0 B12R1.37 BrCCCCCCn1ccnn1 Amb33521755 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.37 BrCCCCCCn1cncn1 Amb33624900 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.37 CCCCCC#Cc1cccs1 Amb27751697 [0,0,0,0,0,0|0,1,2]=3 3 B12R1.37 CCCCCCCC1OCCO1 Amb25368281 [0,0,0,0,0,0|1,0,3]=4 4 B12R1.37 CCCCCCCc1ccco1 Amb10070289 [0,0,0,0,0,0|0,0,0]=0 5 B12R1.37 CCCCCCCc1cccs1 Amb24089104 [0,0,0,0,0,0|0,1,0]=1 6 B12R1.37 CCCCCCCc1ccsc1 Amb8515180 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.37 CCCCCCCn1ccnc1 Amb22752782 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.37 CCCCCNCc1ccco1 Amb5261471 [0,0,0,0,0,0|1,0,0]=1 9 B12R1.37 CCCCCNCc1cccs1 Amb837717 [0,0,0,0,0,0|1,1,0]=2 10 B12R1.37 CCCCCNCc1ccsc1 Amb5262475 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.37 CCCCCNCc1cncs1 Amb19069012 [0,0,0,0,0,0|2,1,0]=3 12 B12R1.37 CCCCCNCc1csnn1 Amb9529001 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.37 CCCCNCCc1nccs1 Amb17315486 [0,0,0,0,0,0|2,1,0]=3 14 B12R1.37 CCCNCCCn1ccnc1 Amb9208467 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.37 CCNCCC#Cc1ccco1 Amb35659667 [0,0,0,0,0,0|1,0,2]=3 16 B12R1.37 CCNCCC#Cc1cccs1 Amb30040550 [0,0,0,0,0,0|1,1,2]=4 17 B12R1.37 CCNCCNCc1ccco1 Amb18805892 [0,0,0,0,0,0|2,0,0]=2 18 B12R1.37 CCOCCNCc1ccco1 Amb9241000 [0,0,0,0,0,0|2,0,0]=2 19 B12R1.37 CCOCCNCc1cccs1 Amb9241052 [0,0,0,0,0,0|2,1,0]=3 20 B12R1.37 CCOCCNCc1ccsc1 Amb9454147 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.37 CCOCCNCc1cncs1 Amb19070210 [0,0,0,0,0,0|3,1,0]=4 22 B12R1.37 CNCCCNCc1ccco1 Amb5261477 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.37 CNCCCNCc1cccs1 Amb19074972 [0,0,0,0,0,0|2,1,0]=3 24 B12R1.37 COCCCNCc1ccco1 Amb875961 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.37 COCCCNCc1cccs1 Amb875719 [0,0,0,0,0,0|2,1,0]=3 26 B12R1.37 COCCCNCc1ccsc1 Amb6730184 [0,0,0,0,0,0|4,0,0]=4 27 B12R1.37 COCCCNCc1cncs1 Amb19070208 [0,0,0,0,0,0|3,1,0]=4 28 B12R1.37 COCCCNCc1nccs1 Amb17335876 [0,0,0,0,0,0|3,1,0]=4 29 B12R1.37 COCCNCCc1nccs1 Amb17315515 [0,0,0,0,0,0|3,1,0]=4 30 B12R1.37 CSCCCNCc1ccco1 Amb6719039 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.37 CSCCCNCc1cccs1 Amb6729526 [0,0,0,0,0,0|2,1,0]=3 32 B12R1.37 ClCCCCCCn1ccnc1 Amb24080156 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.37 NCCCCC#Cc1ccco1 Amb27615347 [0,0,0,0,0,0|1,0,2]=3 34 B12R1.37 NCCCCCCc1ccsc1 Amb33320899 [0,0,0,0,0,0|3,0,0]=3 35 B12R1.37 NCCCCCCn1cccn1 Amb33481050 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.37 NCCCCCCn1ccnc1 Amb5357894 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.37 NCCCCCCn1cncn1 Amb33358434 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.37 NCCCNCCc1cccs1 Amb18608752 [0,0,0,0,0,0|2,1,0]=3 39 B12R1.37 NCCCOCCc1ccsc1 Amb32953622 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.37 NCCCOCCn1cccn1 Amb18801338 [0,0,0,0,0,0|4,0,0]=4 41 B12R1.37 O=CCCCCCc1ccsc1 Amb33320896 [0,0,0,0,0,0|3,0,1]=4 42 B12R1.37 O=CCCCCCn1cccn1 Amb32727337 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.37 OCCCCC#Cc1cccs1 Amb28065349 [0,0,0,0,0,0|1,1,2]=4 44 B12R1.37 OCCCCCCn1ccnn1 Amb33623453 [0,0,0,0,0,0|4,0,0]=4 45 B12R1.37 OCCCCNCc1cccs1 Amb838164 [0,0,0,0,0,0|2,1,0]=3 46 B12R1.37 OCCCNCCc1nccs1 Amb17315479 [0,0,0,0,0,0|3,1,0]=4 47 B12R1.37 S=C=NCCSCc1ccco1 Amb29845271 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.4 BrCCCCCc1ccsc1 Amb33009453 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.4 BrCCCCCn1cccn1 Amb33005069 [1,0,0,0,0,0|3,0,0]=4 50 B11R1.4 BrCCC\C=C/c1ccco1 Amb27673526 [1,0,0,0,0,0|1,0,2]=4 51 B11R1.4 BrCCC\C=C\c1ccco1 Amb27672061 [1,0,0,0,0,0|1,0,2]=4 52 B11R1.4 C=CCNCCc1ccco1 Amb18799385 [1,0,0,0,0,0|1,0,2]=4 53 B11R1.4 CC#CCNCc1ccco1 Amb21953890 [1,0,0,0,0,0|1,0,2]=4 54 B11R1.4 CC#CCNCc1ccco1 Amb637270 [1,0,0,0,0,0|1,0,2]=4 55 B11R1.4 CCCCC#Cc1cccs1 Amb27776530 [1,0,0,0,0,0|0,1,2]=4 56 B11R1.4 CCCCCCc1cccs1 Amb6358035 [1,0,0,0,0,0|0,1,0]=2 57 B11R1.4 CCCCCCc1ccsc1 Amb2696630 [1,0,0,0,0,0|2,0,0]=3 58 B11R1.4 CCCCCCn1ccnc1 Amb10574355 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.4 CCCCNCc1ccco1 Amb1140392 [1,0,0,0,0,0|1,0,0]=2 60 B11R1.4 CCCCNCc1ccco1 Amb6867989 [1,0,0,0,0,0|1,0,0]=2 61 B11R1.4 CCCCNCc1cccs1 Amb20673561 [1,0,0,0,0,0|1,1,0]=3 62 B11R1.4 CCCCNCc1cccs1 Amb534495 [1,0,0,0,0,0|1,1,0]=3 63 B11R1.4 CCCCNCc1ccoc1 Amb18179480 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.4 CCCCNCc1ccsc1 Amb5262468 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.4 CCCCNCc1ccsc1 Amb6868332 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.4 CCCCNCc1cncs1 Amb18802030 [1,0,0,0,0,0|2,1,0]=4 67 B11R1.4 CCCCNCc1nccs1 Amb17334822 [1,0,0,0,0,0|2,1,0]=4 68 B11R1.4 CCCCOCc1ccco1 Amb24054478 [1,0,0,0,0,0|1,0,0]=2 69 B11R1.4 CCCNCCc1cccs1 Amb33534035 [1,0,0,0,0,0|1,1,0]=3 70 B11R1.4 CCCNCCc1nccs1 Amb17315483 [1,0,0,0,0,0|2,1,0]=4 71 B11R1.4 CCCNCCn1cccn1 Amb18177296 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.4 CCNC\C=C\c1ccco1 Amb27271367 [1,0,0,0,0,0|1,0,2]=4 73 B11R1.4 CCOCOCc1ccco1 Amb21856201 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.4 CNCCC#Cc1ccco1 Amb35738494 [1,0,0,0,0,0|1,0,2]=4 75 B11R1.4 CNCCCCc1ccsc1 Amb33449244 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.4 CNCCCCn1cccn1 Amb18796727 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.4 CNCCNCc1ccco1 Amb18791584 [1,0,0,0,0,0|2,0,0]=3 78 B11R1.4 CNCCSCc1ccco1 Amb18807017 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.4 CNCC\C=C\c1ccco1 Amb27987208 [1,0,0,0,0,0|1,0,2]=4 80 B11R1.4 COCCNCc1ccco1 Amb2592327 [1,0,0,0,0,0|2,0,0]=3 81 B11R1.4 COCCNCc1cccs1 Amb10610251 [1,0,0,0,0,0|2,1,0]=4 82 B11R1.4 COCCNCc1cccs1 Amb1153808 [1,0,0,0,0,0|2,1,0]=4 83 B11R1.4 C\C=C\CNCc1ccco1 