0 B12R0.248 C#CCCCNC/C=C/C(=O)OC 34a_100000718082_100000742655 [0,0,0,0,0,0|1,0,3]=4 1 B12R0.248 C#CCCCOC/C=C/C(=O)OC 34a_100000215630_100000742655 [0,0,0,0,0,0|1,0,3]=4 2 B12R0.248 C#CCCCOC/C=C/C(=O)OC 7a_100000215630_100000742655 [0,0,0,0,0,0|1,0,3]=4 3 B12R0.248 C#CCCCSC/C=C/C(=O)OC 62a_100000742655_100011215417 [0,0,0,0,0,0|1,0,3]=4 4 B12R0.248 C#CCCCSC/C=C/C(=O)OC 62a_100011215417_100000742655 [0,0,0,0,0,0|1,0,3]=4 5 B12R0.248 C/C=C/CCOC/C=C/C(=O)OC 34a_100016278192_100000742655 [0,0,0,0,0,0|1,0,3]=4 6 B12R0.248 C=CCCCNC/C=C/C(=O)OC 2230a_100000700776_100000742655 [0,0,0,0,0,0|1,0,3]=4 7 B12R0.248 C=CCCCNC/C=C/C(=O)OC 34a_100000700776_100000742655 [0,0,0,0,0,0|1,0,3]=4 8 B12R0.248 C=CCCCOC/C=C/C(=O)OC 34a_100000758997_100000742655 [0,0,0,0,0,0|1,0,3]=4 9 B12R0.248 C=CCCCOC/C=C/C(=O)OC 7a_100000758997_100000742655 [0,0,0,0,0,0|1,0,3]=4 10 B12R0.248 C=CCCCSC/C=C/C(=O)OC 62a_100000742655_100000757094 [0,0,0,0,0,0|1,0,3]=4 11 B12R0.248 C=CCCCSC/C=C/C(=O)OC 62a_100011713584_100000742655 [0,0,0,0,0,0|1,0,3]=4 12 B12R0.248 CC#CCCOC/C=C/C(=O)OC 34a_100000750427_100000742655 [0,0,0,0,0,0|1,0,3]=4 13 B12R0.248 CC/C=C\COC/C=C/C(=O)OC 34a_100016268518_100000742655 [0,0,0,0,0,0|1,0,3]=4 14 B12R0.248 CC/C=C\CSC/C=C/C(=O)OC 62a_100000742655_100103147603 [0,0,0,0,0,0|1,0,3]=4 15 B12R0.248 CC/C=C\CSC/C=C/C(=O)OC 62a_100103147603_100000742655 [0,0,0,0,0,0|1,0,3]=4 16 B12R0.248 CCC#CCOC/C=C/C(=O)OC 34a_100000032950_100000742655 [0,0,0,0,0,0|1,0,3]=4 17 B12R0.248 CCC#CCSC/C=C/C(=O)OC 62a_100000742655_100009813939 [0,0,0,0,0,0|1,0,3]=4 18 B12R0.248 CCC#CCSC/C=C/C(=O)OC 62a_100009813939_100000742655 [0,0,0,0,0,0|1,0,3]=4 19 B12R0.248 CCCC/C=C/COCC(=O)OC 34a_200016272032_100000747449 [0,0,0,0,0,0|1,0,3]=4 20 B12R0.248 CCCC/C=C/COCC(=O)OC 7a_200016272032_100000747449 [0,0,0,0,0,0|1,0,3]=4 21 B12R0.248 CCCCC/C=C/CCC(=O)CC 1458a_200015255902_100000210202 [0,0,0,0,0,0|1,0,2]=3 22 B12R0.248 CCCCC/C=C/CCC(=O)CF 1458a_200015255902_100015361967 [0,0,0,0,0,0|2,0,2]=4 23 B12R0.248 CCCCC/C=C/CCC(=O)NC 11a_106832991635_200015255902 [0,0,0,0,0,0|1,0,2]=3 24 B12R0.248 CCCCC/C=C/CCC(=O)NC 1626a_100102657272_200015255902 [0,0,0,0,0,0|1,0,2]=3 25 B12R0.248 CCCCC/C=C/CCC(=O)NC 240690a_100102657272_200015255902 [0,0,0,0,0,0|1,0,2]=3 26 B12R0.248 CCCCC/C=C/CCC(=O)NC 527a_100102657272_200015255902 [0,0,0,0,0,0|1,0,2]=3 27 B12R0.248 CCCCC=CC=NNC(=O)CC 4a_100000183195_100016268198 [0,0,0,0,0,0|3,0,1]=4 28 B12R0.248 CCCCCC/C=C/CC(=O)CC 1458a_100020681715_100000210202 [0,0,0,0,0,0|1,0,2]=3 29 B12R0.248 CCCCCC/C=C/CC(=O)CF 1458a_100020681715_100015361967 [0,0,0,0,0,0|2,0,2]=4 30 B12R0.248 CCCCCC/C=C/CC(=O)NC 11a_106832991635_100020681715 [0,0,0,0,0,0|1,0,2]=3 31 B12R0.248 CCCCCC/C=C/CC(=O)NC 1626a_100102657272_100020681715 [0,0,0,0,0,0|1,0,2]=3 32 B12R0.248 CCCCCC/C=C/CC(=O)NC 240690a_100102657272_100020681715 [0,0,0,0,0,0|1,0,2]=3 33 B12R0.248 CCCCCCC=NNC(=O)CC 4a_100000183195_100000234349 [0,0,0,0,0,0|3,0,1]=4 34 B12R0.248 CCCCCCCC=CC(=O)CC 1458a_200015332781_100000210202 [0,0,0,0,0,0|1,0,2]=3 35 B12R0.248 CCCCCCCC=CC(=O)CF 1458a_200015332781_100015361967 [0,0,0,0,0,0|2,0,2]=4 36 B12R0.248 CCCCCCCC=CC(=O)NC 11a_106832991635_200015332781 [0,0,0,0,0,0|1,0,2]=3 37 B12R0.248 CCCCCCCC=CC(=O)NC 1626a_100102657272_200015332781 [0,0,0,0,0,0|1,0,2]=3 38 B12R0.248 CCCCCCCC=CC(=O)NC 240690a_100102657272_200015332781 [0,0,0,0,0,0|1,0,2]=3 39 B12R0.248 CCCCCCCNCC(=O)OC 2230a_100000229938_100000747449 [0,0,0,0,0,0|1,0,3]=4 40 B12R0.248 CCCCCCCOCC(=O)OC 34a_100000210272_100000747449 [0,0,0,0,0,0|1,0,3]=4 41 B12R0.248 CCCCCCCOCC(=O)OC 7a_100000210272_100000747449 [0,0,0,0,0,0|1,0,3]=4 42 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000210614_100000747449 [0,0,0,0,0,0|1,0,3]=4 43 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000747449_100000210316 [0,0,0,0,0,0|1,0,3]=4 44 B12R0.248 CCCCCCNCCC(=O)OC 2230a_100000210581_100000204255 [0,0,0,0,0,0|1,0,3]=4 45 B12R0.248 CCCCCCOCCC(=O)OC 34a_100000210259_100000742370 [0,0,0,0,0,0|1,0,3]=4 46 B12R0.248 CCCCCCOCCC(=O)OC 7a_100000210259_100000204255 [0,0,0,0,0,0|1,0,3]=4 47 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000204255_100000210757 [0,0,0,0,0,0|1,0,3]=4 48 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000210314_100000204255 [0,0,0,0,0,0|1,0,3]=4 49 B12R0.248 CCCCCCSCOC(=O)OC 62a_100000210314_100000139417 [0,0,0,0,0,0|2,0,2]=4 50 B12R0.248 CCCCCNC/C=C/C(=O)OC 2230a_100000209983_100000742655 [0,0,0,0,0,0|1,0,1]=2 51 B12R0.248 CCCCCNCCCC(=O)OC 2230a_100000209983_100011218270 [0,0,0,0,0,0|1,0,3]=4 52 B12R0.248 CCCCCNN=CCC(=O)OC 4a_100000694160_200011552997 [0,0,0,0,0,0|2,0,1]=3 53 B12R0.248 CCCCCOC/C=C/C(=O)OC 34a_100000210253_100000742655 [0,0,0,0,0,0|1,0,1]=2 54 B12R0.248 CCCCCOC/C=C/C(=O)OC 7a_100000210253_100000742655 [0,0,0,0,0,0|1,0,1]=2 55 B12R0.248 CCCCCOCCCC(=O)OC 34a_100000210253_100000742333 [0,0,0,0,0,0|1,0,3]=4 56 B12R0.248 CCCCCOCCCC(=O)OC 7a_100000210253_100011218270 [0,0,0,0,0,0|1,0,3]=4 57 B12R0.248 CCCCCOCCNC(=O)OC 34a_100000757965_100000718602 [0,0,0,0,0,0|2,0,2]=4 58 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [0,0,0,0,0,0|2,0,2]=4 59 B12R0.248 CCCCCSC/C=C/C(=O)OC 62a_100000210326_100000742655 [0,0,0,0,0,0|1,0,1]=2 60 B12R0.248 CCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210326 [0,0,0,0,0,0|1,0,1]=2 61 B12R0.248 CCCCCSCCCC(=O)OC 62a_100000210326_100011218270 [0,0,0,0,0,0|1,0,3]=4 62 B12R0.248 CCCCCSCCCC(=O)OC 62a_100011218270_100000210326 [0,0,0,0,0,0|1,0,3]=4 63 B12R0.248 CCCCNN=CC=CC(=O)OC 4a_100025702795_100016254430 [0,0,0,0,0,0|2,0,0]=2 64 B12R0.248 CCCCNN=CCCC(=O)OC 4a_100025702795_100012047195 [0,0,0,0,0,0|2,0,2]=4 65 B12R0.248 CCOCCNC/C=C/C(=O)OC 2230a_102516460346_100000742655 [0,0,0,0,0,0|2,0,1]=3 66 B12R0.248 CCOCCNC/C=C/C(=O)OC 34a_102516460346_100000742655 [0,0,0,0,0,0|2,0,1]=3 67 B12R0.248 CCOCCNN=CCC(=O)OC 4a_100000732670_200011552997 [0,0,0,0,0,0|3,0,1]=4 68 B12R0.248 CCOCCOC/C=C/C(=O)OC 34a_100000210136_100000742655 [0,0,0,0,0,0|2,0,1]=3 69 B12R0.248 CCOCCOC/C=C/C(=O)OC 7a_100000210136_100000742655 [0,0,0,0,0,0|2,0,1]=3 70 B12R0.248 CCOCCSC/C=C/C(=O)OC 62a_100000210147_100000742655 [0,0,0,0,0,0|2,0,1]=3 71 B12R0.248 CCOCCSC/C=C/C(=O)OC 62a_100000742655_100011215890 [0,0,0,0,0,0|2,0,1]=3 72 B12R0.248 CCSCCNC/C=C/C(=O)OC 2230a_100000106463_100000742655 [0,0,0,0,0,0|2,0,1]=3 73 B12R0.248 CCSCCOC/C=C/C(=O)OC 34a_100000212035_100000742655 [0,0,0,0,0,0|2,0,1]=3 74 B12R0.248 CCSCCOC/C=C/C(=O)OC 7a_100000212035_100000742655 [0,0,0,0,0,0|2,0,1]=3 75 B12R0.248 CCSCCSC/C=C/C(=O)OC 62a_100000742655_100000757381 [0,0,0,0,0,0|2,0,1]=3 76 B12R0.248 CCSCCSC/C=C/C(=O)OC 62a_100000757381_100000742655 [0,0,0,0,0,0|2,0,1]=3 77 B12R0.248 CNCCCOC/C=C/C(=O)OC 34a_100000213112_100000742655 [0,0,0,0,0,0|2,0,1]=3 78 B12R0.248 COC(=O)/C=C/CNCCCCO 2230a_100000750430_100000742655 [0,0,0,0,0,0|2,0,1]=3 79 B12R0.248 COC(=O)/C=C/CNCCCCO 34a_100000750430_100000742655 [0,0,0,0,0,0|2,0,1]=3 80 B12R0.248 COC(=O)/C=C/CNCCCSC 2230a_100000749238_100000742655 [0,0,0,0,0,0|2,0,1]=3 81 B12R0.248 COC(=O)/C=C/COCCCCBr 34a_100011216708_100000742655 [0,0,0,0,0,0|2,0,1]=3 82 B12R0.248 COC(=O)/C=C/COCCCCCl 34a_100000210776_100000742655 [0,0,0,0,0,0|2,0,1]=3 83 B12R0.248 COC(=O)/C=C/COCCCCCl 7a_100000210776_100000742655 [0,0,0,0,0,0|2,0,1]=3 84 B12R0.248 COC(=O)/C=C/COCCCCF 34a_100011995726_100000742655 [0,0,0,0,0,0|2,0,1]=3 85 B12R0.248 COC(=O)/C=C/COCCCCF 7a_100011995726_100000742655 [0,0,0,0,0,0|2,0,1]=3 86 B12R0.248 COC(=O)/C=C/COCCCCI 34a_200012148704_100000742655 [0,0,0,0,0,0|2,0,1]=3 87 B12R0.248 COC(=O)/C=C/COCCCCN 34a_100000750430_100000742655 [0,0,0,0,0,0|2,0,1]=3 88 B12R0.248 COC(=O)/C=C/COCCCSC 34a_100000690336_100000742655 [0,0,0,0,0,0|2,0,1]=3 89 B12R0.248 COC(=O)/C=C/COCCCSC 7a_100000690336_100000742655 [0,0,0,0,0,0|2,0,1]=3 90 B12R0.248 COC(=O)/C=C/CSCCCC#N 62a_100000687738_100000742655 [0,0,0,0,0,0|2,0,2]=4 91 B12R0.248 COC(=O)/C=C/CSCCCC#N 62a_100000742655_100000687738 [0,0,0,0,0,0|2,0,2]=4 92 B12R0.248 COC(=O)/C=C/CSCCCC=O 62a_100000742655_200011292268 [0,0,0,0,0,0|2,0,2]=4 93 B12R0.248 COC(=O)/C=C/CSCCCC=O 62a_200011292268_100000742655 [0,0,0,0,0,0|2,0,2]=4 94 B12R0.248 COC(=O)/C=C/CSCCCCF 62a_100000729493_100000742655 [0,0,0,0,0,0|2,0,1]=3 95 B12R0.248 COC(=O)/C=C/CSCCCCF 62a_100000742655_100000729493 [0,0,0,0,0,0|2,0,1]=3 96 B12R0.248 COC(=O)/C=C/CSCCCCO 62a_100000210776_100000742655 [0,0,0,0,0,0|2,0,1]=3 97 B12R0.248 COC(=O)/C=C/CSCCCCO 62a_100000742655_100000210776 [0,0,0,0,0,0|2,0,1]=3 98 B12R0.248 COC(=O)C=CC=NNCCC#N 4a_100000229987_100016254430 [0,0,0,0,0,0|3,0,1]=4 99 B12R0.248 COCCCNC/C=C/C(=O)OC 34a_100150723488_100000742655 [0,0,0,0,0,0|2,0,1]=3 100 B12R0.248 COCCCOC/C=C/C(=O)OC 34a_100000740835_100000742655 [0,0,0,0,0,0|2,0,1]=3 101 B12R0.248 COCCCSC/C=C/C(=O)OC 62a_100000709357_100000742655 [0,0,0,0,0,0|2,0,1]=3 102 B12R0.248 COCCCSC/C=C/C(=O)OC 62a_100000742655_100000709357 [0,0,0,0,0,0|2,0,1]=3 103 B11R0.3 C/C=C/C=C/COCCCCC 34a_100016283227_100000718602 [1,0,0,0,0,0|2,0,1]=4 104 B11R0.3 CC/C=C/C/C=C/CCOCC 34a_200016273837_100000210202 [1,0,0,0,0,0|2,0,1]=4 105 B11R0.3 CC/C=C/C/C=C/CCOCC 7a_200016273837_100000210202 [1,0,0,0,0,0|2,0,1]=4 106 B11R0.3 CC=CC=CC=NNCCCC 4a_100025702795_100000691131 [1,0,0,0,0,0|3,0,0]=4 107 B11R0.3 CCC/C=C/C=C/COCCC 34a_100016294078_100000210303 [1,0,0,0,0,0|2,0,1]=4 108 B11R0.3 CCC=CC=CC=NNCCC 4a_100000740057_100103038579 [1,0,0,0,0,0|3,0,0]=4 109 B11R0.3 CCC=CC=NNCCCCC 4a_100000694160_100011216943 [1,0,0,0,0,0|3,0,0]=4 110 B11R0.3 CCCCC/C=C/C=C/COC 34a_200014065772_200000210301 [1,0,0,0,0,0|0,0,1]=2 111 B11R0.3 CCCCC/C=C/C=C/COC 7a_200014065772_200000210301 [1,0,0,0,0,0|0,0,1]=2 112 B11R0.3 CCCCC/C=C/C=C/CO[13CH3] 34a_200014065772_200025704644 [1,0,0,0,0,0|0,0,1]=2 113 B11R0.3 CCCCC/C=C/C=C/CO[13CH3] 7a_200014065772_200025704644 [1,0,0,0,0,0|0,0,1]=2 114 B11R0.3 CCCCC/C=C\CCCOC 34a_100020655193_200000210301 [1,0,0,0,0,0|0,0,3]=4 115 B11R0.3 CCCCC/C=C\CCCOC 7a_100020655193_200000210301 [1,0,0,0,0,0|0,0,3]=4 116 B11R0.3 CCCCC/C=C\CCCO[13CH3] 34a_100020655193_200025704644 [1,0,0,0,0,0|0,0,3]=4 117 B11R0.3 CCCCC/C=C\CCCO[13CH3] 7a_100020655193_200025704644 [1,0,0,0,0,0|0,0,3]=4 118 B11R0.3 CCCCCC=CC=NNCC 4a_100000756455_100016268540 [1,0,0,0,0,0|3,0,0]=4 119 B11R0.40 CCCCC/C=C/CC(=O)CC 1458a_100020675968_100000210202 [1,0,0,0,0,0|1,0,1]=3 120 B11R0.40 CCCCC/C=C/CC(=O)CF 1458a_100020675968_100015361967 [1,0,0,0,0,0|2,0,1]=4 121 B11R0.40 CCCCC/C=C/CC(=O)NC 11a_106832991635_100020675968 [1,0,0,0,0,0|1,0,1]=3 122 B11R0.40 CCCCC/C=C/CC(=O)NC 1626a_100102657272_100020675968 [1,0,0,0,0,0|1,0,1]=3 123 B11R0.40 CCCCC/C=C/CC(=O)NC 240690a_100102657272_100020675968 [1,0,0,0,0,0|1,0,1]=3 124 B11R0.40 CCCCCC=NNC(=O)CC 4a_100000183195_100000737632 [1,0,0,0,0,0|3,0,0]=4 125 B11R0.40 CCCCCCC=CC(=O)CC 1458a_200015324643_100000210202 [1,0,0,0,0,0|1,0,1]=3 126 B11R0.40 CCCCCCC=CC(=O)CF 1458a_200015324643_100015361967 [1,0,0,0,0,0|2,0,1]=4 127 B11R0.40 CCCCCCC=CC(=O)NC 11a_106832991635_200015324643 [1,0,0,0,0,0|1,0,1]=3 128 B11R0.40 CCCCCCC=CC(=O)NC 1626a_100102657272_200015324643 [1,0,0,0,0,0|1,0,1]=3 129 B11R0.40 CCCCCCC=CC(=O)NC 240690a_100102657272_200015324643 [1,0,0,0,0,0|1,0,1]=3 130 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [1,0,0,0,0,0|1,0,2]=4 131 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [1,0,0,0,0,0|1,0,2]=4 132 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [1,0,0,0,0,0|1,0,2]=4 133 B11R0.40 CCCCCCSCC(=O)OC 62a_100000210314_100000747449 [1,0,0,0,0,0|1,0,2]=4 134 B11R0.40 CCCCCCSCC(=O)OC 62a_100000747449_100000210757 [1,0,0,0,0,0|1,0,2]=4 135 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [1,0,0,0,0,0|1,0,2]=4 136 B11R0.40 CCCCCNN=CC(=O)OC 4a_100000694160_200011823558 [1,0,0,0,0,0|2,0,0]=3 137 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [1,0,0,0,0,0|1,0,2]=4 138 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [1,0,0,0,0,0|1,0,2]=4 139 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [1,0,0,0,0,0|1,0,2]=4 140 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [1,0,0,0,0,0|1,0,2]=4 141 B11R0.40 CCCCCSCOC(=O)OC 62a_100000210326_100000139417 [1,0,0,0,0,0|2,0,1]=4 142 B11R0.40 CCCCNC/C=C/C(=O)OC 2230a_100000102301_100000742655 [1,0,0,0,0,0|1,0,1]=3 143 B11R0.40 CCCCNC/C=C/C(=O)OC 7a_106832991798_100000742655 [1,0,0,0,0,0|1,0,1]=3 144 B11R0.40 CCCCNN=CCC(=O)OC 4a_100025702795_200011552997 [1,0,0,0,0,0|2,0,1]=4 145 B11R0.40 CCCCOC/C=C/C(=O)OC 34a_100000210227_100000742655 [1,0,0,0,0,0|1,0,1]=3 146 B11R0.40 CCCCOC/C=C/C(=O)OC 7a_100000210227_100000742655 [1,0,0,0,0,0|1,0,1]=3 147 B11R0.40 CCCCSC/C=C/C(=O)OC 62a_100000210211_100000742655 [1,0,0,0,0,0|1,0,1]=3 148 B11R0.40 CCCCSC/C=C/C(=O)OC 62a_100000742655_100000210210 [1,0,0,0,0,0|1,0,1]=3 149 B11R0.40 CCCNN=CC=CC(=O)OC 4a_100000740057_100016254430 [1,0,0,0,0,0|2,0,0]=3 150 B11R0.40 CCOCCNN=CC(=O)OC 4a_100000732670_200011823558 [1,0,0,0,0,0|3,0,0]=4 151 B11R0.40 CCOCSC/C=C/C(=O)OC 62a_100000739092_100000742655 [1,0,0,0,0,0|2,0,1]=4 152 B11R0.40 CCOCSC/C=C/C(=O)OC 62a_100000742655_100000739092 [1,0,0,0,0,0|2,0,1]=4 153 B11R0.40 COC(=O)/C=C/CNCCCF 2230a_100015189416_100000742655 [1,0,0,0,0,0|2,0,1]=4 154 B11R0.40 COC(=O)/C=C/CNCCCF 34a_100015189416_100000742655 [1,0,0,0,0,0|2,0,1]=4 155 B11R0.40 COC(=O)/C=C/CNCCSC 2230a_100020590264_100000742655 [1,0,0,0,0,0|2,0,1]=4 156 B11R0.40 COC(=O)/C=C/COCCCBr 34a_100011217188_100000742655 [1,0,0,0,0,0|2,0,1]=4 157 B11R0.40 COC(=O)/C=C/COCCCCl 34a_100000230001_100000742655 [1,0,0,0,0,0|2,0,1]=4 158 B11R0.40 COC(=O)/C=C/COCCCF 34a_100000759539_100000742655 [1,0,0,0,0,0|2,0,1]=4 159 B11R0.40 COC(=O)/C=C/COCCCN 34a_100000182051_100000742655 [1,0,0,0,0,0|2,0,1]=4 160 B11R0.40 COC(=O)/C=C/COCCSC 34a_100000230434_100000742655 [1,0,0,0,0,0|2,0,1]=4 161 B11R0.40 COC(=O)/C=C/COCCSC 7a_100000230434_100000742655 [1,0,0,0,0,0|2,0,1]=4 162 B11R0.40 COC(=O)/C=C/CSCCCF 62a_100000742655_100011934791 [1,0,0,0,0,0|2,0,1]=4 163 B11R0.40 COC(=O)/C=C/CSCCCF 62a_100011934791_100000742655 [1,0,0,0,0,0|2,0,1]=4 164 B11R0.40 COC(=O)/C=C/CSCCCO 62a_100000742655_100011215043 [1,0,0,0,0,0|2,0,1]=4 165 B11R0.40 COC(=O)/C=C/CSCCCO 62a_100011215043_100000742655 [1,0,0,0,0,0|2,0,1]=4 166 B11R0.40 COC(=O)/C=C/CSCCSC 62a_100000212216_100000742655 [1,0,0,0,0,0|2,0,1]=4 167 B11R0.40 COC(=O)/C=C/CSCCSC 62a_100000742655_100000751147 [1,0,0,0,0,0|2,0,1]=4 168 B11R0.40 COC(=O)C=CC=NNCCO 4a_100000210001_100016254430 [1,0,0,0,0,0|3,0,0]=4 169 B11R0.40 COCCNC/C=C/C(=O)OC 2230a_100000209980_100000742655 [1,0,0,0,0,0|2,0,1]=4 170 B11R0.40 COCCOC/C=C/C(=O)OC 34a_100000210237_100000742655 [1,0,0,0,0,0|2,0,1]=4 171 B11R0.40 COCCSC/C=C/C(=O)OC 62a_100000233755_100000742655 [1,0,0,0,0,0|2,0,1]=4 172 B11R0.40 COCCSC/C=C/C(=O)OC 62a_100000742655_100000233755 [1,0,0,0,0,0|2,0,1]=4 173 B11R0.148 CCCCC/C=C/CCC(=O)C 1458a_200015255902_200000210301 [1,0,0,0,0,0|0,0,2]=3 174 B11R0.148 CCCCC/C=C/CCC(=O)[13CH3] 1458a_200015255902_200025704644 [1,0,0,0,0,0|0,0,2]=3 175 B11R0.148 CCCCC=CC=NNC(=O)C 4a_100000189765_100016268198 [1,0,0,0,0,0|2,0,1]=4 176 B11R0.148 CCCCCC/C=C/CC(=O)C 1458a_100020681715_200000210301 [1,0,0,0,0,0|0,0,2]=3 177 B11R0.148 CCCCCC/C=C/CC(=O)[13CH3] 1458a_100020681715_200025704644 [1,0,0,0,0,0|0,0,2]=3 178 B11R0.148 CCCCCCC=NNC(=O)C 4a_100000189765_100000234349 [1,0,0,0,0,0|2,0,1]=4 179 B11R0.148 CCCCCCCC=CC(=O)C 1458a_200015332781_200000210301 [1,0,0,0,0,0|0,0,2]=3 180 B11R0.148 CCCCCCCC=CC(=O)[13CH3] 1458a_200015332781_200025704644 [1,0,0,0,0,0|0,0,2]=3 181 B11R0.148 CCCCCNN=CC=C(C)C 4a_100000694160_100011215525 [1,0,0,0,0,0|3,0,0]=4 182 B13R0.2 CCCCC/C=C/CCC(=O)CCC 1458a_200015255902_100000210303 [0,1,0,0,0,0|1,0,2]=4 183 B13R0.2 CCCCC/C=C/CCC(=O)CCF 1458a_200015255902_100011217306 [0,1,0,0,0,0|1,0,2]=4 184 B13R0.2 CCCCC/C=C/CCC(=O)CCO 1458a_200015255902_100000211926 [0,1,0,0,0,0|1,0,2]=4 185 B13R0.2 CCCCC/C=C/CCC(=O)NCC 11a_100015525214_200015255902 [0,1,0,0,0,0|1,0,2]=4 186 B13R0.2 CCCCC/C=C/CCC(=O)NCC 240690a_100015525214_200015255902 [0,1,0,0,0,0|1,0,2]=4 187 B13R0.2 CCCCC/C=C/CCC(=O)NCC 527a_100015525214_200015255902 [0,1,0,0,0,0|1,0,2]=4 188 B13R0.2 CCCCC/C=C/CCC(=O)NNC 22a_100016993582_200015255902 [0,1,0,0,0,0|1,0,2]=4 189 B13R0.2 CCCCC=CC=NNC(=O)COC 4a_100000216845_100016268198 [0,1,0,0,0,0|2,0,1]=4 190 B13R0.2 CCCCCC/C=C/CC(=O)CCC 1458a_100020681715_100000210303 [0,1,0,0,0,0|1,0,2]=4 191 B13R0.2 CCCCCC/C=C/CC(=O)CCF 1458a_100020681715_100011217306 [0,1,0,0,0,0|1,0,2]=4 192 B13R0.2 CCCCCC/C=C/CC(=O)CCO 1458a_100020681715_100000211926 [0,1,0,0,0,0|1,0,2]=4 193 B13R0.2 CCCCCC/C=C/CC(=O)NCC 11a_100015525214_100020681715 [0,1,0,0,0,0|1,0,2]=4 194 B13R0.2 CCCCCC/C=C/CC(=O)NCC 240690a_100015525214_100020681715 [0,1,0,0,0,0|1,0,2]=4 195 B13R0.2 CCCCCC/C=C/CC(=O)NNC 22a_100016993582_100020681715 [0,1,0,0,0,0|1,0,2]=4 196 B13R0.2 CCCCCCC=NNC(=O)COC 4a_100000216845_100000234349 [0,1,0,0,0,0|2,0,1]=4 197 B13R0.2 CCCCCCCC=CC(=O)CCC 1458a_200015332781_100000210303 [0,1,0,0,0,0|1,0,2]=4 198 B13R0.2 CCCCCCCC=CC(=O)CCF 1458a_200015332781_100011217306 [0,1,0,0,0,0|1,0,2]=4 199 B13R0.2 CCCCCCCC=CC(=O)CCO 1458a_200015332781_100000211926 [0,1,0,0,0,0|1,0,2]=4 200 B13R0.2 CCCCCCCC=CC(=O)NCC 11a_100015525214_200015332781 [0,1,0,0,0,0|1,0,2]=4 201 B13R0.2 CCCCCCCC=CC(=O)NCC 240690a_100015525214_200015332781 [0,1,0,0,0,0|1,0,2]=4 202 B13R0.2 CCCCCCCC=CC(=O)NNC 22a_100016993582_200015332781 [0,1,0,0,0,0|1,0,2]=4 203 B13R0.2 CCCCCNC/C=C/C(=O)OCC 2230a_100000209983_100016267167 [0,1,0,0,0,0|1,0,1]=3 204 B13R0.2 CCCCCNN=C[CH-]C(=O)OCC 4a_100000694160_100010622808 [0,1,0,0,0,0|2,0,1]=4 205 B13R0.2 CCCCCOC/C=C/C(=O)OCC 34a_100000210253_100016267167 [0,1,0,0,0,0|1,0,1]=3 206 B13R0.2 CCCCCOC/C=C/C(=O)OCC 7a_100000210253_100016267167 [0,1,0,0,0,0|1,0,1]=3 207 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100000210326_100016267167 [0,1,0,0,0,0|1,0,1]=3 208 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210326 [0,1,0,0,0,0|1,0,1]=3 209 B13R0.2 CCCCNN=CC=CC(=O)OCC 4a_100025702795_100016289910 [0,1,0,0,0,0|2,0,0]=3 210 B13R0.2 CCOC(=O)/C=C/CNCCCCO 2230a_100000750430_100016267167 [0,1,0,0,0,0|2,0,1]=4 211 B13R0.2 CCOC(=O)/C=C/CNCCCCO 34a_100000750430_100016267167 [0,1,0,0,0,0|2,0,1]=4 212 B13R0.2 CCOC(=O)/C=C/CNCCCOC 34a_100150723488_100016267167 [0,1,0,0,0,0|2,0,1]=4 213 B13R0.2 CCOC(=O)/C=C/CNCCCSC 2230a_100000749238_100016267167 [0,1,0,0,0,0|2,0,1]=4 214 B13R0.2 CCOC(=O)/C=C/CNCCSCC 2230a_100000106463_100016267167 [0,1,0,0,0,0|2,0,1]=4 215 B13R0.2 CCOC(=O)/C=C/COCCCCBr 34a_100011216708_100016267167 [0,1,0,0,0,0|2,0,1]=4 216 B13R0.2 CCOC(=O)/C=C/COCCCCCl 34a_100000210776_100016267167 [0,1,0,0,0,0|2,0,1]=4 217 B13R0.2 CCOC(=O)/C=C/COCCCCCl 7a_100000210776_100016267167 [0,1,0,0,0,0|2,0,1]=4 218 B13R0.2 CCOC(=O)/C=C/COCCCCF 34a_100011995726_100016267167 [0,1,0,0,0,0|2,0,1]=4 219 B13R0.2 CCOC(=O)/C=C/COCCCCF 7a_100011995726_100016267167 [0,1,0,0,0,0|2,0,1]=4 220 B13R0.2 CCOC(=O)/C=C/COCCCCI 34a_200012148704_100016267167 [0,1,0,0,0,0|2,0,1]=4 221 B13R0.2 CCOC(=O)/C=C/COCCCCN 34a_100000750430_100016267167 [0,1,0,0,0,0|2,0,1]=4 222 B13R0.2 CCOC(=O)/C=C/COCCCNC 34a_100000213112_100016267167 [0,1,0,0,0,0|2,0,1]=4 223 B13R0.2 CCOC(=O)/C=C/COCCCOC 34a_100000740835_100016267167 [0,1,0,0,0,0|2,0,1]=4 224 B13R0.2 CCOC(=O)/C=C/COCCCSC 34a_100000690336_100016267167 [0,1,0,0,0,0|2,0,1]=4 225 B13R0.2 CCOC(=O)/C=C/COCCCSC 7a_100000690336_100016267167 [0,1,0,0,0,0|2,0,1]=4 226 B13R0.2 CCOC(=O)/C=C/COCCSCC 34a_100000212035_100016267167 [0,1,0,0,0,0|2,0,1]=4 227 B13R0.2 CCOC(=O)/C=C/COCCSCC 7a_100000212035_100016267167 [0,1,0,0,0,0|2,0,1]=4 228 B13R0.2 CCOC(=O)/C=C/CSCCCCF 62a_100000729493_100016267167 [0,1,0,0,0,0|2,0,1]=4 229 B13R0.2 CCOC(=O)/C=C/CSCCCCF 62a_100016267167_100000729493 [0,1,0,0,0,0|2,0,1]=4 230 B13R0.2 CCOC(=O)/C=C/CSCCCCO 62a_100000210776_100016267167 [0,1,0,0,0,0|2,0,1]=4 231 B13R0.2 CCOC(=O)/C=C/CSCCCCO 62a_100016267167_100000210776 [0,1,0,0,0,0|2,0,1]=4 232 B13R0.2 CCOC(=O)/C=C/CSCCCOC 62a_100000709357_100016267167 [0,1,0,0,0,0|2,0,1]=4 233 B13R0.2 CCOC(=O)/C=C/CSCCCOC 62a_100016267167_100000709357 [0,1,0,0,0,0|2,0,1]=4 234 B13R0.2 CCOC(=O)/C=C/CSCCSCC 62a_100000757381_100016267167 [0,1,0,0,0,0|2,0,1]=4 235 B13R0.2 CCOC(=O)/C=C/CSCCSCC 62a_100016267167_100000757381 [0,1,0,0,0,0|2,0,1]=4 236 B13R0.2 CCOCCNC/C=C/C(=O)OCC 2230a_102516460346_100016267167 [0,1,0,0,0,0|2,0,1]=4 237 B13R0.2 CCOCCNC/C=C/C(=O)OCC 34a_102516460346_100016267167 [0,1,0,0,0,0|2,0,1]=4 238 B13R0.2 CCOCCOC/C=C/C(=O)OCC 34a_100000210136_100016267167 [0,1,0,0,0,0|2,0,1]=4 239 B13R0.2 CCOCCOC/C=C/C(=O)OCC 7a_100000210136_100016267167 [0,1,0,0,0,0|2,0,1]=4 240 B13R0.2 CCOCCSC/C=C/C(=O)OCC 62a_100000210147_100016267167 [0,1,0,0,0,0|2,0,1]=4 241 B13R0.2 CCOCCSC/C=C/C(=O)OCC 62a_100016267167_100011215890 [0,1,0,0,0,0|2,0,1]=4 242 B13R0.87 CCCC(=O)CSC/C=C/C(=O)OC 62a_100000742655_100000747444 [0,1,0,0,0,0|1,0,2]=4 243 B13R0.87 CCCC(=O)CSC/C=C/C(=O)OC 62a_100000747444_100000742655 [0,1,0,0,0,0|1,0,2]=4 244 B13R0.87 CCCC(=O)NN=CC=CC(=O)OC 4a_100000189770_100016254430 [0,1,0,0,0,0|2,0,1]=4 245 B13R0.87 CCCC(C)COC/C=C/C(=O)OC 34a_100000688023_100000742655 [0,1,0,0,0,0|1,0,1]=3 246 B13R0.87 CCCC(C)COC/C=C/C(=O)OC 7a_100000688023_100000742655 [0,1,0,0,0,0|1,0,1]=3 247 B13R0.87 CCCC(C)CSC/C=C/C(=O)OC 62a_100000742655_100011216630 [0,1,0,0,0,0|1,0,1]=3 248 B13R0.87 CCCC(C)CSC/C=C/C(=O)OC 62a_100011216630_100000742655 [0,1,0,0,0,0|1,0,1]=3 249 B13R0.87 CCC[C@H](N)COC/C=C/C(=O)OC 34a_100000732646_100000742655 [0,1,0,0,0,0|1,0,1]=3 250 B13R0.87 COC(=O)/C=C/COCC(C)CCN 34a_106354213184_100000742655 [0,1,0,0,0,0|2,0,1]=4 251 B13R0.87 COCC(N)COC/C=C/C(=O)OC 34a_100000724102_100000742655 [0,1,0,0,0,0|2,0,1]=4 252 B13R0.87 COCC(O)CNC/C=C/C(=O)OC 2230a_100000756049_100000742655 [0,1,0,0,0,0|2,0,1]=4 253 B13R0.87 COCC(O)CNC/C=C/C(=O)OC 34a_100000756049_100000742655 [0,1,0,0,0,0|2,0,1]=4 254 B13R0.87 COCC(O)CSC/C=C/C(=O)OC 62a_100000742655_100011215053 [0,1,0,0,0,0|2,0,1]=4 255 B13R0.87 COCC(O)CSC/C=C/C(=O)OC 62a_100011215053_100000742655 [0,1,0,0,0,0|2,0,1]=4 256 B13R0.113 CCCCC(C)NC/C=C/C(=O)OC 2230a_100000126638_100000742655 [0,1,0,0,0,0|1,0,1]=3 257 B13R0.113 CCCCC(C)OC/C=C/C(=O)OC 34a_100000687866_100000742655 [0,1,0,0,0,0|1,0,1]=3 258 B13R0.113 CCCCC(C)OC/C=C/C(=O)OC 7a_100000687866_100000742655 [0,1,0,0,0,0|1,0,1]=3 259 B13R0.113 CCCCC(C)SC/C=C/C(=O)OC 62a_100000742655_200011215066 [0,1,0,0,0,0|1,0,1]=3 260 B13R0.113 CCCCC(C)SC/C=C/C(=O)OC 62a_200011215066_100000742655 [0,1,0,0,0,0|1,0,1]=3 261 B13R0.113 CCOCC(C)OC/C=C/C(=O)OC 34a_100000718985_100000742655 [0,1,0,0,0,0|2,0,1]=4 262 B13R0.113 CCOCC(C)OC/C=C/C(=O)OC 7a_100000718985_100000742655 [0,1,0,0,0,0|2,0,1]=4 263 B13R0.113 COC(=O)/C=C/COC(C)CCCCl 34a_200000718107_100000742655 [0,1,0,0,0,0|2,0,1]=4 264 B13R0.113 COC(=O)/C=C/COC(C)CCCCl 7a_200000718107_100000742655 [0,1,0,0,0,0|2,0,1]=4 265 B13R0.147 C#CCCCCNC/C=C/C(=O)OC 2230a_100000706060_100000742655 [0,1,0,0,0,0|1,0,2]=4 266 B13R0.147 C#CCCCCNC/C=C/C(=O)OC 34a_100000706060_100000742655 [0,1,0,0,0,0|1,0,2]=4 267 B13R0.147 C#CCCCCOC/C=C/C(=O)OC 34a_100000766709_100000742655 [0,1,0,0,0,0|1,0,2]=4 268 B13R0.147 C#CCCCCOC/C=C/C(=O)OC 7a_100000766709_100000742655 [0,1,0,0,0,0|1,0,2]=4 269 B13R0.147 C#CCCCCSC/C=C/C(=O)OC 62a_100000742655_100010269958 [0,1,0,0,0,0|1,0,2]=4 270 B13R0.147 C#CCCCCSC/C=C/C(=O)OC 62a_100010269958_100000742655 [0,1,0,0,0,0|1,0,2]=4 271 B13R0.147 C=CCCCCNC/C=C/C(=O)OC 2230a_100000703577_100000742655 [0,1,0,0,0,0|1,0,2]=4 272 B13R0.147 C=CCCCCNC/C=C/C(=O)OC 34a_100000703577_100000742655 [0,1,0,0,0,0|1,0,2]=4 273 B13R0.147 C=CCCCCOC/C=C/C(=O)OC 34a_100000766645_100000742655 [0,1,0,0,0,0|1,0,2]=4 274 B13R0.147 C=CCCCCOC/C=C/C(=O)OC 7a_100000766645_100000742655 [0,1,0,0,0,0|1,0,2]=4 275 B13R0.147 C=CCCCCSC/C=C/C(=O)OC 62a_100000742655_100011215482 [0,1,0,0,0,0|1,0,2]=4 276 B13R0.147 C=CCCCCSC/C=C/C(=O)OC 62a_100011215482_100000742655 [0,1,0,0,0,0|1,0,2]=4 277 B13R0.147 CC/C=C\CCOC/C=C/C(=O)OC 34a_100016288707_100000742655 [0,1,0,0,0,0|1,0,2]=4 278 B13R0.147 CC/C=C\CCOC/C=C/C(=O)OC 7a_100016288707_100000742655 [0,1,0,0,0,0|1,0,2]=4 279 B13R0.147 CC/C=C\CCSC/C=C/C(=O)OC 62a_100000742655_100015370543 [0,1,0,0,0,0|1,0,2]=4 280 B13R0.147 CC/C=C\CCSC/C=C/C(=O)OC 62a_100015370543_100000742655 [0,1,0,0,0,0|1,0,2]=4 281 B13R0.147 CC=CCCCOC/C=C/C(=O)OC 34a_100020645299_100000742655 [0,1,0,0,0,0|1,0,2]=4 282 B13R0.147 CCC#CCCOC/C=C/C(=O)OC 34a_100000036655_100000742655 [0,1,0,0,0,0|1,0,2]=4 283 B13R0.147 CCC#CCCOC/C=C/C(=O)OC 7a_100000036655_100000742655 [0,1,0,0,0,0|1,0,2]=4 284 B13R0.147 CCC/C=C/COC/C=C/C(=O)OC 34a_100016278788_100000742655 [0,1,0,0,0,0|1,0,2]=4 285 B13R0.147 CCC/C=C/COC/C=C/C(=O)OC 7a_100016278788_100000742655 [0,1,0,0,0,0|1,0,2]=4 286 B13R0.147 CCCC#CCOC/C=C/C(=O)OC 34a_100000034806_100000742655 [0,1,0,0,0,0|1,0,2]=4 287 B13R0.147 CCCC#CCOC/C=C/C(=O)OC 7a_100000034806_100000742655 [0,1,0,0,0,0|1,0,2]=4 288 B13R0.147 CCCCC/C=C/COCC(=O)CC 7a_100016258190_100000747405 [0,1,0,0,0,0|1,0,2]=4 289 B13R0.147 CCCCC/C=C/COCC(=O)NC 34a_100016258190_100000183359 [0,1,0,0,0,0|1,0,2]=4 290 B13R0.147 CCCCC/C=C/COCC(=O)NC 7a_100016258190_100000183359 [0,1,0,0,0,0|1,0,2]=4 291 B13R0.147 CCCCC/C=C/COCC(=O)OC 34a_100016258190_100000747449 [0,1,0,0,0,0|0,0,2]=3 292 B13R0.147 CCCCC/C=C/COCC(=O)OC 7a_100016258190_100000747449 [0,1,0,0,0,0|0,0,2]=3 293 B13R0.147 CCCCCC=CC=NNC(=O)CC 4a_100000183195_100016268540 [0,1,0,0,0,0|2,0,0]=3 294 B13R0.147 CCCCCCCCC=CC(=O)CC 1458a_100015345288_100000210202 [0,1,0,0,0,0|1,0,2]=4 295 B13R0.147 CCCCCCCCC=CC(=O)NC 11a_106832991635_100015345288 [0,1,0,0,0,0|1,0,2]=4 296 B13R0.147 CCCCCCCCC=CC(=O)NC 1626a_100102657272_100015345288 [0,1,0,0,0,0|1,0,2]=4 297 B13R0.147 CCCCCCCCC=CC(=O)NC 240690a_100102657272_100015345288 [0,1,0,0,0,0|1,0,2]=4 298 B13R0.147 CCCCCCNC/C=C/C(=O)OC 2230a_100000210581_100000742655 [0,1,0,0,0,0|0,0,2]=3 299 B13R0.147 CCCCCCOC/C=C/C(=O)OC 34a_100000210259_100000742655 [0,1,0,0,0,0|0,0,2]=3 300 B13R0.147 CCCCCCOC/C=C/C(=O)OC 7a_100000210259_100000742655 [0,1,0,0,0,0|0,0,2]=3 301 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000210314_100000742655 [0,1,0,0,0,0|0,0,2]=3 302 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210757 [0,1,0,0,0,0|0,0,2]=3 303 B13R0.147 CCCCCNN=CC=CC(=O)OC 4a_100000694160_100016254430 [0,1,0,0,0,0|1,0,0]=2 304 B13R0.147 CCCCCNN=CCCC(=O)OC 4a_100000694160_100012047195 [0,1,0,0,0,0|1,0,2]=4 305 B13R0.147 CCCCOCSC/C=C/C(=O)OC 62a_100000742655_100011995733 [0,1,0,0,0,0|1,0,1]=3 306 B13R0.147 CCCCOCSC/C=C/C(=O)OC 62a_100011995733_100000742655 [0,1,0,0,0,0|1,0,1]=3 307 B13R0.147 CCCOCCNC/C=C/C(=O)OC 2230a_100161115042_100000742655 [0,1,0,0,0,0|1,0,1]=3 308 B13R0.147 CCCOCCNC/C=C/C(=O)OC 34a_100161115042_100000742655 [0,1,0,0,0,0|1,0,1]=3 309 B13R0.147 CCCOCCOC/C=C/C(=O)OC 34a_100000752267_100000742655 [0,1,0,0,0,0|1,0,1]=3 310 B13R0.147 CCCOCCOC/C=C/C(=O)OC 7a_100000752267_100000742655 [0,1,0,0,0,0|1,0,1]=3 311 B13R0.147 CCCOCCSC/C=C/C(=O)OC 62a_100000742655_100011215938 [0,1,0,0,0,0|1,0,1]=3 312 B13R0.147 CCCOCCSC/C=C/C(=O)OC 62a_100011215938_100000742655 [0,1,0,0,0,0|1,0,1]=3 313 B13R0.147 CCCSCCNC/C=C/C(=O)OC 2230a_100020603323_100000742655 [0,1,0,0,0,0|1,0,1]=3 314 B13R0.147 CCCSCCOC/C=C/C(=O)OC 34a_200000230433_100000742655 [0,1,0,0,0,0|1,0,1]=3 315 B13R0.147 CCCSCCOC/C=C/C(=O)OC 7a_200000230433_100000742655 [0,1,0,0,0,0|1,0,1]=3 316 B13R0.147 CCOCCCNC/C=C/C(=O)OC 2230a_100000210961_100000742655 [0,1,0,0,0,0|1,0,1]=3 317 B13R0.147 CCOCCCNC/C=C/C(=O)OC 34a_100000210961_100000742655 [0,1,0,0,0,0|1,0,1]=3 318 B13R0.147 CCOCCCOC/C=C/C(=O)OC 34a_100000757476_100000742655 [0,1,0,0,0,0|1,0,1]=3 319 B13R0.147 CCOCCCOC/C=C/C(=O)OC 7a_100000757476_100000742655 [0,1,0,0,0,0|1,0,1]=3 320 B13R0.147 CCOCCCSC/C=C/C(=O)OC 62a_100000742655_100012232248 [0,1,0,0,0,0|1,0,1]=3 321 B13R0.147 CCOCCCSC/C=C/C(=O)OC 62a_100012232248_100000742655 [0,1,0,0,0,0|1,0,1]=3 322 B13R0.147 CCOCCNN=CC=CC(=O)OC 4a_100000732670_100016254430 [0,1,0,0,0,0|2,0,0]=3 323 B13R0.147 CCSCCCOC/C=C/C(=O)OC 34a_100011216438_100000742655 [0,1,0,0,0,0|1,0,1]=3 324 B13R0.147 CCSCCCOC/C=C/C(=O)OC 7a_100011216438_100000742655 [0,1,0,0,0,0|1,0,1]=3 325 B13R0.147 CNC(=O)C=CCCCCCCCO 1626a_100102657272_100016988705 [0,1,0,0,0,0|1,0,2]=4 326 B13R0.147 CNC(=O)C=CCCCCCCCO 240690a_100102657272_100016988705 [0,1,0,0,0,0|1,0,2]=4 327 B13R0.147 COC(=O)/C=C/CNCCCCCO 2230a_100000762737_100000742655 [0,1,0,0,0,0|1,0,1]=3 328 B13R0.147 COC(=O)/C=C/CNCCCCCO 34a_100000762737_100000742655 [0,1,0,0,0,0|1,0,1]=3 329 B13R0.147 COC(=O)/C=C/CNCCOCCO 2230a_100000211614_100000742655 [0,1,0,0,0,0|2,0,1]=4 330 B13R0.147 COC(=O)/C=C/CNCCOCCO 34a_100000211614_100000742655 [0,1,0,0,0,0|2,0,1]=4 331 B13R0.147 COC(=O)/C=C/CNCCSCCO 2230a_100011219999_100000742655 [0,1,0,0,0,0|2,0,1]=4 332 B13R0.147 COC(=O)/C=C/COCCCCCBr 34a_100000746331_100000742655 [0,1,0,0,0,0|1,0,1]=3 333 B13R0.147 COC(=O)/C=C/COCCCCCBr 7a_100000746331_100000742655 [0,1,0,0,0,0|1,0,1]=3 334 B13R0.147 COC(=O)/C=C/COCCCCCCl 34a_100000746330_100000742655 [0,1,0,0,0,0|1,0,1]=3 335 B13R0.147 COC(=O)/C=C/COCCCCCCl 7a_100000746330_100000742655 [0,1,0,0,0,0|1,0,1]=3 336 B13R0.147 COC(=O)/C=C/COCCCCCI 34a_200012148887_100000742655 [0,1,0,0,0,0|1,0,1]=3 337 B13R0.147 COC(=O)/C=C/COCCCCCI 7a_200012148887_100000742655 [0,1,0,0,0,0|1,0,1]=3 338 B13R0.147 COC(=O)/C=C/COCCCCCN 34a_100000762737_100000742655 [0,1,0,0,0,0|1,0,1]=3 339 B13R0.147 COC(=O)/C=C/COCCCCSC 34a_100011217163_100000742655 [0,1,0,0,0,0|1,0,1]=3 340 B13R0.147 COC(=O)/C=C/COCCCCSC 7a_100011217163_100000742655 [0,1,0,0,0,0|1,0,1]=3 341 B13R0.147 COC(=O)/C=C/COCCOCCBr 34a_100000692535_100000742655 [0,1,0,0,0,0|2,0,1]=4 342 B13R0.147 COC(=O)/C=C/COCCOCCBr 7a_100000692535_100000742655 [0,1,0,0,0,0|2,0,1]=4 343 B13R0.147 COC(=O)/C=C/COCCOCCCl 34a_100011215305_100000742655 [0,1,0,0,0,0|2,0,1]=4 344 B13R0.147 COC(=O)/C=C/COCCOCCCl 7a_100011215305_100000742655 [0,1,0,0,0,0|2,0,1]=4 345 B13R0.147 COC(=O)/C=C/COCCOCCF 34a_200015357709_100000742655 [0,1,0,0,0,0|2,0,1]=4 346 B13R0.147 COC(=O)/C=C/COCCOCCF 7a_200015357709_100000742655 [0,1,0,0,0,0|2,0,1]=4 347 B13R0.147 COC(=O)/C=C/COCCOCCI 34a_100012149058_100000742655 [0,1,0,0,0,0|2,0,1]=4 348 B13R0.147 COC(=O)/C=C/COCCOCCI 7a_100012149058_100000742655 [0,1,0,0,0,0|2,0,1]=4 349 B13R0.147 COC(=O)/C=C/COCCOCCN 34a_100000211614_100000742655 [0,1,0,0,0,0|2,0,1]=4 350 B13R0.147 COC(=O)/C=C/CSCCCCC#N 62a_100000742655_100000211819 [0,1,0,0,0,0|1,0,2]=4 351 B13R0.147 COC(=O)/C=C/CSCCCCC#N 62a_100011219923_100000742655 [0,1,0,0,0,0|1,0,2]=4 352 B13R0.147 COC(=O)/C=C/CSCCCCC=O 62a_100000139335_100000742655 [0,1,0,0,0,0|1,0,2]=4 353 B13R0.147 COC(=O)/C=C/CSCCCCC=O 62a_100000742655_100000139335 [0,1,0,0,0,0|1,0,2]=4 354 B13R0.147 COC(=O)/C=C/CSCCCCCF 62a_100000729378_100000742655 [0,1,0,0,0,0|1,0,1]=3 355 B13R0.147 COC(=O)/C=C/CSCCCCCF 62a_100000742655_100000729378 [0,1,0,0,0,0|1,0,1]=3 356 B13R0.147 COC(=O)/C=C/CSCCCCCO 62a_100000742655_100000746330 [0,1,0,0,0,0|1,0,1]=3 357 B13R0.147 COC(=O)/C=C/CSCCCCCO 62a_100000746330_100000742655 [0,1,0,0,0,0|1,0,1]=3 358 B13R0.147 COC(=O)/C=C/CSCCOCCO 62a_100000742655_100011215305 [0,1,0,0,0,0|2,0,1]=4 359 B13R0.147 COC(=O)/C=C/CSCCOCCO 62a_100011215305_100000742655 [0,1,0,0,0,0|2,0,1]=4 360 B13R0.147 COCCCCOC/C=C/C(=O)OC 34a_100000740925_100000742655 [0,1,0,0,0,0|1,0,1]=3 361 B13R0.147 COCCCCSC/C=C/C(=O)OC 62a_100000730899_100000742655 [0,1,0,0,0,0|1,0,1]=3 362 B13R0.147 COCCCCSC/C=C/C(=O)OC 62a_100000742655_100000730899 [0,1,0,0,0,0|1,0,1]=3 363 B13R0.147 COCCOCSC/C=C/C(=O)OC 62a_100000231047_100000742655 [0,1,0,0,0,0|2,0,1]=4 364 B13R0.147 COCCOCSC/C=C/C(=O)OC 62a_100000742655_100000231047 [0,1,0,0,0,0|2,0,1]=4 365 B13R0.150 CCCCC/C=C/CCC(=O)C(C)C 1458a_200015255902_100000210206 [0,1,0,0,0,0|1,0,2]=4 366 B13R0.150 CCCCC/C=C/CCC(=O)N(C)C 11a_100102631434_200015255902 [0,1,0,0,0,0|1,0,2]=4 367 B13R0.150 CCCCC/C=C/CCC(=O)N(C)C 1626a_100102631434_200015255902 [0,1,0,0,0,0|1,0,2]=4 368 B13R0.150 CCCCC/C=C/CCC(=O)N(C)C 240690a_100102631434_200015255902 [0,1,0,0,0,0|1,0,2]=4 369 B13R0.150 CCCCC/C=C/CCC(=O)N(C)C 527a_100102631434_200015255902 [0,1,0,0,0,0|1,0,2]=4 370 B13R0.150 CCCCCC/C=C/CC(=O)C(C)C 1458a_100020681715_100000210206 [0,1,0,0,0,0|1,0,2]=4 371 B13R0.150 CCCCCC/C=C/CC(=O)N(C)C 11a_100102631434_100020681715 [0,1,0,0,0,0|1,0,2]=4 372 B13R0.150 CCCCCC/C=C/CC(=O)N(C)C 1626a_100102631434_100020681715 [0,1,0,0,0,0|1,0,2]=4 373 B13R0.150 CCCCCC/C=C/CC(=O)N(C)C 240690a_100102631434_100020681715 [0,1,0,0,0,0|1,0,2]=4 374 B13R0.150 CCCCCCCC=CC(=O)C(C)C 1458a_200015332781_100000210206 [0,1,0,0,0,0|1,0,2]=4 375 B13R0.150 CCCCCCCC=CC(=O)N(C)C 11a_100102631434_200015332781 [0,1,0,0,0,0|1,0,2]=4 376 B13R0.150 CCCCCCCC=CC(=O)N(C)C 1626a_100102631434_200015332781 [0,1,0,0,0,0|1,0,2]=4 377 B13R0.150 CCCCCCCC=CC(=O)N(C)C 240690a_100102631434_200015332781 [0,1,0,0,0,0|1,0,2]=4 378 B13R0.194 CCCCCC(=O)CCCC(=O)OC 1458a_100000212188_100011218270 [0,1,0,0,0,0|0,0,3]=4 379 B13R0.194 CCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210326 [0,1,0,0,0,0|0,0,3]=4 380 B13R0.194 CCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210326 [0,1,0,0,0,0|1,0,2]=4 381 B13R0.194 CCCCCC(=O)CSCC(=O)OC 62a_100000747449_200012276598 [0,1,0,0,0,0|1,0,2]=4 382 B13R0.194 CCCCCC(=O)CSCC(=O)OC 62a_200012276598_100000747449 [0,1,0,0,0,0|1,0,2]=4 383 B13R0.194 CCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000212188 [0,1,0,0,0,0|1,0,2]=4 384 B13R0.194 CCCCCC(=O)NN=CC(=O)OC 4a_100000189784_200011823558 [0,1,0,0,0,0|2,0,0]=3 385 B13R0.194 CCCCCN(C)C/C=C/C(=O)OC 2230a_100000223495_100000742655 [0,1,0,0,0,0|1,0,1]=3 386 B13R0.194 CCCCCN(C)C/C=C/C(=O)OC 269982a_100000223495_100000742655 [0,1,0,0,0,0|1,0,1]=3 387 B13R0.194 COC(=O)/C=C/CN(C)CCCCO 2230a_100000717598_100000742655 [0,1,0,0,0,0|2,0,1]=4 388 B13R0.194 COC(=O)/C=C/CN(C)CCCCO 269982a_100000717598_100000742655 [0,1,0,0,0,0|2,0,1]=4 389 B13R0.194 COCCCN(C)C/C=C/C(=O)OC 2230a_100000224831_100000742655 [0,1,0,0,0,0|2,0,1]=4 390 B13R0.194 COCCCN(C)C/C=C/C(=O)OC 269982a_100000224831_100000742655 [0,1,0,0,0,0|2,0,1]=4 391 B13R0.201 CCC(C)CCNC/C=C/C(=O)OC 2230a_100020591266_100000742655 [0,1,0,0,0,0|1,0,1]=3 392 B13R0.201 CCC(C)CCOC/C=C/C(=O)OC 7a_100011215188_100000742655 [0,1,0,0,0,0|1,0,1]=3 393 B13R0.201 CCC(O)CNN=CC=CC(=O)OC 4a_100015206393_100016254430 [0,1,0,0,0,0|2,0,0]=3 394 B13R0.201 COC(=O)/C=C/CNCCC(C)CO 2230a_106354213184_100000742655 [0,1,0,0,0,0|2,0,1]=4 395 B13R0.201 COC(=O)/C=C/CNCCC(C)CO 34a_106354213184_100000742655 [0,1,0,0,0,0|2,0,1]=4 396 B13R0.201 COC(=O)/C=C/COCCC(C)OC 7a_100000764861_100000742655 [0,1,0,0,0,0|2,0,1]=4 397 B13R0.202 COC(=O)/C=C/CNCCCC(C)C 2230a_200000737386_100000742655 [0,1,0,0,0,0|1,0,1]=3 398 B13R0.202 COC(=O)/C=C/CNCCCC(C)C 34a_200000737386_100000742655 [0,1,0,0,0,0|1,0,1]=3 399 B13R0.202 COC(=O)/C=C/CNCCCS(=O)C 2230a_200000753449_100000742655 [0,1,0,0,0,0|2,0,1]=4 400 B13R0.202 COC(=O)/C=C/CNCCOC(C)C 2230a_100000701111_100000742655 [0,1,0,0,0,0|2,0,1]=4 401 B13R0.202 COC(=O)/C=C/CNCCOC(C)C 34a_100000701111_100000742655 [0,1,0,0,0,0|2,0,1]=4 402 B13R0.202 COC(=O)/C=C/CNCCSC(C)C 2230a_100000731138_100000742655 [0,1,0,0,0,0|2,0,1]=4 403 B13R0.202 COC(=O)/C=C/CNCCSC(C)C 34a_100000731138_100000742655 [0,1,0,0,0,0|2,0,1]=4 404 B13R0.202 COC(=O)/C=C/COCCCC(=O)C 34a_100000759063_100000742655 [0,1,0,0,0,0|1,0,2]=4 405 B13R0.202 COC(=O)/C=C/COCCCC(=O)C 7a_100000759063_100000742655 [0,1,0,0,0,0|1,0,2]=4 406 B13R0.202 COC(=O)/C=C/COCCCC(C)C 34a_100000210774_100000742655 [0,1,0,0,0,0|1,0,1]=3 407 B13R0.202 COC(=O)/C=C/COCCCC(C)C 7a_100000210774_100000742655 [0,1,0,0,0,0|1,0,1]=3 408 B13R0.202 COC(=O)/C=C/COCCNC(C)C 34a_100000224655_100000742655 [0,1,0,0,0,0|2,0,1]=4 409 B13R0.202 COC(=O)/C=C/COCCOC(C)C 34a_100000211219_100000742655 [0,1,0,0,0,0|2,0,1]=4 410 B13R0.202 COC(=O)/C=C/COCCOC(C)C 7a_100000211219_100000742655 [0,1,0,0,0,0|2,0,1]=4 411 B13R0.202 COC(=O)/C=C/COCCSC(C)C 34a_200011212901_100000742655 [0,1,0,0,0,0|2,0,1]=4 412 B13R0.202 COC(=O)/C=C/COCCSC(C)C 7a_200011212901_100000742655 [0,1,0,0,0,0|2,0,1]=4 413 B13R0.202 COC(=O)/C=C/CSCCCC(=O)C 62a_100000742655_100011215641 [0,1,0,0,0,0|1,0,2]=4 414 B13R0.202 COC(=O)/C=C/CSCCCC(=O)C 62a_100011215641_100000742655 [0,1,0,0,0,0|1,0,2]=4 415 B13R0.202 COC(=O)/C=C/CSCCCC(C)C 62a_100000742655_100011214892 [0,1,0,0,0,0|1,0,1]=3 416 B13R0.202 COC(=O)/C=C/CSCCCC(C)C 62a_100011214892_100000742655 [0,1,0,0,0,0|1,0,1]=3 417 B13R0.202 COC(=O)/C=C/CSCCCC(C)O 62a_100000742655_200000718107 [0,1,0,0,0,0|1,0,1]=3 418 B13R0.202 COC(=O)/C=C/CSCCCC(C)O 62a_200000718107_100000742655 [0,1,0,0,0,0|1,0,1]=3 419 B13R0.202 COC(=O)/C=C/CSCCCN(C)C 62a_100000742655_100000757444 [0,1,0,0,0,0|2,0,1]=4 420 B13R0.202 COC(=O)/C=C/CSCCOC(C)C 62a_100000211751_100000742655 [0,1,0,0,0,0|2,0,1]=4 421 B13R0.202 COC(=O)/C=C/CSCCOC(C)C 62a_100000742655_100000211751 [0,1,0,0,0,0|2,0,1]=4 422 B13R0.202 COC(=O)/C=C/CSCCSC(C)C 62a_100000730970_100000742655 [0,1,0,0,0,0|2,0,1]=4 423 B13R0.202 COC(=O)/C=C/CSCCSC(C)C 62a_100000742655_100000730970 [0,1,0,0,0,0|2,0,1]=4 424 B13R0.274 CCC/C=C/C=CC(=O)CC(=O)OC 1458a_200016258893_100000747449 [0,1,0,0,0,0|0,0,3]=4 425 B13R0.274 CCCC/C=C/CC(=O)CC(=O)OC 1458a_200016282684_100000747449 [0,1,0,0,0,0|0,0,3]=4 426 B13R0.274 CCCCCC#CC(=O)CC(=O)OC 1458a_100011215388_100000747449 [0,1,0,0,0,0|0,0,3]=4 427 B13R0.274 CCCCCC=CC(=O)CC(=O)CC 1458a_100016263427_100000747405 [0,1,0,0,0,0|1,0,1]=3 428 B13R0.274 CCCCCC=CC(=O)CC(=O)NC 1458a_100016263427_100000183359 [0,1,0,0,0,0|1,0,1]=3 429 B13R0.274 CCCCCC=CC(=O)CC(=O)OC 1458a_100016263427_100000747449 [0,1,0,0,0,0|0,0,1]=2 430 B13R0.274 CCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210614 [0,1,0,0,0,0|0,0,3]=4 431 B13R0.274 CCCCCCCC(=O)CC(=O)OC 1458a_100000211969_100000747449 [0,1,0,0,0,0|0,0,3]=4 432 B13R0.274 CCCCCCNC(=O)CC(=O)OC 240690a_100000210581_100000211351 [0,1,0,0,0,0|1,0,2]=4 433 B13R0.274 CCCCCNN=C(C)CC(=O)OC 4a_100000694160_100000210079 [0,1,0,0,0,0|2,0,1]=4 434 B13R0.274 CCCCCNNC(=O)CC(=O)OC 22a_100000694160_100000211351 [0,1,0,0,0,0|2,0,1]=4 435 B13R0.274 CCCCCSCC(=O)CC(=O)OC 62a_100000210326_100000210525 [0,1,0,0,0,0|1,0,2]=4 436 B13R0.274 CCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210326 [0,1,0,0,0,0|1,0,2]=4 437 B13R0.274 CCCCCSCC(=O)NC(=O)OC 62a_100000210326_100000010850 [0,1,0,0,0,0|2,0,1]=4 438 B13R0.340 C=C(COCCCCCC)C(=O)OC 34a_100000210259_100009813391 [0,1,0,0,0,0|1,0,2]=4 439 B13R0.340 C=C(CSCCCCCC)C(=O)OC 62a_100000210314_100009813391 [0,1,0,0,0,0|1,0,2]=4 440 B13R0.340 C=C(CSCCCCCC)C(=O)OC 62a_100009813391_100000210757 [0,1,0,0,0,0|1,0,2]=4 441 B13R0.340 CCCCCCCNC(=O)C(=O)OC 11a_100000229938_100000024059 [0,1,0,0,0,0|1,0,2]=4 442 B13R0.340 CCCCCCCNC(=O)C(=O)OC 1626a_100000229938_100000024059 [0,1,0,0,0,0|1,0,2]=4 443 B13R0.340 CCCCCCCNC(=O)C(=O)OC 240690a_100000229938_100000024059 [0,1,0,0,0,0|1,0,2]=4 444 B13R0.340 CCCCCCCNC(=O)C(=O)OC 527a_100000229938_100000024059 [0,1,0,0,0,0|1,0,2]=4 445 B13R0.340 CCCCCCOCC(=O)C(=O)OC 34a_100000210259_100011610305 [0,1,0,0,0,0|1,0,2]=4 446 B13R0.340 CCCCCCSCC(=O)C(=O)OC 62a_100000210314_100011610305 [0,1,0,0,0,0|1,0,2]=4 447 B13R0.340 CCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210757 [0,1,0,0,0,0|1,0,2]=4 448 B13R0.1170 C#CCCCNC(=O)C=CC(=O)OC 1626a_100000718082_100016283253 [0,1,0,0,0,0|1,0,2]=4 449 B13R0.1170 C=CCCCNC(=O)C=CC(=O)OC 1626a_100000700776_100016283253 [0,1,0,0,0,0|1,0,2]=4 450 B13R0.1170 CC=C(C)C=CC(=O)CCCCCC 1458a_100000692105_100000210757 [0,1,0,0,0,0|2,0,1]=4 451 B13R0.1170 CC=C(C)C=CC(=O)NCCCCC 1626a_100000209983_100000692105 [0,1,0,0,0,0|3,0,0]=4 452 B13R0.1170 CCCCC=CC(=O)NCC(=O)OC 188690a_100000185156_100016266645 [0,1,0,0,0,0|1,0,2]=4 453 B13R0.1170 CCCCCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210757 [0,1,0,0,0,0|1,0,1]=3 454 B13R0.1170 CCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210757 [0,1,0,0,0,0|0,0,3]=4 455 B13R0.1170 CCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210757 [0,1,0,0,0,0|1,0,2]=4 456 B13R0.1170 CCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100102632555 [0,1,0,0,0,0|1,0,2]=4 457 B13R0.1170 CCCCCNC(=O)C=CC(=O)NC 1626a_100000209983_100016259477 [0,1,0,0,0,0|2,0,0]=3 458 B13R0.1170 CCCCCNC(=O)C=CC(=O)OC 1626a_100000209983_100016283253 [0,1,0,0,0,0|1,0,0]=2 459 B13R0.1170 CCCCCNC(=O)CCC(=O)OC 11a_100000209983_100000187943 [0,1,0,0,0,0|1,0,2]=4 460 B13R0.1170 CCCCCNC(=O)CCC(=O)OC 1626a_100000209983_100000187943 [0,1,0,0,0,0|1,0,2]=4 461 B13R0.1170 CCCCCNC(=O)CCC(=O)OC 240690a_100000209983_100000187943 [0,1,0,0,0,0|1,0,2]=4 462 B13R0.1170 CCCCCNC(=O)CCC(=O)OC 527a_100000209983_100000187943 [0,1,0,0,0,0|1,0,2]=4 463 B13R0.1170 CCCCCNC(=O)CNC(=O)OC 11a_100000209983_100000215747 [0,1,0,0,0,0|2,0,1]=4 464 B13R0.1170 CCCCCNC(=O)CNC(=O)OC 1626a_100000209983_100000215747 [0,1,0,0,0,0|2,0,1]=4 465 B13R0.1170 CCCCCNC(=O)CNC(=O)OC 240690a_100000209983_100000215747 [0,1,0,0,0,0|2,0,1]=4 466 B13R0.1170 CCCCCNC(=O)CNC(=O)OC 527a_100000209983_100000215747 [0,1,0,0,0,0|2,0,1]=4 467 B13R0.1170 CCCCNN=C(C)C=CC(=O)OC 4a_100025702795_100016258046 [0,1,0,0,0,0|2,0,0]=3 468 B13R0.1170 CCCCNNC(=O)C=CC(=O)NC 22a_100025702795_100016259477 [0,1,0,0,0,0|3,0,0]=4 469 B13R0.1170 CCCCNNC(=O)C=CC(=O)OC 22a_100025702795_100016283253 [0,1,0,0,0,0|2,0,0]=3 470 B13R0.1170 CCCCOCC(=O)C=CC(=O)NC 1458a_100016259477_100011995733 [0,1,0,0,0,0|2,0,1]=4 471 B13R0.1170 CCCOCCC(=O)C=CC(=O)NC 1458a_100016259477_100011215938 [0,1,0,0,0,0|2,0,1]=4 472 B13R0.1170 CCOCCCC(=O)C=CC(=O)NC 1458a_100016259477_100012232248 [0,1,0,0,0,0|2,0,1]=4 473 B13R0.1170 CCOCCNC(=O)C=CC(=O)NC 1626a_102516460346_100016259477 [0,1,0,0,0,0|3,0,0]=4 474 B13R0.1170 CCOCCNC(=O)C=CC(=O)OC 1626a_102516460346_100016283253 [0,1,0,0,0,0|2,0,0]=3 475 B13R0.1170 CCSCCNC(=O)C=CC(=O)NC 1626a_100000106463_100016259477 [0,1,0,0,0,0|3,0,0]=4 476 B13R0.1170 CCSCCNC(=O)C=CC(=O)OC 1626a_100000106463_100016283253 [0,1,0,0,0,0|2,0,0]=3 477 B13R0.1170 CNC(=O)C=CC(=O)CCCCCF 1458a_100016259477_100000729378 [0,1,0,0,0,0|2,0,1]=4 478 B13R0.1170 CNC(=O)C=CC(=O)CCCCCO 1458a_100016259477_100000746330 [0,1,0,0,0,0|2,0,1]=4 479 B13R0.1170 CNC(=O)C=CC(=O)CCCCOC 1458a_100016259477_100000755781 [0,1,0,0,0,0|2,0,1]=4 480 B13R0.1170 CNC(=O)C=CC(=O)NCCCOC 1626a_100150723488_100016259477 [0,1,0,0,0,0|3,0,0]=4 481 B13R0.1170 CNC(=O)C=CC(=O)NCCCSC 1626a_100000749238_100016259477 [0,1,0,0,0,0|3,0,0]=4 482 B13R0.1170 COC(=O)C=CC(=O)NCCCSC 1626a_100000749238_100016283253 [0,1,0,0,0,0|2,0,0]=3 483 B13R0.1170 COCCCNC(=O)C=CC(=O)OC 1626a_100150723488_100016283253 [0,1,0,0,0,0|2,0,0]=3 484 B13R0.1170 COCCNNC(=O)C=CC(=O)OC 22a_100000741390_100016283253 [0,1,0,0,0,0|3,0,0]=4 485 B13R1.9 CCCCC=Cc1ccc(=O)[nH]c1 271570a_100016275911_100000212171 [0,0,0,1,0,0|1,0,2]=4 486 B13R1.9 CCCCC=Cc1ccc(=O)[nH]n1 271570a_100016275911_100009820020 [0,0,0,1,0,0|2,0,1]=4 487 B13R1.9 CCCCCOc1ccc(=O)[nH]c1 34a_100000075641_100000718602 [0,0,0,1,0,0|2,0,1]=4 488 B13R1.9 CCCCCSc1ccc(=O)[nH]c1 62a_100000210326_100000212171 [0,0,0,1,0,0|2,0,1]=4 489 B13R1.9 CCCCCSc1ccc(=O)[nH]c1 62a_100000212171_100000210326 [0,0,0,1,0,0|2,0,1]=4 490 B13R1.9 CCCCCSc1ccc(=O)[nH]n1 62a_100000210326_100009820020 [0,0,0,1,0,0|3,0,0]=4 491 B13R1.9 CCCCCSc1ccc(=O)[nH]n1 62a_100009820020_100000210326 [0,0,0,1,0,0|3,0,0]=4 492 B13R1.16 CCCC=Cc1cccc(=O)n1C 271570a_100016258520_100000726605 [0,0,0,1,0,0|1,0,2]=4 493 B13R1.16 CCCCNc1cccc(c1C)Br 34a_100000750434_100000210210 [0,0,0,1,0,0|3,0,0]=4 494 B13R1.16 CCCCNc1cccc(c1C)C 2230a_100000210026_100000210211 [0,0,0,1,0,0|3,0,0]=4 495 B13R1.16 CCCCNc1cccc(c1C)C 34a_100000210026_100000210210 [0,0,0,1,0,0|3,0,0]=4 496 B13R1.16 CCCCNc1cccc(c1C)C 7a_100000210026_100000210211 [0,0,0,1,0,0|3,0,0]=4 497 B13R1.16 CCCCNc1cccc(c1C)Cl 2230a_100000210441_100000210211 [0,0,0,1,0,0|3,0,0]=4 498 B13R1.16 CCCCNc1cccc(c1C)Cl 34a_100000210441_100000210210 [0,0,0,1,0,0|3,0,0]=4 499 B13R1.16 CCCCNc1cccc(c1C)Cl 7a_100000210441_100000210211 [0,0,0,1,0,0|3,0,0]=4 500 B13R1.16 CCCCNc1cccc(c1C)F 34a_100000745574_100000210210 [0,0,0,1,0,0|3,0,0]=4 501 B13R1.16 CCCCNc1cccc(c1C)F 7a_100000745574_100000210211 [0,0,0,1,0,0|3,0,0]=4 502 B13R1.16 CCCCNc1cccc(c1C)I 34a_100000761887_100000210210 [0,0,0,1,0,0|3,0,0]=4 503 B13R1.16 CCCCNc1cccc(c1C)O 34a_100011216573_100000210210 [0,0,0,1,0,0|2,0,1]=4 504 B13R1.16 CCCCNc1cccc(c1C)O 7a_100011216573_100000210211 [0,0,0,1,0,0|2,0,1]=4 505 B13R1.16 CCCCOc1cccc(c1C)Br 34a_100012002258_100000210210 [0,0,0,1,0,0|3,0,0]=4 506 B13R1.16 CCCCOc1cccc(c1C)Br 7a_100012002258_100000210211 [0,0,0,1,0,0|3,0,0]=4 507 B13R1.16 CCCCOc1cccc(c1C)C 34a_100000185855_100000210210 [0,0,0,1,0,0|3,0,0]=4 508 B13R1.16 CCCCOc1cccc(c1C)C 7a_100000185855_100000210211 [0,0,0,1,0,0|3,0,0]=4 509 B13R1.16 CCCCOc1cccc(c1C)Cl 34a_100011265684_100000210210 [0,0,0,1,0,0|3,0,0]=4 510 B13R1.16 CCCCOc1cccc(c1C)Cl 7a_100011265684_100000210211 [0,0,0,1,0,0|3,0,0]=4 511 B13R1.16 CCCCOc1cccc(c1C)F 34a_100011217231_100000210210 [0,0,0,1,0,0|3,0,0]=4 512 B13R1.16 CCCCOc1cccc(c1C)F 7a_100011217231_100000210211 [0,0,0,1,0,0|3,0,0]=4 513 B13R1.16 CCCCOc1cccc(c1C)N 34a_100011216573_100000210210 [0,0,0,1,0,0|3,0,0]=4 514 B13R1.16 CCCCOc1cccc(c1C)N 7a_100011216573_100000210211 [0,0,0,1,0,0|3,0,0]=4 515 B13R1.16 CCCCSc1cccc(=O)n1C 62a_100000210211_100000726605 [0,0,0,1,0,0|2,0,0]=3 516 B13R1.16 CCCCSc1cccc(=O)n1C 62a_100000726605_100000210210 [0,0,0,1,0,0|2,0,0]=3 517 B13R1.16 CCCCSc1cccc(c1C)Br 62a_100000210211_100012353703 [0,0,0,1,0,0|3,0,0]=4 518 B13R1.16 CCCCSc1cccc(c1C)Br 62a_100012353703_100000210210 [0,0,0,1,0,0|3,0,0]=4 519 B13R1.16 CCCCSc1cccc(c1C)C 62a_100000210211_100011214922 [0,0,0,1,0,0|3,0,0]=4 520 B13R1.16 CCCCSc1cccc(c1C)C 62a_100011214922_100000210210 [0,0,0,1,0,0|3,0,0]=4 521 B13R1.16 CCCCSc1cccc(c1C)Cl 62a_100000210211_100000726075 [0,0,0,1,0,0|3,0,0]=4 522 B13R1.16 CCCCSc1cccc(c1C)Cl 62a_100000726075_100000210210 [0,0,0,1,0,0|3,0,0]=4 523 B13R1.16 CCCCSc1cccc(c1C)F 62a_100000210211_100011216893 [0,0,0,1,0,0|3,0,0]=4 524 B13R1.16 CCCCSc1cccc(c1C)F 62a_100011216893_100000210210 [0,0,0,1,0,0|3,0,0]=4 525 B13R1.16 CCCCSc1cccc(c1C)N 62a_100000210211_100000761887 [0,0,0,1,0,0|3,0,0]=4 526 B13R1.16 CCCCSc1cccc(c1C)N 62a_100000761887_100000210210 [0,0,0,1,0,0|3,0,0]=4 527 B13R1.16 CCCCSc1cccc(c1C)O 62a_100000210211_100012002258 [0,0,0,1,0,0|2,0,1]=4 528 B13R1.16 CCCCSc1cccc(c1C)O 62a_100012002258_100000210210 [0,0,0,1,0,0|2,0,1]=4 529 B13R1.16 CCCNCc1cccc(c1C)Br 207a_100020643023_100012179384 [0,0,0,1,0,0|3,0,0]=4 530 B13R1.16 CCCNCc1cccc(c1C)Br 270004a_100020643023_100012179384 [0,0,0,1,0,0|3,0,0]=4 531 B13R1.16 CCCNCc1cccc(c1C)Br 34a_100000724210_100000210303 [0,0,0,1,0,0|3,0,0]=4 532 B13R1.16 CCCNCc1cccc(c1C)C 207a_100020643023_100000229941 [0,0,0,1,0,0|3,0,0]=4 533 B13R1.16 CCCNCc1cccc(c1C)C 2230a_100011211637_100000210303 [0,0,0,1,0,0|3,0,0]=4 534 B13R1.16 CCCNCc1cccc(c1C)C 270004a_100020643023_100000229941 [0,0,0,1,0,0|3,0,0]=4 535 B13R1.16 CCCNCc1cccc(c1C)C 34a_100011211637_100000210303 [0,0,0,1,0,0|3,0,0]=4 536 B13R1.16 CCCNCc1cccc(c1C)Cl 207a_100020643023_100012002129 [0,0,0,1,0,0|3,0,0]=4 537 B13R1.16 CCCNCc1cccc(c1C)Cl 2230a_100020639605_100000210303 [0,0,0,1,0,0|3,0,0]=4 538 B13R1.16 CCCNCc1cccc(c1C)Cl 270004a_100020643023_100012002129 [0,0,0,1,0,0|3,0,0]=4 539 B13R1.16 CCCNCc1cccc(c1C)Cl 34a_100020639605_100000210303 [0,0,0,1,0,0|3,0,0]=4 540 B13R1.16 CCCNCc1cccc(c1C)F 207a_100020643023_100000037668 [0,0,0,1,0,0|3,0,0]=4 541 B13R1.16 CCCNCc1cccc(c1C)F 2230a_100132306986_100000210303 [0,0,0,1,0,0|3,0,0]=4 542 B13R1.16 CCCNCc1cccc(c1C)F 270004a_100020643023_100000037668 [0,0,0,1,0,0|3,0,0]=4 543 B13R1.16 CCCNCc1cccc(c1C)F 34a_100132306986_100000210303 [0,0,0,1,0,0|3,0,0]=4 544 B13R1.16 CCCNCc1cccc(c1C)O 270004a_100020643023_100009868165 [0,0,0,1,0,0|2,0,1]=4 545 B13R1.16 CCCOCc1cccc(c1C)Br 34a_100000210258_100000694682 [0,0,0,1,0,0|3,0,0]=4 546 B13R1.16 CCCOCc1cccc(c1C)Br 34a_100000694458_100000210303 [0,0,0,1,0,0|3,0,0]=4 547 B13R1.16 CCCOCc1cccc(c1C)Br 7a_100000694458_100000210303 [0,0,0,1,0,0|3,0,0]=4 548 B13R1.16 CCCOCc1cccc(c1C)C 34a_100000210258_100011273979 [0,0,0,1,0,0|3,0,0]=4 549 B13R1.16 CCCOCc1cccc(c1C)C 34a_100011219135_100000210303 [0,0,0,1,0,0|3,0,0]=4 550 B13R1.16 CCCOCc1cccc(c1C)C 7a_100011219135_100000210303 [0,0,0,1,0,0|3,0,0]=4 551 B13R1.16 CCCOCc1cccc(c1C)Cl 34a_100000210258_100012186920 [0,0,0,1,0,0|3,0,0]=4 552 B13R1.16 CCCOCc1cccc(c1C)Cl 34a_100012000165_100000210303 [0,0,0,1,0,0|3,0,0]=4 553 B13R1.16 CCCOCc1cccc(c1C)Cl 7a_100012000165_100000210303 [0,0,0,1,0,0|3,0,0]=4 554 B13R1.16 CCCOCc1cccc(c1C)F 34a_100000042775_100000210303 [0,0,0,1,0,0|3,0,0]=4 555 B13R1.16 CCCOCc1cccc(c1C)F 34a_100000210258_100009813626 [0,0,0,1,0,0|3,0,0]=4 556 B13R1.16 CCCOCc1cccc(c1C)F 7a_100000042775_100000210303 [0,0,0,1,0,0|3,0,0]=4 557 B13R1.16 CCCOCc1cccc(c1C)I 34a_100000210258_100010150147 [0,0,0,1,0,0|3,0,0]=4 558 B13R1.16 CCCOCc1cccc(c1C)I 34a_100010150139_100000210303 [0,0,0,1,0,0|3,0,0]=4 559 B13R1.16 CCCOCc1cccc(c1C)I 7a_100010150139_100000210303 [0,0,0,1,0,0|3,0,0]=4 560 B13R1.16 CCCOCc1cccc(c1C)N 34a_102495339961_100000210303 [0,0,0,1,0,0|3,0,0]=4 561 B13R1.16 CCCOCc1cccc(c1C)N 7a_102495339961_100000210303 [0,0,0,1,0,0|3,0,0]=4 562 B13R1.16 CCCSCc1cccc(c1C)Br 62a_100000210303_100000694682 [0,0,0,1,0,0|3,0,0]=4 563 B13R1.16 CCCSCc1cccc(c1C)Br 62a_100000694682_100000210303 [0,0,0,1,0,0|3,0,0]=4 564 B13R1.16 CCCSCc1cccc(c1C)C 62a_100000210303_100011515928 [0,0,0,1,0,0|3,0,0]=4 565 B13R1.16 CCCSCc1cccc(c1C)C 62a_100011515928_100000210303 [0,0,0,1,0,0|3,0,0]=4 566 B13R1.16 CCCSCc1cccc(c1C)Cl 62a_100000210303_100012186920 [0,0,0,1,0,0|3,0,0]=4 567 B13R1.16 CCCSCc1cccc(c1C)Cl 62a_100012186920_100000210303 [0,0,0,1,0,0|3,0,0]=4 568 B13R1.16 CCCSCc1cccc(c1C)F 62a_100000210303_100009813626 [0,0,0,1,0,0|3,0,0]=4 569 B13R1.16 CCCSCc1cccc(c1C)F 62a_100009813626_100000210303 [0,0,0,1,0,0|3,0,0]=4 570 B13R1.16 CCCSCc1cccc(c1C)I 62a_100000210303_100010150147 [0,0,0,1,0,0|3,0,0]=4 571 B13R1.16 CCCSCc1cccc(c1C)I 62a_100010150147_100000210303 [0,0,0,1,0,0|3,0,0]=4 572 B13R1.16 CCNCCc1cccc(c1C)Br 2230a_100161000114_100000210202 [0,0,0,1,0,0|3,0,0]=4 573 B13R1.16 CCNCCc1cccc(c1C)Br 34a_100161000114_100000210202 [0,0,0,1,0,0|3,0,0]=4 574 B13R1.16 CCOCSc1cccc(=O)n1C 62a_100000726605_100000739092 [0,0,0,1,0,0|3,0,0]=4 575 B13R1.16 CCOCSc1cccc(=O)n1C 62a_100000739092_100000726605 [0,0,0,1,0,0|3,0,0]=4 576 B13R1.16 COCCSc1cccc(=O)n1C 62a_100000233755_100000726605 [0,0,0,1,0,0|3,0,0]=4 577 B13R1.16 COCCSc1cccc(=O)n1C 62a_100000726605_100000233755 [0,0,0,1,0,0|3,0,0]=4 578 B13R1.16 CSCCSc1cccc(=O)n1C 62a_100000212216_100000726605 [0,0,0,1,0,0|3,0,0]=4 579 B13R1.16 CSCCSc1cccc(=O)n1C 62a_100000726605_100000751147 [0,0,0,1,0,0|3,0,0]=4 580 B13R1.16 Cn1c(cccc1=O)SCCCF 62a_100000726605_100011934791 [0,0,0,1,0,0|3,0,0]=4 581 B13R1.16 Cn1c(cccc1=O)SCCCF 62a_100011934791_100000726605 [0,0,0,1,0,0|3,0,0]=4 582 B13R1.16 Cn1c(cccc1=O)SCCCO 62a_100000726605_100011215043 [0,0,0,1,0,0|3,0,0]=4 583 B13R1.16 Cn1c(cccc1=O)SCCCO 62a_100011215043_100000726605 [0,0,0,1,0,0|3,0,0]=4 584 B13R1.27 CCCCCC=Cc1cc([nH]n1)C 271570a_100000062253_100015199547 [0,0,0,1,0,0|3,0,0]=4 585 B13R1.27 CCCCCC=Cc1cc([nH]n1)N 271570a_100000062253_100009822546 [0,0,0,1,0,0|3,0,0]=4 586 B13R1.27 CCCCCC=Cc1cc(cs1)C 271570a_100000062253_100009876951 [0,0,0,1,0,0|3,0,0]=4 587 B13R1.27 CCCCCC=Cc1cc(n[nH]1)Br 271570a_100000062253_100160470719 [0,0,0,1,0,0|3,0,0]=4 588 B13R1.27 CCCCCC=Cc1cc(ns1)C 271570a_100000062253_100009815735 [0,0,0,1,0,0|3,0,0]=4 589 B13R1.27 CCCCCC=Cc1csc(c1)C 271570a_100000062253_100000759034 [0,0,0,1,0,0|1,1,1]=4 590 B13R1.27 CCCCCC=Cc1noc(n1)C 271570a_100000062253_100012003639 [0,0,0,1,0,0|3,0,0]=4 591 B13R1.27 CCCCCNN=C1C=C(OC1)C 4a_100000694160_200009860027 [0,0,0,1,0,0|3,0,0]=4 592 B13R1.27 CCCCCNN=C1COC(=O)C1 4a_100000694160_100000211896 [0,0,0,1,0,0|2,0,1]=4 593 B13R1.27 CCCCCOCC1=CC(=O)OC1 34a_100000210253_100000716558 [0,0,0,1,0,0|1,0,1]=3 594 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000210326_100000716558 [0,0,0,1,0,0|1,0,1]=3 595 B13R1.27 CCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210326 [0,0,0,1,0,0|1,0,1]=3 596 B13R1.27 CCOCCNCC1=CC(=O)OC1 34a_102516460346_100000716558 [0,0,0,1,0,0|2,0,1]=4 597 B13R1.27 CCOCCOCC1=CC(=O)OC1 34a_100000210136_100000716558 [0,0,0,1,0,0|2,0,1]=4 598 B13R1.27 CCOCCSCC1=CC(=O)OC1 62a_100000210147_100000716558 [0,0,0,1,0,0|2,0,1]=4 599 B13R1.27 CCOCCSCC1=CC(=O)OC1 62a_100000716558_100011215890 [0,0,0,1,0,0|2,0,1]=4 600 B13R1.27 CCSCCOCC1=CC(=O)OC1 34a_100000212035_100000716558 [0,0,0,1,0,0|2,0,1]=4 601 B13R1.27 CCSCCSCC1=CC(=O)OC1 62a_100000716558_100000757381 [0,0,0,1,0,0|2,0,1]=4 602 B13R1.27 CCSCCSCC1=CC(=O)OC1 62a_100000757381_100000716558 [0,0,0,1,0,0|2,0,1]=4 603 B13R1.27 CNCCCOCC1=CC(=O)OC1 34a_100000213112_100000716558 [0,0,0,1,0,0|2,0,1]=4 604 B13R1.27 COCCCNCC1=CC(=O)OC1 34a_100150723488_100000716558 [0,0,0,1,0,0|2,0,1]=4 605 B13R1.27 COCCCOCC1=CC(=O)OC1 34a_100000740835_100000716558 [0,0,0,1,0,0|2,0,1]=4 606 B13R1.27 COCCCSCC1=CC(=O)OC1 62a_100000709357_100000716558 [0,0,0,1,0,0|2,0,1]=4 607 B13R1.27 COCCCSCC1=CC(=O)OC1 62a_100000716558_100000709357 [0,0,0,1,0,0|2,0,1]=4 608 B13R1.27 CSCCCOCC1=CC(=O)OC1 34a_100000690336_100000716558 [0,0,0,1,0,0|2,0,1]=4 609 B13R1.27 NCCCCOCC1=CC(=O)OC1 34a_100000750430_100000716558 [0,0,0,1,0,0|2,0,1]=4 610 B13R1.27 O=C1C=C(CO1)CNCCCCO 34a_100000750430_100000716558 [0,0,0,1,0,0|2,0,1]=4 611 B13R1.27 O=C1C=C(CO1)COCCCCBr 34a_100011216708_100000716558 [0,0,0,1,0,0|2,0,1]=4 612 B13R1.27 O=C1C=C(CO1)COCCCCCl 34a_100000210776_100000716558 [0,0,0,1,0,0|2,0,1]=4 613 B13R1.27 O=C1C=C(CO1)COCCCCF 34a_100011995726_100000716558 [0,0,0,1,0,0|2,0,1]=4 614 B13R1.27 O=C1C=C(CO1)COCCCCI 34a_200012148704_100000716558 [0,0,0,1,0,0|2,0,1]=4 615 B13R1.27 O=C1C=C(CO1)CSCCCCF 62a_100000716558_100000729493 [0,0,0,1,0,0|2,0,1]=4 616 B13R1.27 O=C1C=C(CO1)CSCCCCF 62a_100000729493_100000716558 [0,0,0,1,0,0|2,0,1]=4 617 B13R1.27 O=C1C=C(CO1)CSCCCCO 62a_100000210776_100000716558 [0,0,0,1,0,0|2,0,1]=4 618 B13R1.27 O=C1C=C(CO1)CSCCCCO 62a_100000716558_100000210776 [0,0,0,1,0,0|2,0,1]=4 619 B13R1.189 CCCCC=Cc1ccc(s1)CC 271570a_100016275911_100009844052 [0,0,0,1,0,0|1,1,1]=4 620 B13R1.189 CCCCC=Cc1cnc(s1)OC 271570a_100016275911_100000729428 [0,0,0,1,0,0|1,1,1]=4 621 B13R1.189 CCCCC=Cc1csc(n1)OC 271570a_100016275911_100000727839 [0,0,0,1,0,0|2,0,1]=4 622 B13R1.189 CCCCCCc1ccc(s1)SC 62a_100009817186_200000210301 [0,0,0,1,0,0|0,2,1]=4 623 B13R1.189 CCCCCCc1ccc(s1)SC 62a_200000210301_100009817186 [0,0,0,1,0,0|0,2,1]=4 624 B13R1.189 CCCCCCc1ccc(s1)S[13CH3] 62a_100009817186_200025704644 [0,0,0,1,0,0|0,2,1]=4 625 B13R1.189 CCCCCCc1ccc(s1)S[13CH3] 62a_200025704644_100009817186 [0,0,0,1,0,0|0,2,1]=4 626 B13R1.189 CCCCCSc1ccc(s1)CC 62a_100000210326_100009844052 [0,0,0,1,0,0|2,1,0]=4 627 B13R1.189 CCCCCSc1ccc(s1)CC 62a_100009844052_100000210326 [0,0,0,1,0,0|2,1,0]=4 628 B13R1.189 CCCCCSc1cnc(s1)OC 62a_100000210326_100000729428 [0,0,0,1,0,0|2,1,0]=4 629 B13R1.189 CCCCCSc1cnc(s1)OC 62a_100000729428_100000210326 [0,0,0,1,0,0|2,1,0]=4 630 B13R1.189 CCCCCSc1csc(n1)OC 62a_100000210326_100000727839 [0,0,0,1,0,0|3,0,0]=4 631 B13R1.189 CCCCCSc1csc(n1)OC 62a_100000727839_100000210326 [0,0,0,1,0,0|3,0,0]=4 632 B13R1.189 CCCNN=Cc1ccc(s1)OC 4a_100000740057_100000689122 [0,0,0,1,0,0|2,1,0]=4 633 B13R1.382 CCNc1ncccc1C(=O)OC 27a_100015525214_100000150852 [0,0,0,1,0,0|2,0,1]=4 634 B13R1.382 CCOc1ccccc1C(=O)OC 7a_100000150335_100000210202 [0,0,0,1,0,0|1,0,2]=4 635 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000148710_100000210202 [0,0,0,1,0,0|1,0,2]=4 636 B13R1.382 CCSc1ccccc1C(=O)OC 62a_100000210202_100000148710 [0,0,0,1,0,0|1,0,2]=4 637 B13R1.382 CCSc1ncccc1C(=O)OC 62a_100000210202_100000150852 [0,0,0,1,0,0|2,0,1]=4 638 B13R1.382 CCSc1ncccc1C(=O)OC 62a_100011587185_100000210202 [0,0,0,1,0,0|2,0,1]=4 639 B13R1.382 CNCc1ccccc1C(=O)OC 2230a_106832991635_100000744672 [0,0,0,1,0,0|1,0,2]=4 640 B13R1.382 CNCc1ccccc1C(=O)OC 34a_100102657272_100000744672 [0,0,0,1,0,0|1,0,2]=4 641 B13R1.382 CNCc1ccccc1C(=O)OC 7a_106832991635_100000744672 [0,0,0,1,0,0|1,0,2]=4 642 B13R1.382 CNCc1ncccc1C(=O)OC 2230a_106832991635_100000709840 [0,0,0,1,0,0|2,0,1]=4 643 B13R1.382 CNCc1ncccc1C(=O)OC 34a_100102657272_100012347567 [0,0,0,1,0,0|2,0,1]=4 644 B13R1.382 CNCc1ncccc1C(=O)OC 7a_106832991635_100000709840 [0,0,0,1,0,0|2,0,1]=4 645 B13R1.382 COC(=O)c1ccccc1CSC 62a_100000744672_200000210301 [0,0,0,1,0,0|1,0,2]=4 646 B13R1.382 COC(=O)c1ccccc1CSC 62a_200000210301_100000744672 [0,0,0,1,0,0|1,0,2]=4 647 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_100000744672_200025704644 [0,0,0,1,0,0|1,0,2]=4 648 B13R1.382 COC(=O)c1ccccc1CS[13CH3] 62a_200025704644_100000744672 [0,0,0,1,0,0|1,0,2]=4 649 B13R1.382 COC(=O)c1cccnc1CSC 62a_100000709840_200000210301 [0,0,0,1,0,0|2,0,1]=4 650 B13R1.382 COC(=O)c1cccnc1CSC 62a_200000210301_100000709840 [0,0,0,1,0,0|2,0,1]=4 651 B13R1.382 COC(=O)c1cccnc1CS[13CH3] 62a_100000709840_200025704644 [0,0,0,1,0,0|2,0,1]=4 652 B13R1.382 COC(=O)c1cccnc1CS[13CH3] 62a_200025704644_100000709840 [0,0,0,1,0,0|2,0,1]=4 653 B13R1.382 COCc1ccccc1C(=O)OC 34a_100138415774_100000744672 [0,0,0,1,0,0|1,0,2]=4 654 B13R1.382 COCc1ncccc1C(=O)OC 34a_100138415774_100012347567 [0,0,0,1,0,0|2,0,1]=4 655 B13R1.536 COC(=O)/C=C/CNC1CCCC1 2230a_100000211070_100000742655 [0,0,0,1,0,0|1,0,1]=3 656 B13R1.536 COC(=O)/C=C/CNC1CCCC1 34a_100000211070_100000742655 [0,0,0,1,0,0|1,0,1]=3 657 B13R1.536 COC(=O)/C=C/CN[C@@H]1CCOC1 2230a_200015188469_100000742655 [0,0,0,1,0,0|2,0,1]=4 658 B13R1.536 COC(=O)/C=C/CN[C@H]1CCOC1 2230a_100015188467_100000742655 [0,0,0,1,0,0|2,0,1]=4 659 B13R1.536 COC(=O)/C=C/CN[C@H]1CCOC1 34a_100015188467_100000742655 [0,0,0,1,0,0|2,0,1]=4 660 B13R1.536 COC(=O)/C=C/COC1CCCC1 34a_100000210269_100000742655 [0,0,0,1,0,0|1,0,1]=3 661 B13R1.536 COC(=O)/C=C/COC1CCCC1 7a_100000210269_100000742655 [0,0,0,1,0,0|1,0,1]=3 662 B13R1.536 COC(=O)/C=C/COC1CCCO1 34a_100000085407_100000742655 [0,0,0,1,0,0|2,0,1]=4 663 B13R1.536 COC(=O)/C=C/COC1CCSC1 7a_100011232664_100000742655 [0,0,0,1,0,0|2,0,1]=4 664 B13R1.536 COC(=O)/C=C/CO[C@H]1CCOC1 34a_100000717292_100000742655 [0,0,0,1,0,0|2,0,1]=4 665 B13R1.536 COC(=O)/C=C/CSC1CCCC1 62a_100000742655_100000179811 [0,0,0,1,0,0|1,0,1]=3 666 B13R1.536 COC(=O)/C=C/CSC1CCCC1 62a_100011217020_100000742655 [0,0,0,1,0,0|1,0,1]=3 667 B13R1.536 COC(=O)/C=C/CSC1CCOC1 62a_100000742655_100000690089 [0,0,0,1,0,0|2,0,1]=4 668 B13R1.536 COC(=O)CC=NNC1CCCC1 4a_100000737850_200011552997 [0,0,0,1,0,0|2,0,1]=4 669 B13R1.538 COC(=O)/C=C/COCC1CC1C 34a_100000744939_100000742655 [0,0,0,1,0,0|1,0,1]=3 670 B13R1.538 COC(=O)/C=C/COCC1CC1C 7a_100000744939_100000742655 [0,0,0,1,0,0|1,0,1]=3 671 B13R1.539 COC(=O)/C=C/CNCC1CCC1 2230a_100000738700_100000742655 [0,0,0,1,0,0|1,0,1]=3 672 B13R1.539 COC(=O)/C=C/CNCC1CCC1 34a_100000738700_100000742655 [0,0,0,1,0,0|1,0,1]=3 673 B13R1.539 COC(=O)/C=C/CNCC1COC1 2230a_100015281925_100000742655 [0,0,0,1,0,0|2,0,1]=4 674 B13R1.539 COC(=O)/C=C/CNCC1COC1 34a_100015281925_100000742655 [0,0,0,1,0,0|2,0,1]=4 675 B13R1.539 COC(=O)/C=C/CNC[C@@H]1CCO1 2230a_100020831831_100000742655 [0,0,0,1,0,0|2,0,1]=4 676 B13R1.539 COC(=O)/C=C/CNC[C@@H]1CCO1 34a_100020831831_100000742655 [0,0,0,1,0,0|2,0,1]=4 677 B13R1.539 COC(=O)/C=C/COCC1CCC1 34a_100000760304_100000742655 [0,0,0,1,0,0|1,0,1]=3 678 B13R1.539 COC(=O)/C=C/COCC1CCO1 34a_100000039022_100000742655 [0,0,0,1,0,0|2,0,1]=4 679 B13R1.539 COC(=O)/C=C/COCC1CNC1 34a_100016987283_100000742655 [0,0,0,1,0,0|2,0,1]=4 680 B13R1.539 COC(=O)/C=C/COCC1COC1 34a_100000060846_100000742655 [0,0,0,1,0,0|2,0,1]=4 681 B13R1.539 COC(=O)/C=C/CSCC1CCC1 62a_100000742655_100000763275 [0,0,0,1,0,0|1,0,1]=3 682 B13R1.539 COC(=O)/C=C/CSCC1CCC1 62a_100000763275_100000742655 [0,0,0,1,0,0|1,0,1]=3 683 B13R1.539 COC(=O)/C=C/CSCC1CCO1 62a_100000103362_100000742655 [0,0,0,1,0,0|2,0,1]=4 684 B13R1.539 COC(=O)/C=C/CSCC1CCO1 62a_100000742655_100000103362 [0,0,0,1,0,0|2,0,1]=4 685 B13R1.539 COC(=O)/C=C/CSCC1COC1 62a_100000742655_100010264016 [0,0,0,1,0,0|2,0,1]=4 686 B13R1.539 COC(=O)/C=C/CSCC1COC1 62a_100010264016_100000742655 [0,0,0,1,0,0|2,0,1]=4 687 B13R1.539 COC(=O)C=CC=NNC1CCC1 4a_100000736358_100016254430 [0,0,0,1,0,0|2,0,0]=3 688 B13R1.539 COC(=O)C=CC=NNC1COC1 4a_100015188821_100016254430 [0,0,0,1,0,0|3,0,0]=4 689 B13R1.539 COC(=O)CC=NNCC1CCC1 4a_200020586977_200011552997 [0,0,0,1,0,0|2,0,1]=4 690 B13R1.581 CCCCC1C=CCN1C(=O)CC 11a_100015184376_100000210414 [0,0,0,1,0,0|2,0,1]=4 691 B13R1.581 CCCCC1C=CCN1C(=O)CC 1626a_100015184376_100000210414 [0,0,0,1,0,0|2,0,1]=4 692 B13R1.581 CCCCC1C=CCN1C(=O)CC 240690a_100015184376_100000210414 [0,0,0,1,0,0|2,0,1]=4 693 B13R1.581 CCCCC1C=CCN1C(=O)CC 527a_100015184376_100000210414 [0,0,0,1,0,0|2,0,1]=4 694 B13R1.581 CCCCC1C=CCN1C(=O)NC 2708a_100102657272_100015184376 [0,0,0,1,0,0|2,0,1]=4 695 B13R1.581 CCCCC1C=CCN1C(=O)NC 273464a_100102657272_100015184376 [0,0,0,1,0,0|2,0,1]=4 696 B13R1.581 CCCCc1cc[nH]c1C(=O)OC 271570a_100020621405_100102525103 [0,0,0,1,0,0|1,0,1]=3 697 B13R1.581 CCCCc1ccoc1C(=O)OC 271570a_100020621405_100012676306 [0,0,0,1,0,0|1,0,1]=3 698 B13R1.581 CCCCc1ccsc1C(=O)OC 271570a_100020621405_100000730364 [0,0,0,1,0,0|1,0,1]=3 699 B13R1.581 CCCCc1cn[nH]c1C(=O)OC 271570a_100020621405_100011934057 [0,0,0,1,0,0|2,0,1]=4 700 B13R1.581 CCCCc1cscc1C(=O)OC 271570a_100020621405_100012351140 [0,0,0,1,0,0|1,0,1]=3 701 B13R1.581 CCCCc1nc[nH]c1C(=O)OC 271570a_100020621405_100010290838 [0,0,0,1,0,0|2,0,1]=4 702 B13R1.581 CCCCc1ncsc1C(=O)OC 271570a_100020621405_100013370767 [0,0,0,1,0,0|2,0,1]=4 703 B13R1.581 CCCCc1occc1C(=O)OC 271570a_100020621405_100011935261 [0,0,0,1,0,0|1,0,1]=3 704 B13R1.581 CCCCc1sccc1C(=O)OC 271570a_100020621405_100009822520 [0,0,0,1,0,0|1,0,1]=3 705 B13R1.581 CCCCc1scnc1C(=O)OC 271570a_100020621405_100009816836 [0,0,0,1,0,0|2,0,1]=4 706 B13R1.581 CCCOc1cc[nH]c1C(=O)OC 34a_100000131702_100000210303 [0,0,0,1,0,0|2,0,1]=4 707 B13R1.581 CCCOc1ccsc1C(=O)OC 7a_100000043449_100000210303 [0,0,0,1,0,0|2,0,1]=4 708 B13R1.581 CCCSc1cc[nH]c1C(=O)OC 62a_100000210303_100102525103 [0,0,0,1,0,0|2,0,1]=4 709 B13R1.581 CCCSc1ccoc1C(=O)OC 62a_100000210303_100012676306 [0,0,0,1,0,0|2,0,1]=4 710 B13R1.581 CCCSc1ccsc1C(=O)OC 62a_100000210303_100000730364 [0,0,0,1,0,0|2,0,1]=4 711 B13R1.581 CCCSc1cscc1C(=O)OC 62a_100000210303_100012351140 [0,0,0,1,0,0|2,0,1]=4 712 B13R1.581 CCCSc1cscc1C(=O)OC 62a_100012351140_100000210303 [0,0,0,1,0,0|2,0,1]=4 713 B13R1.581 CCCSc1occc1C(=O)OC 62a_100000210303_100011935261 [0,0,0,1,0,0|2,0,1]=4 714 B13R1.581 CCCSc1sccc1C(=O)OC 62a_100000210303_100009822520 [0,0,0,1,0,0|2,0,1]=4 715 B13R1.581 CCCSc1sccc1C(=O)OC 62a_100009822520_100000210303 [0,0,0,1,0,0|2,0,1]=4 716 B13R1.581 CCNCc1ccoc1C(=O)OC 2230a_100015525214_100000734845 [0,0,0,1,0,0|2,0,1]=4 717 B13R1.581 CCNCc1occc1C(=O)OC 2230a_100015525214_100009813464 [0,0,0,1,0,0|2,0,1]=4 718 B13R1.581 CCOCc1ccoc1C(=O)OC 34a_100121572206_100000734845 [0,0,0,1,0,0|2,0,1]=4 719 B13R1.581 CCOCc1occc1C(=O)OC 34a_100121572206_100009813464 [0,0,0,1,0,0|2,0,1]=4 720 B13R1.581 CCSCc1ccoc1C(=O)OC 62a_100000210202_100000734845 [0,0,0,1,0,0|2,0,1]=4 721 B13R1.581 CCSCc1occc1C(=O)OC 62a_100000210202_100009813464 [0,0,0,1,0,0|2,0,1]=4 722 B13R1.581 CCSCc1occc1C(=O)OC 62a_100009813464_100000210202 [0,0,0,1,0,0|2,0,1]=4 723 B13R1.594 COC(=O)/C=C/CNCCC1CC1 34a_100000764129_100000742655 [0,0,0,1,0,0|1,0,1]=3 724 B13R1.594 COC(=O)/C=C/COCCC1CC1 34a_100000754188_100000742655 [0,0,0,1,0,0|1,0,1]=3 725 B13R1.594 COC(=O)/C=C/COCCC1CC1 7a_100000754188_100000742655 [0,0,0,1,0,0|1,0,1]=3 726 B13R1.594 COC(=O)/C=C/COCC[C@@H]1CO1 34a_100009820653_100000742655 [0,0,0,1,0,0|2,0,1]=4 727 B13R1.594 COC(=O)/C=C/CSCCC1CC1 62a_100000742655_100000764125 [0,0,0,1,0,0|1,0,1]=3 728 B13R1.594 COC(=O)/C=C/CSCCC1CC1 62a_100000764125_100000742655 [0,0,0,1,0,0|1,0,1]=3 729 B13R1.594 COC(=O)/C=C/CSCCC1CO1 62a_100000732470_100000742655 [0,0,0,1,0,0|2,0,1]=4 730 B13R1.594 COC(=O)/C=C/CSCCC1CO1 62a_100000742655_100000732470 [0,0,0,1,0,0|2,0,1]=4 731 B13R1.594 COC(=O)C=CC=NNCC1CC1 4a_100000736359_100016254430 [0,0,0,1,0,0|2,0,0]=3 732 B13R1.599 COC(=O)/C=C/CN1CCC[C@@H]1C 2230a_100020605311_100000742655 [0,0,0,1,0,0|1,0,1]=3 733 B13R1.599 COC(=O)/C=C/CN1CCC[C@@H]1C 269982a_100020605311_100000742655 [0,0,0,1,0,0|1,0,1]=3 734 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 2230a_100015189458_100000742655 [0,0,0,1,0,0|1,0,1]=3 735 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 269982a_100015189458_100000742655 [0,0,0,1,0,0|1,0,1]=3 736 B13R1.599 COC(=O)/C=C/CN1CCC[C@H]1C 34a_100015189458_100000742655 [0,0,0,1,0,0|1,0,1]=3 737 B13R1.599 COC(=O)/C=C/CN1CCSC1C 2230a_200011216479_100000742655 [0,0,0,1,0,0|2,0,1]=4 738 B13R1.599 COC(=O)/C=C/CN1CCSC1C 269982a_200011216479_100000742655 [0,0,0,1,0,0|2,0,1]=4 739 B13R1.599 COC(=O)/C=C/CN1CCSC1C 34a_200011216479_100000742655 [0,0,0,1,0,0|2,0,1]=4 740 B13R1.666 CCCC=Cc1cccc(c1)OC 271570a_100016258520_100000170001 [0,0,0,1,0,0|1,0,2]=4 741 B13R1.666 CCCC=Cc1cccc(n1)OC 271570a_100016258520_100000760917 [0,0,0,1,0,0|1,0,2]=4 742 B13R1.666 CCCCNc1cccc(c1)CC 2230a_100000211250_100000210211 [0,0,0,1,0,0|3,0,0]=4 743 B13R1.666 CCCCNc1cccc(c1)CC 34a_100000211250_100000210210 [0,0,0,1,0,0|3,0,0]=4 744 B13R1.666 CCCCNc1cccc(c1)CC 7a_100000211250_100000210211 [0,0,0,1,0,0|3,0,0]=4 745 B13R1.666 CCCCNc1cccc(c1)OC 34a_100000210024_100000210210 [0,0,0,1,0,0|2,0,0]=3 746 B13R1.666 CCCCNc1cccc(c1)SC 2230a_100000210049_100000210211 [0,0,0,1,0,0|2,1,0]=4 747 B13R1.666 CCCCNc1cccc(c1)SC 34a_100000210049_100000210210 [0,0,0,1,0,0|2,1,0]=4 748 B13R1.666 CCCCNc1ccnc(n1)OC 27a_100000102301_100000069072 [0,0,0,1,0,0|3,0,0]=4 749 B13R1.666 CCCCNc1cncc(n1)OC 27a_100000102301_100009819700 [0,0,0,1,0,0|3,0,0]=4 750 B13R1.666 CCCCNc1nccc(n1)OC 27a_100000102301_100000182009 [0,0,0,1,0,0|3,0,0]=4 751 B13R1.666 CCCCOc1cccc(c1)CC 34a_100000211550_100000210210 [0,0,0,1,0,0|3,0,0]=4 752 B13R1.666 CCCCOc1cccc(c1)CC 7a_100000211550_100000210211 [0,0,0,1,0,0|3,0,0]=4 753 B13R1.666 CCCCOc1cccc(c1)NC 2230a_100000744072_200000210301 [0,0,0,1,0,0|3,0,0]=4 754 B13R1.666 CCCCOc1cccc(c1)NC 34a_100000744072_200000210301 [0,0,0,1,0,0|3,0,0]=4 755 B13R1.666 CCCCOc1cccc(c1)NC 34a_100000756613_100000210210 [0,0,0,1,0,0|3,0,0]=4 756 B13R1.666 CCCCOc1cccc(c1)NC 7a_100000744072_200000210301 [0,0,0,1,0,0|3,0,0]=4 757 B13R1.666 CCCCOc1cccc(c1)NC 7a_100000756613_100000210211 [0,0,0,1,0,0|3,0,0]=4 758 B13R1.666 CCCCOc1cccc(c1)N[13CH3] 2230a_100000744072_200025704644 [0,0,0,1,0,0|3,0,0]=4 759 B13R1.666 CCCCOc1cccc(c1)N[13CH3] 34a_100000744072_200025704644 [0,0,0,1,0,0|3,0,0]=4 760 B13R1.666 CCCCOc1cccc(c1)N[13CH3] 7a_100000744072_200025704644 [0,0,0,1,0,0|3,0,0]=4 761 B13R1.666 CCCCOc1cccc(c1)OC 34a_100000211255_100000210210 [0,0,0,1,0,0|2,0,0]=3 762 B13R1.666 CCCCOc1cccc(c1)OC 34a_100011216386_200000210301 [0,0,0,1,0,0|2,0,0]=3 763 B13R1.666 CCCCOc1cccc(c1)OC 7a_100000211255_100000210211 [0,0,0,1,0,0|2,0,0]=3 764 B13R1.666 CCCCOc1cccc(c1)OC 7a_100011216386_200000210301 [0,0,0,1,0,0|2,0,0]=3 765 B13R1.666 CCCCOc1cccc(c1)O[13CH3] 34a_100011216386_200025704644 [0,0,0,1,0,0|2,0,0]=3 766 B13R1.666 CCCCOc1cccc(c1)O[13CH3] 7a_100011216386_200025704644 [0,0,0,1,0,0|2,0,0]=3 767 B13R1.666 CCCCOc1cccc(c1)SC 34a_100011265683_100000210210 [0,0,0,1,0,0|2,1,0]=4 768 B13R1.666 CCCCOc1cccc(c1)SC 62a_200000210301_200011212284 [0,0,0,1,0,0|2,1,0]=4 769 B13R1.666 CCCCOc1cccc(c1)SC 7a_100011265683_100000210211 [0,0,0,1,0,0|2,1,0]=4 770 B13R1.666 CCCCOc1cccc(c1)S[13CH3] 62a_200025704644_200011212284 [0,0,0,1,0,0|2,1,0]=4 771 B13R1.666 CCCCOc1cccc(n1)NC 27a_100102657272_200011960251 [0,0,0,1,0,0|3,0,0]=4 772 B13R1.666 CCCCOc1cccc(n1)SC 62a_200000210301_200011960251 [0,0,0,1,0,0|2,1,0]=4 773 B13R1.666 CCCCOc1cccc(n1)SC 62a_200011960251_200000210301 [0,0,0,1,0,0|2,1,0]=4 774 B13R1.666 CCCCOc1cccc(n1)S[13CH3] 62a_200011960251_200025704644 [0,0,0,1,0,0|2,1,0]=4 775 B13R1.666 CCCCOc1cccc(n1)S[13CH3] 62a_200025704644_200011960251 [0,0,0,1,0,0|2,1,0]=4 776 B13R1.666 CCCCOc1ccnc(c1)OC 34a_100012181050_100000210210 [0,0,0,1,0,0|3,0,0]=4 777 B13R1.666 CCCCOc1cncc(c1)OC 34a_100000084572_100000210210 [0,0,0,1,0,0|3,0,0]=4 778 B13R1.666 CCCCOc1cncc(c1)OC 7a_100000084572_100000210211 [0,0,0,1,0,0|3,0,0]=4 779 B13R1.666 CCCCSc1cc(ccn1)OC 62a_100000210211_100011216251 [0,0,0,1,0,0|3,0,0]=4 780 B13R1.666 CCCCSc1cc(ccn1)OC 62a_100009817693_100000210210 [0,0,0,1,0,0|3,0,0]=4 781 B13R1.666 CCCCSc1cccc(c1)CC 62a_100000210211_100011263222 [0,0,0,1,0,0|3,0,0]=4 782 B13R1.666 CCCCSc1cccc(c1)CC 62a_100011263222_100000210210 [0,0,0,1,0,0|3,0,0]=4 783 B13R1.666 CCCCSc1cccc(c1)NC 62a_100000210211_100000219648 [0,0,0,1,0,0|3,0,0]=4 784 B13R1.666 CCCCSc1cccc(c1)NC 62a_100000219648_100000210210 [0,0,0,1,0,0|3,0,0]=4 785 B13R1.666 CCCCSc1cccc(c1)OC 62a_100000210211_100000170001 [0,0,0,1,0,0|2,0,0]=3 786 B13R1.666 CCCCSc1cccc(c1)SC 62a_100000210211_100011215954 [0,0,0,1,0,0|2,1,0]=4 787 B13R1.666 CCCCSc1cccc(c1)SC 62a_100010128134_200000210301 [0,0,0,1,0,0|2,1,0]=4 788 B13R1.666 CCCCSc1cccc(c1)SC 62a_100011215954_100000210210 [0,0,0,1,0,0|2,1,0]=4 789 B13R1.666 CCCCSc1cccc(c1)SC 62a_200000210301_100010128134 [0,0,0,1,0,0|2,1,0]=4 790 B13R1.666 CCCCSc1cccc(c1)S[13CH3] 62a_100010128134_200025704644 [0,0,0,1,0,0|2,1,0]=4 791 B13R1.666 CCCCSc1cccc(c1)S[13CH3] 62a_200025704644_100010128134 [0,0,0,1,0,0|2,1,0]=4 792 B13R1.666 CCCCSc1cccc(n1)CC 62a_100000210211_100009856026 [0,0,0,1,0,0|3,0,0]=4 793 B13R1.666 CCCCSc1cccc(n1)CC 62a_100009856026_100000210210 [0,0,0,1,0,0|3,0,0]=4 794 B13R1.666 CCCCSc1cccc(n1)NC 62a_100000210211_100000703281 [0,0,0,1,0,0|3,0,0]=4 795 B13R1.666 CCCCSc1cccc(n1)NC 62a_100000703281_100000210210 [0,0,0,1,0,0|3,0,0]=4 796 B13R1.666 CCCCSc1cccc(n1)OC 62a_100000210211_100000760917 [0,0,0,1,0,0|2,0,0]=3 797 B13R1.666 CCCCSc1cccc(n1)OC 62a_100000760917_100000210210 [0,0,0,1,0,0|2,0,0]=3 798 B13R1.666 CCCCSc1cccc(n1)SC 62a_100000210211_100011960944 [0,0,0,1,0,0|2,1,0]=4 799 B13R1.666 CCCCSc1cccc(n1)SC 62a_100011960944_100000210210 [0,0,0,1,0,0|2,1,0]=4 800 B13R1.666 CCCCSc1ccnc(c1)OC 62a_100000117307_100000210210 [0,0,0,1,0,0|3,0,0]=4 801 B13R1.666 CCCCSc1ccnc(c1)OC 62a_100000210211_100000117307 [0,0,0,1,0,0|3,0,0]=4 802 B13R1.666 CCCCSc1ccnc(n1)OC 62a_100000069072_100000210210 [0,0,0,1,0,0|3,0,0]=4 803 B13R1.666 CCCCSc1ccnc(n1)OC 62a_100000210211_100000069072 [0,0,0,1,0,0|3,0,0]=4 804 B13R1.666 CCCCSc1cncc(c1)OC 