,0|2,0,0]=4 2880 B14R1.14 CCCCCNCc1ccc(cc1)Br 2230a_100000209983_100011217064 [0,1,0,1,0,0|2,0,0]=4 2881 B14R1.14 CCCCCNCc1ccc(cc1)Br 270004a_100000209983_100000186029 [0,1,0,1,0,0|2,0,0]=4 2882 B14R1.14 CCCCCNCc1ccc(cc1)Br 34a_100000174875_100000718602 [0,1,0,1,0,0|2,0,0]=4 2883 B14R1.14 CCCCCNCc1ccc(cc1)C 207a_100000209983_100000211033 [0,1,0,1,0,0|2,0,0]=4 2884 B14R1.14 CCCCCNCc1ccc(cc1)C 2230a_100000174908_100000210326 [0,1,0,1,0,0|2,0,0]=4 2885 B14R1.14 CCCCCNCc1ccc(cc1)C 2230a_100000209983_100000210814 [0,1,0,1,0,0|2,0,0]=4 2886 B14R1.14 CCCCCNCc1ccc(cc1)C 270004a_100000209983_100000211033 [0,1,0,1,0,0|2,0,0]=4 2887 B14R1.14 CCCCCNCc1ccc(cc1)C 34a_100000174908_100000718602 [0,1,0,1,0,0|2,0,0]=4 2888 B14R1.14 CCCCCNCc1ccc(cc1)Cl 207a_100000209983_100000189385 [0,1,0,1,0,0|2,0,0]=4 2889 B14R1.14 CCCCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210326 [0,1,0,1,0,0|2,0,0]=4 2890 B14R1.14 CCCCCNCc1ccc(cc1)Cl 2230a_100000209983_100000694040 [0,1,0,1,0,0|2,0,0]=4 2891 B14R1.14 CCCCCNCc1ccc(cc1)Cl 270004a_100000209983_100000189385 [0,1,0,1,0,0|2,0,0]=4 2892 B14R1.14 CCCCCNCc1ccc(cc1)Cl 34a_100000174871_100000718602 [0,1,0,1,0,0|2,0,0]=4 2893 B14R1.14 CCCCCNCc1ccc(cc1)F 207a_100000209983_100000210084 [0,1,0,1,0,0|2,0,0]=4 2894 B14R1.14 CCCCCNCc1ccc(cc1)F 2230a_100000174882_100000210326 [0,1,0,1,0,0|2,0,0]=4 2895 B14R1.14 CCCCCNCc1ccc(cc1)F 2230a_100000209983_100000198546 [0,1,0,1,0,0|2,0,0]=4 2896 B14R1.14 CCCCCNCc1ccc(cc1)F 270004a_100000209983_100000210084 [0,1,0,1,0,0|2,0,0]=4 2897 B14R1.14 CCCCCNCc1ccc(cc1)F 34a_100000174882_100000718602 [0,1,0,1,0,0|2,0,0]=4 2898 B14R1.14 CCCCCNCc1ccc(cc1)I 207a_100000209983_100000188517 [0,1,0,1,0,0|2,0,0]=4 2899 B14R1.14 CCCCCNCc1ccc(cc1)I 2230a_100000209983_100000189116 [0,1,0,1,0,0|2,0,0]=4 2900 B14R1.14 CCCCCNCc1ccc(cc1)I 2230a_100016989417_100000210326 [0,1,0,1,0,0|2,0,0]=4 2901 B14R1.14 CCCCCNCc1ccc(cc1)I 34a_100016989417_100000718602 [0,1,0,1,0,0|2,0,0]=4 2902 B14R1.14 CCCCCNCc1ccc(cc1)O 34a_100000185549_100000718602 [0,1,0,1,0,0|2,0,0]=4 2903 B14R1.14 CCCCCNCc1ccc(cn1)Br 207a_100000209983_100000754260 [0,1,0,1,0,0|2,0,0]=4 2904 B14R1.14 CCCCCNCc1ccc(cn1)Br 2230a_100000209983_100000702658 [0,1,0,1,0,0|2,0,0]=4 2905 B14R1.14 CCCCCNCc1ccc(cn1)Br 270004a_100000209983_100000754260 [0,1,0,1,0,0|2,0,0]=4 2906 B14R1.14 CCCCCNCc1ccc(cn1)Br 34a_100015188789_100000718602 [0,1,0,1,0,0|2,0,0]=4 2907 B14R1.14 CCCCCNCc1ccc(cn1)C 207a_100000209983_100000050478 [0,1,0,1,0,0|2,0,0]=4 2908 B14R1.14 CCCCCNCc1ccc(cn1)C 2230a_100000209983_100000691093 [0,1,0,1,0,0|2,0,0]=4 2909 B14R1.14 CCCCCNCc1ccc(cn1)C 270004a_100000209983_100000050478 [0,1,0,1,0,0|2,0,0]=4 2910 B14R1.14 CCCCCNCc1ccc(cn1)C 34a_100015187455_100000718602 [0,1,0,1,0,0|2,0,0]=4 2911 B14R1.14 CCCCCNCc1ccc(cn1)Cl 207a_100000209983_100011361569 [0,1,0,1,0,0|2,0,0]=4 2912 B14R1.14 CCCCCNCc1ccc(cn1)Cl 2230a_100000209983_100012066911 [0,1,0,1,0,0|2,0,0]=4 2913 B14R1.14 CCCCCNCc1ccc(cn1)Cl 270004a_100000209983_100011361569 [0,1,0,1,0,0|2,0,0]=4 2914 B14R1.14 CCCCCNCc1ccc(cn1)Cl 34a_100000697193_100000718602 [0,1,0,1,0,0|2,0,0]=4 2915 B14R1.14 CCCCCNCc1ccc(cn1)F 207a_100000209983_100011934744 [0,1,0,1,0,0|2,0,0]=4 2916 B14R1.14 CCCCCNCc1ccc(cn1)F 2230a_100000209983_100000703193 [0,1,0,1,0,0|2,0,0]=4 2917 B14R1.14 CCCCCNCc1ccc(cn1)F 270004a_100000209983_100011934744 [0,1,0,1,0,0|2,0,0]=4 2918 B14R1.14 CCCCCNCc1ccc(cn1)F 34a_100020620131_100000718602 [0,1,0,1,0,0|2,0,0]=4 2919 B14R1.14 CCCCCOCc1ccc(cc1)Br 34a_100000210253_100000189115 [0,1,0,1,0,0|2,0,0]=4 2920 B14R1.14 CCCCCOCc1ccc(cc1)Br 34a_100000695286_100000718602 [0,1,0,1,0,0|2,0,0]=4 2921 B14R1.14 CCCCCOCc1ccc(cc1)Br 7a_100000210253_100011217064 [0,1,0,1,0,0|2,0,0]=4 2922 B14R1.14 CCCCCOCc1ccc(cc1)C 34a_100000210253_100000210814 [0,1,0,1,0,0|2,0,0]=4 2923 B14R1.14 CCCCCOCc1ccc(cc1)C 34a_100011215236_100000718602 [0,1,0,1,0,0|2,0,0]=4 2924 B14R1.14 CCCCCOCc1ccc(cc1)C 7a_100000210253_100000210814 [0,1,0,1,0,0|2,0,0]=4 2925 B14R1.14 CCCCCOCc1ccc(cc1)C 7a_100011215236_100000210326 [0,1,0,1,0,0|2,0,0]=4 2926 B14R1.14 CCCCCOCc1ccc(cc1)Cl 34a_100000210253_100000694040 [0,1,0,1,0,0|2,0,0]=4 2927 B14R1.14 CCCCCOCc1ccc(cc1)Cl 34a_100000211118_100000718602 [0,1,0,1,0,0|2,0,0]=4 2928 B14R1.14 CCCCCOCc1ccc(cc1)Cl 7a_100000210253_100000187161 [0,1,0,1,0,0|2,0,0]=4 2929 B14R1.14 CCCCCOCc1ccc(cc1)Cl 7a_100000211118_100000210326 [0,1,0,1,0,0|2,0,0]=4 2930 B14R1.14 CCCCCOCc1ccc(cc1)F 34a_100000210253_100000198546 [0,1,0,1,0,0|2,0,0]=4 2931 B14R1.14 CCCCCOCc1ccc(cc1)F 34a_100000210977_100000718602 [0,1,0,1,0,0|2,0,0]=4 2932 B14R1.14 CCCCCOCc1ccc(cc1)F 7a_100000210253_100000198546 [0,1,0,1,0,0|2,0,0]=4 2933 B14R1.14 CCCCCOCc1ccc(cc1)F 7a_100000210977_100000210326 [0,1,0,1,0,0|2,0,0]=4 2934 B14R1.14 CCCCCOCc1ccc(cc1)I 34a_100000210253_100000189116 [0,1,0,1,0,0|2,0,0]=4 2935 B14R1.14 CCCCCOCc1ccc(cc1)I 34a_100000690907_100000718602 [0,1,0,1,0,0|2,0,0]=4 2936 B14R1.14 CCCCCOCc1ccc(cc1)I 7a_100000210253_100000189116 [0,1,0,1,0,0|2,0,0]=4 2937 B14R1.14 CCCCCOCc1ccc(cc1)I 7a_100000690907_100000210326 [0,1,0,1,0,0|2,0,0]=4 2938 B14R1.14 CCCCCOCc1ccc(cc1)N 34a_100011215238_100000718602 [0,1,0,1,0,0|2,0,0]=4 2939 B14R1.14 CCCCCOCc1ccc(cn1)Br 34a_100000210253_100000702658 [0,1,0,1,0,0|2,0,0]=4 2940 B14R1.14 CCCCCOCc1ccc(cn1)Br 34a_100000754261_100000718602 [0,1,0,1,0,0|2,0,0]=4 2941 B14R1.14 CCCCCOCc1ccc(cn1)Br 7a_100000210253_100000702658 [0,1,0,1,0,0|2,0,0]=4 2942 B14R1.14 CCCCCOCc1ccc(cn1)C 34a_100000210253_100000691093 [0,1,0,1,0,0|2,0,0]=4 2943 B14R1.14 CCCCCOCc1ccc(cn1)C 34a_100012001401_100000718602 [0,1,0,1,0,0|2,0,0]=4 2944 B14R1.14 CCCCCOCc1ccc(cn1)C 7a_100000210253_100000691093 [0,1,0,1,0,0|2,0,0]=4 2945 B14R1.14 CCCCCOCc1ccc(cn1)Cl 34a_100000210253_100012066911 [0,1,0,1,0,0|2,0,0]=4 2946 B14R1.14 CCCCCOCc1ccc(cn1)Cl 34a_100000703999_100000718602 [0,1,0,1,0,0|2,0,0]=4 2947 B14R1.14 CCCCCOCc1ccc(cn1)Cl 7a_100000210253_100012066911 [0,1,0,1,0,0|2,0,0]=4 2948 B14R1.14 CCCCCOCc1ccc(cn1)F 34a_100000210253_100000703193 [0,1,0,1,0,0|2,0,0]=4 2949 B14R1.14 CCCCCOCc1ccc(cn1)F 34a_100011999454_100000718602 [0,1,0,1,0,0|2,0,0]=4 2950 B14R1.14 CCCCCOCc1ccc(cn1)F 7a_100000210253_100000703193 [0,1,0,1,0,0|2,0,0]=4 2951 B14R1.14 CCCCCOCc1ccc(cn1)N 34a_100011998161_100000718602 [0,1,0,1,0,0|2,0,0]=4 2952 B14R1.14 CCCCCSCc1ccc(cc1)Br 62a_100000189115_100000210326 [0,1,0,1,0,0|2,0,0]=4 2953 B14R1.14 CCCCCSCc1ccc(cc1)Br 62a_100000210326_100000189115 [0,1,0,1,0,0|2,0,0]=4 2954 B14R1.14 CCCCCSCc1ccc(cc1)C 62a_100000210326_100000210814 [0,1,0,1,0,0|2,0,0]=4 2955 B14R1.14 CCCCCSCc1ccc(cc1)C 62a_100000210814_100000210326 [0,1,0,1,0,0|2,0,0]=4 2956 B14R1.14 CCCCCSCc1ccc(cc1)Cl 62a_100000187161_100000210326 [0,1,0,1,0,0|2,0,0]=4 2957 B14R1.14 CCCCCSCc1ccc(cc1)Cl 62a_100000210326_100000187161 [0,1,0,1,0,0|2,0,0]=4 2958 B14R1.14 CCCCCSCc1ccc(cc1)F 62a_100000198546_100000210326 [0,1,0,1,0,0|2,0,0]=4 2959 B14R1.14 CCCCCSCc1ccc(cc1)F 62a_100000210326_100000187164 [0,1,0,1,0,0|2,0,0]=4 2960 B14R1.14 CCCCCSCc1ccc(cc1)I 62a_100000189116_100000210326 [0,1,0,1,0,0|2,0,0]=4 2961 B14R1.14 CCCCCSCc1ccc(cc1)I 62a_100000210326_100000189116 [0,1,0,1,0,0|2,0,0]=4 2962 B14R1.14 CCCCCSCc1ccc(cn1)Br 62a_100000210326_100000702658 [0,1,0,1,0,0|2,0,0]=4 2963 B14R1.14 CCCCCSCc1ccc(cn1)Br 62a_100000702658_100000210326 [0,1,0,1,0,0|2,0,0]=4 2964 B14R1.14 CCCCCSCc1ccc(cn1)C 62a_100000210326_100000691093 [0,1,0,1,0,0|2,0,0]=4 2965 B14R1.14 CCCCCSCc1ccc(cn1)C 62a_100000691093_100000210326 [0,1,0,1,0,0|2,0,0]=4 2966 B14R1.14 CCCCCSCc1ccc(cn1)Cl 62a_100000210326_100000697101 [0,1,0,1,0,0|2,0,0]=4 2967 B14R1.14 CCCCCSCc1ccc(cn1)Cl 62a_100012066911_100000210326 [0,1,0,1,0,0|2,0,0]=4 2968 B14R1.14 CCCCCSCc1ccc(cn1)F 62a_100000210326_100000703193 [0,1,0,1,0,0|2,0,0]=4 2969 B14R1.14 CCCCCSCc1ccc(cn1)F 62a_100000703193_100000210326 [0,1,0,1,0,0|2,0,0]=4 2970 B14R1.14 CCCCNCCc1ccc(cc1)Br 2230a_100000102301_100011740612 [0,1,0,1,0,0|2,0,0]=4 2971 B14R1.14 CCCCNCCc1ccc(cc1)Br 2230a_100000755846_100000210211 [0,1,0,1,0,0|2,0,0]=4 2972 B14R1.14 CCCCNCCc1ccc(cc1)Br 34a_100000755846_100000210210 [0,1,0,1,0,0|2,0,0]=4 2973 B14R1.14 CCCCNCCc1ccc(cc1)Br 7a_106832991798_100011740612 [0,1,0,1,0,0|2,0,0]=4 2974 B14R1.14 CCCCNCCc1ccc(cc1)C 2230a_100000102301_100011713686 [0,1,0,1,0,0|2,0,0]=4 2975 B14R1.14 CCCCNCCc1ccc(cc1)C 2230a_100000705350_100000210211 [0,1,0,1,0,0|2,0,0]=4 2976 B14R1.14 CCCCNCCc1ccc(cc1)C 34a_100000705350_100000210210 [0,1,0,1,0,0|2,0,0]=4 2977 B14R1.14 