Amb17872669 [1,0,0,0,0,0|1,0,2]=4 84 B11R1.4 ClCCCCCc1cccs1 Amb1102003 [1,0,0,0,0,0|1,1,0]=3 85 B11R1.4 ClCCCCCn1cccn1 Amb19373078 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.4 ClCCCNCc1ccco1 Amb20573428 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.4 N#CCCCCc1cccs1 Amb18862653 [1,0,0,0,0,0|1,1,1]=4 88 B11R1.4 N#CCCNCc1ccco1 Amb1151292 [1,0,0,0,0,0|2,0,1]=4 89 B11R1.4 N#CCCOCc1ccco1 Amb5494057 [1,0,0,0,0,0|2,0,1]=4 90 B11R1.4 N#CCCSCc1ccco1 Amb9204467 [1,0,0,0,0,0|2,0,1]=4 91 B11R1.4 NCCCCCc1ccsc1 Amb33079652 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.4 NCCCCCn1cccn1 Amb18179495 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.4 NCCCNCc1ccco1 Amb17315268 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.4 NCCCOCc1ccco1 Amb1154610 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.4 NCCCSCc1ccco1 Amb21984189 [1,0,0,0,0,0|2,0,0]=3 96 B11R1.4 NCCCSCc1ccco1 Amb9203028 [1,0,0,0,0,0|2,0,0]=3 97 B11R1.4 O=CCCCCc1cccs1 Amb18048615 [1,0,0,0,0,0|1,1,1]=4 98 B11R1.4 OCCCC#Cc1ccco1 Amb26844924 [1,0,0,0,0,0|1,0,2]=4 99 B11R1.4 OCCCCCc1ccsc1 Amb32954776 [1,0,0,0,0,0|3,0,0]=4 100 B11R1.4 OCCCCCn1cccn1 Amb18799534 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.4 OCCCNCc1ccco1 Amb2592329 [1,0,0,0,0,0|2,0,0]=3 102 B11R1.4 OCCCNCc1cccs1 Amb6772394 [1,0,0,0,0,0|2,1,0]=4 103 B11R1.4 OCCCNCc1cccs1 Amb838115 [1,0,0,0,0,0|2,1,0]=4 104 B11R1.4 OCCC\N=C\c1ccco1 Amb27989630 [1,0,0,0,0,0|2,0,1]=4 105 B11R1.4 SCCCCCc1ccsc1 Amb33484588 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.4 SCCCCCn1cccn1 Amb32953376 [1,0,0,0,0,0|3,0,0]=4 107 B13R1.27 C#CCCCSCc1ccc(Cl)o1 Amb32789042 [0,1,0,0,0,0|1,0,2]=4 108 B13R1.27 CCCCCCCc1nnc(N)o1 Amb7786452 [0,1,0,0,0,0|2,0,0]=3 109 B13R1.27 CCCCCCCc1nnc(N)s1 Amb1795893 [0,1,0,0,0,0|2,1,0]=4 110 B13R1.27 CCCCCCCc1nnc(S)o1 Amb7802052 [0,1,0,0,0,0|2,0,0]=3 111 B13R1.27 CCCCCCCn1cc(N)cn1 Amb7794733 [0,1,0,0,0,0|2,0,0]=3 112 B13R1.27 CCCCCCCn1cc(N)nn1 Amb32702952 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.27 CCCCCCCn1ccc(N)n1 Amb18181455 [0,1,0,0,0,0|2,0,0]=3 114 B13R1.27 CCCCCCCn1cnc(N)c1 Amb32701992 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.27 CCCCCCCn1cnc(N)n1 Amb18322357 [0,1,0,0,0,0|3,0,0]=4 116 B13R1.27 CCCCCCCn1ncc(N)n1 Amb32708270 [0,1,0,0,0,0|3,0,0]=4 117 B13R1.27 CCCCCCNc1ccn(C)n1 Amb18181447 [0,1,0,0,0,0|3,0,0]=4 118 B13R1.27 CCCCCCOc1ncc(N)s1 Amb33035398 [0,1,0,0,0,0|2,1,0]=4 119 B13R1.27 CCCCCNCc1cc(Br)cs1 Amb7756994 [0,1,0,0,0,0|1,1,0]=3 120 B13R1.27 CCCCCNCc1ccc(Br)s1 Amb6688187 [0,1,0,0,0,0|1,1,0]=3 121 B13R1.27 CCCCCNCc1ccc(C)o1 Amb6688089 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.27 CCCCCNCc1ccc(C)s1 Amb6720011 [0,1,0,0,0,0|1,1,0]=3 123 B13R1.27 CCCCCNCc1ccn(C)n1 Amb31214158 [0,1,0,0,0,0|3,0,0]=4 124 B13R1.27 CCCCNCCc1nc(C)cs1 Amb17316372 [0,1,0,0,0,0|2,1,0]=4 125 B13R1.27 CCCCOCCn1cc(N)cn1 Amb18322611 [0,1,0,0,0,0|3,0,0]=4 126 B13R1.27 CCCCOCCn1ccc(N)n1 Amb19057182 [0,1,0,0,0,0|3,0,0]=4 127 B13R1.27 CCNCCSCc1ccc(Cl)o1 Amb32789098 [0,1,0,0,0,0|2,0,0]=3 128 B13R1.27 CCOCCNCc1cc(Br)cs1 Amb9454289 [0,1,0,0,0,0|2,1,0]=4 129 B13R1.27 CCOCCNCc1ccc(Br)s1 Amb9454183 [0,1,0,0,0,0|2,1,0]=4 130 B13R1.27 CCOCCNCc1ccc(C)o1 Amb9454144 [0,1,0,0,0,0|2,0,0]=3 131 B13R1.27 CCOCCNCc1ccc(C)s1 Amb9454053 [0,1,0,0,0,0|2,1,0]=4 132 B13R1.27 CNCCCNCc1ccc(C)s1 Amb10242982 [0,1,0,0,0,0|2,1,0]=4 133 B13R1.27 CNCCCSCc1ccc(Cl)o1 Amb32788987 [0,1,0,0,0,0|2,0,0]=3 134 B13R1.27 COCCCNCc1cc(Br)cs1 Amb9203186 [0,1,0,0,0,0|2,1,0]=4 135 B13R1.27 COCCCNCc1ccc(Br)s1 Amb6730315 [0,1,0,0,0,0|2,1,0]=4 136 B13R1.27 COCCCNCc1ccc(C)o1 Amb2592347 [0,1,0,0,0,0|2,0,0]=3 137 B13R1.27 COCCCNCc1ccc(C)s1 Amb875786 [0,1,0,0,0,0|2,1,0]=4 138 B13R1.27 CSCCCNCc1cc(Br)cs1 Amb33044397 [0,1,0,0,0,0|2,1,0]=4 139 B13R1.27 Cc1ccc(CNCCCCO)s1 Amb837672 [0,1,0,0,0,0|2,1,0]=4 140 B13R1.27 ClCCCCSCc1ccc(Cl)o1 Amb32789055 [0,1,0,0,0,0|2,0,0]=3 141 B13R1.27 Clc1ccc(CSCCCCBr)o1 Amb32789058 [0,1,0,0,0,0|2,0,0]=3 142 B13R1.27 N#CCCCSCc1ccc(Cl)o1 Amb32789123 [0,1,0,0,0,0|2,0,1]=4 143 B13R1.27 NCCCCSCc1ccc(Cl)o1 Amb32789099 [0,1,0,0,0,0|2,0,0]=3 144 B13R1.27 NOCCCSCc1ccc(Cl)o1 Amb32789242 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.27 Nc1ccn(CCCCCCO)n1 Amb32699689 [0,1,0,0,0,0|3,0,0]=4 146 B13R1.27 Nc1cnn(CCCCCCO)c1 Amb32699690 [0,1,0,0,0,0|3,0,0]=4 147 B13R1.27 OCCCCSCc1ccc(Cl)o1 Amb32788930 [0,1,0,0,0,0|2,0,0]=3 148 B13R1.27 SCCCCSCc1ccc(Cl)o1 Amb32789178 [0,1,0,0,0,0|2,0,0]=3 149 B13R1.48 CCCCC#CC(O)c1cccs1 Amb28065926 [0,1,0,0,0,0|0,1,2]=4 150 B13R1.48 CCCCCCC(=O)c1cccs1 Amb9826887 [0,1,0,0,0,0|0,1,1]=3 151 B13R1.48 CCCCCNC(C)c1ccco1 Amb6688129 [0,1,0,0,0,0|1,0,0]=2 152 B13R1.48 CCCCCNC(C)c1cccs1 Amb6688120 [0,1,0,0,0,0|1,1,0]=3 153 B13R1.48 CCCCCNC(C)c1nccs1 Amb33496623 [0,1,0,0,0,0|2,1,0]=4 154 B13R1.48 CCOCCNC(C)c1ccco1 Amb9256802 [0,1,0,0,0,0|2,0,0]=3 155 B13R1.48 CCOCCNC(C)c1cccs1 Amb9256634 [0,1,0,0,0,0|2,1,0]=4 156 B13R1.48 COCCCNC(C)c1ccco1 Amb6730233 [0,1,0,0,0,0|2,0,0]=3 157 B13R1.48 COCCCNC(C)c1cccs1 Amb6730223 [0,1,0,0,0,0|2,1,0]=4 158 B13R1.48 OCCSCCC(O)c1cccs1 Amb21984521 [0,1,0,0,0,0|2,1,0]=4 159 B13R1.119 CCCCCCCCc1cccs1 Amb10807985 [0,1,0,0,0,0|0,1,0]=2 160 B13R1.119 CCCCCCCCc1ccsc1 Amb17750261 [0,1,0,0,0,0|2,0,0]=3 161 B13R1.119 CCCCCCCCn1cccc1 Amb22731900 [0,1,0,0,0,0|2,0,0]=3 162 B13R1.119 CCCCCCCCn1ccnc1 Amb22347752 [0,1,0,0,0,0|3,0,0]=4 163 B13R1.119 CCCCCCNCc1ccco1 Amb5261472 [0,1,0,0,0,0|0,0,0]=1 164 B13R1.119 CCCCCCNCc1cccs1 Amb837875 [0,1,0,0,0,0|0,1,0]=2 165 B13R1.119 CCCCCCNCc1ccsc1 Amb5262476 [0,1,0,0,0,0|2,0,0]=3 166 B13R1.119 CCCCCCNCc1cncs1 Amb18325712 [0,1,0,0,0,0|1,1,0]=3 167 B13R1.119 CCCCCCNCc1csnn1 Amb9529219 [0,1,0,0,0,0|3,0,0]=4 168 B13R1.119 CCCCCNCCc1nccs1 Amb17315492 [0,1,0,0,0,0|1,1,0]=3 169 B13R1.119 CCCCNCCCn1ccnc1 Amb9203242 [0,1,0,0,0,0|3,0,0]=4 170 B13R1.119 CCCNCCNCc1ccco1 Amb18327940 [0,1,0,0,0,0|1,0,0]=2 171 B13R1.119 CCNCCCNCc1ccco1 Amb880553 [0,1,0,0,0,0|1,0,0]=2 172 B13R1.119 CCOCCCNCc1ccco1 Amb2592330 [0,1,0,0,0,0|1,0,0]=2 173 B13R1.119 CCOCCCNCc1cccs1 Amb838301 [0,1,0,0,0,0|1,1,0]=3 174 B13R1.119 CCOCCCNCc1ccsc1 Amb5262473 [0,1,0,0,0,0|3,0,0]=4 175 B13R1.119 CCOCCCNCc1cncs1 Amb18331551 [0,1,0,0,0,0|2,1,0]=4 176 B13R1.119 CCOCCCNCc1nccs1 Amb17337603 [0,1,0,0,0,0|2,1,0]=4 177 B13R1.119 COCCCCCNc1ccsc1 Amb33133278 [0,1,0,0,0,0|3,0,0]=4 178 B13R1.119 COCCCCNCc1ccco1 Amb18322554 [0,1,0,0,0,0|1,0,0]=2 179 B13R1.119 COCCCCNCc1cccs1 Amb18332402 [0,1,0,0,0,0|1,1,0]=3 180 B13R1.119 COCCCCNCc1ccsc1 Amb18332403 [0,1,0,0,0,0|3,0,0]=4 181 B13R1.119 ClCCCCCCCc1cccs1 Amb1085947 [0,1,0,0,0,0|0,1,0]=2 182 B13R1.119 OCCCCCCSc1ccsc1 Amb17779304 [0,1,0,0,0,0|3,0,0]=4 183 B13R1.119 OCCCCCNCc1ccco1 Amb875965 [0,1,0,0,0,0|1,0,0]=2 184 B13R1.119 OCCCCCNCc1cccs1 Amb875724 [0,1,0,0,0,0|1,1,0]=3 185 B13R1.119 OCCNCCNCc1ccco1 Amb5261476 [0,1,0,0,0,0|2,0,0]=3 186 B13R1.119 OCCNCCNCc1cccs1 Amb22531596 [0,1,0,0,0,0|2,1,0]=4 187 B13R1.119 OCCOCCNCc1ccco1 Amb6736105 [0,1,0,0,0,0|2,0,0]=3 188 B13R1.119 OCCOCCNCc1cccs1 Amb837619 [0,1,0,0,0,0|2,1,0]=4 189 B13R1.153 C=CCCC(C)NCc1ccco1 Amb33442259 [0,1,0,0,0,0|1,0,2]=4 190 B13R1.153 CC(CCCO)NCc1ccco1 Amb33363380 [0,1,0,0,0,0|2,0,0]=3 191 B13R1.153 CC(CCCO)NCc1cccs1 Amb33363352 [0,1,0,0,0,0|2,1,0]=4 192 B13R1.153 CCC#CC(C)SCc1ccco1 Amb27456054 [0,1,0,0,0,0|1,0,2]=4 193 B13R1.153 CCCOC(=O)NCc1ccco1 Amb3101959 [0,1,0,0,0,0|2,0,1]=4 194 B13R1.153 NCCCC(=O)NCc1ccco1 Amb5785142 [0,1,0,0,0,0|2,0,1]=4 195 B13R1.156 CNCCCN(C)Cc1ccco1 Amb18318440 [0,1,0,0,0,0|2,0,0]=3 196 B13R1.156 COCCNC(C)Cc1cccs1 Amb18054012 [0,1,0,0,0,0|2,1,0]=4 197 B13R1.156 C\C(=C/c1ccco1)CCCCN Amb33311257 [0,1,0,0,0,0|1,0,2]=4 198 B13R1.343 CC(=O)CCCC#Cc1ccco1 Amb27247021 [0,1,0,0,0,0|0,0,3]=4 199 B13R1.343 CC(=O)NCCNCc1ccco1 Amb6732511 [0,1,0,0,0,0|2,0,1]=4 200 B13R1.343 CC(C)NCCNCc1ccco1 Amb19056908 [0,1,0,0,0,0|2,0,0]=3 201 B13R1.343 CC(C)OCCNCc1ccco1 Amb19074362 [0,1,0,0,0,0|2,0,0]=3 202 B13R1.343 CN(C)CCCNCc1ccco1 Amb6356088 [0,1,0,0,0,0|2,0,0]=3 203 B13R1.343 CN(C)CCCNCc1cccs1 Amb2093056 [0,1,0,0,0,0|2,1,0]=4 204 B13R1.343 CN(C)CCCNCc1cccs1 Amb6574242 [0,1,0,0,0,0|2,1,0]=4 205 B13R1.343 O=C(O)CCCCCc1cccs1 Amb9306077 [0,1,0,0,0,0|1,1,1]=4 206 B13R1.343 O=C(O)CCCNCc1ccco1 Amb8455326 [0,1,0,0,0,0|2,0,1]=4 207 B13R1.404 CCCC(C)CNCc1ccco1 Amb6719044 [0,1,0,0,0,0|1,0,0]=2 208 B13R1.404 CCCC(C)CNCc1cccs1 Amb6729531 [0,1,0,0,0,0|1,1,0]=3 209 B13R1.404 CCCC(C)NCCc1cccs1 Amb6697868 [0,1,0,0,0,0|1,1,0]=3 210 B13R1.404 CCCC(C)NCCn1cccn1 Amb18796507 [0,1,0,0,0,0|3,0,0]=4 211 B13R1.404 CCOC(=O)COCc1ccco1 Amb9204470 [0,1,0,0,0,0|2,0,1]=4 212 B13R1.404 CNCC(O)COCc1ccco1 Amb9741135 [0,1,0,0,0,0|2,0,0]=3 213 B13R1.404 COCC(C)NCCc1cccs1 Amb19089623 [0,1,0,0,0,0|2,1,0]=4 214 B13R1.404 O=C(CCBr)NCCc1ccco1 Amb17324281 [0,1,0,0,0,0|2,0,1]=4 215 B13R1.536 CCC(C)CNCCc1cccs1 Amb6721306 [0,1,0,0,0,0|1,1,0]=3 216 B13R1.536 COC(=O)CCNCc1ccco1 Amb8830810 [0,1,0,0,0,0|2,0,1]=4 217 B13R1.536 COC(=O)CCOCc1ccco1 Amb9206355 [0,1,0,0,0,0|2,0,1]=4 218 B13R1.654 C#CCCCSCc1occc1C Amb32987536 [0,1,0,0,0,0|1,0,2]=4 219 B13R1.654 CCCCCCCn1ccnc1N Amb18796498 [0,1,0,0,0,0|3,0,0]=4 220 B13R1.654 CCCCCNCc1cccn1C Amb6861973 [0,1,0,0,0,0|2,0,0]=3 221 B13R1.654 CCCCCNCc1ccnn1C Amb31214159 [0,1,0,0,0,0|3,0,0]=4 222 B13R1.654 CCCCCNCc1ccnn1C Amb9528282 [0,1,0,0,0,0|3,0,0]=4 223 B13R1.654 CCCCCNCc1sccc1Br Amb33044608 [0,1,0,0,0,0|1,1,0]=3 224 B13R1.654 CCCCCNCc1sccc1C Amb838031 [0,1,0,0,0,0|1,1,0]=3 225 B13R1.654 CCCCCNCc1scnc1C Amb33496288 [0,1,0,0,0,0|2,1,0]=4 226 B13R1.654 CCNCCC#Cc1occc1Br Amb35659688 [0,1,0,0,0,0|1,0,2]=4 227 B13R1.654 CCNCCSCc1occc1C Amb32987519 [0,1,0,0,0,0|2,0,0]=3 228 B13R1.654 CCOCCNCc1cccn1C Amb18322349 [0,1,0,0,0,0|3,0,0]=4 229 B13R1.654 CCOCCNCc1sccc1Br Amb33044622 [0,1,0,0,0,0|2,1,0]=4 230 B13R1.654 CNCCCSCc1occc1C Amb32987521 [0,1,0,0,0,0|2,0,0]=3 231 B13R1.654 COCCCNCc1cccn1C Amb10116002 [0,1,0,0,0,0|3,0,0]=4 232 B13R1.654 COCCCNCc1sccc1Br Amb33044615 [0,1,0,0,0,0|2,1,0]=4 233 B13R1.654 Cc1ccoc1CSCCCC#N Amb32987661 [0,1,0,0,0,0|2,0,1]=4 234 B13R1.654 Cc1ccoc1CSCCCCBr Amb32987594 [0,1,0,0,0,0|2,0,0]=3 235 B13R1.654 Cc1ccoc1CSCCCCCl Amb32987591 [0,1,0,0,0,0|2,0,0]=3 236 B13R1.654 Cc1ccoc1CSCCCCN Amb32987520 [0,1,0,0,0,0|2,0,0]=3 237 B13R1.654 Cc1ccoc1CSCCCCO Amb32987918 [0,1,0,0,0,0|2,0,0]=3 238 B13R1.654 Cc1ccoc1CSCCCCS Amb32987796 [0,1,0,0,0,0|2,0,0]=3 239 B13R1.654 Cc1ccoc1CSCCCON Amb32987696 [0,1,0,0,0,0|3,0,0]=4 240 B13R1.654 Cc1ccsc1CNCCCCO Amb837946 [0,1,0,0,0,0|2,1,0]=4 241 B11R0.3 C=CCCCCCCCCCC Amb3940486 [0,0,1,0,0,0|1,0,2]=4 242 B11R0.3 CCCCCCCC\C=C\C=O Amb22045177 [0,0,1,0,0,0|0,0,2]=3 243 B11R0.3 CCCCCCCC\C=C\CO Amb22052644 [0,0,1,0,0,0|0,0,2]=3 244 B11R0.4 C=COC(=O)CCCCCCC Amb17672562 [0,0,1,0,0,0|1,0,0]=2 245 B11R0.4 CCCCCCCC(=O)OCC Amb6608755 [0,0,1,0,0,0|1,0,2]=4 246 B13R2.18 BrC1CCCCC1c2cccs2 Amb28365541 [0,0,0,1,0,0|1,1,0]=3 247 B13R2.18 BrC1CCCCC1c2cncs2 Amb35632693 [0,0,0,1,0,0|2,1,0]=4 248 B13R2.18 CC1=C(c2ccco2)CNCC1 Amb28366295 [0,0,0,1,0,0|1,0,2]=4 249 B13R2.18 CC1=C(c2ccco2)CNCC1 Amb28963388 [0,0,0,1,0,0|1,0,2]=4 250 B13R2.18 CC1CCCCN1c2nccs2 Amb27650146 [0,0,0,1,0,0|2,1,0]=4 251 B13R2.18 CC1CCCNC1c2cccs2 Amb33500876 [0,0,0,1,0,0|1,1,0]=3 252 B13R2.18 CC1CCCNC1c2ccsc2 Amb33500922 [0,0,0,1,0,0|3,0,0]=4 253 B13R2.18 CC1CCNCC1c2cccs2 Amb33500882 [0,0,0,1,0,0|1,1,0]=3 254 B13R2.18 CC1CCNCC1c2ccsc2 Amb33500930 [0,0,0,1,0,0|3,0,0]=4 255 B13R2.18 CC1CCNCC1c2ncno2 Amb30008056 [0,0,0,1,0,0|3,0,0]=4 256 B13R2.18 CC1CNCCC1c2ccco2 Amb27614756 [0,0,0,1,0,0|1,0,0]=2 257 B13R2.18 CC1CNCCC1c2cccs2 Amb26937050 [0,0,0,1,0,0|1,1,0]=3 258 B13R2.18 CC1CNCCC1c2ccns2 Amb28288509 [0,0,0,1,0,0|2,1,0]=4 259 B13R2.18 CC1CNCCC1c2ccsc2 Amb28136068 [0,0,0,1,0,0|3,0,0]=4 260 B13R2.18 CC1CNCCC1n2cccn2 Amb24715280 [0,0,0,1,0,0|3,0,0]=4 261 B13R2.18 CC1CNCCN1c2cccs2 Amb25173330 [0,0,0,1,0,0|2,1,0]=4 262 B13R2.18 CC1COCCC1c2cnco2 Amb35655864 [0,0,0,1,0,0|2,0,0]=3 263 B13R2.18 CC1NCCCC1c2cccs2 Amb33500879 [0,0,0,1,0,0|1,1,0]=3 264 B13R2.18 CC1NCCCC1c2ccsc2 Amb33500927 [0,0,0,1,0,0|3,0,0]=4 265 B13R2.18 CC1SCCNC1c2ccco2 Amb27475747 [0,0,0,1,0,0|2,0,0]=3 266 B13R2.18 CN1CCCCC1c2ccoc2 Amb23578303 [0,0,0,1,0,0|3,0,0]=4 267 B13R2.18 CN1CCCCC1c2ccsc2 Amb23578357 [0,0,0,1,0,0|3,0,0]=4 268 B13R2.18 CN1CCCCC1c2nccs2 Amb35694508 [0,0,0,1,0,0|2,1,0]=4 269 B13R2.18 CN1CCCCC1c2nnco2 Amb27766193 [0,0,0,1,0,0|3,0,0]=4 270 B13R2.18 CN1CCNCC1c2ccco2 Amb17062764 [0,0,0,1,0,0|2,0,0]=3 271 B13R2.18 CN1CCNCC1c2cccs2 Amb8010147 [0,0,0,1,0,0|2,1,0]=4 272 B13R2.18 CN1CCNCC1c2cnco2 Amb33415609 [0,0,0,1,0,0|3,0,0]=4 273 B13R2.18 CN1CCSCC1c2cccs2 Amb28207102 [0,0,0,1,0,0|2,1,0]=4 274 B13R2.18 ClC1CCCCC1c2ccns2 Amb27235051 [0,0,0,1,0,0|2,1,0]=4 275 B13R2.18 ClC1CCCCC1c2ccoc2 Amb27661241 [0,0,0,1,0,0|3,0,0]=4 276 B13R2.18 ClC1CCCCC1c2cncs2 Amb35632692 [0,0,0,1,0,0|2,1,0]=4 277 B13R2.18 FC1CCCCC1n2cccn2 Amb28251401 [0,0,0,1,0,0|3,0,0]=4 278 B13R2.18 NC1CCCCC1c2ccns2 Amb28142488 [0,0,0,1,0,0|2,1,0]=4 279 B13R2.18 NC1CCCCC1c2ccsn2 Amb18823539 [0,0,0,1,0,0|3,0,0]=4 280 B13R2.18 NC1CCCCC1c2cncs2 Amb35608573 [0,0,0,1,0,0|2,1,0]=4 281 B13R2.18 NC1CCCCC1c2cocn2 Amb18827623 [0,0,0,1,0,0|3,0,0]=4 282 B13R2.18 NC1CCCCC1n2cccn2 Amb5722798 [0,0,0,1,0,0|3,0,0]=4 283 B13R2.18 NC1CCCNC1c2cccs2 Amb17400957 [0,0,0,1,0,0|2,1,0]=4 284 B13R2.18 NC1CCNCC1c2cccs2 Amb33500905 [0,0,0,1,0,0|2,1,0]=4 285 B13R2.18 NC1CNCCC1c2cccs2 Amb32685317 [0,0,0,1,0,0|2,1,0]=4 286 B13R2.18 NN1CCCCC1c2cccs2 Amb24385304 [0,0,0,1,0,0|2,1,0]=4 287 B13R2.18 O=C1CCCCC1c2cccs2 Amb18805140 [0,0,0,1,0,0|1,1,1]=4 288 B13R2.18 O=C1CCNCC1c2ccco2 Amb18828387 [0,0,0,1,0,0|2,0,1]=4 289 B13R2.18 OC1CCCCC1c2ccco2 Amb22261602 [0,0,0,1,0,0|1,0,0]=2 290 B13R2.18 OC1CCCCC1c2cccs2 Amb6333471 [0,0,0,1,0,0|1,1,0]=3 291 B13R2.18 OC1CCCCC1c2ccns2 Amb25934270 [0,0,0,1,0,0|2,1,0]=4 292 B13R2.18 OC1CCCCC1c2ccoc2 Amb28078125 [0,0,0,1,0,0|3,0,0]=4 293 B13R2.18 OC1CCCCC1c2ccsc2 Amb24457150 [0,0,0,1,0,0|3,0,0]=4 294 B13R2.18 OC1CCCCC1c2ccsn2 Amb25958370 [0,0,0,1,0,0|3,0,0]=4 295 B13R2.18 OC1CCCCC1c2cncs2 Amb32950610 [0,0,0,1,0,0|2,1,0]=4 296 B13R2.18 OC1CCCCC1c2cscn2 Amb25759436 [0,0,0,1,0,0|3,0,0]=4 297 B13R2.18 OC1CCCCC1c2nccs2 Amb32945400 [0,0,0,1,0,0|2,1,0]=4 298 B13R2.18 OC1CCCCC1n2cccn2 Amb18792776 [0,0,0,1,0,0|3,0,0]=4 299 B13R2.18 OC1CCCNC1c2ccco2 Amb18827186 [0,0,0,1,0,0|2,0,0]=3 300 B13R2.18 OC1CCCNC1c2cnco2 Amb18826598 [0,0,0,1,0,0|3,0,0]=4 301 B13R2.18 O[C@@H]1CCCC[C@H]1c2ccco2 Amb28206168 [0,0,0,1,0,0|1,0,0]=2 302 B13R2.18 O[C@@H]1CCCC[C@H]1c2cccs2 Amb25349469 [0,0,0,1,0,0|1,1,0]=3 303 B13R2.18 O[C@@H]1CCCC[C@H]1c2ccns2 Amb32944543 [0,0,0,1,0,0|2,1,0]=4 304 B13R2.18 O[C@@H]1CCCC[C@H]1c2ccoc2 Amb32950249 [0,0,0,1,0,0|3,0,0]=4 305 B13R2.18 O[C@@H]1CCCC[C@H]1c2ccsc2 Amb32945696 [0,0,0,1,0,0|3,0,0]=4 306 B13R2.18 O[C@@H]1CCCC[C@H]1c2ccsn2 Amb33213188 [0,0,0,1,0,0|3,0,0]=4 307 B13R2.18 O[C@@H]1CCCC[C@H]1c2cncs2 Amb33213181 [0,0,0,1,0,0|2,1,0]=4 308 B13R2.18 O[C@@H]1CCCC[C@H]1c2cscn2 Amb33213576 [0,0,0,1,0,0|3,0,0]=4 309 B13R2.18 O[C@@H]1CCCC[C@H]1c2nccs2 Amb33213579 [0,0,0,1,0,0|2,1,0]=4 310 B13R2.18 O[C@H]1CCCC[C@@H]1c2cccs2 Amb28131045 [0,0,0,1,0,0|1,1,0]=3 311 B13R2.18 O[C@H]1CCCC[C@@H]1c2ccoc2 Amb28319990 [0,0,0,1,0,0|3,0,0]=4 312 B13R2.29 BrC1CCCC1Cc2ccns2 Amb29887268 [0,0,0,1,0,0|2,1,0]=4 313 B13R2.29 BrC1CCCC1Cc2ccsc2 Amb27425313 [0,0,0,1,0,0|3,0,0]=4 314 B13R2.29 BrC1COCC1Cc2cccs2 Amb29877868 [0,0,0,1,0,0|2,1,0]=4 315 B13R2.29 CC1CCCC1Nc2ccsc2 Amb27263278 [0,0,0,1,0,0|3,0,0]=4 316 B13R2.29 CC1CCCN1Cc2cncs2 Amb27858156 [0,0,0,1,0,0|2,1,0]=4 317 B13R2.29 CC1CCCN1Cc2cscn2 Amb28065712 [0,0,0,1,0,0|3,0,0]=4 318 B13R2.29 CC1OCCC1Cn2cccc2 Amb27243378 [0,0,0,1,0,0|3,0,0]=4 319 B13R2.29 CN1CCCC1Cn2cccn2 Amb27763914 [0,0,0,1,0,0|3,0,0]=4 320 B13R2.29 ClC1CCCC1Cc2ccns2 Amb35673623 [0,0,0,1,0,0|2,1,0]=4 321 B13R2.29 ClC1COCC1Cc2cccs2 Amb29877783 [0,0,0,1,0,0|2,1,0]=4 322 B13R2.29 NC1CCCC1Cc2ccco2 Amb663111 [0,0,0,1,0,0|1,0,0]=2 323 B13R2.29 NC1CCCC1Cc2cccs2 Amb18954326 [0,0,0,1,0,0|1,1,0]=3 324 B13R2.29 NC1CCCC1Cc2ccns2 Amb29870818 [0,0,0,1,0,0|2,1,0]=4 325 B13R2.29 NC1CCCC1Cc2ncno2 Amb35730641 [0,0,0,1,0,0|3,0,0]=4 326 B13R2.29 NC1CCCC1Sc2cccs2 Amb27668718 [0,0,0,1,0,0|2,1,0]=4 327 B13R2.29 NC1COCC1Cc2cccs2 Amb35608396 [0,0,0,1,0,0|2,1,0]=4 328 B13R2.29 N[C@@H]1CCC[C@H]1Cc2ncno2 Amb35680796 [0,0,0,1,0,0|3,0,0]=4 329 B13R2.29 O=C1CCCC1Cc2ccco2 Amb18788275 [0,0,0,1,0,0|1,0,1]=3 330 B13R2.29 O=C1CCCC1Cc2cccs2 Amb18791172 [0,0,0,1,0,0|1,1,1]=4 331 B13R2.29 O=C1CCNC1Cc2ccco2 Amb27636573 [0,0,0,1,0,0|2,0,1]=4 332 B13R2.29 OC1CCCC1Cc2ccco2 Amb18788456 [0,0,0,1,0,0|1,0,0]=2 333 B13R2.29 OC1CCCC1Cc2cccs2 Amb19074189 [0,0,0,1,0,0|1,1,0]=3 334 B13R2.29 OC1CCCC1Cc2ccns2 Amb30008531 [0,0,0,1,0,0|2,1,0]=4 335 B13R2.29 OC1CCCC1Cc2ccoc2 Amb26452856 [0,0,0,1,0,0|3,0,0]=4 336 B13R2.29 OC1CCCC1Cc2ccsc2 Amb19074190 [0,0,0,1,0,0|3,0,0]=4 337 B13R2.29 OC1CCCC1Cc2cncs2 Amb25678005 [0,0,0,1,0,0|2,1,0]=4 338 B13R2.29 OC1CCCC1Cc2cscn2 Amb27170299 [0,0,0,1,0,0|3,0,0]=4 339 B13R2.29 OC1CCCC1Cc2nccs2 Amb26323471 [0,0,0,1,0,0|2,1,0]=4 340 B13R2.29 OC1CCCC1Cn2cccc2 Amb27452841 [0,0,0,1,0,0|3,0,0]=4 341 B13R2.29 OC1CNCC1Cc2ccco2 Amb33472061 [0,0,0,1,0,0|2,0,0]=3 342 B13R2.29 OC1CNCC1Cc2cccs2 Amb33212895 [0,0,0,1,0,0|2,1,0]=4 343 B13R2.29 OC1COCC1Cc2ccco2 