62a_100000050176_100000210210 [0,0,0,1,0,0|3,0,0]=4 805 B13R1.666 CCCCSc1cncc(c1)OC 62a_100000210211_100000050176 [0,0,0,1,0,0|3,0,0]=4 806 B13R1.666 CCCCSc1cncc(n1)OC 62a_100000210211_100000756030 [0,0,0,1,0,0|3,0,0]=4 807 B13R1.666 CCCCSc1cncc(n1)OC 62a_100000756030_100000210210 [0,0,0,1,0,0|3,0,0]=4 808 B13R1.666 CCCCSc1nccc(n1)OC 62a_100000182009_100000210210 [0,0,0,1,0,0|3,0,0]=4 809 B13R1.666 CCCCSc1nccc(n1)OC 62a_100000210211_100000182009 [0,0,0,1,0,0|3,0,0]=4 810 B13R1.666 CCCNCc1cc(ccn1)OC 207a_100020643023_100000087537 [0,0,0,1,0,0|3,0,0]=4 811 B13R1.666 CCCNCc1cc(ccn1)OC 270004a_100020643023_100000087537 [0,0,0,1,0,0|3,0,0]=4 812 B13R1.666 CCCNCc1cccc(c1)CC 207a_100020643023_100011999841 [0,0,0,1,0,0|3,0,0]=4 813 B13R1.666 CCCNCc1cccc(c1)CC 270004a_100020643023_100011999841 [0,0,0,1,0,0|3,0,0]=4 814 B13R1.666 CCCNCc1cccc(c1)OC 207a_100020643023_100000170238 [0,0,0,1,0,0|2,0,0]=3 815 B13R1.666 CCCNCc1cccc(c1)OC 2230a_100000174954_100000210303 [0,0,0,1,0,0|2,0,0]=3 816 B13R1.666 CCCNCc1cccc(c1)OC 270004a_100020643023_100000170238 [0,0,0,1,0,0|2,0,0]=3 817 B13R1.666 CCCNCc1cccc(c1)OC 34a_100000174954_100000210303 [0,0,0,1,0,0|2,0,0]=3 818 B13R1.666 CCCNCc1cccc(c1)SC 207a_100020643023_100011935093 [0,0,0,1,0,0|2,1,0]=4 819 B13R1.666 CCCNCc1cccc(c1)SC 270004a_100020643023_100011935093 [0,0,0,1,0,0|2,1,0]=4 820 B13R1.666 CCCNCc1cccc(c1)SC 62a_100015184641_200000210301 [0,0,0,1,0,0|2,1,0]=4 821 B13R1.666 CCCNCc1cccc(c1)SC 62a_200000210301_100015184641 [0,0,0,1,0,0|2,1,0]=4 822 B13R1.666 CCCNCc1cccc(c1)S[13CH3] 62a_100015184641_200025704644 [0,0,0,1,0,0|2,1,0]=4 823 B13R1.666 CCCNCc1cccc(c1)S[13CH3] 62a_200025704644_100015184641 [0,0,0,1,0,0|2,1,0]=4 824 B13R1.666 CCCNCc1cccc(n1)OC 207a_100020643023_100000694346 [0,0,0,1,0,0|2,0,0]=3 825 B13R1.666 CCCNCc1cccc(n1)OC 2230a_100000746380_100000210303 [0,0,0,1,0,0|2,0,0]=3 826 B13R1.666 CCCNCc1cccc(n1)OC 270004a_100020643023_100000694346 [0,0,0,1,0,0|2,0,0]=3 827 B13R1.666 CCCNCc1ccnc(c1)OC 207a_100020643023_100000050969 [0,0,0,1,0,0|3,0,0]=4 828 B13R1.666 CCCNCc1ccnc(c1)OC 270004a_100020643023_100000050969 [0,0,0,1,0,0|3,0,0]=4 829 B13R1.666 CCCNCc1cncc(c1)OC 207a_100020643023_100011361638 [0,0,0,1,0,0|3,0,0]=4 830 B13R1.666 CCCNCc1cncc(c1)OC 2230a_100020589029_100000210303 [0,0,0,1,0,0|3,0,0]=4 831 B13R1.666 CCCNCc1cncc(c1)OC 270004a_100020643023_100011361638 [0,0,0,1,0,0|3,0,0]=4 832 B13R1.666 CCCNCc1cncc(c1)OC 34a_100020589029_100000210303 [0,0,0,1,0,0|3,0,0]=4 833 B13R1.666 CCCOCc1cc(ccn1)OC 34a_100000210258_100000752681 [0,0,0,1,0,0|3,0,0]=4 834 B13R1.666 CCCOCc1cc(ccn1)OC 34a_100000749536_100000210303 [0,0,0,1,0,0|3,0,0]=4 835 B13R1.666 CCCOCc1cccc(c1)OC 34a_100000198976_100000210303 [0,0,0,1,0,0|2,0,0]=3 836 B13R1.666 CCCOCc1cccc(c1)OC 34a_100000210258_100000688526 [0,0,0,1,0,0|2,0,0]=3 837 B13R1.666 CCCOCc1cccc(n1)OC 34a_100000210258_100000755263 [0,0,0,1,0,0|2,0,0]=3 838 B13R1.666 CCCOCc1ccnc(c1)OC 34a_100000210258_100103152439 [0,0,0,1,0,0|3,0,0]=4 839 B13R1.666 CCCOCc1cncc(c1)OC 34a_100000732071_100000210303 [0,0,0,1,0,0|3,0,0]=4 840 B13R1.666 CCCSCc1cc(ccn1)OC 62a_100000210303_100000752681 [0,0,0,1,0,0|3,0,0]=4 841 B13R1.666 CCCSCc1cc(ccn1)OC 62a_100000752681_100000210303 [0,0,0,1,0,0|3,0,0]=4 842 B13R1.666 CCCSCc1cccc(c1)OC 62a_100000210303_100000211672 [0,0,0,1,0,0|2,0,0]=3 843 B13R1.666 CCCSCc1cccc(c1)OC 62a_100000688526_100000210303 [0,0,0,1,0,0|2,0,0]=3 844 B13R1.666 CCCSCc1cccc(n1)OC 62a_100000210303_100000755263 [0,0,0,1,0,0|2,0,0]=3 845 B13R1.666 CCCSCc1cccc(n1)OC 62a_100000755263_100000210303 [0,0,0,1,0,0|2,0,0]=3 846 B13R1.666 CCCSCc1ccnc(c1)OC 62a_100000210303_100103152439 [0,0,0,1,0,0|3,0,0]=4 847 B13R1.666 CCCSCc1ccnc(c1)OC 62a_100103152439_100000210303 [0,0,0,1,0,0|3,0,0]=4 848 B13R1.666 CCNCCc1cccc(c1)OC 2230a_100000740386_100000210202 [0,0,0,1,0,0|2,0,0]=3 849 B13R1.666 CCNCCc1cccc(c1)OC 2230a_100015525214_100011713679 [0,0,0,1,0,0|2,0,0]=3 850 B13R1.666 CCNCCc1cccc(c1)OC 34a_100000740386_100000210202 [0,0,0,1,0,0|2,0,0]=3 851 B13R1.666 CCOCCc1cccc(c1)OC 34a_100011215300_100000210202 [0,0,0,1,0,0|2,0,0]=3 852 B13R1.666 CCOCCc1cccc(c1)OC 34a_100121572206_100011713679 [0,0,0,1,0,0|2,0,0]=3 853 B13R1.666 CCOCCc1cccc(c1)OC 7a_100011215300_100000210202 [0,0,0,1,0,0|2,0,0]=3 854 B13R1.666 CCOCSc1cccc(c1)OC 62a_100000739092_100000170001 [0,0,0,1,0,0|3,0,0]=4 855 B13R1.666 CCOCSc1cccc(n1)OC 62a_100000739092_100000760917 [0,0,0,1,0,0|3,0,0]=4 856 B13R1.666 CCOCSc1cccc(n1)OC 62a_100000760917_100000739092 [0,0,0,1,0,0|3,0,0]=4 857 B13R1.666 CCSCCc1cccc(c1)OC 62a_100000210202_100011713679 [0,0,0,1,0,0|2,0,0]=3 858 B13R1.666 CCSCCc1cccc(c1)OC 62a_100011713679_100000210202 [0,0,0,1,0,0|2,0,0]=3 859 B13R1.666 CNCCCc1cccc(c1)OC 2230a_100000750448_200000210301 [0,0,0,1,0,0|2,0,0]=3 860 B13R1.666 CNCCCc1cccc(c1)OC 34a_100000750448_200000210301 [0,0,0,1,0,0|2,0,0]=3 861 B13R1.666 CNCCOc1cccc(c1)OC 2230a_100000737234_200000210301 [0,0,0,1,0,0|3,0,0]=4 862 B13R1.666 CNCCOc1cccc(c1)OC 2230a_106832991635_100000691273 [0,0,0,1,0,0|3,0,0]=4 863 B13R1.666 CNCCOc1cccc(c1)OC 34a_100000737234_200000210301 [0,0,0,1,0,0|3,0,0]=4 864 B13R1.666 CNCCOc1cccc(c1)OC 34a_100102657272_100000691273 [0,0,0,1,0,0|3,0,0]=4 865 B13R1.666 CNCCOc1cccc(c1)OC 7a_106832991635_100000691273 [0,0,0,1,0,0|3,0,0]=4 866 B13R1.666 COCCCc1cccc(c1)OC 34a_100000760512_200000210301 [0,0,0,1,0,0|2,0,0]=3 867 B13R1.666 COCCCc1cccc(c1)OC 7a_100000760512_200000210301 [0,0,0,1,0,0|2,0,0]=3 868 B13R1.666 COCCNc1cccc(c1)OC 34a_100000210024_100011201679 [0,0,0,1,0,0|3,0,0]=4 869 B13R1.666 COCCOc1cccc(c1)OC 34a_100000211255_100011201679 [0,0,0,1,0,0|3,0,0]=4 870 B13R1.666 COCCOc1cccc(c1)OC 34a_100138415774_100000691273 [0,0,0,1,0,0|3,0,0]=4 871 B13R1.666 COCCOc1cccc(c1)OC 7a_100000211255_100000233755 [0,0,0,1,0,0|3,0,0]=4 872 B13R1.666 COCCSc1cccc(c1)OC 62a_100000233755_100000170001 [0,0,0,1,0,0|3,0,0]=4 873 B13R1.666 COCCSc1cccc(c1)OC 7a_200011235993_200000210301 [0,0,0,1,0,0|3,0,0]=4 874 B13R1.666 COCCSc1cccc(n1)OC 62a_100000233755_100000760917 [0,0,0,1,0,0|3,0,0]=4 875 B13R1.666 COCCSc1cccc(n1)OC 62a_100000760917_100000233755 [0,0,0,1,0,0|3,0,0]=4 876 B13R1.666 COCNCc1cccc(c1)OC 2230a_100000174954_100000766300 [0,0,0,1,0,0|3,0,0]=4 877 B13R1.666 COCNCc1cccc(n1)OC 2230a_100000746380_100000766300 [0,0,0,1,0,0|3,0,0]=4 878 B13R1.666 COCSCc1cccc(c1)OC 62a_100000688526_100000766300 [0,0,0,1,0,0|3,0,0]=4 879 B13R1.666 COCSCc1cccc(c1)OC 62a_100000766300_100000211672 [0,0,0,1,0,0|3,0,0]=4 880 B13R1.666 COCSCc1cccc(n1)OC 62a_100000755263_100000766300 [0,0,0,1,0,0|3,0,0]=4 881 B13R1.666 COCSCc1cccc(n1)OC 62a_100000766300_100000755263 [0,0,0,1,0,0|3,0,0]=4 882 B13R1.666 COc1cccc(c1)CCCN[13CH3] 2230a_100000750448_200025704644 [0,0,0,1,0,0|2,0,0]=3 883 B13R1.666 COc1cccc(c1)CCCN[13CH3] 34a_100000750448_200025704644 [0,0,0,1,0,0|2,0,0]=3 884 B13R1.666 COc1cccc(c1)CCCO[13CH3] 34a_100000760512_200025704644 [0,0,0,1,0,0|2,0,0]=3 885 B13R1.666 COc1cccc(c1)CCCO[13CH3] 7a_100000760512_200025704644 [0,0,0,1,0,0|2,0,0]=3 886 B13R1.666 COc1cccc(c1)CCNCF 34a_100000740386_100015361967 [0,0,0,1,0,0|3,0,0]=4 887 B13R1.666 COc1cccc(c1)CCOCF 34a_100011215300_100015361967 [0,0,0,1,0,0|3,0,0]=4 888 B13R1.666 COc1cccc(c1)CCOCF 7a_100011215300_100015361967 [0,0,0,1,0,0|3,0,0]=4 889 B13R1.666 COc1cccc(c1)CCSCF 62a_100011713679_100015361967 [0,0,0,1,0,0|3,0,0]=4 890 B13R1.666 COc1cccc(c1)CCSCF 62a_100015361967_100011713679 [0,0,0,1,0,0|3,0,0]=4 891 B13R1.666 COc1cccc(c1)CNCCF 2230a_100000174954_100011217306 [0,0,0,1,0,0|3,0,0]=4 892 B13R1.666 COc1cccc(c1)CNCCF 34a_100000174954_100011217306 [0,0,0,1,0,0|3,0,0]=4 893 B13R1.666 COc1cccc(c1)CNCCF 34a_100000724931_100000688526 [0,0,0,1,0,0|3,0,0]=4 894 B13R1.666 COc1cccc(c1)CNCCO 207a_100000210304_100000170238 [0,0,0,1,0,0|3,0,0]=4 895 B13R1.666 COc1cccc(c1)CNCCO 2230a_100000174954_100000211926 [0,0,0,1,0,0|3,0,0]=4 896 B13R1.666 COc1cccc(c1)CNCCO 2230a_100016997473_100000211672 [0,0,0,1,0,0|3,0,0]=4 897 B13R1.666 COc1cccc(c1)CNCCO 270004a_100000210304_100000170238 [0,0,0,1,0,0|3,0,0]=4 898 B13R1.666 COc1cccc(c1)CNCCO 34a_100000174954_100000211926 [0,0,0,1,0,0|3,0,0]=4 899 B13R1.666 COc1cccc(c1)CNCCO 34a_100016990907_100000688526 [0,0,0,1,0,0|3,0,0]=4 900 B13R1.666 COc1cccc(c1)CNCSC 2230a_100000174954_100011218213 [0,0,0,1,0,0|3,0,0]=4 901 B13R1.666 COc1cccc(c1)CNCSC 34a_100000174954_100011218213 [0,0,0,1,0,0|3,0,0]=4 902 B13R1.666 COc1cccc(c1)COCCBr 34a_100000211926_100000688526 [0,0,0,1,0,0|3,0,0]=4 903 B13R1.666 COc1cccc(c1)COCCF 34a_100000198976_100011217306 [0,0,0,1,0,0|3,0,0]=4 904 B13R1.666 COc1cccc(c1)COCCN 34a_100000210304_100000688526 [0,0,0,1,0,0|3,0,0]=4 905 B13R1.666 COc1cccc(c1)COCCO 34a_100000198976_100000211926 [0,0,0,1,0,0|3,0,0]=4 906 B13R1.666 COc1cccc(c1)COCSC 34a_100000198976_100011218213 [0,0,0,1,0,0|3,0,0]=4 907 B13R1.666 COc1cccc(c1)CSCCF 62a_100000688526_100011217306 [0,0,0,1,0,0|3,0,0]=4 908 B13R1.666 COc1cccc(c1)CSCCF 62a_100011217306_100000211672 [0,0,0,1,0,0|3,0,0]=4 909 B13R1.666 COc1cccc(c1)CSCCO 62a_100000211926_100000211672 [0,0,0,1,0,0|3,0,0]=4 910 B13R1.666 COc1cccc(c1)CSCCO 62a_100000688526_100000211926 [0,0,0,1,0,0|3,0,0]=4 911 B13R1.666 COc1cccc(c1)CSCSC 62a_100000688526_100011218213 [0,0,0,1,0,0|3,0,0]=4 912 B13R1.666 COc1cccc(c1)CSCSC 62a_100011218213_100000211672 [0,0,0,1,0,0|3,0,0]=4 913 B13R1.666 COc1cccc(c1)NCCCF 34a_100000210024_100011934791 [0,0,0,1,0,0|3,0,0]=4 914 B13R1.666 COc1cccc(c1)NCCCO 34a_100000210024_100000230001 [0,0,0,1,0,0|3,0,0]=4 915 B13R1.666 COc1cccc(c1)NCCSC 34a_100000210024_100000212216 [0,0,0,1,0,0|3,0,0]=4 916 B13R1.666 COc1cccc(c1)OCCCF 34a_100000211255_100011934791 [0,0,0,1,0,0|3,0,0]=4 917 B13R1.666 COc1cccc(c1)OCCCF 7a_100000211255_100011934791 [0,0,0,1,0,0|3,0,0]=4 918 B13R1.666 COc1cccc(c1)OCCCO 34a_100000211255_100000230001 [0,0,0,1,0,0|3,0,0]=4 919 B13R1.666 COc1cccc(c1)OCCCO 7a_100000211255_100011215043 [0,0,0,1,0,0|3,0,0]=4 920 B13R1.666 COc1cccc(c1)OCCN[13CH3] 2230a_100000737234_200025704644 [0,0,0,1,0,0|3,0,0]=4 921 B13R1.666 COc1cccc(c1)OCCN[13CH3] 34a_100000737234_200025704644 [0,0,0,1,0,0|3,0,0]=4 922 B13R1.666 COc1cccc(c1)OCCSC 34a_100000211255_100000212216 [0,0,0,1,0,0|3,0,0]=4 923 B13R1.666 COc1cccc(c1)OCCSC 62a_100000691273_200000210301 [0,0,0,1,0,0|3,0,0]=4 924 B13R1.666 COc1cccc(c1)OCCSC 62a_200000210301_100000691273 [0,0,0,1,0,0|3,0,0]=4 925 B13R1.666 COc1cccc(c1)OCCSC 7a_100000211255_100000212216 [0,0,0,1,0,0|3,0,0]=4 926 B13R1.666 COc1cccc(c1)OCCS[13CH3] 62a_100000691273_200025704644 [0,0,0,1,0,0|3,0,0]=4 927 B13R1.666 COc1cccc(c1)OCCS[13CH3] 62a_200025704644_100000691273 [0,0,0,1,0,0|3,0,0]=4 928 B13R1.666 COc1cccc(c1)SCCCF 62a_100011934791_100000170001 [0,0,0,1,0,0|3,0,0]=4 929 B13R1.666 COc1cccc(c1)SCCCO 62a_100011215043_100000170001 [0,0,0,1,0,0|3,0,0]=4 930 B13R1.666 COc1cccc(c1)SCCO[13CH3] 7a_200011235993_200025704644 [0,0,0,1,0,0|3,0,0]=4 931 B13R1.666 COc1cccc(c1)SCCSC 62a_100000212216_100000170001 [0,0,0,1,0,0|3,0,0]=4 932 B13R1.666 COc1cccc(n1)CNCCF 2230a_100000746380_100011217306 [0,0,0,1,0,0|3,0,0]=4 933 B13R1.666 COc1cccc(n1)CNCCF 34a_100000724931_100000755263 [0,0,0,1,0,0|3,0,0]=4 934 B13R1.666 COc1cccc(n1)CNCCO 207a_100000210304_100000694346 [0,0,0,1,0,0|3,0,0]=4 935 B13R1.666 COc1cccc(n1)CNCCO 2230a_100000746380_100000211926 [0,0,0,1,0,0|3,0,0]=4 936 B13R1.666 COc1cccc(n1)CNCCO 2230a_100016997473_100000755263 [0,0,0,1,0,0|3,0,0]=4 937 B13R1.666 COc1cccc(n1)CNCCO 270004a_100000210304_100000694346 [0,0,0,1,0,0|3,0,0]=4 938 B13R1.666 COc1cccc(n1)CNCCO 34a_100016990907_100000755263 [0,0,0,1,0,0|3,0,0]=4 939 B13R1.666 COc1cccc(n1)CNCSC 2230a_100000746380_100011218213 [0,0,0,1,0,0|3,0,0]=4 940 B13R1.666 COc1cccc(n1)COCCBr 34a_100000211926_100000755263 [0,0,0,1,0,0|3,0,0]=4 941 B13R1.666 COc1cccc(n1)COCCN 34a_100000210304_100000755263 [0,0,0,1,0,0|3,0,0]=4 942 B13R1.666 COc1cccc(n1)CSCCF 62a_100000755263_100011217306 [0,0,0,1,0,0|3,0,0]=4 943 B13R1.666 COc1cccc(n1)CSCCF 62a_100011217306_100000755263 [0,0,0,1,0,0|3,0,0]=4 944 B13R1.666 COc1cccc(n1)CSCCO 62a_100000211926_100000755263 [0,0,0,1,0,0|3,0,0]=4 945 B13R1.666 COc1cccc(n1)CSCCO 62a_100000755263_100000211926 [0,0,0,1,0,0|3,0,0]=4 946 B13R1.666 COc1cccc(n1)CSCSC 62a_100000755263_100011218213 [0,0,0,1,0,0|3,0,0]=4 947 B13R1.666 COc1cccc(n1)CSCSC 62a_100011218213_100000755263 [0,0,0,1,0,0|3,0,0]=4 948 B13R1.666 COc1cccc(n1)SCCCF 62a_100000760917_100011934791 [0,0,0,1,0,0|3,0,0]=4 949 B13R1.666 COc1cccc(n1)SCCCF 62a_100011934791_100000760917 [0,0,0,1,0,0|3,0,0]=4 950 B13R1.666 COc1cccc(n1)SCCCO 62a_100000760917_100011215043 [0,0,0,1,0,0|3,0,0]=4 951 B13R1.666 COc1cccc(n1)SCCCO 62a_100011215043_100000760917 [0,0,0,1,0,0|3,0,0]=4 952 B13R1.666 COc1cccc(n1)SCCSC 62a_100000212216_100000760917 [0,0,0,1,0,0|3,0,0]=4 953 B13R1.666 COc1cccc(n1)SCCSC 62a_100000760917_100000751147 [0,0,0,1,0,0|3,0,0]=4 954 B13R1.718 CCC(=O)C=CCN1CCCCC1 1458a_100015232380_100000210202 [0,0,0,1,0,0|2,0,1]=4 955 B13R1.718 CNC(=O)C=CCN1CCCCC1 11a_106832991635_100015232380 [0,0,0,1,0,0|2,0,1]=4 956 B13R1.718 CNC(=O)C=CCN1CCCCC1 240690a_100102657272_100015232380 [0,0,0,1,0,0|2,0,1]=4 957 B13R1.718 COC(=O)/C=C/CN1CCCOC1 2230a_100000131196_100000742655 [0,0,0,1,0,0|2,0,1]=4 958 B13R1.718 COC(=O)/C=C/CN1CCCOC1 269982a_100000131196_100000742655 [0,0,0,1,0,0|2,0,1]=4 959 B13R1.718 COC(=O)/C=C/CN1CCCOC1 34a_100000131196_100000742655 [0,0,0,1,0,0|2,0,1]=4 960 B13R1.718 COC(=O)/C=C/CN1CCOCC1 2230a_100015191051_100000742655 [0,0,0,1,0,0|2,0,1]=4 961 B13R1.718 COC(=O)/C=C/CN1CCOCC1 269982a_100015191051_100000742655 [0,0,0,1,0,0|2,0,1]=4 962 B13R1.718 COC(=O)/C=C/CN1CCOCC1 34a_100015191051_100000742655 [0,0,0,1,0,0|2,0,1]=4 963 B13R1.718 COC(=O)/C=C/CN1CCSCC1 2230a_100000737611_100000742655 [0,0,0,1,0,0|2,0,1]=4 964 B13R1.718 COC(=O)/C=C/CN1CCSCC1 269982a_100000737611_100000742655 [0,0,0,1,0,0|2,0,1]=4 965 B13R1.718 COC(=O)C=NNC1CCCCC1 4a_100000709804_200011823558 [0,0,0,1,0,0|2,0,1]=4 966 B10R0.71 C/C=C/C=C/COCCCC 34a_100016283227_100000210210 [2,0,0,0,0,0|1,0,1]=4 967 B10R0.71 CC=CC=CC=NNCCC 4a_100000740057_100000691131 [2,0,0,0,0,0|2,0,0]=4 968 B10R0.71 CCCCC/C=C\CCOC 34a_100016277358_200000210301 [2,0,0,0,0,0|0,0,2]=4 969 B10R0.71 CCCCC/C=C\CCOC 7a_100016277358_200000210301 [2,0,0,0,0,0|0,0,2]=4 970 B10R0.71 CCCCC/C=C\CCO[13CH3] 34a_100016277358_200025704644 [2,0,0,0,0,0|0,0,2]=4 971 B10R0.71 CCCCC/C=C\CCO[13CH3] 7a_100016277358_200025704644 [2,0,0,0,0,0|0,0,2]=4 972 B10R0.71 CCCCCC/C=C/COC 34a_200016276170_200000210301 [2,0,0,0,0,0|0,0,2]=4 973 B10R0.71 CCCCCC/C=C/COC 7a_200016276170_200000210301 [2,0,0,0,0,0|0,0,2]=4 974 B10R0.71 CCCCCC/C=C/CO[13CH3] 34a_200016276170_200025704644 [2,0,0,0,0,0|0,0,2]=4 975 B10R0.71 CCCCCC/C=C/CO[13CH3] 7a_200016276170_200025704644 [2,0,0,0,0,0|0,0,2]=4 976 B10R0.4 CCCCC/C=C/CC(=O)C 1458a_100020675968_200000210301 [2,0,0,0,0,0|0,0,1]=3 977 B10R0.4 CCCCC/C=C/CC(=O)[13CH3] 1458a_100020675968_200025704644 [2,0,0,0,0,0|0,0,1]=3 978 B10R0.4 CCCCCC=NNC(=O)C 4a_100000189765_100000737632 [2,0,0,0,0,0|2,0,0]=4 979 B10R0.4 CCCCCCC=CC(=O)C 1458a_200015324643_200000210301 [2,0,0,0,0,0|0,0,1]=3 980 B10R0.4 CCCCCCC=CC(=O)[13CH3] 1458a_200015324643_200025704644 [2,0,0,0,0,0|0,0,1]=3 981 B10R0.74 CCC/C=C/C=CC(=O)CC 1458a_200016258893_100000210202 [2,0,0,0,0,0|1,0,0]=3 982 B10R0.74 CCC/C=C/C=CC(=O)CF 1458a_200016258893_100015361967 [2,0,0,0,0,0|2,0,0]=4 983 B10R0.74 CCC/C=C/C=CC(=O)NC 11a_106832991635_200016258893 [2,0,0,0,0,0|1,0,0]=3 984 B10R0.74 CCC/C=C/C=CC(=O)NC 1626a_100102657272_200016258893 [2,0,0,0,0,0|1,0,0]=3 985 B10R0.74 CCC/C=C/C=CC(=O)NC 240690a_100102657272_200016258893 [2,0,0,0,0,0|1,0,0]=3 986 B10R0.74 CCCC/C=C/CC(=O)CC 1458a_200016282684_100000210202 [2,0,0,0,0,0|1,0,1]=4 987 B10R0.74 CCCC/C=C/CC(=O)NC 11a_106832991635_200016282684 [2,0,0,0,0,0|1,0,1]=4 988 B10R0.74 CCCC/C=C/CC(=O)NC 1626a_100102657272_200016282684 [2,0,0,0,0,0|1,0,1]=4 989 B10R0.74 CCCC/C=C/CC(=O)NC 240690a_100102657272_200016282684 [2,0,0,0,0,0|1,0,1]=4 990 B10R0.74 CCCC/C=C/CC(=O)NC 527a_100102657272_200016282684 [2,0,0,0,0,0|1,0,1]=4 991 B10R0.74 CCCCCC=CC(=O)CC 1458a_100016263427_100000210202 [2,0,0,0,0,0|1,0,0]=3 992 B10R0.74 CCCCCC=CC(=O)CF 1458a_100016263427_100015361967 [2,0,0,0,0,0|2,0,0]=4 993 B10R0.74 CCCCCC=CC(=O)NC 11a_106832991635_100016263427 [2,0,0,0,0,0|1,0,0]=3 994 B10R0.74 CCCCCC=CC(=O)NC 1626a_100102657272_100016263427 [2,0,0,0,0,0|1,0,0]=3 995 B10R0.74 CCCCCC=CC(=O)NC 240690a_100102657272_100016263427 [2,0,0,0,0,0|1,0,0]=3 996 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [2,0,0,0,0,0|1,0,1]=4 997 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [2,0,0,0,0,0|1,0,1]=4 998 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [2,0,0,0,0,0|1,0,1]=4 999 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [2,0,0,0,0,0|1,0,1]=4 1000 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [2,0,0,0,0,0|1,0,1]=4 1001 B10R0.74 CCCCNN=CC(=O)OC 4a_100025702795_200011823558 [2,0,0,0,0,0|2,0,0]=4 1002 B10R0.74 CCCOC/C=C/C(=O)OC 34a_100000210258_100000742655 [2,0,0,0,0,0|1,0,0]=3 1003 B10R0.74 CCCSC/C=C/C(=O)OC 62a_100000210303_100000742655 [2,0,0,0,0,0|1,0,0]=3 1004 B10R0.74 CCCSC/C=C/C(=O)OC 62a_100000742655_100000210303 [2,0,0,0,0,0|1,0,0]=3 1005 B10R0.74 CCNN=CC=CC(=O)OC 4a_100000756455_100016254430 [2,0,0,0,0,0|2,0,0]=4 1006 B10R0.74 COC(=O)/C=C/CNCCF 34a_100000724931_100000742655 [2,0,0,0,0,0|2,0,0]=4 1007 B10R0.74 COC(=O)/C=C/CNCCO 2230a_100016997473_100000742655 [2,0,0,0,0,0|2,0,0]=4 1008 B10R0.74 COC(=O)/C=C/CNCCO 34a_100016990907_100000742655 [2,0,0,0,0,0|2,0,0]=4 1009 B10R0.74 COC(=O)/C=C/COCCBr 34a_100000211926_100000742655 [2,0,0,0,0,0|2,0,0]=4 1010 B10R0.74 COC(=O)/C=C/COCCN 34a_100000210304_100000742655 [2,0,0,0,0,0|2,0,0]=4 1011 B10R0.74 COC(=O)/C=C/CSCCF 62a_100000742655_100011217306 [2,0,0,0,0,0|2,0,0]=4 1012 B10R0.74 COC(=O)/C=C/CSCCF 62a_100011217306_100000742655 [2,0,0,0,0,0|2,0,0]=4 1013 B10R0.74 COC(=O)/C=C/CSCCO 62a_100000211926_100000742655 [2,0,0,0,0,0|2,0,0]=4 1014 B10R0.74 COC(=O)/C=C/CSCCO 62a_100000742655_100000211926 [2,0,0,0,0,0|2,0,0]=4 1015 B10R0.74 COC(=O)/C=C/CSCSC 62a_100000742655_100011218213 [2,0,0,0,0,0|2,0,0]=4 1016 B10R0.74 COC(=O)/C=C/CSCSC 62a_100011218213_100000742655 [2,0,0,0,0,0|2,0,0]=4 1017 B10R0.74 COCSC/C=C/C(=O)OC 62a_100000742655_100000766300 [2,0,0,0,0,0|2,0,0]=4 1018 B10R0.74 COCSC/C=C/C(=O)OC 62a_100000766300_100000742655 [2,0,0,0,0,0|2,0,0]=4 1019 B12R0.5 CC/C=C/C/C=C/CCOCCC 34a_200016273837_100000210303 [1,1,0,0,0,0|1,0,1]=4 1020 B12R0.5 CC/C=C/C/C=C/CCOCCC 7a_200016273837_100000210303 [1,1,0,0,0,0|1,0,1]=4 1021 B12R0.5 CC=CC=CC=NNCCCCC 4a_100000694160_100000691131 [1,1,0,0,0,0|2,0,0]=4 1022 B12R0.5 CCC/C=C/C=C/COCCCC 34a_100016294078_100000210210 [1,1,0,0,0,0|1,0,1]=4 1023 B12R0.5 CCC=CC=CC=NNCCCC 4a_100025702795_100103038579 [1,1,0,0,0,0|2,0,0]=4 1024 B12R0.5 CCCCC/C=C/C=C/COCC 34a_200014065772_100000210202 [1,1,0,0,0,0|0,0,1]=3 1025 B12R0.5 CCCCC/C=C/C=C/COCC 7a_200014065772_100000210202 [1,1,0,0,0,0|0,0,1]=3 1026 B12R0.5 CCCCC/C=C/C=C/COCF 34a_200014065772_100015361967 [1,1,0,0,0,0|0,0,1]=3 1027 B12R0.5 CCCCC/C=C/C=C/COCF 7a_200014065772_100015361967 [1,1,0,0,0,0|0,0,1]=3 1028 B12R0.5 CCCCCC/C=C/C=C/COC 34a_200028454808_200000210301 [1,1,0,0,0,0|0,0,1]=3 1029 B12R0.5 CCCCCC/C=C/C=C/COC 7a_200028454808_200000210301 [1,1,0,0,0,0|0,0,1]=3 1030 B12R0.5 CCCCCC/C=C/C=C/CO[13CH3] 34a_200028454808_200025704644 [1,1,0,0,0,0|0,0,1]=3 1031 B12R0.5 CCCCCC/C=C/C=C/CO[13CH3] 7a_200028454808_200025704644 [1,1,0,0,0,0|0,0,1]=3 1032 B12R0.47 C/C=C/C=CC(=O)CCCCCC 1458a_100000185730_100000210757 [1,1,0,0,0,0|1,0,1]=4 1033 B12R0.47 C/C=C/C=CC(=O)NCCCCC 11a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1034 B12R0.47 C/C=C/C=CC(=O)NCCCCC 1626a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1035 B12R0.47 C/C=C/C=CC(=O)NCCCCC 240690a_100000209983_100000185730 [1,1,0,0,0,0|2,0,0]=4 1036 B12R0.47 CCCCCCC(=O)C=CCOC 1458a_100016285016_100000210757 [1,1,0,0,0,0|0,0,2]=4 1037 B12R0.47 CCCCCNC(=O)C=CCOC 11a_100000209983_100016285016 [1,1,0,0,0,0|1,0,1]=4 1038 B12R0.47 CCCCCNC(=O)C=CCOC 1626a_100000209983_100016285016 [1,1,0,0,0,0|1,0,1]=4 1039 B12R0.47 CCCCCNC(=O)C=CCOC 240690a_100000209983_100016285016 [1,1,0,0,0,0|1,0,1]=4 1040 B12R0.206 C/C=C/CC(=O)C=CCCCCC 1458a_100016263427_100102629194 [1,1,0,0,0,0|1,0,1]=4 1041 B12R0.206 CC=CCC(=O)C=CCCCCC 1458a_100016263427_100000070051 [1,1,0,0,0,0|1,0,1]=4 1042 B12R0.206 CCCCCC=CC(=O)CCOC 1458a_100016263427_100000233755 [1,1,0,0,0,0|0,0,2]=4 1043 B12R0.206 CCCCCCCC(=O)C=COC 1458a_100016268678_100000210614 [1,1,0,0,0,0|0,0,2]=4 1044 B12R0.206 CCCCCCNC(=O)C=COC 1626a_100000210581_100016268678 [1,1,0,0,0,0|1,0,1]=4 1045 B12R0.206 CCCCCCNC(=O)C=COC 240690a_100000210581_100016268678 [1,1,0,0,0,0|1,0,1]=4 1046 B12R0.206 CCCCCNN=C(C)C=COC 4a_100000694160_100102564965 [1,1,0,0,0,0|2,0,0]=4 1047 B12R0.206 CCCCCNNC(=O)C=COC 22a_100000694160_100016268678 [1,1,0,0,0,0|2,0,0]=4 1048 B12R0.49 C=C(COCCCCC)C(=O)OC 34a_100000210253_100009813391 [1,1,0,0,0,0|1,0,1]=4 1049 B12R0.49 C=C(CSCCCCC)C(=O)OC 62a_100000210326_100009813391 [1,1,0,0,0,0|1,0,1]=4 1050 B12R0.49 C=C(CSCCCCC)C(=O)OC 62a_100009813391_100000210326 [1,1,0,0,0,0|1,0,1]=4 1051 B12R0.49 CCCCCCNC(=O)C(=O)OC 11a_100000210581_100000024059 [1,1,0,0,0,0|1,0,1]=4 1052 B12R0.49 CCCCCCNC(=O)C(=O)OC 1626a_100000210581_100000024059 [1,1,0,0,0,0|1,0,1]=4 1053 B12R0.49 CCCCCCNC(=O)C(=O)OC 240690a_100000210581_100000024059 [1,1,0,0,0,0|1,0,1]=4 1054 B12R0.49 CCCCCCNC(=O)C(=O)OC 527a_100000210581_100000024059 [1,1,0,0,0,0|1,0,1]=4 1055 B12R0.49 CCCCCNN=C(C)C(=O)OC 4a_100000694160_100000211753 [1,1,0,0,0,0|2,0,0]=4 1056 B12R0.49 CCCCCOCC(=O)C(=O)OC 34a_100000210253_100011610305 [1,1,0,0,0,0|1,0,1]=4 1057 B12R0.49 CCCCCSCC(=O)C(=O)OC 62a_100000210326_100011610305 [1,1,0,0,0,0|1,0,1]=4 1058 B12R0.49 CCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210326 [1,1,0,0,0,0|1,0,1]=4 1059 B12R0.102 CCCCC(=O)NN=CC(=O)OC 4a_100000189769_200011823558 [1,1,0,0,0,0|2,0,0]=4 1060 B12R0.102 CCCCN(C)C/C=C/C(=O)OC 2230a_100000207549_100000742655 [1,1,0,0,0,0|1,0,1]=4 1061 B12R0.102 CCCCN(C)C/C=C/C(=O)OC 269982a_100000207549_100000742655 [1,1,0,0,0,0|1,0,1]=4 1062 B12R0.113 CCCCC=CC(=O)CC(=O)CC 1458a_100016266645_100000747405 [1,1,0,0,0,0|1,0,1]=4 1063 B12R0.113 CCCCC=CC(=O)CC(=O)NC 1458a_100016266645_100000183359 [1,1,0,0,0,0|1,0,1]=4 1064 B12R0.113 CCCCC=CC(=O)CC(=O)OC 1458a_100016266645_100000747449 [1,1,0,0,0,0|0,0,1]=3 1065 B12R0.113 CCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210757 [1,1,0,0,0,0|0,0,2]=4 1066 B12R0.113 CCCCCCC(=O)CC(=O)OC 1458a_100102632555_100000747449 [1,1,0,0,0,0|0,0,2]=4 1067 B12R0.113 CCCCCNC(=O)CC(=O)OC 240690a_100000209983_100000211351 [1,1,0,0,0,0|1,0,1]=4 1068 B12R0.142 CC=C(C)C=CC(=O)CCCCC 1458a_100000692105_100000210326 [1,1,0,0,0,0|2,0,0]=4 1069 B12R0.142 CCCCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210326 [1,1,0,0,0,0|1,0,0]=3 1070 B12R0.142 CCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210326 [1,1,0,0,0,0|0,0,2]=4 1071 B12R0.142 CCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210326 [1,1,0,0,0,0|1,0,1]=4 1072 B12R0.142 CCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000212188 [1,1,0,0,0,0|1,0,1]=4 1073 B12R0.142 CCCCNC(=O)C=CC(=O)NC 1626a_100000102301_100016259477 [1,1,0,0,0,0|2,0,0]=4 1074 B12R0.142 CCCCNC(=O)C=CC(=O)OC 1626a_100000102301_100016283253 [1,1,0,0,0,0|1,0,0]=3 1075 B12R0.142 CCCCOC(=O)C=CC(=O)NC 1626a_100102657272_100015195251 [1,1,0,0,0,0|2,0,0]=4 1076 B12R0.142 CCCCOC(=O)C=CC(=O)NC 240690a_100102657272_100015195251 [1,1,0,0,0,0|2,0,0]=4 1077 B12R0.142 CCCNN=C(C)C=CC(=O)OC 4a_100000740057_100016258046 [1,1,0,0,0,0|2,0,0]=4 1078 B12R0.142 CCCNNC(=O)C=CC(=O)OC 22a_100000740057_100016283253 [1,1,0,0,0,0|2,0,0]=4 1079 B12R0.142 CCOCCC(=O)C=CC(=O)NC 1458a_100016259477_100011215890 [1,1,0,0,0,0|2,0,0]=4 1080 B12R0.142 CCSCCC(=O)C=CC(=O)NC 1458a_100016259477_100000757381 [1,1,0,0,0,0|2,0,0]=4 1081 B12R0.142 CNC(=O)C=CC(=O)CCCCF 1458a_100016259477_100000729493 [1,1,0,0,0,0|2,0,0]=4 1082 B12R0.142 CNC(=O)C=CC(=O)CCCCO 1458a_100016259477_100000210776 [1,1,0,0,0,0|2,0,0]=4 1083 B12R0.142 CNC(=O)C=CC(=O)CCCOC 1458a_100016259477_100000740836 [1,1,0,0,0,0|2,0,0]=4 1084 B12R0.142 COC(=O)C=CC(=O)NCCCF 1626a_100015189416_100016283253 [1,1,0,0,0,0|2,0,0]=4 1085 B12R0.142 COC(=O)C=CC(=O)NCCSC 1626a_100020590264_100016283253 [1,1,0,0,0,0|2,0,0]=4 1086 B12R0.142 COCCNC(=O)C=CC(=O)OC 1626a_100000209980_100016283253 [1,1,0,0,0,0|2,0,0]=4 1087 B12R0.183 CCC(C)CNC/C=C/C(=O)OC 2230a_100020588543_100000742655 [1,1,0,0,0,0|1,0,1]=4 1088 B12R0.183 CCC(C)CSC/C=C/C(=O)OC 62a_100000742655_100000748023 [1,1,0,0,0,0|1,0,1]=4 1089 B12R0.183 CCC(C)CSC/C=C/C(=O)OC 62a_100000748023_100000742655 [1,1,0,0,0,0|1,0,1]=4 1090 B12R0.183 CCC(C)NN=CC=CC(=O)OC 4a_100000718999_100016254430 [1,1,0,0,0,0|2,0,0]=4 1091 B12R0.183 CCC(O)CNC/C=C/C(=O)OC 2230a_100011218483_100000742655 [1,1,0,0,0,0|1,0,1]=4 1092 B12R0.183 CCC(O)CSC/C=C/C(=O)OC 62a_100000742655_100011218378 [1,1,0,0,0,0|1,0,1]=4 1093 B12R0.183 CCC(O)CSC/C=C/C(=O)OC 62a_100011218378_100000742655 [1,1,0,0,0,0|1,0,1]=4 1094 B12R0.183 CC[C@H](C)COC/C=C/C(=O)OC 7a_100009816381_100000742655 [1,1,0,0,0,0|1,0,1]=4 1095 B12R0.183 CC[C@H](C)CSC/C=C/C(=O)OC 62a_100000742655_100009816398 [1,1,0,0,0,0|1,0,1]=4 1096 B12R0.183 CC[C@H](C)CSC/C=C/C(=O)OC 62a_100009816398_100000742655 [1,1,0,0,0,0|1,0,1]=4 1097 B12R0.184 COC(=O)/C=C/CNCCC(C)O 2230a_200000755665_100000742655 [1,1,0,0,0,0|1,0,1]=4 1098 B12R0.184 COC(=O)/C=C/COCCC(C)Br 34a_100009893172_100000742655 [1,1,0,0,0,0|1,0,1]=4 1099 B12R0.184 COC(=O)/C=C/COCCC(C)C 34a_100000210254_100000742655 [1,1,0,0,0,0|1,0,1]=4 1100 B12R0.184 COC(=O)/C=C/COCCC(C)C 7a_100000210254_100000742655 [1,1,0,0,0,0|1,0,1]=4 1101 B12R0.184 COC(=O)/C=C/COCC[C@@H](C)N 34a_100000706166_100000742655 [1,1,0,0,0,0|1,0,1]=4 1102 B12R0.184 COC(=O)/C=C/CSCCC(C)C 62a_100000210312_100000742655 [1,1,0,0,0,0|1,0,1]=4 1103 B12R0.184 COC(=O)/C=C/CSCCC(C)C 62a_100000742655_100000210312 [1,1,0,0,0,0|1,0,1]=4 1104 B12R0.184 COC(=O)/C=C/CSCCC(C)O 62a_100000742655_100012276601 [1,1,0,0,0,0|1,0,1]=4 1105 B12R0.184 COC(=O)/C=C/CSCCC(C)O 62a_100012276601_100000742655 [1,1,0,0,0,0|1,0,1]=4 1106 B12R0.184 COC(=O)C=CC=NNCC(C)O 4a_200000730056_100016254430 [1,1,0,0,0,0|2,0,0]=4 1107 B12R0.251 CCCCC/C=C/CC(=O)C(C)C 1458a_100020675968_100000210206 [1,1,0,0,0,0|1,0,1]=4 1108 B12R0.251 CCCCC/C=C/CC(=O)N(C)C 11a_100102631434_100020675968 [1,1,0,0,0,0|1,0,1]=4 1109 B12R0.251 CCCCC/C=C/CC(=O)N(C)C 1626a_100102631434_100020675968 [1,1,0,0,0,0|1,0,1]=4 1110 B12R0.251 CCCCC/C=C/CC(=O)N(C)C 240690a_100102631434_100020675968 [1,1,0,0,0,0|1,0,1]=4 1111 B12R0.251 CCCCCCC=CC(=O)C(C)C 1458a_200015324643_100000210206 [1,1,0,0,0,0|1,0,1]=4 1112 B12R0.251 CCCCCCC=CC(=O)N(C)C 11a_100102631434_200015324643 [1,1,0,0,0,0|1,0,1]=4 1113 B12R0.251 CCCCCCC=CC(=O)N(C)C 1626a_100102631434_200015324643 [1,1,0,0,0,0|1,0,1]=4 1114 B12R0.251 CCCCCCC=CC(=O)N(C)C 240690a_100102631434_200015324643 [1,1,0,0,0,0|1,0,1]=4 1115 B12R0.276 CCCC(C)NC/C=C/C(=O)OC 2230a_100000741246_100000742655 [1,1,0,0,0,0|1,0,1]=4 1116 B12R0.276 CCCC(C)OC/C=C/C(=O)OC 34a_100000764384_100000742655 [1,1,0,0,0,0|1,0,1]=4 1117 B12R0.276 CCCC(C)OC/C=C/C(=O)OC 7a_100000764384_100000742655 [1,1,0,0,0,0|1,0,1]=4 1118 B12R0.276 CCCC(C)SC/C=C/C(=O)OC 62a_100000742655_100000766640 [1,1,0,0,0,0|1,0,1]=4 1119 B12R0.276 CCCC(C)SC/C=C/C(=O)OC 62a_100000766640_100000742655 [1,1,0,0,0,0|1,0,1]=4 1120 B12R0.4 C=C(C)CC(=O)C=CCCCCC 1458a_100016263427_100000748629 [1,1,0,0,0,0|1,0,1]=4 1121 B12R0.4 CCCCCC=CC(=O)CC(=O)N 1458a_100016263427_100000187820 [1,1,0,0,0,0|1,0,1]=4 1122 B12R0.4 CCCCCC=CC(=O)CC(=O)[O-] 1458a_100016263427_100020667443 [1,1,0,0,0,0|0,0,2]=4 1123 B14R0.1 CCCC(C)COC/C=C/C(=O)OCC 34a_100000688023_100016267167 [0,2,0,0,0,0|1,0,1]=4 1124 B14R0.1 CCCC(C)COC/C=C/C(=O)OCC 7a_100000688023_100016267167 [0,2,0,0,0,0|1,0,1]=4 1125 B14R0.1 CCCC(C)CSC/C=C/C(=O)OCC 62a_100011216630_100016267167 [0,2,0,0,0,0|1,0,1]=4 1126 B14R0.1 CCCC(C)CSC/C=C/C(=O)OCC 62a_100016267167_100011216630 [0,2,0,0,0,0|1,0,1]=4 1127 B14R0.1 CCC[C@H](N)COC/C=C/C(=O)OCC 34a_100000732646_100016267167 [0,2,0,0,0,0|1,0,1]=4 1128 B14R0.32 CCCC(C)CCOC/C=C/C(=O)OC 34a_100011217855_100000742655 [0,2,0,0,0,0|0,0,2]=4 1129 B14R0.32 CCCC(C)CCOC/C=C/C(=O)OC 7a_100011217855_100000742655 [0,2,0,0,0,0|0,0,2]=4 1130 B14R0.32 CCC[C@H](N)CCOC/C=C/C(=O)OC 34a_100015193777_100000742655 [0,2,0,0,0,0|0,0,2]=4 1131 B14R0.32 CCOC(=O)/C=C/CNCCC(C)CC 2230a_100020591266_100016267167 [0,2,0,0,0,0|1,0,1]=4 1132 B14R0.32 CCOC(=O)/C=C/COCCC(C)CC 7a_100011215188_100016267167 [0,2,0,0,0,0|1,0,1]=4 1133 B14R0.32 CCOC(=O)C=CC=NNCC(O)CC 4a_100015206393_100016289910 [0,2,0,0,0,0|2,0,0]=4 1134 B14R0.32 COC(=O)C=CC=NNCC(O)CSC 4a_200000122717_100016254430 [0,2,0,0,0,0|2,0,0]=4 1135 B14R0.73 C=COC(=O)CC(=O)C=CCCCCC 1458a_100016263427_100000036128 [0,2,0,0,0,0|0,0,2]=4 1136 B14R0.73 CCCCCC=CC(=O)CC(=O)CCC 1458a_100016263427_100000747444 [0,2,0,0,0,0|1,0,1]=4 1137 B14R0.73 CCCCCC=CC(=O)CC(=O)NCC 1458a_100016263427_100000183381 [0,2,0,0,0,0|1,0,1]=4 1138 B14R0.73 CCCCCC=CC(=O)CC(=O)NCO 1458a_100016263427_100000185155 [0,2,0,0,0,0|1,0,1]=4 1139 B14R0.73 CCCCCC=CC(=O)CC(=O)OCC 1458a_100016263427_100000188475 [0,2,0,0,0,0|0,0,1]=3 1140 B14R0.73 CCCCCNCC(=CC(=O)OCC)C 2230a_100000209983_100135422193 [0,2,0,0,0,0|1,0,1]=4 1141 B14R0.73 CCCCCOCC(=CC(=O)OCC)C 34a_100000210253_100135422193 [0,2,0,0,0,0|1,0,1]=4 1142 B14R0.73 CCCCCOCC(=CC(=O)OCC)C 7a_100000210253_100135422193 [0,2,0,0,0,0|1,0,1]=4 1143 B14R0.73 CCCCCSCC(=CC(=O)OCC)C 62a_100000210326_100135422193 [0,2,0,0,0,0|1,0,1]=4 1144 B14R0.73 CCCCCSCC(=CC(=O)OCC)C 62a_100135422193_100000210326 [0,2,0,0,0,0|1,0,1]=4 1145 B14R0.73 CCCCNN=C/C(=C/C(=O)OCC)/C 4a_100025702795_200016988100 [0,2,0,0,0,0|2,0,0]=4 1146 B14R0.163 CCCCC(C)NC/C=C/C(=O)OCC 2230a_100000126638_100016267167 [0,2,0,0,0,0|1,0,1]=4 1147 B14R0.163 CCCCC(C)OC/C=C/C(=O)OCC 34a_100000687866_100016267167 [0,2,0,0,0,0|1,0,1]=4 1148 B14R0.163 CCCCC(C)OC/C=C/C(=O)OCC 7a_100000687866_100016267167 [0,2,0,0,0,0|1,0,1]=4 1149 B14R0.163 CCCCC(C)SC/C=C/C(=O)OCC 62a_100016267167_200011215066 [0,2,0,0,0,0|1,0,1]=4 1150 B14R0.163 CCCCC(C)SC/C=C/C(=O)OCC 62a_200011215066_100016267167 [0,2,0,0,0,0|1,0,1]=4 1151 B14R0.181 CCCCC/C=C/COC(C)C(=O)OC 34a_100016258190_100000211248 [0,2,0,0,0,0|0,0,2]=4 1152 B14R0.181 CCCCC/C=C/COC(C)C(=O)OC 7a_100016258190_100000211248 [0,2,0,0,0,0|0,0,2]=4 1153 B14R0.199 CCCCCCC(=O)C=CC(=O)OCC 1458a_100000210415_100000210757 [0,2,0,0,0,0|0,0,1]=3 1154 B14R0.199 CCCCCNC(=O)C=CC(=O)OCC 1626a_100000209983_100000210415 [0,2,0,0,0,0|1,0,0]=3 1155 B14R0.199 CCCCCNC(=O)C=CC(=O)OCC 240690a_100000209983_100000210415 [0,2,0,0,0,0|1,0,0]=3 1156 B14R0.199 CCCCNN=C(C)C=CC(=O)OCC 4a_100025702795_200016282221 [0,2,0,0,0,0|2,0,0]=4 1157 B14R0.199 CCCCOCC(=O)C=CC(=O)OCC 1458a_100000210415_100011995733 [0,2,0,0,0,0|1,0,1]=4 1158 B14R0.199 CCCOCCC(=O)C=CC(=O)OCC 1458a_100000210415_100011215938 [0,2,0,0,0,0|1,0,1]=4 1159 B14R0.199 CCOC(=O)C=CC(=O)CCCCCF 1458a_100000210415_100000729378 [0,2,0,0,0,0|1,0,1]=4 1160 B14R0.199 CCOC(=O)C=CC(=O)CCCCCO 1458a_100000210415_100000746330 [0,2,0,0,0,0|1,0,1]=4 1161 B14R0.199 CCOC(=O)C=CC(=O)CCCCOC 1458a_100000210415_100000755781 [0,2,0,0,0,0|1,0,1]=4 1162 B14R0.199 CCOC(=O)C=CC(=O)NCCCCO 240690a_100000750430_100000210415 [0,2,0,0,0,0|2,0,0]=4 1163 B14R0.199 CCOC(=O)C=CC(=O)NCCCOC 1626a_100150723488_100000210415 [0,2,0,0,0,0|2,0,0]=4 1164 B14R0.199 CCOC(=O)C=CC(=O)NCCCOC 240690a_100150723488_100000210415 [0,2,0,0,0,0|2,0,0]=4 1165 B14R0.199 CCOC(=O)C=CC(=O)NCCCSC 1626a_100000749238_100000210415 [0,2,0,0,0,0|2,0,0]=4 1166 B14R0.199 CCOC(=O)C=CC(=O)NCCCSC 240690a_100000749238_100000210415 [0,2,0,0,0,0|2,0,0]=4 1167 B14R0.199 CCOC(=O)C=CC(=O)NCCSCC 1626a_100000106463_100000210415 [0,2,0,0,0,0|2,0,0]=4 1168 B14R0.199 CCOC(=O)C=CC(=O)NCCSCC 240690a_100000106463_100000210415 [0,2,0,0,0,0|2,0,0]=4 1169 B14R0.199 CCOCCCC(=O)C=CC(=O)OCC 1458a_100000210415_100012232248 [0,2,0,0,0,0|1,0,1]=4 1170 B14R0.199 CCOCCNC(=O)C=CC(=O)OCC 1626a_102516460346_100000210415 [0,2,0,0,0,0|2,0,0]=4 1171 B14R0.199 CCOCCNC(=O)C=CC(=O)OCC 240690a_100011200944_100000210415 [0,2,0,0,0,0|2,0,0]=4 1172 B14R0.393 CCCCC/C=C/COCC(=O)OCC 34a_100016258190_100000188475 [0,2,0,0,0,0|0,0,2]=4 1173 B14R0.393 CCCCC/C=C/COCC(=O)OCC 7a_100016258190_100000188475 [0,2,0,0,0,0|0,0,2]=4 1174 B14R0.393 CCCCCC=CC=NNC(=O)CCC 4a_100000189770_100016268540 [0,2,0,0,0,0|2,0,0]=4 1175 B14R0.393 CCCCCC=CC=NNC(=O)COC 4a_100000216845_100016268540 [0,2,0,0,0,0|1,0,0]=3 1176 B14R0.393 CCCCCCNC/C=C/C(=O)OCC 2230a_100000210581_100016267167 [0,2,0,0,0,0|0,0,2]=4 1177 B14R0.393 CCCCCCOC/C=C/C(=O)OCC 34a_100000210259_100016267167 [0,2,0,0,0,0|0,0,2]=4 1178 B14R0.393 CCCCCCOC/C=C/C(=O)OCC 7a_100000210259_100016267167 [0,2,0,0,0,0|0,0,2]=4 1179 B14R0.393 CCCCCCSC/C=C/C(=O)OCC 62a_100000210314_100016267167 [0,2,0,0,0,0|0,0,2]=4 1180 B14R0.393 CCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210757 [0,2,0,0,0,0|0,0,2]=4 1181 B14R0.393 CCCCCNN=CC=CC(=O)OCC 4a_100000694160_100016289910 [0,2,0,0,0,0|1,0,0]=3 1182 B14R0.393 CCCCOCSC/C=C/C(=O)OCC 62a_100011995733_100016267167 [0,2,0,0,0,0|1,0,1]=4 1183 B14R0.393 CCCCOCSC/C=C/C(=O)OCC 62a_100016267167_100011995733 [0,2,0,0,0,0|1,0,1]=4 1184 B14R0.393 CCCOCCNC/C=C/C(=O)OCC 2230a_100161115042_100016267167 [0,2,0,0,0,0|1,0,1]=4 1185 B14R0.393 CCCOCCNC/C=C/C(=O)OCC 34a_100161115042_100016267167 [0,2,0,0,0,0|1,0,1]=4 1186 B14R0.393 CCCOCCOC/C=C/C(=O)OCC 34a_100000752267_100016267167 [0,2,0,0,0,0|1,0,1]=4 1187 B14R0.393 CCCOCCOC/C=C/C(=O)OCC 7a_100000752267_100016267167 [0,2,0,0,0,0|1,0,1]=4 1188 B14R0.393 CCCOCCSC/C=C/C(=O)OCC 62a_100011215938_100016267167 [0,2,0,0,0,0|1,0,1]=4 1189 B14R0.393 CCCOCCSC/C=C/C(=O)OCC 62a_100016267167_100011215938 [0,2,0,0,0,0|1,0,1]=4 1190 B14R0.393 CCCSCCNC/C=C/C(=O)OCC 2230a_100020603323_100016267167 [0,2,0,0,0,0|1,0,1]=4 1191 B14R0.393 CCCSCCOC/C=C/C(=O)OCC 34a_200000230433_100016267167 [0,2,0,0,0,0|1,0,1]=4 1192 B14R0.393 CCCSCCOC/C=C/C(=O)OCC 7a_200000230433_100016267167 [0,2,0,0,0,0|1,0,1]=4 1193 B14R0.393 CCOC(=O)/C=C/CNCCCCCO 2230a_100000762737_100016267167 [0,2,0,0,0,0|1,0,1]=4 1194 B14R0.393 CCOC(=O)/C=C/CNCCCCCO 34a_100000762737_100016267167 [0,2,0,0,0,0|1,0,1]=4 1195 B14R0.393 CCOC(=O)/C=C/COCCCCCBr 34a_100000746331_100016267167 [0,2,0,0,0,0|1,0,1]=4 1196 B14R0.393 CCOC(=O)/C=C/COCCCCCBr 7a_100000746331_100016267167 [0,2,0,0,0,0|1,0,1]=4 1197 B14R0.393 CCOC(=O)/C=C/COCCCCCCl 34a_100000746330_100016267167 [0,2,0,0,0,0|1,0,1]=4 1198 B14R0.393 CCOC(=O)/C=C/COCCCCCCl 7a_100000746330_100016267167 [0,2,0,0,0,0|1,0,1]=4 1199 B14R0.393 CCOC(=O)/C=C/COCCCCCI 34a_200012148887_100016267167 [0,2,0,0,0,0|1,0,1]=4 1200 B14R0.393 CCOC(=O)/C=C/COCCCCCI 7a_200012148887_100016267167 [0,2,0,0,0,0|1,0,1]=4 1201 B14R0.393 CCOC(=O)/C=C/COCCCCCN 34a_100000762737_100016267167 [0,2,0,0,0,0|1,0,1]=4 1202 B14R0.393 CCOC(=O)/C=C/COCCCCOC 34a_100000740925_100016267167 [0,2,0,0,0,0|1,0,1]=4 1203 B14R0.393 CCOC(=O)/C=C/COCCCCSC 34a_100011217163_100016267167 [0,2,0,0,0,0|1,0,1]=4 1204 B14R0.393 CCOC(=O)/C=C/COCCCCSC 7a_100011217163_100016267167 [0,2,0,0,0,0|1,0,1]=4 1205 B14R0.393 CCOC(=O)/C=C/COCCCSCC 34a_100011216438_100016267167 [0,2,0,0,0,0|1,0,1]=4 1206 B14R0.393 CCOC(=O)/C=C/COCCCSCC 7a_100011216438_100016267167 [0,2,0,0,0,0|1,0,1]=4 1207 B14R0.393 CCOC(=O)/C=C/CSCCCCCF 62a_100000729378_100016267167 [0,2,0,0,0,0|1,0,1]=4 1208 B14R0.393 CCOC(=O)/C=C/CSCCCCCF 62a_100016267167_100000729378 [0,2,0,0,0,0|1,0,1]=4 1209 B14R0.393 CCOC(=O)/C=C/CSCCCCCO 62a_100000746330_100016267167 [0,2,0,0,0,0|1,0,1]=4 1210 B14R0.393 CCOC(=O)/C=C/CSCCCCCO 62a_100016267167_100000746330 [0,2,0,0,0,0|1,0,1]=4 1211 B14R0.393 CCOC(=O)/C=C/CSCCCCOC 62a_100000730899_100016267167 [0,2,0,0,0,0|1,0,1]=4 1212 B14R0.393 CCOC(=O)/C=C/CSCCCCOC 62a_100016267167_100000730899 [0,2,0,0,0,0|1,0,1]=4 1213 B14R0.393 CCOCCCNC/C=C/C(=O)OCC 2230a_100000210961_100016267167 [0,2,0,0,0,0|1,0,1]=4 1214 B14R0.393 CCOCCCNC/C=C/C(=O)OCC 34a_100000210961_100016267167 [0,2,0,0,0,0|1,0,1]=4 1215 B14R0.393 CCOCCCOC/C=C/C(=O)OCC 34a_100000757476_100016267167 [0,2,0,0,0,0|1,0,1]=4 1216 B14R0.393 CCOCCCOC/C=C/C(=O)OCC 7a_100000757476_100016267167 [0,2,0,0,0,0|1,0,1]=4 1217 B14R0.393 CCOCCCSC/C=C/C(=O)OCC 62a_100012232248_100016267167 [0,2,0,0,0,0|1,0,1]=4 1218 B14R0.393 CCOCCCSC/C=C/C(=O)OCC 62a_100016267167_100012232248 [0,2,0,0,0,0|1,0,1]=4 1219 B14R0.393 CCOCCNN=CC=CC(=O)OCC 4a_100000732670_100016289910 [0,2,0,0,0,0|2,0,0]=4 1220 B14R0.432 CCOC(=O)/C=C/CNCCCC(C)C 2230a_200000737386_100016267167 [0,2,0,0,0,0|1,0,1]=4 1221 B14R0.432 CCOC(=O)/C=C/CNCCCC(C)C 34a_200000737386_100016267167 [0,2,0,0,0,0|1,0,1]=4 1222 B14R0.432 CCOC(=O)/C=C/COCCCC(C)C 34a_100000210774_100016267167 [0,2,0,0,0,0|1,0,1]=4 1223 B14R0.432 CCOC(=O)/C=C/COCCCC(C)C 7a_100000210774_100016267167 [0,2,0,0,0,0|1,0,1]=4 1224 B14R0.432 CCOC(=O)/C=C/CSCCCC(C)C 62a_100011214892_100016267167 [0,2,0,0,0,0|1,0,1]=4 1225 B14R0.432 CCOC(=O)/C=C/CSCCCC(C)C 62a_100016267167_100011214892 [0,2,0,0,0,0|1,0,1]=4 1226 B14R0.432 CCOC(=O)/C=C/CSCCCC(C)O 62a_100016267167_200000718107 [0,2,0,0,0,0|1,0,1]=4 1227 B14R0.432 CCOC(=O)/C=C/CSCCCC(C)O 62a_200000718107_100016267167 [0,2,0,0,0,0|1,0,1]=4 1228 B14R0.493 CCCCC/C=C/CCC(=O)CCOC 1458a_200015255902_100000233755 [0,2,0,0,0,0|0,0,2]=4 1229 B14R0.493 CCCCCC/C=C/CC(=O)CCOC 1458a_100020681715_100000233755 [0,2,0,0,0,0|0,0,2]=4 1230 B14R0.493 CCCCCCCC=CC(=O)CCOC 1458a_200015332781_100000233755 [0,2,0,0,0,0|0,0,2]=4 1231 B14R0.2432 CCCCCC(=O)NN=CC(=O)OCC 4a_100000189784_100000742314 [0,2,0,0,0,0|2,0,0]=4 1232 B14R0.2432 CCCCCN(C)C/C=C/C(=O)OCC 2230a_100000223495_100016267167 [0,2,0,0,0,0|1,0,1]=4 1233 B14R0.2432 CCCCCN(C)C/C=C/C(=O)OCC 269982a_100000223495_100016267167 [0,2,0,0,0,0|1,0,1]=4 1234 B14R0.152 CCCCC(=O)NN=CC=CC(=O)OC 4a_100000189769_100016254430 [0,2,0,0,0,0|1,0,1]=4 1235 B14R0.152 CCCCC(C)COC/C=C/C(=O)OC 34a_100011995851_100000742655 [0,2,0,0,0,0|0,0,2]=4 1236 B14R0.152 CCCCC(C)COC/C=C/C(=O)OC 7a_100011995851_100000742655 [0,2,0,0,0,0|0,0,2]=4 1237 B14R0.152 CCCC[C@H](N)COC/C=C/C(=O)OC 34a_100011934283_100000742655 [0,2,0,0,0,0|0,0,2]=4 1238 B14R0.152 CCCOC(C)CNC/C=C/C(=O)OC 2230a_100015185124_100000742655 [0,2,0,0,0,0|1,0,1]=4 1239 B14R0.152 CCCOC(C)CNC/C=C/C(=O)OC 34a_100015185124_100000742655 [0,2,0,0,0,0|1,0,1]=4 1240 B14R0.152 CCOCC(O)CNC/C=C/C(=O)OC 2230a_102515437182_100000742655 [0,2,0,0,0,0|1,0,1]=4 1241 B14R0.152 CCOCC(O)CNC/C=C/C(=O)OC 34a_102515437182_100000742655 [0,2,0,0,0,0|1,0,1]=4 1242 B14R0.152 COC(=O)/C=C/CNC[C@H](C)CCCO 2230a_100160569302_100000742655 [0,2,0,0,0,0|1,0,1]=4 1243 B14R0.152 COC(=O)/C=C/CNC[C@H](C)CCCO 34a_100160569302_100000742655 [0,2,0,0,0,0|1,0,1]=4 1244 B14R0.152 COC(=O)/C=C/COC[C@@H](N)CCSC 34a_100011827619_100000742655 [0,2,0,0,0,0|1,0,1]=4 1245 B14R0.286 CCCC(C)(C)COC/C=C/C(=O)OC 7a_100011995695_100000742655 [0,2,0,0,0,0|1,0,1]=4 1246 B14R0.309 COC(=O)/C=C/COC[C@@H](N)CC(C)C 34a_100011830311_100000742655 [0,2,0,0,0,0|1,0,1]=4 1247 B14R0.310 CCCC(C)C(C)OC/C=C/C(=O)OC 34a_100000708338_100000742655 [0,2,0,0,0,0|1,0,1]=4 1248 B14R0.310 CCCC(C)C(C)OC/C=C/C(=O)OC 7a_100000708338_100000742655 [0,2,0,0,0,0|1,0,1]=4 1249 B14R0.195 COC(=O)/C=C/CNC(C)CCC(C)C 2230a_100138410893_100000742655 [0,2,0,0,0,0|1,0,1]=4 1250 B14R0.195 COC(=O)/C=C/COC(C)CCC(C)C 34a_100011215350_100000742655 [0,2,0,0,0,0|1,0,1]=4 1251 B14R0.195 COC(=O)/C=C/COC(C)CCC(C)C 7a_100011215350_100000742655 [0,2,0,0,0,0|1,0,1]=4 1252 B14R0.195 COC(=O)/C=C/CSC(C)CCC(C)C 62a_100000742655_100011261404 [0,2,0,0,0,0|1,0,1]=4 1253 B14R0.195 COC(=O)/C=C/CSC(C)CCC(C)C 62a_100011261404_100000742655 [0,2,0,0,0,0|1,0,1]=4 1254 B14R0.226 CCCCCC(=O)NN=CCC(=O)OC 4a_100000189784_200011552997 [0,2,0,0,0,0|1,0,1]=4 1255 B14R0.226 CCCCCC(C)NC/C=C/C(=O)OC 2230a_100000211957_100000742655 [0,2,0,0,0,0|0,0,2]=4 1256 B14R0.226 CCCCCC(C)OC/C=C/C(=O)OC 34a_100011215632_100000742655 [0,2,0,0,0,0|0,0,2]=4 1257 B14R0.226 CCCCCC(C)OC/C=C/C(=O)OC 7a_100011215632_100000742655 [0,2,0,0,0,0|0,0,2]=4 1258 B14R0.226 CCCCCC(C)SC/C=C/C(=O)OC 62a_100000742655_200011218191 [0,2,0,0,0,0|0,0,2]=4 1259 B14R0.226 CCCCCC(C)SC/C=C/C(=O)OC 62a_200011218191_100000742655 [0,2,0,0,0,0|0,0,2]=4 1260 B14R0.226 COCCCC(C)OC/C=C/C(=O)OC 34a_200011539412_100000742655 [0,2,0,0,0,0|1,0,1]=4 1261 B14R0.226 COCCCC(C)OC/C=C/C(=O)OC 7a_200011539412_100000742655 [0,2,0,0,0,0|1,0,1]=4 1262 B14R0.353 C#CC(CCCC)OC/C=C/C(=O)OC 34a_200011217967_100000742655 [0,2,0,0,0,0|1,0,1]=4 1263 B14R0.353 C#CC(CCCC)OC/C=C/C(=O)OC 7a_200011217967_100000742655 [0,2,0,0,0,0|1,0,1]=4 1264 B14R0.353 C=CC(CCCC)OC/C=C/C(=O)OC 34a_200011215037_100000742655 [0,2,0,0,0,0|1,0,1]=4 1265 B14R0.353 C=CC(CCCC)OC/C=C/C(=O)OC 7a_200011215037_100000742655 [0,2,0,0,0,0|1,0,1]=4 1266 B14R0.353 CCCCC(CC)OC/C=C/C(=O)OC 34a_100011215227_100000742655 [0,2,0,0,0,0|1,0,1]=4 1267 B14R0.353 CCCCC(CC)OC/C=C/C(=O)OC 7a_100011215227_100000742655 [0,2,0,0,0,0|1,0,1]=4 1268 B14R0.353 CCCCC(CC)SC/C=C/C(=O)OC 62a_100000742655_200011216223 [0,2,0,0,0,0|1,0,1]=4 1269 B14R0.353 CCCCC(CC)SC/C=C/C(=O)OC 62a_200011216223_100000742655 [0,2,0,0,0,0|1,0,1]=4 1270 B14R0.353 CCCC[C@@H](CO)NC/C=C/C(=O)OC 2230a_100011934283_100000742655 [0,2,0,0,0,0|1,0,1]=4 1271 B14R0.353 CCCC[C@@H](CO)NC/C=C/C(=O)OC 34a_100011934283_100000742655 [0,2,0,0,0,0|1,0,1]=4 1272 B14R0.449 CCCCC(C)NC(=O)C=CC(=O)NC 1626a_100000126638_100016259477 [0,2,0,0,0,0|2,0,0]=4 1273 B14R0.449 CCCCC(C)NC(=O)C=CC(=O)OC 1626a_100000126638_100016283253 [0,2,0,0,0,0|1,0,0]=3 1274 B14R0.568 CCCCC(C)(C)OC/C=C/C(=O)OC 7a_100011219641_100000742655 [0,2,0,0,0,0|1,0,1]=4 1275 B14R0.2341 CCC(C)CC(C)NC/C=C/C(=O)OC 2230a_100000763565_100000742655 [0,2,0,0,0,0|1,0,1]=4 1276 B14R0.12 CCCCCCC(=O)NN=CC(=O)OC 4a_100011221127_200011823558 [0,2,0,0,0,0|1,0,1]=4 1277 B14R0.12 CCCCCCN(C)C/C=C/C(=O)OC 2230a_106256046315_100000742655 [0,2,0,0,0,0|0,0,2]=4 1278 B14R0.12 CCCCCCN(C)C/C=C/C(=O)OC 269982a_106256046315_100000742655 [0,2,0,0,0,0|0,0,2]=4 1279 B14R0.12 COC(=O)/C=C/CN(C)CCCCCO 2230a_100000722520_100000742655 [0,2,0,0,0,0|1,0,1]=4 1280 B14R0.12 COC(=O)/C=C/CN(C)CCCCCO 269982a_100000722520_100000742655 [0,2,0,0,0,0|1,0,1]=4 1281 B14R0.82 CCCCC/C=C/CC(=O)CC(=O)CC 1458a_100020675968_100000747405 [0,2,0,0,0,0|1,0,1]=4 1282 B14R0.82 CCCCC/C=C/CC(=O)CC(=O)NC 1458a_100020675968_100000183359 [0,2,0,0,0,0|1,0,1]=4 1283 B14R0.82 CCCCC/C=C/CC(=O)CC(=O)OC 1458a_100020675968_100000747449 [0,2,0,0,0,0|0,0,1]=3 1284 B14R0.82 CCCCCCC=CC(=O)CC(=O)CC 1458a_200015324643_100000747405 [0,2,0,0,0,0|1,0,1]=4 1285 B14R0.82 CCCCCCC=CC(=O)CC(=O)NC 1458a_200015324643_100000183359 [0,2,0,0,0,0|1,0,1]=4 1286 B14R0.82 CCCCCCC=CC(=O)CC(=O)OC 1458a_200015324643_100000747449 [0,2,0,0,0,0|0,0,1]=3 1287 B14R0.140 C#CCCCCNC(=O)C=CC(=O)OC 1626a_100000706060_100016283253 [0,2,0,0,0,0|1,0,1]=4 1288 B14R0.140 C=CCCCCNC(=O)C=CC(=O)OC 1626a_100000703577_100016283253 [0,2,0,0,0,0|1,0,1]=4 1289 B14R0.140 CCCCCC=CC(=NNC(=O)CC)C 4a_100000183195_100016257799 [0,2,0,0,0,0|2,0,0]=4 1290 B14R0.140 CCCCCC=CC(=O)NCC(=O)NC 11a_100000693194_100016263427 [0,2,0,0,0,0|1,0,1]=4 1291 B14R0.140 CCCCCC=CC(=O)NCC(=O)NC 240690a_100000693194_100016263427 [0,2,0,0,0,0|1,0,1]=4 1292 B14R0.140 CCCCCC=CC(=O)NCC(=O)OC 188690a_100000185156_100016263427 [0,2,0,0,0,0|0,0,1]=3 1293 B14R0.140 CCCCCC=CC(=O)NNC(=O)CC 22a_100000183195_100016263427 [0,2,0,0,0,0|2,0,0]=4 1294 B14R0.140 CCCCCCCC(=O)C=CC(=O)NC 1458a_100016259477_100000210614 [0,2,0,0,0,0|1,0,1]=4 1295 B14R0.140 CCCCCCNC(=O)C=CC(=O)NC 1626a_100000210581_100016259477 [0,2,0,0,0,0|1,0,1]=4 1296 B14R0.140 CCCCCCNC(=O)C=CC(=O)OC 1626a_100000210581_100016283253 [0,2,0,0,0,0|0,0,1]=3 1297 B14R0.140 CCCCCNN=C(C)C=CC(=O)OC 4a_100000694160_100016258046 [0,2,0,0,0,0|1,0,0]=3 1298 B14R0.140 CCCCCNNC(=O)C=CC(=O)NC 22a_100000694160_100016259477 [0,2,0,0,0,0|2,0,0]=4 1299 B14R0.140 CCCCCNNC(=O)C=CC(=O)OC 22a_100000694160_100016283253 [0,2,0,0,0,0|1,0,0]=3 1300 B14R0.140 CCCCOCCC(=O)C=CC(=O)NC 1458a_100016259477_100000743108 [0,2,0,0,0,0|1,0,1]=4 1301 B14R0.140 CCCOCCNC(=O)C=CC(=O)NC 1626a_100161115042_100016259477 [0,2,0,0,0,0|2,0,0]=4 1302 B14R0.140 CCCOCCNC(=O)C=CC(=O)OC 1626a_100161115042_100016283253 [0,2,0,0,0,0|1,0,0]=3 1303 B14R0.140 CCOCCCNC(=O)C=CC(=O)NC 1626a_100000210961_100016259477 [0,2,0,0,0,0|2,0,0]=4 1304 B14R0.140 CCOCCCNC(=O)C=CC(=O)OC 1626a_100000210961_100016283253 [0,2,0,0,0,0|1,0,0]=3 1305 B14R0.140 CCOCCNN=C(C)C=CC(=O)OC 4a_100000732670_100016258046 [0,2,0,0,0,0|2,0,0]=4 1306 B14R0.140 CCOCCNNC(=O)C=CC(=O)OC 22a_100000732670_100016283253 [0,2,0,0,0,0|2,0,0]=4 1307 B14R0.140 CNC(=O)C=CC(=O)CCCCCCF 1458a_100016259477_100015922095 [0,2,0,0,0,0|1,0,1]=4 1308 B14R0.140 CNC(=O)C=CC(=O)CCCCCCO 1458a_100016259477_100000766143 [0,2,0,0,0,0|1,0,1]=4 1309 B14R0.140 COC(=O)C=CC(=O)NCCCCC#N 1626a_100000751965_100016283253 [0,2,0,0,0,0|1,0,1]=4 1310 B14R0.140 COCCCNNC(=O)C=CC(=O)OC 22a_100025702787_100016283253 [0,2,0,0,0,0|2,0,0]=4 1311 B14R0.197 CCC(C)CCCOC/C=C/C(=O)OC 7a_100011216074_100000742655 [0,2,0,0,0,0|0,0,2]=4 1312 B14R0.197 CCN(C)CCCSC/C=C/C(=O)OC 62a_100000742655_100015186262 [0,2,0,0,0,0|1,0,1]=4 1313 B14R0.197 COC(=O)/C=C/COCCC[C@@H](C)CN 34a_100160569302_100000742655 [0,2,0,0,0,0|1,0,1]=4 1314 B14R0.305 COC(=O)/C=C/CNCCCOC(C)C 2230a_100000737246_100000742655 [0,2,0,0,0,0|1,0,1]=4 1315 B14R0.305 COC(=O)/C=C/CNCCCOC(C)C 34a_100000737246_100000742655 [0,2,0,0,0,0|1,0,1]=4 1316 B14R0.305 COC(=O)/C=C/COCCCCC(C)C 34a_100011214890_100000742655 [0,2,0,0,0,0|0,0,2]=4 1317 B14R0.305 COC(=O)/C=C/COCCCCC(C)C 7a_100011214890_100000742655 [0,2,0,0,0,0|0,0,2]=4 1318 B14R0.305 COC(=O)/C=C/COCCCNC(C)C 34a_100000182298_100000742655 [0,2,0,0,0,0|1,0,1]=4 1319 B14R0.305 COC(=O)/C=C/COCCNCC(C)C 34a_100015185251_100000742655 [0,2,0,0,0,0|1,0,1]=4 1320 B14R0.305 COC(=O)/C=C/COCCOCC(C)C 34a_100000703358_100000742655 [0,2,0,0,0,0|1,0,1]=4 1321 B14R0.305 COC(=O)/C=C/COCCOCC(C)C 7a_100000703358_100000742655 [0,2,0,0,0,0|1,0,1]=4 1322 B14R0.305 COC(=O)/C=C/COCCSCC(C)C 34a_200000230437_100000742655 [0,2,0,0,0,0|1,0,1]=4 1323 B14R0.305 COC(=O)/C=C/COCCSCC(C)C 7a_200000230437_100000742655 [0,2,0,0,0,0|1,0,1]=4 1324 B14R0.305 COC(=O)/C=C/CSCCCCC(=O)C 62a_100000735457_100000742655 [0,2,0,0,0,0|1,0,1]=4 1325 B14R0.305 COC(=O)/C=C/CSCCCCC(=O)C 62a_100000742655_100000735457 [0,2,0,0,0,0|1,0,1]=4 1326 B14R0.305 COC(=O)/C=C/CSCCCCC(C)C 62a_100000742655_100011216152 [0,2,0,0,0,0|0,0,2]=4 1327 B14R0.305 COC(=O)/C=C/CSCCCCC(C)C 62a_100011216152_100000742655 [0,2,0,0,0,0|0,0,2]=4 1328 B14R0.305 COC(=O)/C=C/CSCCCCN(C)C 62a_100000742655_100000690147 [0,2,0,0,0,0|1,0,1]=4 1329 B14R0.337 C#CCCCCCOC/C=C/C(=O)OC 34a_100000766912_100000742655 [0,2,0,0,0,0|1,0,1]=4 1330 B14R0.337 C#CCCCCCOC/C=C/C(=O)OC 7a_100000766912_100000742655 [0,2,0,0,0,0|1,0,1]=4 1331 B14R0.337 C#CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100012094781 [0,2,0,0,0,0|1,0,1]=4 1332 B14R0.337 C#CCCCCCSC/C=C/C(=O)OC 62a_100012094781_100000742655 [0,2,0,0,0,0|1,0,1]=4 1333 B14R0.337 C=CCCCCCOC/C=C/C(=O)OC 34a_100011216702_100000742655 [0,2,0,0,0,0|1,0,1]=4 1334 B14R0.337 C=CCCCCCOC/C=C/C(=O)OC 7a_100011216702_100000742655 [0,2,0,0,0,0|1,0,1]=4 1335 B14R0.337 C=CCCCCCSC/C=C/C(=O)OC 62a_100000700193_100000742655 [0,2,0,0,0,0|1,0,1]=4 1336 B14R0.337 C=CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000700193 [0,2,0,0,0,0|1,0,1]=4 1337 B14R0.337 CC/C=C/CCCOC/C=C/C(=O)OC 34a_100016287902_100000742655 [0,2,0,0,0,0|1,0,1]=4 1338 B14R0.337 CC/C=C/CCCOC/C=C/C(=O)OC 7a_100016287902_100000742655 [0,2,0,0,0,0|1,0,1]=4 1339 B14R0.337 CCCC#CCCOC/C=C/C(=O)OC 34a_100000042726_100000742655 [0,2,0,0,0,0|1,0,1]=4 1340 B14R0.337 CCCC#CCCOC/C=C/C(=O)OC 7a_100000042726_100000742655 [0,2,0,0,0,0|1,0,1]=4 1341 B14R0.337 CCCC/C=C/C=CC=NNC(=O)CC 4a_100000183195_200016287853 [0,2,0,0,0,0|1,0,1]=4 1342 B14R0.337 CCCC/C=C/COC/C=C/C(=O)OC 34a_200016272032_100000742655 [0,2,0,0,0,0|0,0,2]=4 1343 B14R0.337 CCCC/C=C/COC/C=C/C(=O)OC 7a_200016272032_100000742655 [0,2,0,0,0,0|0,0,2]=4 1344 B14R0.337 CCCCC#CCOC/C=C/C(=O)OC 34a_200000034558_100000742655 [0,2,0,0,0,0|1,0,1]=4 1345 B14R0.337 CCCCC#CCOC/C=C/C(=O)OC 7a_200000034558_100000742655 [0,2,0,0,0,0|1,0,1]=4 1346 B14R0.337 CCCCC/C=C/COCCC(=O)OC 34a_100016258190_100000742370 [0,2,0,0,0,0|0,0,2]=4 1347 B14R0.337 CCCCC/C=C/COCCC(=O)OC 7a_100016258190_100000204255 [0,2,0,0,0,0|0,0,2]=4 1348 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 34a_100016277358_100000747449 [0,2,0,0,0,0|0,0,2]=4 1349 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 7a_100016277358_100000747449 [0,2,0,0,0,0|0,0,2]=4 1350 B14R0.337 CCCCCC/C=C/COCC(=O)OC 34a_200016276170_100000747449 [0,2,0,0,0,0|0,0,2]=4 1351 B14R0.337 CCCCCC/C=C/COCC(=O)OC 7a_200016276170_100000747449 [0,2,0,0,0,0|0,0,2]=4 1352 B14R0.337 CCCCCCC=CC=NNC(=O)CC 4a_100000183195_100016264548 [0,2,0,0,0,0|1,0,1]=4 1353 B14R0.337 CCCCCCCNC/C=C/C(=O)OC 2230a_100000229938_100000742655 [0,2,0,0,0,0|0,0,2]=4 1354 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 34a_100000210272_100000742655 [0,2,0,0,0,0|0,0,2]=4 1355 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 7a_100000210272_100000742655 [0,2,0,0,0,0|0,0,2]=4 1356 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000210614_100000742655 [0,2,0,0,0,0|0,0,2]=4 1357 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210316 [0,2,0,0,0,0|0,0,2]=4 1358 B14R0.337 CCCCOCCOC/C=C/C(=O)OC 34a_100000210238_100000742655 [0,2,0,0,0,0|0,0,2]=4 1359 B14R0.337 CCCCOCCOC/C=C/C(=O)OC 7a_100000210238_100000742655 [0,2,0,0,0,0|0,0,2]=4 1360 B14R0.337 CCCCOCCSC/C=C/C(=O)OC 62a_100000742655_100000743108 [0,2,0,0,0,0|0,0,2]=4 1361 B14R0.337 CCCCOCCSC/C=C/C(=O)OC 62a_100000743108_100000742655 [0,2,0,0,0,0|0,0,2]=4 1362 B14R0.337 CCCCSCCNC/C=C/C(=O)OC 2230a_100025743550_100000742655 [0,2,0,0,0,0|0,0,2]=4 1363 B14R0.337 CCCCSCCOC/C=C/C(=O)OC 34a_200000230436_100000742655 [0,2,0,0,0,0|0,0,2]=4 1364 B14R0.337 CCCCSCCOC/C=C/C(=O)OC 7a_200000230436_100000742655 [0,2,0,0,0,0|0,0,2]=4 1365 B14R0.337 CCCOCCCNC/C=C/C(=O)OC 2230a_100011217757_100000742655 [0,2,0,0,0,0|0,0,2]=4 1366 B14R0.337 CCCOCCCNC/C=C/C(=O)OC 34a_100011217757_100000742655 [0,2,0,0,0,0|0,0,2]=4 1367 B14R0.337 CNCCCCCOC/C=C/C(=O)OC 34a_100000722520_100000742655 [0,2,0,0,0,0|0,0,2]=4 1368 B14R0.337 CNCCOCCOC/C=C/C(=O)OC 34a_100000228057_100000742655 [0,2,0,0,0,0|1,0,1]=4 1369 B14R0.337 COC(=O)/C=C/CNCCCCCCO 2230a_100000686447_100000742655 [0,2,0,0,0,0|0,0,2]=4 1370 B14R0.337 COC(=O)/C=C/CNCCCCCCO 34a_100000686447_100000742655 [0,2,0,0,0,0|0,0,2]=4 1371 B14R0.337 COC(=O)/C=C/COCCCCCCBr 34a_100011215345_100000742655 [0,2,0,0,0,0|0,0,2]=4 1372 B14R0.337 COC(=O)/C=C/COCCCCCCBr 7a_100011215345_100000742655 [0,2,0,0,0,0|0,0,2]=4 1373 B14R0.337 COC(=O)/C=C/COCCCCCCCl 34a_100000766143_100000742655 [0,2,0,0,0,0|0,0,2]=4 1374 B14R0.337 COC(=O)/C=C/COCCCCCCCl 7a_100000766143_100000742655 [0,2,0,0,0,0|0,0,2]=4 1375 B14R0.337 COC(=O)/C=C/COCCCCCCF 34a_100000732779_100000742655 [0,2,0,0,0,0|0,0,2]=4 1376 B14R0.337 COC(=O)/C=C/COCCCCCCF 7a_100000732779_100000742655 [0,2,0,0,0,0|0,0,2]=4 1377 B14R0.337 COC(=O)/C=C/COCCCCCCN 34a_100000686447_100000742655 [0,2,0,0,0,0|0,0,2]=4 1378 B14R0.337 COC(=O)/C=C/CSCCCCCC#N 62a_100000742655_100009813376 [0,2,0,0,0,0|1,0,1]=4 1379 B14R0.337 COC(=O)/C=C/CSCCCCCC#N 62a_100009813376_100000742655 [0,2,0,0,0,0|1,0,1]=4 1380 B14R0.337 COC(=O)/C=C/CSCCCCCC=O 62a_100000139337_100000742655 [0,2,0,0,0,0|1,0,1]=4 1381 B14R0.337 COC(=O)/C=C/CSCCCCCC=O 62a_100000742655_100000139337 [0,2,0,0,0,0|1,0,1]=4 1382 B14R0.337 COC(=O)/C=C/CSCCCCCCF 62a_100000742655_100015922095 [0,2,0,0,0,0|0,0,2]=4 1383 B14R0.337 COC(=O)/C=C/CSCCCCCCF 62a_100015922095_100000742655 [0,2,0,0,0,0|0,0,2]=4 1384 B14R0.337 COC(=O)/C=C/CSCCCCCCO 62a_100000742655_100000766143 [0,2,0,0,0,0|0,0,2]=4 1385 B14R0.337 COC(=O)/C=C/CSCCCCCCO 62a_100000766143_100000742655 [0,2,0,0,0,0|0,0,2]=4 1386 B14R0.337 COCCCCCNC/C=C/C(=O)OC 2230a_100000747528_100000742655 [0,2,0,0,0,0|0,0,2]=4 1387 B14R0.337 COCCCCCNC/C=C/C(=O)OC 34a_100000747528_100000742655 [0,2,0,0,0,0|0,0,2]=4 1388 B14R0.337 COCCOCCNC/C=C/C(=O)OC 2230a_100000745349_100000742655 [0,2,0,0,0,0|1,0,1]=4 1389 B14R0.337 COCCOCCNC/C=C/C(=O)OC 34a_100000745349_100000742655 [0,2,0,0,0,0|1,0,1]=4 1390 B14R0.337 COCCOCCOC/C=C/C(=O)OC 34a_100011215163_100000742655 [0,2,0,0,0,0|1,0,1]=4 1391 B14R0.337 COCCOCCOC/C=C/C(=O)OC 7a_100011215163_100000742655 [0,2,0,0,0,0|1,0,1]=4 1392 B14R0.337 COCCOCCSC/C=C/C(=O)OC 62a_100000695917_100000742655 [0,2,0,0,0,0|1,0,1]=4 1393 B14R0.337 COCCOCCSC/C=C/C(=O)OC 62a_100000742655_100000695917 [0,2,0,0,0,0|1,0,1]=4 1394 B14R0.340 CCCCCC=CC=NNC(=O)C(C)C 4a_100000184118_100016268540 [0,2,0,0,0,0|2,0,0]=4 1395 B14R0.92 CCCCCC=CC(=O)CC(=O)C(=O)C 1458a_100016263427_100011261029 [0,2,0,0,0,0|1,0,1]=4 1396 B14R0.92 CCCCCC=CC(=O)CC(=O)C(C)C 1458a_100016263427_100000753385 [0,2,0,0,0,0|1,0,1]=4 1397 B14R0.92 CCCCCC=CC(=O)CC(=O)N(C)C 1458a_100016263427_100000185267 [0,2,0,0,0,0|1,0,1]=4 1398 B14R0.180 CCCCCCC(=O)C=CC(=O)N(C)C 1458a_100011200747_100000210757 [0,2,0,0,0,0|1,0,1]=4 1399 B14R0.180 CCCCCNC(=O)C=CC(=O)N(C)C 1626a_100000209983_100011200747 [0,2,0,0,0,0|2,0,0]=4 1400 B14R0.534 COC(=O)/C=C/COCCC(N)C(C)C 34a_100161115045_100000742655 [0,2,0,0,0,0|1,0,1]=4 1401 B14R0.18 CCC(C)CCNC(=O)C=CC(=O)NC 1626a_100020591266_100016259477 [0,2,0,0,0,0|2,0,0]=4 1402 B14R0.18 CCC(C)CCNC(=O)C=CC(=O)OC 1626a_100020591266_100016283253 [0,2,0,0,0,0|1,0,0]=3 1403 B14R0.18 CCC(O)CNN=C(C)C=CC(=O)OC 4a_100015206393_100016258046 [0,2,0,0,0,0|2,0,0]=4 1404 B14R0.18 CCC(O)CNNC(=O)C=CC(=O)OC 22a_100015206393_100016283253 [0,2,0,0,0,0|2,0,0]=4 1405 B14R0.230 CCCCCC(=O)CC(=O)CC(=O)OC 1458a_100000211351_200012276598 [0,2,0,0,0,0|0,0,2]=4 1406 B14R0.230 CCCCCC(=O)CC(=O)NC(=O)OC 1458a_100000212188_100000010850 [0,2,0,0,0,0|1,0,1]=4 1407 B14R0.244 CCCCCC(=O)NN=C(C)C(=O)OC 4a_100000189784_100000211753 [0,2,0,0,0,0|2,0,0]=4 1408 B14R0.473 CCCCCC(C)C(=O)C=CC(=O)NC 1458a_100016259477_200011218191 [0,2,0,0,0,0|1,0,1]=4 1409 B14R0.473 CCCCCN(C)C(=O)C=CC(=O)NC 1626a_100000223495_100016259477 [0,2,0,0,0,0|2,0,0]=4 1410 B14R0.473 CCCCCN(C)C(=O)C=CC(=O)OC 1626a_100000223495_100016283253 [0,2,0,0,0,0|1,0,0]=3 1411 B14R0.473 COCCCN(C)C(=O)C=CC(=O)OC 1626a_100000224831_100016283253 [0,2,0,0,0,0|2,0,0]=4 1412 B14R0.198 COC(=O)/C=C/CSCCCC(C)(C)O 62a_100000742655_100009888830 [0,2,0,0,0,0|1,0,1]=4 1413 B14R0.198 COC(=O)/C=C/CSCCCC(C)(C)O 62a_100009888830_100000742655 [0,2,0,0,0,0|1,0,1]=4 1414 B14R0.1749 CNC(=O)C=CC(=O)CCCCC(C)C 1458a_100016259477_100011216152 [0,2,0,0,0,0|1,0,1]=4 1415 B14R0.1749 CNC(=O)C=CC(=O)NCCCC(C)C 1626a_200000737386_100016259477 [0,2,0,0,0,0|2,0,0]=4 1416 B14R0.1749 COC(=O)C=CC(=O)NCCCC(C)C 1626a_200000737386_100016283253 [0,2,0,0,0,0|1,0,0]=3 1417 B14R0.1749 COC(=O)C=CC(=O)NCCOC(C)C 1626a_100000701111_100016283253 [0,2,0,0,0,0|2,0,0]=4 1418 B14R0.1749 COC(=O)C=CC(=O)NCCSC(C)C 1626a_100000731138_100016283253 [0,2,0,0,0,0|2,0,0]=4 1419 B14R0.95 CCCCCNC/C(=C\C(=O)OC)/OC 2230a_100000209983_100016998490 [0,2,0,0,0,0|1,0,1]=4 1420 B14R0.95 CCCCCOC/C(=C\C(=O)OC)/OC 34a_100000210253_100016998490 [0,2,0,0,0,0|1,0,1]=4 1421 B14R0.95 CCCCCSC/C(=C\C(=O)OC)/OC 62a_100000210326_100016998490 [0,2,0,0,0,0|1,0,1]=4 1422 B14R0.95 CCCCCSC/C(=C\C(=O)OC)/OC 62a_100016998490_100000210326 [0,2,0,0,0,0|1,0,1]=4 1423 B14R0.143 CCCCCC=CC(=O)C(C)C(=O)CC 1458a_100016263427_100000742827 [0,2,0,0,0,0|1,0,1]=4 1424 B14R0.143 CCCCCC=CC(=O)C(C)C(=O)NC 1458a_100016263427_100000209862 [0,2,0,0,0,0|1,0,1]=4 1425 B14R0.143 CCCCCC=CC(=O)C(C)C(=O)OC 1458a_100016263427_100000211248 [0,2,0,0,0,0|0,0,1]=3 1426 B14R0.143 CCCCCC=CC(=O)C(F)C(=O)NC 1458a_100016263427_100009813575 [0,2,0,0,0,0|1,0,1]=4 1427 B14R0.341 C=C(CC(=O)OC)C(=O)NCCCCC 1626a_100000209983_100000040833 [0,2,0,0,0,0|1,0,1]=4 1428 B12R1.37 CCCCCC=Cc1cc[nH]n1 271570a_100000062253_100000062575 [1,0,0,1,0,0|2,0,0]=4 1429 B12R1.37 CCCCCC=Cc1ccco1 271570a_100000062253_100009814098 [1,0,0,1,0,0|2,0,0]=4 1430 B12R1.37 CCCCCC=Cc1cccs1 271570a_100000062253_100011215356 [1,0,0,1,0,0|2,0,0]=4 1431 B12R1.37 CCCCCC=Cc1ccoc1 271570a_100000062253_100011215275 [1,0,0,1,0,0|0,0,1]=3 1432 B12R1.37 CCCCCC=Cc1ccsc1 271570a_100000062253_100000738268 [1,0,0,1,0,0|0,1,1]=4 1433 B12R1.37 CCCCCC=Cc1ccsn1 271570a_100000062253_100009818082 [1,0,0,1,0,0|1,1,0]=4 1434 B12R1.37 CCCCCC=Cc1cnoc1 271570a_100000062253_100009815712 [1,0,0,1,0,0|1,0,1]=4 1435 B12R1.45 CCCNCc1occc1OC 207a_100020643023_200009856553 [1,0,0,1,0,0|2,0,0]=4 1436 B12R1.45 CCCNCc1occc1OC 270004a_100020643023_200009856553 [1,0,0,1,0,0|2,0,0]=4 1437 B12R1.45 CCCNCc1sccc1OC 207a_100020643023_100000689126 [1,0,0,1,0,0|2,0,0]=4 1438 B12R1.45 CCCNCc1sccc1OC 270004a_100020643023_100000689126 [1,0,0,1,0,0|2,0,0]=4 1439 B12R1.121 CCCCc1ccccc1CC 271570a_100020621405_100011215823 [1,0,0,1,0,0|1,0,1]=4 1440 B12R1.121 CCCCc1ccccc1NC 2230a_200011217597_200000210301 [1,0,0,1,0,0|1,0,1]=4 1441 B12R1.121 CCCCc1ccccc1NC 271570a_100020621405_100020606079 [1,0,0,1,0,0|1,0,1]=4 1442 B12R1.121 CCCCc1ccccc1NC 34a_200011217597_200000210301 [1,0,0,1,0,0|1,0,1]=4 1443 B12R1.121 CCCCc1ccccc1NC 7a_200011217597_200000210301 [1,0,0,1,0,0|1,0,1]=4 1444 B12R1.121 CCCCc1ccccc1N[13CH3] 2230a_200011217597_200025704644 [1,0,0,1,0,0|1,0,1]=4 1445 B12R1.121 CCCCc1ccccc1N[13CH3] 34a_200011217597_200025704644 [1,0,0,1,0,0|1,0,1]=4 1446 B12R1.121 CCCCc1ccccc1N[13CH3] 7a_200011217597_200025704644 [1,0,0,1,0,0|1,0,1]=4 1447 B12R1.121 CCCCc1ccccc1OC 271570a_100020621405_100000174000 [1,0,0,1,0,0|0,0,1]=3 1448 B12R1.121 CCCCc1ccccc1SC 271570a_100020621405_100011217816 [1,0,0,1,0,0|0,1,1]=4 1449 B12R1.121 CCCCc1cccnc1OC 271570a_100020621405_100000047025 [1,0,0,1,0,0|1,0,1]=4 1450 B12R1.121 CCCCc1ccncc1OC 271570a_100020621405_100016988167 [1,0,0,1,0,0|1,0,1]=4 1451 B12R1.121 CCCCc1cnccc1OC 271570a_100020621405_100011997281 [1,0,0,1,0,0|1,0,1]=4 1452 B12R1.121 CCCCc1ncccc1OC 271570a_100020621405_100000690851 [1,0,0,1,0,0|1,0,1]=4 1453 B12R1.121 CCCNc1ccccc1OC 34a_100000210025_100000210303 [1,0,0,1,0,0|1,0,1]=4 1454 B12R1.121 CCCOc1ccccc1OC 34a_100000180214_200000210301 [1,0,0,1,0,0|1,0,1]=4 1455 B12R1.121 CCCOc1ccccc1OC 34a_100000210385_100000210303 [1,0,0,1,0,0|1,0,1]=4 1456 B12R1.121 CCCOc1ccccc1OC 7a_100000180214_200000210301 [1,0,0,1,0,0|1,0,1]=4 1457 B12R1.121 CCCOc1ccccc1O[13CH3] 34a_100000180214_200025704644 [1,0,0,1,0,0|1,0,1]=4 1458 B12R1.121 CCCOc1ccccc1O[13CH3] 7a_100000180214_200025704644 [1,0,0,1,0,0|1,0,1]=4 1459 B12R1.121 CCCSc1ccccc1OC 62a_100000210303_100000210334 [1,0,0,1,0,0|1,0,1]=4 1460 B12R1.121 CCCSc1ccccc1OC 62a_100000210334_100000210303 [1,0,0,1,0,0|1,0,1]=4 1461 B12R1.121 CCNCc1ccccc1OC 207a_100015525214_100000169842 [1,0,0,1,0,0|1,0,1]=4 1462 B12R1.121 CCNCc1ccccc1OC 2230a_100015525214_100000210004 [1,0,0,1,0,0|1,0,1]=4 1463 B12R1.121 CCNCc1ccccc1OC 270004a_100015525214_100000169842 [1,0,0,1,0,0|1,0,1]=4 1464 B12R1.121 CCNCc1ccccc1OC 34a_100000188900_100000210202 [1,0,0,1,0,0|1,0,1]=4 1465 B12R1.121 CCOCc1ccccc1OC 34a_100000211301_100000210202 [1,0,0,1,0,0|1,0,1]=4 1466 B12R1.121 CCOCc1ccccc1OC 34a_100121572206_100000210004 [1,0,0,1,0,0|1,0,1]=4 1467 B12R1.121 CCSCc1ccccc1OC 62a_100000210004_100000210202 [1,0,0,1,0,0|1,0,1]=4 1468 B12R1.121 CCSCc1ccccc1OC 62a_100000210202_100000210004 [1,0,0,1,0,0|1,0,1]=4 1469 B12R1.121 CNCCc1ccccc1OC 2230a_100000211851_200000210301 [1,0,0,1,0,0|1,0,1]=4 1470 B12R1.121 CNCCc1ccccc1OC 2230a_106832991635_100011713687 [1,0,0,1,0,0|1,0,1]=4 1471 B12R1.121 CNCCc1ccccc1OC 270004a_106832991635_100011713418 [1,0,0,1,0,0|1,0,1]=4 1472 B12R1.121 CNCCc1ccccc1OC 34a_100000211851_200000210301 [1,0,0,1,0,0|1,0,1]=4 1473 B12R1.121 CNCCc1ccccc1OC 34a_100102657272_100011713687 [1,0,0,1,0,0|1,0,1]=4 1474 B12R1.121 CNCCc1ccccc1OC 7a_106832991635_100011713687 [1,0,0,1,0,0|1,0,1]=4 1475 B12R1.121 COCCc1ccccc1OC 34a_100000722730_200000210301 [1,0,0,1,0,0|1,0,1]=4 1476 B12R1.121 COCCc1ccccc1OC 34a_100011218620_200000210301 [1,0,0,1,0,0|1,0,1]=4 1477 B12R1.121 COCCc1ccccc1OC 34a_100138415774_100011713687 [1,0,0,1,0,0|1,0,1]=4 1478 B12R1.121 COCCc1ccccc1OC 7a_100000722730_200000210301 [1,0,0,1,0,0|1,0,1]=4 1479 B12R1.121 COCCc1ccccc1OC 7a_100011218620_200000210301 [1,0,0,1,0,0|1,0,1]=4 1480 B12R1.121 COCCc1ccccc1O[13CH3] 34a_100000722730_200025704644 [1,0,0,1,0,0|1,0,1]=4 1481 B12R1.121 COCCc1ccccc1O[13CH3] 7a_100000722730_200025704644 [1,0,0,1,0,0|1,0,1]=4 1482 B12R1.121 COc1ccccc1CCN[13CH3] 2230a_100000211851_200025704644 [1,0,0,1,0,0|1,0,1]=4 1483 B12R1.121 COc1ccccc1CCN[13CH3] 34a_100000211851_200025704644 [1,0,0,1,0,0|1,0,1]=4 1484 B12R1.121 COc1ccccc1CCO[13CH3] 34a_100011218620_200025704644 [1,0,0,1,0,0|1,0,1]=4 1485 B12R1.121 COc1ccccc1CCO[13CH3] 7a_100011218620_200025704644 [1,0,0,1,0,0|1,0,1]=4 1486 B12R1.121 COc1ccccc1CCSC 62a_100011713687_200000210301 [1,0,0,1,0,0|1,0,1]=4 1487 B12R1.121 COc1ccccc1CCSC 62a_200000210301_100011713687 [1,0,0,1,0,0|1,0,1]=4 1488 B12R1.121 COc1ccccc1CCS[13CH3] 62a_100011713687_200025704644 [1,0,0,1,0,0|1,0,1]=4 1489 B12R1.121 COc1ccccc1CCS[13CH3] 62a_200025704644_100011713687 [1,0,0,1,0,0|1,0,1]=4 1490 B12R1.267 CCCCNc1ccccc1C 34a_100015192222_100000210210 [1,0,0,1,0,0|2,0,0]=4 1491 B12R1.267 CCCCOc1ccccc1C 34a_100000210338_100000210210 [1,0,0,1,0,0|2,0,0]=4 1492 B12R1.267 CCCCOc1ccccc1C 7a_100000210338_100000210211 [1,0,0,1,0,0|2,0,0]=4 1493 B12R1.267 CCCCSc1cccc[n+]1C 62a_100000210211_100000212160 [1,0,0,1,0,0|2,0,0]=4 1494 B12R1.267 CCCCSc1ccccc1C 62a_100000210211_100000210755 [1,0,0,1,0,0|2,0,0]=4 1495 B12R1.267 CCCCSc1ccccc1C 62a_100000210755_100000210210 [1,0,0,1,0,0|2,0,0]=4 1496 B12R1.267 CCCNCc1ccccc1C 207a_100020643023_100000211143 [1,0,0,1,0,0|2,0,0]=4 1497 B12R1.267 CCCNCc1ccccc1C 270004a_100020643023_100000211143 [1,0,0,1,0,0|2,0,0]=4 1498 B12R1.267 CCCNCc1ccccc1C 34a_100000174972_100000210303 [1,0,0,1,0,0|2,0,0]=4 1499 B12R1.267 CCCOCc1ccccc1C 34a_100000210258_100000211839 [1,0,0,1,0,0|2,0,0]=4 1500 B12R1.267 CCCOCc1ccccc1C 34a_100000698903_100000210303 [1,0,0,1,0,0|2,0,0]=4 1501 B12R1.267 CCCOCc1ccccc1C 7a_100000698903_100000210303 [1,0,0,1,0,0|2,0,0]=4 1502 B12R1.267 CCCSCc1ccccc1C 62a_100000210303_100000211839 [1,0,0,1,0,0|2,0,0]=4 1503 B12R1.267 CCCSCc1ccccc1C 62a_100000211839_100000210303 [1,0,0,1,0,0|2,0,0]=4 1504 B12R1.267 CCNCCc1ccccc1C 2230a_100000685071_100000210202 [1,0,0,1,0,0|2,0,0]=4 1505 B12R1.267 CCNCCc1ccccc1C 2230a_100015525214_100011713688 [1,0,0,1,0,0|2,0,0]=4 1506 B12R1.267 CCNCCc1ccccc1C 34a_100000685071_100000210202 [1,0,0,1,0,0|2,0,0]=4 1507 B12R1.267 CCOCCc1ccccc1C 34a_100011220023_100000210202 [1,0,0,1,0,0|2,0,0]=4 1508 B12R1.267 CCOCCc1ccccc1C 34a_100121572206_100011713688 [1,0,0,1,0,0|2,0,0]=4 1509 B12R1.267 CCOCCc1ccccc1C 7a_100011220023_100000210202 [1,0,0,1,0,0|2,0,0]=4 1510 B12R1.267 CCSCCc1ccccc1C 62a_100000210202_100011713688 [1,0,0,1,0,0|2,0,0]=4 1511 B12R1.267 CCSCCc1ccccc1C 62a_100011713688_100000210202 [1,0,0,1,0,0|2,0,0]=4 1512 B12R1.7 CCCCOCC1=CC(=O)OC1 34a_100000210227_100000716558 [1,0,0,1,0,0|1,0,1]=4 1513 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000210211_100000716558 [1,0,0,1,0,0|1,0,1]=4 1514 B12R1.7 CCCCSCC1=CC(=O)OC1 62a_100000716558_100000210210 [1,0,0,1,0,0|1,0,1]=4 1515 B12R1.25 CCCCc1cccc(=O)n1C 271570a_100020621405_100000726605 [1,0,0,1,0,0|1,0,0]=3 1516 B12R1.25 CCCCc1cccc(c1C)Br 271570a_100020621405_100012353703 [1,0,0,1,0,0|2,0,0]=4 1517 B12R1.25 CCCCc1cccc(c1C)C 271570a_100020621405_100011214922 [1,0,0,1,0,0|2,0,0]=4 1518 B12R1.25 CCCCc1cccc(c1C)Cl 271570a_100020621405_100000726075 [1,0,0,1,0,0|2,0,0]=4 1519 B12R1.25 CCCCc1cccc(c1C)F 271570a_100020621405_100011216893 [1,0,0,1,0,0|2,0,0]=4 1520 B12R1.25 CCCCc1cccc(c1C)N 271570a_100020621405_100000761887 [1,0,0,1,0,0|2,0,0]=4 1521 B12R1.25 CCCCc1cccc(c1C)O 271570a_100020621405_100012002258 [1,0,0,1,0,0|1,0,1]=4 1522 B12R1.25 CCCSc1cccc(=O)n1C 62a_100000210303_100000726605 [1,0,0,1,0,0|2,0,0]=4 1523 B12R1.25 CCCSc1cccc(=O)n1C 62a_100000726605_100000210303 [1,0,0,1,0,0|2,0,0]=4 1524 B12R1.27 CCC(=O)C=CC1=CCCCC1 1458a_100016289660_100000210202 [1,0,0,1,0,0|1,0,0]=3 1525 B12R1.27 CCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210202 [1,0,0,1,0,0|1,0,1]=4 1526 B12R1.27 CNC(=O)C=CC1=CCCCC1 1626a_100102657272_100016289660 [1,0,0,1,0,0|1,0,0]=3 1527 B12R1.27 CNC(=O)C=CC1=CCCCC1 240690a_100102657272_100016289660 [1,0,0,1,0,0|1,0,0]=3 1528 B12R1.27 CNC(=O)C=CC1CCCCC1 11a_106832991635_100102566626 [1,0,0,1,0,0|1,0,1]=4 1529 B12R1.27 CNC(=O)C=CC1CCCCC1 1626a_100102657272_100102566626 [1,0,0,1,0,0|1,0,1]=4 1530 B12R1.27 CNC(=O)C=CC1CCCCC1 240690a_100102657272_100102566626 [1,0,0,1,0,0|1,0,1]=4 1531 B12R1.27 O=C(C=CC1=CCCCC1)CF 1458a_100016289660_100015361967 [1,0,0,1,0,0|2,0,0]=4 1532 B12R1.356 COC(=O)/C=C/CNC1CCC1 2230a_100000749019_100000742655 [1,0,0,1,0,0|1,0,1]=4 1533 B12R1.356 COC(=O)/C=C/CNC1CCC1 34a_100000749019_100000742655 [1,0,0,1,0,0|1,0,1]=4 1534 B12R1.356 COC(=O)/C=C/COC1CCC1 34a_100000748187_100000742655 [1,0,0,1,0,0|1,0,1]=4 1535 B12R1.356 COC(=O)/C=C/CSC1CCC1 62a_100000742655_100000749161 [1,0,0,1,0,0|1,0,1]=4 1536 B12R1.356 COC(=O)C=NNCC1CCC1 4a_200020586977_200011823558 [1,0,0,1,0,0|2,0,0]=4 1537 B12R1.360 COC(=O)/C=C/CNCC1CC1 2230a_100000735609_100000742655 [1,0,0,1,0,0|1,0,1]=4 1538 B12R1.360 COC(=O)/C=C/CNCC1CC1 34a_100000735609_100000742655 [1,0,0,1,0,0|1,0,1]=4 1539 B12R1.360 COC(=O)/C=C/COCC1CC1 34a_100000211283_100000742655 [1,0,0,1,0,0|1,0,1]=4 1540 B12R1.360 COC(=O)/C=C/CSCC1CC1 62a_100000742655_100000742324 [1,0,0,1,0,0|1,0,1]=4 1541 B12R1.360 COC(=O)/C=C/CSCC1CC1 62a_100000756562_100000742655 [1,0,0,1,0,0|1,0,1]=4 1542 B12R1.360 COC(=O)C=CC=NNC1CC1 4a_100000701032_100016254430 [1,0,0,1,0,0|2,0,0]=4 1543 B12R1.364 COC(=O)/C=C/CN1CCC1C 269982a_100000755817_100000742655 [1,0,0,1,0,0|1,0,1]=4 1544 B12R1.364 COC(=O)/C=C/CN1CCC1C 34a_100000755817_100000742655 [1,0,0,1,0,0|1,0,1]=4 1545 B12R1.382 CCCCc1cc(ccn1)OC 271570a_100020621405_100011216251 [1,0,0,1,0,0|2,0,0]=4 1546 B12R1.382 CCCCc1cccc(c1)CC 271570a_100020621405_100000684523 [1,0,0,1,0,0|2,0,0]=4 1547 B12R1.382 CCCCc1cccc(c1)NC 2230a_200012017287_200000210301 [1,0,0,1,0,0|2,0,0]=4 1548 B12R1.382 CCCCc1cccc(c1)NC 271570a_100020621405_100000219648 [1,0,0,1,0,0|2,0,0]=4 1549 B12R1.382 CCCCc1cccc(c1)NC 34a_200012017287_200000210301 [1,0,0,1,0,0|2,0,0]=4 1550 B12R1.382 CCCCc1cccc(c1)NC 7a_200012017287_200000210301 [1,0,0,1,0,0|2,0,0]=4 1551 B12R1.382 CCCCc1cccc(c1)N[13CH3] 2230a_200012017287_200025704644 [1,0,0,1,0,0|2,0,0]=4 1552 B12R1.382 CCCCc1cccc(c1)N[13CH3] 34a_200012017287_200025704644 [1,0,0,1,0,0|2,0,0]=4 1553 B12R1.382 CCCCc1cccc(c1)N[13CH3] 7a_200012017287_200025704644 [1,0,0,1,0,0|2,0,0]=4 1554 B12R1.382 CCCCc1cccc(c1)OC 271570a_100020621405_100000170001 [1,0,0,1,0,0|1,0,0]=3 1555 B12R1.382 CCCCc1cccc(c1)SC 271570a_100020621405_100011215954 [1,0,0,1,0,0|1,1,0]=4 1556 B12R1.382 CCCCc1cccc(c1)SC 62a_200000210301_200010244551 [1,0,0,1,0,0|1,1,0]=4 1557 B12R1.382 CCCCc1cccc(c1)SC 62a_200010244551_200000210301 [1,0,0,1,0,0|1,1,0]=4 1558 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200010244551_200025704644 [1,0,0,1,0,0|1,1,0]=4 1559 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200025704644_200010244551 [1,0,0,1,0,0|1,1,0]=4 1560 B12R1.382 CCCCc1cccc(n1)CC 271570a_100020621405_100009856026 [1,0,0,1,0,0|2,0,0]=4 1561 B12R1.382 CCCCc1cccc(n1)NC 271570a_100020621405_100000703281 [1,0,0,1,0,0|2,0,0]=4 1562 B12R1.382 CCCCc1cccc(n1)OC 271570a_100020621405_100000760917 [1,0,0,1,0,0|1,0,0]=3 1563 B12R1.382 CCCCc1cccc(n1)SC 271570a_100020621405_100011960944 [1,0,0,1,0,0|1,1,0]=4 1564 B12R1.382 CCCCc1ccnc(c1)OC 271570a_100020621405_100000117307 [1,0,0,1,0,0|2,0,0]=4 1565 B12R1.382 CCCCc1ccnc(n1)OC 271570a_100020621405_100000069072 [1,0,0,1,0,0|2,0,0]=4 1566 B12R1.382 CCCCc1cncc(c1)OC 271570a_100020621405_100000684773 [1,0,0,1,0,0|2,0,0]=4 1567 B12R1.382 CCCCc1cncc(n1)OC 271570a_100020621405_100000756030 [1,0,0,1,0,0|2,0,0]=4 1568 B12R1.382 CCCCc1nccc(n1)OC 271570a_100020621405_100000182009 [1,0,0,1,0,0|2,0,0]=4 1569 B12R1.382 CCCNc1cccc(c1)OC 34a_100000210024_100000210303 [1,0,0,1,0,0|2,0,0]=4 1570 B12R1.382 CCCOc1cccc(c1)OC 34a_100000211255_100000210303 [1,0,0,1,0,0|2,0,0]=4 1571 B12R1.382 CCCOc1cccc(c1)OC 34a_100000748497_200000210301 [1,0,0,1,0,0|2,0,0]=4 1572 B12R1.382 CCCOc1cccc(c1)OC 7a_100000211255_100000210303 [1,0,0,1,0,0|2,0,0]=4 1573 B12R1.382 CCCOc1cccc(c1)OC 7a_100000748497_200000210301 [1,0,0,1,0,0|2,0,0]=4 1574 B12R1.382 CCCOc1cccc(c1)O[13CH3] 34a_100000748497_200025704644 [1,0,0,1,0,0|2,0,0]=4 1575 B12R1.382 CCCOc1cccc(c1)O[13CH3] 7a_100000748497_200025704644 [1,0,0,1,0,0|2,0,0]=4 1576 B12R1.382 CCCSc1cccc(c1)OC 62a_100000210303_100000170001 [1,0,0,1,0,0|2,0,0]=4 1577 B12R1.382 CCCSc1cccc(n1)OC 62a_100000210303_100000760917 [1,0,0,1,0,0|2,0,0]=4 1578 B12R1.382 CCCSc1cccc(n1)OC 62a_100000760917_100000210303 [1,0,0,1,0,0|2,0,0]=4 1579 B12R1.382 CCNCc1cccc(c1)OC 207a_100015525214_100000170238 [1,0,0,1,0,0|2,0,0]=4 1580 B12R1.382 CCNCc1cccc(c1)OC 2230a_100000174954_100000210202 [1,0,0,1,0,0|2,0,0]=4 1581 B12R1.382 CCNCc1cccc(c1)OC 2230a_100015525214_100000211672 [1,0,0,1,0,0|2,0,0]=4 1582 B12R1.382 CCNCc1cccc(c1)OC 270004a_100015525214_100000170238 [1,0,0,1,0,0|2,0,0]=4 1583 B12R1.382 CCNCc1cccc(c1)OC 34a_100000174954_100000210202 [1,0,0,1,0,0|2,0,0]=4 1584 B12R1.382 CCNCc1cccc(c1)OC 34a_100000201218_200000210301 [1,0,0,1,0,0|2,0,0]=4 1585 B12R1.382 CCNCc1cccc(c1)O[13CH3] 34a_100000201218_200025704644 [1,0,0,1,0,0|2,0,0]=4 1586 B12R1.382 CCNCc1cccc(n1)OC 207a_100015525214_100000694346 [1,0,0,1,0,0|2,0,0]=4 1587 B12R1.382 CCNCc1cccc(n1)OC 2230a_100000746380_100000210202 [1,0,0,1,0,0|2,0,0]=4 1588 B12R1.382 CCNCc1cccc(n1)OC 2230a_100015525214_100000755263 [1,0,0,1,0,0|2,0,0]=4 1589 B12R1.382 CCNCc1cccc(n1)OC 270004a_100015525214_100000694346 [1,0,0,1,0,0|2,0,0]=4 1590 B12R1.382 CCOCc1cccc(c1)OC 34a_100000198976_100000210202 [1,0,0,1,0,0|2,0,0]=4 1591 B12R1.382 CCOCc1cccc(c1)OC 34a_100121572206_100000688526 [1,0,0,1,0,0|2,0,0]=4 1592 B12R1.382 CCOCc1cccc(n1)OC 34a_100121572206_100000755263 [1,0,0,1,0,0|2,0,0]=4 1593 B12R1.382 CCSCc1cccc(c1)OC 62a_100000210202_100000211672 [1,0,0,1,0,0|2,0,0]=4 1594 B12R1.382 CCSCc1cccc(c1)OC 62a_100000688526_100000210202 [1,0,0,1,0,0|2,0,0]=4 1595 B12R1.382 CCSCc1cccc(n1)OC 62a_100000210202_100000755263 [1,0,0,1,0,0|2,0,0]=4 1596 B12R1.382 CCSCc1cccc(n1)OC 62a_100000755263_100000210202 [1,0,0,1,0,0|2,0,0]=4 1597 B12R1.382 CNCCc1cccc(c1)OC 2230a_100000740386_200000210301 [1,0,0,1,0,0|2,0,0]=4 1598 B12R1.382 CNCCc1cccc(c1)OC 2230a_106832991635_100011713679 [1,0,0,1,0,0|2,0,0]=4 1599 B12R1.382 CNCCc1cccc(c1)OC 34a_100000740386_200000210301 [1,0,0,1,0,0|2,0,0]=4 1600 B12R1.382 CNCCc1cccc(c1)OC 34a_100102657272_100011713679 [1,0,0,1,0,0|2,0,0]=4 1601 B12R1.382 CNCCc1cccc(c1)OC 7a_106832991635_100011713679 [1,0,0,1,0,0|2,0,0]=4 1602 B12R1.382 COCCc1cccc(c1)OC 34a_100011215300_200000210301 [1,0,0,1,0,0|2,0,0]=4 1603 B12R1.382 COCCc1cccc(c1)OC 34a_100138415774_100011713679 [1,0,0,1,0,0|2,0,0]=4 1604 B12R1.382 COCCc1cccc(c1)OC 7a_100011215300_200000210301 [1,0,0,1,0,0|2,0,0]=4 1605 B12R1.382 COc1cccc(c1)CCCO 34a_200011999501_200000210301 [1,0,0,1,0,0|2,0,0]=4 1606 B12R1.382 COc1cccc(c1)CCCO 7a_200011999501_200000210301 [1,0,0,1,0,0|2,0,0]=4 1607 B12R1.382 COc1cccc(c1)CCN[13CH3] 2230a_100000740386_200025704644 [1,0,0,1,0,0|2,0,0]=4 1608 B12R1.382 COc1cccc(c1)CCN[13CH3] 34a_100000740386_200025704644 [1,0,0,1,0,0|2,0,0]=4 1609 B12R1.382 COc1cccc(c1)CCO[13CH3] 34a_100011215300_200025704644 [1,0,0,1,0,0|2,0,0]=4 1610 B12R1.382 COc1cccc(c1)CCO[13CH3] 7a_100011215300_200025704644 [1,0,0,1,0,0|2,0,0]=4 1611 B12R1.382 COc1cccc(c1)CCSC 62a_100011713679_200000210301 [1,0,0,1,0,0|2,0,0]=4 1612 B12R1.382 COc1cccc(c1)CCSC 62a_200000210301_100011713679 [1,0,0,1,0,0|2,0,0]=4 1613 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_100011713679_200025704644 [1,0,0,1,0,0|2,0,0]=4 1614 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713679 [1,0,0,1,0,0|2,0,0]=4 1615 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 34a_200011999501_200025704644 [1,0,0,1,0,0|2,0,0]=4 1616 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 7a_200011999501_200025704644 [1,0,0,1,0,0|2,0,0]=4 1617 B12R1.477 COC(=O)/C=C/CN1CCCC1 2230a_100000188435_100000742655 [1,0,0,1,0,0|1,0,1]=4 1618 B12R1.477 COC(=O)/C=C/CN1CCCC1 269982a_100000188435_100000742655 [1,0,0,1,0,0|1,0,1]=4 1619 B12R1.477 COC(=O)C=NNC1CCCC1 4a_100000737850_200011823558 [1,0,0,1,0,0|2,0,0]=4 1620 B12R1.1748 CCC(=O)C=C1CCCCCC1 1458a_100011240665_100000210202 [1,0,0,1,0,0|1,0,1]=4 1621 B12R1.1748 CNC(=O)C=C1CCCCCC1 11a_106832991635_100011240665 [1,0,0,1,0,0|1,0,1]=4 1622 B12R1.1748 CNC(=O)C=C1CCCCCC1 1626a_100102657272_100011240665 [1,0,0,1,0,0|1,0,1]=4 1623 B12R1.1748 CNC(=O)C=C1CCCCCC1 240690a_100102657272_100011240665 [1,0,0,1,0,0|1,0,1]=4 1624 B12R1.28 CCCCNc1cccc(c1)C 2230a_100000188690_100000210211 [1,0,0,1,0,0|2,0,0]=4 1625 B12R1.28 CCCCNc1cccc(c1)C 34a_100000188690_100000210210 [1,0,0,1,0,0|2,0,0]=4 1626 B12R1.28 CCCCNc1cccc(c1)O 34a_100000210217_100000210210 [1,0,0,1,0,0|2,0,0]=4 1627 B12R1.28 CCCCOc1cccc(=O)[nH]1 34a_100000033347_100000210210 [1,0,0,1,0,0|2,0,0]=4 1628 B12R1.28 CCCCOc1cccc(c1)C 34a_100000210337_100000210210 [1,0,0,1,0,0|2,0,0]=4 1629 B12R1.28 CCCCOc1cccc(c1)C 7a_100000210337_100000210211 [1,0,0,1,0,0|2,0,0]=4 1630 B12R1.28 CCCCOc1cccc(c1)O 271570a_203496583355_200011212284 [1,0,0,1,0,0|2,0,0]=4 1631 B12R1.28 CCCCOc1cccc(n1)O 271570a_203496583355_200011960251 [1,0,0,1,0,0|2,0,0]=4 1632 B12R1.28 CCCCSc1cccc(=O)[nH]1 62a_100000210211_100000752884 [1,0,0,1,0,0|2,0,0]=4 1633 B12R1.28 CCCCSc1cccc(c1)C 62a_100000210211_100011215228 [1,0,0,1,0,0|2,0,0]=4 1634 B12R1.28 CCCCSc1cccc(c1)C 62a_100011215228_100000210210 [1,0,0,1,0,0|2,0,0]=4 1635 B12R1.28 CCCCSc1cccc(c1)O 271570a_203496583355_100010128134 [1,0,0,1,0,0|2,0,0]=4 1636 B12R1.28 CCCCSc1cccc(c1)O 62a_100000210211_100000211634 [1,0,0,1,0,0|2,0,0]=4 1637 B12R1.28 CCCCSc1cccc(n1)C 62a_100000210211_100000742759 [1,0,0,1,0,0|2,0,0]=4 1638 B12R1.28 CCCCSc1cccc(n1)C 62a_100000742759_100000210210 [1,0,0,1,0,0|2,0,0]=4 1639 B12R1.28 CCCNCc1cccc(=O)[nH]1 207a_100020643023_100011935257 [1,0,0,1,0,0|2,0,0]=4 1640 B12R1.28 CCCNCc1cccc(=O)[nH]1 2230a_100000696482_100000210303 [1,0,0,1,0,0|2,0,0]=4 1641 B12R1.28 CCCNCc1cccc(c1)C 207a_100020643023_100000211157 [1,0,0,1,0,0|2,0,0]=4 1642 B12R1.28 CCCNCc1cccc(c1)C 2230a_100000185548_100000210303 [1,0,0,1,0,0|2,0,0]=4 1643 B12R1.28 CCCNCc1cccc(c1)C 270004a_100020643023_100000211157 [1,0,0,1,0,0|2,0,0]=4 1644 B12R1.28 CCCNCc1cccc(c1)C 34a_100000185548_100000210303 [1,0,0,1,0,0|2,0,0]=4 1645 B12R1.28 CCCNCc1cccc(c1)O 207a_100020643023_100000188321 [1,0,0,1,0,0|2,0,0]=4 1646 B12R1.28 CCCNCc1cccc(c1)O 2230a_100000743036_100000210303 [1,0,0,1,0,0|2,0,0]=4 1647 B12R1.28 CCCNCc1cccc(c1)O 270004a_100020643023_100000188321 [1,0,0,1,0,0|2,0,0]=4 1648 B12R1.28 CCCNCc1cccc(c1)O 271570a_203496583355_100015184641 [1,0,0,1,0,0|2,0,0]=4 1649 B12R1.28 CCCNCc1cccc(c1)O 34a_100000743036_100000210303 [1,0,0,1,0,0|2,0,0]=4 1650 B12R1.28 CCCNCc1cccc(n1)C 207a_100020643023_100011215050 [1,0,0,1,0,0|2,0,0]=4 1651 B12R1.28 CCCNCc1cccc(n1)C 270004a_100020643023_100011215050 [1,0,0,1,0,0|2,0,0]=4 1652 B12R1.28 CCCNCc1cccc(n1)C 34a_100000701342_100000210303 [1,0,0,1,0,0|2,0,0]=4 1653 B12R1.28 CCCOCc1cccc(c1)C 34a_100000210258_100000211840 [1,0,0,1,0,0|2,0,0]=4 1654 B12R1.28 CCCOCc1cccc(c1)C 34a_100011217746_100000210303 [1,0,0,1,0,0|2,0,0]=4 1655 B12R1.28 CCCOCc1cccc(c1)C 7a_100011217746_100000210303 [1,0,0,1,0,0|2,0,0]=4 1656 B12R1.28 CCCOCc1cccc(c1)O 34a_100000210258_100011660834 [1,0,0,1,0,0|2,0,0]=4 1657 B12R1.28 CCCOCc1cccc(n1)C 34a_100000210258_100000757606 [1,0,0,1,0,0|2,0,0]=4 1658 B12R1.28 CCCOCc1cccc(n1)C 34a_100000690600_100000210303 [1,0,0,1,0,0|2,0,0]=4 1659 B12R1.28 CCCSCc1cccc(c1)C 62a_100000210303_100000211840 [1,0,0,1,0,0|2,0,0]=4 1660 B12R1.28 CCCSCc1cccc(c1)C 62a_100000211840_100000210303 [1,0,0,1,0,0|2,0,0]=4 1661 B12R1.28 CCCSCc1cccc(c1)O 62a_100000210303_100011660834 [1,0,0,1,0,0|2,0,0]=4 1662 B12R1.28 CCCSCc1cccc(c1)O 62a_100011660834_100000210303 [1,0,0,1,0,0|2,0,0]=4 1663 B12R1.28 CCCSCc1cccc(n1)C 62a_100000210303_100000757606 [1,0,0,1,0,0|2,0,0]=4 1664 B12R1.28 CCCSCc1cccc(n1)C 62a_100000757606_100000210303 [1,0,0,1,0,0|2,0,0]=4 1665 B12R1.28 CCNCCc1cccc(c1)C 2230a_100000749837_100000210202 [1,0,0,1,0,0|2,0,0]=4 1666 B12R1.28 CCNCCc1cccc(c1)C 2230a_100015525214_100011713685 [1,0,0,1,0,0|2,0,0]=4 1667 B12R1.28 CCNCCc1cccc(c1)C 34a_100000749837_100000210202 [1,0,0,1,0,0|2,0,0]=4 1668 B12R1.28 CCNCCc1cccc(c1)O 2230a_100000747277_100000210202 [1,0,0,1,0,0|2,0,0]=4 1669 B12R1.28 CCNCCc1cccc(c1)O 34a_100000747277_100000210202 [1,0,0,1,0,0|2,0,0]=4 1670 B12R1.28 CCNCCc1cccc(n1)C 2230a_100011824523_100000210202 [1,0,0,1,0,0|2,0,0]=4 1671 B12R1.28 CCNCCc1cccc(n1)C 34a_100011824523_100000210202 [1,0,0,1,0,0|2,0,0]=4 1672 B12R1.28 CCOCCc1cccc(c1)C 34a_100011217157_100000210202 [1,0,0,1,0,0|2,0,0]=4 1673 B12R1.28 CCOCCc1cccc(c1)C 34a_100121572206_100011713685 [1,0,0,1,0,0|2,0,0]=4 1674 B12R1.28 CCOCCc1cccc(c1)C 7a_100011217157_100000210202 [1,0,0,1,0,0|2,0,0]=4 1675 B12R1.28 CCSCCc1cccc(c1)C 62a_100000210202_100011713685 [1,0,0,1,0,0|2,0,0]=4 1676 B12R1.28 CCSCCc1cccc(c1)C 62a_100011713685_100000210202 [1,0,0,1,0,0|2,0,0]=4 1677 B12R1.28 CNCCCc1cccc(c1)C 2230a_103496528808_200000210301 [1,0,0,1,0,0|2,0,0]=4 1678 B12R1.28 CNCCCc1cccc(c1)C 34a_103496528808_200000210301 [1,0,0,1,0,0|2,0,0]=4 1679 B12R1.28 COCCCc1cccc(n1)C 34a_100000211354_200000210301 [1,0,0,1,0,0|2,0,0]=4 1680 B12R1.28 Cc1cccc(c1)CCCN[13CH3] 2230a_103496528808_200025704644 [1,0,0,1,0,0|2,0,0]=4 1681 B12R1.28 Cc1cccc(c1)CCCN[13CH3] 34a_103496528808_200025704644 [1,0,0,1,0,0|2,0,0]=4 1682 B12R1.28 Cc1cccc(n1)CCCO[13CH3] 34a_100000211354_200025704644 [1,0,0,1,0,0|2,0,0]=4 1683 B12R1.252 CC(=O)C=CCN1CCCCC1 1458a_100015232380_200000210301 [1,0,0,1,0,0|1,0,1]=4 1684 B12R1.252 [13CH3]C(=O)C=CCN1CCCCC1 1458a_100015232380_200025704644 [1,0,0,1,0,0|1,0,1]=4 1685 B12R1.386 CCCCC1C=CCN1C(=O)C 11a_100015184376_100015343762 [1,0,0,1,0,0|1,0,1]=4 1686 B12R1.386 CCCCC1C=CCN1C(=O)C 1626a_100015184376_100015343762 [1,0,0,1,0,0|1,0,1]=4 1687 B12R1.386 CCCCC1C=CCN1C(=O)C 240690a_100015184376_100015343762 [1,0,0,1,0,0|1,0,1]=4 1688 B12R1.386 CCCCC1C=CCN1C(=O)C 527a_100015184376_100103153847 [1,0,0,1,0,0|1,0,1]=4 1689 B12R1.386 CCCCc1ccsc1C(=O)C 271570a_100020621405_100000738688 [1,0,0,1,0,0|1,0,1]=4 1690 B14R1.26 CCCCCC=Cc1cc[nH]c(=O)c1 271570a_100000062253_100009816521 [0,1,0,1,0,0|1,0,1]=4 1691 B14R1.26 CCCCCC=Cc1cn[nH]c(=O)c1 271570a_100000062253_100010197405 [0,1,0,1,0,0|1,0,1]=4 1692 B14R1.609 CCOC(=O)/C=C/CNC1CCCC1 2230a_100000211070_100016267167 [0,1,0,1,0,0|1,0,1]=4 1693 B14R1.609 CCOC(=O)/C=C/CNC1CCCC1 34a_100000211070_100016267167 [0,1,0,1,0,0|1,0,1]=4 1694 B14R1.609 CCOC(=O)/C=C/COC1CCCC1 34a_100000210269_100016267167 [0,1,0,1,0,0|1,0,1]=4 1695 B14R1.609 CCOC(=O)/C=C/COC1CCCC1 7a_100000210269_100016267167 [0,1,0,1,0,0|1,0,1]=4 1696 B14R1.609 CCOC(=O)/C=C/CSC1CCCC1 62a_100011217020_100016267167 [0,1,0,1,0,0|1,0,1]=4 1697 B14R1.609 CCOC(=O)/C=C/CSC1CCCC1 62a_100016267167_100000179811 [0,1,0,1,0,0|1,0,1]=4 1698 B14R1.611 CCOC(=O)/C=C/COCC1CC1C 34a_100000744939_100016267167 [0,1,0,1,0,0|1,0,1]=4 1699 B14R1.611 CCOC(=O)/C=C/COCC1CC1C 7a_100000744939_100016267167 [0,1,0,1,0,0|1,0,1]=4 1700 B14R1.612 CCOC(=O)/C=C/CNCC1CCC1 2230a_100000738700_100016267167 [0,1,0,1,0,0|1,0,1]=4 1701 B14R1.612 CCOC(=O)/C=C/CNCC1CCC1 34a_100000738700_100016267167 [0,1,0,1,0,0|1,0,1]=4 1702 B14R1.612 CCOC(=O)/C=C/COCC1CCC1 34a_100000760304_100016267167 [0,1,0,1,0,0|1,0,1]=4 1703 B14R1.612 CCOC(=O)/C=C/CSCC1CCC1 62a_100000763275_100016267167 [0,1,0,1,0,0|1,0,1]=4 1704 B14R1.612 CCOC(=O)/C=C/CSCC1CCC1 62a_100016267167_100000763275 [0,1,0,1,0,0|1,0,1]=4 1705 B14R1.612 CCOC(=O)C=CC=NNC1CCC1 4a_100000736358_100016289910 [0,1,0,1,0,0|2,0,0]=4 1706 B14R1.635 CCCCC1C=CCN1C(=O)COC 11a_100015184376_100000210968 [0,1,0,1,0,0|1,0,1]=4 1707 B14R1.635 CCCCC1C=CCN1C(=O)COC 1626a_100015184376_100000210968 [0,1,0,1,0,0|1,0,1]=4 1708 B14R1.635 CCCCC1C=CCN1C(=O)COC 240690a_100015184376_100000210968 [0,1,0,1,0,0|1,0,1]=4 1709 B14R1.635 CCCCC1C=CCN1C(=O)COC 527a_100015184376_100000210968 [0,1,0,1,0,0|1,0,1]=4 1710 B14R1.635 CCCCc1cscc1C(=O)OCC 271570a_100020621405_100012353568 [0,1,0,1,0,0|1,0,1]=4 1711 B14R1.635 CCCCc1sccc1C(=O)OCC 271570a_100020621405_100010219215 [0,1,0,1,0,0|1,0,1]=4 1712 B14R1.898 CCCCNc1cccc(c1)COC 2230a_100000737370_100000210211 [0,1,0,1,0,0|2,0,0]=4 1713 B14R1.898 CCCCNc1cccc(c1)COC 34a_100000737370_100000210210 [0,1,0,1,0,0|2,0,0]=4 1714 B14R1.898 CCCCNc1cccc(c1)OCC 2230a_100000742568_100000210211 [0,1,0,1,0,0|2,0,0]=4 1715 B14R1.898 CCCCNc1cccc(c1)OCC 34a_100000742568_100000210210 [0,1,0,1,0,0|2,0,0]=4 1716 B14R1.898 CCCCOc1cccc(c1)OCC 34a_100011215941_100000210210 [0,1,0,1,0,0|2,0,0]=4 1717 B14R1.898 CCCCOc1cccc(c1)OCC 34a_100011216386_100000210202 [0,1,0,1,0,0|2,0,0]=4 1718 B14R1.898 CCCCOc1cccc(c1)OCC 7a_100011215941_100000210211 [0,1,0,1,0,0|2,0,0]=4 1719 B14R1.898 CCCCOc1cccc(c1)OCC 7a_100011216386_100000210202 [0,1,0,1,0,0|2,0,0]=4 1720 B14R1.898 CCCCOc1cccc(c1)OCF 34a_100011216386_100015361967 [0,1,0,1,0,0|2,0,0]=4 1721 B14R1.898 CCCCOc1cccc(c1)OCF 7a_100011216386_100015361967 [0,1,0,1,0,0|2,0,0]=4 1722 B14R1.898 CCCCSc1cccc(c1)COC 62a_100000210211_100011493687 [0,1,0,1,0,0|2,0,0]=4 1723 B14R1.898 CCCCSc1cccc(c1)COC 62a_100011493687_100000210210 [0,1,0,1,0,0|2,0,0]=4 1724 B14R1.898 CCCCSc1cccc(c1)OCC 62a_100000210211_100000170002 [0,1,0,1,0,0|2,0,0]=4 1725 B14R1.898 CCCCSc1cccc(n1)OCC 62a_100000210211_100000752924 [0,1,0,1,0,0|2,0,0]=4 1726 B14R1.898 CCCCSc1cccc(n1)OCC 62a_100000752924_100000210210 [0,1,0,1,0,0|2,0,0]=4 1727 B14R1.898 CCCNCc1cccc(c1)OCC 207a_100020643023_100000170239 [0,1,0,1,0,0|2,0,0]=4 1728 B14R1.898 CCCNCc1cccc(c1)OCC 2230a_106359896916_100000210303 [0,1,0,1,0,0|2,0,0]=4 1729 B14R1.898 CCCNCc1cccc(c1)OCC 270004a_100020643023_100000170239 [0,1,0,1,0,0|2,0,0]=4 1730 B14R1.898 CCCNCc1cccc(c1)OCC 34a_106359896916_100000210303 [0,1,0,1,0,0|2,0,0]=4 1731 B14R1.898 CCCOCc1cccc(c1)OCC 34a_200011232711_100000210303 [0,1,0,1,0,0|2,0,0]=4 1732 B14R1.898 CCCOCc1cccc(c1)OCC 7a_200011232711_100000210303 [0,1,0,1,0,0|2,0,0]=4 1733 B14R1.898 CCNCCc1cccc(c1)OCC 2230a_100138557038_100000210202 [0,1,0,1,0,0|2,0,0]=4 1734 B14R1.898 CCNCCc1cccc(c1)OCC 34a_100138557038_100000210202 [0,1,0,1,0,0|2,0,0]=4 1735 B14R1.948 CCOC(=O)/C=C/CN1CCC[C@@H]1C 2230a_100020605311_100016267167 [0,1,0,1,0,0|1,0,1]=4 1736 B14R1.948 CCOC(=O)/C=C/CN1CCC[C@@H]1C 269982a_100020605311_100016267167 [0,1,0,1,0,0|1,0,1]=4 1737 B14R1.948 CCOC(=O)/C=C/CN1CCC[C@H]1C 2230a_100015189458_100016267167 [0,1,0,1,0,0|1,0,1]=4 1738 B14R1.948 CCOC(=O)/C=C/CN1CCC[C@H]1C 269982a_100015189458_100016267167 [0,1,0,1,0,0|1,0,1]=4 1739 B14R1.948 CCOC(=O)/C=C/CN1CCC[C@H]1C 34a_100015189458_100016267167 [0,1,0,1,0,0|1,0,1]=4 1740 B14R1.955 CCOC(=O)/C=C/CNCCC1CC1 34a_100000764129_100016267167 [0,1,0,1,0,0|1,0,1]=4 1741 B14R1.955 CCOC(=O)/C=C/COCCC1CC1 34a_100000754188_100016267167 [0,1,0,1,0,0|1,0,1]=4 1742 B14R1.955 CCOC(=O)/C=C/COCCC1CC1 7a_100000754188_100016267167 [0,1,0,1,0,0|1,0,1]=4 1743 B14R1.955 CCOC(=O)/C=C/CSCCC1CC1 62a_100000764125_100016267167 [0,1,0,1,0,0|1,0,1]=4 1744 B14R1.955 CCOC(=O)/C=C/CSCCC1CC1 62a_100016267167_100000764125 [0,1,0,1,0,0|1,0,1]=4 1745 B14R1.955 CCOC(=O)C=CC=NNCC1CC1 4a_100000736359_100016289910 [0,1,0,1,0,0|2,0,0]=4 1746 B14R1.3126 CCCCCC=Cc1cc(nn1C)C 271570a_100000062253_100009818511 [0,1,0,1,0,0|2,0,0]=4 1747 B14R1.3126 CCCCCC=Cc1cc(nn1C)N 271570a_100000062253_100116209741 [0,1,0,1,0,0|2,0,0]=4 1748 B14R1.3126 CCCCCC=Cc1cc(sc1C)C 271570a_100000062253_100000688054 [0,1,0,1,0,0|1,1,0]=4 1749 B14R1.3619 CCCCNc1cccc(c1OC)Br 34a_100011935253_100000210210 [0,1,0,1,0,0|2,0,0]=4 1750 B14R1.3619 CCCCNc1cccc(c1OC)C 34a_100012017360_100000210210 [0,1,0,1,0,0|2,0,0]=4 1751 B14R1.3619 CCCCNc1cccc(c1OC)Cl 2230a_100000743799_100000210211 [0,1,0,1,0,0|2,0,0]=4 1752 B14R1.3619 CCCCNc1cccc(c1OC)Cl 34a_100000743799_100000210210 [0,1,0,1,0,0|2,0,0]=4 1753 B14R1.3619 CCCCNc1cccc(c1OC)F 34a_100011215007_100000210210 [0,1,0,1,0,0|2,0,0]=4 1754 B14R1.3619 CCCCOc1cccc(c1OC)Br 34a_100010234590_100000210210 [0,1,0,1,0,0|2,0,0]=4 1755 B14R1.3619 CCCCOc1cccc(c1OC)Cl 34a_200009886253_100000210210 [0,1,0,1,0,0|2,0,0]=4 1756 B14R1.3619 CCCCOc1cccc(c1OC)Cl 7a_200009886253_100000210211 [0,1,0,1,0,0|2,0,0]=4 1757 B14R1.3619 CCCCSc1cccc(c1OC)Br 62a_100000210211_100010146560 [0,1,0,1,0,0|2,0,0]=4 1758 B14R1.3619 CCCCSc1cccc(c1OC)Br 62a_100010146560_100000210210 [0,1,0,1,0,0|2,0,0]=4 1759 B14R1.3619 CCCCSc1cccc(c1OC)C 62a_100000210211_100010141385 [0,1,0,1,0,0|2,0,0]=4 1760 B14R1.3619 CCCCSc1cccc(c1OC)C 62a_100010141385_100000210210 [0,1,0,1,0,0|2,0,0]=4 1761 B14R1.3619 CCCCSc1cccc(c1OC)Cl 62a_100000210211_100010147678 [0,1,0,1,0,0|2,0,0]=4 1762 B14R1.3619 CCCCSc1cccc(c1OC)Cl 62a_100010147678_100000210210 [0,1,0,1,0,0|2,0,0]=4 1763 B14R1.3619 CCCCSc1cccc(c1OC)F 62a_100000210211_100009816759 [0,1,0,1,0,0|2,0,0]=4 1764 B14R1.3619 CCCCSc1cccc(c1OC)F 62a_100009816759_100000210210 [0,1,0,1,0,0|2,0,0]=4 1765 B14R1.3619 CCCCSc1cccc(c1OC)N 62a_100011935253_100000210210 [0,1,0,1,0,0|2,0,0]=4 1766 B14R1.3619 CCCCSc1cccc(c1OC)O 62a_100000210211_100010234590 [0,1,0,1,0,0|1,0,1]=4 1767 B14R1.3619 CCCNCc1cccc(c1OC)Br 207a_100020643023_100000692592 [0,1,0,1,0,0|2,0,0]=4 1768 B14R1.3619 CCCNCc1cccc(c1OC)Br 270004a_100020643023_100000692592 [0,1,0,1,0,0|2,0,0]=4 1769 B14R1.3619 CCCNCc1cccc(c1OC)C 207a_100020643023_100011361485 [0,1,0,1,0,0|2,0,0]=4 1770 B14R1.3619 CCCNCc1cccc(c1OC)C 270004a_100020643023_100011361485 [0,1,0,1,0,0|2,0,0]=4 1771 B14R1.3619 CCCNCc1cccc(c1OC)Cl 207a_100020643023_100011466644 [0,1,0,1,0,0|2,0,0]=4 1772 B14R1.3619 CCCNCc1cccc(c1OC)Cl 270004a_100020643023_100011466644 [0,1,0,1,0,0|2,0,0]=4 1773 B14R1.3619 CCCNCc1cccc(c1OC)F 207a_100020643023_100011830294 [0,1,0,1,0,0|2,0,0]=4 1774 B14R1.3619 CCCNCc1cccc(c1OC)F 270004a_100020643023_100011830294 [0,1,0,1,0,0|2,0,0]=4 1775 B14R1.3619 CCCNCc1cccc(c1OC)F 34a_100137345168_100000210303 [0,1,0,1,0,0|2,0,0]=4 1776 B14R1.3619 CCCOCc1cccc(c1OC)Br 34a_100000210258_100011470457 [0,1,0,1,0,0|2,0,0]=4 1777 B14R1.3619 CCCOCc1cccc(c1OC)Br 34a_100000704359_100000210303 [0,1,0,1,0,0|2,0,0]=4 1778 B14R1.3619 CCCOCc1cccc(c1OC)Br 7a_100000704359_100000210303 [0,1,0,1,0,0|2,0,0]=4 1779 B14R1.3619 CCCOCc1cccc(c1OC)C 34a_100000210258_100012349798 [0,1,0,1,0,0|2,0,0]=4 1780 B14R1.3619 CCCOCc1cccc(c1OC)C 34a_100012184769_100000210303 [0,1,0,1,0,0|2,0,0]=4 1781 B14R1.3619 CCCOCc1cccc(c1OC)C 7a_100012184769_100000210303 [0,1,0,1,0,0|2,0,0]=4 1782 B14R1.3619 CCCOCc1cccc(c1OC)F 34a_100011830279_100000210303 [0,1,0,1,0,0|2,0,0]=4 1783 B14R1.3619 CCCOCc1cccc(c1OC)F 7a_100011830279_100000210303 [0,1,0,1,0,0|2,0,0]=4 1784 B14R1.3619 CCCSCc1cccc(c1OC)Br 62a_100000210303_100011470457 [0,1,0,1,0,0|2,0,0]=4 1785 B14R1.3619 CCCSCc1cccc(c1OC)Br 62a_100011470457_100000210303 [0,1,0,1,0,0|2,0,0]=4 1786 B14R1.3619 CCCSCc1cccc(c1OC)C 62a_100000210303_100012349798 [0,1,0,1,0,0|2,0,0]=4 1787 B14R1.3619 CCCSCc1cccc(c1OC)C 62a_100012349798_100000210303 [0,1,0,1,0,0|2,0,0]=4 1788 B14R1.17 CCCC(C)Sc1cccc(=O)n1C 62a_100000726605_100000766640 [0,1,0,1,0,0|2,0,0]=4 1789 B14R1.17 CCCC(C)Sc1cccc(=O)n1C 62a_100000766640_100000726605 [0,1,0,1,0,0|2,0,0]=4 1790 B14R1.519 CCCC(C)COCC1=CC(=O)OC1 34a_100000688023_100000716558 [0,1,0,1,0,0|1,0,1]=4 1791 B14R1.519 CCCC(C)CSCC1=CC(=O)OC1 62a_100000716558_100011216630 [0,1,0,1,0,0|1,0,1]=4 1792 B14R1.519 CCCC(C)CSCC1=CC(=O)OC1 62a_100011216630_100000716558 [0,1,0,1,0,0|1,0,1]=4 1793 B14R1.519 CCC[C@H](N)COCC1=CC(=O)OC1 34a_100000732646_100000716558 [0,1,0,1,0,0|1,0,1]=4 1794 B14R1.722 COC(=O)/C=C/CNCC1CC(C1)O 2230a_100016992100_100000742655 [0,1,0,1,0,0|1,0,1]=4 1795 B14R1.722 COC(=O)/C=C/COCC1CC(C1)Cl 34a_100009874164_100000742655 [0,1,0,1,0,0|1,0,1]=4 1796 B14R1.730 COC(=O)/C=C/CNCC1CCCC1 2230a_100000737975_100000742655 [0,1,0,1,0,0|0,0,2]=4 1797 B14R1.730 COC(=O)/C=C/CNCC1CCCC1 34a_100000737975_100000742655 [0,1,0,1,0,0|0,0,2]=4 1798 B14R1.730 COC(=O)/C=C/CNCC1CCOC1 2230a_100000737293_100000742655 [0,1,0,1,0,0|1,0,1]=4 1799 B14R1.730 COC(=O)/C=C/CNCC1CCOC1 34a_100000737293_100000742655 [0,1,0,1,0,0|1,0,1]=4 1800 B14R1.730 COC(=O)/C=C/CNC[C@@H]1CCCO1 2230a_100020590478_100000742655 [0,1,0,1,0,0|1,0,1]=4 1801 B14R1.730 COC(=O)/C=C/CNC[C@@H]1CCCO1 34a_100020590478_100000742655 [0,1,0,1,0,0|1,0,1]=4 1802 B14R1.730 COC(=O)/C=C/COCC1CCCC1 34a_100000742336_100000742655 [0,1,0,1,0,0|0,0,2]=4 1803 B14R1.730 COC(=O)/C=C/COCC1CCCC1 7a_100000742336_100000742655 [0,1,0,1,0,0|0,0,2]=4 1804 B14R1.730 COC(=O)/C=C/COCC1CCCO1 34a_100000210270_100000742655 [0,1,0,1,0,0|1,0,1]=4 1805 B14R1.730 COC(=O)/C=C/COCC1CCCO1 7a_100000210270_100000742655 [0,1,0,1,0,0|1,0,1]=4 1806 B14R1.730 COC(=O)/C=C/COCC1CCNC1 34a_100000748654_100000742655 [0,1,0,1,0,0|1,0,1]=4 1807 B14R1.730 COC(=O)/C=C/COCC1CCOC1 34a_100000740260_100000742655 [0,1,0,1,0,0|1,0,1]=4 1808 B14R1.730 COC(=O)/C=C/COC[C@H]1CCCN1 34a_100000745186_100000742655 [0,1,0,1,0,0|1,0,1]=4 1809 B14R1.730 COC(=O)/C=C/CSCC1CCCC1 62a_100000740388_100000742655 [0,1,0,1,0,0|0,0,2]=4 1810 B14R1.730 COC(=O)/C=C/CSCC1CCCC1 62a_100000742655_100000740388 [0,1,0,1,0,0|0,0,2]=4 1811 B14R1.730 COC(=O)/C=C/CSCC1CCCO1 62a_100000203698_100000742655 [0,1,0,1,0,0|1,0,1]=4 1812 B14R1.730 COC(=O)/C=C/CSCC1CCCO1 62a_100000742655_100000203698 [0,1,0,1,0,0|1,0,1]=4 1813 B14R1.730 COC(=O)/C=C/CSCC1CCOC1 62a_100000702531_100000742655 [0,1,0,1,0,0|1,0,1]=4 1814 B14R1.730 COC(=O)/C=C/CSCC1CCOC1 62a_100000742655_100000702531 [0,1,0,1,0,0|1,0,1]=4 1815 B14R1.730 COC(=O)C=CC=NNC1CCCC1 4a_100000737850_100016254430 [0,1,0,1,0,0|1,0,0]=3 1816 B14R1.730 COC(=O)C=CC=NNC1CCOC1 4a_100000690549_100016254430 [0,1,0,1,0,0|2,0,0]=4 1817 B14R1.730 COC(=O)C=CC=NNC1CCSC1 4a_200000731317_100016254430 [0,1,0,1,0,0|2,0,0]=4 1818 B14R1.819 COC(=O)/C=C/COC1CCCC1C 34a_100011216460_100000742655 [0,1,0,1,0,0|0,0,2]=4 1819 B14R1.819 COC(=O)/C=C/COC1CCCC1C 7a_100011216460_100000742655 [0,1,0,1,0,0|0,0,2]=4 1820 B14R1.819 COC(=O)/C=C/CO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000742655 [0,1,0,1,0,0|1,0,1]=4 1821 B14R1.819 COC(=O)/C=C/CO[C@H]1CCC[C@@H]1N 34a_100000748460_100000742655 [0,1,0,1,0,0|1,0,1]=4 1822 B14R1.819 COC(=O)/C=C/CO[C@H]1CNC[C@H]1C 34a_200015306588_100000742655 [0,1,0,1,0,0|1,0,1]=4 1823 B14R1.819 COC(=O)/C=C/CS[C@@H]1CCC[C@H]1O 62a_100000742655_200016002552 [0,1,0,1,0,0|1,0,1]=4 1824 B14R1.819 COC(=O)/C=C/CS[C@@H]1CCC[C@H]1O 62a_200016002552_100000742655 [0,1,0,1,0,0|1,0,1]=4 1825 B14R1.962 CCCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210303 [0,1,0,1,0,0|1,0,1]=4 1826 B14R1.962 CCCC(=O)Cc1cccc(c1)OC 1458a_100000211992_100000211672 [0,1,0,1,0,0|1,0,1]=4 1827 B14R1.962 CCCC(=O)Cc1cccc(n1)OC 1458a_100000211992_100000755263 [0,1,0,1,0,0|1,0,1]=4 1828 B14R1.962 CCCC(C)Nc1cccc(c1)OC 34a_100000210024_100000766640 [0,1,0,1,0,0|2,0,0]=4 1829 B14R1.962 CCCC(C)Oc1cccc(c1)OC 34a_100000211255_100000766640 [0,1,0,1,0,0|2,0,0]=4 1830 B14R1.962 CCCC(C)Oc1cccc(c1)OC 7a_100000211255_100000766640 [0,1,0,1,0,0|2,0,0]=4 1831 B14R1.962 CCCC(C)Sc1cccc(c1)OC 62a_100000766640_100000170001 [0,1,0,1,0,0|2,0,0]=4 1832 B14R1.962 CCCC(C)Sc1cccc(n1)OC 62a_100000760917_100000766640 [0,1,0,1,0,0|2,0,0]=4 1833 B14R1.962 CCCC(C)Sc1cccc(n1)OC 62a_100000766640_100000760917 [0,1,0,1,0,0|2,0,0]=4 1834 B14R1.962 CCCN(C)Cc1cccc(c1)OC 2230a_100000184262_100000210303 [0,1,0,1,0,0|2,0,0]=4 1835 B14R1.962 CCCN(C)Cc1cccc(c1)OC 2230a_100000747261_100000211672 [0,1,0,1,0,0|2,0,0]=4 1836 B14R1.962 CCCN(C)Cc1cccc(c1)OC 2230a_200015186522_200000210301 [0,1,0,1,0,0|2,0,0]=4 1837 B14R1.962 CCCN(C)Cc1cccc(c1)OC 269982a_100000184262_100000210303 [0,1,0,1,0,0|2,0,0]=4 1838 B14R1.962 CCCN(C)Cc1cccc(c1)OC 269982a_100000747261_100000688526 [0,1,0,1,0,0|2,0,0]=4 1839 B14R1.962 CCCN(C)Cc1cccc(c1)OC 269982a_200015186522_200000210301 [0,1,0,1,0,0|2,0,0]=4 1840 B14R1.962 CCCN(C)Cc1cccc(c1)OC 26a_100000747261_100000211255 [0,1,0,1,0,0|2,0,0]=4 1841 B14R1.962 CCCN(C)Cc1cccc(c1)OC 270004a_100000747261_100000170238 [0,1,0,1,0,0|2,0,0]=4 1842 B14R1.962 CCCN(C)Cc1cccc(n1)OC 2230a_100000747261_100000755263 [0,1,0,1,0,0|2,0,0]=4 1843 B14R1.962 CCCN(C)Cc1cccc(n1)OC 269982a_100000747261_100000755263 [0,1,0,1,0,0|2,0,0]=4 1844 B14R1.962 CCCN(C)Cc1cccc(n1)OC 270004a_100000747261_100000694346 [0,1,0,1,0,0|2,0,0]=4 1845 B14R1.962 CCCN([13CH3])Cc1cccc(c1)OC 2230a_200015186522_200025704644 [0,1,0,1,0,0|2,0,0]=4 1846 B14R1.962 CCCN([13CH3])Cc1cccc(c1)OC 269982a_200015186522_200025704644 [0,1,0,1,0,0|2,0,0]=4 1847 B14R1.962 CCNC(C)Cc1cccc(c1)OC 270004a_100015525214_100011218204 [0,1,0,1,0,0|2,0,0]=4 1848 B14R1.962 COCC(N)Cc1cccc(c1)OC 34a_200012001539_200000210301 [0,1,0,1,0,0|2,0,0]=4 1849 B14R1.962 COc1cccc(c1)CC(N)CO[13CH3] 34a_200012001539_200025704644 [0,1,0,1,0,0|2,0,0]=4 1850 B14R1.1025 COC(=O)/C=C/CN1CCCC(C1)F 2230a_100000697950_100000742655 [0,1,0,1,0,0|1,0,1]=4 1851 B14R1.1025 COC(=O)/C=C/CN1CCCC(C1)F 269982a_100000697950_100000742655 [0,1,0,1,0,0|1,0,1]=4 1852 B14R1.1025 COC(=O)/C=C/CN1CCCC(C1)F 34a_100000697950_100000742655 [0,1,0,1,0,0|1,0,1]=4 1853 B14R1.1025 COC(=O)/C=C/CN1CCCC(C1)O 2230a_100000211013_100000742655 [0,1,0,1,0,0|1,0,1]=4 1854 B14R1.1025 COC(=O)/C=C/CN1CCCC(C1)O 269982a_100000211013_100000742655 [0,1,0,1,0,0|1,0,1]=4 1855 B14R1.1025 COC(=O)/C=C/CN1CCC[C@@H](C1)C 2230a_100000717927_100000742655 [0,1,0,1,0,0|1,0,1]=4 1856 B14R1.1025 COC(=O)/C=C/CN1CCC[C@@H](C1)C 269982a_100000717927_100000742655 [0,1,0,1,0,0|1,0,1]=4 1857 B14R1.1025 COC(=O)/C=C/CN1CCC[C@@H](C1)C 34a_100000717927_100000742655 [0,1,0,1,0,0|1,0,1]=4 1858 B14R1.1129 COC(=O)/C=C/CNCC(O)C1CC1 2230a_100000751198_100000742655 [0,1,0,1,0,0|1,0,1]=4 1859 B14R1.1129 COC(=O)/C=C/CNCC(O)C1CC1 34a_100000751198_100000742655 [0,1,0,1,0,0|1,0,1]=4 1860 B14R1.1129 COC(=O)/C=C/COC[C@H](N)C1CC1 34a_100020623730_100000742655 [0,1,0,1,0,0|1,0,1]=4 1861 B14R1.9173 COC(=O)/C=C/CNCC1(CCC1)C 2230a_100000706607_100000742655 [0,1,0,1,0,0|1,0,1]=4 1862 B14R1.9173 COC(=O)/C=C/CNCC1(CCC1)O 2230a_100000752638_100000742655 [0,1,0,1,0,0|1,0,1]=4 1863 B14R1.9173 COC(=O)/C=C/CSCC1(CCC1)C 62a_100000726658_100000742655 [0,1,0,1,0,0|1,0,1]=4 1864 B14R1.9173 COC(=O)/C=C/CSCC1(CCC1)C 62a_100000742655_100000726658 [0,1,0,1,0,0|1,0,1]=4 1865 B14R1.155 CCCCC(C)OCC1=CC(=O)OC1 34a_100000687866_100000716558 [0,1,0,1,0,0|1,0,1]=4 1866 B14R1.155 CCCCC(C)SCC1=CC(=O)OC1 62a_100000716558_200011215066 [0,1,0,1,0,0|1,0,1]=4 1867 B14R1.155 CCCCC(C)SCC1=CC(=O)OC1 62a_200011215066_100000716558 [0,1,0,1,0,0|1,0,1]=4 1868 B14R1.715 COC(=O)/C=C/CN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000742655 [0,1,0,1,0,0|1,0,1]=4 1869 B14R1.715 COC(=O)/C=C/COC1CCC(C1)C 34a_100000698185_100000742655 [0,1,0,1,0,0|1,0,1]=4 1870 B14R1.716 COC(=O)/C=C/CNC1CCCCC1 2230a_100000182618_100000742655 [0,1,0,1,0,0|0,0,2]=4 1871 B14R1.716 COC(=O)/C=C/CNC1CCCCC1 34a_100000182618_100000742655 [0,1,0,1,0,0|0,0,2]=4 1872 B14R1.716 COC(=O)/C=C/CNC1CCCOC1 2230a_100000719290_100000742655 [0,1,0,1,0,0|1,0,1]=4 1873 B14R1.716 COC(=O)/C=C/CNC1CCCOC1 34a_100000719290_100000742655 [0,1,0,1,0,0|1,0,1]=4 1874 B14R1.716 COC(=O)/C=C/CNC1CCOCC1 2230a_100000741149_100000742655 [0,1,0,1,0,0|1,0,1]=4 1875 B14R1.716 COC(=O)/C=C/CNC1CCOCC1 34a_100000741149_100000742655 [0,1,0,1,0,0|1,0,1]=4 1876 B14R1.716 COC(=O)/C=C/CNC1CCSCC1 2230a_100000748639_100000742655 [0,1,0,1,0,0|1,0,1]=4 1877 B14R1.716 COC(=O)/C=C/CNC1CCSCC1 34a_100000748639_100000742655 [0,1,0,1,0,0|1,0,1]=4 1878 B14R1.716 COC(=O)/C=C/COC1CCCCC1 34a_100000210231_100000742655 [0,1,0,1,0,0|0,0,2]=4 1879 B14R1.716 COC(=O)/C=C/COC1CCCCC1 7a_100000210231_100000742655 [0,1,0,1,0,0|0,0,2]=4 1880 B14R1.716 COC(=O)/C=C/COC1CCCCO1 34a_100000033831_100000742655 [0,1,0,1,0,0|1,0,1]=4 1881 B14R1.716 COC(=O)/C=C/COC1CCCOC1 34a_100000754041_100000742655 [0,1,0,1,0,0|1,0,1]=4 1882 B14R1.716 COC(=O)/C=C/COC1CCCSC1 7a_100015962668_100000742655 [0,1,0,1,0,0|1,0,1]=4 1883 B14R1.716 COC(=O)/C=C/COC1CCOCC1 34a_100000744328_100000742655 [0,1,0,1,0,0|1,0,1]=4 1884 B14R1.716 COC(=O)/C=C/COC1CCSCC1 34a_100000731022_100000742655 [0,1,0,1,0,0|1,0,1]=4 1885 B14R1.716 COC(=O)/C=C/COC1CCSCC1 7a_100000731022_100000742655 [0,1,0,1,0,0|1,0,1]=4 1886 B14R1.716 COC(=O)/C=C/CSC1CCCCC1 62a_100000210327_100000742655 [0,1,0,1,0,0|0,0,2]=4 1887 B14R1.716 COC(=O)/C=C/CSC1CCCCC1 62a_100000742655_100000210327 [0,1,0,1,0,0|0,0,2]=4 1888 B14R1.716 COC(=O)/C=C/CSC1CCCOC1 62a_100000742655_100000693364 [0,1,0,1,0,0|1,0,1]=4 1889 B14R1.716 COC(=O)/C=C/CSC1CCOCC1 62a_100000742655_100011324220 [0,1,0,1,0,0|1,0,1]=4 1890 B14R1.716 COC(=O)/C=C/CSC1CCSCC1 62a_100000742655_100000069128 [0,1,0,1,0,0|1,0,1]=4 1891 B14R1.765 CCCCc1ccc(s1)CC(=O)OC 271570a_100020621405_100012028946 [0,1,0,1,0,0|0,0,2]=4 1892 B14R1.780 CCCCc1cc(ccn1)C(=O)OC 271570a_100020621405_100011934382 [0,1,0,1,0,0|1,0,1]=4 1893 B14R1.780 CCCCc1cccc(c1)C(=O)CC 1458a_100012178757_100000210202 [0,1,0,1,0,0|1,0,1]=4 1894 B14R1.780 CCCCc1cccc(c1)C(=O)CC 271570a_100020621405_100000211677 [0,1,0,1,0,0|1,0,1]=4 1895 B14R1.780 CCCCc1cccc(c1)C(=O)NC 11a_106832991635_100012178757 [0,1,0,1,0,0|1,0,1]=4 1896 B14R1.780 CCCCc1cccc(c1)C(=O)NC 1626a_100102657272_100012178757 [0,1,0,1,0,0|1,0,1]=4 1897 B14R1.780 CCCCc1cccc(c1)C(=O)NC 240690a_100102657272_100012178757 [0,1,0,1,0,0|1,0,1]=4 1898 B14R1.780 CCCCc1cccc(c1)C(=O)NC 271570a_100020621405_100000155082 [0,1,0,1,0,0|1,0,1]=4 1899 B14R1.780 CCCCc1cccc(c1)C(=O)NC 527a_100102657272_100012178757 [0,1,0,1,0,0|1,0,1]=4 1900 B14R1.780 CCCCc1cccc(c1)C(=O)OC 271570a_100020621405_100000148679 [0,1,0,1,0,0|0,0,1]=3 1901 B14R1.780 CCCCc1cccc(n1)C(=O)CC 271570a_100020621405_100011004013 [0,1,0,1,0,0|1,0,1]=4 1902 B14R1.780 CCCCc1cccc(n1)C(=O)NC 271570a_100020621405_100000755456 [0,1,0,1,0,0|1,0,1]=4 1903 B14R1.780 CCCCc1cccc(n1)C(=O)OC 271570a_100020621405_100000708286 [0,1,0,1,0,0|0,0,1]=3 1904 B14R1.780 CCCCc1ccnc(c1)C(=O)OC 271570a_100020621405_100000693414 [0,1,0,1,0,0|1,0,1]=4 1905 B14R1.780 CCCCc1cncc(c1)C(=O)OC 271570a_100020621405_100000148912 [0,1,0,1,0,0|1,0,1]=4 1906 B14R1.780 CCCCc1cncc(n1)C(=O)OC 271570a_100020621405_100000765340 [0,1,0,1,0,0|1,0,1]=4 1907 B14R1.780 CCCCc1nccc(n1)C(=O)OC 271570a_100020621405_100000070389 [0,1,0,1,0,0|1,0,1]=4 1908 B14R1.780 CCCOc1cccc(c1)C(=O)OC 34a_100000150331_100000210303 [0,1,0,1,0,0|1,0,1]=4 1909 B14R1.780 CCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000210303 [0,1,0,1,0,0|1,0,1]=4 1910 B14R1.780 CCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210303 [0,1,0,1,0,0|1,0,1]=4 1911 B14R1.780 CCCSc1cccc(c1)C(=O)OC 62a_100000210303_100000148848 [0,1,0,1,0,0|1,0,1]=4 1912 B14R1.780 CCCSc1cccc(n1)C(=O)OC 62a_100000210303_100000708286 [0,1,0,1,0,0|1,0,1]=4 1913 B14R1.780 CCCSc1cccc(n1)C(=O)OC 62a_100000708286_100000210303 [0,1,0,1,0,0|1,0,1]=4 1914 B14R1.780 CCNCc1cccc(c1)C(=O)OC 2230a_100015525214_100000184886 [0,1,0,1,0,0|1,0,1]=4 1915 B14R1.780 CCNCc1cccc(c1)C(=O)OC 270004a_100015525214_100000687630 [0,1,0,1,0,0|1,0,1]=4 1916 B14R1.780 CCNCc1cccc(n1)C(=O)OC 2230a_100015525214_100000097194 [0,1,0,1,0,0|1,0,1]=4 1917 B14R1.780 CCNCc1cccc(n1)C(=O)OC 270004a_100015525214_100000085286 [0,1,0,1,0,0|1,0,1]=4 1918 B14R1.780 CCOCc1cccc(c1)C(=O)OC 34a_100000750316_100000210202 [0,1,0,1,0,0|1,0,1]=4 1919 B14R1.780 CCOCc1cccc(c1)C(=O)OC 34a_100121572206_100000184886 [0,1,0,1,0,0|1,0,1]=4 1920 B14R1.780 CCOCc1cccc(c1)C(=O)OC 7a_100000750316_100000210202 [0,1,0,1,0,0|1,0,1]=4 1921 B14R1.780 CCOCc1cccc(n1)C(=O)OC 34a_100121572206_100010006753 [0,1,0,1,0,0|1,0,1]=4 1922 B14R1.780 CCSCc1cccc(c1)C(=O)OC 62a_100000184886_100000210202 [0,1,0,1,0,0|1,0,1]=4 1923 B14R1.780 CCSCc1cccc(c1)C(=O)OC 62a_100000210202_100000184886 [0,1,0,1,0,0|1,0,1]=4 1924 B14R1.780 CCSCc1cccc(n1)C(=O)OC 62a_100000097194_100000210202 [0,1,0,1,0,0|1,0,1]=4 1925 B14R1.780 CCSCc1cccc(n1)C(=O)OC 62a_100000210202_100010006753 [0,1,0,1,0,0|1,0,1]=4 1926 B14R1.837 COC(=O)/C=C/CN1CCCCC1C 2230a_100000211376_100000742655 [0,1,0,1,0,0|0,0,2]=4 1927 B14R1.837 COC(=O)/C=C/CN1CCCCC1C 269982a_100000211376_100000742655 [0,1,0,1,0,0|0,0,2]=4 1928 B14R1.837 COC(=O)/C=C/CN1CCCCC1C 34a_100000211376_100000742655 [0,1,0,1,0,0|0,0,2]=4 1929 B14R1.837 COC(=O)/C=C/CN1CCOC[C@@H]1C 2230a_100009815349_100000742655 [0,1,0,1,0,0|1,0,1]=4 1930 B14R1.837 COC(=O)/C=C/CN1CCOC[C@@H]1C 269982a_100009815349_100000742655 [0,1,0,1,0,0|1,0,1]=4 1931 B14R1.837 COC(=O)/C=C/CN1CCOC[C@@H]1C 34a_100009815349_100000742655 [0,1,0,1,0,0|1,0,1]=4 1932 B14R1.934 CCCCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210211 [0,1,0,1,0,0|1,0,1]=4 1933 B14R1.934 CCCCN(C)c1cccc(c1)OC 2230a_100000219725_100000210211 [0,1,0,1,0,0|2,0,0]=4 1934 B14R1.934 CCCCN(C)c1cccc(c1)OC 269982a_100000219725_100000210211 [0,1,0,1,0,0|2,0,0]=4 1935 B14R1.934 CCCCN(C)c1cccc(c1)OC 34a_100000219725_100000210210 [0,1,0,1,0,0|2,0,0]=4 1936 B14R1.934 CCCNC(C)c1cccc(c1)OC 2230a_100000737859_100000210303 [0,1,0,1,0,0|2,0,0]=4 1937 B14R1.934 CCCNC(C)c1cccc(c1)OC 269862a_100020643023_100000171656 [0,1,0,1,0,0|2,0,0]=4 1938 B14R1.934 CCCNC(C)c1cccc(n1)OC 269862a_100020643023_100000069440 [0,1,0,1,0,0|2,0,0]=4 1939 B14R1.934 CCCN[C@H](C)c1cccc(n1)OC 2230a_100016223015_100000210303 [0,1,0,1,0,0|2,0,0]=4 1940 B14R1.934 CCCOC(C)c1cccc(c1)OC 34a_100000246466_100000210303 [0,1,0,1,0,0|2,0,0]=4 1941 B14R1.934 CCCOC(C)c1cccc(c1)OC 7a_100000246466_100000210303 [0,1,0,1,0,0|2,0,0]=4 1942 B14R1.934 CCNCC(O)c1cccc(c1)OC 34a_100000737735_200000210301 [0,1,0,1,0,0|2,0,0]=4 1943 B14R1.934 CCNCC(O)c1cccc(c1)O[13CH3] 34a_100000737735_200025704644 [0,1,0,1,0,0|2,0,0]=4 1944 B14R1.934 CCOCC(N)c1cccc(c1)OC 34a_100020589383_100000210202 [0,1,0,1,0,0|2,0,0]=4 1945 B14R1.934 COCCC(N)c1cccc(c1)OC 34a_200011661557_200000210301 [0,1,0,1,0,0|2,0,0]=4 1946 B14R1.934 COc1cccc(c1)C(N)CCO[13CH3] 34a_200011661557_200025704644 [0,1,0,1,0,0|2,0,0]=4 1947 B14R1.1526 COC(=O)/C=C/COC1(CCCC1)C 34a_100000751722_100000742655 [0,1,0,1,0,0|1,0,1]=4 1948 B14R1.1526 COC(=O)/C=C/COC1(CCCC1)C 7a_100000751722_100000742655 [0,1,0,1,0,0|1,0,1]=4 1949 B14R1.7648 COC(=O)/C=C/CN1C(CCC1C)C 2230a_100000687148_100000742655 [0,1,0,1,0,0|1,0,1]=4 1950 B14R1.7648 COC(=O)/C=C/CN1C(CCC1C)C 269982a_100000687148_100000742655 [0,1,0,1,0,0|1,0,1]=4 1951 B14R1.7648 COC(=O)/C=C/CN1C(CCC1C)C 34a_100000687148_100000742655 [0,1,0,1,0,0|1,0,1]=4 1952 B14R1.7728 COC(=O)/C=C/CNC(C)C1CCC1 2230a_100016994624_100000742655 [0,1,0,1,0,0|1,0,1]=4 1953 B14R1.7728 COC(=O)/C=C/CNC(C)C1CCC1 34a_100016994624_100000742655 [0,1,0,1,0,0|1,0,1]=4 1954 B14R1.7728 COC(=O)/C=C/COC(C)C1CCC1 34a_100000766398_100000742655 [0,1,0,1,0,0|1,0,1]=4 1955 B14R1.7728 COC(=O)/C=C/COC(C)C1CCC1 7a_100000766398_100000742655 [0,1,0,1,0,0|1,0,1]=4 1956 B14R1.9 CCCCC=Cc1cccc(=O)n1C 271570a_100016275911_100000726605 [0,1,0,1,0,0|1,0,1]=4 1957 B14R1.9 CCCCCNc1cccc(c1C)Br 34a_100000750434_100000718602 [0,1,0,1,0,0|2,0,0]=4 1958 B14R1.9 CCCCCNc1cccc(c1C)C 2230a_100000210026_100000210326 [0,1,0,1,0,0|2,0,0]=4 1959 B14R1.9 CCCCCNc1cccc(c1C)C 34a_100000210026_100000718602 [0,1,0,1,0,0|2,0,0]=4 1960 B14R1.9 CCCCCNc1cccc(c1C)C 7a_100000210026_100000210326 [0,1,0,1,0,0|2,0,0]=4 1961 B14R1.9 CCCCCNc1cccc(c1C)Cl 2230a_100000210441_100000210326 [0,1,0,1,0,0|2,0,0]=4 1962 B14R1.9 CCCCCNc1cccc(c1C)Cl 34a_100000210441_100000718602 [0,1,0,1,0,0|2,0,0]=4 1963 B14R1.9 CCCCCNc1cccc(c1C)Cl 7a_100000210441_100000210326 [0,1,0,1,0,0|2,0,0]=4 1964 B14R1.9 CCCCCNc1cccc(c1C)F 34a_100000745574_100000718602 [0,1,0,1,0,0|2,0,0]=4 1965 B14R1.9 CCCCCNc1cccc(c1C)F 7a_100000745574_100000210326 [0,1,0,1,0,0|2,0,0]=4 1966 B14R1.9 CCCCCNc1cccc(c1C)I 34a_100000761887_100000718602 [0,1,0,1,0,0|2,0,0]=4 1967 B14R1.9 CCCCCNc1cccc(c1C)O 34a_100011216573_100000718602 [0,1,0,1,0,0|1,0,1]=4 1968 B14R1.9 CCCCCNc1cccc(c1C)O 7a_100011216573_100000210326 [0,1,0,1,0,0|1,0,1]=4 1969 B14R1.9 CCCCCOc1cccc(c1C)Br 34a_100012002258_100000718602 [0,1,0,1,0,0|2,0,0]=4 1970 B14R1.9 CCCCCOc1cccc(c1C)Br 7a_100012002258_100000210326 [0,1,0,1,0,0|2,0,0]=4 1971 B14R1.9 CCCCCOc1cccc(c1C)C 34a_100000185855_100000718602 [0,1,0,1,0,0|2,0,0]=4 1972 B14R1.9 CCCCCOc1cccc(c1C)C 7a_100000185855_100000210326 [0,1,0,1,0,0|2,0,0]=4 1973 B14R1.9 CCCCCOc1cccc(c1C)Cl 34a_100011265684_100000718602 [0,1,0,1,0,0|2,0,0]=4 1974 B14R1.9 CCCCCOc1cccc(c1C)Cl 7a_100011265684_100000210326 [0,1,0,1,0,0|2,0,0]=4 1975 B14R1.9 CCCCCOc1cccc(c1C)F 34a_100011217231_100000718602 [0,1,0,1,0,0|2,0,0]=4 1976 B14R1.9 CCCCCOc1cccc(c1C)F 7a_100011217231_100000210326 [0,1,0,1,0,0|2,0,0]=4 1977 B14R1.9 CCCCCOc1cccc(c1C)N 34a_100011216573_100000718602 [0,1,0,1,0,0|2,0,0]=4 1978 B14R1.9 CCCCCOc1cccc(c1C)N 7a_100011216573_100000210326 [0,1,0,1,0,0|2,0,0]=4 1979 B14R1.9 CCCCCSc1cccc(=O)n1C 62a_100000210326_100000726605 [0,1,0,1,0,0|1,0,0]=3 1980 B14R1.9 CCCCCSc1cccc(=O)n1C 62a_100000726605_100000210326 [0,1,0,1,0,0|1,0,0]=3 1981 B14R1.9 CCCCCSc1cccc(c1C)Br 62a_100000210326_100012353703 [0,1,0,1,0,0|2,0,0]=4 1982 B14R1.9 CCCCCSc1cccc(c1C)Br 62a_100012353703_100000210326 [0,1,0,1,0,0|2,0,0]=4 1983 B14R1.9 CCCCCSc1cccc(c1C)C 62a_100000210326_100011214922 [0,1,0,1,0,0|2,0,0]=4 1984 B14R1.9 CCCCCSc1cccc(c1C)C 62a_100011214922_100000210326 [0,1,0,1,0,0|2,0,0]=4 1985 B14R1.9 CCCCCSc1cccc(c1C)Cl 62a_100000210326_100000726075 [0,1,0,1,0,0|2,0,0]=4 1986 B14R1.9 CCCCCSc1cccc(c1C)Cl 