CCCCNCCc1ccc(cc1)C 7a_106832991798_100011713686 [0,1,0,1,0,0|2,0,0]=4 2978 B14R1.14 CCCCNCCc1ccc(cc1)Cl 2230a_100000102301_100011713675 [0,1,0,1,0,0|2,0,0]=4 2979 B14R1.14 CCCCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210211 [0,1,0,1,0,0|2,0,0]=4 2980 B14R1.14 CCCCNCCc1ccc(cc1)Cl 34a_100000185265_100000210210 [0,1,0,1,0,0|2,0,0]=4 2981 B14R1.14 CCCCNCCc1ccc(cc1)Cl 7a_106832991798_100011713675 [0,1,0,1,0,0|2,0,0]=4 2982 B14R1.14 CCCCNCCc1ccc(cc1)F 2230a_100000102301_100011217392 [0,1,0,1,0,0|2,0,0]=4 2983 B14R1.14 CCCCNCCc1ccc(cc1)F 2230a_100000199005_100000210211 [0,1,0,1,0,0|2,0,0]=4 2984 B14R1.14 CCCCNCCc1ccc(cc1)F 34a_100000199005_100000210210 [0,1,0,1,0,0|2,0,0]=4 2985 B14R1.14 CCCCNCCc1ccc(cc1)F 7a_106832991798_100011217392 [0,1,0,1,0,0|2,0,0]=4 2986 B14R1.14 CCCCNCCc1ccc(cc1)O 2230a_100000102301_100009816426 [0,1,0,1,0,0|2,0,0]=4 2987 B14R1.14 CCCCNCCc1ccc(cc1)O 34a_100000743037_100000210210 [0,1,0,1,0,0|2,0,0]=4 2988 B14R1.14 CCCCNCCc1ccc(cc1)O 7a_106832991798_100009816426 [0,1,0,1,0,0|2,0,0]=4 2989 B14R1.14 CCCCOCCc1ccc(cc1)Br 34a_100000210227_100011740612 [0,1,0,1,0,0|2,0,0]=4 2990 B14R1.14 CCCCOCCc1ccc(cc1)Br 34a_100000766406_100000210210 [0,1,0,1,0,0|2,0,0]=4 2991 B14R1.14 CCCCOCCc1ccc(cc1)Br 7a_100000210227_100011740612 [0,1,0,1,0,0|2,0,0]=4 2992 B14R1.14 CCCCOCCc1ccc(cc1)Br 7a_100000766406_100000210211 [0,1,0,1,0,0|2,0,0]=4 2993 B14R1.14 CCCCOCCc1ccc(cc1)C 34a_100000210227_100011713686 [0,1,0,1,0,0|2,0,0]=4 2994 B14R1.14 CCCCOCCc1ccc(cc1)C 34a_100000756670_100000210210 [0,1,0,1,0,0|2,0,0]=4 2995 B14R1.14 CCCCOCCc1ccc(cc1)C 7a_100000210227_100011713686 [0,1,0,1,0,0|2,0,0]=4 2996 B14R1.14 CCCCOCCc1ccc(cc1)C 7a_100000756670_100000210211 [0,1,0,1,0,0|2,0,0]=4 2997 B14R1.14 CCCCOCCc1ccc(cc1)Cl 34a_100000210227_100011713675 [0,1,0,1,0,0|2,0,0]=4 2998 B14R1.14 CCCCOCCc1ccc(cc1)Cl 34a_100011219627_100000210210 [0,1,0,1,0,0|2,0,0]=4 2999 B14R1.14 CCCCOCCc1ccc(cc1)Cl 7a_100000210227_100011713675 [0,1,0,1,0,0|2,0,0]=4 3000 B14R1.14 CCCCOCCc1ccc(cc1)Cl 7a_100011219627_100000210211 [0,1,0,1,0,0|2,0,0]=4 3001 B14R1.14 CCCCOCCc1ccc(cc1)F 34a_100000210227_100011217392 [0,1,0,1,0,0|2,0,0]=4 3002 B14R1.14 CCCCOCCc1ccc(cc1)F 34a_100000754732_100000210210 [0,1,0,1,0,0|2,0,0]=4 3003 B14R1.14 CCCCOCCc1ccc(cc1)F 7a_100000210227_100011217392 [0,1,0,1,0,0|2,0,0]=4 3004 B14R1.14 CCCCOCCc1ccc(cc1)F 7a_100000754732_100000210211 [0,1,0,1,0,0|2,0,0]=4 3005 B14R1.14 CCCCOCCc1ccc(cc1)I 34a_100012291149_100000210210 [0,1,0,1,0,0|2,0,0]=4 3006 B14R1.14 CCCCOCCc1ccc(cc1)I 7a_100012291149_100000210211 [0,1,0,1,0,0|2,0,0]=4 3007 B14R1.14 CCCCOCCc1ccc(cc1)N 34a_100011204434_100000210210 [0,1,0,1,0,0|2,0,0]=4 3008 B14R1.14 CCCCOCCc1ccc(cc1)O 7a_100000210227_100009816426 [0,1,0,1,0,0|2,0,0]=4 3009 B14R1.14 CCCCOCCc1ccc(cn1)Br 34a_100012357577_100000210210 [0,1,0,1,0,0|2,0,0]=4 3010 B14R1.14 CCCCSCCc1ccc(cc1)Br 62a_100000210211_100011740612 [0,1,0,1,0,0|2,0,0]=4 3011 B14R1.14 CCCCSCCc1ccc(cc1)Br 62a_100011740612_100000210210 [0,1,0,1,0,0|2,0,0]=4 3012 B14R1.14 CCCCSCCc1ccc(cc1)C 62a_100000210211_100011713686 [0,1,0,1,0,0|2,0,0]=4 3013 B14R1.14 CCCCSCCc1ccc(cc1)C 62a_100011713686_100000210210 [0,1,0,1,0,0|2,0,0]=4 3014 B14R1.14 CCCCSCCc1ccc(cc1)Cl 62a_100000210211_100011713675 [0,1,0,1,0,0|2,0,0]=4 3015 B14R1.14 CCCCSCCc1ccc(cc1)Cl 62a_100011713675_100000210210 [0,1,0,1,0,0|2,0,0]=4 3016 B14R1.14 CCCCSCCc1ccc(cc1)F 62a_100000210211_100011217392 [0,1,0,1,0,0|2,0,0]=4 3017 B14R1.14 CCCCSCCc1ccc(cc1)F 62a_100011217392_100000210210 [0,1,0,1,0,0|2,0,0]=4 3018 B14R1.14 CCCCSCCc1ccc(cc1)O 62a_100000210211_100009816426 [0,1,0,1,0,0|2,0,0]=4 3019 B14R1.14 CCCCSCCc1ccc(cc1)O 62a_100009816426_100000210210 [0,1,0,1,0,0|2,0,0]=4 3020 B14R1.14 CCCNCCCc1ccc(cc1)Br 2230a_100011297623_100000210303 [0,1,0,1,0,0|2,0,0]=4 3021 B14R1.14 CCCNCCCc1ccc(cc1)Br 34a_100011297623_100000210303 [0,1,0,1,0,0|2,0,0]=4 3022 B14R1.14 CCCNCCCc1ccc(cc1)C 2230a_100011236272_100000210303 [0,1,0,1,0,0|2,0,0]=4 3023 B14R1.14 CCCNCCCc1ccc(cc1)C 34a_100011236272_100000210303 [0,1,0,1,0,0|2,0,0]=4 3024 B14R1.14 CCCNCCCc1ccc(cc1)Cl 2230a_100000748451_100000210303 [0,1,0,1,0,0|2,0,0]=4 3025 B14R1.14 CCCNCCCc1ccc(cc1)Cl 34a_100000748451_100000210303 [0,1,0,1,0,0|2,0,0]=4 3026 B14R1.14 CCCNCCCc1ccc(cc1)F 2230a_100025745824_100000210303 [0,1,0,1,0,0|2,0,0]=4 3027 B14R1.14 CCCNCCCc1ccc(cc1)F 34a_100025745824_100000210303 [0,1,0,1,0,0|2,0,0]=4 3028 B14R1.14 CCCOCCCc1ccc(cc1)Br 34a_100000210258_100011713682 [0,1,0,1,0,0|2,0,0]=4 3029 B14R1.14 CCCOCCCc1ccc(cc1)Br 34a_100011709247_100000210303 [0,1,0,1,0,0|2,0,0]=4 3030 B14R1.14 CCCOCCCc1ccc(cc1)Br 7a_100011709247_100000210303 [0,1,0,1,0,0|2,0,0]=4 3031 B14R1.14 CCCOCCCc1ccc(cc1)C 34a_100000189427_100000210303 [0,1,0,1,0,0|2,0,0]=4 3032 B14R1.14 CCCOCCCc1ccc(cc1)C 7a_100000189427_100000210303 [0,1,0,1,0,0|2,0,0]=4 3033 B14R1.14 CCCOCCCc1ccc(cc1)Cl 34a_100000210258_100000759440 [0,1,0,1,0,0|2,0,0]=4 3034 B14R1.14 CCCOCCCc1ccc(cc1)Cl 34a_100011217485_100000210303 [0,1,0,1,0,0|2,0,0]=4 3035 B14R1.14 CCCOCCCc1ccc(cc1)Cl 7a_100011217485_100000210303 [0,1,0,1,0,0|2,0,0]=4 3036 B14R1.14 CCCOCCCc1ccc(cc1)F 34a_100000210258_200011713563 [0,1,0,1,0,0|2,0,0]=4 3037 B14R1.14 CCCOCCCc1ccc(cc1)F 34a_100000757351_100000210303 [0,1,0,1,0,0|2,0,0]=4 3038 B14R1.14 CCCOCCCc1ccc(cc1)F 7a_100000757351_100000210303 [0,1,0,1,0,0|2,0,0]=4 3039 B14R1.14 CCCSCCCc1ccc(cc1)Br 62a_100000210303_100011713682 [0,1,0,1,0,0|2,0,0]=4 3040 B14R1.14 CCCSCCCc1ccc(cc1)Br 62a_100011713682_100000210303 [0,1,0,1,0,0|2,0,0]=4 3041 B14R1.14 CCCSCCCc1ccc(cc1)Cl 62a_100000210303_100000759440 [0,1,0,1,0,0|2,0,0]=4 3042 B14R1.14 CCCSCCCc1ccc(cc1)Cl 62a_100000759440_100000210303 [0,1,0,1,0,0|2,0,0]=4 3043 B14R1.14 CCCSCCCc1ccc(cc1)F 62a_100000210303_200011713563 [0,1,0,1,0,0|2,0,0]=4 3044 B14R1.14 CCCSCCCc1ccc(cc1)F 62a_200011713563_100000210303 [0,1,0,1,0,0|2,0,0]=4 3045 B14R1.14 CCNCCCCc1ccc(cc1)Br 2230a_100015525214_200012094861 [0,1,0,1,0,0|2,0,0]=4 3046 B14R1.14 CCNCCCCc1ccc(cc1)Cl 2230a_100160821348_100000210202 [0,1,0,1,0,0|2,0,0]=4 3047 B14R1.14 CCNCCCCc1ccc(cc1)Cl 34a_100160821348_100000210202 [0,1,0,1,0,0|2,0,0]=4 3048 B14R1.14 CCNCCCCc1ccc(cc1)F 2230a_100015525214_100012093538 [0,1,0,1,0,0|2,0,0]=4 3049 B14R1.14 CCOCCCCc1ccc(cc1)Br 34a_100121572206_200012094861 [0,1,0,1,0,0|2,0,0]=4 3050 B14R1.14 CCOCCCCc1ccc(cc1)F 34a_100121572206_100012093538 [0,1,0,1,0,0|2,0,0]=4 3051 B14R1.14 CCSCCCCc1ccc(cc1)Br 62a_100000210202_200012094861 [0,1,0,1,0,0|2,0,0]=4 3052 B14R1.14 CCSCCCCc1ccc(cc1)Br 62a_200012094861_100000210202 [0,1,0,1,0,0|2,0,0]=4 3053 B14R1.14 CCSCCCCc1ccc(cc1)F 62a_100000210202_100012093538 [0,1,0,1,0,0|2,0,0]=4 3054 B14R1.14 CCSCCCCc1ccc(cc1)F 62a_100012093538_100000210202 [0,1,0,1,0,0|2,0,0]=4 3055 B14R1.228 C=Cc1cccc(c1)CCCCCC 271570a_100011290941_100009816010 [0,1,0,1,0,0|1,0,1]=4 3056 B14R1.228 CCCCCSc1cccc(c1)C=O 62a_100000014684_100000210326 [0,1,0,1,0,0|1,0,1]=4 3057 B14R1.228 CCCCCSc1cccc(c1)C=O 62a_100000210326_100000014684 [0,1,0,1,0,0|1,0,1]=4 3058 B14R1.228 CCCCCSc1cccc(n1)C=O 62a_100000210326_100000688028 [0,1,0,1,0,0|1,0,1]=4 3059 B14R1.228 CCCCCSc1cccc(n1)C=O 62a_100000688028_100000210326 [0,1,0,1,0,0|1,0,1]=4 3060 B14R1.228 CCCCNCc1cccc(c1)C=O 2230a_100000102301_100009816774 [0,1,0,1,0,0|1,0,1]=4 3061 B14R1.228 CCCCNCc1cccc(c1)C=O 7a_106832991798_100009816774 [0,1,0,1,0,0|1,0,1]=4 3062 B14R1.228 CCCCOCc1cccc(c1)C=O 34a_100000210227_100009816774 [0,1,0,1,0,0|1,0,1]=4 3063 B14R1.228 CCCCOCc1cccc(c1)C=O 7a_100000210227_100009816774 [0,1,0,1,0,0|1,0,1]=4 3064 B14R1.228 CCCCSCc1cccc(c1)C=O 62a_100000210211_100009816774 [0,1,0,1,0,0|1,0,1]=4 3065 B14R1.228 CCCCSCc1cccc(c1)C=O 62a_100009816774_100000210210 [0,1,0,1,0,0|1,0,1]=4 3066 B14R1.716 CCC(=O)CCCCc1ccccc1 1458a_100000210414_100000701786 [0,1,0,1,0,0|1,0,1]=4 3067 B14R1.716 CCC(=O)CCCCc1ccccc1 1458a_100011215911_100000210202 [0,1,0,1,0,0|1,0,1]=4 3068 B14R1.716 CCC(C)CCNCc1ccccc1 207a_100020591266_100015611070 [0,1,0,1,0,0|2,0,0]=4 3069 B14R1.716 CCC(C)CCNCc1ccccc1 2230a_100020591266_100015291786 [0,1,0,1,0,0|2,0,0]=4 3070 B14R1.716 CCC(C)CCNCc1ccccc1 270004a_100020591266_100015611070 [0,1,0,1,0,0|2,0,0]=4 3071 B14R1.716 CCC(C)CCNCc1ccccn1 207a_100020591266_100000209966 [0,1,0,1,0,0|2,0,0]=4 3072 B14R1.716 CCC(C)CCNCc1ccccn1 2230a_100020591266_100000721315 [0,1,0,1,0,0|2,0,0]=4 3073 B14R1.716 CCC(C)CCNCc1ccccn1 270004a_100020591266_100000209966 [0,1,0,1,0,0|2,0,0]=4 3074 B14R1.716 CCC(C)CCOCc1ccccc1 7a_100011215188_100000211182 [0,1,0,1,0,0|2,0,0]=4 3075 B14R1.716 CCC(C)CCOCc1ccccn1 7a_100011215188_100000721315 [0,1,0,1,0,0|2,0,0]=4 3076 B14R1.716 CCC(C)CNCCc1ccccc1 2230a_100000106460_100000748023 [0,1,0,1,0,0|2,0,0]=4 3077 B14R1.716 CCC(C)CNCCc1ccccc1 2230a_100020588543_100000765856 [0,1,0,1,0,0|2,0,0]=4 3078 B14R1.716 CCC(C)CNCCc1ccccc1 270004a_100000106460_100000243153 [0,1,0,1,0,0|2,0,0]=4 3079 B14R1.716 CCC(C)CNCCc1ccccc1 34a_100000106460_100000748023 [0,1,0,1,0,0|2,0,0]=4 3080 B14R1.716 CCC(C)CNCCc1ccccn1 2230a_100020588543_100015183660 [0,1,0,1,0,0|2,0,0]=4 3081 B14R1.716 CCC(C)CNCCc1ccccn1 270004a_100000211156_100000243153 [0,1,0,1,0,0|2,0,0]=4 3082 B14R1.716 CCC(C)COCCc1ccccc1 34a_100000210268_100000748023 [0,1,0,1,0,0|2,0,0]=4 3083 B14R1.716 CCC(C)COCCc1ccccc1 7a_100000210268_100000748023 [0,1,0,1,0,0|2,0,0]=4 3084 B14R1.716 CCC(C)COCCc1ccccn1 34a_100000210271_100000748023 [0,1,0,1,0,0|2,0,0]=4 3085 B14R1.716 CCC(C)CSCCc1ccccc1 62a_100000748023_100011218657 [0,1,0,1,0,0|2,0,0]=4 3086 B14R1.716 CCC(C)CSCCc1ccccc1 62a_100000765856_100000748023 [0,1,0,1,0,0|2,0,0]=4 3087 B14R1.716 CCC(C)CSCCc1ccccn1 62a_100000748023_100015183660 [0,1,0,1,0,0|2,0,0]=4 3088 B14R1.716 CCC(C)CSCCc1ccccn1 62a_100015183660_100000748023 [0,1,0,1,0,0|2,0,0]=4 3089 B14R1.716 CCC(C)NCCCc1ccccc1 2230a_100000209981_100000211621 [0,1,0,1,0,0|2,0,0]=4 3090 B14R1.716 CCC(C)NCCCc1ccccc1 2230a_100000211184_100000758301 [0,1,0,1,0,0|2,0,0]=4 3091 B14R1.716 CCC(C)NCCCc1ccccc1 34a_100000211184_100011215416 [0,1,0,1,0,0|2,0,0]=4 3092 B14R1.716 CCC(C)OCCCc1ccccc1 34a_100000210828_100011215416 [0,1,0,1,0,0|2,0,0]=4 3093 B14R1.716 CCC(C)OCCCc1ccccc1 7a_100000210228_100000211621 [0,1,0,1,0,0|2,0,0]=4 3094 B14R1.716 CCC(C)OCCCc1ccccc1 7a_100000210828_100000758301 [0,1,0,1,0,0|2,0,0]=4 3095 B14R1.716 CCC(C)OCCCc1ccccn1 34a_100011215068_100011215416 [0,1,0,1,0,0|2,0,0]=4 3096 B14R1.716 CCC(C)SCCCc1ccccc1 62a_100000211621_100000758301 [0,1,0,1,0,0|2,0,0]=4 3097 B14R1.716 CCC(C)SCCCc1ccccc1 62a_100000758301_100000211621 [0,1,0,1,0,0|2,0,0]=4 3098 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100000106460_100011218378 [0,1,0,1,0,0|2,0,0]=4 3099 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100011218483_100000765856 [0,1,0,1,0,0|2,0,0]=4 3100 B14R1.716 CCC(O)CNCCc1ccccc1 34a_100000106460_100011218378 [0,1,0,1,0,0|2,0,0]=4 3101 B14R1.716 CCC(O)CNCCc1ccccn1 2230a_100011218483_100015183660 [0,1,0,1,0,0|2,0,0]=4 3102 B14R1.716 CCC(O)COCCc1ccccc1 34a_100000210268_100011218378 [0,1,0,1,0,0|2,0,0]=4 3103 B14R1.716 CCC(O)COCCc1ccccc1 7a_100000210268_100011218378 [0,1,0,1,0,0|2,0,0]=4 3104 B14R1.716 CCC(O)COCCc1ccccn1 34a_100000210271_100011218378 [0,1,0,1,0,0|2,0,0]=4 3105 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100000765856_100011218378 [0,1,0,1,0,0|2,0,0]=4 3106 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100011218378_100011218657 [0,1,0,1,0,0|2,0,0]=4 3107 B14R1.716 CCC(O)CSCCc1ccccn1 62a_100011218378_100015183660 [0,1,0,1,0,0|2,0,0]=4 3108 B14R1.716 CCC(O)CSCCc1ccccn1 62a_100015183660_100011218378 [0,1,0,1,0,0|2,0,0]=4 3109 B14R1.716 CCN(C)CCCCc1ccccc1 2230a_100000225621_100000701786 [0,1,0,1,0,0|2,0,0]=4 3110 B14R1.716 CCN(C)CCCCc1ccccc1 2230a_100000741445_100000210202 [0,1,0,1,0,0|2,0,0]=4 3111 B14R1.716 CCN(C)CCCCc1ccccc1 269982a_100000225621_100000701786 [0,1,0,1,0,0|2,0,0]=4 3112 B14R1.716 CCN(C)CCCCc1ccccc1 269982a_100000741445_100000204670 [0,1,0,1,0,0|2,0,0]=4 3113 B14R1.716 CCN(C)CCCCc1ccccc1 34a_100000741445_100000210202 [0,1,0,1,0,0|2,0,0]=4 3114 B14R1.716 CC[C@H](C)CNCCc1ccccc1 2230a_100000106460_100009816398 [0,1,0,1,0,0|2,0,0]=4 3115 B14R1.716 CC[C@H](C)CNCCc1ccccc1 34a_100000106460_100009816398 [0,1,0,1,0,0|2,0,0]=4 3116 B14R1.716 CC[C@H](C)COCCc1ccccc1 34a_100000210268_100009816398 [0,1,0,1,0,0|2,0,0]=4 3117 B14R1.716 CC[C@H](C)COCCc1ccccc1 7a_100000210268_100009816398 [0,1,0,1,0,0|2,0,0]=4 3118 B14R1.716 CC[C@H](C)COCCc1ccccc1 7a_100009816381_100000765856 [0,1,0,1,0,0|2,0,0]=4 3119 B14R1.716 CC[C@H](C)COCCc1ccccn1 34a_100000210271_100009816398 [0,1,0,1,0,0|2,0,0]=4 3120 B14R1.716 CC[C@H](C)COCCc1ccccn1 7a_100009816381_100015183660 [0,1,0,1,0,0|2,0,0]=4 3121 B14R1.716 CC[C@H](C)CSCCc1ccccc1 62a_100000765856_100009816398 [0,1,0,1,0,0|2,0,0]=4 3122 B14R1.716 CC[C@H](C)CSCCc1ccccc1 62a_100009816398_100011218657 [0,1,0,1,0,0|2,0,0]=4 3123 B14R1.716 CC[C@H](C)CSCCc1ccccn1 62a_100009816398_100015183660 [0,1,0,1,0,0|2,0,0]=4 3124 B14R1.716 CC[C@H](C)CSCCc1ccccn1 62a_100015183660_100009816398 [0,1,0,1,0,0|2,0,0]=4 3125 B14R1.716 CNC(C)CCCCc1ccccc1 270004a_106832991635_200011485782 [0,1,0,1,0,0|2,0,0]=4 3126 B14R1.837 CCC(C)NCCn1ccccc1=O 2230a_100000687133_100000758301 [0,1,0,1,0,0|2,0,0]=4 3127 B14R1.3454 CCCCCC=Cc1ccc(o1)C=O 271570a_100000062253_100000185145 [0,1,0,1,0,0|0,0,2]=4 3128 B14R1.3454 CCCCCC=Cc1ccc(s1)C=O 271570a_100000062253_100000179771 [0,1,0,1,0,0|0,0,2]=4 3129 B14R1.3454 CCCCCCNc1ncc(s1)C=O 27a_100000210581_100009814069 [0,1,0,1,0,0|2,0,0]=4 3130 B14R1.3454 CCCCCCSc1c[nH]c(c1)C=O 62a_100000210314_100000720742 [0,1,0,1,0,0|2,0,0]=4 3131 B14R1.3454 CCCCCCSc1c[nH]c(c1)C=O 62a_100000720742_100000210757 [0,1,0,1,0,0|2,0,0]=4 3132 B14R1.3454 CCCCCCSc1cc(c[nH]1)C=O 62a_100000210314_100009882863 [0,1,0,1,0,0|2,0,0]=4 3133 B14R1.3454 CCCCCCSc1cc(c[nH]1)C=O 62a_100009882863_100000210757 [0,1,0,1,0,0|2,0,0]=4 3134 B14R1.3454 CCCCCCSc1cc(cs1)C=O 62a_100000210314_100000737087 [0,1,0,1,0,0|2,0,0]=4 3135 B14R1.3454 CCCCCCSc1cc(cs1)C=O 62a_100000737087_100000210757 [0,1,0,1,0,0|2,0,0]=4 3136 B14R1.3454 CCCCCCSc1ccc([nH]1)C=O 62a_100000210314_100009875417 [0,1,0,1,0,0|1,0,0]=3 3137 B14R1.3454 CCCCCCSc1ccc(o1)C=O 62a_100000210314_100000186757 [0,1,0,1,0,0|1,0,0]=3 3138 B14R1.3454 CCCCCCSc1ccc(s1)C=O 62a_100000179771_100000210757 [0,1,0,1,0,0|1,0,0]=3 3139 B14R1.3454 CCCCCCSc1ccc(s1)C=O 62a_100000210314_100000179771 [0,1,0,1,0,0|1,0,0]=3 3140 B14R1.3454 CCCCCCSc1cnc(s1)C=O 62a_100000210314_100000699580 [0,1,0,1,0,0|2,0,0]=4 3141 B14R1.3454 CCCCCCSc1cnc(s1)C=O 62a_100000699580_100000210757 [0,1,0,1,0,0|2,0,0]=4 3142 B14R1.3454 CCCCCCSc1coc(c1)C=O 62a_100000210314_100000747035 [0,1,0,1,0,0|2,0,0]=4 3143 B14R1.3454 CCCCCCSc1coc(c1)C=O 62a_100000747035_100000210757 [0,1,0,1,0,0|2,0,0]=4 3144 B14R1.3454 CCCCCCSc1csc(c1)C=O 62a_100000210314_100000211722 [0,1,0,1,0,0|2,0,0]=4 3145 B14R1.3454 CCCCCCSc1csc(c1)C=O 62a_100000211722_100000210757 [0,1,0,1,0,0|2,0,0]=4 3146 B14R1.3454 CCCCCCSc1csc(n1)C=O 62a_100000210314_100009816814 [0,1,0,1,0,0|2,0,0]=4 3147 B14R1.3454 CCCCCCSc1csc(n1)C=O 62a_100009816814_100000210757 [0,1,0,1,0,0|2,0,0]=4 3148 B14R1.3454 CCCCCCSc1nc(cs1)C=O 62a_100000210314_100009816748 [0,1,0,1,0,0|2,0,0]=4 3149 B14R1.3454 CCCCCCSc1nc(cs1)C=O 62a_100009816748_100000210757 [0,1,0,1,0,0|2,0,0]=4 3150 B14R1.3454 CCCCCCSc1ncc(s1)C=O 62a_100000210314_100009814069 [0,1,0,1,0,0|2,0,0]=4 3151 B14R1.3454 CCCCCCSc1ncc(s1)C=O 62a_100009814069_100000210757 [0,1,0,1,0,0|2,0,0]=4 3152 B14R1.3454 CCCCCNCc1ccc(o1)C=O 2230a_100000209983_200000079136 [0,1,0,1,0,0|1,0,0]=3 3153 B14R1.3454 CCCCCNCc1csc(c1)C=O 2230a_100000209983_100000070824 [0,1,0,1,0,0|2,0,0]=4 3154 B14R1.3454 CCCCCOCc1ccc(o1)C=O 34a_100000210253_200000079136 [0,1,0,1,0,0|1,0,0]=3 3155 B14R1.3454 CCCCCOCc1ccc(o1)C=O 7a_100000210253_200000079136 [0,1,0,1,0,0|1,0,0]=3 3156 B14R1.3454 CCCCCOCc1csc(c1)C=O 34a_100000210253_100000070824 [0,1,0,1,0,0|2,0,0]=4 3157 B14R1.3454 CCCCCOCc1csc(c1)C=O 7a_100000210253_100000070824 [0,1,0,1,0,0|2,0,0]=4 3158 B14R1.3454 CCCCCSCc1ccc(o1)C=O 62a_100000210326_200000079136 [0,1,0,1,0,0|1,0,0]=3 3159 B14R1.3454 CCCCCSCc1csc(c1)C=O 62a_100000070824_100000210326 [0,1,0,1,0,0|2,0,0]=4 3160 B14R1.3454 CCCCCSCc1csc(c1)C=O 62a_100000210326_100000070824 [0,1,0,1,0,0|2,0,0]=4 3161 B14R1.3454 CCCCOCSc1ccc([nH]1)C=O 62a_100011995733_100009875417 [0,1,0,1,0,0|2,0,0]=4 3162 B14R1.3454 CCCCOCSc1ccc(o1)C=O 62a_100011995733_100000186757 [0,1,0,1,0,0|2,0,0]=4 3163 B14R1.3454 CCCCOCSc1ccc(s1)C=O 62a_100000179771_100011995733 [0,1,0,1,0,0|2,0,0]=4 3164 B14R1.3454 CCCCOCSc1ccc(s1)C=O 62a_100011995733_100000179771 [0,1,0,1,0,0|2,0,0]=4 3165 B14R1.3454 CCCOCCSc1ccc([nH]1)C=O 62a_100011215938_100009875417 [0,1,0,1,0,0|2,0,0]=4 3166 B14R1.3454 CCCOCCSc1ccc(o1)C=O 62a_100011215938_100000186757 [0,1,0,1,0,0|2,0,0]=4 3167 B14R1.3454 CCCOCCSc1ccc(s1)C=O 62a_100000179771_100011215938 [0,1,0,1,0,0|2,0,0]=4 3168 B14R1.3454 CCCOCCSc1ccc(s1)C=O 62a_100011215938_100000179771 [0,1,0,1,0,0|2,0,0]=4 3169 