Amb32950528 [0,0,0,1,0,0|2,0,0]=3 344 B13R2.29 OC1COCC1Cc2cccs2 Amb32950335 [0,0,0,1,0,0|2,1,0]=4 345 B13R2.29 OC1CSCC1Cc2cccs2 Amb27251782 [0,0,0,1,0,0|2,1,0]=4 346 B13R2.29 O[C@@H]1CCC[C@H]1Cc2ccco2 Amb32944811 [0,0,0,1,0,0|1,0,0]=2 347 B13R2.29 O[C@@H]1CCC[C@H]1Cc2cccs2 Amb33213982 [0,0,0,1,0,0|1,1,0]=3 348 B13R2.29 O[C@@H]1CCC[C@H]1Cc2ccns2 Amb32945473 [0,0,0,1,0,0|2,1,0]=4 349 B13R2.29 O[C@@H]1CCC[C@H]1Cc2ccoc2 Amb32944671 [0,0,0,1,0,0|3,0,0]=4 350 B13R2.29 O[C@@H]1CCC[C@H]1Cc2ccsc2 Amb32945295 [0,0,0,1,0,0|3,0,0]=4 351 B13R2.29 O[C@@H]1CCC[C@H]1Cc2cncs2 Amb32945217 [0,0,0,1,0,0|2,1,0]=4 352 B13R2.29 O[C@@H]1CCC[C@H]1Cc2cscn2 Amb32946002 [0,0,0,1,0,0|3,0,0]=4 353 B13R2.29 O[C@@H]1CCC[C@H]1Cc2nccs2 Amb32944763 [0,0,0,1,0,0|2,1,0]=4 354 B13R2.29 O[C@@H]1CCC[C@H]1Sc2ncco2 Amb27431955 [0,0,0,1,0,0|3,0,0]=4 355 B13R2.29 O[C@@H]1CNC[C@H]1Cc2ccco2 Amb32944722 [0,0,0,1,0,0|2,0,0]=3 356 B13R2.29 O[C@@H]1CNC[C@H]1Cc2cccs2 Amb33213473 [0,0,0,1,0,0|2,1,0]=4 357 B13R2.29 O[C@@H]1COC[C@H]1Cc2ccco2 Amb33213641 [0,0,0,1,0,0|2,0,0]=3 358 B13R2.29 O[C@@H]1COC[C@H]1Cc2cccs2 Amb32944338 [0,0,0,1,0,0|2,1,0]=4 359 B13R2.29 O[C@H]1CCC[C@@H]1Sc2cccs2 Amb27822821 [0,0,0,1,0,0|2,1,0]=4 360 B13R2.29 O[C@H]1CCC[C@@H]1Sc2ncco2 Amb27219588 [0,0,0,1,0,0|3,0,0]=4 361 B13R2.47 NCC1CC1CCc2ccsc2 Amb33320911 [0,0,0,1,0,0|3,0,0]=4 362 B13R2.47 NCC1CC1CCn2cccn2 Amb32727363 [0,0,0,1,0,0|3,0,0]=4 363 B13R2.47 NC[C@@H]1C[C@H]1CCc2ccsc2 Amb33223677 [0,0,0,1,0,0|3,0,0]=4 364 B13R2.47 NC[C@@H]1C[C@H]1CCn2cccn2 Amb32727364 [0,0,0,1,0,0|3,0,0]=4 365 B13R2.61 CCC1COCC1n2cccc2 Amb35636583 [0,0,0,1,0,0|3,0,0]=4 366 B13R2.61 CCC1NCCC1c2ncno2 Amb35651113 [0,0,0,1,0,0|3,0,0]=4 367 B13R2.61 CCC1OCCC1c2cnco2 Amb35655910 [0,0,0,1,0,0|2,0,0]=3 368 B13R2.61 CNC1CCCC1c2cncs2 Amb35608575 [0,0,0,1,0,0|2,1,0]=4 369 B13R2.61 CNC1CCCC1n2cccn2 Amb18956865 [0,0,0,1,0,0|3,0,0]=4 370 B13R2.61 CNC1CCCC1n2cccn2 Amb33496223 [0,0,0,1,0,0|3,0,0]=4 371 B13R2.61 CNC1COCC1c2ccco2 Amb35635699 [0,0,0,1,0,0|2,0,0]=3 372 B13R2.61 CNC1COCC1c2cccs2 Amb35635704 [0,0,0,1,0,0|2,1,0]=4 373 B13R2.61 CN[C@@H]1CCC[C@H]1n2cccn2 Amb28990974 [0,0,0,1,0,0|3,0,0]=4 374 B13R2.61 NCC1CCCC1c2ccns2 Amb27855667 [0,0,0,1,0,0|2,1,0]=4 375 B13R2.61 NCC1CCCC1c2cncs2 Amb29878039 [0,0,0,1,0,0|2,1,0]=4 376 B13R2.61 NCC1CCCC1c2cscn2 Amb27203620 [0,0,0,1,0,0|3,0,0]=4 377 B13R2.61 NCC1CCCC1c2ncno2 Amb27770892 [0,0,0,1,0,0|3,0,0]=4 378 B13R2.61 NCC1CCNC1c2ccco2 Amb18827663 [0,0,0,1,0,0|2,0,0]=3 379 B13R2.61 NCC1CCNC1c2cccs2 Amb18823529 [0,0,0,1,0,0|2,1,0]=4 380 B13R2.61 NCC1CCNC1c2cnco2 Amb18827082 [0,0,0,1,0,0|3,0,0]=4 381 B13R2.61 O=CN1CCCC1c2ccco2 Amb23578264 [0,0,0,1,0,0|2,0,1]=4 382 B13R2.61 OCC1CCCC1c2ccsc2 Amb28138521 [0,0,0,1,0,0|3,0,0]=4 383 B13R2.61 OCC1NCCC1c2ccco2 Amb27651029 [0,0,0,1,0,0|2,0,0]=3 384 B13R2.61 OC[C@@H]1CCCN1c2cccs2 Amb27451972 [0,0,0,1,0,0|2,1,0]=4 385 B13R2.61 OC[C@H]1CNC[C@@H]1c2ccco2 Amb27473223 [0,0,0,1,0,0|2,0,0]=3 386 B13R2.62 CCC1CCN1Cc2ccno2 Amb27859112 [0,0,0,1,0,0|2,0,0]=3 387 B13R2.62 NCC1CCC1Cc2ccns2 Amb35643803 [0,0,0,1,0,0|2,1,0]=4 388 B13R2.62 NCC1CCC1Cc2ccsc2 Amb27391003 [0,0,0,1,0,0|3,0,0]=4 389 B13R2.62 NCC1CCN1Cc2ccco2 Amb29852846 [0,0,0,1,0,0|2,0,0]=3 390 B13R2.62 NCC1CCN1Cc2cccs2 Amb33252031 [0,0,0,1,0,0|2,1,0]=4 391 B13R2.62 NCC1CCN1Cc2ccno2 Amb35581667 [0,0,0,1,0,0|3,0,0]=4 392 B13R2.64 C(=C1CCCCC1)c2ccno2 Amb27251574 [0,0,0,1,0,0|1,0,2]=4 393 B13R2.64 C1=C(CC2CCCCC2)CCC1 Amb27248712 [0,0,0,1,0,0|1,0,2]=4 394 B13R2.64 C1=CCC(CC2CCCCC2)C1 Amb29888253 [0,0,0,1,0,0|1,0,2]=4 395 B13R2.64 c1cc(CC2CCCCN2)cs1 Amb18967409 [0,0,0,1,0,0|3,0,0]=4 396 B13R2.64 c1cc(CC2CCCCN2)sn1 Amb35733224 [0,0,0,1,0,0|2,1,0]=4 397 B13R2.64 c1cc(CC2CCCNC2)co1 Amb27205531 [0,0,0,1,0,0|3,0,0]=4 398 B13R2.64 c1cc(CC2CCCNC2)cs1 Amb26840978 [0,0,0,1,0,0|3,0,0]=4 399 B13R2.64 c1cc(CC2CCCNC2)no1 Amb33456620 [0,0,0,1,0,0|3,0,0]=4 400 B13R2.64 c1cc(CC2CCCNC2)sn1 Amb35649860 [0,0,0,1,0,0|2,1,0]=4 401 B13R2.64 c1cc(CC2CCNCC2)co1 Amb32954703 [0,0,0,1,0,0|3,0,0]=4 402 B13R2.64 c1cc(CC2CCNCC2)cs1 Amb27411945 [0,0,0,1,0,0|3,0,0]=4 403 B13R2.64 c1cc(CC2CCNCC2)no1 Amb33456619 [0,0,0,1,0,0|3,0,0]=4 404 B13R2.64 c1cc(CC2CCNCC2)on1 Amb18827580 [0,0,0,1,0,0|2,0,0]=3 405 B13R2.64 c1cc(CN2CCCCC2)sn1 Amb35733216 [0,0,0,1,0,0|2,1,0]=4 406 B13R2.64 c1cc(CN2CCNCC2)on1 Amb30077733 [0,0,0,1,0,0|3,0,0]=4 407 B13R2.64 c1cc(CN2CCNCC2)on1 Amb6745554 [0,0,0,1,0,0|3,0,0]=4 408 B13R2.64 c1cc(CN2CCSCC2)on1 Amb27203474 [0,0,0,1,0,0|3,0,0]=4 409 B13R2.64 c1cc(NC2CCCCC2)cs1 Amb25304409 [0,0,0,1,0,0|3,0,0]=4 410 B13R2.64 c1cc(NC2CCCCC2)ns1 Amb27409107 [0,0,0,1,0,0|3,0,0]=4 411 B13R2.64 c1ccn(CC2CCCCO2)c1 Amb18792677 [0,0,0,1,0,0|3,0,0]=4 412 B13R2.64 c1ccn(CC2CCCNC2)c1 Amb5744330 [0,0,0,1,0,0|3,0,0]=4 413 B13R2.64 c1ccn(CC2CCNCC2)c1 Amb33539741 [0,0,0,1,0,0|3,0,0]=4 414 B13R2.64 c1cnn(CC2CCCCC2)c1 Amb27168849 [0,0,0,1,0,0|2,0,0]=3 415 B13R2.64 c1cnn(CC2CCCCC2)c1 Amb30584895 [0,0,0,1,0,0|2,0,0]=3 416 B13R2.64 c1cnn(CC2CCCCN2)c1 Amb18283504 [0,0,0,1,0,0|3,0,0]=4 417 B13R2.64 c1cnn(CC2CCCCO2)c1 Amb27474069 [0,0,0,1,0,0|3,0,0]=4 418 B13R2.64 c1cnn(CC2CCCNC2)c1 Amb18956095 [0,0,0,1,0,0|3,0,0]=4 419 B13R2.64 c1cnn(CC2CCNCC2)c1 Amb21959761 [0,0,0,1,0,0|3,0,0]=4 420 B13R2.64 c1cnn(CC2CCNCC2)c1 Amb8010113 [0,0,0,1,0,0|3,0,0]=4 421 B13R2.64 c1cnn(C[C@H]2CCCNC2)c1 Amb28204225 [0,0,0,1,0,0|3,0,0]=4 422 B13R2.64 c1coc(CC2CCCNC2)c1 Amb26472653 [0,0,0,1,0,0|1,0,0]=2 423 B13R2.64 c1coc(CC2CCNCC2)c1 Amb33456571 [0,0,0,1,0,0|1,0,0]=2 424 B13R2.64 c1coc(CC2CNCCN2)c1 Amb27595607 [0,0,0,1,0,0|2,0,0]=3 425 B13R2.64 c1coc(CC2CNCCO2)c1 Amb27953104 [0,0,0,1,0,0|2,0,0]=3 426 B13R2.64 c1coc(CC2COCCN2)c1 Amb24497476 [0,0,0,1,0,0|2,0,0]=3 427 B13R2.64 c1coc(CN2CCNCC2)c1 Amb17622229 [0,0,0,1,0,0|2,0,0]=3 