62a_100000726075_100000210326 [0,1,0,1,0,0|2,0,0]=4 1987 B14R1.9 CCCCCSc1cccc(c1C)F 62a_100000210326_100011216893 [0,1,0,1,0,0|2,0,0]=4 1988 B14R1.9 CCCCCSc1cccc(c1C)F 62a_100011216893_100000210326 [0,1,0,1,0,0|2,0,0]=4 1989 B14R1.9 CCCCCSc1cccc(c1C)N 62a_100000210326_100000761887 [0,1,0,1,0,0|2,0,0]=4 1990 B14R1.9 CCCCCSc1cccc(c1C)N 62a_100000761887_100000210326 [0,1,0,1,0,0|2,0,0]=4 1991 B14R1.9 CCCCCSc1cccc(c1C)O 62a_100000210326_100012002258 [0,1,0,1,0,0|1,0,1]=4 1992 B14R1.9 CCCCCSc1cccc(c1C)O 62a_100012002258_100000210326 [0,1,0,1,0,0|1,0,1]=4 1993 B14R1.9 CCCCNCc1cccc(c1C)Br 207a_100000102301_100012179384 [0,1,0,1,0,0|2,0,0]=4 1994 B14R1.9 CCCCNCc1cccc(c1C)Br 2230a_100000102301_100000694682 [0,1,0,1,0,0|2,0,0]=4 1995 B14R1.9 CCCCNCc1cccc(c1C)Br 270004a_100000102301_100012179384 [0,1,0,1,0,0|2,0,0]=4 1996 B14R1.9 CCCCNCc1cccc(c1C)Br 34a_100000724210_100000210210 [0,1,0,1,0,0|2,0,0]=4 1997 B14R1.9 CCCCNCc1cccc(c1C)Br 7a_106832991798_100000694682 [0,1,0,1,0,0|2,0,0]=4 1998 B14R1.9 CCCCNCc1cccc(c1C)C 207a_100000102301_100000229941 [0,1,0,1,0,0|2,0,0]=4 1999 B14R1.9 CCCCNCc1cccc(c1C)C 2230a_100000102301_100011515928 [0,1,0,1,0,0|2,0,0]=4 2000 B14R1.9 CCCCNCc1cccc(c1C)C 2230a_100011211637_100000210211 [0,1,0,1,0,0|2,0,0]=4 2001 B14R1.9 CCCCNCc1cccc(c1C)C 270004a_100000102301_100000229941 [0,1,0,1,0,0|2,0,0]=4 2002 B14R1.9 CCCCNCc1cccc(c1C)C 34a_100011211637_100000210210 [0,1,0,1,0,0|2,0,0]=4 2003 B14R1.9 CCCCNCc1cccc(c1C)C 7a_106832991798_100011515928 [0,1,0,1,0,0|2,0,0]=4 2004 B14R1.9 CCCCNCc1cccc(c1C)Cl 207a_100000102301_100012002129 [0,1,0,1,0,0|2,0,0]=4 2005 B14R1.9 CCCCNCc1cccc(c1C)Cl 2230a_100000102301_100012186920 [0,1,0,1,0,0|2,0,0]=4 2006 B14R1.9 CCCCNCc1cccc(c1C)Cl 2230a_100020639605_100000210211 [0,1,0,1,0,0|2,0,0]=4 2007 B14R1.9 CCCCNCc1cccc(c1C)Cl 270004a_100000102301_100012002129 [0,1,0,1,0,0|2,0,0]=4 2008 B14R1.9 CCCCNCc1cccc(c1C)Cl 34a_100020639605_100000210210 [0,1,0,1,0,0|2,0,0]=4 2009 B14R1.9 CCCCNCc1cccc(c1C)Cl 7a_106832991798_100012186920 [0,1,0,1,0,0|2,0,0]=4 2010 B14R1.9 CCCCNCc1cccc(c1C)F 207a_100000102301_100000037668 [0,1,0,1,0,0|2,0,0]=4 2011 B14R1.9 CCCCNCc1cccc(c1C)F 2230a_100000102301_100009813626 [0,1,0,1,0,0|2,0,0]=4 2012 B14R1.9 CCCCNCc1cccc(c1C)F 2230a_100132306986_100000210211 [0,1,0,1,0,0|2,0,0]=4 2013 B14R1.9 CCCCNCc1cccc(c1C)F 270004a_100000102301_100000037668 [0,1,0,1,0,0|2,0,0]=4 2014 B14R1.9 CCCCNCc1cccc(c1C)F 34a_100132306986_100000210210 [0,1,0,1,0,0|2,0,0]=4 2015 B14R1.9 CCCCNCc1cccc(c1C)F 7a_106832991798_100009813626 [0,1,0,1,0,0|2,0,0]=4 2016 B14R1.9 CCCCNCc1cccc(c1C)I 2230a_100000102301_100010150147 [0,1,0,1,0,0|2,0,0]=4 2017 B14R1.9 CCCCNCc1cccc(c1C)I 7a_106832991798_100010150147 [0,1,0,1,0,0|2,0,0]=4 2018 B14R1.9 CCCCNCc1cccc(c1C)O 270004a_100000102301_100009868165 [0,1,0,1,0,0|1,0,1]=4 2019 B14R1.9 CCCCOCc1cccc(c1C)Br 34a_100000210227_100000694682 [0,1,0,1,0,0|2,0,0]=4 2020 B14R1.9 CCCCOCc1cccc(c1C)Br 34a_100000694458_100000210210 [0,1,0,1,0,0|2,0,0]=4 2021 B14R1.9 CCCCOCc1cccc(c1C)Br 7a_100000210227_100000694682 [0,1,0,1,0,0|2,0,0]=4 2022 B14R1.9 CCCCOCc1cccc(c1C)Br 7a_100000694458_100000210211 [0,1,0,1,0,0|2,0,0]=4 2023 B14R1.9 CCCCOCc1cccc(c1C)C 34a_100000210227_100011273979 [0,1,0,1,0,0|2,0,0]=4 2024 B14R1.9 CCCCOCc1cccc(c1C)C 34a_100011219135_100000210210 [0,1,0,1,0,0|2,0,0]=4 2025 B14R1.9 CCCCOCc1cccc(c1C)C 7a_100000210227_100011515928 [0,1,0,1,0,0|2,0,0]=4 2026 B14R1.9 CCCCOCc1cccc(c1C)C 7a_100011219135_100000210211 [0,1,0,1,0,0|2,0,0]=4 2027 B14R1.9 CCCCOCc1cccc(c1C)Cl 34a_100000210227_100012186920 [0,1,0,1,0,0|2,0,0]=4 2028 B14R1.9 CCCCOCc1cccc(c1C)Cl 34a_100012000165_100000210210 [0,1,0,1,0,0|2,0,0]=4 2029 B14R1.9 CCCCOCc1cccc(c1C)Cl 7a_100000210227_100012186920 [0,1,0,1,0,0|2,0,0]=4 2030 B14R1.9 CCCCOCc1cccc(c1C)Cl 7a_100012000165_100000210211 [0,1,0,1,0,0|2,0,0]=4 2031 B14R1.9 CCCCOCc1cccc(c1C)F 34a_100000042775_100000210210 [0,1,0,1,0,0|2,0,0]=4 2032 B14R1.9 CCCCOCc1cccc(c1C)F 34a_100000210227_100009813626 [0,1,0,1,0,0|2,0,0]=4 2033 B14R1.9 CCCCOCc1cccc(c1C)F 7a_100000042775_100000210211 [0,1,0,1,0,0|2,0,0]=4 2034 B14R1.9 CCCCOCc1cccc(c1C)F 7a_100000210227_100009813626 [0,1,0,1,0,0|2,0,0]=4 2035 B14R1.9 CCCCOCc1cccc(c1C)I 34a_100000210227_100010150147 [0,1,0,1,0,0|2,0,0]=4 2036 B14R1.9 CCCCOCc1cccc(c1C)I 34a_100010150139_100000210210 [0,1,0,1,0,0|2,0,0]=4 2037 B14R1.9 CCCCOCc1cccc(c1C)I 7a_100000210227_100010150147 [0,1,0,1,0,0|2,0,0]=4 2038 B14R1.9 CCCCOCc1cccc(c1C)I 7a_100010150139_100000210211 [0,1,0,1,0,0|2,0,0]=4 2039 B14R1.9 CCCCOCc1cccc(c1C)N 34a_102495339961_100000210210 [0,1,0,1,0,0|2,0,0]=4 2040 B14R1.9 CCCCOCc1cccc(c1C)N 7a_102495339961_100000210211 [0,1,0,1,0,0|2,0,0]=4 2041 B14R1.9 CCCCSCc1cccc(c1C)Br 62a_100000210211_100000694682 [0,1,0,1,0,0|2,0,0]=4 2042 B14R1.9 CCCCSCc1cccc(c1C)Br 62a_100000694682_100000210210 [0,1,0,1,0,0|2,0,0]=4 2043 B14R1.9 CCCCSCc1cccc(c1C)C 62a_100000210211_100011515928 [0,1,0,1,0,0|2,0,0]=4 2044 B14R1.9 CCCCSCc1cccc(c1C)C 62a_100011515928_100000210210 [0,1,0,1,0,0|2,0,0]=4 2045 B14R1.9 CCCCSCc1cccc(c1C)Cl 62a_100000210211_100012186920 [0,1,0,1,0,0|2,0,0]=4 2046 B14R1.9 CCCCSCc1cccc(c1C)Cl 62a_100012186920_100000210210 [0,1,0,1,0,0|2,0,0]=4 2047 B14R1.9 CCCCSCc1cccc(c1C)F 62a_100000210211_100009813626 [0,1,0,1,0,0|2,0,0]=4 2048 B14R1.9 CCCCSCc1cccc(c1C)F 62a_100009813626_100000210210 [0,1,0,1,0,0|2,0,0]=4 2049 B14R1.9 CCCCSCc1cccc(c1C)I 62a_100000210211_100010150147 [0,1,0,1,0,0|2,0,0]=4 2050 B14R1.9 CCCCSCc1cccc(c1C)I 62a_100010150147_100000210210 [0,1,0,1,0,0|2,0,0]=4 2051 B14R1.9 CCCNCCc1cccc(c1C)Br 2230a_100161000114_100000210303 [0,1,0,1,0,0|2,0,0]=4 2052 B14R1.9 CCCNCCc1cccc(c1C)Br 34a_100161000114_100000210303 [0,1,0,1,0,0|2,0,0]=4 2053 B14R1.9 CCOCCSc1cccc(=O)n1C 62a_100000210147_100000726605 [0,1,0,1,0,0|2,0,0]=4 2054 B14R1.9 CCOCCSc1cccc(=O)n1C 62a_100000726605_100011215890 [0,1,0,1,0,0|2,0,0]=4 2055 B14R1.9 CCSCCSc1cccc(=O)n1C 62a_100000726605_100000757381 [0,1,0,1,0,0|2,0,0]=4 2056 B14R1.9 CCSCCSc1cccc(=O)n1C 62a_100000757381_100000726605 [0,1,0,1,0,0|2,0,0]=4 2057 B14R1.9 COCCCSc1cccc(=O)n1C 62a_100000709357_100000726605 [0,1,0,1,0,0|2,0,0]=4 2058 B14R1.9 COCCCSc1cccc(=O)n1C 62a_100000726605_100000709357 [0,1,0,1,0,0|2,0,0]=4 2059 B14R1.9 Cn1c(cccc1=O)SCCCCF 62a_100000726605_100000729493 [0,1,0,1,0,0|2,0,0]=4 2060 B14R1.9 Cn1c(cccc1=O)SCCCCF 62a_100000729493_100000726605 [0,1,0,1,0,0|2,0,0]=4 2061 B14R1.9 Cn1c(cccc1=O)SCCCCO 62a_100000210776_100000726605 [0,1,0,1,0,0|2,0,0]=4 2062 B14R1.9 Cn1c(cccc1=O)SCCCCO 62a_100000726605_100000210776 [0,1,0,1,0,0|2,0,0]=4 2063 B14R1.14 CCCCCC=Cc1ccc(=O)[nH]c1 271570a_100000062253_100000212171 [0,1,0,1,0,0|1,0,1]=4 2064 B14R1.14 CCCCCC=Cc1ccc(=O)[nH]n1 271570a_100000062253_100009820020 [0,1,0,1,0,0|2,0,0]=4 2065 B14R1.14 CCCCCC=Cc1cnc(=O)[nH]c1 271570a_100000062253_102495366499 [0,1,0,1,0,0|1,0,1]=4 2066 B14R1.109 CCC1CCCN1C/C=C/C(=O)OC 2230a_100000754278_100000742655 [0,1,0,1,0,0|0,0,2]=4 2067 B14R1.109 CCC1CCCN1C/C=C/C(=O)OC 269982a_100000754278_100000742655 [0,1,0,1,0,0|0,0,2]=4 2068 B14R1.109 CCC1CCCN1C/C=C/C(=O)OC 34a_100000754278_100000742655 [0,1,0,1,0,0|0,0,2]=4 2069 B14R1.109 COC(=O)/C=C/CN1CCC[C@@H]1CO 2230a_100000745186_100000742655 [0,1,0,1,0,0|1,0,1]=4 2070 B14R1.109 COC(=O)/C=C/CN1CCC[C@@H]1CO 269982a_100000745186_100000742655 [0,1,0,1,0,0|1,0,1]=4 2071 B14R1.109 COC(=O)/C=C/CN1CCC[C@@H]1CO 34a_100000745186_100000742655 [0,1,0,1,0,0|1,0,1]=4 2072 B14R1.122 CCCCCCOCC1=CC(=O)OC1 34a_100000210259_100000716558 [0,1,0,1,0,0|0,0,2]=4 2073 B14R1.122 CCCCCCSCC1=CC(=O)OC1 62a_100000210314_100000716558 [0,1,0,1,0,0|0,0,2]=4 2074 B14R1.122 CCCCCCSCC1=CC(=O)OC1 62a_100000716558_100000210757 [0,1,0,1,0,0|0,0,2]=4 2075 B14R1.122 CCCCOCSCC1=CC(=O)OC1 62a_100000716558_100011995733 [0,1,0,1,0,0|1,0,1]=4 2076 B14R1.122 CCCCOCSCC1=CC(=O)OC1 62a_100011995733_100000716558 [0,1,0,1,0,0|1,0,1]=4 2077 B14R1.122 CCCOCCNCC1=CC(=O)OC1 34a_100161115042_100000716558 [0,1,0,1,0,0|1,0,1]=4 2078 B14R1.122 CCCOCCOCC1=CC(=O)OC1 34a_100000752267_100000716558 [0,1,0,1,0,0|1,0,1]=4 2079 B14R1.122 CCCOCCSCC1=CC(=O)OC1 62a_100000716558_100011215938 [0,1,0,1,0,0|1,0,1]=4 2080 B14R1.122 CCCOCCSCC1=CC(=O)OC1 62a_100011215938_100000716558 [0,1,0,1,0,0|1,0,1]=4 2081 B14R1.122 CCCSCCOCC1=CC(=O)OC1 34a_200000230433_100000716558 [0,1,0,1,0,0|1,0,1]=4 2082 B14R1.122 CCOCCCNCC1=CC(=O)OC1 34a_100000210961_100000716558 [0,1,0,1,0,0|1,0,1]=4 2083 B14R1.122 CCOCCCOCC1=CC(=O)OC1 34a_100000757476_100000716558 [0,1,0,1,0,0|1,0,1]=4 2084 B14R1.122 CCOCCCSCC1=CC(=O)OC1 62a_100000716558_100012232248 [0,1,0,1,0,0|1,0,1]=4 2085 B14R1.122 CCOCCCSCC1=CC(=O)OC1 62a_100012232248_100000716558 [0,1,0,1,0,0|1,0,1]=4 2086 B14R1.122 CCSCCCOCC1=CC(=O)OC1 34a_100011216438_100000716558 [0,1,0,1,0,0|1,0,1]=4 2087 B14R1.122 COCCCCOCC1=CC(=O)OC1 34a_100000740925_100000716558 [0,1,0,1,0,0|1,0,1]=4 2088 B14R1.122 COCCCCSCC1=CC(=O)OC1 62a_100000716558_100000730899 [0,1,0,1,0,0|1,0,1]=4 2089 B14R1.122 COCCCCSCC1=CC(=O)OC1 62a_100000730899_100000716558 [0,1,0,1,0,0|1,0,1]=4 2090 B14R1.122 CSCCCCOCC1=CC(=O)OC1 34a_100011217163_100000716558 [0,1,0,1,0,0|1,0,1]=4 2091 B14R1.122 NCCCCCOCC1=CC(=O)OC1 34a_100000762737_100000716558 [0,1,0,1,0,0|1,0,1]=4 2092 B14R1.122 O=C1C=C(CO1)CNCCCCCO 34a_100000762737_100000716558 [0,1,0,1,0,0|1,0,1]=4 2093 B14R1.122 O=C1C=C(CO1)COCCCCCBr 34a_100000746331_100000716558 [0,1,0,1,0,0|1,0,1]=4 2094 B14R1.122 O=C1C=C(CO1)COCCCCCCl 34a_100000746330_100000716558 [0,1,0,1,0,0|1,0,1]=4 2095 B14R1.122 O=C1C=C(CO1)COCCCCCI 34a_200012148887_100000716558 [0,1,0,1,0,0|1,0,1]=4 2096 B14R1.122 O=C1C=C(CO1)CSCCCCCF 62a_100000716558_100000729378 [0,1,0,1,0,0|1,0,1]=4 2097 B14R1.122 O=C1C=C(CO1)CSCCCCCF 62a_100000729378_100000716558 [0,1,0,1,0,0|1,0,1]=4 2098 B14R1.122 O=C1C=C(CO1)CSCCCCCO 62a_100000716558_100000746330 [0,1,0,1,0,0|1,0,1]=4 2099 B14R1.122 O=C1C=C(CO1)CSCCCCCO 62a_100000746330_100000716558 [0,1,0,1,0,0|1,0,1]=4 2100 B14R1.228 CCCCC=Cc1cc(ccn1)OC 271570a_100016275911_100011216251 [0,1,0,1,0,0|1,0,1]=4 2101 B14R1.228 CCCCC=Cc1cccc(c1)OC 271570a_100016275911_100000170001 [0,1,0,1,0,0|1,0,1]=4 2102 B14R1.228 CCCCC=Cc1cccc(n1)OC 271570a_100016275911_100000760917 [0,1,0,1,0,0|1,0,1]=4 2103 B14R1.228 CCCCC=Cc1ccnc(c1)OC 271570a_100016275911_100000117307 [0,1,0,1,0,0|1,0,1]=4 2104 B14R1.228 CCCCC=Cc1ccnc(n1)OC 271570a_100016275911_100000069072 [0,1,0,1,0,0|1,0,1]=4 2105 B14R1.228 CCCCC=Cc1cncc(c1)OC 271570a_100016275911_100000684773 [0,1,0,1,0,0|1,0,1]=4 2106 B14R1.228 CCCCC=Cc1cncc(n1)OC 271570a_100016275911_100000756030 [0,1,0,1,0,0|1,0,1]=4 2107 B14R1.228 CCCCC=Cc1nccc(n1)OC 271570a_100016275911_100000182009 [0,1,0,1,0,0|1,0,1]=4 2108 B14R1.228 CCCCCCc1cccc(c1)SC 62a_100009816010_200000210301 [0,1,0,1,0,0|1,1,0]=4 2109 B14R1.228 CCCCCCc1cccc(c1)SC 62a_200000210301_100009816010 [0,1,0,1,0,0|1,1,0]=4 2110 B14R1.228 CCCCCCc1cccc(c1)S[13CH3] 62a_100009816010_200025704644 [0,1,0,1,0,0|1,1,0]=4 2111 B14R1.228 CCCCCCc1cccc(c1)S[13CH3] 62a_200025704644_100009816010 [0,1,0,1,0,0|1,1,0]=4 2112 B14R1.228 CCCCCNc1cccc(c1)CC 2230a_100000211250_100000210326 [0,1,0,1,0,0|2,0,0]=4 2113 B14R1.228 CCCCCNc1cccc(c1)CC 34a_100000211250_100000718602 [0,1,0,1,0,0|2,0,0]=4 2114 B14R1.228 CCCCCNc1cccc(c1)CC 7a_100000211250_100000210326 [0,1,0,1,0,0|2,0,0]=4 2115 B14R1.228 CCCCCNc1cccc(c1)OC 34a_100000210024_100000718602 [0,1,0,1,0,0|1,0,0]=3 2116 B14R1.228 CCCCCNc1cccc(c1)SC 2230a_100000210049_100000210326 [0,1,0,1,0,0|1,1,0]=4 2117 B14R1.228 CCCCCNc1cccc(c1)SC 34a_100000210049_100000718602 [0,1,0,1,0,0|1,1,0]=4 2118 B14R1.228 CCCCCNc1ccnc(n1)OC 27a_100000209983_100000069072 [0,1,0,1,0,0|2,0,0]=4 2119 B14R1.228 CCCCCNc1cncc(n1)OC 27a_100000209983_100009819700 [0,1,0,1,0,0|2,0,0]=4 2120 B14R1.228 CCCCCNc1nccc(n1)OC 27a_100000209983_100000182009 [0,1,0,1,0,0|2,0,0]=4 2121 B14R1.228 CCCCCOc1cccc(c1)CC 34a_100000211550_100000718602 [0,1,0,1,0,0|2,0,0]=4 2122 B14R1.228 CCCCCOc1cccc(c1)CC 7a_100000211550_100000210326 [0,1,0,1,0,0|2,0,0]=4 2123 B14R1.228 CCCCCOc1cccc(c1)NC 34a_100000756613_100000718602 [0,1,0,1,0,0|2,0,0]=4 2124 B14R1.228 CCCCCOc1cccc(c1)NC 7a_100000756613_100000210326 [0,1,0,1,0,0|2,0,0]=4 2125 B14R1.228 CCCCCOc1cccc(c1)OC 34a_100000211255_100000718602 [0,1,0,1,0,0|1,0,0]=3 2126 B14R1.228 CCCCCOc1cccc(c1)OC 7a_100000211255_100000210326 [0,1,0,1,0,0|1,0,0]=3 2127 B14R1.228 CCCCCOc1cccc(c1)SC 34a_100011265683_100000718602 [0,1,0,1,0,0|1,1,0]=4 2128 B14R1.228 CCCCCOc1cccc(c1)SC 7a_100011265683_100000210326 [0,1,0,1,0,0|1,1,0]=4 2129 B14R1.228 CCCCCOc1ccnc(c1)OC 34a_100012181050_100000718602 [0,1,0,1,0,0|2,0,0]=4 2130 B14R1.228 CCCCCOc1cncc(c1)OC 34a_100000084572_100000718602 [0,1,0,1,0,0|2,0,0]=4 2131 B14R1.228 CCCCCOc1cncc(c1)OC 7a_100000084572_100000210326 [0,1,0,1,0,0|2,0,0]=4 2132 B14R1.228 CCCCCSc1cc(ccn1)OC 62a_100000210326_100011216251 [0,1,0,1,0,0|2,0,0]=4 2133 B14R1.228 CCCCCSc1cc(ccn1)OC 62a_100009817693_100000210326 [0,1,0,1,0,0|2,0,0]=4 2134 B14R1.228 CCCCCSc1cccc(c1)CC 62a_100000210326_100011263222 [0,1,0,1,0,0|2,0,0]=4 2135 B14R1.228 CCCCCSc1cccc(c1)CC 62a_100011263222_100000210326 [0,1,0,1,0,0|2,0,0]=4 2136 B14R1.228 CCCCCSc1cccc(c1)NC 62a_100000210326_100000219648 [0,1,0,1,0,0|2,0,0]=4 2137 B14R1.228 CCCCCSc1cccc(c1)NC 62a_100000219648_100000210326 [0,1,0,1,0,0|2,0,0]=4 2138 B14R1.228 CCCCCSc1cccc(c1)OC 62a_100000210326_100000170001 [0,1,0,1,0,0|1,0,0]=3 2139 B14R1.228 CCCCCSc1cccc(c1)SC 62a_100000210326_100011215954 [0,1,0,1,0,0|1,1,0]=4 2140 B14R1.228 CCCCCSc1cccc(c1)SC 62a_100011215954_100000210326 [0,1,0,1,0,0|1,1,0]=4 2141 B14R1.228 CCCCCSc1cccc(n1)CC 62a_100000210326_100009856026 [0,1,0,1,0,0|2,0,0]=4 2142 B14R1.228 CCCCCSc1cccc(n1)CC 62a_100009856026_100000210326 [0,1,0,1,0,0|2,0,0]=4 2143 B14R1.228 CCCCCSc1cccc(n1)NC 62a_100000210326_100000703281 [0,1,0,1,0,0|2,0,0]=4 2144 B14R1.228 CCCCCSc1cccc(n1)NC 62a_100000703281_100000210326 [0,1,0,1,0,0|2,0,0]=4 2145 B14R1.228 CCCCCSc1cccc(n1)OC 62a_100000210326_100000760917 [0,1,0,1,0,0|1,0,0]=3 2146 B14R1.228 CCCCCSc1cccc(n1)OC 62a_100000760917_100000210326 [0,1,0,1,0,0|1,0,0]=3 2147 B14R1.228 CCCCCSc1cccc(n1)SC 62a_100000210326_100011960944 [0,1,0,1,0,0|1,1,0]=4 2148 B14R1.228 CCCCCSc1cccc(n1)SC 62a_100011960944_100000210326 [0,1,0,1,0,0|1,1,0]=4 2149 B14R1.228 CCCCCSc1ccnc(c1)OC 62a_100000117307_100000210326 [0,1,0,1,0,0|2,0,0]=4 2150 B14R1.228 CCCCCSc1ccnc(c1)OC 62a_100000210326_100000117307 [0,1,0,1,0,0|2,0,0]=4 2151 B14R1.228 CCCCCSc1ccnc(n1)OC 62a_100000069072_100000210326 [0,1,0,1,0,0|2,0,0]=4 2152 B14R1.228 CCCCCSc1ccnc(n1)OC 62a_100000210326_100000069072 [0,1,0,1,0,0|2,0,0]=4 2153 B14R1.228 CCCCCSc1cncc(c1)OC 62a_100000050176_100000210326 [0,1,0,1,0,0|2,0,0]=4 2154 B14R1.228 CCCCCSc1cncc(c1)OC 62a_100000210326_100000050176 [0,1,0,1,0,0|2,0,0]=4 2155 B14R1.228 CCCCCSc1cncc(n1)OC 62a_100000210326_100000756030 [0,1,0,1,0,0|2,0,0]=4 2156 B14R1.228 CCCCCSc1cncc(n1)OC 62a_100000756030_100000210326 [0,1,0,1,0,0|2,0,0]=4 2157 B14R1.228 CCCCCSc1nccc(n1)OC 62a_100000182009_100000210326 [0,1,0,1,0,0|2,0,0]=4 2158 B14R1.228 CCCCCSc1nccc(n1)OC 62a_100000210326_100000182009 [0,1,0,1,0,0|2,0,0]=4 2159 B14R1.228 CCCCNCc1cc(ccn1)OC 207a_100000102301_100000087537 [0,1,0,1,0,0|2,0,0]=4 2160 B14R1.228 CCCCNCc1cc(ccn1)OC 2230a_100000102301_100000752681 [0,1,0,1,0,0|2,0,0]=4 2161 B14R1.228 CCCCNCc1cc(ccn1)OC 270004a_100000102301_100000087537 [0,1,0,1,0,0|2,0,0]=4 2162 B14R1.228 CCCCNCc1cc(ccn1)OC 7a_106832991798_100000752681 [0,1,0,1,0,0|2,0,0]=4 2163 B14R1.228 CCCCNCc1cccc(c1)CC 207a_100000102301_100011999841 [0,1,0,1,0,0|2,0,0]=4 2164 B14R1.228 CCCCNCc1cccc(c1)CC 270004a_100000102301_100011999841 [0,1,0,1,0,0|2,0,0]=4 2165 B14R1.228 CCCCNCc1cccc(c1)OC 207a_100000102301_100000170238 [0,1,0,1,0,0|1,0,0]=3 2166 B14R1.228 CCCCNCc1cccc(c1)OC 2230a_100000102301_100000211672 [0,1,0,1,0,0|1,0,0]=3 2167 B14R1.228 CCCCNCc1cccc(c1)OC 2230a_100000174954_100000210211 [0,1,0,1,0,0|1,0,0]=3 2168 B14R1.228 CCCCNCc1cccc(c1)OC 270004a_100000102301_100000170238 [0,1,0,1,0,0|1,0,0]=3 2169 B14R1.228 CCCCNCc1cccc(c1)OC 34a_100000174954_100000210210 [0,1,0,1,0,0|1,0,0]=3 2170 B14R1.228 CCCCNCc1cccc(c1)OC 7a_106832991798_100000211672 [0,1,0,1,0,0|1,0,0]=3 2171 B14R1.228 CCCCNCc1cccc(c1)SC 207a_100000102301_100011935093 [0,1,0,1,0,0|1,1,0]=4 2172 B14R1.228 CCCCNCc1cccc(c1)SC 270004a_100000102301_100011935093 [0,1,0,1,0,0|1,1,0]=4 2173 B14R1.228 CCCCNCc1cccc(c1)SC 62a_100015186518_200000210301 [0,1,0,1,0,0|1,1,0]=4 2174 B14R1.228 CCCCNCc1cccc(c1)SC 62a_200000210301_100015186518 [0,1,0,1,0,0|1,1,0]=4 2175 B14R1.228 CCCCNCc1cccc(c1)S[13CH3] 62a_100015186518_200025704644 [0,1,0,1,0,0|1,1,0]=4 2176 B14R1.228 CCCCNCc1cccc(c1)S[13CH3] 62a_200025704644_100015186518 [0,1,0,1,0,0|1,1,0]=4 2177 B14R1.228 CCCCNCc1cccc(n1)OC 207a_100000102301_100000694346 [0,1,0,1,0,0|1,0,0]=3 2178 B14R1.228 CCCCNCc1cccc(n1)OC 2230a_100000102301_100000755263 [0,1,0,1,0,0|1,0,0]=3 2179 B14R1.228 CCCCNCc1cccc(n1)OC 2230a_100000746380_100000210211 [0,1,0,1,0,0|1,0,0]=3 2180 B14R1.228 CCCCNCc1cccc(n1)OC 270004a_100000102301_100000694346 [0,1,0,1,0,0|1,0,0]=3 2181 B14R1.228 CCCCNCc1cccc(n1)OC 7a_106832991798_100000755263 [0,1,0,1,0,0|1,0,0]=3 2182 B14R1.228 CCCCNCc1ccnc(c1)OC 207a_100000102301_100000050969 [0,1,0,1,0,0|2,0,0]=4 2183 B14R1.228 CCCCNCc1ccnc(c1)OC 2230a_100000102301_100103152439 [0,1,0,1,0,0|2,0,0]=4 2184 B14R1.228 CCCCNCc1ccnc(c1)OC 270004a_100000102301_100000050969 [0,1,0,1,0,0|2,0,0]=4 2185 B14R1.228 CCCCNCc1ccnc(c1)OC 7a_106832991798_100103152439 [0,1,0,1,0,0|2,0,0]=4 2186 B14R1.228 CCCCNCc1cncc(c1)OC 207a_100000102301_100011361638 [0,1,0,1,0,0|2,0,0]=4 2187 B14R1.228 CCCCNCc1cncc(c1)OC 2230a_100020589029_100000210211 [0,1,0,1,0,0|2,0,0]=4 2188 B14R1.228 CCCCNCc1cncc(c1)OC 270004a_100000102301_100011361638 [0,1,0,1,0,0|2,0,0]=4 2189 B14R1.228 CCCCNCc1cncc(c1)OC 34a_100020589029_100000210210 [0,1,0,1,0,0|2,0,0]=4 2190 B14R1.228 CCCCOCc1cc(ccn1)OC 34a_100000210227_100000752681 [0,1,0,1,0,0|2,0,0]=4 2191 B14R1.228 CCCCOCc1cc(ccn1)OC 34a_100000749536_100000210210 [0,1,0,1,0,0|2,0,0]=4 2192 B14R1.228 CCCCOCc1cc(ccn1)OC 7a_100000210227_100000752681 [0,1,0,1,0,0|2,0,0]=4 2193 B14R1.228 CCCCOCc1cccc(c1)OC 34a_100000198976_100000210210 [0,1,0,1,0,0|1,0,0]=3 2194 B14R1.228 CCCCOCc1cccc(c1)OC 34a_100000210227_100000688526 [0,1,0,1,0,0|1,0,0]=3 2195 B14R1.228 CCCCOCc1cccc(c1)OC 7a_100000210227_100000211672 [0,1,0,1,0,0|1,0,0]=3 2196 B14R1.228 CCCCOCc1cccc(n1)OC 34a_100000210227_100000755263 [0,1,0,1,0,0|1,0,0]=3 2197 B14R1.228 CCCCOCc1cccc(n1)OC 7a_100000210227_100000755263 [0,1,0,1,0,0|1,0,0]=3 2198 B14R1.228 CCCCOCc1ccnc(c1)OC 34a_100000210227_100103152439 [0,1,0,1,0,0|2,0,0]=4 2199 B14R1.228 CCCCOCc1ccnc(c1)OC 7a_100000210227_100103152439 [0,1,0,1,0,0|2,0,0]=4 2200 B14R1.228 CCCCOCc1cncc(c1)OC 34a_100000732071_100000210210 [0,1,0,1,0,0|2,0,0]=4 2201 B14R1.228 CCCCSCc1cc(ccn1)OC 62a_100000210211_100000752681 [0,1,0,1,0,0|2,0,0]=4 2202 B14R1.228 CCCCSCc1cc(ccn1)OC 62a_100000752681_100000210210 [0,1,0,1,0,0|2,0,0]=4 2203 B14R1.228 CCCCSCc1cccc(c1)OC 62a_100000210211_100000211672 [0,1,0,1,0,0|1,0,0]=3 2204 B14R1.228 CCCCSCc1cccc(c1)OC 62a_100000688526_100000210210 [0,1,0,1,0,0|1,0,0]=3 2205 B14R1.228 CCCCSCc1cccc(n1)OC 62a_100000210211_100000755263 [0,1,0,1,0,0|1,0,0]=3 2206 B14R1.228 CCCCSCc1cccc(n1)OC 62a_100000755263_100000210210 [0,1,0,1,0,0|1,0,0]=3 2207 B14R1.228 CCCCSCc1ccnc(c1)OC 62a_100000210211_100103152439 [0,1,0,1,0,0|2,0,0]=4 2208 B14R1.228 CCCCSCc1ccnc(c1)OC 62a_100103152439_100000210210 [0,1,0,1,0,0|2,0,0]=4 2209 B14R1.228 CCCNCCc1cccc(c1)OC 2230a_100000740386_100000210303 [0,1,0,1,0,0|1,0,0]=3 2210 B14R1.228 CCCNCCc1cccc(c1)OC 34a_100000740386_100000210303 [0,1,0,1,0,0|1,0,0]=3 2211 B14R1.228 CCCOCCc1cccc(c1)OC 34a_100000210258_100011713679 [0,1,0,1,0,0|1,0,0]=3 2212 B14R1.228 CCCOCCc1cccc(c1)OC 34a_100011215300_100000210303 [0,1,0,1,0,0|1,0,0]=3 2213 B14R1.228 CCCOCCc1cccc(c1)OC 7a_100011215300_100000210303 [0,1,0,1,0,0|1,0,0]=3 2214 B14R1.228 CCCSCCc1cccc(c1)OC 62a_100000210303_100011713679 [0,1,0,1,0,0|1,0,0]=3 2215 B14R1.228 CCCSCCc1cccc(c1)OC 62a_100011713679_100000210303 [0,1,0,1,0,0|1,0,0]=3 2216 B14R1.228 CCNCCCc1cccc(c1)OC 2230a_100000750448_100000210202 [0,1,0,1,0,0|1,0,0]=3 2217 B14R1.228 CCNCCCc1cccc(c1)OC 34a_100000750448_100000210202 [0,1,0,1,0,0|1,0,0]=3 2218 B14R1.228 CCNCCOc1cccc(c1)OC 2230a_100000737234_100000210202 [0,1,0,1,0,0|2,0,0]=4 2219 B14R1.228 CCNCCOc1cccc(c1)OC 2230a_100015525214_100000691273 [0,1,0,1,0,0|2,0,0]=4 2220 B14R1.228 CCNCCOc1cccc(c1)OC 34a_100000737234_100000210202 [0,1,0,1,0,0|2,0,0]=4 2221 B14R1.228 CCOCCCc1cccc(c1)OC 34a_100000760512_100000210202 [0,1,0,1,0,0|1,0,0]=3 2222 B14R1.228 CCOCCCc1cccc(c1)OC 7a_100000760512_100000210202 [0,1,0,1,0,0|1,0,0]=3 2223 B14R1.228 CCOCCNc1cccc(c1)OC 34a_100000210024_100000210147 [0,1,0,1,0,0|2,0,0]=4 2224 B14R1.228 CCOCCOc1cccc(c1)OC 34a_100000211255_100000210147 [0,1,0,1,0,0|2,0,0]=4 2225 B14R1.228 CCOCCOc1cccc(c1)OC 34a_100121572206_100000691273 [0,1,0,1,0,0|2,0,0]=4 2226 B14R1.228 CCOCCOc1cccc(c1)OC 7a_100000211255_100011215890 [0,1,0,1,0,0|2,0,0]=4 2227 B14R1.228 CCOCCSc1cccc(c1)OC 62a_100000210147_100000170001 [0,1,0,1,0,0|2,0,0]=4 2228 B14R1.228 CCOCCSc1cccc(c1)OC 7a_200011235993_100000210202 [0,1,0,1,0,0|2,0,0]=4 2229 B14R1.228 CCOCCSc1cccc(n1)OC 62a_100000210147_100000760917 [0,1,0,1,0,0|2,0,0]=4 2230 B14R1.228 CCOCCSc1cccc(n1)OC 62a_100000760917_100011215890 [0,1,0,1,0,0|2,0,0]=4 2231 B14R1.228 CCOCSCc1cccc(c1)OC 62a_100000688526_100000739092 [0,1,0,1,0,0|2,0,0]=4 2232 B14R1.228 CCOCSCc1cccc(c1)OC 62a_100000739092_100000211672 [0,1,0,1,0,0|2,0,0]=4 2233 B14R1.228 CCOCSCc1cccc(n1)OC 62a_100000739092_100000755263 [0,1,0,1,0,0|2,0,0]=4 2234 B14R1.228 CCOCSCc1cccc(n1)OC 62a_100000755263_100000739092 [0,1,0,1,0,0|2,0,0]=4 2235 B14R1.228 CCSCCNc1cccc(c1)OC 34a_100000210024_100000757381 [0,1,0,1,0,0|2,0,0]=4 2236 B14R1.228 CCSCCOc1cccc(c1)OC 34a_100000211255_100000757381 [0,1,0,1,0,0|2,0,0]=4 2237 B14R1.228 CCSCCOc1cccc(c1)OC 62a_100000210202_100000691273 [0,1,0,1,0,0|2,0,0]=4 2238 B14R1.228 CCSCCOc1cccc(c1)OC 62a_100000691273_100000210202 [0,1,0,1,0,0|2,0,0]=4 2239 B14R1.228 CCSCCOc1cccc(c1)OC 7a_100000211255_100000757381 [0,1,0,1,0,0|2,0,0]=4 2240 B14R1.228 CCSCCSc1cccc(c1)OC 62a_100000757381_100000170001 [0,1,0,1,0,0|2,0,0]=4 2241 B14R1.228 CCSCCSc1cccc(n1)OC 62a_100000757381_100000760917 [0,1,0,1,0,0|2,0,0]=4 2242 B14R1.228 CCSCCSc1cccc(n1)OC 62a_100000760917_100000757381 [0,1,0,1,0,0|2,0,0]=4 2243 B14R1.228 CNCCCOc1cccc(c1)OC 2230a_100000758337_200000210301 [0,1,0,1,0,0|2,0,0]=4 2244 B14R1.228 CNCCCOc1cccc(c1)OC 34a_100000758337_200000210301 [0,1,0,1,0,0|2,0,0]=4 2245 B14R1.228 COCCCNc1cccc(c1)OC 34a_100000210024_100000740836 [0,1,0,1,0,0|2,0,0]=4 2246 B14R1.228 COCCCOc1cccc(c1)OC 34a_100000211255_100000740836 [0,1,0,1,0,0|2,0,0]=4 2247 B14R1.228 COCCCOc1cccc(c1)OC 7a_100000211255_100000740836 [0,1,0,1,0,0|2,0,0]=4 2248 B14R1.228 COCCCSc1cccc(c1)OC 62a_100000709357_100000170001 [0,1,0,1,0,0|2,0,0]=4 2249 B14R1.228 COCCCSc1cccc(n1)OC 62a_100000709357_100000760917 [0,1,0,1,0,0|2,0,0]=4 2250 B14R1.228 COCCCSc1cccc(n1)OC 62a_100000760917_100000709357 [0,1,0,1,0,0|2,0,0]=4 2251 B14R1.228 COCCNCc1cccc(c1)OC 207a_100000209980_100000170238 [0,1,0,1,0,0|2,0,0]=4 2252 B14R1.228 COCCNCc1cccc(c1)OC 2230a_100000174954_100011201679 [0,1,0,1,0,0|2,0,0]=4 2253 B14R1.228 COCCNCc1cccc(c1)OC 2230a_100000209980_100000211672 [0,1,0,1,0,0|2,0,0]=4 2254 B14R1.228 COCCNCc1cccc(c1)OC 270004a_100000209980_100000170238 [0,1,0,1,0,0|2,0,0]=4 2255 B14R1.228 COCCNCc1cccc(c1)OC 34a_100000174954_100011201679 [0,1,0,1,0,0|2,0,0]=4 2256 B14R1.228 COCCNCc1cccc(n1)OC 207a_100000209980_100000694346 [0,1,0,1,0,0|2,0,0]=4 2257 B14R1.228 COCCNCc1cccc(n1)OC 2230a_100000209980_100000755263 [0,1,0,1,0,0|2,0,0]=4 2258 B14R1.228 COCCNCc1cccc(n1)OC 2230a_100000746380_100011201679 [0,1,0,1,0,0|2,0,0]=4 2259 B14R1.228 COCCNCc1cccc(n1)OC 270004a_100000209980_100000694346 [0,1,0,1,0,0|2,0,0]=4 2260 B14R1.228 COCCOCc1cccc(c1)OC 34a_100000198976_100011201679 [0,1,0,1,0,0|2,0,0]=4 2261 B14R1.228 COCCOCc1cccc(c1)OC 34a_100000210237_100000688526 [0,1,0,1,0,0|2,0,0]=4 2262 B14R1.228 COCCOCc1cccc(n1)OC 34a_100000210237_100000755263 [0,1,0,1,0,0|2,0,0]=4 2263 B14R1.228 COCCSCc1cccc(c1)OC 62a_100000233755_100000211672 [0,1,0,1,0,0|2,0,0]=4 2264 B14R1.228 COCCSCc1cccc(c1)OC 62a_100000688526_100000233755 [0,1,0,1,0,0|2,0,0]=4 2265 B14R1.228 COCCSCc1cccc(n1)OC 62a_100000233755_100000755263 [0,1,0,1,0,0|2,0,0]=4 2266 B14R1.228 COCCSCc1cccc(n1)OC 62a_100000755263_100000233755 [0,1,0,1,0,0|2,0,0]=4 2267 B14R1.228 COCNCCc1cccc(c1)OC 2230a_100000740386_100000766300 [0,1,0,1,0,0|2,0,0]=4 2268 B14R1.228 COCSCCc1cccc(c1)OC 62a_100000766300_100011713679 [0,1,0,1,0,0|2,0,0]=4 2269 B14R1.228 COCSCCc1cccc(c1)OC 62a_100011713679_100000766300 [0,1,0,1,0,0|2,0,0]=4 2270 B14R1.228 COc1cccc(c1)CCCNCF 34a_100000750448_100015361967 [0,1,0,1,0,0|2,0,0]=4 2271 B14R1.228 COc1cccc(c1)CCCOCF 34a_100000760512_100015361967 [0,1,0,1,0,0|2,0,0]=4 2272 B14R1.228 COc1cccc(c1)CCCOCF 7a_100000760512_100015361967 [0,1,0,1,0,0|2,0,0]=4 2273 B14R1.228 COc1cccc(c1)CCNCCF 2230a_100000740386_100011217306 [0,1,0,1,0,0|2,0,0]=4 2274 B14R1.228 COc1cccc(c1)CCNCCF 34a_100000724931_100011713679 [0,1,0,1,0,0|2,0,0]=4 2275 B14R1.228 COc1cccc(c1)CCNCCF 34a_100000740386_100011217306 [0,1,0,1,0,0|2,0,0]=4 2276 B14R1.228 COc1cccc(c1)CCNCCO 2230a_100000740386_100000211926 [0,1,0,1,0,0|2,0,0]=4 2277 B14R1.228 COc1cccc(c1)CCNCCO 2230a_100016997473_100011713679 [0,1,0,1,0,0|2,0,0]=4 2278 B14R1.228 COc1cccc(c1)CCNCCO 34a_100000740386_100000211926 [0,1,0,1,0,0|2,0,0]=4 2279 B14R1.228 COc1cccc(c1)CCNCCO 34a_100016990907_100011713679 [0,1,0,1,0,0|2,0,0]=4 2280 B14R1.228 COc1cccc(c1)CCNCSC 2230a_100000740386_100011218213 [0,1,0,1,0,0|2,0,0]=4 2281 B14R1.228 COc1cccc(c1)CCNCSC 34a_100000740386_100011218213 [0,1,0,1,0,0|2,0,0]=4 2282 B14R1.228 COc1cccc(c1)CCOCCBr 34a_100000211926_100011713679 [0,1,0,1,0,0|2,0,0]=4 2283 B14R1.228 COc1cccc(c1)CCOCCF 34a_100011215300_100011217306 [0,1,0,1,0,0|2,0,0]=4 2284 B14R1.228 COc1cccc(c1)CCOCCF 7a_100011215300_100011217306 [0,1,0,1,0,0|2,0,0]=4 2285 B14R1.228 COc1cccc(c1)CCOCCN 34a_100000210304_100011713679 [0,1,0,1,0,0|2,0,0]=4 2286 B14R1.228 COc1cccc(c1)CCOCCO 34a_100011215300_100000211926 [0,1,0,1,0,0|2,0,0]=4 2287 B14R1.228 COc1cccc(c1)CCOCCO 7a_100011215300_100000211926 [0,1,0,1,0,0|2,0,0]=4 2288 B14R1.228 COc1cccc(c1)CCOCSC 34a_100011215300_100011218213 [0,1,0,1,0,0|2,0,0]=4 2289 B14R1.228 COc1cccc(c1)CCSCCF 62a_100011217306_100011713679 [0,1,0,1,0,0|2,0,0]=4 2290 B14R1.228 COc1cccc(c1)CCSCCF 62a_100011713679_100011217306 [0,1,0,1,0,0|2,0,0]=4 2291 B14R1.228 COc1cccc(c1)CCSCCO 62a_100000211926_100011713679 [0,1,0,1,0,0|2,0,0]=4 2292 B14R1.228 COc1cccc(c1)CCSCCO 62a_100011713679_100000211926 [0,1,0,1,0,0|2,0,0]=4 2293 B14R1.228 COc1cccc(c1)CCSCSC 62a_100011218213_100011713679 [0,1,0,1,0,0|2,0,0]=4 2294 B14R1.228 COc1cccc(c1)CCSCSC 62a_100011713679_100011218213 [0,1,0,1,0,0|2,0,0]=4 2295 B14R1.228 COc1cccc(c1)CNCCCF 207a_100015189416_100000170238 [0,1,0,1,0,0|2,0,0]=4 2296 B14R1.228 COc1cccc(c1)CNCCCF 2230a_100000174954_100011934791 [0,1,0,1,0,0|2,0,0]=4 2297 B14R1.228 COc1cccc(c1)CNCCCF 2230a_100015189416_100000211672 [0,1,0,1,0,0|2,0,0]=4 2298 B14R1.228 COc1cccc(c1)CNCCCF 270004a_100015189416_100000170238 [0,1,0,1,0,0|2,0,0]=4 2299 B14R1.228 COc1cccc(c1)CNCCCF 34a_100000174954_100011934791 [0,1,0,1,0,0|2,0,0]=4 2300 B14R1.228 COc1cccc(c1)CNCCCF 34a_100015189416_100000688526 [0,1,0,1,0,0|2,0,0]=4 2301 B14R1.228 COc1cccc(c1)CNCCCO 207a_100000182051_100000170238 [0,1,0,1,0,0|2,0,0]=4 2302 B14R1.228 COc1cccc(c1)CNCCCO 2230a_100000174954_100000230001 [0,1,0,1,0,0|2,0,0]=4 2303 B14R1.228 COc1cccc(c1)CNCCCO 270004a_100000182051_100000170238 [0,1,0,1,0,0|2,0,0]=4 2304 B14R1.228 COc1cccc(c1)CNCCCO 34a_100000174954_100000230001 [0,1,0,1,0,0|2,0,0]=4 2305 B14R1.228 COc1cccc(c1)CNCCSC 207a_100020590264_100000170238 [0,1,0,1,0,0|2,0,0]=4 2306 B14R1.228 COc1cccc(c1)CNCCSC 2230a_100000174954_100000751147 [0,1,0,1,0,0|2,0,0]=4 2307 B14R1.228 COc1cccc(c1)CNCCSC 2230a_100020590264_100000211672 [0,1,0,1,0,0|2,0,0]=4 2308 B14R1.228 COc1cccc(c1)CNCCSC 270004a_100020590264_100000170238 [0,1,0,1,0,0|2,0,0]=4 2309 B14R1.228 COc1cccc(c1)CNCCSC 34a_100000174954_100000212216 [0,1,0,1,0,0|2,0,0]=4 2310 B14R1.228 COc1cccc(c1)COCCCBr 34a_100011217188_100000688526 [0,1,0,1,0,0|2,0,0]=4 2311 B14R1.228 COc1cccc(c1)COCCCCl 34a_100000230001_100000688526 [0,1,0,1,0,0|2,0,0]=4 2312 B14R1.228 COc1cccc(c1)COCCCF 34a_100000198976_100011934791 [0,1,0,1,0,0|2,0,0]=4 2313 B14R1.228 COc1cccc(c1)COCCCF 34a_100000759539_100000688526 [0,1,0,1,0,0|2,0,0]=4 2314 B14R1.228 COc1cccc(c1)COCCCN 34a_100000182051_100000688526 [0,1,0,1,0,0|2,0,0]=4 2315 B14R1.228 COc1cccc(c1)COCCCO 34a_100000198976_100000230001 [0,1,0,1,0,0|2,0,0]=4 2316 B14R1.228 COc1cccc(c1)COCCSC 34a_100000198976_100000212216 [0,1,0,1,0,0|2,0,0]=4 2317 B14R1.228 COc1cccc(c1)COCCSC 34a_100000230434_100000688526 [0,1,0,1,0,0|2,0,0]=4 2318 B14R1.228 COc1cccc(c1)COCCSC 7a_100000230434_100000211672 [0,1,0,1,0,0|2,0,0]=4 2319 B14R1.228 COc1cccc(c1)CSCCCF 62a_100000688526_100011934791 [0,1,0,1,0,0|2,0,0]=4 2320 B14R1.228 COc1cccc(c1)CSCCCF 62a_100011934791_100000211672 [0,1,0,1,0,0|2,0,0]=4 2321 B14R1.228 COc1cccc(c1)CSCCCO 62a_100000688526_100011215043 [0,1,0,1,0,0|2,0,0]=4 2322 B14R1.228 COc1cccc(c1)CSCCCO 62a_100011215043_100000211672 [0,1,0,1,0,0|2,0,0]=4 2323 B14R1.228 COc1cccc(c1)CSCCSC 62a_100000212216_100000211672 [0,1,0,1,0,0|2,0,0]=4 2324 B14R1.228 COc1cccc(c1)CSCCSC 62a_100000688526_100000751147 [0,1,0,1,0,0|2,0,0]=4 2325 B14R1.228 COc1cccc(c1)NCCCCF 34a_100000210024_100000729493 [0,1,0,1,0,0|2,0,0]=4 2326 B14R1.228 COc1cccc(c1)NCCCCO 34a_100000210024_100011216708 [0,1,0,1,0,0|2,0,0]=4 2327 B14R1.228 COc1cccc(c1)OCCCCF 34a_100000211255_100000729493 [0,1,0,1,0,0|2,0,0]=4 2328 B14R1.228 COc1cccc(c1)OCCCCF 7a_100000211255_100000729493 [0,1,0,1,0,0|2,0,0]=4 2329 B14R1.228 COc1cccc(c1)OCCCCO 34a_100000211255_100011216708 [0,1,0,1,0,0|2,0,0]=4 2330 B14R1.228 COc1cccc(c1)OCCCCO 7a_100000211255_100000210776 [0,1,0,1,0,0|2,0,0]=4 2331 B14R1.228 COc1cccc(c1)OCCCN[13CH3] 2230a_100000758337_200025704644 [0,1,0,1,0,0|2,0,0]=4 2332 B14R1.228 COc1cccc(c1)OCCCN[13CH3] 34a_100000758337_200025704644 [0,1,0,1,0,0|2,0,0]=4 2333 B14R1.228 COc1cccc(c1)SCCCCF 62a_100000729493_100000170001 [0,1,0,1,0,0|2,0,0]=4 2334 B14R1.228 COc1cccc(c1)SCCCCO 62a_100000210776_100000170001 [0,1,0,1,0,0|2,0,0]=4 2335 B14R1.228 COc1cccc(n1)CNCCCF 207a_100015189416_100000694346 [0,1,0,1,0,0|2,0,0]=4 2336 B14R1.228 COc1cccc(n1)CNCCCF 2230a_100000746380_100011934791 [0,1,0,1,0,0|2,0,0]=4 2337 B14R1.228 COc1cccc(n1)CNCCCF 2230a_100015189416_100000755263 [0,1,0,1,0,0|2,0,0]=4 2338 B14R1.228 COc1cccc(n1)CNCCCF 270004a_100015189416_100000694346 [0,1,0,1,0,0|2,0,0]=4 2339 B14R1.228 COc1cccc(n1)CNCCCF 34a_100015189416_100000755263 [0,1,0,1,0,0|2,0,0]=4 2340 B14R1.228 COc1cccc(n1)CNCCCO 207a_100000182051_100000694346 [0,1,0,1,0,0|2,0,0]=4 2341 B14R1.228 COc1cccc(n1)CNCCCO 2230a_100000746380_100000230001 [0,1,0,1,0,0|2,0,0]=4 2342 B14R1.228 COc1cccc(n1)CNCCCO 270004a_100000182051_100000694346 [0,1,0,1,0,0|2,0,0]=4 2343 B14R1.228 COc1cccc(n1)CNCCSC 207a_100020590264_100000694346 [0,1,0,1,0,0|2,0,0]=4 2344 B14R1.228 COc1cccc(n1)CNCCSC 2230a_100000746380_100000751147 [0,1,0,1,0,0|2,0,0]=4 2345 B14R1.228 COc1cccc(n1)CNCCSC 2230a_100020590264_100000755263 [0,1,0,1,0,0|2,0,0]=4 2346 B14R1.228 COc1cccc(n1)CNCCSC 270004a_100020590264_100000694346 [0,1,0,1,0,0|2,0,0]=4 2347 B14R1.228 COc1cccc(n1)COCCCBr 34a_100011217188_100000755263 [0,1,0,1,0,0|2,0,0]=4 2348 B14R1.228 COc1cccc(n1)COCCCCl 34a_100000230001_100000755263 [0,1,0,1,0,0|2,0,0]=4 2349 B14R1.228 COc1cccc(n1)COCCCF 34a_100000759539_100000755263 [0,1,0,1,0,0|2,0,0]=4 2350 B14R1.228 COc1cccc(n1)COCCCN 34a_100000182051_100000755263 [0,1,0,1,0,0|2,0,0]=4 2351 B14R1.228 COc1cccc(n1)COCCSC 34a_100000230434_100000755263 [0,1,0,1,0,0|2,0,0]=4 2352 B14R1.228 COc1cccc(n1)COCCSC 7a_100000230434_100000755263 [0,1,0,1,0,0|2,0,0]=4 2353 B14R1.228 COc1cccc(n1)CSCCCF 62a_100000755263_100011934791 [0,1,0,1,0,0|2,0,0]=4 2354 B14R1.228 COc1cccc(n1)CSCCCF 62a_100011934791_100000755263 [0,1,0,1,0,0|2,0,0]=4 2355 B14R1.228 COc1cccc(n1)CSCCCO 62a_100000755263_100011215043 [0,1,0,1,0,0|2,0,0]=4 2356 B14R1.228 COc1cccc(n1)CSCCCO 62a_100011215043_100000755263 [0,1,0,1,0,0|2,0,0]=4 2357 B14R1.228 COc1cccc(n1)CSCCSC 62a_100000212216_100000755263 [0,1,0,1,0,0|2,0,0]=4 2358 B14R1.228 COc1cccc(n1)CSCCSC 62a_100000755263_100000751147 [0,1,0,1,0,0|2,0,0]=4 2359 B14R1.228 COc1cccc(n1)SCCCCF 62a_100000729493_100000760917 [0,1,0,1,0,0|2,0,0]=4 2360 B14R1.228 COc1cccc(n1)SCCCCF 62a_100000760917_100000729493 [0,1,0,1,0,0|2,0,0]=4 2361 B14R1.228 COc1cccc(n1)SCCCCO 62a_100000210776_100000760917 [0,1,0,1,0,0|2,0,0]=4 2362 B14R1.228 COc1cccc(n1)SCCCCO 62a_100000760917_100000210776 [0,1,0,1,0,0|2,0,0]=4 2363 B14R1.259 COCC1CCN1C/C=C/C(=O)OC 2230a_100015195929_100000742655 [0,1,0,1,0,0|1,0,1]=4 2364 B14R1.259 COCC1CCN1C/C=C/C(=O)OC 269982a_100015195929_100000742655 [0,1,0,1,0,0|1,0,1]=4 2365 B14R1.259 COCC1CCN1C/C=C/C(=O)OC 34a_100015195929_100000742655 [0,1,0,1,0,0|1,0,1]=4 2366 B14R1.789 CCCCc1ccccc1C(=O)NC 271570a_100020621405_100000155073 [0,1,0,1,0,0|1,0,1]=4 2367 B14R1.789 CCCCc1ccccc1C(=O)OC 271570a_100020621405_100000148710 [0,1,0,1,0,0|0,0,1]=3 2368 B14R1.789 CCCCc1cccnc1C(=O)OC 271570a_100020621405_100011935214 [0,1,0,1,0,0|0,0,1]=3 2369 B14R1.789 CCCCc1ccncc1C(=O)OC 271570a_100020621405_100020629055 [0,1,0,1,0,0|0,0,1]=3 2370 B14R1.789 CCCCc1cnccc1C(=O)OC 271570a_100020621405_100010008606 [0,1,0,1,0,0|0,0,1]=3 2371 B14R1.789 CCCCc1cncnc1C(=O)OC 271570a_100020621405_100012360100 [0,1,0,1,0,0|1,0,1]=4 2372 B14R1.789 CCCCc1ncccc1C(=O)NC 271570a_100020621405_100000159833 [0,1,0,1,0,0|1,0,1]=4 2373 B14R1.789 CCCCc1ncccc1C(=O)OC 271570a_100020621405_100000150852 [0,1,0,1,0,0|0,0,1]=3 2374 B14R1.789 CCCCc1nccnc1C(=O)OC 271570a_100020621405_100000688410 [0,1,0,1,0,0|1,0,1]=4 2375 B14R1.789 CCCCc1ncncc1C(=O)OC 271570a_100020621405_100000726419 [0,1,0,1,0,0|1,0,1]=4 2376 B14R1.789 CCCOc1ccccc1C(=O)OC 7a_100000150335_100000210303 [0,1,0,1,0,0|0,0,2]=4 2377 B14R1.789 CCCOc1cccnc1C(=O)OC 34a_100000744052_100000210303 [0,1,0,1,0,0|1,0,1]=4 2378 B14R1.789 CCCOc1cccnc1C(=O)OC 7a_100000744052_100000210303 [0,1,0,1,0,0|1,0,1]=4 2379 B14R1.789 CCCSc1ccccc1C(=O)OC 62a_100000148710_100000210303 [0,1,0,1,0,0|0,0,2]=4 2380 B14R1.789 CCCSc1ccccc1C(=O)OC 62a_100000210303_100000148710 [0,1,0,1,0,0|0,0,2]=4 2381 B14R1.789 CCCSc1cccnc1C(=O)OC 62a_100000210303_100011935214 [0,1,0,1,0,0|1,0,1]=4 2382 B14R1.789 CCCSc1cccnc1C(=O)OC 62a_100011935214_100000210303 [0,1,0,1,0,0|1,0,1]=4 2383 B14R1.789 CCCSc1ccncc1C(=O)OC 62a_100000210303_100020629055 [0,1,0,1,0,0|1,0,1]=4 2384 B14R1.789 CCCSc1ccncc1C(=O)OC 62a_100020629055_100000210303 [0,1,0,1,0,0|1,0,1]=4 2385 B14R1.789 CCCSc1cnccc1C(=O)OC 62a_100000210303_100010008606 [0,1,0,1,0,0|1,0,1]=4 2386 B14R1.789 CCCSc1cnccc1C(=O)OC 62a_100010008606_100000210303 [0,1,0,1,0,0|1,0,1]=4 2387 B14R1.789 CCCSc1ncccc1C(=O)OC 62a_100000210303_100000150852 [0,1,0,1,0,0|1,0,1]=4 2388 