B14R1.3454 CCOCCCSc1ccc([nH]1)C=O 62a_100012232248_100009875417 [0,1,0,1,0,0|2,0,0]=4 3170 B14R1.3454 CCOCCCSc1ccc(o1)C=O 62a_100012232248_100000186757 [0,1,0,1,0,0|2,0,0]=4 3171 B14R1.3454 CCOCCCSc1ccc(s1)C=O 62a_100000179771_100012232248 [0,1,0,1,0,0|2,0,0]=4 3172 B14R1.3454 CCOCCCSc1ccc(s1)C=O 62a_100012232248_100000179771 [0,1,0,1,0,0|2,0,0]=4 3173 B14R1.3454 CCOCCNCc1ccc(o1)C=O 2230a_102516460346_200000079136 [0,1,0,1,0,0|2,0,0]=4 3174 B14R1.3454 CCOCCNCc1ccc(o1)C=O 34a_102516460346_200000079136 [0,1,0,1,0,0|2,0,0]=4 3175 B14R1.3454 CCOCCOCc1ccc(o1)C=O 34a_100000210136_200000079136 [0,1,0,1,0,0|2,0,0]=4 3176 B14R1.3454 CCOCCOCc1ccc(o1)C=O 7a_100000210136_200000079136 [0,1,0,1,0,0|2,0,0]=4 3177 B14R1.3454 CCOCCSCc1ccc(o1)C=O 62a_100000210147_200000079136 [0,1,0,1,0,0|2,0,0]=4 3178 B14R1.3454 CCSCCNCc1ccc(o1)C=O 2230a_100000106463_200000079136 [0,1,0,1,0,0|2,0,0]=4 3179 B14R1.3454 CCSCCOCc1ccc(o1)C=O 34a_100000212035_200000079136 [0,1,0,1,0,0|2,0,0]=4 3180 B14R1.3454 CCSCCOCc1ccc(o1)C=O 7a_100000212035_200000079136 [0,1,0,1,0,0|2,0,0]=4 3181 B14R1.3454 CCSCCSCc1ccc(o1)C=O 62a_100000757381_200000079136 [0,1,0,1,0,0|2,0,0]=4 3182 B14R1.3454 CNCCCOCc1ccc(o1)C=O 34a_100000213112_200000079136 [0,1,0,1,0,0|2,0,0]=4 3183 B14R1.3454 COCCCCSc1ccc([nH]1)C=O 62a_100000730899_100009875417 [0,1,0,1,0,0|2,0,0]=4 3184 B14R1.3454 COCCCCSc1ccc(o1)C=O 62a_100000730899_100000186757 [0,1,0,1,0,0|2,0,0]=4 3185 B14R1.3454 COCCCCSc1ccc(s1)C=O 62a_100000179771_100000730899 [0,1,0,1,0,0|2,0,0]=4 3186 B14R1.3454 COCCCCSc1ccc(s1)C=O 62a_100000730899_100000179771 [0,1,0,1,0,0|2,0,0]=4 3187 B14R1.3454 COCCCNCc1ccc(o1)C=O 34a_100150723488_200000079136 [0,1,0,1,0,0|2,0,0]=4 3188 B14R1.3454 COCCCOCc1ccc(o1)C=O 34a_100000740835_200000079136 [0,1,0,1,0,0|2,0,0]=4 3189 B14R1.3454 COCCCSCc1ccc(o1)C=O 62a_100000709357_200000079136 [0,1,0,1,0,0|2,0,0]=4 3190 B14R1.3454 CSCCCNCc1ccc(o1)C=O 2230a_100000749238_200000079136 [0,1,0,1,0,0|2,0,0]=4 3191 B14R1.3454 CSCCCOCc1ccc(o1)C=O 34a_100000690336_200000079136 [0,1,0,1,0,0|2,0,0]=4 3192 B14R1.3454 CSCCCOCc1ccc(o1)C=O 7a_100000690336_200000079136 [0,1,0,1,0,0|2,0,0]=4 3193 B14R1.3454 NCCCCOCc1ccc(o1)C=O 34a_100000750430_200000079136 [0,1,0,1,0,0|2,0,0]=4 3194 B14R1.3454 O=Cc1ccc([nH]1)SCCCCCF 62a_100000729378_100009875417 [0,1,0,1,0,0|2,0,0]=4 3195 B14R1.3454 O=Cc1ccc([nH]1)SCCCCCO 62a_100000746330_100009875417 [0,1,0,1,0,0|2,0,0]=4 3196 B14R1.3454 O=Cc1ccc(o1)CNCCCCO 2230a_100000750430_200000079136 [0,1,0,1,0,0|2,0,0]=4 3197 B14R1.3454 O=Cc1ccc(o1)CNCCCCO 34a_100000750430_200000079136 [0,1,0,1,0,0|2,0,0]=4 3198 B14R1.3454 O=Cc1ccc(o1)COCCCCBr 34a_100011216708_200000079136 [0,1,0,1,0,0|2,0,0]=4 3199 B14R1.3454 O=Cc1ccc(o1)COCCCCCl 34a_100000210776_200000079136 [0,1,0,1,0,0|2,0,0]=4 3200 B14R1.3454 O=Cc1ccc(o1)COCCCCCl 7a_100000210776_200000079136 [0,1,0,1,0,0|2,0,0]=4 3201 B14R1.3454 O=Cc1ccc(o1)COCCCCF 34a_100011995726_200000079136 [0,1,0,1,0,0|2,0,0]=4 3202 B14R1.3454 O=Cc1ccc(o1)COCCCCF 7a_100011995726_200000079136 [0,1,0,1,0,0|2,0,0]=4 3203 B14R1.3454 O=Cc1ccc(o1)COCCCCI 34a_200012148704_200000079136 [0,1,0,1,0,0|2,0,0]=4 3204 B14R1.3454 O=Cc1ccc(o1)CSCCCCF 62a_100000729493_200000079136 [0,1,0,1,0,0|2,0,0]=4 3205 B14R1.3454 O=Cc1ccc(o1)CSCCCCO 62a_100000210776_200000079136 [0,1,0,1,0,0|2,0,0]=4 3206 B14R1.3454 O=Cc1ccc(o1)SCCCCCF 62a_100000729378_100000186757 [0,1,0,1,0,0|2,0,0]=4 3207 B14R1.3454 O=Cc1ccc(o1)SCCCCCO 62a_100000746330_100000186757 [0,1,0,1,0,0|2,0,0]=4 3208 B14R1.3454 O=Cc1ccc(s1)SCCCCCF 62a_100000179771_100000729378 [0,1,0,1,0,0|2,0,0]=4 3209 B14R1.3454 O=Cc1ccc(s1)SCCCCCF 62a_100000729378_100000179771 [0,1,0,1,0,0|2,0,0]=4 3210 B14R1.3454 O=Cc1ccc(s1)SCCCCCO 62a_100000179771_100000746330 [0,1,0,1,0,0|2,0,0]=4 3211 B14R1.3454 O=Cc1ccc(s1)SCCCCCO 62a_100000746330_100000179771 [0,1,0,1,0,0|2,0,0]=4 3212 B14R1.38 CCCCCCC(=O)c1ccccc1 1458a_100000185807_100000210757 [0,1,0,1,0,0|1,0,1]=4 3213 B14R1.38 CCCCCCN(C)c1ccccc1 2230a_100000210012_100000210314 [0,1,0,1,0,0|2,0,0]=4 3214 B14R1.38 CCCCCCN(C)c1ccccc1 2230a_200000219565_200000210301 [0,1,0,1,0,0|2,0,0]=4 3215 B14R1.38 CCCCCCN(C)c1ccccc1 269982a_100000210012_100000210757 [0,1,0,1,0,0|2,0,0]=4 3216 B14R1.38 CCCCCCN(C)c1ccccc1 269982a_200000219565_200000210301 [0,1,0,1,0,0|2,0,0]=4 3217 B14R1.38 CCCCCCN(C)c1ccccc1 34a_100000210012_100000210314 [0,1,0,1,0,0|2,0,0]=4 3218 B14R1.38 CCCCCCN(C)c1ccccc1 34a_200000219565_200000210301 [0,1,0,1,0,0|2,0,0]=4 3219 B14R1.38 CCCCCCN(C)c1ccccc1 7a_200000219565_200000210301 [0,1,0,1,0,0|2,0,0]=4 3220 B14R1.38 CCCCCCN([13CH3])c1ccccc1 2230a_200000219565_200025704644 [0,1,0,1,0,0|2,0,0]=4 3221 B14R1.38 CCCCCCN([13CH3])c1ccccc1 269982a_200000219565_200025704644 [0,1,0,1,0,0|2,0,0]=4 3222 B14R1.38 CCCCCCN([13CH3])c1ccccc1 34a_200000219565_200025704644 [0,1,0,1,0,0|2,0,0]=4 3223 B14R1.38 CCCCCCN([13CH3])c1ccccc1 7a_200000219565_200025704644 [0,1,0,1,0,0|2,0,0]=4 3224 B14R1.38 CCCCCNC(C)c1ccccc1 2230a_100000209983_100000230085 [0,1,0,1,0,0|2,0,0]=4 3225 B14R1.38 CCCCCNC(C)c1ccccc1 269862a_100000209983_100000185851 [0,1,0,1,0,0|2,0,0]=4 3226 B14R1.38 CCCCCNC(C)c1ccccn1 2230a_100000181244_100000210326 [0,1,0,1,0,0|2,0,0]=4 3227 B14R1.38 CCCCCNC(C)c1ccccn1 269862a_100000209983_100000210467 [0,1,0,1,0,0|2,0,0]=4 3228 B14R1.38 CCCCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210326 [0,1,0,1,0,0|2,0,0]=4 3229 B14R1.38 CCCCCOC(C)c1ccccc1 34a_100000210253_100000211855 [0,1,0,1,0,0|2,0,0]=4 3230 B14R1.38 CCCCCOC(C)c1ccccc1 7a_100000210253_100000230085 [0,1,0,1,0,0|2,0,0]=4 3231 B14R1.38 CCCCCO[C@H](C)c1ccccc1 34a_100000761318_100000718602 [0,1,0,1,0,0|2,0,0]=4 3232 B14R1.38 CCCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210326 [0,1,0,1,0,0|2,0,0]=4 3233 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000210326_100000230085 [0,1,0,1,0,0|2,0,0]=4 3234 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000230085_100000210326 [0,1,0,1,0,0|2,0,0]=4 3235 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000102301_100000756946 [0,1,0,1,0,0|2,0,0]=4 3236 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000701038_100000210211 [0,1,0,1,0,0|2,0,0]=4 3237 B14R1.38 CCCCNCC(C)c1ccccc1 270004a_100000102301_100000212034 [0,1,0,1,0,0|2,0,0]=4 3238 B14R1.38 CCCCNCC(C)c1ccccc1 34a_100000701038_100000210210 [0,1,0,1,0,0|2,0,0]=4 3239 B14R1.38 CCCCNCC(C)c1ccccc1 7a_106832991798_100000756946 [0,1,0,1,0,0|2,0,0]=4 3240 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000102301_100000185958 [0,1,0,1,0,0|2,0,0]=4 3241 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000210709_100000210211 [0,1,0,1,0,0|2,0,0]=4 3242 B14R1.38 CCCCNCC(O)c1ccccc1 7a_106832991798_100000185958 [0,1,0,1,0,0|2,0,0]=4 3243 B14R1.38 CCCCNCC(O)c1ccccn1 2230a_100000691469_100000210211 [0,1,0,1,0,0|2,0,0]=4 3244 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 2230a_100000102301_100011933945 [0,1,0,1,0,0|2,0,0]=4 3245 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 7a_106832991798_100011933945 [0,1,0,1,0,0|2,0,0]=4 3246 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100000210227_100000756946 [0,1,0,1,0,0|2,0,0]=4 3247 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100011215166_100000210210 [0,1,0,1,0,0|2,0,0]=4 3248 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100000210227_100000756946 [0,1,0,1,0,0|2,0,0]=4 3249 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100011215166_100000210211 [0,1,0,1,0,0|2,0,0]=4 3250 B14R1.38 CCCCOCC(O)c1ccccc1 34a_100000210227_100000185958 [0,1,0,1,0,0|2,0,0]=4 3251 B14R1.38 CCCCOCC(O)c1ccccc1 7a_100000210227_100000185958 [0,1,0,1,0,0|2,0,0]=4 3252 B14R1.38 CCCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210210 [0,1,0,1,0,0|2,0,0]=4 3253 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 34a_100000210227_100011933945 [0,1,0,1,0,0|2,0,0]=4 3254 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 7a_100000210227_100011933945 [0,1,0,1,0,0|2,0,0]=4 3255 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000210211_100000756946 [0,1,0,1,0,0|2,0,0]=4 3256 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000756946_100000210210 [0,1,0,1,0,0|2,0,0]=4 3257 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000185958_100000210210 [0,1,0,1,0,0|2,0,0]=4 3258 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000210211_100000185958 [0,1,0,1,0,0|2,0,0]=4 3259 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100000210211_100011933945 [0,1,0,1,0,0|2,0,0]=4 3260 