428 B13R2.64 c1coc(CN2CCNCC2)c1 Amb6335600 [0,0,0,1,0,0|2,0,0]=3 429 B13R2.64 c1coc(CN2CCNCC2)n1 Amb18862725 [0,0,0,1,0,0|3,0,0]=4 430 B13R2.64 c1coc(CN2CCNCC2)n1 Amb32664876 [0,0,0,1,0,0|3,0,0]=4 431 B13R2.64 c1coc(CN2CCOCC2)c1 Amb9677688 [0,0,0,1,0,0|2,0,0]=3 432 B13R2.64 c1coc(C[C@H]2CCCNC2)c1 Amb27444852 [0,0,0,1,0,0|1,0,0]=2 433 B13R2.64 c1coc(NC2CCCCC2)n1 Amb27438428 [0,0,0,1,0,0|2,0,0]=3 434 B13R2.64 c1coc(NC2CCCNC2)n1 Amb27977711 [0,0,0,1,0,0|3,0,0]=4 435 B13R2.64 c1coc(OC2CCCNC2)c1 Amb33360913 [0,0,0,1,0,0|2,0,0]=3 436 B13R2.64 c1coc(OC2CCNCC2)c1 Amb33360915 [0,0,0,1,0,0|2,0,0]=3 437 B13R2.64 c1coc(SC2CCOCC2)n1 Amb27653912 [0,0,0,1,0,0|3,0,0]=4 438 B13R2.64 c1csc(CC2CCCCC2)c1 Amb27491596 [0,0,0,1,0,0|0,1,0]=2 439 B13R2.64 c1csc(CC2CCCCN2)c1 Amb18528444 [0,0,0,1,0,0|1,1,0]=3 440 B13R2.64 c1csc(CC2CCCCN2)n1 Amb27484956 [0,0,0,1,0,0|2,1,0]=4 441 B13R2.64 c1csc(CC2CCCNC2)c1 Amb5739778 [0,0,0,1,0,0|1,1,0]=3 442 B13R2.64 c1csc(CC2CCCNC2)n1 Amb5740976 [0,0,0,1,0,0|2,1,0]=4 443 B13R2.64 c1csc(CC2CCCOC2)n1 Amb32673990 [0,0,0,1,0,0|2,1,0]=4 444 B13R2.64 c1csc(CC2CCNCC2)c1 Amb17991262 [0,0,0,1,0,0|1,1,0]=3 445 B13R2.64 c1csc(CC2CCNCC2)c1 Amb5739788 [0,0,0,1,0,0|1,1,0]=3 446 B13R2.64 c1csc(CC2CCNCC2)n1 Amb5740956 [0,0,0,1,0,0|2,1,0]=4 447 B13R2.64 c1csc(CC2CCOCC2)n1 Amb32673989 [0,0,0,1,0,0|2,1,0]=4 448 B13R2.64 c1csc(CC2CNCCN2)c1 Amb25148546 [0,0,0,1,0,0|2,1,0]=4 449 B13R2.64 c1csc(CC2CNCCO2)c1 Amb25699927 [0,0,0,1,0,0|2,1,0]=4 450 B13R2.64 c1csc(CN2CCCCC2)c1 Amb4418542 [0,0,0,1,0,0|1,1,0]=3 451 B13R2.64 c1csc(CN2CCCCC2)n1 Amb24645128 [0,0,0,1,0,0|2,1,0]=4 452 B13R2.64 c1csc(CN2CCCCN2)c1 Amb27969466 [0,0,0,1,0,0|2,1,0]=4 453 B13R2.64 c1csc(CN2CCNCC2)c1 Amb17622282 [0,0,0,1,0,0|2,1,0]=4 454 B13R2.64 c1csc(CN2CCNCC2)c1 Amb6335645 [0,0,0,1,0,0|2,1,0]=4 455 B13R2.64 c1csc(CN2CCOCC2)c1 Amb4401503 [0,0,0,1,0,0|2,1,0]=4 456 B13R2.64 c1csc(CN2CCSCC2)c1 Amb8509839 [0,0,0,1,0,0|2,1,0]=4 457 B13R2.64 c1csc(C[C@@H]2CCCNC2)c1 Amb27777339 [0,0,0,1,0,0|1,1,0]=3 458 B13R2.64 c1csc(C[C@@H]2CNCCN2)c1 Amb25929781 [0,0,0,1,0,0|2,1,0]=4 459 B13R2.64 c1csc(C[C@H]2CNCCN2)c1 Amb26366384 [0,0,0,1,0,0|2,1,0]=4 460 B13R2.64 c1csc(NC2CCCCC2)c1 Amb18141452 [0,0,0,1,0,0|1,1,0]=3 461 B13R2.64 c1csc(NC2CCCCC2)n1 Amb1103900 [0,0,0,1,0,0|2,1,0]=4 462 B13R2.64 c1csc(NC2CCCNC2)c1 Amb27198502 [0,0,0,1,0,0|2,1,0]=4 463 B13R2.64 c1csc(NC2CCNCC2)c1 Amb28280861 [0,0,0,1,0,0|2,1,0]=4 464 B13R2.64 c1csc(OC2CCCNC2)c1 Amb33360623 [0,0,0,1,0,0|2,1,0]=4 465 B13R2.64 c1csc(OC2CCNCC2)c1 Amb33360625 [0,0,0,1,0,0|2,1,0]=4 466 B13R2.64 c1csc(SC2CCCCC2)c1 Amb27753596 [0,0,0,1,0,0|1,1,0]=3 467 B13R2.64 c1csc(SC2CCCOC2)c1 Amb28435995 [0,0,0,1,0,0|2,1,0]=4 468 B13R2.64 c1csc(SC2CCNCC2)c1 Amb18283520 [0,0,0,1,0,0|2,1,0]=4 469 B13R2.64 c1nc(CC2CCCNC2)cs1 Amb24593124 [0,0,0,1,0,0|3,0,0]=4 470 B13R2.64 c1nc(CC2CCNCC2)cs1 Amb33319112 [0,0,0,1,0,0|3,0,0]=4 471 B13R2.64 c1ncc(CC2CCCCC2)o1 Amb35652261 [0,0,0,1,0,0|1,0,0]=2 472 B13R2.64 c1ncc(CC2CCCCO2)o1 Amb35653985 [0,0,0,1,0,0|2,0,0]=3 473 B13R2.64 c1ncc(CC2CCCNC2)o1 Amb33415237 [0,0,0,1,0,0|2,0,0]=3 474 B13R2.64 c1ncc(CC2CCCNC2)s1 Amb26048282 [0,0,0,1,0,0|2,1,0]=4 475 B13R2.64 c1ncc(CC2CCNCC2)o1 Amb33226418 [0,0,0,1,0,0|2,0,0]=3 476 B13R2.64 c1ncc(CC2CCNCC2)s1 Amb33456612 [0,0,0,1,0,0|2,1,0]=4 477 B13R2.64 c1ncc(CN2CCCCC2)s1 Amb22750495 [0,0,0,1,0,0|2,1,0]=4 478 B13R2.64 c1ncc(CN2CCNCC2)o1 Amb18286207 [0,0,0,1,0,0|3,0,0]=4 479 B13R2.64 c1ncc(OC2CCCNC2)o1 Amb33319559 [0,0,0,1,0,0|3,0,0]=4 480 B13R2.64 c1ncc(OC2CCNCC2)o1 Amb33319563 [0,0,0,1,0,0|3,0,0]=4 481 B13R2.64 c1noc(CC2CCCCN2)n1 Amb35673728 [0,0,0,1,0,0|3,0,0]=4 482 B13R2.68 CNCC1CCC1c2cccs2 Amb27628531 [0,0,0,1,0,0|1,1,0]=3 483 B13R2.68 CNCC1CCC1c2ccns2 Amb27246914 [0,0,0,1,0,0|2,1,0]=4 484 B13R2.68 CNCC1CCC1c2cncs2 Amb29878038 [0,0,0,1,0,0|2,1,0]=4 485 B13R2.139 CCCC1CC1Nc2nccs2 Amb27870433 [0,0,0,1,0,0|2,1,0]=4 486 B13R2.158 CC1CCC1NCc2ccns2 Amb29856460 [0,0,0,1,0,0|2,1,0]=4 487 B13R2.158 CC1CCC1NCc2cscn2 Amb27775587 [0,0,0,1,0,0|3,0,0]=4 488 B13R2.158 NC1CCC1CCc2cccs2 Amb28366676 [0,0,0,1,0,0|1,1,0]=3 489 B13R2.158 OC1CCC1CCc2cccs2 Amb33213438 [0,0,0,1,0,0|1,1,0]=3 490 B13R2.158 OC1CCC1CCc2ccns2 Amb33213754 [0,0,0,1,0,0|2,1,0]=4 491 B13R2.158 OC1CCC1CCc2ccsc2 Amb32951073 [0,0,0,1,0,0|3,0,0]=4 492 B13R2.158 O[C@@H]1CC[C@H]1NCc2ccco2 Amb27645527 [0,0,0,1,0,0|2,0,0]=3 493 B13R2.158 O[C@@H]1CC[C@H]1NCc2cccs2 Amb27658120 [0,0,0,1,0,0|2,1,0]=4 494 B13R2.183 C(#CC1CCNC1)c2ccco2 Amb29863513 [0,0,0,1,0,0|1,0,2]=4 495 B13R2.183 C1=CC(CCC2CCCC2)NC1 Amb28078137 [0,0,0,1,0,0|1,0,2]=4 496 B13R2.183 C1=CC(NCc2ccco2)CC1 Amb30006707 [0,0,0,1,0,0|1,0,2]=4 497 B13R2.183 C1=CCC(CCC2CCCC2)C1 Amb29888254 [0,0,0,1,0,0|1,0,2]=4 498 B13R2.183 C1=CCC(CCc2cccs2)C1 Amb29888496 [0,0,0,1,0,0|0,1,2]=4 499 B13R2.183 C1=CCC(NCc2ccco2)C1 Amb27249180 [0,0,0,1,0,0|1,0,2]=4 500 B13R2.183 c1cc(CCC2CCCN2)cs1 Amb25336035 [0,0,0,1,0,0|3,0,0]=4 501 B13R2.183 c1cc(CCC2CCNC2)cs1 Amb25865151 [0,0,0,1,0,0|3,0,0]=4 502 B13R2.183 c1cc(CNC2CCCC2)cs1 Amb1925720 [0,0,0,1,0,0|3,0,0]=4 503 B13R2.183 c1cc(CNC2CCCC2)cs1 Amb6868333 [0,0,0,1,0,0|3,0,0]=4 504 B13R2.183 c1cc(CNC2CCCC2)sn1 Amb29856454 [0,0,0,1,0,0|2,1,0]=4 505 B13R2.183 c1cc(CSC2CCCC2)on1 Amb28454163 [0,0,0,1,0,0|2,0,0]=3 506 B13R2.183 c1ccn(CCC2CCCC2)c1 Amb18792515 [0,0,0,1,0,0|2,0,0]=3 507 B13R2.183 c1ccn(COC2CCCC2)c1 Amb27666732 [0,0,0,1,0,0|3,0,0]=4 508 B13R2.183 c1ccn(NCC2CCCC2)c1 Amb27480152 [0,0,0,1,0,0|3,0,0]=4 509 B13R2.183 c1cn(CCC2CCCC2)cn1 Amb27479134 [0,0,0,1,0,0|3,0,0]=4 510 B13R2.183 c1cnn(CCC2CCCC2)c1 Amb28185413 [0,0,0,1,0,0|2,0,0]=3 511 B13R2.183 c1cnn(CCC2CCCN2)c1 Amb32727021 [0,0,0,1,0,0|3,0,0]=4 512 B13R2.183 c1cnn(CCC2CCCO2)c1 Amb27388355 [0,0,0,1,0,0|3,0,0]=4 513 B13R2.183 