B14R1.789 CCCSc1ncccc1C(=O)OC 62a_100011587185_100000210303 [0,1,0,1,0,0|1,0,1]=4 2389 B14R1.789 CCNCc1ccccc1C(=O)OC 2230a_100015525214_100000744672 [0,1,0,1,0,0|0,0,2]=4 2390 B14R1.789 CCNCc1cccnc1C(=O)OC 2230a_100015525214_100010177730 [0,1,0,1,0,0|1,0,1]=4 2391 B14R1.789 CCNCc1ncccc1C(=O)OC 2230a_100015525214_100000709840 [0,1,0,1,0,0|1,0,1]=4 2392 B14R1.789 CCOCc1ccccc1C(=O)OC 34a_100121572206_100000744672 [0,1,0,1,0,0|0,0,2]=4 2393 B14R1.789 CCOCc1cccnc1C(=O)OC 34a_100121572206_100010177730 [0,1,0,1,0,0|1,0,1]=4 2394 B14R1.789 CCOCc1ncccc1C(=O)OC 34a_100121572206_100012347567 [0,1,0,1,0,0|1,0,1]=4 2395 B14R1.789 CCSCc1ccccc1C(=O)OC 62a_100000210202_100000744672 [0,1,0,1,0,0|0,0,2]=4 2396 B14R1.789 CCSCc1ccccc1C(=O)OC 62a_100000744672_100000210202 [0,1,0,1,0,0|0,0,2]=4 2397 B14R1.789 CCSCc1cccnc1C(=O)OC 62a_100000210202_100010177730 [0,1,0,1,0,0|1,0,1]=4 2398 B14R1.789 CCSCc1cccnc1C(=O)OC 62a_100010177730_100000210202 [0,1,0,1,0,0|1,0,1]=4 2399 B14R1.789 CCSCc1ncccc1C(=O)OC 62a_100000210202_100000709840 [0,1,0,1,0,0|1,0,1]=4 2400 B14R1.789 CCSCc1ncccc1C(=O)OC 62a_100000709840_100000210202 [0,1,0,1,0,0|1,0,1]=4 2401 B14R1.789 CNCCc1ccccc1C(=O)OC 2230a_106832991635_200010284099 [0,1,0,1,0,0|0,0,2]=4 2402 B14R1.789 CNCCc1ccccc1C(=O)OC 34a_100102657272_200010284099 [0,1,0,1,0,0|0,0,2]=4 2403 B14R1.789 CNCCc1ccccc1C(=O)OC 7a_106832991635_200010284099 [0,1,0,1,0,0|0,0,2]=4 2404 B14R1.789 COC(=O)c1ccccc1CCSC 62a_200000210301_200010284099 [0,1,0,1,0,0|0,0,2]=4 2405 B14R1.789 COC(=O)c1ccccc1CCSC 62a_200010284099_200000210301 [0,1,0,1,0,0|0,0,2]=4 2406 B14R1.789 COC(=O)c1ccccc1CCS[13CH3] 62a_200010284099_200025704644 [0,1,0,1,0,0|0,0,2]=4 2407 B14R1.789 COC(=O)c1ccccc1CCS[13CH3] 62a_200025704644_200010284099 [0,1,0,1,0,0|0,0,2]=4 2408 B14R1.789 COCCc1ccccc1C(=O)OC 34a_100138415774_200010284099 [0,1,0,1,0,0|0,0,2]=4 2409 B14R1.800 CCCCC1C=CCN1CC(=O)OC 2230a_100015184376_100000747449 [0,1,0,1,0,0|0,0,2]=4 2410 B14R1.800 CCCCC1C=CCN1CC(=O)OC 269982a_100015184376_100000747449 [0,1,0,1,0,0|0,0,2]=4 2411 B14R1.800 CCCCC1C=CCN1CC(=O)OC 34a_100015184376_100000747449 [0,1,0,1,0,0|0,0,2]=4 2412 B14R1.823 COC(=O)/C=C/COCCC1COC1 34a_100009855314_100000742655 [0,1,0,1,0,0|1,0,1]=4 2413 B14R1.823 COC(=O)C=CC=NNCC1CCC1 4a_200020586977_100016254430 [0,1,0,1,0,0|1,0,0]=3 2414 B14R1.827 COC(=O)/C=C/COCCNC1CC1 34a_100000738766_100000742655 [0,1,0,1,0,0|1,0,1]=4 2415 B14R1.827 COC(=O)/C=C/CSCCCC1CO1 62a_100000733510_100000742655 [0,1,0,1,0,0|1,0,1]=4 2416 B14R1.827 COC(=O)/C=C/CSCCCC1CO1 62a_100000742655_100000733510 [0,1,0,1,0,0|1,0,1]=4 2417 B14R1.913 CCCC=Cc1cc[nH]c1C(=O)OC 271570a_100016258520_100102525103 [0,1,0,1,0,0|0,0,2]=4 2418 B14R1.913 CCCC=Cc1ccoc1C(=O)OC 271570a_100016258520_100012676306 [0,1,0,1,0,0|0,0,2]=4 2419 B14R1.913 CCCC=Cc1ccsc1C(=O)OC 271570a_100016258520_100000730364 [0,1,0,1,0,0|0,0,2]=4 2420 B14R1.913 CCCC=Cc1cscc1C(=O)OC 271570a_100016258520_100012351140 [0,1,0,1,0,0|0,0,2]=4 2421 B14R1.913 CCCC=Cc1occc1C(=O)OC 271570a_100016258520_100011935261 [0,1,0,1,0,0|0,0,2]=4 2422 B14R1.913 CCCC=Cc1sccc1C(=O)OC 271570a_100016258520_100009822520 [0,1,0,1,0,0|0,0,2]=4 2423 B14R1.913 CCCCOc1cc[nH]c1C(=O)OC 34a_100000131702_100000210210 [0,1,0,1,0,0|1,0,0]=3 2424 B14R1.913 CCCCOc1ccsc1C(=O)OC 7a_100000043449_100000210211 [0,1,0,1,0,0|1,0,0]=3 2425 B14R1.913 CCCCSc1cc[nH]c1C(=O)OC 62a_100000210211_100102525103 [0,1,0,1,0,0|1,0,0]=3 2426 B14R1.913 CCCCSc1ccoc1C(=O)OC 62a_100000210211_100012676306 [0,1,0,1,0,0|1,0,0]=3 2427 B14R1.913 CCCCSc1ccsc1C(=O)OC 62a_100000210211_100000730364 [0,1,0,1,0,0|1,0,0]=3 2428 B14R1.913 CCCCSc1cn[nH]c1C(=O)OC 62a_100000210211_100012355743 [0,1,0,1,0,0|2,0,0]=4 2429 B14R1.913 CCCCSc1cscc1C(=O)OC 62a_100000210211_100012351140 [0,1,0,1,0,0|1,0,0]=3 2430 B14R1.913 CCCCSc1cscc1C(=O)OC 62a_100012351140_100000210210 [0,1,0,1,0,0|1,0,0]=3 2431 B14R1.913 CCCCSc1nc[nH]c1C(=O)OC 62a_100000210211_100010290838 [0,1,0,1,0,0|2,0,0]=4 2432 B14R1.913 CCCCSc1ncsc1C(=O)OC 62a_100000210211_100013370767 [0,1,0,1,0,0|2,0,0]=4 2433 B14R1.913 CCCCSc1occc1C(=O)OC 62a_100000210211_100011935261 [0,1,0,1,0,0|1,0,0]=3 2434 B14R1.913 CCCCSc1sccc1C(=O)OC 62a_100000210211_100009822520 [0,1,0,1,0,0|1,0,0]=3 2435 B14R1.913 CCCCSc1sccc1C(=O)OC 62a_100009822520_100000210210 [0,1,0,1,0,0|1,0,0]=3 2436 B14R1.913 CCCCSc1scnc1C(=O)OC 62a_100000210211_100009816836 [0,1,0,1,0,0|2,0,0]=4 2437 B14R1.913 CCCCSc1scnc1C(=O)OC 62a_100009816836_100000210210 [0,1,0,1,0,0|2,0,0]=4 2438 B14R1.913 CCCOCc1ccoc1C(=O)OC 34a_100000210258_100000734845 [0,1,0,1,0,0|1,0,0]=3 2439 B14R1.913 CCCOCc1occc1C(=O)OC 34a_100000210258_100009813464 [0,1,0,1,0,0|1,0,0]=3 2440 B14R1.913 CCCSCc1ccoc1C(=O)OC 62a_100000210303_100000734845 [0,1,0,1,0,0|1,0,0]=3 2441 B14R1.913 CCCSCc1occc1C(=O)OC 62a_100000210303_100009813464 [0,1,0,1,0,0|1,0,0]=3 2442 B14R1.913 CCCSCc1occc1C(=O)OC 62a_100009813464_100000210303 [0,1,0,1,0,0|1,0,0]=3 2443 B14R1.913 CCOCSc1cc[nH]c1C(=O)OC 62a_100000739092_100102525103 [0,1,0,1,0,0|2,0,0]=4 2444 B14R1.913 CCOCSc1ccoc1C(=O)OC 62a_100000739092_100012676306 [0,1,0,1,0,0|2,0,0]=4 2445 B14R1.913 CCOCSc1ccsc1C(=O)OC 62a_100000739092_100000730364 [0,1,0,1,0,0|2,0,0]=4 2446 B14R1.913 CCOCSc1cscc1C(=O)OC 62a_100000739092_100012351140 [0,1,0,1,0,0|2,0,0]=4 2447 B14R1.913 CCOCSc1cscc1C(=O)OC 62a_100012351140_100000739092 [0,1,0,1,0,0|2,0,0]=4 2448 B14R1.913 CCOCSc1occc1C(=O)OC 62a_100000739092_100011935261 [0,1,0,1,0,0|2,0,0]=4 2449 B14R1.913 CCOCSc1sccc1C(=O)OC 62a_100000739092_100009822520 [0,1,0,1,0,0|2,0,0]=4 2450 B14R1.913 CCOCSc1sccc1C(=O)OC 62a_100009822520_100000739092 [0,1,0,1,0,0|2,0,0]=4 2451 B14R1.913 COC(=O)c1[nH]ccc1OCCCF 34a_100000131702_100011934791 [0,1,0,1,0,0|2,0,0]=4 2452 B14R1.913 COC(=O)c1[nH]ccc1OCCCO 34a_100000131702_100000230001 [0,1,0,1,0,0|2,0,0]=4 2453 B14R1.913 COC(=O)c1[nH]ccc1OCCSC 34a_100000131702_100000212216 [0,1,0,1,0,0|2,0,0]=4 2454 B14R1.913 COC(=O)c1[nH]ccc1SCCCF 62a_100011934791_100102525103 [0,1,0,1,0,0|2,0,0]=4 2455 B14R1.913 COC(=O)c1[nH]ccc1SCCCO 62a_100011215043_100102525103 [0,1,0,1,0,0|2,0,0]=4 2456 B14R1.913 COC(=O)c1[nH]ccc1SCCSC 62a_100000212216_100102525103 [0,1,0,1,0,0|2,0,0]=4 2457 B14R1.913 COC(=O)c1ccoc1CNCCF 34a_100000724931_100009813464 [0,1,0,1,0,0|2,0,0]=4 2458 B14R1.913 COC(=O)c1ccoc1CNCCO 2230a_100016997473_100009813464 [0,1,0,1,0,0|2,0,0]=4 2459 B14R1.913 COC(=O)c1ccoc1CNCCO 34a_100016990907_100009813464 [0,1,0,1,0,0|2,0,0]=4 2460 B14R1.913 COC(=O)c1ccoc1COCCBr 34a_100000211926_100009813464 [0,1,0,1,0,0|2,0,0]=4 2461 B14R1.913 COC(=O)c1ccoc1COCCN 34a_100000210304_100009813464 [0,1,0,1,0,0|2,0,0]=4 2462 B14R1.913 COC(=O)c1ccoc1CSCCF 62a_100009813464_100011217306 [0,1,0,1,0,0|2,0,0]=4 2463 B14R1.913 COC(=O)c1ccoc1CSCCF 62a_100011217306_100009813464 [0,1,0,1,0,0|2,0,0]=4 2464 B14R1.913 COC(=O)c1ccoc1CSCCO 62a_100000211926_100009813464 [0,1,0,1,0,0|2,0,0]=4 2465 B14R1.913 COC(=O)c1ccoc1CSCCO 62a_100009813464_100000211926 [0,1,0,1,0,0|2,0,0]=4 2466 B14R1.913 COC(=O)c1ccoc1CSCSC 62a_100009813464_100011218213 [0,1,0,1,0,0|2,0,0]=4 2467 B14R1.913 COC(=O)c1ccoc1CSCSC 62a_100011218213_100009813464 [0,1,0,1,0,0|2,0,0]=4 2468 B14R1.913 COC(=O)c1ccoc1SCCCF 62a_100011934791_100011935261 [0,1,0,1,0,0|2,0,0]=4 2469 B14R1.913 COC(=O)c1ccoc1SCCCO 62a_100011215043_100011935261 [0,1,0,1,0,0|2,0,0]=4 2470 B14R1.913 COC(=O)c1ccoc1SCCSC 62a_100000212216_100011935261 [0,1,0,1,0,0|2,0,0]=4 2471 B14R1.913 COC(=O)c1ccsc1SCCCF 62a_100009822520_100011934791 [0,1,0,1,0,0|2,0,0]=4 2472 B14R1.913 COC(=O)c1ccsc1SCCCF 62a_100011934791_100009822520 [0,1,0,1,0,0|2,0,0]=4 2473 B14R1.913 COC(=O)c1ccsc1SCCCO 62a_100009822520_100011215043 [0,1,0,1,0,0|2,0,0]=4 2474 B14R1.913 COC(=O)c1ccsc1SCCCO 62a_100011215043_100009822520 [0,1,0,1,0,0|2,0,0]=4 2475 B14R1.913 COC(=O)c1ccsc1SCCSC 62a_100000212216_100009822520 [0,1,0,1,0,0|2,0,0]=4 2476 B14R1.913 COC(=O)c1ccsc1SCCSC 62a_100009822520_100000751147 [0,1,0,1,0,0|2,0,0]=4 2477 B14R1.913 COC(=O)c1cscc1SCCCF 62a_100011934791_100012351140 [0,1,0,1,0,0|2,0,0]=4 2478 B14R1.913 COC(=O)c1cscc1SCCCF 62a_100012351140_100011934791 [0,1,0,1,0,0|2,0,0]=4 2479 B14R1.913 COC(=O)c1cscc1SCCCO 62a_100011215043_100012351140 [0,1,0,1,0,0|2,0,0]=4 2480 B14R1.913 COC(=O)c1cscc1SCCCO 62a_100012351140_100011215043 [0,1,0,1,0,0|2,0,0]=4 2481 B14R1.913 COC(=O)c1cscc1SCCSC 62a_100000212216_100012351140 [0,1,0,1,0,0|2,0,0]=4 2482 B14R1.913 COC(=O)c1cscc1SCCSC 62a_100012351140_100000751147 [0,1,0,1,0,0|2,0,0]=4 2483 B14R1.913 COC(=O)c1occc1CNCCF 34a_100000724931_100000734845 [0,1,0,1,0,0|2,0,0]=4 2484 B14R1.913 COC(=O)c1occc1CNCCO 2230a_100016997473_100000734845 [0,1,0,1,0,0|2,0,0]=4 2485 B14R1.913 COC(=O)c1occc1CNCCO 34a_100016990907_100000734845 [0,1,0,1,0,0|2,0,0]=4 2486 B14R1.913 COC(=O)c1occc1COCCBr 34a_100000211926_100000734845 [0,1,0,1,0,0|2,0,0]=4 2487 B14R1.913 COC(=O)c1occc1COCCN 34a_100000210304_100000734845 [0,1,0,1,0,0|2,0,0]=4 2488 B14R1.913 COC(=O)c1occc1CSCCF 62a_100011217306_100000734845 [0,1,0,1,0,0|2,0,0]=4 2489 B14R1.913 COC(=O)c1occc1CSCCO 62a_100000211926_100000734845 [0,1,0,1,0,0|2,0,0]=4 2490 B14R1.913 COC(=O)c1occc1CSCSC 62a_100011218213_100000734845 [0,1,0,1,0,0|2,0,0]=4 2491 B14R1.913 COC(=O)c1occc1SCCCF 62a_100011934791_100012676306 [0,1,0,1,0,0|2,0,0]=4 2492 B14R1.913 COC(=O)c1occc1SCCCO 62a_100011215043_100012676306 [0,1,0,1,0,0|2,0,0]=4 2493 B14R1.913 COC(=O)c1occc1SCCSC 62a_100000212216_100012676306 [0,1,0,1,0,0|2,0,0]=4 2494 B14R1.913 COC(=O)c1sccc1OCCCF 7a_100000043449_100011934791 [0,1,0,1,0,0|2,0,0]=4 2495 B14R1.913 COC(=O)c1sccc1OCCCO 7a_100000043449_100011215043 [0,1,0,1,0,0|2,0,0]=4 2496 B14R1.913 COC(=O)c1sccc1OCCSC 7a_100000043449_100000212216 [0,1,0,1,0,0|2,0,0]=4 2497 B14R1.913 COC(=O)c1sccc1SCCCF 62a_100011934791_100000730364 [0,1,0,1,0,0|2,0,0]=4 2498 B14R1.913 COC(=O)c1sccc1SCCCO 62a_100011215043_100000730364 [0,1,0,1,0,0|2,0,0]=4 2499 B14R1.913 COC(=O)c1sccc1SCCSC 62a_100000212216_100000730364 [0,1,0,1,0,0|2,0,0]=4 2500 B14R1.913 COCCOc1cc[nH]c1C(=O)OC 34a_100000131702_100011201679 [0,1,0,1,0,0|2,0,0]=4 2501 B14R1.913 COCCOc1ccsc1C(=O)OC 7a_100000043449_100000233755 [0,1,0,1,0,0|2,0,0]=4 2502 B14R1.913 COCCSc1cc[nH]c1C(=O)OC 62a_100000233755_100102525103 [0,1,0,1,0,0|2,0,0]=4 2503 B14R1.913 COCCSc1ccoc1C(=O)OC 62a_100000233755_100012676306 [0,1,0,1,0,0|2,0,0]=4 2504 B14R1.913 COCCSc1ccsc1C(=O)OC 62a_100000233755_100000730364 [0,1,0,1,0,0|2,0,0]=4 2505 B14R1.913 COCCSc1cscc1C(=O)OC 62a_100000233755_100012351140 [0,1,0,1,0,0|2,0,0]=4 2506 B14R1.913 COCCSc1cscc1C(=O)OC 62a_100012351140_100000233755 [0,1,0,1,0,0|2,0,0]=4 2507 B14R1.913 COCCSc1occc1C(=O)OC 62a_100000233755_100011935261 [0,1,0,1,0,0|2,0,0]=4 2508 B14R1.913 COCCSc1sccc1C(=O)OC 62a_100000233755_100009822520 [0,1,0,1,0,0|2,0,0]=4 2509 B14R1.913 COCCSc1sccc1C(=O)OC 62a_100009822520_100000233755 [0,1,0,1,0,0|2,0,0]=4 2510 B14R1.913 COCSCc1ccoc1C(=O)OC 62a_100000766300_100000734845 [0,1,0,1,0,0|2,0,0]=4 2511 B14R1.913 COCSCc1occc1C(=O)OC 62a_100000766300_100009813464 [0,1,0,1,0,0|2,0,0]=4 2512 B14R1.913 COCSCc1occc1C(=O)OC 62a_100009813464_100000766300 [0,1,0,1,0,0|2,0,0]=4 2513 B14R1.1586 COC(=O)/C=C/CN1CCCCCC1 2230a_100000185865_100000742655 [0,1,0,1,0,0|0,0,2]=4 2514 B14R1.1586 COC(=O)/C=C/CN1CCCCCC1 269982a_100000185865_100000742655 [0,1,0,1,0,0|0,0,2]=4 2515 B14R1.1586 COC(=O)/C=C/CN1CCCCCC1 34a_100000185865_100000742655 [0,1,0,1,0,0|0,0,2]=4 2516 B14R1.1586 COC(=O)/C=C/CN1CCCOCC1 2230a_100000685342_100000742655 [0,1,0,1,0,0|1,0,1]=4 2517 B14R1.1586 COC(=O)/C=C/CN1CCCOCC1 269982a_100000685342_100000742655 [0,1,0,1,0,0|1,0,1]=4 2518 B14R1.1586 COC(=O)/C=C/CN1CCCOCC1 34a_100000685342_100000742655 [0,1,0,1,0,0|1,0,1]=4 2519 B14R1.3452 CCCCCC=Cc1cnc(n1C)C 271570a_100000062253_100000762843 [0,1,0,1,0,0|2,0,0]=4 2520 B14R1.3452 CCCCCC=Cc1csc(c1C)C 271570a_100000062253_100009820295 [0,1,0,1,0,0|2,0,0]=4 2521 B14R1.3452 CCCCCC=Cc1ncc(n1C)C 271570a_100000062253_100009816807 [0,1,0,1,0,0|2,0,0]=4 2522 B14R1.3454 CCCCCC=Cc1cc(c[nH]1)C=O 271570a_100000062253_100009882863 [0,1,0,1,0,0|2,0,0]=4 2523 B14R1.3454 CCCCCC=Cc1cc(cs1)C=O 271570a_100000062253_100000737087 [0,1,0,1,0,0|2,0,0]=4 2524 B14R1.3454 CCCCCC=Cc1ccc(s1)CC 271570a_100000062253_100009844052 [0,1,0,1,0,0|1,1,0]=4 2525 B14R1.3454 CCCCCC=Cc1cnc(s1)OC 271570a_100000062253_100000729428 [0,1,0,1,0,0|0,1,0]=3 2526 B14R1.3454 CCCCCC=Cc1coc(c1)C=O 271570a_100000062253_100000747035 [0,1,0,1,0,0|0,0,1]=3 2527 B14R1.3454 CCCCCC=Cc1csc(c1)C=O 271570a_100000062253_100000211722 [0,1,0,1,0,0|0,1,1]=4 2528 B14R1.3454 CCCCCC=Cc1csc(c1)CC 271570a_100000062253_100009846239 [0,1,0,1,0,0|1,1,0]=4 2529 B14R1.3454 CCCCCC=Cc1csc(c1)SC 271570a_100000062253_200010256830 [0,1,0,1,0,0|0,2,0]=4 2530 B14R1.3454 CCCCCC=Cc1csc(n1)OC 271570a_100000062253_100000727839 [0,1,0,1,0,0|1,0,0]=3 2531 B14R1.3454 CCCCCC=Cc1csc(n1)SC 271570a_100000062253_100000732701 [0,1,0,1,0,0|1,1,0]=4 2532 B14R1.3454 CCCCNN=Cc1ccc(s1)OC 4a_100025702795_100000689122 [0,1,0,1,0,0|1,1,0]=4 2533 B14R1.7684 COC(=O)COC1C=CCCCCC1 34a_100000688657_100000747449 [0,1,0,1,0,0|0,0,2]=4 2534 B14R1.232 CCCCC=Cc1ccc(=O)n(c1)C 271570a_100016275911_100011245003 [0,1,0,1,0,0|1,0,1]=4 2535 B14R1.232 CCCCC=Cc1ccc(=O)n(n1)C 271570a_100016275911_100009820752 [0,1,0,1,0,0|1,0,1]=4 2536 B14R1.232 CCCCCSc1ccc(=O)n(c1)C 62a_100000210326_100011245003 [0,1,0,1,0,0|2,0,0]=4 2537 B14R1.232 CCCCCSc1ccc(=O)n(c1)C 62a_100011245003_100000210326 [0,1,0,1,0,0|2,0,0]=4 2538 B14R1.232 CCCCCSc1ccc(=O)n(n1)C 62a_100000210326_100009820752 [0,1,0,1,0,0|2,0,0]=4 2539 B14R1.232 CCCCCSc1ccc(=O)n(n1)C 62a_100009820752_100000210326 [0,1,0,1,0,0|2,0,0]=4 2540 B14R1.3127 CCCCCC=Cc1cc(c(s1)C)C 271570a_100000062253_100009850898 [0,1,0,1,0,0|2,0,0]=4 2541 B14R1.3127 CCCCCC=Cc1cc(n(n1)C)C 271570a_100000062253_100012001299 [0,1,0,1,0,0|2,0,0]=4 2542 B14R1.3127 CCCCCC=Cc1cc(n(n1)C)N 271570a_100000062253_100000734454 [0,1,0,1,0,0|2,0,0]=4 2543 B14R1.729 COC(=O)/C=C/CN(C)C1CCCC1 2230a_100000207505_100000742655 [0,1,0,1,0,0|1,0,1]=4 2544 B14R1.729 COC(=O)/C=C/CN(C)C1CCCC1 269982a_100000207505_100000742655 [0,1,0,1,0,0|1,0,1]=4 2545 B14R1.729 COC(=O)/C=C/CN(C)C1CCCC1 34a_100000207505_100000742655 [0,1,0,1,0,0|1,0,1]=4 2546 B14R1.729 COC(=O)C=NNC(=O)C1CCCC1 4a_100000189808_200011823558 [0,1,0,1,0,0|2,0,0]=4 2547 B14R1.888 CCCC=Cc1ccc([nH]1)C(=O)OC 271570a_100016258520_100000687774 [0,1,0,1,0,0|0,0,2]=4 2548 B14R1.888 CCCC=Cc1ccc(o1)C(=O)OC 271570a_100016258520_100000148852 [0,1,0,1,0,0|0,0,2]=4 2549 B14R1.888 CCCC=Cc1ccc(s1)C(=O)OC 271570a_100016258520_100000148107 [0,1,0,1,0,0|0,0,2]=4 2550 B14R1.888 CCCCNc1nc(co1)C(=O)OC 27a_100000102301_100010235569 [0,1,0,1,0,0|2,0,0]=4 2551 B14R1.888 CCCCNc1ncc(s1)C(=O)OC 27a_100000102301_100000738003 [0,1,0,1,0,0|2,0,0]=4 2552 B14R1.888 CCCCSc1c[nH]c(c1)C(=O)OC 62a_100000210211_100000205823 [0,1,0,1,0,0|2,0,0]=4 2553 B14R1.888 CCCCSc1cc(c[nH]1)C(=O)OC 62a_100000210211_100009840242 [0,1,0,1,0,0|2,0,0]=4 2554 B14R1.888 CCCCSc1cc(c[nH]1)C(=O)OC 62a_100009840242_100000210210 [0,1,0,1,0,0|2,0,0]=4 2555 B14R1.888 CCCCSc1cc(cs1)C(=O)OC 62a_100000210211_100000692058 [0,1,0,1,0,0|2,0,0]=4 2556 B14R1.888 CCCCSc1cc(cs1)C(=O)OC 62a_100000692058_100000210210 [0,1,0,1,0,0|2,0,0]=4 2557 B14R1.888 CCCCSc1ccc([nH]1)C(=O)OC 62a_100000210211_100000687774 [0,1,0,1,0,0|1,0,0]=3 2558 B14R1.888 CCCCSc1ccc(o1)C(=O)NC 62a_100000210211_100000159859 [0,1,0,1,0,0|2,0,0]=4 2559 B14R1.888 CCCCSc1ccc(o1)C(=O)OC 62a_100000210211_100000148852 [0,1,0,1,0,0|1,0,0]=3 2560 B14R1.888 CCCCSc1ccc(s1)C(=O)CC 62a_100000210211_200011203577 [0,1,0,1,0,0|2,0,0]=4 2561 B14R1.888 CCCCSc1ccc(s1)C(=O)CC 62a_200011203577_100000210210 [0,1,0,1,0,0|2,0,0]=4 2562 B14R1.888 CCCCSc1ccc(s1)C(=O)NC 62a_100000210211_200000155069 [0,1,0,1,0,0|2,0,0]=4 2563 B14R1.888 CCCCSc1ccc(s1)C(=O)NC 62a_200000155069_100000210210 [0,1,0,1,0,0|2,0,0]=4 2564 B14R1.888 CCCCSc1ccc(s1)C(=O)OC 62a_100000148107_100000210210 [0,1,0,1,0,0|1,0,0]=3 2565 B14R1.888 CCCCSc1ccc(s1)C(=O)OC 62a_100000210211_100000148107 [0,1,0,1,0,0|1,0,0]=3 2566 B14R1.888 CCCCSc1cnc(s1)C(=O)OC 62a_100000210211_100010191244 [0,1,0,1,0,0|2,0,0]=4 2567 B14R1.888 CCCCSc1cnc(s1)C(=O)OC 62a_100010191244_100000210210 [0,1,0,1,0,0|2,0,0]=4 2568 B14R1.888 CCCCSc1coc(c1)C(=O)OC 62a_100000210211_100009992624 [0,1,0,1,0,0|2,0,0]=4 2569 B14R1.888 CCCCSc1csc(c1)C(=O)OC 62a_100000210211_100009815473 [0,1,0,1,0,0|2,0,0]=4 2570 B14R1.888 CCCCSc1csc(c1)C(=O)OC 62a_100009815473_100000210210 [0,1,0,1,0,0|2,0,0]=4 2571 B14R1.888 CCCCSc1csc(n1)C(=O)OC 62a_100000210211_100012360158 [0,1,0,1,0,0|2,0,0]=4 2572 B14R1.888 CCCCSc1csc(n1)C(=O)OC 62a_100012360158_100000210210 [0,1,0,1,0,0|2,0,0]=4 2573 B14R1.888 CCCCSc1nc(co1)C(=O)OC 62a_100000210211_100010235569 [0,1,0,1,0,0|2,0,0]=4 2574 B14R1.888 CCCCSc1nc(co1)C(=O)OC 62a_100010235569_100000210210 [0,1,0,1,0,0|2,0,0]=4 2575 B14R1.888 CCCCSc1nc(cs1)C(=O)OC 62a_100000210211_100009816811 [0,1,0,1,0,0|2,0,0]=4 2576 B14R1.888 CCCCSc1nc(cs1)C(=O)OC 62a_100009816811_100000210210 [0,1,0,1,0,0|2,0,0]=4 2577 B14R1.888 CCCCSc1ncc([nH]1)C(=O)OC 62a_100000210211_106744473586 [0,1,0,1,0,0|2,0,0]=4 2578 B14R1.888 CCCCSc1ncc([nH]1)C(=O)OC 62a_106744473586_100000210210 [0,1,0,1,0,0|2,0,0]=4 2579 B14R1.888 CCCCSc1ncc(s1)C(=O)OC 62a_100000210211_100000738003 [0,1,0,1,0,0|2,0,0]=4 2580 B14R1.888 CCCCSc1ncc(s1)C(=O)OC 62a_100000738003_100000210210 [0,1,0,1,0,0|2,0,0]=4 2581 B14R1.888 CCCNCc1c[nH]c(c1)C(=O)OC 270004a_100020643023_100000079124 [0,1,0,1,0,0|2,0,0]=4 2582 B14R1.888 CCCNCc1cc(co1)C(=O)OC 270004a_100020643023_200000756054 [0,1,0,1,0,0|2,0,0]=4 2583 B14R1.888 CCCNCc1cc(cs1)C(=O)OC 270004a_100020643023_100000061919 [0,1,0,1,0,0|2,0,0]=4 2584 B14R1.888 CCCNCc1ccc([nH]1)C(=O)OC 270004a_100020643023_100000094942 [0,1,0,1,0,0|1,0,0]=3 2585 B14R1.888 CCCNCc1ccc(o1)C(=O)NC 34a_100015185133_100000210303 [0,1,0,1,0,0|2,0,0]=4 2586 B14R1.888 CCCNCc1ccc(s1)C(=O)OC 270004a_100020643023_100000078589 [0,1,0,1,0,0|1,0,0]=3 2587 B14R1.888 CCCNCc1nc(cs1)C(=O)OC 270004a_100020643023_100000145320 [0,1,0,1,0,0|2,0,0]=4 2588 B14R1.888 CCCOCc1ccc(o1)C(=O)NC 34a_100000118023_100000210303 [0,1,0,1,0,0|2,0,0]=4 2589 B14R1.888 CCCOCc1ccc(o1)C(=O)NC 34a_100000210258_100000118017 [0,1,0,1,0,0|2,0,0]=4 2590 B14R1.888 CCCOCc1ccc(o1)C(=O)NC 7a_100000118023_100000210303 [0,1,0,1,0,0|2,0,0]=4 2591 B14R1.888 CCCOCc1ccc(o1)C(=O)OC 34a_100000210258_100000010372 [0,1,0,1,0,0|1,0,0]=3 2592 B14R1.888 CCCOCc1ccc(o1)C(=O)OC 34a_100000246396_100000210303 [0,1,0,1,0,0|1,0,0]=3 2593 B14R1.888 CCCOCc1ccc(o1)C(=O)OC 7a_100000246396_100000210303 [0,1,0,1,0,0|1,0,0]=3 2594 B14R1.888 CCCOCc1ccc(s1)C(=O)OC 34a_100000210258_100000752602 [0,1,0,1,0,0|1,0,0]=3 2595 B14R1.888 CCCOCc1nc(co1)C(=O)OC 34a_100000210258_100000068285 [0,1,0,1,0,0|2,0,0]=4 2596 B14R1.888 CCCOCc1nc(cs1)C(=O)OC 34a_100000210258_100000089538 [0,1,0,1,0,0|2,0,0]=4 2597 B14R1.888 CCCOCc1ncc(s1)C(=O)OC 34a_100000210258_200010288744 [0,1,0,1,0,0|2,0,0]=4 2598 B14R1.888 CCCSCc1ccc(o1)C(=O)NC 62a_100000118017_100000210303 [0,1,0,1,0,0|2,0,0]=4 2599 B14R1.888 CCCSCc1ccc(o1)C(=O)NC 62a_100000210303_100000118017 [0,1,0,1,0,0|2,0,0]=4 2600 B14R1.888 CCCSCc1ccc(o1)C(=O)OC 62a_100000210303_100000010372 [0,1,0,1,0,0|1,0,0]=3 2601 B14R1.888 CCCSCc1ccc(s1)C(=O)OC 62a_100000210303_100000752602 [0,1,0,1,0,0|1,0,0]=3 2602 B14R1.888 CCCSCc1ccc(s1)C(=O)OC 62a_100000752602_100000210303 [0,1,0,1,0,0|1,0,0]=3 2603 B14R1.888 CCCSCc1nc(co1)C(=O)OC 62a_100000068285_100000210303 [0,1,0,1,0,0|2,0,0]=4 2604 B14R1.888 CCCSCc1nc(co1)C(=O)OC 62a_100000210303_100000068285 [0,1,0,1,0,0|2,0,0]=4 2605 B14R1.888 CCCSCc1nc(cs1)C(=O)OC 62a_100000089538_100000210303 [0,1,0,1,0,0|2,0,0]=4 2606 B14R1.888 CCCSCc1nc(cs1)C(=O)OC 62a_100000210303_100000089538 [0,1,0,1,0,0|2,0,0]=4 2607 B14R1.888 CCCSCc1ncc(s1)C(=O)OC 62a_100000210303_200010288744 [0,1,0,1,0,0|2,0,0]=4 2608 B14R1.888 CCCSCc1ncc(s1)C(=O)OC 62a_200010288744_100000210303 [0,1,0,1,0,0|2,0,0]=4 2609 B14R1.888 CCOCCc1ccc(s1)C(=O)OC 7a_100009866635_100000210202 [0,1,0,1,0,0|1,0,0]=3 2610 B14R1.888 CCOCSc1ccc([nH]1)C(=O)OC 62a_100000739092_100000687774 [0,1,0,1,0,0|2,0,0]=4 2611 B14R1.888 CCOCSc1ccc(o1)C(=O)OC 62a_100000739092_100000148852 [0,1,0,1,0,0|2,0,0]=4 2612 B14R1.888 CCOCSc1ccc(s1)C(=O)OC 62a_100000148107_100000739092 [0,1,0,1,0,0|2,0,0]=4 2613 B14R1.888 CCOCSc1ccc(s1)C(=O)OC 62a_100000739092_100000148107 [0,1,0,1,0,0|2,0,0]=4 2614 B14R1.888 COC(=O)c1ccc([nH]1)CNCCO 270004a_100000210304_100000094942 [0,1,0,1,0,0|2,0,0]=4 2615 B14R1.888 COC(=O)c1ccc([nH]1)SCCCF 62a_100011934791_100000687774 [0,1,0,1,0,0|2,0,0]=4 2616 B14R1.888 COC(=O)c1ccc([nH]1)SCCCO 62a_100011215043_100000687774 [0,1,0,1,0,0|2,0,0]=4 2617 B14R1.888 COC(=O)c1ccc([nH]1)SCCSC 62a_100000212216_100000687774 [0,1,0,1,0,0|2,0,0]=4 2618 B14R1.888 COC(=O)c1ccc(o1)CNCCF 34a_100000724931_100000010372 [0,1,0,1,0,0|2,0,0]=4 2619 B14R1.888 COC(=O)c1ccc(o1)CNCCO 2230a_100016997473_100000010372 [0,1,0,1,0,0|2,0,0]=4 2620 B14R1.888 COC(=O)c1ccc(o1)CNCCO 34a_100016990907_100000010372 [0,1,0,1,0,0|2,0,0]=4 2621 B14R1.888 COC(=O)c1ccc(o1)COCCBr 34a_100000211926_100000010372 [0,1,0,1,0,0|2,0,0]=4 2622 B14R1.888 COC(=O)c1ccc(o1)COCCF 34a_100000246396_100011217306 [0,1,0,1,0,0|2,0,0]=4 2623 B14R1.888 COC(=O)c1ccc(o1)COCCF 7a_100000246396_100011217306 [0,1,0,1,0,0|2,0,0]=4 2624 B14R1.888 COC(=O)c1ccc(o1)COCCN 34a_100000210304_100000010372 [0,1,0,1,0,0|2,0,0]=4 2625 B14R1.888 COC(=O)c1ccc(o1)COCCO 34a_100000246396_100000211926 [0,1,0,1,0,0|2,0,0]=4 2626 B14R1.888 COC(=O)c1ccc(o1)COCCO 7a_100000246396_100000211926 [0,1,0,1,0,0|2,0,0]=4 2627 B14R1.888 COC(=O)c1ccc(o1)COCSC 34a_100000246396_100011218213 [0,1,0,1,0,0|2,0,0]=4 2628 B14R1.888 COC(=O)c1ccc(o1)CSCCF 62a_100011217306_100000010372 [0,1,0,1,0,0|2,0,0]=4 2629 B14R1.888 COC(=O)c1ccc(o1)CSCCO 62a_100000211926_100000010372 [0,1,0,1,0,0|2,0,0]=4 2630 B14R1.888 COC(=O)c1ccc(o1)CSCSC 62a_100011218213_100000010372 [0,1,0,1,0,0|2,0,0]=4 2631 B14R1.888 COC(=O)c1ccc(o1)SCCCF 62a_100011934791_100000148852 [0,1,0,1,0,0|2,0,0]=4 2632 B14R1.888 COC(=O)c1ccc(o1)SCCCO 62a_100011215043_100000148852 [0,1,0,1,0,0|2,0,0]=4 2633 B14R1.888 COC(=O)c1ccc(o1)SCCSC 62a_100000212216_100000148852 [0,1,0,1,0,0|2,0,0]=4 2634 B14R1.888 COC(=O)c1ccc(s1)CCOCF 7a_100009866635_100015361967 [0,1,0,1,0,0|2,0,0]=4 2635 B14R1.888 COC(=O)c1ccc(s1)CNCCF 34a_100000724931_100000752602 [0,1,0,1,0,0|2,0,0]=4 2636 B14R1.888 COC(=O)c1ccc(s1)CNCCO 2230a_100016997473_100000752602 [0,1,0,1,0,0|2,0,0]=4 2637 B14R1.888 COC(=O)c1ccc(s1)CNCCO 270004a_100000210304_100000078589 [0,1,0,1,0,0|2,0,0]=4 2638 B14R1.888 COC(=O)c1ccc(s1)CNCCO 34a_100016990907_100000752602 [0,1,0,1,0,0|2,0,0]=4 2639 B14R1.888 COC(=O)c1ccc(s1)COCCBr 34a_100000211926_100000752602 [0,1,0,1,0,0|2,0,0]=4 2640 B14R1.888 COC(=O)c1ccc(s1)COCCN 34a_100000210304_100000752602 [0,1,0,1,0,0|2,0,0]=4 2641 B14R1.888 COC(=O)c1ccc(s1)CSCCF 62a_100000752602_100011217306 [0,1,0,1,0,0|2,0,0]=4 2642 B14R1.888 COC(=O)c1ccc(s1)CSCCF 62a_100011217306_100000752602 [0,1,0,1,0,0|2,0,0]=4 2643 B14R1.888 COC(=O)c1ccc(s1)CSCCO 62a_100000211926_100000752602 [0,1,0,1,0,0|2,0,0]=4 2644 B14R1.888 COC(=O)c1ccc(s1)CSCCO 62a_100000752602_100000211926 [0,1,0,1,0,0|2,0,0]=4 2645 B14R1.888 COC(=O)c1ccc(s1)CSCSC 62a_100000752602_100011218213 [0,1,0,1,0,0|2,0,0]=4 2646 B14R1.888 COC(=O)c1ccc(s1)CSCSC 62a_100011218213_100000752602 [0,1,0,1,0,0|2,0,0]=4 2647 B14R1.888 COC(=O)c1ccc(s1)SCCCF 62a_100000148107_100011934791 [0,1,0,1,0,0|2,0,0]=4 2648 B14R1.888 COC(=O)c1ccc(s1)SCCCF 62a_100011934791_100000148107 [0,1,0,1,0,0|2,0,0]=4 2649 B14R1.888 COC(=O)c1ccc(s1)SCCCO 62a_100000148107_100011215043 [0,1,0,1,0,0|2,0,0]=4 2650 B14R1.888 COC(=O)c1ccc(s1)SCCCO 62a_100011215043_100000148107 [0,1,0,1,0,0|2,0,0]=4 2651 B14R1.888 COC(=O)c1ccc(s1)SCCSC 62a_100000148107_100000751147 [0,1,0,1,0,0|2,0,0]=4 2652 B14R1.888 COC(=O)c1ccc(s1)SCCSC 62a_100000212216_100000148107 [0,1,0,1,0,0|2,0,0]=4 2653 B14R1.888 COCCSc1ccc([nH]1)C(=O)OC 62a_100000233755_100000687774 [0,1,0,1,0,0|2,0,0]=4 2654 B14R1.888 COCCSc1ccc(o1)C(=O)OC 62a_100000233755_100000148852 [0,1,0,1,0,0|2,0,0]=4 2655 B14R1.888 COCCSc1ccc(s1)C(=O)OC 62a_100000148107_100000233755 [0,1,0,1,0,0|2,0,0]=4 2656 B14R1.888 COCCSc1ccc(s1)C(=O)OC 62a_100000233755_100000148107 [0,1,0,1,0,0|2,0,0]=4 2657 B14R1.888 COCSCc1ccc(o1)C(=O)OC 62a_100000766300_100000010372 [0,1,0,1,0,0|2,0,0]=4 2658 B14R1.888 COCSCc1ccc(s1)C(=O)OC 62a_100000752602_100000766300 [0,1,0,1,0,0|2,0,0]=4 2659 B14R1.888 COCSCc1ccc(s1)C(=O)OC 62a_100000766300_100000752602 [0,1,0,1,0,0|2,0,0]=4 2660 B14R1.7356 CCCCc1c(csc1C(=O)OC)C 271570a_100020621405_100000716566 [0,1,0,1,0,0|1,0,1]=4 2661 B14R1.7737 COC(=O)/C=C/CN(C)CC1CCC1 2230a_200000750244_100000742655 [0,1,0,1,0,0|1,0,1]=4 2662 B14R1.7737 COC(=O)/C=C/CN(C)CC1CCC1 269982a_200000750244_100000742655 [0,1,0,1,0,0|1,0,1]=4 2663 B14R1.7737 COC(=O)/C=C/CN(C)CC1CCC1 34a_200000750244_100000742655 [0,1,0,1,0,0|1,0,1]=4 2664 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)C 2230a_100000188429_100000742655 [0,1,0,1,0,0|1,0,1]=4 2665 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)C 269982a_100000188429_100000742655 [0,1,0,1,0,0|1,0,1]=4 2666 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)C 34a_100000188429_100000742655 [0,1,0,1,0,0|1,0,1]=4 2667 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)F 2230a_100015193889_100000742655 [0,1,0,1,0,0|1,0,1]=4 2668 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)F 269982a_100015193889_100000742655 [0,1,0,1,0,0|1,0,1]=4 2669 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)F 34a_100015193889_100000742655 [0,1,0,1,0,0|1,0,1]=4 2670 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)O 2230a_100025773856_100000742655 [0,1,0,1,0,0|1,0,1]=4 2671 B14R1.13 COC(=O)/C=C/CN1CCC(CC1)O 269982a_100025773856_100000742655 [0,1,0,1,0,0|1,0,1]=4 2672 B14R1.15 CCC(C)CSc1cccc(=O)n1C 62a_100000726605_100000748023 [0,1,0,1,0,0|2,0,0]=4 2673 B14R1.15 CCC(C)CSc1cccc(=O)n1C 62a_100000748023_100000726605 [0,1,0,1,0,0|2,0,0]=4 2674 B14R1.15 CCC(O)CSc1cccc(=O)n1C 62a_100000726605_100011218378 [0,1,0,1,0,0|2,0,0]=4 2675 B14R1.15 CCC(O)CSc1cccc(=O)n1C 62a_100011218378_100000726605 [0,1,0,1,0,0|2,0,0]=4 2676 B14R1.15 CC[C@H](C)CSc1cccc(=O)n1C 62a_100000726605_100009816398 [0,1,0,1,0,0|2,0,0]=4 2677 B14R1.15 CC[C@H](C)CSc1cccc(=O)n1C 62a_100009816398_100000726605 [0,1,0,1,0,0|2,0,0]=4 2678 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000210414_100011713679 [0,1,0,1,0,0|1,0,1]=4 2679 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000234931_100000210202 [0,1,0,1,0,0|1,0,1]=4 2680 B14R1.77 CCC(C)CNc1cccc(c1)OC 34a_100000210024_100000748023 [0,1,0,1,0,0|2,0,0]=4 2681 B14R1.77 CCC(C)COc1cccc(c1)OC 34a_100000211255_100000748023 [0,1,0,1,0,0|2,0,0]=4 2682 B14R1.77 CCC(C)COc1cccc(c1)OC 7a_100000211255_100000748023 [0,1,0,1,0,0|2,0,0]=4 2683 B14R1.77 CCC(C)CSc1cccc(c1)OC 62a_100000748023_100000170001 [0,1,0,1,0,0|2,0,0]=4 2684 B14R1.77 CCC(C)CSc1cccc(n1)OC 62a_100000748023_100000760917 [0,1,0,1,0,0|2,0,0]=4 2685 B14R1.77 CCC(C)CSc1cccc(n1)OC 62a_100000760917_100000748023 [0,1,0,1,0,0|2,0,0]=4 2686 B14R1.77 CCC(C)NCc1cccc(c1)OC 207a_100000209981_100000170238 [0,1,0,1,0,0|2,0,0]=4 2687 B14R1.77 CCC(C)NCc1cccc(c1)OC 2230a_100000174954_100000758301 [0,1,0,1,0,0|2,0,0]=4 2688 B14R1.77 CCC(C)NCc1cccc(c1)OC 2230a_100000209981_100000211672 [0,1,0,1,0,0|2,0,0]=4 2689 B14R1.77 CCC(C)NCc1cccc(c1)OC 270004a_100000209981_100000170238 [0,1,0,1,0,0|2,0,0]=4 2690 B14R1.77 CCC(C)NCc1cccc(c1)OC 34a_100000174954_100011215416 [0,1,0,1,0,0|2,0,0]=4 2691 B14R1.77 CCC(C)NCc1cccc(n1)OC 207a_100000209981_100000694346 [0,1,0,1,0,0|2,0,0]=4 2692 B14R1.77 CCC(C)NCc1cccc(n1)OC 2230a_100000209981_100000755263 [0,1,0,1,0,0|2,0,0]=4 2693 B14R1.77 CCC(C)NCc1cccc(n1)OC 2230a_100000746380_100000758301 [0,1,0,1,0,0|2,0,0]=4 2694 B14R1.77 CCC(C)NCc1cccc(n1)OC 270004a_100000209981_100000694346 [0,1,0,1,0,0|2,0,0]=4 2695 B14R1.77 CCC(C)OCc1cccc(c1)OC 34a_100000198976_100011215416 [0,1,0,1,0,0|2,0,0]=4 2696 B14R1.77 CCC(C)OCc1cccc(c1)OC 7a_100000210228_100000211672 [0,1,0,1,0,0|2,0,0]=4 2697 B14R1.77 CCC(C)OCc1cccc(n1)OC 7a_100000210228_100000755263 [0,1,0,1,0,0|2,0,0]=4 2698 B14R1.77 CCC(C)SCc1cccc(c1)OC 62a_100000688526_100000758301 [0,1,0,1,0,0|2,0,0]=4 2699 B14R1.77 CCC(C)SCc1cccc(c1)OC 62a_100000758301_100000211672 [0,1,0,1,0,0|2,0,0]=4 2700 B14R1.77 CCC(C)SCc1cccc(n1)OC 62a_100000755263_100000758301 [0,1,0,1,0,0|2,0,0]=4 2701 B14R1.77 CCC(C)SCc1cccc(n1)OC 62a_100000758301_100000755263 [0,1,0,1,0,0|2,0,0]=4 2702 B14R1.77 CCC(O)CNc1cccc(c1)OC 34a_100000210024_100011218378 [0,1,0,1,0,0|2,0,0]=4 2703 B14R1.77 CCC(O)COc1cccc(c1)OC 34a_100000211255_100011218378 [0,1,0,1,0,0|2,0,0]=4 2704 B14R1.77 CCC(O)COc1cccc(c1)OC 7a_100000211255_100011218378 [0,1,0,1,0,0|2,0,0]=4 2705 B14R1.77 CCC(O)CSc1cccc(c1)OC 62a_100011218378_100000170001 [0,1,0,1,0,0|2,0,0]=4 2706 B14R1.77 CCC(O)CSc1cccc(n1)OC 62a_100000760917_100011218378 [0,1,0,1,0,0|2,0,0]=4 2707 B14R1.77 CCC(O)CSc1cccc(n1)OC 62a_100011218378_100000760917 [0,1,0,1,0,0|2,0,0]=4 2708 B14R1.77 CCN(C)CCc1cccc(c1)OC 2230a_100000225621_100011713679 [0,1,0,1,0,0|2,0,0]=4 2709 B14R1.77 CCN(C)CCc1cccc(c1)OC 2230a_100011269071_100000210202 [0,1,0,1,0,0|2,0,0]=4 2710 B14R1.77 CCN(C)CCc1cccc(c1)OC 269982a_100000225621_100011713679 [0,1,0,1,0,0|2,0,0]=4 2711 B14R1.77 CCN(C)CCc1cccc(c1)OC 269982a_100011269071_100000204670 [0,1,0,1,0,0|2,0,0]=4 2712 B14R1.77 CCN(C)CCc1cccc(c1)OC 34a_100011269071_100000210202 [0,1,0,1,0,0|2,0,0]=4 2713 B14R1.77 CC[C@H](C)CNc1cccc(c1)OC 34a_100000210024_100009816398 [0,1,0,1,0,0|2,0,0]=4 2714 B14R1.77 CC[C@H](C)COc1cccc(c1)OC 34a_100000211255_100009816398 [0,1,0,1,0,0|2,0,0]=4 2715 B14R1.77 CC[C@H](C)COc1cccc(c1)OC 7a_100000211255_100009816398 [0,1,0,1,0,0|2,0,0]=4 2716 B14R1.77 CC[C@H](C)CSc1cccc(c1)OC 62a_100009816398_100000170001 [0,1,0,1,0,0|2,0,0]=4 2717 B14R1.77 CC[C@H](C)CSc1cccc(n1)OC 62a_100000760917_100009816398 [0,1,0,1,0,0|2,0,0]=4 2718 B14R1.77 CC[C@H](C)CSc1cccc(n1)OC 62a_100009816398_100000760917 [0,1,0,1,0,0|2,0,0]=4 2719 B14R1.76 COc1cccc(c1)CCNC(C)C 2230a_100000740386_100000210206 [0,1,0,1,0,0|2,0,0]=4 2720 B14R1.76 COc1cccc(c1)CCNC(C)C 2230a_100138425928_100011713679 [0,1,0,1,0,0|2,0,0]=4 2721 B14R1.76 COc1cccc(c1)CCNC(C)C 34a_100000740386_100000210206 [0,1,0,1,0,0|2,0,0]=4 2722 B14R1.76 COc1cccc(c1)CCNC(C)C 34a_100138425928_100011713679 [0,1,0,1,0,0|2,0,0]=4 2723 B14R1.76 COc1cccc(c1)CCOC(C)C 34a_100000212225_100011713679 [0,1,0,1,0,0|2,0,0]=4 2724 B14R1.76 COc1cccc(c1)CCOC(C)C 34a_100011215300_100000210206 [0,1,0,1,0,0|2,0,0]=4 2725 B14R1.76 COc1cccc(c1)CCOC(C)C 7a_100011215300_100000210206 [0,1,0,1,0,0|2,0,0]=4 2726 B14R1.76 COc1cccc(c1)CCSC(C)C 62a_100000210206_100011713679 [0,1,0,1,0,0|2,0,0]=4 2727 B14R1.76 COc1cccc(c1)CCSC(C)C 62a_100011713679_100000210206 [0,1,0,1,0,0|2,0,0]=4 2728 B14R1.76 COc1cccc(c1)CNCC(C)C 207a_100000210953_100000170238 [0,1,0,1,0,0|2,0,0]=4 2729 B14R1.76 COc1cccc(c1)CNCC(C)C 2230a_100000174954_100000210760 [0,1,0,1,0,0|2,0,0]=4 2730 B14R1.76 COc1cccc(c1)CNCC(C)C 2230a_100000210953_100000211672 [0,1,0,1,0,0|2,0,0]=4 2731 B14R1.76 COc1cccc(c1)CNCC(C)C 26a_100000210953_100000211255 [0,1,0,1,0,0|2,0,0]=4 2732 B14R1.76 COc1cccc(c1)CNCC(C)C 270004a_100000174954_100000210432 [0,1,0,1,0,0|2,0,0]=4 2733 B14R1.76 COc1cccc(c1)CNCC(C)C 270004a_100000210953_100000170238 [0,1,0,1,0,0|2,0,0]=4 2734 B14R1.76 COc1cccc(c1)CNCC(C)C 34a_100000174954_100000210624 [0,1,0,1,0,0|2,0,0]=4 2735 B14R1.76 COc1cccc(c1)CNCC(C)C 34a_100000210953_100000688526 [0,1,0,1,0,0|2,0,0]=4 2736 B14R1.76 COc1cccc(c1)CNCC(C)O 207a_100000210904_100000170238 [0,1,0,1,0,0|2,0,0]=4 2737 B14R1.76 COc1cccc(c1)CNCC(C)O 2230a_100000174954_100011218427 [0,1,0,1,0,0|2,0,0]=4 2738 B14R1.76 COc1cccc(c1)CNCC(C)O 2230a_100000210904_100000211672 [0,1,0,1,0,0|2,0,0]=4 2739 B14R1.76 COc1cccc(c1)CNCC(C)O 270004a_100000210904_100000170238 [0,1,0,1,0,0|2,0,0]=4 2740 B14R1.76 COc1cccc(c1)CNCC(C)O 34a_100000174954_100011218427 [0,1,0,1,0,0|2,0,0]=4 2741 B14R1.76 COc1cccc(c1)CNCC(C)O 34a_100000210904_100000688526 [0,1,0,1,0,0|2,0,0]=4 2742 B14R1.76 COc1cccc(c1)CNC[C@@H](C)O 2230a_100000174954_100009817552 [0,1,0,1,0,0|2,0,0]=4 2743 B14R1.76 COc1cccc(c1)CNC[C@@H](C)O 34a_100000174954_100009817552 [0,1,0,1,0,0|2,0,0]=4 2744 B14R1.76 COc1cccc(c1)COCC(C)Br 34a_100012180447_100000688526 [0,1,0,1,0,0|2,0,0]=4 2745 B14R1.76 COc1cccc(c1)COCC(C)C 34a_100000198976_100000210624 [0,1,0,1,0,0|2,0,0]=4 2746 B14R1.76 COc1cccc(c1)COCC(C)C 34a_100000210257_100000688526 [0,1,0,1,0,0|2,0,0]=4 2747 B14R1.76 COc1cccc(c1)COCC(C)F 34a_100015925927_100000688526 [0,1,0,1,0,0|2,0,0]=4 2748 B14R1.76 COc1cccc(c1)COCC(C)O 34a_100000198976_100011218427 [0,1,0,1,0,0|2,0,0]=4 2749 B14R1.76 COc1cccc(c1)COC[C@@H](C)Cl 34a_100016084084_100000688526 [0,1,0,1,0,0|2,0,0]=4 2750 B14R1.76 COc1cccc(c1)COC[C@@H](C)N 34a_100000737577_100000688526 [0,1,0,1,0,0|2,0,0]=4 2751 B14R1.76 COc1cccc(c1)COC[C@@H](C)O 34a_100000198976_100009817552 [0,1,0,1,0,0|2,0,0]=4 2752 B14R1.76 COc1cccc(c1)CSCC(C)C 62a_100000210624_100000211672 [0,1,0,1,0,0|2,0,0]=4 2753 B14R1.76 COc1cccc(c1)CSCC(C)C 62a_100000688526_100000210760 [0,1,0,1,0,0|2,0,0]=4 2754 B14R1.76 COc1cccc(c1)CSCC(C)O 62a_100000688526_100011218427 [0,1,0,1,0,0|2,0,0]=4 2755 B14R1.76 COc1cccc(c1)CSCC(C)O 62a_100011218427_100000211672 [0,1,0,1,0,0|2,0,0]=4 2756 B14R1.76 COc1cccc(c1)CSC[C@@H](C)O 62a_100000688526_100009817552 [0,1,0,1,0,0|2,0,0]=4 2757 B14R1.76 COc1cccc(c1)CSC[C@@H](C)O 62a_100009817552_100000211672 [0,1,0,1,0,0|2,0,0]=4 2758 B14R1.76 COc1cccc(c1)NCCC(C)C 34a_100000210024_100000210312 [0,1,0,1,0,0|2,0,0]=4 2759 B14R1.76 COc1cccc(c1)NCCC(C)O 34a_100000210024_100012276601 [0,1,0,1,0,0|2,0,0]=4 2760 B14R1.76 COc1cccc(c1)OCCC(C)C 34a_100000211255_100000210312 [0,1,0,1,0,0|2,0,0]=4 2761 B14R1.76 COc1cccc(c1)OCCC(C)C 7a_100000211255_100000210626 [0,1,0,1,0,0|2,0,0]=4 2762 B14R1.76 COc1cccc(c1)OCCC(C)O 34a_100000211255_100012276601 [0,1,0,1,0,0|2,0,0]=4 2763 B14R1.76 COc1cccc(c1)OCCC(C)O 7a_100000211255_100012276601 [0,1,0,1,0,0|2,0,0]=4 2764 B14R1.76 COc1cccc(c1)SCCC(C)C 62a_100000210312_100000170001 [0,1,0,1,0,0|2,0,0]=4 2765 B14R1.76 COc1cccc(c1)SCCC(C)O 62a_100012276601_100000170001 [0,1,0,1,0,0|2,0,0]=4 2766 B14R1.76 COc1cccc(n1)CNCC(C)C 207a_100000210953_100000694346 [0,1,0,1,0,0|2,0,0]=4 2767 B14R1.76 COc1cccc(n1)CNCC(C)C 2230a_100000210953_100000755263 [0,1,0,1,0,0|2,0,0]=4 2768 B14R1.76 COc1cccc(n1)CNCC(C)C 2230a_100000746380_100000210760 [0,1,0,1,0,0|2,0,0]=4 2769 B14R1.76 COc1cccc(n1)CNCC(C)C 270004a_100000210953_100000694346 [0,1,0,1,0,0|2,0,0]=4 2770 B14R1.76 COc1cccc(n1)CNCC(C)C 34a_100000210953_100000755263 [0,1,0,1,0,0|2,0,0]=4 2771 B14R1.76 COc1cccc(n1)CNCC(C)O 207a_100000210904_100000694346 [0,1,0,1,0,0|2,0,0]=4 2772 B14R1.76 COc1cccc(n1)CNCC(C)O 2230a_100000210904_100000755263 [0,1,0,1,0,0|2,0,0]=4 2773 B14R1.76 COc1cccc(n1)CNCC(C)O 2230a_100000746380_100011218427 [0,1,0,1,0,0|2,0,0]=4 2774 B14R1.76 COc1cccc(n1)CNCC(C)O 270004a_100000210904_100000694346 [0,1,0,1,0,0|2,0,0]=4 2775 B14R1.76 COc1cccc(n1)CNCC(C)O 34a_100000210904_100000755263 [0,1,0,1,0,0|2,0,0]=4 2776 B14R1.76 COc1cccc(n1)CNC[C@@H](C)O 2230a_100000746380_100009817552 [0,1,0,1,0,0|2,0,0]=4 