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100011933945_100000210210 [0,1,0,1,0,0|2,0,0]=4 3261 B14R1.38 CCCNCCC(C)c1ccccc1 270004a_100020643023_100000189432 [0,1,0,1,0,0|2,0,0]=4 3262 B14R1.38 CCCNCCC(O)c1ccccc1 2230a_100000763605_100000210303 [0,1,0,1,0,0|2,0,0]=4 3263 B14R1.38 CCCOCC[C@@H](O)c1ccccc1 34a_100000210258_100000729684 [0,1,0,1,0,0|2,0,0]=4 3264 B14R1.38 CCCOCC[C@H](N)c1ccccc1 34a_100025705951_100000210303 [0,1,0,1,0,0|2,0,0]=4 3265 B14R1.38 CCCSCC[C@@H](O)c1ccccc1 62a_100000210303_100000729684 [0,1,0,1,0,0|2,0,0]=4 3266 B14R1.38 CCCSCC[C@@H](O)c1ccccc1 62a_100000729684_100000210303 [0,1,0,1,0,0|2,0,0]=4 3267 B14R1.38 CCOCCCC(N)c1ccccc1 34a_100000759318_100000210202 [0,1,0,1,0,0|2,0,0]=4 3268 B14R1.92 CCCCCCC(C)Sc1ccco1 62a_100009814098_100011215978 [0,1,0,1,0,0|1,0,1]=4 3269 B14R1.92 CCCCCCC(C)Sc1ccco1 62a_100011215978_100009814098 [0,1,0,1,0,0|1,0,1]=4 3270 B14R1.92 CCCCCCC(C)Sc1cccs1 62a_100011215356_100011215978 [0,1,0,1,0,0|1,1,0]=4 3271 B14R1.92 CCCCCCC(C)Sc1cccs1 62a_100011215978_100011215356 [0,1,0,1,0,0|1,1,0]=4 3272 B14R1.62 CCCCCC=Cc1ccoc1C=O 271570a_100000062253_100000756499 [0,1,0,1,0,0|0,0,2]=4 3273 B14R1.62 CCCCCC=Cc1ccsc1C=O 271570a_100000062253_100000766043 [0,1,0,1,0,0|0,0,2]=4 3274 B14R1.62 CCCCCC=Cc1cscc1C=O 271570a_100000062253_100000685484 [0,1,0,1,0,0|0,0,2]=4 3275 B14R1.62 CCCCCC=Cc1sccc1C=O 271570a_100000062253_100009816921 [0,1,0,1,0,0|0,0,2]=4 3276 B14R1.62 CCCCCCSc1[nH]cnc1C=O 62a_100000210314_100015192532 [0,1,0,1,0,0|2,0,0]=4 3277 B14R1.62 CCCCCCSc1[nH]cnc1C=O 62a_100015192532_100000210757 [0,1,0,1,0,0|2,0,0]=4 3278 B14R1.62 CCCCCCSc1ccoc1C=O 62a_100000210314_100000756499 [0,1,0,1,0,0|1,0,0]=3 3279 B14R1.62 CCCCCCSc1ccoc1C=O 62a_100000756499_100000210757 [0,1,0,1,0,0|1,0,0]=3 3280 B14R1.62 CCCCCCSc1ccsc1C=O 62a_100000210314_100000766043 [0,1,0,1,0,0|1,0,0]=3 3281 B14R1.62 CCCCCCSc1ccsc1C=O 62a_100000766043_100000210757 [0,1,0,1,0,0|1,0,0]=3 3282 B14R1.62 CCCCCCSc1cn[nH]c1C=O 62a_100000210314_100000732679 [0,1,0,1,0,0|2,0,0]=4 3283 B14R1.62 CCCCCCSc1cn[nH]c1C=O 62a_100000732679_100000210757 [0,1,0,1,0,0|2,0,0]=4 3284 B14R1.62 CCCCCCSc1cscc1C=O 62a_100000210314_100000685484 [0,1,0,1,0,0|1,0,0]=3 3285 B14R1.62 CCCCCCSc1cscc1C=O 62a_100000685484_100000210757 [0,1,0,1,0,0|1,0,0]=3 3286 B14R1.62 CCCCCCSc1sccc1C=O 62a_100000210314_100009816921 [0,1,0,1,0,0|1,0,0]=3 3287 B14R1.62 CCCCCCSc1sccc1C=O 62a_100009816921_100000210757 [0,1,0,1,0,0|1,0,0]=3 3288 B14R1.62 CCCCOCSc1ccoc1C=O 62a_100000756499_100011995733 [0,1,0,1,0,0|2,0,0]=4 3289 B14R1.62 CCCCOCSc1ccoc1C=O 62a_100011995733_100000756499 [0,1,0,1,0,0|2,0,0]=4 3290 B14R1.62 CCCCOCSc1ccsc1C=O 62a_100000766043_100011995733 [0,1,0,1,0,0|2,0,0]=4 3291 B14R1.62 CCCCOCSc1ccsc1C=O 62a_100011995733_100000766043 [0,1,0,1,0,0|2,0,0]=4 3292 B14R1.62 CCCCOCSc1cscc1C=O 62a_100000685484_100011995733 [0,1,0,1,0,0|2,0,0]=4 3293 B14R1.62 CCCCOCSc1cscc1C=O 62a_100011995733_100000685484 [0,1,0,1,0,0|2,0,0]=4 3294 B14R1.62 CCCCOCSc1sccc1C=O 62a_100009816921_100011995733 [0,1,0,1,0,0|2,0,0]=4 3295 B14R1.62 CCCCOCSc1sccc1C=O 62a_100011995733_100009816921 [0,1,0,1,0,0|2,0,0]=4 3296 B14R1.62 CCCOCCSc1ccoc1C=O 62a_100000756499_100011215938 [0,1,0,1,0,0|2,0,0]=4 3297 B14R1.62 CCCOCCSc1ccoc1C=O 62a_100011215938_100000756499 [0,1,0,1,0,0|2,0,0]=4 3298 B14R1.62 CCCOCCSc1ccsc1C=O 62a_100000766043_100011215938 [0,1,0,1,0,0|2,0,0]=4 3299 B14R1.62 CCCOCCSc1ccsc1C=O 62a_100011215938_100000766043 [0,1,0,1,0,0|2,0,0]=4 3300 B14R1.62 CCCOCCSc1cscc1C=O 62a_100000685484_100011215938 [0,1,0,1,0,0|2,0,0]=4 3301 B14R1.62 CCCOCCSc1cscc1C=O 62a_100011215938_100000685484 [0,1,0,1,0,0|2,0,0]=4 3302 B14R1.62 CCCOCCSc1sccc1C=O 62a_100009816921_100011215938 [0,1,0,1,0,0|2,0,0]=4 3303 B14R1.62 CCCOCCSc1sccc1C=O 62a_100011215938_100009816921 [0,1,0,1,0,0|2,0,0]=4 3304 B14R1.62 CCOCCCSc1ccoc1C=O 62a_100000756499_100012232248 [0,1,0,1,0,0|2,0,0]=4 3305 B14R1.62 CCOCCCSc1ccoc1C=O 62a_100012232248_100000756499 [0,1,0,1,0,0|2,0,0]=4 3306 B14R1.62 CCOCCCSc1ccsc1C=O 62a_100000766043_100012232248 [0,1,0,1,0,0|2,0,0]=4 3307 B14R1.62 CCOCCCSc1ccsc1C=O 62a_100012232248_100000766043 [0,1,0,1,0,0|2,0,0]=4 3308 B14R1.62 CCOCCCSc1cscc1C=O 62a_100000685484_100012232248 [0,1,0,1,0,0|2,0,0]=4 3309 B14R1.62 CCOCCCSc1cscc1C=O 62a_100012232248_100000685484 [0,1,0,1,0,0|2,0,0]=4 3310 B14R1.62 CCOCCCSc1sccc1C=O 62a_100009816921_100012232248 [0,1,0,1,0,0|2,0,0]=4 3311 B14R1.62 CCOCCCSc1sccc1C=O 62a_100012232248_100009816921 [0,1,0,1,0,0|2,0,0]=4 3312 B14R1.62 COCCCCSc1ccoc1C=O 62a_100000730899_100000756499 [0,1,0,1,0,0|2,0,0]=4 3313 B14R1.62 COCCCCSc1ccoc1C=O 62a_100000756499_100000730899 [0,1,0,1,0,0|2,0,0]=4 3314 B14R1.62 COCCCCSc1ccsc1C=O 62a_100000730899_100000766043 [0,1,0,1,0,0|2,0,0]=4 3315 B14R1.62 COCCCCSc1ccsc1C=O 62a_100000766043_100000730899 [0,1,0,1,0,0|2,0,0]=4 3316 B14R1.62 COCCCCSc1cscc1C=O 62a_100000685484_100000730899 [0,1,0,1,0,0|2,0,0]=4 3317 B14R1.62 COCCCCSc1cscc1C=O 62a_100000730899_100000685484 [0,1,0,1,0,0|2,0,0]=4 3318 B14R1.62 COCCCCSc1sccc1C=O 62a_100000730899_100009816921 [0,1,0,1,0,0|2,0,0]=4 3319 B14R1.62 COCCCCSc1sccc1C=O 62a_100009816921_100000730899 [0,1,0,1,0,0|2,0,0]=4 3320 B14R1.62 O=Cc1ccsc1SCCCCCF 62a_100000729378_100009816921 [0,1,0,1,0,0|2,0,0]=4 3321 B14R1.62 O=Cc1ccsc1SCCCCCF 62a_100009816921_100000729378 [0,1,0,1,0,0|2,0,0]=4 3322 B14R1.62 O=Cc1ccsc1SCCCCCO 62a_100000746330_100009816921 [0,1,0,1,0,0|2,0,0]=4 3323 B14R1.62 O=Cc1ccsc1SCCCCCO 62a_100009816921_100000746330 [0,1,0,1,0,0|2,0,0]=4 3324 B14R1.62 O=Cc1cscc1SCCCCCF 62a_100000685484_100000729378 [0,1,0,1,0,0|2,0,0]=4 3325 B14R1.62 O=Cc1cscc1SCCCCCF 62a_100000729378_100000685484 [0,1,0,1,0,0|2,0,0]=4 3326 B14R1.62 O=Cc1cscc1SCCCCCO 62a_100000685484_100000746330 [0,1,0,1,0,0|2,0,0]=4 3327 B14R1.62 O=Cc1cscc1SCCCCCO 62a_100000746330_100000685484 [0,1,0,1,0,0|2,0,0]=4 3328 B14R1.62 O=Cc1occc1SCCCCCF 62a_100000729378_100000756499 [0,1,0,1,0,0|2,0,0]=4 3329 B14R1.62 O=Cc1occc1SCCCCCF 62a_100000756499_100000729378 [0,1,0,1,0,0|2,0,0]=4 3330 B14R1.62 O=Cc1occc1SCCCCCO 62a_100000746330_100000756499 [0,1,0,1,0,0|2,0,0]=4 3331 B14R1.62 O=Cc1occc1SCCCCCO 62a_100000756499_100000746330 [0,1,0,1,0,0|2,0,0]=4 3332 B14R1.62 O=Cc1sccc1SCCCCCF 62a_100000729378_100000766043 [0,1,0,1,0,0|2,0,0]=4 3333 B14R1.62 O=Cc1sccc1SCCCCCF 62a_100000766043_100000729378 [0,1,0,1,0,0|2,0,0]=4 3334 B14R1.62 O=Cc1sccc1SCCCCCO 62a_100000746330_100000766043 [0,1,0,1,0,0|2,0,0]=4 3335 B14R1.62 O=Cc1sccc1SCCCCCO 62a_100000766043_100000746330 [0,1,0,1,0,0|2,0,0]=4 3336 B14R1.138 CCCCCOc1cccccc1=O 34a_100000036025_100000718602 [0,1,0,1,0,0|0,0,2]=4 3337 B14R1.138 CCCCCOc1cccccc1=O 7a_100000036025_100000210326 [0,1,0,1,0,0|0,0,2]=4 3338 B14R1.234 CC=Cc1sccc1CCCCCC 271570a_100016259895_100009817158 [0,1,0,1,0,0|1,0,1]=4 3339 B14R1.476 CCCCCSc1ccccc1C=O 62a_100000210073_100000210326 [0,1,0,1,0,0|0,0,2]=4 3340 B14R1.476 CCCCCSc1ccccc1C=O 62a_100000210326_100000210073 [0,1,0,1,0,0|0,0,2]=4 3341 B14R1.476 CCCCCSc1cccnc1C=O 62a_100000210326_100011934733 [0,1,0,1,0,0|1,0,1]=4 3342 B14R1.476 CCCCCSc1cccnc1C=O 62a_100011934733_100000210326 [0,1,0,1,0,0|1,0,1]=4 3343 B14R1.476 CCCCCSc1ccncc1C=O 62a_100000050567_100000210326 [0,1,0,1,0,0|1,0,1]=4 3344 B14R1.476 CCCCCSc1ccncc1C=O 62a_100000210326_100000050567 [0,1,0,1,0,0|1,0,1]=4 3345 B14R1.476 CCCCCSc1cnccc1C=O 62a_100000210326_100011934409 [0,1,0,1,0,0|1,0,1]=4 3346 B14R1.476 CCCCCSc1cnccc1C=O 62a_100011934409_100000210326 [0,1,0,1,0,0|1,0,1]=4 3347 B14R1.476 CCCCCSc1ncccc1C=O 62a_100000210326_100009816751 [0,1,0,1,0,0|1,0,1]=4 3348 B14R1.476 CCCCCSc1ncccc1C=O 62a_100009816751_100000210326 [0,1,0,1,0,0|1,0,1]=4 3349 B14R1.476 CCCCNCc1ccccc1C=O 2230a_100000102301_200009853537 [0,1,0,1,0,0|0,0,2]=4 3350 B14R1.476 CCCCNCc1ccccc1C=O 7a_106832991798_200009853537 [0,1,0,1,0,0|0,0,2]=4 3351 B14R1.476 CCCCOCc1ccccc1C=O 34a_100000210227_200009853537 [0,1,0,1,0,0|0,0,2]=4 3352 B14R1.476 CCCCOCc1ccccc1C=O 7a_100000210227_200009853537 [0,1,0,1,0,0|0,0,2]=4 3353 B14R1.476 CCCCSCc1ccccc1C=O 62a_100000210211_200009853537 [0,1,0,1,0,0|0,0,2]=4 3354 B14R1.476 CCCCSCc1ccccc1C=O 62a_200009853537_100000210210 [0,1,0,1,0,0|0,0,2]=4 3355 B14R1.476 CCCOCCc1ccccc1C=O 34a_100000210258_100010186698 [0,1,0,1,0,0|0,0,2]=4 3356 B14R1.476 CCCSCCc1ccccc1C=O 62a_100000210303_100010186698 [0,1,0,1,0,0|0,0,2]=4 3357 B14R1.476 CCCSCCc1ccccc1C=O 62a_100010186698_100000210303 [0,1,0,1,0,0|0,0,2]=4 3358 B14R1.2352 C/C=C/C=C/COC1CCCCCC1 34a_100016283227_100011217769 [0,1,0,1,0,0|1,0,1]=4 3359 B14R1.86 C/C=C/C=CC(=O)CCC1CCCC1 1458a_100000185730_100000760354 [0,1,0,1,0,0|1,0,0]=3 3360 B14R1.86 C/C=C/C=CC(=O)CCN1CCCC1 1458a_100000185730_100000004467 [0,1,0,1,0,0|2,0,0]=4 3361 B14R1.86 C/C=C/C=CC(=O)NCC1CCCC1 11a_100000737975_100000185730 [0,1,0,1,0,0|2,0,0]=4 3362 B14R1.86 C/C=C/C=CC(=O)NCC1CCCC1 1626a_100000737975_100000185730 [0,1,0,1,0,0|2,0,0]=4 3363 B14R1.86 C/C=C/C=CC(=O)NCC1CCCC1 240690a_100000737975_100000185730 [0,1,0,1,0,0|2,0,0]=4 3364 B14R1.158 C/C=C/C=CC(=O)CC1CCCCC1 1458a_100000185730_100000211423 [0,1,0,1,0,0|1,0,0]=3 3365 B14R1.158 C/C=C/C=CC(=O)CC1CCCCO1 1458a_100000185730_100000211543 [0,1,0,1,0,0|2,0,0]=4 3366 B14R1.158 C/C=C/C=CC(=O)CC1CCCOC1 1458a_100000185730_100000741521 [0,1,0,1,0,0|2,0,0]=4 3367 B14R1.158 C/C=C/C=CC(=O)CC1CCOCC1 1458a_100000185730_100000754603 [0,1,0,1,0,0|2,0,0]=4 3368 B14R1.158 C/C=C/C=CC(=O)NC1CCCCC1 11a_100000182618_100000185730 [0,1,0,1,0,0|2,0,0]=4 3369 B14R1.158 C/C=C/C=CC(=O)NC1CCCCC1 1626a_100000182618_100000185730 [0,1,0,1,0,0|2,0,0]=4 3370 B14R1.158 C/C=C/C=CC(=O)NC1CCCCC1 240690a_100000182618_100000185730 [0,1,0,1,0,0|2,0,0]=4 3371 B14R1.158 CCCCCC(=O)Cc1ccccc1 1458a_100000212188_100015291786 [0,1,0,1,0,0|1,0,1]=4 3372 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000212188_100000721315 [0,1,0,1,0,0|1,0,1]=4 3373 B14R1.158 CCCCCC(=O)Cc1ccccn1 1458a_100000233486_100000210326 [0,1,0,1,0,0|1,0,1]=4 3374 B14R1.158 CCCCCC(C)Nc1ccccc1 34a_100000106764_200011218191 [0,1,0,1,0,0|2,0,0]=4 3375 B14R1.158 CCCCCC(C)Oc1ccccc1 34a_100000210340_200011218191 [0,1,0,1,0,0|2,0,0]=4 3376 B14R1.158 CCCCCC(C)Oc1ccccc1 7a_100000210340_200011218191 [0,1,0,1,0,0|2,0,0]=4 3377 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_100000719477_200011218191 [0,1,0,1,0,0|2,0,0]=4 3378 B14R1.158 CCCCCC(C)Sc1ccccc1 62a_200011218191_100000041952 [0,1,0,1,0,0|2,0,0]=4 3379 B14R1.158 CCCCCC(C)Sc1ccccn1 62a_100011216584_200011218191 [0,1,0,1,0,0|2,0,0]=4 3380 B14R1.158 CCCCCC(C)Sc1ccccn1 62a_200011218191_100011216584 [0,1,0,1,0,0|2,0,0]=4 3381 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000186898_100000210326 [0,1,0,1,0,0|2,0,0]=4 3382 B14R1.158 CCCCCN(C)Cc1ccccc1 2230a_100000223495_100015291786 [0,1,0,1,0,0|2,0,0]=4 3383 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000186898_100000210215 [0,1,0,1,0,0|2,0,0]=4 3384 B14R1.158 CCCCCN(C)Cc1ccccc1 269982a_100000223495_100000211182 [0,1,0,1,0,0|2,0,0]=4 3385 B14R1.158 CCCCCN(C)Cc1ccccc1 270004a_100000223495_100015611070 [0,1,0,1,0,0|2,0,0]=4 3386 B14R1.158 CCCCCN(C)Cc1ccccn1 2230a_100000207498_100000210326 [0,1,0,1,0,0|2,0,0]=4 3387 B14R1.158 CCCCCN(C)Cc1ccccn1 2230a_100000223495_100000721315 [0,1,0,1,0,0|2,0,0]=4 3388 B14R1.158 CCCCCN(C)Cc1ccccn1 269982a_100000207498_100000210215 [0,1,0,1,0,0|2,0,0]=4 3389 B14R1.158 CCCCCN(C)Cc1ccccn1 269982a_100000223495_100000721315 [0,1,0,1,0,0|2,0,0]=4 3390 B14R1.158 CCCCCN(C)Cc1ccccn1 270004a_100000223495_100000209966 [0,1,0,1,0,0|2,0,0]=4 3391 B14R1.158 CCCCNC(C)Cc1ccccc1 7a_106832991798_200011218536 [0,1,0,1,0,0|2,0,0]=4 3392 B14R1.158 CCCCNC(C)Cc1ccccn1 2230a_100000238496_100000210211 [0,1,0,1,0,0|2,0,0]=4 3393 B14R1.158 CCCCOC(C)Cc1ccccc1 34a_100000210227_200011218536 [0,1,0,1,0,0|2,0,0]=4 3394 B14R1.158 CCCCOC(C)Cc1ccccc1 34a_100000748627_100000210210 [0,1,0,1,0,0|2,0,0]=4 3395 B14R1.158 CCCCOC(C)Cc1ccccc1 7a_100000210227_200011218536 [0,1,0,1,0,0|2,0,0]=4 3396 B14R1.158 CCCCOC(C)Cc1ccccc1 7a_100000748627_100000210211 [0,1,0,1,0,0|2,0,0]=4 3397 B14R1.158 CCCCSC(C)Cc1ccccc1 62a_100000210211_200011218536 [0,1,0,1,0,0|2,0,0]=4 3398 B14R1.158 CCCCSC(C)Cc1ccccc1 62a_200011218536_100000210210 [0,1,0,1,0,0|2,0,0]=4 3399 B14R1.158 CCCNCC(O)Cc1ccccc1 2230a_100000752270_100000210303 [0,1,0,1,0,0|2,0,0]=4 3400 B14R1.158 CCCOCC(C)Cc1ccccc1 34a_100012125295_100000210303 [0,1,0,1,0,0|2,0,0]=4 3401 B14R1.158 CCCOCC(C)Cc1ccccc1 7a_100012125295_100000210303 [0,1,0,1,0,0|2,0,0]=4 3402 B14R1.158 CCCOCC(N)Cc1ccccc1 34a_100000739027_100000210303 [0,1,0,1,0,0|2,0,0]=4 3403 B14R1.158 CCCOC[C@@H](O)Cc1ccccc1 34a_100000210258_100000729385 [0,1,0,1,0,0|2,0,0]=4 3404 B14R1.158 CCCSC[C@@H](O)Cc1ccccc1 62a_100000210303_100000729385 [0,1,0,1,0,0|2,0,0]=4 3405 B14R1.158 CCCSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000210303 [0,1,0,1,0,0|2,0,0]=4 3406 B14R1.169 CCCCCNCC(=O)c1cccs1 2230a_100000209983_100000211436 [0,1,0,1,0,0|1,1,0]=4 3407 B14R1.169 CCCCCOCC(=O)c1ccc[nH]1 7a_100000210253_200011262396 [0,1,0,1,0,0|2,0,0]=4 3408 B14R1.169 CCCCCOCC(=O)c1ccco1 7a_100000210253_100000211439 [0,1,0,1,0,0|1,0,1]=4 3409 B14R1.169 CCCCCOCC(=O)c1cccs1 7a_100000210253_100000211436 [0,1,0,1,0,0|1,1,0]=4 3410 B14R1.169 CCCCCSCC(=O)c1ccc[nH]1 62a_100000210326_200011262396 [0,1,0,1,0,0|2,0,0]=4 3411 B14R1.169 CCCCCSCC(=O)c1ccc[nH]1 62a_200011262396_100000210326 [0,1,0,1,0,0|2,0,0]=4 3412 B14R1.169 CCCCCSCC(=O)c1ccco1 62a_100000210326_100000211439 [0,1,0,1,0,0|1,0,1]=4 3413 B14R1.169 CCCCCSCC(=O)c1ccco1 62a_100000211439_100000210326 [0,1,0,1,0,0|1,0,1]=4 3414 B14R1.169 CCCCCSCC(=O)c1cccs1 62a_100000210326_100000211436 [0,1,0,1,0,0|1,1,0]=4 3415 B14R1.169 CCCCCSCC(=O)c1cccs1 62a_100000211436_100000210326 [0,1,0,1,0,0|1,1,0]=4 3416 B14R1.169 CCCCNCCC(=O)c1cccs1 2230a_100000102301_100011290775 [0,1,0,1,0,0|1,1,0]=4 3417 B14R1.169 CCCCNCCC(=O)c1cccs1 7a_106832991798_100011290775 [0,1,0,1,0,0|1,1,0]=4 3418 B14R1.169 CCCCOCCC(=O)c1cccs1 7a_100000210227_100011290775 [0,1,0,1,0,0|1,1,0]=4 3419 B14R1.169 CCCCSCCC(=O)c1cccs1 62a_100000210211_100011290775 [0,1,0,1,0,0|1,1,0]=4 3420 B14R1.169 CCCCSCCC(=O)c1cccs1 62a_100011290775_100000210210 [0,1,0,1,0,0|1,1,0]=4 3421 B14R1.1035 C/C=C/C=CC(=O)N1CCCCC1C 11a_100000211376_100000185730 [0,1,0,1,0,0|2,0,0]=4 3422 B14R1.1035 C/C=C/C=CC(=O)N1CCCCC1C 1626a_100000211376_100000185730 [0,1,0,1,0,0|2,0,0]=4 3423 B14R1.1035 C/C=C/C=CC(=O)N1CCCCC1C 240690a_100000211376_100000185730 [0,1,0,1,0,0|2,0,0]=4 3424 B14R1.1045 C/C=C/C=CC(=O)N1CCCC1CC 11a_100000754278_100000185730 [0,1,0,1,0,0|2,0,0]=4 3425 B14R1.1045 C/C=C/C=CC(=O)N1CCCC1CC 1626a_100000754278_100000185730 [0,1,0,1,0,0|2,0,0]=4 3426 B14R1.1045 C/C=C/C=CC(=O)N1CCCC1CC 240690a_100000754278_100000185730 [0,1,0,1,0,0|2,0,0]=4 3427 B14R1.3001 C/C=C/C=CC(=O)C1CCCCCC1 1458a_100000185730_100011217769 [0,1,0,1,0,0|1,0,0]=3 3428 B14R1.3001 C/C=C/C=CC(=O)N1CCCCCC1 11a_100000185865_100000185730 [0,1,0,1,0,0|2,0,0]=4 3429 B14R1.3001 C/C=C/C=CC(=O)N1CCCCCC1 1626a_100000185865_100000185730 [0,1,0,1,0,0|2,0,0]=4 3430 B14R1.3001 C/C=C/C=CC(=O)N1CCCCCC1 240690a_100000185865_100000185730 [0,1,0,1,0,0|2,0,0]=4 3431 B14R2.3 CCCNC1CCc2c1cccc2 269862a_100020643023_100000212051 [0,0,0,2,0,0|2,0,0]=4 3432 B14R2.3 CCCN[C@H]1CCc2c1cccc2 2230a_100016989578_100000210303 [0,0,0,2,0,0|2,0,0]=4 3433 B14R2.3 CCCN[C@H]1CCc2c1cccc2 34a_100016989578_100000210303 [0,0,0,2,0,0|2,0,0]=4 3434 B14R2.3 CCCOC1CCc2c1cccc2 34a_100000212247_100000210303 [0,0,0,2,0,0|2,0,0]=4 3435 B14R2.3 CCCOC1CCc2c1cccc2 7a_100000212247_100000210303 [0,0,0,2,0,0|2,0,0]=4 3436 B14R2.3 CCCSC1CCc2c1cccc2 62a_100000210303_200000721974 [0,0,0,2,0,0|2,0,0]=4 3437 B14R2.3 CCNCC1CCc2c1cccc2 2230a_100020632452_100000210202 [0,0,0,2,0,0|2,0,0]=4 3438 B14R2.3 CCNCC1CCc2c1cccc2 34a_100020632452_100000210202 [0,0,0,2,0,0|2,0,0]=4 3439 B14R2.6 c1ccc(cc1)NC2CCCCC2 34a_100000106764_100000210327 [0,0,0,2,0,0|2,0,0]=4 3440 B14R2.6 c1ccc(cc1)OC2CCCCC2 34a_100000210340_100000210327 [0,0,0,2,0,0|2,0,0]=4 3441 B14R2.6 c1ccc(cc1)OC2CCCCC2 7a_100000210340_100000210327 [0,0,0,2,0,0|2,0,0]=4 3442 B14R2.6 c1ccc(cc1)SC2CCCCC2 62a_100000210327_100000041952 [0,0,0,2,0,0|2,0,0]=4 3443 B14R2.6 c1ccc(cc1)SC2CCCCC2 62a_100000719477_100000210327 [0,0,0,2,0,0|2,0,0]=4 3444 B14R2.6 c1ccc(nc1)SC2CCCCC2 62a_100000210327_100011216584 [0,0,0,2,0,0|2,0,0]=4 3445 B14R2.6 c1ccc(nc1)SC2CCCCC2 62a_100011216584_100000210327 [0,0,0,2,0,0|2,0,0]=4 3446 B14R2.14 CCN1CCCC1c2ccccc2 2230a_100000243309_100000210202 [0,0,0,2,0,0|2,0,0]=4 3447 B14R2.14 CCN1CCCC1c2ccccc2 269982a_100000243309_100000204670 [0,0,0,2,0,0|2,0,0]=4 3448 B14R2.14 CCN1CCCC1c2ccccc2 34a_100000243309_100000210202 [0,0,0,2,0,0|2,0,0]=4 3449 B14R2.14 CCN1CCCC1c2ccccn2 2230a_100000744244_100000210202 [0,0,0,2,0,0|2,0,0]=4 3450 B14R2.14 CCN1CCCC1c2ccccn2 269982a_100000744244_100000204670 [0,0,0,2,0,0|2,0,0]=4 3451 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200000210301 [0,0,0,2,0,0|2,0,0]=4 3452 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200000210301 [0,0,0,2,0,0|2,0,0]=4 3453 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200025704644 [0,0,0,2,0,0|2,0,0]=4 3454 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200025704644 [0,0,0,2,0,0|2,0,0]=4 3455 B14R2.24 CN1CCCCC1c2ccccc2 2230a_100000707174_200000210301 [0,0,0,2,0,0|2,0,0]=4 3456 B14R2.24 CN1CCCCC1c2ccccc2 269982a_100000707174_200000210301 [0,0,0,2,0,0|2,0,0]=4 3457 B14R2.24 CN1CCCCC1c2ccccc2 34a_100000707174_200000210301 [0,0,0,2,0,0|2,0,0]=4 3458 B14R2.24 CN1CCCCC1c2ccccn2 2230a_100015185292_200000210301 [0,0,0,2,0,0|2,0,0]=4 3459 B14R2.24 CN1CCCCC1c2ccccn2 269982a_100015185292_200000210301 [0,0,0,2,0,0|2,0,0]=4 3460 B14R2.24 Oc1ccccc1C2CCCCC2 271570a_203496583355_200009813743 [0,0,0,2,0,0|0,0,2]=4 3461 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 2230a_100000707174_200025704644 [0,0,0,2,0,0|2,0,0]=4 3462 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 269982a_100000707174_200025704644 [0,0,0,2,0,0|2,0,0]=4 3463 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 34a_100000707174_200025704644 [0,0,0,2,0,0|2,0,0]=4 3464 B14R2.24 [13CH3]N1CCCCC1c2ccccn2 2230a_100015185292_200025704644 [0,0,0,2,0,0|2,0,0]=4 3465 B14R2.24 [13CH3]N1CCCCC1c2ccccn2 269982a_100015185292_200025704644 [0,0,0,2,0,0|2,0,0]=4 3466 B14R2.30 CN1CCCC1Cc2ccccc2 2230a_100159249835_200000210301 [0,0,0,2,0,0|2,0,0]=4 3467 B14R2.30 CN1CCCC1Cc2ccccc2 269982a_100159249835_200000210301 [0,0,0,2,0,0|2,0,0]=4 3468 B14R2.30 CN1CCCC1Cc2ccccc2 34a_100159249835_200000210301 [0,0,0,2,0,0|2,0,0]=4 3469 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 2230a_100015189458_100015291786 [0,0,0,2,0,0|2,0,0]=4 3470 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 269982a_100015189458_100000211182 [0,0,0,2,0,0|2,0,0]=4 3471 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 270004a_100015189458_100015611070 [0,0,0,2,0,0|2,0,0]=4 3472 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 34a_100015189458_100015291786 [0,0,0,2,0,0|2,0,0]=4 3473 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 2230a_100015189458_100000721315 [0,0,0,2,0,0|2,0,0]=4 3474 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 269982a_100015189458_100000721315 [0,0,0,2,0,0|2,0,0]=4 3475 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 270004a_100015189458_100000209966 [0,0,0,2,0,0|2,0,0]=4 3476 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 34a_100015189458_100000721315 [0,0,0,2,0,0|2,0,0]=4 3477 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 2230a_100020605311_100015291786 [0,0,0,2,0,0|2,0,0]=4 3478 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 269982a_100020605311_100000211182 [0,0,0,2,0,0|2,0,0]=4 3479 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 270004a_100020605311_100015611070 [0,0,0,2,0,0|2,0,0]=4 3480 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 2230a_100020605311_100000721315 [0,0,0,2,0,0|2,0,0]=4 3481 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 269982a_100020605311_100000721315 [0,0,0,2,0,0|2,0,0]=4 3482 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 270004a_100020605311_100000209966 [0,0,0,2,0,0|2,0,0]=4 3483 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 2230a_100159249835_200025704644 [0,0,0,2,0,0|2,0,0]=4 3484 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 269982a_100159249835_200025704644 [0,0,0,2,0,0|2,0,0]=4 3485 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 34a_100159249835_200025704644 [0,0,0,2,0,0|2,0,0]=4 3486 B14R2.31 CC1CCN1CCc2ccccc2 269982a_100000755817_100000765856 [0,0,0,2,0,0|2,0,0]=4 3487 B14R2.31 CC1CCN1CCc2ccccc2 34a_100000755817_100000765856 [0,0,0,2,0,0|2,0,0]=4 3488 B14R2.31 CC1CCN1CCc2ccccn2 269982a_100000755817_100015183660 [0,0,0,2,0,0|2,0,0]=4 3489 B14R2.33 CCCN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100000210303 [0,0,0,2,0,0|2,0,0]=4 3490 B14R2.33 CCCN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000210303 [0,0,0,2,0,0|2,0,0]=4 3491 B14R2.33 CCCN1C[C@@H]1Cc2ccccc2 34a_100016998360_100000210303 [0,0,0,2,0,0|2,0,0]=4 3492 B14R2.35 CCCN1CCC1c2ccccc2 2230a_100000739605_100000210303 [0,0,0,2,0,0|2,0,0]=4 3493 B14R2.35 CCCN1CCC1c2ccccc2 269982a_100000739605_100000210303 [0,0,0,2,0,0|2,0,0]=4 3494 B14R2.49 CC1CC1COCc2ccccc2 34a_100000744939_100015291786 [0,0,0,2,0,0|2,0,0]=4 3495 B14R2.49 CC1CC1COCc2ccccc2 7a_100000744939_100000211182 [0,0,0,2,0,0|2,0,0]=4 3496 B14R2.49 CC1CC1COCc2ccccn2 34a_100000744939_100000721315 [0,0,0,2,0,0|2,0,0]=4 3497 B14R2.49 CC1CC1COCc2ccccn2 7a_100000744939_100000721315 [0,0,0,2,0,0|2,0,0]=4 3498 B14R2.66 CCCN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100000210303 [0,0,0,2,0,0|2,0,0]=4 3499 B14R2.66 CCCN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000210303 [0,0,0,2,0,0|2,0,0]=4 3500 B14R2.66 CCOCC1CC1c2ccccc2 34a_100011997005_100000210202 [0,0,0,2,0,0|2,0,0]=4 3501 B14R2.66 CCOCC1CC1c2ccccc2 7a_100011997005_100000210202 [0,0,0,2,0,0|2,0,0]=4 3502 B14R2.101 C(=CC1CCCCC1)c2ccco2 271570a_100016283615_100009814098 [0,0,0,2,0,0|0,0,2]=4 3503 B14R2.101 C(=CC1CCCCC1)c2cccs2 271570a_100016283615_100011215356 [0,0,0,2,0,0|0,1,1]=4 3504 B14R2.101 c1ccc(cc1)CCN2CCCC2 2230a_100000188435_100000765856 [0,0,0,2,0,0|2,0,0]=4 3505 B14R2.101 c1ccc(cc1)CCN2CCCC2 269982a_100000188435_100000765856 [0,0,0,2,0,0|2,0,0]=4 3506 B14R2.101 c1ccc(cc1)CNC2CCCC2 207a_100000211070_100015611070 [0,0,0,2,0,0|2,0,0]=4 3507 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100000211070_100015291786 [0,0,0,2,0,0|2,0,0]=4 3508 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100015324214_100000179811 [0,0,0,2,0,0|2,0,0]=4 3509 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100000211070_100015611070 [0,0,0,2,0,0|2,0,0]=4 3510 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100015324214_100000210133 [0,0,0,2,0,0|2,0,0]=4 3511 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100000211070_100015291786 [0,0,0,2,0,0|2,0,0]=4 3512 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100015324214_100000179811 [0,0,0,2,0,0|2,0,0]=4 3513 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210269_100015291786 [0,0,0,2,0,0|2,0,0]=4 3514 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210790_100000179811 [0,0,0,2,0,0|2,0,0]=4 3515 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210269_100000211182 [0,0,0,2,0,0|2,0,0]=4 3516 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210790_100000179811 [0,0,0,2,0,0|2,0,0]=4 3517 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100000211182_100000179811 [0,0,0,2,0,0|2,0,0]=4 3518 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100011217020_100015291786 [0,0,0,2,0,0|2,0,0]=4 3519 B14R2.101 c1ccc(cc1)NCC2CCCC2 34a_100000106764_100000740388 [0,0,0,2,0,0|2,0,0]=4 3520 B14R2.101 c1ccc(cc1)OCC2CCCC2 34a_100000210340_100000740388 [0,0,0,2,0,0|2,0,0]=4 3521 B14R2.101 c1ccc(cc1)OCC2CCCC2 7a_100000210340_100000740388 [0,0,0,2,0,0|2,0,0]=4 3522 B14R2.101 c1ccc(cc1)SCC2CCCC2 62a_100000719477_100000740388 [0,0,0,2,0,0|2,0,0]=4 3523 B14R2.101 c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000041952 [0,0,0,2,0,0|2,0,0]=4 3524 B14R2.101 c1ccc(nc1)CCN2CCCC2 2230a_100000188435_100015183660 [0,0,0,2,0,0|2,0,0]=4 3525 B14R2.101 c1ccc(nc1)CCN2CCCC2 269982a_100000188435_100015183660 [0,0,0,2,0,0|2,0,0]=4 3526 B14R2.101 c1ccc(nc1)CNC2CCCC2 207a_100000211070_100000209966 [0,0,0,2,0,0|2,0,0]=4 3527 B14R2.101 c1ccc(nc1)CNC2CCCC2 2230a_100000211070_100000721315 [0,0,0,2,0,0|2,0,0]=4 3528 B14R2.101 c1ccc(nc1)CNC2CCCC2 270004a_100000210449_100000210133 [0,0,0,2,0,0|2,0,0]=4 3529 B14R2.101 c1ccc(nc1)CNC2CCCC2 270004a_100000211070_100000209966 [0,0,0,2,0,0|2,0,0]=4 3530 B14R2.101 c1ccc(nc1)CNC2CCCC2 34a_100000211070_100000721315 [0,0,0,2,0,0|2,0,0]=4 3531 B14R2.101 c1ccc(nc1)COC2CCCC2 34a_100000210269_100000721315 [0,0,0,2,0,0|2,0,0]=4 3532 B14R2.101 c1ccc(nc1)COC2CCCC2 7a_100000210269_100000721315 [0,0,0,2,0,0|2,0,0]=4 3533 B14R2.101 c1ccc(nc1)CSC2CCCC2 62a_100000721315_100000179811 [0,0,0,2,0,0|2,0,0]=4 3534 B14R2.101 c1ccc(nc1)CSC2CCCC2 62a_100011217020_100000721315 [0,0,0,2,0,0|2,0,0]=4 3535 B14R2.101 c1ccc(nc1)SCC2CCCC2 62a_100000740388_100011216584 [0,0,0,2,0,0|2,0,0]=4 3536 B14R2.101 c1ccc(nc1)SCC2CCCC2 62a_100011216584_100000740388 [0,0,0,2,0,0|2,0,0]=4 3537 B14R2.101 c1coc(c1)SCC2CCCCC2 62a_100000211423_100009814098 [0,0,0,2,0,0|1,0,1]=4 3538 B14R2.101 c1coc(c1)SCC2CCCCC2 62a_100009814098_100000211423 [0,0,0,2,0,0|1,0,1]=4 3539 B14R2.101 c1csc(c1)SCC2CCCCC2 