c1cnn(CCC2CCNC2)c1 Amb25917591 [0,0,0,1,0,0|3,0,0]=4 514 B13R2.183 c1cnn(CCC2CCOC2)c1 Amb28345912 [0,0,0,1,0,0|3,0,0]=4 515 B13R2.183 c1cnn(CCN2CCCC2)c1 Amb27440821 [0,0,0,1,0,0|3,0,0]=4 516 B13R2.183 c1coc(CCC2=NCCN2)c1 Amb18563620 [0,0,0,1,0,0|2,0,1]=4 517 B13R2.183 c1coc(CCC2=NCCS2)c1 Amb27791156 [0,0,0,1,0,0|2,0,1]=4 518 B13R2.183 c1coc(CCC2CCCN2)c1 Amb6744554 [0,0,0,1,0,0|1,0,0]=2 519 B13R2.183 c1coc(CCC2CCCN2)n1 Amb27209070 [0,0,0,1,0,0|2,0,0]=3 520 B13R2.183 c1coc(CNC2CCCC2)c1 Amb6335657 [0,0,0,1,0,0|1,0,0]=2 521 B13R2.183 c1coc(CN[C@H]2CCNC2)c1 Amb29892630 [0,0,0,1,0,0|2,0,0]=3 522 B13R2.183 c1coc(CSC2CCCC2)c1 Amb28193657 [0,0,0,1,0,0|1,0,0]=2 523 B13R2.183 c1coc(CSC2CCCO2)c1 Amb28193658 [0,0,0,1,0,0|2,0,0]=3 524 B13R2.183 c1coc(CSC2CCNC2)c1 Amb18988570 [0,0,0,1,0,0|2,0,0]=3 525 B13R2.183 c1coc(NCC2CCCC2)n1 Amb26989104 [0,0,0,1,0,0|2,0,0]=3 526 B13R2.183 c1coc(NCC2CCCO2)c1 Amb24473140 [0,0,0,1,0,0|2,0,0]=3 527 B13R2.183 c1coc(SCC2CCCO2)n1 Amb27749111 [0,0,0,1,0,0|3,0,0]=4 528 B13R2.183 c1csc(CCC2CCCN2)c1 Amb17400893 [0,0,0,1,0,0|1,1,0]=3 529 B13R2.183 c1csc(CCC2NCCS2)c1 Amb27389456 [0,0,0,1,0,0|2,1,0]=4 530 B13R2.183 c1csc(CNC2CCCC2)c1 Amb15740763 [0,0,0,1,0,0|1,1,0]=3 531 B13R2.183 c1csc(CNC2CCCC2)c1 Amb6356054 [0,0,0,1,0,0|1,1,0]=3 532 B13R2.183 c1csc(CNC2CCCC2)n1 Amb17335579 [0,0,0,1,0,0|2,1,0]=4 533 B13R2.183 c1csc(CNC2CCSC2)c1 Amb6729388 [0,0,0,1,0,0|2,1,0]=4 534 B13R2.183 c1csc(CN[C@H]2CCNC2)c1 Amb35660750 [0,0,0,1,0,0|2,1,0]=4 535 B13R2.183 c1csc(C[NH2+]C2CCCC2)c1 Amb4260213 [0,0,0,1,0,0|1,1,0]=3 536 B13R2.183 c1csc(SC[C@@H]2CCCN2)c1 Amb27229622 [0,0,0,1,0,0|2,1,0]=4 537 B13R2.183 c1ncc(CCC2CCCC2)o1 Amb30019106 [0,0,0,1,0,0|1,0,0]=2 538 B13R2.183 c1ncc(CCC2CCCO2)o1 Amb35652460 [0,0,0,1,0,0|2,0,0]=3 539 B13R2.183 c1ncc(CCC2CCOC2)o1 Amb35653307 [0,0,0,1,0,0|2,0,0]=3 540 B13R2.183 c1ncc(CNC2CCCC2)s1 Amb18300817 [0,0,0,1,0,0|2,1,0]=4 541 B13R2.183 c1ncc(CNC2CCNC2)o1 Amb35599649 [0,0,0,1,0,0|3,0,0]=4 542 B13R2.183 c1ncc(CNC2CCOC2)o1 Amb28244144 [0,0,0,1,0,0|3,0,0]=4 543 B13R2.183 c1ncc(CN[C@H]2CCNC2)o1 Amb29892638 [0,0,0,1,0,0|3,0,0]=4 544 B13R2.183 c1noc(CCC2CCNC2)n1 Amb27258493 [0,0,0,1,0,0|3,0,0]=4 545 B13R2.292 CCCC1CNCc2ccsc21 Amb25045450 [0,0,0,1,0,0|3,0,0]=4 546 B13R2.292 CCCC1CNCc2sccc21 Amb24455715 [0,0,0,1,0,0|1,1,0]=3 547 B13R2.292 CCCC1NCCc2ccoc21 Amb32647841 [0,0,0,1,0,0|3,0,0]=4 548 B13R2.292 CCCC1NCCc2ccsc21 Amb25699946 [0,0,0,1,0,0|3,0,0]=4 549 B13R2.292 CCCC1NCCc2occc21 Amb27239837 [0,0,0,1,0,0|1,0,0]=2 550 B13R2.292 CCCC1NCCc2sccc21 Amb17233858 [0,0,0,1,0,0|1,1,0]=3 551 B13R2.292 CCCC1NCCn2cccc21 Amb2721868 [0,0,0,1,0,0|3,0,0]=4 552 B13R2.292 CCC[C@@H]1NCCn2cccc21 Amb27403464 [0,0,0,1,0,0|3,0,0]=4 553 B13R2.292 CCC[C@H]1NCCn2cccc21 Amb27635796 [0,0,0,1,0,0|3,0,0]=4 554 B13R2.292 CCNC1CCCc2ncsc21 Amb18284468 [0,0,0,1,0,0|3,0,0]=4 555 B13R2.292 CCNC1CCCc2oncc21 Amb27667398 [0,0,0,1,0,0|2,0,0]=3 556 B13R2.292 CCNC1CCCc2sccc21 Amb18965073 [0,0,0,1,0,0|1,1,0]=3 557 B13R2.292 CCOC1=CCCc2occc21 Amb28139803 [0,0,0,1,0,0|1,0,2]=4 558 B13R2.292 CCOC1CCCc2occc21 Amb27433855 [0,0,0,1,0,0|1,0,0]=2 559 B13R2.292 CNCC1CCCc2ccoc21 Amb27638495 [0,0,0,1,0,0|3,0,0]=4 560 B13R2.292 CNCC1CCCc2ncoc21 Amb27669972 [0,0,0,1,0,0|3,0,0]=4 561 B13R2.292 CNCC1CCCc2ocnc21 Amb27625167 [0,0,0,1,0,0|2,0,0]=3 562 B13R2.292 CNCC1OCCc2sccc21 Amb25773556 [0,0,0,1,0,0|2,1,0]=4 563 B13R2.292 CNC[C@@H]1CCCc2sccc21 Amb27777316 [0,0,0,1,0,0|1,1,0]=3 564 B13R2.292 COCC1NCCc2occc21 Amb29852940 [0,0,0,1,0,0|2,0,0]=3 565 B13R2.292 COCC1NCCc2sccc21 Amb23512800 [0,0,0,1,0,0|2,1,0]=4 566 B13R2.292 CONC1CCCc2sccc21 Amb27228621 [0,0,0,1,0,0|2,1,0]=4 567 B13R2.292 ClCCC1CCCc2sccc21 Amb27263860 [0,0,0,1,0,0|1,1,0]=3 568 B13R2.292 NCCC1CCCc2cncn21 Amb18828066 [0,0,0,1,0,0|3,0,0]=4 569 B13R2.292 NCCC1CCCc2nccn21 Amb28436492 [0,0,0,1,0,0|3,0,0]=4 570 B13R2.292 NCCC1CCCc2ncoc21 Amb27441528 [0,0,0,1,0,0|3,0,0]=4 571 B13R2.292 NCCC1CCCc2occc21 Amb18828239 [0,0,0,1,0,0|1,0,0]=2 572 B13R2.292 NCCC1CCCc2oncc21 Amb27789060 [0,0,0,1,0,0|2,0,0]=3 573 B13R2.292 NCCC1CCCc2sccc21 Amb18823919 [0,0,0,1,0,0|1,1,0]=3 574 B13R2.292 NCCC1CCCn2nccc21 Amb27966180 [0,0,0,1,0,0|3,0,0]=4 575 B13R2.292 NCCC1NCCc2occc21 Amb18827541 [0,0,0,1,0,0|2,0,0]=3 576 B13R2.292 OCCC1CCCc2occc21 Amb27493622 [0,0,0,1,0,0|1,0,0]=2 577 B13R2.292 OCCC1NCCc2sccc21 Amb32946516 [0,0,0,1,0,0|2,1,0]=4 578 B13R2.292 OCCC1OCCc2sccc21 Amb28280528 [0,0,0,1,0,0|2,1,0]=4 579 B13R2.292 OC\C=C1/CCCc2occc21 Amb27426748 [0,0,0,1,0,0|1,0,2]=4 580 B13R2.292 [N-]=[N+]=N[C@@H]1CCCc2occc21 Amb27593727 [0,0,0,1,0,0|3,0,0]=4 581 B13R2.468 CCNCC1CCc2scnc21 Amb27389902 [0,0,0,1,0,0|2,1,0]=4 582 B13R2.628 CCC1NCCCc2sccc21 Amb27150089 [0,0,0,1,0,0|1,1,0]=3 583 B13R2.628 CCN1CCCCc2sccc21 Amb28281657 [0,0,0,1,0,0|1,1,0]=3 584 B13R2.628 NCC1OCCCc2sccc21 Amb27394661 [0,0,0,1,0,0|2,1,0]=4 585 B13R2.628 OCC1CCCCn2cccc21 Amb27490923 [0,0,0,1,0,0|3,0,0]=4 586 B13R2.677 c1cc(C2CCCNCC2)co1 Amb28047846 [0,0,0,1,0,0|3,0,0]=4 587 B13R2.677 c1cc(C2CCCNCC2)cs1 Amb27242415 [0,0,0,1,0,0|3,0,0]=4 588 B13R2.677 c1cc(C2CCCNCC2)on1 Amb18827618 [0,0,0,1,0,0|2,0,0]=3 589 B13R2.677 c1ccn(C2CCCSCC2)c1 Amb35722196 [0,0,0,1,0,0|3,0,0]=4 590 B13R2.677 c1cn(C2CCCCCC2)cn1 Amb22752796 [0,0,0,1,0,0|3,0,0]=4 591 B13R2.677 c1cn(C2CCCCCC2)nn1 Amb35607529 [0,0,0,1,0,0|3,0,0]=4 592 B13R2.677 c1cnn(C2CCCCCC2)c1 Amb33537777 [0,0,0,1,0,0|2,0,0]=3 593 B13R2.677 c1coc(C2CCCCCN2)c1 Amb17622151 [0,0,0,1,0,0|1,0,0]=2 594 B13R2.677 c1coc(C2CCCCCN2)c1 Amb2234791 [0,0,0,1,0,0|1,0,0]=2 595 B13R2.677 c1coc(C2CCNCCS2)c1 Amb22642300 [0,0,0,1,0,0|2,0,0]=3 596 B13R2.677 c1coc(C2CNCCCO2)c1 Amb9358527 [0,0,0,1,0,0|2,0,0]=3 597 B13R2.677 c1csc(C2CCCCCN2)c1 Amb2237242 [0,0,0,1,0,0|1,1,0]=3 598 B13R2.677 