2777 B14R1.76 COc1cccc(n1)COCC(C)Br 34a_100012180447_100000755263 [0,1,0,1,0,0|2,0,0]=4 2778 B14R1.76 COc1cccc(n1)COCC(C)C 34a_100000210257_100000755263 [0,1,0,1,0,0|2,0,0]=4 2779 B14R1.76 COc1cccc(n1)COCC(C)F 34a_100015925927_100000755263 [0,1,0,1,0,0|2,0,0]=4 2780 B14R1.76 COc1cccc(n1)COC[C@@H](C)Cl 34a_100016084084_100000755263 [0,1,0,1,0,0|2,0,0]=4 2781 B14R1.76 COc1cccc(n1)COC[C@@H](C)N 34a_100000737577_100000755263 [0,1,0,1,0,0|2,0,0]=4 2782 B14R1.76 COc1cccc(n1)CSCC(C)C 62a_100000210624_100000755263 [0,1,0,1,0,0|2,0,0]=4 2783 B14R1.76 COc1cccc(n1)CSCC(C)C 62a_100000755263_100000210760 [0,1,0,1,0,0|2,0,0]=4 2784 B14R1.76 COc1cccc(n1)CSCC(C)O 62a_100000755263_100011218427 [0,1,0,1,0,0|2,0,0]=4 2785 B14R1.76 COc1cccc(n1)CSCC(C)O 62a_100011218427_100000755263 [0,1,0,1,0,0|2,0,0]=4 2786 B14R1.76 COc1cccc(n1)CSC[C@@H](C)O 62a_100000755263_100009817552 [0,1,0,1,0,0|2,0,0]=4 2787 B14R1.76 COc1cccc(n1)CSC[C@@H](C)O 62a_100009817552_100000755263 [0,1,0,1,0,0|2,0,0]=4 2788 B14R1.76 COc1cccc(n1)SCCC(C)C 62a_100000210312_100000760917 [0,1,0,1,0,0|2,0,0]=4 2789 B14R1.76 COc1cccc(n1)SCCC(C)C 62a_100000760917_100000210312 [0,1,0,1,0,0|2,0,0]=4 2790 B14R1.76 COc1cccc(n1)SCCC(C)O 62a_100000760917_100012276601 [0,1,0,1,0,0|2,0,0]=4 2791 B14R1.76 COc1cccc(n1)SCCC(C)O 62a_100012276601_100000760917 [0,1,0,1,0,0|2,0,0]=4 2792 B14R1.128 CC(C)CCCNCC1=CC(=O)OC1 34a_200000737386_100000716558 [0,1,0,1,0,0|1,0,1]=4 2793 B14R1.128 CC(C)CCCOCC1=CC(=O)OC1 34a_100000210774_100000716558 [0,1,0,1,0,0|1,0,1]=4 2794 B14R1.128 CC(C)CCCSCC1=CC(=O)OC1 62a_100000716558_100011214892 [0,1,0,1,0,0|1,0,1]=4 2795 B14R1.128 CC(C)CCCSCC1=CC(=O)OC1 62a_100011214892_100000716558 [0,1,0,1,0,0|1,0,1]=4 2796 B14R1.128 CC(O)CCCSCC1=CC(=O)OC1 62a_100000716558_200000718107 [0,1,0,1,0,0|1,0,1]=4 2797 B14R1.128 CC(O)CCCSCC1=CC(=O)OC1 62a_200000718107_100000716558 [0,1,0,1,0,0|1,0,1]=4 2798 B14R1.154 CC(C)CCSc1cccc(=O)n1C 62a_100000210312_100000726605 [0,1,0,1,0,0|2,0,0]=4 2799 B14R1.154 CC(C)CCSc1cccc(=O)n1C 62a_100000726605_100000210312 [0,1,0,1,0,0|2,0,0]=4 2800 B14R1.154 CC(O)CCSc1cccc(=O)n1C 62a_100000726605_100012276601 [0,1,0,1,0,0|2,0,0]=4 2801 B14R1.154 CC(O)CCSc1cccc(=O)n1C 62a_100012276601_100000726605 [0,1,0,1,0,0|2,0,0]=4 2802 B14R1.2973 COC(=O)/C=C/CN1CCCC1(C)C 2230a_100000761399_100000742655 [0,1,0,1,0,0|1,0,1]=4 2803 B14R1.2973 COC(=O)/C=C/CN1CCCC1(C)C 269982a_100000761399_100000742655 [0,1,0,1,0,0|1,0,1]=4 2804 B14R1.2973 COC(=O)/C=C/CN1CCCC1(C)C 34a_100000761399_100000742655 [0,1,0,1,0,0|1,0,1]=4 2805 B14R1.7731 COC(=O)/C=C/COCC1CC1(C)C 34a_100000728257_100000742655 [0,1,0,1,0,0|1,0,1]=4 2806 B14R1.7731 COC(=O)/C=C/COCC1CC1(C)C 7a_100000728257_100000742655 [0,1,0,1,0,0|1,0,1]=4 2807 B14R1.48 CCCCNc1cc(cc(c1)OC)Br 34a_100000750983_100000210210 [0,1,0,1,0,0|2,0,0]=4 2808 B14R1.48 CCCCNc1cc(cc(c1)OC)Br 7a_100000750983_100000210211 [0,1,0,1,0,0|2,0,0]=4 2809 B14R1.48 CCCCNc1cc(cc(c1)OC)C 2230a_100012001870_100000210211 [0,1,0,1,0,0|2,0,0]=4 2810 B14R1.48 CCCCNc1cc(cc(c1)OC)C 34a_100012001870_100000210210 [0,1,0,1,0,0|2,0,0]=4 2811 B14R1.48 CCCCNc1cc(cc(c1)OC)C 7a_100012001870_100000210211 [0,1,0,1,0,0|2,0,0]=4 2812 B14R1.48 CCCCNc1cc(cc(c1)OC)Cl 2230a_100000051436_100000210211 [0,1,0,1,0,0|2,0,0]=4 2813 B14R1.48 CCCCNc1cc(cc(c1)OC)Cl 34a_100000051436_100000210210 [0,1,0,1,0,0|2,0,0]=4 2814 B14R1.48 CCCCNc1cc(cc(c1)OC)Cl 7a_100000051436_100000210211 [0,1,0,1,0,0|2,0,0]=4 2815 B14R1.48 CCCCNc1cc(cc(c1)OC)F 2230a_100000687699_100000210211 [0,1,0,1,0,0|2,0,0]=4 2816 B14R1.48 CCCCNc1cc(cc(c1)OC)F 34a_100000687699_100000210210 [0,1,0,1,0,0|2,0,0]=4 2817 B14R1.48 CCCCNc1cc(cc(c1)OC)F 7a_100000687699_100000210211 [0,1,0,1,0,0|2,0,0]=4 2818 B14R1.48 CCCCNc1cc(cc(c1)OC)O 34a_200000692186_100000210210 [0,1,0,1,0,0|2,0,0]=4 2819 B14R1.48 CCCCOc1cc(cc(c1)OC)Br 34a_100010068927_100000210210 [0,1,0,1,0,0|2,0,0]=4 2820 B14R1.48 CCCCOc1cc(cc(c1)OC)Br 7a_100010068927_100000210211 [0,1,0,1,0,0|2,0,0]=4 2821 B14R1.48 CCCCOc1cc(cc(c1)OC)C 34a_100011216608_100000210210 [0,1,0,1,0,0|2,0,0]=4 2822 B14R1.48 CCCCOc1cc(cc(c1)OC)C 7a_100011216608_100000210211 [0,1,0,1,0,0|2,0,0]=4 2823 B14R1.48 CCCCOc1cc(cc(c1)OC)Cl 34a_100000051430_100000210210 [0,1,0,1,0,0|2,0,0]=4 2824 B14R1.48 CCCCOc1cc(cc(c1)OC)Cl 7a_100000051430_100000210211 [0,1,0,1,0,0|2,0,0]=4 2825 B14R1.48 CCCCOc1cc(cc(c1)OC)F 34a_100011369910_100000210210 [0,1,0,1,0,0|2,0,0]=4 2826 B14R1.48 CCCCOc1cc(cc(c1)OC)F 7a_100011369910_100000210211 [0,1,0,1,0,0|2,0,0]=4 2827 B14R1.48 CCCCOc1cc(cc(c1)OC)N 34a_200000692186_100000210210 [0,1,0,1,0,0|2,0,0]=4 2828 B14R1.48 CCCCOc1cc(cc(c1)OC)N 7a_200000692186_100000210211 [0,1,0,1,0,0|2,0,0]=4 2829 B14R1.48 CCCCSc1cc(cc(c1)OC)Br 62a_100000210211_100010141301 [0,1,0,1,0,0|2,0,0]=4 2830 B14R1.48 CCCCSc1cc(cc(c1)OC)Br 62a_100010141301_100000210210 [0,1,0,1,0,0|2,0,0]=4 2831 B14R1.48 CCCCSc1cc(cc(c1)OC)C 62a_100000210211_100010187550 [0,1,0,1,0,0|2,0,0]=4 2832 B14R1.48 CCCCSc1cc(cc(c1)OC)Cl 62a_100000210211_100010147680 [0,1,0,1,0,0|2,0,0]=4 2833 B14R1.48 CCCCSc1cc(cc(c1)OC)Cl 62a_100010147680_100000210210 [0,1,0,1,0,0|2,0,0]=4 2834 B14R1.48 CCCCSc1cc(cc(c1)OC)F 62a_100000210211_100011934182 [0,1,0,1,0,0|2,0,0]=4 2835 B14R1.48 CCCCSc1cc(cc(c1)OC)F 62a_100011934182_100000210210 [0,1,0,1,0,0|2,0,0]=4 2836 B14R1.48 CCCCSc1cc(cc(c1)OC)N 62a_100000210211_100000750983 [0,1,0,1,0,0|2,0,0]=4 2837 B14R1.48 CCCCSc1cc(cc(c1)OC)N 62a_100000750983_100000210210 [0,1,0,1,0,0|2,0,0]=4 2838 B14R1.48 CCCCSc1cc(cc(c1)OC)O 62a_100000210211_100010068927 [0,1,0,1,0,0|2,0,0]=4 2839 B14R1.48 CCCCSc1cc(cc(n1)OC)C 62a_100000210211_100009856763 [0,1,0,1,0,0|2,0,0]=4 2840 B14R1.48 CCCCSc1cc(cc(n1)OC)C 62a_100009856763_100000210210 [0,1,0,1,0,0|2,0,0]=4 2841 B14R1.48 CCCCSc1cc(cc(n1)OC)N 62a_100000210211_100012187057 [0,1,0,1,0,0|2,0,0]=4 2842 B14R1.48 CCCCSc1cc(cc(n1)OC)N 62a_100012187057_100000210210 [0,1,0,1,0,0|2,0,0]=4 2843 B14R1.48 CCCNCc1cc(cc(c1)OC)Br 207a_100020643023_100009816777 [0,1,0,1,0,0|2,0,0]=4 2844 B14R1.48 CCCNCc1cc(cc(c1)OC)Br 269862a_100020643023_100009816777 [0,1,0,1,0,0|2,0,0]=4 2845 B14R1.48 CCCNCc1cc(cc(c1)OC)Br 270004a_100020643023_100009816777 [0,1,0,1,0,0|2,0,0]=4 2846 B14R1.48 CCCNCc1cc(cc(c1)OC)C 207a_100020643023_100000101404 [0,1,0,1,0,0|2,0,0]=4 2847 B14R1.48 CCCNCc1cc(cc(c1)OC)C 270004a_100020643023_100000101404 [0,1,0,1,0,0|2,0,0]=4 2848 B14R1.48 CCCNCc1cc(cc(c1)OC)Cl 207a_100020643023_100000087488 [0,1,0,1,0,0|2,0,0]=4 2849 B14R1.48 CCCNCc1cc(cc(c1)OC)Cl 2230a_106744500063_100000210303 [0,1,0,1,0,0|2,0,0]=4 2850 B14R1.48 CCCNCc1cc(cc(c1)OC)Cl 270004a_100020643023_100000087488 [0,1,0,1,0,0|2,0,0]=4 2851 B14R1.48 CCCNCc1cc(cc(c1)OC)Cl 34a_106744500063_100000210303 [0,1,0,1,0,0|2,0,0]=4 2852 B14R1.48 CCCNCc1cc(cc(c1)OC)F 207a_100020643023_100011934815 [0,1,0,1,0,0|2,0,0]=4 2853 B14R1.48 CCCNCc1cc(cc(c1)OC)F 2230a_100000696013_100000210303 [0,1,0,1,0,0|2,0,0]=4 2854 B14R1.48 CCCNCc1cc(cc(c1)OC)F 270004a_100020643023_100011934815 [0,1,0,1,0,0|2,0,0]=4 2855 B14R1.48 CCCNCc1cc(cc(c1)OC)F 34a_100000696013_100000210303 [0,1,0,1,0,0|2,0,0]=4 2856 B14R1.48 CCCNCc1cc(cc(c1)OC)O 207a_100020643023_100009856911 [0,1,0,1,0,0|2,0,0]=4 2857 B14R1.48 CCCNCc1cc(cc(c1)OC)O 270004a_100020643023_100009856911 [0,1,0,1,0,0|2,0,0]=4 2858 B14R1.48 CCCOCc1cc(cc(c1)OC)Br 34a_100000210258_100010162483 [0,1,0,1,0,0|2,0,0]=4 2859 B14R1.48 CCCOCc1cc(cc(c1)OC)Br 34a_100009995317_100000210303 [0,1,0,1,0,0|2,0,0]=4 2860 B14R1.48 CCCOCc1cc(cc(c1)OC)Br 7a_100009995317_100000210303 [0,1,0,1,0,0|2,0,0]=4 2861 B14R1.48 CCCOCc1cc(cc(c1)OC)C 34a_100009863105_100000210303 [0,1,0,1,0,0|2,0,0]=4 2862 B14R1.48 CCCOCc1cc(cc(c1)OC)C 7a_100009863105_100000210303 [0,1,0,1,0,0|2,0,0]=4 2863 B14R1.48 CCCOCc1cc(cc(c1)OC)Cl 34a_100000087487_100000210303 [0,1,0,1,0,0|2,0,0]=4 2864 B14R1.48 CCCOCc1cc(cc(c1)OC)Cl 34a_100000210258_100010188059 [0,1,0,1,0,0|2,0,0]=4 2865 B14R1.48 CCCOCc1cc(cc(c1)OC)Cl 7a_100000087487_100000210303 [0,1,0,1,0,0|2,0,0]=4 2866 B14R1.48 CCCOCc1cc(cc(c1)OC)F 34a_100000210258_100011934817 [0,1,0,1,0,0|2,0,0]=4 2867 B14R1.48 CCCOCc1cc(cc(c1)OC)F 34a_100011934816_100000210303 [0,1,0,1,0,0|2,0,0]=4 2868 B14R1.48 CCCOCc1cc(cc(c1)OC)F 7a_100011934816_100000210303 [0,1,0,1,0,0|2,0,0]=4 2869 B14R1.48 CCCOCc1cc(cc(c1)OC)N 34a_100012182899_100000210303 [0,1,0,1,0,0|2,0,0]=4 2870 B14R1.48 CCCSCc1cc(cc(c1)OC)Br 62a_100000210303_100010162483 [0,1,0,1,0,0|2,0,0]=4 2871 B14R1.48 CCCSCc1cc(cc(c1)OC)Br 62a_100010162483_100000210303 [0,1,0,1,0,0|2,0,0]=4 2872 B14R1.48 CCCSCc1cc(cc(c1)OC)Cl 62a_100000210303_100010188059 [0,1,0,1,0,0|2,0,0]=4 2873 B14R1.48 CCCSCc1cc(cc(c1)OC)Cl 62a_100010188059_100000210303 [0,1,0,1,0,0|2,0,0]=4 2874 B14R1.48 CCCSCc1cc(cc(c1)OC)F 62a_100000210303_100011934817 [0,1,0,1,0,0|2,0,0]=4 2875 B14R1.48 CCCSCc1cc(cc(c1)OC)F 62a_100011934817_100000210303 [0,1,0,1,0,0|2,0,0]=4 2876 B14R1.743 CCC(=O)CC(=O)C=C1CCCCC1 1458a_100000743792_100000747405 [0,1,0,1,0,0|1,0,1]=4 2877 B14R1.743 CNC(=O)CC(=O)C=C1CCCCC1 1458a_100000743792_100000183359 [0,1,0,1,0,0|1,0,1]=4 2878 B14R1.743 COC(=O)CC(=O)C=C1CCCCC1 1458a_100000743792_100000747449 [0,1,0,1,0,0|0,0,1]=3 2879 B14R1.743 COC(=O)CC(=O)C=C1CCOCC1 1458a_100000761426_100000747449 [0,1,0,1,0,0|1,0,1]=4 2880 B14R1.1372 CCCCc1csc(c1C(=O)OC)N 271570a_100020621405_200010874472 [0,1,0,1,0,0|1,0,1]=4 2881 B14R1.4519 CCCCCC=CC(=O)C1CCC1=O 1458a_100016263427_100009892977 [0,1,0,1,0,0|1,0,1]=4 2882 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210211 [0,1,0,1,0,0|2,0,0]=4 2883 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210210 [0,1,0,1,0,0|2,0,0]=4 2884 B14R1.907 CCCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210211 [0,1,0,1,0,0|2,0,0]=4 2885 B14R1.907 CCCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210210 [0,1,0,1,0,0|2,0,0]=4 2886 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210211 [0,1,0,1,0,0|2,0,0]=4 2887 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210210 [0,1,0,1,0,0|2,0,0]=4 2888 B14R1.907 CCCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210211 [0,1,0,1,0,0|2,0,0]=4 2889 B14R1.907 CCCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210210 [0,1,0,1,0,0|2,0,0]=4 2890 B14R1.907 CCCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210210 [0,1,0,1,0,0|2,0,0]=4 2891 B14R1.907 CCCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210210 [0,1,0,1,0,0|2,0,0]=4 2892 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210210 [0,1,0,1,0,0|2,0,0]=4 2893 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210211 [0,1,0,1,0,0|2,0,0]=4 2894 B14R1.907 CCCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210210 [0,1,0,1,0,0|2,0,0]=4 2895 B14R1.907 CCCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210211 [0,1,0,1,0,0|2,0,0]=4 2896 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210210 [0,1,0,1,0,0|2,0,0]=4 2897 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210211 [0,1,0,1,0,0|2,0,0]=4 2898 B14R1.907 CCCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210210 [0,1,0,1,0,0|2,0,0]=4 2899 B14R1.907 CCCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210211 [0,1,0,1,0,0|2,0,0]=4 2900 B14R1.907 CCCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210210 [0,1,0,1,0,0|2,0,0]=4 2901 B14R1.907 CCCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210211 [0,1,0,1,0,0|2,0,0]=4 2902 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100000210211_100012353699 [0,1,0,1,0,0|2,0,0]=4 2903 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210210 [0,1,0,1,0,0|2,0,0]=4 2904 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100000210211_100011830276 [0,1,0,1,0,0|2,0,0]=4 2905 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210210 [0,1,0,1,0,0|2,0,0]=4 2906 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100000210211_100011356853 [0,1,0,1,0,0|2,0,0]=4 2907 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210210 [0,1,0,1,0,0|2,0,0]=4 2908 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100000210211_100011934186 [0,1,0,1,0,0|2,0,0]=4 2909 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210210 [0,1,0,1,0,0|2,0,0]=4 2910 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100000210211_100015196925 [0,1,0,1,0,0|2,0,0]=4 2911 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210210 [0,1,0,1,0,0|2,0,0]=4 2912 B14R1.907 CCCCSc1ccc(c(c1)OC)O 62a_100000210211_100000694246 [0,1,0,1,0,0|2,0,0]=4 2913 B14R1.907 CCCCSc1ccc(c(n1)OC)N 62a_100000210211_100000687816 [0,1,0,1,0,0|2,0,0]=4 2914 B14R1.907 CCCCSc1ccc(c(n1)OC)N 62a_100000687816_100000210210 [0,1,0,1,0,0|2,0,0]=4 2915 B14R1.907 CCCCSc1ccc(c(n1)OC)O 62a_100000210211_100010893133 [0,1,0,1,0,0|2,0,0]=4 2916 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 207a_100020643023_100010244714 [0,1,0,1,0,0|2,0,0]=4 2917 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 270004a_100020643023_100010244714 [0,1,0,1,0,0|2,0,0]=4 2918 B14R1.907 CCCNCc1ccc(c(c1)OC)C 207a_100020643023_100000719150 [0,1,0,1,0,0|2,0,0]=4 2919 B14R1.907 CCCNCc1ccc(c(c1)OC)C 270004a_100020643023_100000719150 [0,1,0,1,0,0|2,0,0]=4 2920 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 207a_100020643023_100011998524 [0,1,0,1,0,0|2,0,0]=4 2921 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210303 [0,1,0,1,0,0|2,0,0]=4 2922 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 270004a_100020643023_100011998524 [0,1,0,1,0,0|2,0,0]=4 2923 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210303 [0,1,0,1,0,0|2,0,0]=4 2924 B14R1.907 CCCNCc1ccc(c(c1)OC)F 207a_100020643023_100000692873 [0,1,0,1,0,0|2,0,0]=4 2925 B14R1.907 CCCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210303 [0,1,0,1,0,0|2,0,0]=4 2926 B14R1.907 CCCNCc1ccc(c(c1)OC)F 270004a_100020643023_100000692873 [0,1,0,1,0,0|2,0,0]=4 2927 B14R1.907 CCCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210303 [0,1,0,1,0,0|2,0,0]=4 2928 B14R1.907 CCCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210303 [0,1,0,1,0,0|2,0,0]=4 2929 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100000210258_100010110085 [0,1,0,1,0,0|2,0,0]=4 2930 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210303 [0,1,0,1,0,0|2,0,0]=4 2931 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210303 [0,1,0,1,0,0|2,0,0]=4 2932 B14R1.907 CCCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210303 [0,1,0,1,0,0|2,0,0]=4 2933 B14R1.907 CCCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210303 [0,1,0,1,0,0|2,0,0]=4 2934 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100000210258_200010214485 [0,1,0,1,0,0|2,0,0]=4 2935 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210303 [0,1,0,1,0,0|2,0,0]=4 2936 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000210258_100012349856 [0,1,0,1,0,0|2,0,0]=4 2937 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210303 [0,1,0,1,0,0|2,0,0]=4 2938 B14R1.907 CCCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210303 [0,1,0,1,0,0|2,0,0]=4 2939 B14R1.907 CCCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210303 [0,1,0,1,0,0|2,0,0]=4 2940 B14R1.907 CCCOCc1ccc(c(n1)OC)Br 34a_100000210258_200010066506 [0,1,0,1,0,0|2,0,0]=4 2941 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100000210303_100010110085 [0,1,0,1,0,0|2,0,0]=4 2942 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210303 [0,1,0,1,0,0|2,0,0]=4 2943 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_100000210303_200010214485 [0,1,0,1,0,0|2,0,0]=4 2944 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210303 [0,1,0,1,0,0|2,0,0]=4 2945 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100000210303_100012349856 [0,1,0,1,0,0|2,0,0]=4 2946 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210303 [0,1,0,1,0,0|2,0,0]=4 2947 B14R1.907 CCCSCc1ccc(c(n1)OC)Br 62a_100000210303_200010066506 [0,1,0,1,0,0|2,0,0]=4 2948 B14R1.907 CCCSCc1ccc(c(n1)OC)Br 62a_200010066506_100000210303 [0,1,0,1,0,0|2,0,0]=4 2949 B14R1.907 CCNCCc1ccc(c(c1)OC)O 2230a_100015525214_100010741665 [0,1,0,1,0,0|2,0,0]=4 2950 B14R1.907 CCNCCc1ccc(c(c1)OC)O 34a_100000756042_100000210202 [0,1,0,1,0,0|2,0,0]=4 2951 B14R1.907 CCSCCc1ccc(c(c1)OC)O 62a_100000210202_100010741665 [0,1,0,1,0,0|2,0,0]=4 2952 B14R1.776 CCCCC=Cc1ccc(cc1)OC 271570a_100016275911_100000171711 [0,1,0,1,0,0|1,0,1]=4 2953 B14R1.776 CCCCC=Cc1ccc(cn1)OC 271570a_100016275911_100000755202 [0,1,0,1,0,0|1,0,1]=4 2954 B14R1.776 CCCCC=Cc1ccc(nc1)OC 271570a_100016275911_100000047065 [0,1,0,1,0,0|1,0,1]=4 2955 B14R1.776 CCCCC=Cc1ccc(nn1)OC 271570a_100016275911_100009819040 [0,1,0,1,0,0|1,0,1]=4 2956 B14R1.776 CCCCCCc1ccc(cc1)OC 34a_100000011238_200000210301 [0,1,0,1,0,0|1,0,1]=4 2957 B14R1.776 CCCCCCc1ccc(cc1)OC 7a_100000011238_200000210301 [0,1,0,1,0,0|1,0,1]=4 2958 B14R1.776 CCCCCCc1ccc(cc1)O[13CH3] 34a_100000011238_200025704644 [0,1,0,1,0,0|1,0,1]=4 2959 B14R1.776 CCCCCCc1ccc(cc1)O[13CH3] 7a_100000011238_200025704644 [0,1,0,1,0,0|1,0,1]=4 2960 B14R1.776 CCCCCNc1ccc(cc1)OC 34a_100000184247_100000718602 [0,1,0,1,0,0|2,0,0]=4 2961 B14R1.776 CCCCCNc1ccc(nn1)OC 27a_100000209983_100010231723 [0,1,0,1,0,0|2,0,0]=4 2962 B14R1.776 CCCCCOc1ccc(cc1)OC 34a_100000183632_200000210301 [0,1,0,1,0,0|2,0,0]=4 2963 B14R1.776 CCCCCOc1ccc(cc1)OC 34a_100000210503_100000718602 [0,1,0,1,0,0|2,0,0]=4 2964 B14R1.776 CCCCCOc1ccc(cc1)OC 7a_100000183632_200000210301 [0,1,0,1,0,0|2,0,0]=4 2965 B14R1.776 CCCCCOc1ccc(cc1)O[13CH3] 34a_100000183632_200025704644 [0,1,0,1,0,0|2,0,0]=4 2966 B14R1.776 CCCCCOc1ccc(cc1)O[13CH3] 7a_100000183632_200025704644 [0,1,0,1,0,0|2,0,0]=4 2967 B14R1.776 CCCCCOc1ccc(cn1)OC 34a_100012002028_100000718602 [0,1,0,1,0,0|2,0,0]=4 2968 B14R1.776 CCCCCOc1ccc(nc1)OC 34a_100011934560_100000718602 [0,1,0,1,0,0|2,0,0]=4 2969 B14R1.776 CCCCCSc1ccc(cc1)OC 62a_100000210326_100000171711 [0,1,0,1,0,0|2,0,0]=4 2970 B14R1.776 CCCCCSc1ccc(cn1)OC 62a_100000210326_100000744180 [0,1,0,1,0,0|2,0,0]=4 2971 B14R1.776 CCCCCSc1ccc(cn1)OC 62a_100000755202_100000210326 [0,1,0,1,0,0|2,0,0]=4 2972 B14R1.776 CCCCCSc1ccc(nc1)OC 62a_100000047065_100000210326 [0,1,0,1,0,0|2,0,0]=4 2973 B14R1.776 CCCCCSc1ccc(nc1)OC 62a_100000210326_100000047065 [0,1,0,1,0,0|2,0,0]=4 2974 B14R1.776 CCCCCSc1ccc(nn1)OC 62a_100000210326_100009819040 [0,1,0,1,0,0|2,0,0]=4 2975 B14R1.776 CCCCCSc1ccc(nn1)OC 62a_100009819040_100000210326 [0,1,0,1,0,0|2,0,0]=4 2976 B14R1.900 CCCCNc1cccc(c1Br)OC 34a_100000703447_100000210210 [0,1,0,1,0,0|2,0,0]=4 2977 B14R1.900 CCCCNc1cccc(c1C)OC 34a_100011244893_100000210210 [0,1,0,1,0,0|2,0,0]=4 2978 B14R1.900 CCCCNc1cccc(c1C)OC 7a_100011244893_100000210211 [0,1,0,1,0,0|2,0,0]=4 2979 B14R1.900 CCCCNc1cccc(c1Cl)OC 34a_100000089720_100000210210 [0,1,0,1,0,0|2,0,0]=4 2980 B14R1.900 CCCCNc1cccc(c1F)OC 34a_100000100910_100000210210 [0,1,0,1,0,0|2,0,0]=4 2981 B14R1.900 CCCCNc1cccc(c1I)OC 34a_100010245509_100000210210 [0,1,0,1,0,0|2,0,0]=4 2982 B14R1.900 CCCCNc1cccc(c1O)OC 34a_100000123586_100000210210 [0,1,0,1,0,0|1,0,1]=4 2983 B14R1.900 CCCCOc1cccc(c1Br)OC 34a_100010202623_100000210210 [0,1,0,1,0,0|2,0,0]=4 2984 B14R1.900 CCCCOc1cccc(c1Br)OC 7a_100010202623_100000210211 [0,1,0,1,0,0|2,0,0]=4 2985 B14R1.900 CCCCOc1cccc(c1Cl)OC 34a_100000087810_100000210210 [0,1,0,1,0,0|2,0,0]=4 2986 B14R1.900 CCCCOc1cccc(c1Cl)OC 7a_100000087810_100000210211 [0,1,0,1,0,0|2,0,0]=4 2987 B14R1.900 CCCCOc1cccc(c1F)OC 34a_100000102366_100000210210 [0,1,0,1,0,0|2,0,0]=4 2988 B14R1.900 CCCCOc1cccc(c1F)OC 7a_100000102366_100000210211 [0,1,0,1,0,0|2,0,0]=4 2989 B14R1.900 CCCCOc1cccc(c1I)OC 34a_200010201982_100000210210 [0,1,0,1,0,0|2,0,0]=4 2990 B14R1.900 CCCCOc1cccc(c1I)OC 7a_200010201982_100000210211 [0,1,0,1,0,0|2,0,0]=4 2991 B14R1.900 CCCCOc1cccc(c1N)OC 34a_100012022766_100000210210 [0,1,0,1,0,0|2,0,0]=4 2992 B14R1.900 CCCCOc1cccc(c1N)OC 7a_100012022766_100000210211 [0,1,0,1,0,0|2,0,0]=4 2993 B14R1.900 CCCCSc1cccc(c1Br)OC 62a_100000210211_100010146559 [0,1,0,1,0,0|2,0,0]=4 2994 B14R1.900 CCCCSc1cccc(c1Br)OC 62a_100010146559_100000210210 [0,1,0,1,0,0|2,0,0]=4 2995 B14R1.900 CCCCSc1cccc(c1C)C=O 62a_100000210211_100012179384 [0,1,0,1,0,0|2,0,0]=4 2996 B14R1.900 CCCCSc1cccc(c1C)C=O 62a_100012179384_100000210210 [0,1,0,1,0,0|2,0,0]=4 2997 B14R1.900 CCCCSc1cccc(c1C)OC 62a_100000210211_100010002647 [0,1,0,1,0,0|2,0,0]=4 2998 B14R1.900 CCCCSc1cccc(c1C)OC 62a_100010002647_100000210210 [0,1,0,1,0,0|2,0,0]=4 2999 B14R1.900 CCCCSc1cccc(c1Cl)OC 62a_100000210211_100010147677 [0,1,0,1,0,0|2,0,0]=4 3000 B14R1.900 CCCCSc1cccc(c1Cl)OC 62a_100010147677_100000210210 [0,1,0,1,0,0|2,0,0]=4 3001 B14R1.900 CCCCSc1cccc(c1F)OC 62a_100000210211_100010185846 [0,1,0,1,0,0|2,0,0]=4 3002 B14R1.900 CCCCSc1cccc(c1F)OC 62a_100010185846_100000210210 [0,1,0,1,0,0|2,0,0]=4 3003 B14R1.900 CCCCSc1cccc(c1N)OC 62a_100000708083_100000210210 [0,1,0,1,0,0|2,0,0]=4 3004 B14R1.900 CCCCSc1cccc(c1O)OC 62a_100000210211_100000686866 [0,1,0,1,0,0|1,0,1]=4 3005 B14R1.900 CCCNCc1cccc(c1Br)OC 207a_100020643023_100010209554 [0,1,0,1,0,0|2,0,0]=4 3006 B14R1.900 CCCNCc1cccc(c1Br)OC 270004a_100020643023_100010209554 [0,1,0,1,0,0|2,0,0]=4 3007 B14R1.900 CCCNCc1cccc(c1C)OC 207a_100020643023_100000101217 [0,1,0,1,0,0|2,0,0]=4 3008 B14R1.900 CCCNCc1cccc(c1C)OC 270004a_100020643023_100000101217 [0,1,0,1,0,0|2,0,0]=4 3009 B14R1.900 CCCNCc1cccc(c1Cl)OC 207a_100020643023_100000068750 [0,1,0,1,0,0|2,0,0]=4 3010 B14R1.900 CCCNCc1cccc(c1Cl)OC 270004a_100020643023_100000068750 [0,1,0,1,0,0|2,0,0]=4 3011 B14R1.900 CCCNCc1cccc(c1F)OC 207a_100020643023_100000692048 [0,1,0,1,0,0|2,0,0]=4 3012 B14R1.900 CCCNCc1cccc(c1F)OC 270004a_100020643023_100000692048 [0,1,0,1,0,0|2,0,0]=4 3013 B14R1.900 CCCNCc1cccc(c1F)OC 34a_100137345169_100000210303 [0,1,0,1,0,0|2,0,0]=4 3014 B14R1.900 CCCOCc1cccc(c1Br)OC 34a_100010146792_100000210303 [0,1,0,1,0,0|2,0,0]=4 3015 B14R1.900 CCCOCc1cccc(c1Br)OC 7a_100010146792_100000210303 [0,1,0,1,0,0|2,0,0]=4 3016 B14R1.900 CCCOCc1cccc(c1C)OC 34a_100000210258_100009876938 [0,1,0,1,0,0|2,0,0]=4 3017 B14R1.900 CCCOCc1cccc(c1C)OC 34a_100009871736_100000210303 [0,1,0,1,0,0|2,0,0]=4 3018 B14R1.900 CCCOCc1cccc(c1C)OC 7a_100009871736_100000210303 [0,1,0,1,0,0|2,0,0]=4 3019 B14R1.900 CCCOCc1cccc(c1Cl)OC 34a_100000210258_200010147866 [0,1,0,1,0,0|2,0,0]=4 3020 B14R1.900 CCCOCc1cccc(c1F)OC 34a_100000210258_100011260763 [0,1,0,1,0,0|2,0,0]=4 3021 B14R1.900 CCCOCc1cccc(c1F)OC 34a_100011935170_100000210303 [0,1,0,1,0,0|2,0,0]=4 3022 B14R1.900 CCCOCc1cccc(c1F)OC 7a_100011935170_100000210303 [0,1,0,1,0,0|2,0,0]=4 3023 B14R1.900 CCCOCc1cccc(c1I)OC 34a_100010236476_100000210303 [0,1,0,1,0,0|2,0,0]=4 3024 B14R1.900 CCCOCc1cccc(c1I)OC 7a_100010236476_100000210303 [0,1,0,1,0,0|2,0,0]=4 3025 B14R1.900 CCCOCc1cccc(c1N)OC 34a_100011999522_100000210303 [0,1,0,1,0,0|2,0,0]=4 3026 B14R1.900 CCCSCc1cccc(c1C)OC 62a_100000210303_100009876938 [0,1,0,1,0,0|2,0,0]=4 3027 B14R1.900 CCCSCc1cccc(c1C)OC 62a_100009876938_100000210303 [0,1,0,1,0,0|2,0,0]=4 3028 B14R1.900 CCCSCc1cccc(c1Cl)OC 62a_100000210303_200010147866 [0,1,0,1,0,0|2,0,0]=4 3029 B14R1.900 CCCSCc1cccc(c1Cl)OC 62a_200010147866_100000210303 [0,1,0,1,0,0|2,0,0]=4 3030 B14R1.900 CCCSCc1cccc(c1F)OC 62a_100000210303_100011260763 [0,1,0,1,0,0|2,0,0]=4 3031 B14R1.900 CCCSCc1cccc(c1F)OC 62a_100011260763_100000210303 [0,1,0,1,0,0|2,0,0]=4 3032 B14R1.163 CNC(=O)C=CC(=O)C1CCCCC1 1458a_100016259477_100000210327 [0,1,0,1,0,0|1,0,1]=4 3033 B14R1.163 COC(=O)C=CC(=O)N1CCOCC1 1626a_100015191051_100016283253 [0,1,0,1,0,0|2,0,0]=4 3034 B14R1.731 CNC(=O)C=CC(=O)CC1CCCC1 1458a_100016259477_100000740388 [0,1,0,1,0,0|1,0,1]=4 3035 B14R1.731 CNC(=O)C=CC(=O)NC1CCCC1 1626a_100000211070_100016259477 [0,1,0,1,0,0|2,0,0]=4 3036 B14R1.731 COC(=O)C=CC(=O)NC1CCCC1 1626a_100000211070_100016283253 [0,1,0,1,0,0|1,0,0]=3 3037 B14R1.731 COC(=O)C=CC(=O)N[C@H]1CCOC1 1626a_100015188467_100016283253 [0,1,0,1,0,0|2,0,0]=4 3038 B14R1.885 CCCCNc1cc(ccc1Br)OC 34a_100000748603_100000210210 [0,1,0,1,0,0|2,0,0]=4 3039 B14R1.885 CCCCNc1cc(ccc1C)OC 2230a_100000760359_100000210211 [0,1,0,1,0,0|2,0,0]=4 3040 B14R1.885 CCCCNc1cc(ccc1C)OC 34a_100000760359_100000210210 [0,1,0,1,0,0|2,0,0]=4 3041 B14R1.885 CCCCNc1cc(ccc1Cl)OC 34a_100000745576_100000210210 [0,1,0,1,0,0|2,0,0]=4 3042 B14R1.885 CCCCNc1cc(ccc1F)OC 34a_100000764331_100000210210 [0,1,0,1,0,0|2,0,0]=4 3043 B14R1.885 CCCCNc1cc(ccc1I)OC 34a_100000748021_100000210210 [0,1,0,1,0,0|2,0,0]=4 3044 B14R1.885 CCCCNc1cc(ccc1O)OC 34a_100000188146_100000210210 [0,1,0,1,0,0|2,0,0]=4 3045 B14R1.885 CCCCOc1cc(ccc1Br)OC 34a_100000719091_100000210210 [0,1,0,1,0,0|2,0,0]=4 3046 B14R1.885 CCCCOc1cc(ccc1Br)OC 7a_100000719091_100000210211 [0,1,0,1,0,0|2,0,0]=4 3047 B14R1.885 CCCCOc1cc(ccc1C)OC 34a_100012179981_100000210210 [0,1,0,1,0,0|2,0,0]=4 3048 B14R1.885 CCCCOc1cc(ccc1C)OC 7a_100012179981_100000210211 [0,1,0,1,0,0|2,0,0]=4 3049 B14R1.885 CCCCOc1cc(ccc1Cl)OC 34a_100011516019_100000210210 [0,1,0,1,0,0|2,0,0]=4 3050 B14R1.885 CCCCOc1cc(ccc1Cl)OC 7a_100011516019_100000210211 [0,1,0,1,0,0|2,0,0]=4 3051 B14R1.885 CCCCOc1cc(ccc1F)OC 34a_100012178750_100000210210 [0,1,0,1,0,0|2,0,0]=4 3052 B14R1.885 CCCCOc1cc(ccc1F)OC 7a_100012178750_100000210211 [0,1,0,1,0,0|2,0,0]=4 3053 B14R1.885 CCCCOc1cc(ccc1I)OC 34a_100010168831_100000210210 [0,1,0,1,0,0|2,0,0]=4 3054 B14R1.885 CCCCOc1cc(ccc1I)OC 7a_100010168831_100000210211 [0,1,0,1,0,0|2,0,0]=4 3055 B14R1.885 CCCCOc1cc(ccc1N)OC 34a_100016989039_100000210210 [0,1,0,1,0,0|2,0,0]=4 3056 B14R1.885 CCCCOc1cc(ccc1N)OC 7a_100016989039_100000210211 [0,1,0,1,0,0|2,0,0]=4 3057 B14R1.885 CCCCSc1cc(ccc1Br)OC 62a_100000210211_100009992028 [0,1,0,1,0,0|2,0,0]=4 3058 B14R1.885 CCCCSc1cc(ccc1Br)OC 62a_100009992028_100000210210 [0,1,0,1,0,0|2,0,0]=4 3059 B14R1.885 CCCCSc1cc(ccc1C)OC 62a_100000210211_100012349166 [0,1,0,1,0,0|2,0,0]=4 3060 B14R1.885 CCCCSc1cc(ccc1C)OC 62a_100012349166_100000210210 [0,1,0,1,0,0|2,0,0]=4 3061 B14R1.885 CCCCSc1cc(ccc1Cl)OC 62a_100000210211_100011356938 [0,1,0,1,0,0|2,0,0]=4 3062 B14R1.885 CCCCSc1cc(ccc1Cl)OC 62a_100011356938_100000210210 [0,1,0,1,0,0|2,0,0]=4 3063 B14R1.885 CCCCSc1cc(ccc1F)OC 62a_100000210211_100000699733 [0,1,0,1,0,0|2,0,0]=4 3064 B14R1.885 CCCCSc1cc(ccc1F)OC 62a_100000699733_100000210210 [0,1,0,1,0,0|2,0,0]=4 3065 B14R1.885 CCCCSc1cc(ccc1N)OC 62a_100000210211_100015195136 [0,1,0,1,0,0|2,0,0]=4 3066 B14R1.885 CCCCSc1cc(ccc1N)OC 62a_100015195136_100000210210 [0,1,0,1,0,0|2,0,0]=4 3067 B14R1.885 CCCCSc1cc(ccc1O)OC 62a_100000210211_100000685887 [0,1,0,1,0,0|2,0,0]=4 3068 B14R1.885 CCCCSc1nc(ccc1N)OC 62a_100000069805_100000210210 [0,1,0,1,0,0|2,0,0]=4 3069 B14R1.885 CCCCSc1nc(ccc1N)OC 62a_100000210211_100000069805 [0,1,0,1,0,0|2,0,0]=4 3070 B14R1.885 CCCNCc1cc(ccc1Br)OC 207a_100020643023_100000691568 [0,1,0,1,0,0|2,0,0]=4 3071 B14R1.885 CCCNCc1cc(ccc1Br)OC 2230a_100000741592_100000210303 [0,1,0,1,0,0|2,0,0]=4 3072 B14R1.885 CCCNCc1cc(ccc1Br)OC 270004a_100020643023_100000691568 [0,1,0,1,0,0|2,0,0]=4 3073 B14R1.885 CCCNCc1cc(ccc1Br)OC 34a_100000741592_100000210303 [0,1,0,1,0,0|2,0,0]=4 3074 B14R1.885 CCCNCc1cc(ccc1C)OC 207a_100020643023_100012017359 [0,1,0,1,0,0|2,0,0]=4 3075 B14R1.885 CCCNCc1cc(ccc1C)OC 270004a_100020643023_100012017359 [0,1,0,1,0,0|2,0,0]=4 3076 B14R1.885 CCCNCc1cc(ccc1C)OC 34a_100012180165_100000210303 [0,1,0,1,0,0|2,0,0]=4 3077 B14R1.885 CCCNCc1cc(ccc1Cl)OC 207a_100020643023_100000117592 [0,1,0,1,0,0|2,0,0]=4 3078 B14R1.885 CCCNCc1cc(ccc1Cl)OC 270004a_100020643023_100000117592 [0,1,0,1,0,0|2,0,0]=4 3079 B14R1.885 CCCNCc1cc(ccc1F)OC 207a_100020643023_100000034340 [0,1,0,1,0,0|2,0,0]=4 3080 B14R1.885 CCCNCc1cc(ccc1F)OC 270004a_100020643023_100000034340 [0,1,0,1,0,0|2,0,0]=4 3081 B14R1.885 CCCNCc1cc(ccc1F)OC 34a_100016995475_100000210303 [0,1,0,1,0,0|2,0,0]=4 3082 B14R1.885 CCCNCc1cc(ccc1I)OC 207a_100020643023_100010075557 [0,1,0,1,0,0|2,0,0]=4 3083 B14R1.885 CCCNCc1cc(ccc1I)OC 270004a_100020643023_100010075557 [0,1,0,1,0,0|2,0,0]=4 3084 B14R1.885 CCCNCc1nc(ccc1Br)OC 207a_100020643023_200010173843 [0,1,0,1,0,0|2,0,0]=4 3085 B14R1.885 CCCNCc1nc(ccc1Br)OC 270004a_100020643023_200010173843 [0,1,0,1,0,0|2,0,0]=4 3086 B14R1.885 CCCNCc1nc(ccc1Cl)OC 207a_100020643023_100000070420 [0,1,0,1,0,0|2,0,0]=4 3087 B14R1.885 CCCNCc1nc(ccc1Cl)OC 2230a_100011639525_100000210303 [0,1,0,1,0,0|2,0,0]=4 3088 B14R1.885 CCCNCc1nc(ccc1Cl)OC 270004a_100020643023_100000070420 [0,1,0,1,0,0|2,0,0]=4 3089 B14R1.885 CCCOCc1cc(ccc1Br)OC 34a_100000210258_100000761528 [0,1,0,1,0,0|2,0,0]=4 3090 B14R1.885 CCCOCc1cc(ccc1Br)OC 34a_200011273942_100000210303 [0,1,0,1,0,0|2,0,0]=4 3091 B14R1.885 CCCOCc1cc(ccc1Br)OC 7a_200011273942_100000210303 [0,1,0,1,0,0|2,0,0]=4 3092 B14R1.885 CCCOCc1cc(ccc1C)OC 34a_100009841904_100000210303 [0,1,0,1,0,0|2,0,0]=4 3093 B14R1.885 CCCOCc1cc(ccc1C)OC 7a_100009841904_100000210303 [0,1,0,1,0,0|2,0,0]=4 3094 B14R1.885 CCCOCc1cc(ccc1Cl)OC 34a_100000210258_100000718613 [0,1,0,1,0,0|2,0,0]=4 3095 B14R1.885 CCCOCc1cc(ccc1F)OC 34a_100000067870_100000210303 [0,1,0,1,0,0|2,0,0]=4 3096 B14R1.885 CCCOCc1cc(ccc1F)OC 34a_100000210258_100010243555 [0,1,0,1,0,0|2,0,0]=4 3097 B14R1.885 CCCOCc1cc(ccc1F)OC 7a_100000067870_100000210303 [0,1,0,1,0,0|2,0,0]=4 3098 B14R1.885 CCCOCc1cc(ccc1N)OC 34a_100012001277_100000210303 [0,1,0,1,0,0|2,0,0]=4 3099 B14R1.885 CCCOCc1nc(ccc1Cl)OC 34a_100011438736_100000210303 [0,1,0,1,0,0|2,0,0]=4 3100 B14R1.885 CCCSCc1cc(ccc1Br)OC 62a_100000210303_100000761528 [0,1,0,1,0,0|2,0,0]=4 3101 B14R1.885 CCCSCc1cc(ccc1Br)OC 62a_100000761528_100000210303 [0,1,0,1,0,0|2,0,0]=4 3102 B14R1.885 CCCSCc1cc(ccc1Cl)OC 62a_100000210303_100000718613 [0,1,0,1,0,0|2,0,0]=4 3103 B14R1.885 CCCSCc1cc(ccc1Cl)OC 62a_100000718613_100000210303 [0,1,0,1,0,0|2,0,0]=4 3104 B14R1.885 CCCSCc1cc(ccc1F)OC 62a_100000210303_100010243555 [0,1,0,1,0,0|2,0,0]=4 3105 B14R1.885 CCCSCc1cc(ccc1F)OC 62a_100010243555_100000210303 [0,1,0,1,0,0|2,0,0]=4 3106 B14R1.885 CCOCCc1cc(ccc1Br)OC 34a_100012259501_100000210202 [0,1,0,1,0,0|2,0,0]=4 3107 B14R1.885 CCOCCc1cc(ccc1Br)OC 7a_100012259501_100000210202 [0,1,0,1,0,0|2,0,0]=4 3108 B14R1.4461 COC(=O)C=CC(=O)N1CCSC1C 1626a_200011216479_100016283253 [0,1,0,1,0,0|2,0,0]=4 3109 B14R1.7452 CCCCc1cc(sc1C(=O)OC)C 271570a_100020621405_100009817204 [0,1,0,1,0,0|1,0,1]=4 3110 B14R1.7452 CCCCc1sc(cc1C(=O)OC)C 271570a_100020621405_100009817063 [0,1,0,1,0,0|1,0,1]=4 3111 B14R1.7758 CNC(=O)C=CC(=O)NCC1CCC1 1626a_100000738700_100016259477 [0,1,0,1,0,0|2,0,0]=4 3112 B14R1.7758 COC(=O)C=CC(=NNC1CCC1)C 4a_100000736358_100016258046 [0,1,0,1,0,0|2,0,0]=4 3113 B14R1.7758 COC(=O)C=CC(=O)NCC1CCC1 1626a_100000738700_100016283253 [0,1,0,1,0,0|1,0,0]=3 3114 B14R1.7758 COC(=O)C=CC(=O)NCC1COC1 1626a_100015281925_100016283253 [0,1,0,1,0,0|2,0,0]=4 3115 B14R1.7758 COC(=O)C=CC(=O)NC[C@@H]1CCO1 1626a_100020831831_100016283253 [0,1,0,1,0,0|2,0,0]=4 3116 B14R1.7758 COC(=O)C=CC(=O)NNC1CCC1 22a_100000736358_100016283253 [0,1,0,1,0,0|2,0,0]=4 3117 B14R1.7759 CNC(=O)C=CC(=O)NCCC1CC1 1626a_100000764129_100016259477 [0,1,0,1,0,0|2,0,0]=4 3118 B14R1.7759 COC(=O)C=CC(=NNCC1CC1)C 4a_100000736359_100016258046 [0,1,0,1,0,0|2,0,0]=4 3119 B14R1.7759 COC(=O)C=CC(=O)NCCC1CC1 1626a_100000764129_100016283253 [0,1,0,1,0,0|1,0,0]=3 3120 B14R1.7759 COC(=O)C=CC(=O)NNCC1CC1 22a_100000736359_100016283253 [0,1,0,1,0,0|2,0,0]=4 3121 B14R2.4487 Cn1c(cccc1=O)SCC2CC2 62a_100000726605_100000742324 [0,0,0,2,0,0|2,0,0]=4 3122 B14R2.4487 Cn1c(cccc1=O)SCC2CC2 62a_100000756562_100000726605 [0,0,0,2,0,0|2,0,0]=4 3123 B14R2.4489 Cn1c(cccc1=O)SC2CCC2 62a_100000726605_100000749161 [0,0,0,2,0,0|2,0,0]=4 3124 B14R2.252 O=C1C=C(CO1)CNC2CCCC2 34a_100000211070_100000716558 [0,0,0,2,0,0|1,0,1]=4 3125 B14R2.252 O=C1C=C(CO1)COC2CCCC2 34a_100000210269_100000716558 [0,0,0,2,0,0|1,0,1]=4 3126 B14R2.252 O=C1C=C(CO1)CSC2CCCC2 62a_100000716558_100000179811 [0,0,0,2,0,0|1,0,1]=4 3127 B14R2.252 O=C1C=C(CO1)CSC2CCCC2 62a_100011217020_100000716558 [0,0,0,2,0,0|1,0,1]=4 3128 B14R2.257 CC1CC1COCC2=CC(=O)OC2 34a_100000744939_100000716558 [0,0,0,2,0,0|1,0,1]=4 3129 B14R2.259 C[C@@H]1CCCN1CC2=CC(=O)OC2 34a_100015189458_100000716558 [0,0,0,2,0,0|1,0,1]=4 3130 B14R2.4374 O=C1C=C(CO1)CNCCC2CC2 34a_100000764129_100000716558 [0,0,0,2,0,0|1,0,1]=4 3131 B14R2.4374 O=C1C=C(CO1)COCCC2CC2 34a_100000754188_100000716558 [0,0,0,2,0,0|1,0,1]=4 3132 B14R2.4374 O=C1C=C(CO1)CSCCC2CC2 62a_100000716558_100000764125 [0,0,0,2,0,0|1,0,1]=4 3133 B14R2.4374 O=C1C=C(CO1)CSCCC2CC2 62a_100000764125_100000716558 [0,0,0,2,0,0|1,0,1]=4 3134 B14R2.4390 O=C1C=C(CO1)CNCC2CCC2 34a_100000738700_100000716558 [0,0,0,2,0,0|1,0,1]=4 3135 B14R2.4390 O=C1C=C(CO1)COCC2CCC2 34a_100000760304_100000716558 [0,0,0,2,0,0|1,0,1]=4 3136 B14R2.4390 O=C1C=C(CO1)CSCC2CCC2 62a_100000716558_100000763275 [0,0,0,2,0,0|1,0,1]=4 3137 B14R2.4390 O=C1C=C(CO1)CSCC2CCC2 62a_100000763275_100000716558 [0,0,0,2,0,0|1,0,1]=4 3138 B14R2.11689 CNC1CCc2c1c(ccc2)OC 2230a_100103153739_200000210301 [0,0,0,2,0,0|2,0,0]=4 3139 B14R2.11689 CNC1CCc2c1c(ccc2)OC 34a_100103153739_200000210301 [0,0,0,2,0,0|2,0,0]=4 3140 B14R2.11689 COc1cccc2c1C(CC2)N[13CH3] 2230a_100103153739_200025704644 [0,0,0,2,0,0|2,0,0]=4 3141 B14R2.11689 COc1cccc2c1C(CC2)N[13CH3] 34a_100103153739_200025704644 [0,0,0,2,0,0|2,0,0]=4 3142 B14R2.10655 COC(=O)c1ccccc1C2CC2 271570a_100011220607_100000148710 [0,0,0,2,0,0|0,0,2]=4 3143 B14R2.10655 COC(=O)c1cccnc1C2CC2 271570a_100011220607_100000150852 [0,0,0,2,0,0|1,0,1]=4 3144 B14R2.10768 COC(=O)/C=C/CN1CC2CC2C1 2230a_100000741873_100000742655 [0,0,0,2,0,0|1,0,1]=4 3145 B14R2.10768 COC(=O)/C=C/CN1CC2CC2C1 269982a_100000741873_100000742655 [0,0,0,2,0,0|1,0,1]=4 3146 B14R2.10768 COC(=O)/C=C/CN1CC2CC2C1 34a_100000741873_100000742655 [0,0,0,2,0,0|1,0,1]=4 3147 B14R2.3265 COc1cccc(c1)CN2CCC2 269982a_100000754969_100000688526 [0,0,0,2,0,0|2,0,0]=4 3148 B14R2.3265 COc1cccc(c1)CN2CCC2 26a_100000754969_100000211255 [0,0,0,2,0,0|2,0,0]=4 3149 B14R2.3265 COc1cccc(c1)NC2CCC2 34a_100000210024_100000749161 [0,0,0,2,0,0|2,0,0]=4 3150 B14R2.3265 COc1cccc(c1)OC2CCC2 34a_100000211255_100000749161 [0,0,0,2,0,0|2,0,0]=4 3151 B14R2.3265 COc1cccc(n1)CN2CCC2 269982a_100000754969_100000755263 [0,0,0,2,0,0|2,0,0]=4 3152 B14R2.3265 COc1cccc(n1)SC2CCC2 62a_100000760917_100000749161 [0,0,0,2,0,0|2,0,0]=4 3153 B14R2.2185 COc1cccc(c1)CNC2CC2 34a_100000174954_100000211595 [0,0,0,2,0,0|2,0,0]=4 3154 B14R2.2185 COc1cccc(c1)CNC2CC2 34a_100000212008_100000688526 [0,0,0,2,0,0|2,0,0]=4 3155 B14R2.2185 COc1cccc(c1)COC2CC2 34a_100000198976_100000211595 [0,0,0,2,0,0|2,0,0]=4 3156 B14R2.2185 COc1cccc(c1)CSC2CC2 62a_100000688526_100000211595 [0,0,0,2,0,0|2,0,0]=4 3157 B14R2.2185 COc1cccc(c1)NCC2CC2 34a_100000210024_100000742324 [0,0,0,2,0,0|2,0,0]=4 3158 B14R2.2185 COc1cccc(c1)OCC2CC2 34a_100000211255_100000742324 [0,0,0,2,0,0|2,0,0]=4 3159 B14R2.2185 COc1cccc(c1)OCC2CC2 7a_100000211255_100000742324 [0,0,0,2,0,0|2,0,0]=4 3160 B14R2.2185 COc1cccc(c1)SCC2CC2 62a_100000756562_100000170001 [0,0,0,2,0,0|2,0,0]=4 3161 B14R2.2185 COc1cccc(n1)CNC2CC2 34a_100000212008_100000755263 [0,0,0,2,0,0|2,0,0]=4 3162 B14R2.2185 COc1cccc(n1)CSC2CC2 62a_100000755263_100000211595 [0,0,0,2,0,0|2,0,0]=4 3163 B14R2.2185 COc1cccc(n1)SCC2CC2 62a_100000756562_100000760917 [0,0,0,2,0,0|2,0,0]=4 3164 B14R2.2185 COc1cccc(n1)SCC2CC2 62a_100000760917_100000742324 [0,0,0,2,0,0|2,0,0]=4 3165 B14R2.152 CNC1CCc2c1ccc(c2)OC 269862a_106832991636_100011215323 [0,0,0,2,0,0|2,0,0]=4