62a_100000211423_100011215356 [0,0,0,2,0,0|1,1,0]=4 3540 B14R2.101 c1csc(c1)SCC2CCCCC2 62a_100011215356_100000211423 [0,0,0,2,0,0|1,1,0]=4 3541 B14R2.2014 CNC1CCCCc2c1cccc2 269862a_106832991636_100000184060 [0,0,0,2,0,0|2,0,0]=4 3542 B14R2.3018 c1ccc(cc1)CCCNC2CC2 34a_100000211184_100000211595 [0,0,0,2,0,0|2,0,0]=4 3543 B14R2.3018 c1ccc(cc1)CCCNC2CC2 34a_100000212008_100000211621 [0,0,0,2,0,0|2,0,0]=4 3544 B14R2.3018 c1ccc(cc1)CCCOC2CC2 34a_100000210828_100000211595 [0,0,0,2,0,0|2,0,0]=4 3545 B14R2.3018 c1ccc(cc1)CCCSC2CC2 62a_100000211621_100000211595 [0,0,0,2,0,0|2,0,0]=4 3546 B14R2.3018 c1ccc(cc1)CCNCC2CC2 2230a_100000106460_100000742324 [0,0,0,2,0,0|2,0,0]=4 3547 B14R2.3018 c1ccc(cc1)CCNCC2CC2 2230a_100000735609_100000765856 [0,0,0,2,0,0|2,0,0]=4 3548 B14R2.3018 c1ccc(cc1)CCNCC2CC2 269862a_100000106460_100000741477 [0,0,0,2,0,0|2,0,0]=4 3549 B14R2.3018 c1ccc(cc1)CCNCC2CC2 34a_100000106460_100000742324 [0,0,0,2,0,0|2,0,0]=4 3550 B14R2.3018 c1ccc(cc1)CCNCC2CC2 34a_100000735609_100000765856 [0,0,0,2,0,0|2,0,0]=4 3551 B14R2.3018 c1ccc(cc1)CCOCC2CC2 34a_100000210268_100000742324 [0,0,0,2,0,0|2,0,0]=4 3552 B14R2.3018 c1ccc(cc1)CCOCC2CC2 34a_100000211283_100000765856 [0,0,0,2,0,0|2,0,0]=4 3553 B14R2.3018 c1ccc(cc1)CCOCC2CC2 7a_100000210268_100000742324 [0,0,0,2,0,0|2,0,0]=4 3554 B14R2.3018 c1ccc(cc1)CCSCC2CC2 62a_100000756562_100011218657 [0,0,0,2,0,0|2,0,0]=4 3555 B14R2.3018 c1ccc(cc1)CCSCC2CC2 62a_100000765856_100000742324 [0,0,0,2,0,0|2,0,0]=4 3556 B14R2.3018 c1ccc(cc1)CNCCC2CC2 207a_100000764129_100015611070 [0,0,0,2,0,0|2,0,0]=4 3557 B14R2.3018 c1ccc(cc1)CNCCC2CC2 2230a_100015324214_100000694398 [0,0,0,2,0,0|2,0,0]=4 3558 B14R2.3018 c1ccc(cc1)CNCCC2CC2 270004a_100000764129_100015611070 [0,0,0,2,0,0|2,0,0]=4 3559 B14R2.3018 c1ccc(cc1)CNCCC2CC2 34a_100000764129_100015291786 [0,0,0,2,0,0|2,0,0]=4 3560 B14R2.3018 c1ccc(cc1)CNCCC2CC2 34a_100015324214_100000694398 [0,0,0,2,0,0|2,0,0]=4 3561 B14R2.3018 c1ccc(cc1)COCCC2CC2 34a_100000210790_100000694398 [0,0,0,2,0,0|2,0,0]=4 3562 B14R2.3018 c1ccc(cc1)COCCC2CC2 34a_100000754188_100015291786 [0,0,0,2,0,0|2,0,0]=4 3563 B14R2.3018 c1ccc(cc1)COCCC2CC2 7a_100000210790_100000764125 [0,0,0,2,0,0|2,0,0]=4 3564 B14R2.3018 c1ccc(cc1)COCCC2CC2 7a_100000754188_100000211182 [0,0,0,2,0,0|2,0,0]=4 3565 B14R2.3018 c1ccc(cc1)CSCCC2CC2 62a_100000211182_100000764125 [0,0,0,2,0,0|2,0,0]=4 3566 B14R2.3018 c1ccc(cc1)CSCCC2CC2 62a_100000764125_100015291786 [0,0,0,2,0,0|2,0,0]=4 3567 B14R2.3018 c1ccc(nc1)CCCOC2CC2 34a_100011215068_100000211595 [0,0,0,2,0,0|2,0,0]=4 3568 B14R2.3018 c1ccc(nc1)CCNCC2CC2 2230a_100000735609_100015183660 [0,0,0,2,0,0|2,0,0]=4 3569 B14R2.3018 c1ccc(nc1)CCNCC2CC2 269862a_100000211156_100000741477 [0,0,0,2,0,0|2,0,0]=4 3570 B14R2.3018 c1ccc(nc1)CCOCC2CC2 34a_100000210271_100000742324 [0,0,0,2,0,0|2,0,0]=4 3571 B14R2.3018 c1ccc(nc1)CCSCC2CC2 62a_100000756562_100015183660 [0,0,0,2,0,0|2,0,0]=4 3572 B14R2.3018 c1ccc(nc1)CCSCC2CC2 62a_100015183660_100000742324 [0,0,0,2,0,0|2,0,0]=4 3573 B14R2.3018 c1ccc(nc1)CNCCC2CC2 207a_100000764129_100000209966 [0,0,0,2,0,0|2,0,0]=4 3574 B14R2.3018 c1ccc(nc1)CNCCC2CC2 270004a_100000764129_100000209966 [0,0,0,2,0,0|2,0,0]=4 3575 B14R2.3018 c1ccc(nc1)CNCCC2CC2 34a_100000764129_100000721315 [0,0,0,2,0,0|2,0,0]=4 3576 B14R2.3018 c1ccc(nc1)COCCC2CC2 34a_100000754188_100000721315 [0,0,0,2,0,0|2,0,0]=4 3577 B14R2.3018 c1ccc(nc1)COCCC2CC2 7a_100000754188_100000721315 [0,0,0,2,0,0|2,0,0]=4 3578 B14R2.3018 c1ccc(nc1)CSCCC2CC2 62a_100000721315_100000764125 [0,0,0,2,0,0|2,0,0]=4 3579 B14R2.3018 c1ccc(nc1)CSCCC2CC2 62a_100000764125_100000721315 [0,0,0,2,0,0|2,0,0]=4 3580 B14R2.3019 c1ccc(cc1)CCCN2CCC2 269982a_100000754969_100000211621 [0,0,0,2,0,0|2,0,0]=4 3581 B14R2.3019 c1ccc(cc1)CCNC2CCC2 2230a_100000749019_100000765856 [0,0,0,2,0,0|2,0,0]=4 3582 B14R2.3019 c1ccc(cc1)CCNC2CCC2 270004a_100000106460_100000241760 [0,0,0,2,0,0|2,0,0]=4 3583 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000106460_100000749161 [0,0,0,2,0,0|2,0,0]=4 3584 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000749019_100000765856 [0,0,0,2,0,0|2,0,0]=4 3585 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000210268_100000749161 [0,0,0,2,0,0|2,0,0]=4 3586 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000748187_100000765856 [0,0,0,2,0,0|2,0,0]=4 3587 B14R2.3019 c1ccc(cc1)CCSC2CCC2 62a_100000765856_100000749161 [0,0,0,2,0,0|2,0,0]=4 3588 B14R2.3019 c1ccc(cc1)CNCC2CCC2 207a_100000738700_100015611070 [0,0,0,2,0,0|2,0,0]=4 3589 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100000738700_100015291786 [0,0,0,2,0,0|2,0,0]=4 3590 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100015324214_100000763275 [0,0,0,2,0,0|2,0,0]=4 3591 B14R2.3019 c1ccc(cc1)CNCC2CCC2 269862a_100015324214_100000753134 [0,0,0,2,0,0|2,0,0]=4 3592 B14R2.3019 c1ccc(cc1)CNCC2CCC2 270004a_100000738700_100015611070 [0,0,0,2,0,0|2,0,0]=4 3593 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100000738700_100015291786 [0,0,0,2,0,0|2,0,0]=4 3594 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100015324214_100000763275 [0,0,0,2,0,0|2,0,0]=4 3595 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000210790_100000763275 [0,0,0,2,0,0|2,0,0]=4 3596 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000760304_100015291786 [0,0,0,2,0,0|2,0,0]=4 3597 B14R2.3019 c1ccc(cc1)COCC2CCC2 7a_100000210790_100000763275 [0,0,0,2,0,0|2,0,0]=4 3598 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000211182_100000763275 [0,0,0,2,0,0|2,0,0]=4 3599 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000763275_100015291786 [0,0,0,2,0,0|2,0,0]=4 3600 B14R2.3019 c1ccc(nc1)CCNC2CCC2 2230a_100000749019_100015183660 [0,0,0,2,0,0|2,0,0]=4 3601 B14R2.3019 c1ccc(nc1)CCNC2CCC2 270004a_100000211156_100000241760 [0,0,0,2,0,0|2,0,0]=4 3602 B14R2.3019 c1ccc(nc1)CCOC2CCC2 34a_100000210271_100000749161 [0,0,0,2,0,0|2,0,0]=4 3603 B14R2.3019 c1ccc(nc1)CCSC2CCC2 62a_100015183660_100000749161 [0,0,0,2,0,0|2,0,0]=4 3604 B14R2.3019 c1ccc(nc1)CNCC2CCC2 207a_100000738700_100000209966 [0,0,0,2,0,0|2,0,0]=4 3605 B14R2.3019 c1ccc(nc1)CNCC2CCC2 2230a_100000738700_100000721315 [0,0,0,2,0,0|2,0,0]=4 3606 B14R2.3019 c1ccc(nc1)CNCC2CCC2 270004a_100000738700_100000209966 [0,0,0,2,0,0|2,0,0]=4 3607 B14R2.3019 c1ccc(nc1)CNCC2CCC2 34a_100000738700_100000721315 [0,0,0,2,0,0|2,0,0]=4 3608 B14R2.3019 c1ccc(nc1)COCC2CCC2 34a_100000760304_100000721315 [0,0,0,2,0,0|2,0,0]=4 3609 B14R2.3019 c1ccc(nc1)CSCC2CCC2 62a_100000721315_100000763275 [0,0,0,2,0,0|2,0,0]=4 3610 B14R2.3019 c1ccc(nc1)CSCC2CCC2 62a_100000763275_100000721315 [0,0,0,2,0,0|2,0,0]=4 3611 B14R2.7150 CCNC1CCCc2c1cccc2 269862a_100015525214_100000210882 [0,0,0,2,0,0|2,0,0]=4 3612 B14R2.7150 CCNC1CCCc2c1cccn2 269862a_100015525214_100000058033 [0,0,0,2,0,0|2,0,0]=4 3613 B14R2.7150 CCN[C@H]1CCCc2c1cccc2 34a_100020654734_100000210202 [0,0,0,2,0,0|2,0,0]=4 3614 B14R2.7150 CCOC1CCCc2c1cccc2 34a_100000183665_100000210202 [0,0,0,2,0,0|2,0,0]=4 3615 B14R2.7150 CCOC1CCCc2c1cccc2 7a_100000183665_100000210202 [0,0,0,2,0,0|2,0,0]=4 3616 B14R2.16538 CCCCNC1Cc2c1cccc2 7a_106832991798_100009813401 [0,0,0,2,0,0|2,0,0]=4 3617 B14R2.16538 CCCCOC1Cc2c1cccc2 7a_100000210227_100009813401 [0,0,0,2,0,0|2,0,0]=4 3618 B14R2.16538 CCCCSC1Cc2c1cccc2 62a_100000210211_100009813401 [0,0,0,2,0,0|2,0,0]=4 3619 B14R2.16538 CCCCSC1Cc2c1cccc2 62a_100009813401_100000210210 [0,0,0,2,0,0|2,0,0]=4 3620 B14R2.16538 CCCOCC1Cc2c1cccc2 34a_100012476685_100000210303 [0,0,0,2,0,0|2,0,0]=4 3621 B14R2.16538 CCCOCC1Cc2c1cccc2 7a_100012476685_100000210303 [0,0,0,2,0,0|2,0,0]=4 3622 B14R2.322 C(=Cc1ccco1)CC2CCCC2 271570a_200000069456_100009814098 [0,0,0,2,0,0|0,0,2]=4 3623 B14R2.322 C(=Cc1cccs1)CC2CCCC2 271570a_200000069456_100011215356 [0,0,0,2,0,0|0,1,1]=4 3624 B14R2.322 c1coc(c1)SCCC2CCCC2 62a_100000760354_100009814098 [0,0,0,2,0,0|1,0,1]=4 3625 B14R2.322 c1coc(c1)SCCC2CCCC2 62a_100009814098_100000760354 [0,0,0,2,0,0|1,0,1]=4 3626 B14R2.322 c1csc(c1)SCCC2CCCC2 62a_100000760354_100011215356 [0,0,0,2,0,0|1,1,0]=4 3627 B14R2.322 c1csc(c1)SCCC2CCCC2 62a_100011215356_100000760354 [0,0,0,2,0,0|1,1,0]=4 3628 B14R2.2840 c1coc(c1)SC2CCCCCC2 62a_100009814098_100011217769 [0,0,0,2,0,0|1,0,1]=4 3629 B14R2.2840 c1coc(c1)SC2CCCCCC2 62a_100011217769_100009814098 [0,0,0,2,0,0|1,0,1]=4 3630 B14R2.2840 c1csc(c1)SC2CCCCCC2 62a_100011215356_100011217769 [0,0,0,2,0,0|1,1,0]=4 3631 B14R2.2840 c1csc(c1)SC2CCCCCC2 62a_100011217769_100011215356 [0,0,0,2,0,0|1,1,0]=4