c1csc(C2CCCNCC2)c1 Amb18564183 [0,0,0,1,0,0|1,1,0]=3 599 B13R2.677 c1csc(C2CCCSCC2)n1 Amb35615757 [0,0,0,1,0,0|2,1,0]=4 600 B13R2.677 c1csc(C2CCNCCS2)c1 Amb31203004 [0,0,0,1,0,0|2,1,0]=4 601 B13R2.677 c1csc(N2CCCNCC2)c1 Amb18945984 [0,0,0,1,0,0|2,1,0]=4 602 B13R2.677 c1nc(C2CCCCCN2)cs1 Amb27236583 [0,0,0,1,0,0|3,0,0]=4 603 B13R2.677 c1ncc(C2CCCCCC2)o1 Amb35647949 [0,0,0,1,0,0|1,0,0]=2 604 B13R2.677 c1nnc(C2CCCCCN2)o1 Amb27804341 [0,0,0,1,0,0|3,0,0]=4 605 B13R2.677 c1nnc(C2CCCNCC2)o1 Amb27635569 [0,0,0,1,0,0|3,0,0]=4 606 B13R2.677 c1nnc(N2CCCCCC2)o1 Amb27980308 [0,0,0,1,0,0|3,0,0]=4 607 B13R2.2380 c1csc(CCNCC2CC2)c1 Amb9423087 [0,0,0,1,0,0|1,1,0]=3 608 B13R2.2381 c1cc(CCCC2CNC2)cs1 Amb33321996 [0,0,0,1,0,0|3,0,0]=4 609 B13R2.2381 c1cc(NCCC2CCC2)cs1 Amb27882935 [0,0,0,1,0,0|3,0,0]=4 610 B13R2.2381 c1cnn(CCCC2CNC2)c1 Amb32727115 [0,0,0,1,0,0|3,0,0]=4 611 B13R2.2381 c1csc(CCNC2CCC2)c1 Amb18809642 [0,0,0,1,0,0|1,1,0]=3 612 B13R2.2381 c1csc(CCOC2CNC2)c1 Amb18314577 [0,0,0,1,0,0|2,1,0]=4 613 B13R2.2381 c1csc(NCCC2CCC2)n1 Amb27781385 [0,0,0,1,0,0|2,1,0]=4 614 B13R2.3047 OC1CCCCCc2occc21 Amb27175736 [0,0,0,1,0,0|1,0,0]=2 615 B13R1.28 BrCCCCCCc1ccccc1 Amb2685411 [0,0,0,0,0,1|2,0,0]=3 616 B13R1.28 BrCCCCCOc1ccccc1 Amb22730694 [0,0,0,0,0,1|3,0,0]=4 617 B13R1.28 BrCCCCOCc1ccccc1 Amb4006164 [0,0,0,0,0,1|3,0,0]=4 618 B13R1.28 CCCCCC#Cc1ccccc1 Amb2721606 [0,0,0,0,0,1|1,0,2]=4 619 B13R1.28 CCCCCC#Cc1cccnc1 Amb27830198 [0,0,0,0,0,1|1,0,2]=4 620 B13R1.28 CCCCCCCN1CC=CCC1 Amb32428387 [0,0,0,0,0,1|2,0,1]=4 621 B13R1.28 CCCCCCCc1ccccc1 Amb8513456 [0,0,0,0,0,1|1,0,0]=2 622 B13R1.28 CCCCCCCc1ccccn1 Amb22235249 [0,0,0,0,0,1|1,0,0]=2 623 B13R1.28 CCCCCCCc1cccnc1 Amb22235253 [0,0,0,0,0,1|1,0,0]=2 624 B13R1.28 CCCCCCCc1ccncc1 Amb22235258 [0,0,0,0,0,1|1,0,0]=2 625 B13R1.28 CCCCCCNc1ccccc1 Amb597405 [0,0,0,0,0,1|2,0,0]=3 626 B13R1.28 CCCCCCSc1ccccn1 Amb24101307 [0,0,0,0,0,1|2,0,0]=3 627 B13R1.28 CCCCCCSc1cccnc1 Amb24085373 [0,0,0,0,0,1|2,0,0]=3 628 B13R1.28 CCCCCCSc1ccncc1 Amb24102986 [0,0,0,0,0,1|2,0,0]=3 629 B13R1.28 CCCCCNCc1ccccc1 Amb838091 [0,0,0,0,0,1|2,0,0]=3 630 B13R1.28 CCCCCNCc1ccccn1 Amb5262448 [0,0,0,0,0,1|2,0,0]=3 631 B13R1.28 CCCCCNCc1cccnc1 Amb6688087 [0,0,0,0,0,1|2,0,0]=3 632 B13R1.28 CCCCCNCc1ccncc1 Amb838356 [0,0,0,0,0,1|2,0,0]=3 633 B13R1.28 CCCCCNCc1cncnc1 Amb18804943 [0,0,0,0,0,1|3,0,0]=4 634 B13R1.28 CCCCC\C=C\c1cccnc1 Amb2613049 [0,0,0,0,0,1|1,0,2]=4 635 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [0,0,0,0,0,1|2,0,0]=3 636 B13R1.28 CCCCNCCc1ccccc1 Amb875620 [0,0,0,0,0,1|2,0,0]=3 637 B13R1.28 CCCCNOCc1ccccc1 Amb27433781 [0,0,0,0,0,1|3,0,0]=4 638 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [0,0,0,0,0,1|2,0,0]=3 639 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [0,0,0,0,0,1|2,0,0]=3 640 B13R1.28 CCCNCCCc1ccccc1 Amb6714447 [0,0,0,0,0,1|2,0,0]=3 641 B13R1.28 CCCNCCSc1ccccn1 Amb18318129 [0,0,0,0,0,1|3,0,0]=4 642 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [0,0,0,0,0,1|2,0,0]=3 643 B13R1.28 CCCSCCNc1ccccc1 Amb17307515 [0,0,0,0,0,1|3,0,0]=4 644 B13R1.28 CCNCCCCc1ccccc1 Amb8853688 [0,0,0,0,0,1|2,0,0]=3 645 B13R1.28 CCNCCCOc1ccccc1 Amb7760967 [0,0,0,0,0,1|3,0,0]=4 646 B13R1.28 CCNCCNCc1ccccn1 Amb18184616 [0,0,0,0,0,1|3,0,0]=4 647 B13R1.28 CCNCCNCc1cccnc1 Amb18184617 [0,0,0,0,0,1|3,0,0]=4 648 B13R1.28 CCNCCNCc1ccncc1 Amb20414355 [0,0,0,0,0,1|3,0,0]=4 649 B13R1.28 CCOCCCNc1ccncc1 Amb6638685 [0,0,0,0,0,1|3,0,0]=4 650 B13R1.28 CCOCCNCc1ccccc1 Amb9241003 [0,0,0,0,0,1|3,0,0]=4 651 B13R1.28 CCOCCNCc1ccccn1 Amb9241011 [0,0,0,0,0,1|3,0,0]=4 652 B13R1.28 CCOCCNCc1cccnc1 Amb9241013 [0,0,0,0,0,1|3,0,0]=4 653 B13R1.28 CCOCCNCc1ccncc1 Amb9241012 [0,0,0,0,0,1|3,0,0]=4 654 B13R1.28 CCSCCCNc1ccccn1 Amb32670759 [0,0,0,0,0,1|3,0,0]=4 655 B13R1.28 CNCCCCOc1ccccc1 Amb17309029 [0,0,0,0,0,1|3,0,0]=4 656 B13R1.28 CNCCCNCc1ccccn1 Amb5262459 [0,0,0,0,0,1|3,0,0]=4 657 B13R1.28 CNCCCNCc1ccncc1 Amb22531665 [0,0,0,0,0,1|3,0,0]=4 658 B13R1.28 CNCCCOCc1ccccc1 Amb18186412 [0,0,0,0,0,1|3,0,0]=4 659 B13R1.28 COCCCNCc1ccccc1 Amb2172436 [0,0,0,0,0,1|3,0,0]=4 660 B13R1.28 COCCCNCc1ccccc1 Amb838852 [0,0,0,0,0,1|3,0,0]=4 661 B13R1.28 COCCCNCc1ccccn1 Amb534487 [0,0,0,0,0,1|3,0,0]=4 662 B13R1.28 COCCCNCc1cccnc1 Amb875736 [0,0,0,0,0,1|3,0,0]=4 663 B13R1.28 COCCCNCc1ccncc1 Amb875727 [0,0,0,0,0,1|3,0,0]=4 664 B13R1.28 COCCNCCc1ccccc1 Amb6685596 [0,0,0,0,0,1|3,0,0]=4 665 B13R1.28 COCCNCCc1ccncc1 Amb16191750 [0,0,0,0,0,1|3,0,0]=4 666 B13R1.28 CSCCCNCc1ccccc1 Amb6719949 [0,0,0,0,0,1|3,0,0]=4 667 B13R1.28 CSCCCNCc1ccccn1 Amb6721496 [0,0,0,0,0,1|3,0,0]=4 668 B13R1.28 CSCCCNCc1cccnc1 Amb6729954 [0,0,0,0,0,1|3,0,0]=4 669 B13R1.28 CSCCCNCc1ccncc1 Amb6729737 [0,0,0,0,0,1|3,0,0]=4 670 B13R1.28 ClCCCCCCc1cncnc1 Amb24070772 [0,0,0,0,0,1|3,0,0]=4 671 B13R1.28 ClCCCCOCc1ccccc1 Amb19084569 [0,0,0,0,0,1|3,0,0]=4 672 B13R1.28 ClCCCNCCc1ccccc1 Amb29565621 [0,0,0,0,0,1|3,0,0]=4 673 B13R1.28 ClCCCOCCc1ccccc1 Amb9208564 [0,0,0,0,0,1|3,0,0]=4 674 B13R1.28 FCCCCNCc1ccccc1 Amb27863240 [0,0,0,0,0,1|3,0,0]=4 675 B13R1.28 ICCCCOCc1ccccc1 Amb26863429 [0,0,0,0,0,1|3,0,0]=4 676 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [0,0,0,0,0,1|2,0,0]=3 677 B13R1.28 NCCCCCCc1ccccn1 Amb18564087 [0,0,0,0,0,1|2,0,0]=3 678 B13R1.28 NCCCCCOc1ccccc1 Amb17233606 [0,0,0,0,0,1|3,0,0]=4 679 B13R1.28 NCCCCCSc1ccccc1 Amb18321384 [0,0,0,0,0,1|3,0,0]=4 680 B13R1.28 NCCCCCSc1ccccc1 Amb32662100 [0,0,0,0,0,1|3,0,0]=4 681 B13R1.28 NCCCCCSc1ccccn1 Amb18321554 [0,0,0,0,0,1|3,0,0]=4 682 B13R1.28 NCCCCCSc1ccccn1 Amb32662134 [0,0,0,0,0,1|3,0,0]=4 683 B13R1.28 NCCCCCSc1ncccn1 Amb19054694 [0,0,0,0,0,1|3,0,0]=4 684 B13R1.28 NCCCCCSc1ncccn1 Amb32662116 [0,0,0,0,0,1|3,0,0]=4 685 B13R1.28 NCCCCOCc1ccccc1 Amb6246928 [0,0,0,0,0,1|3,0,0]=4 686 B13R1.28 NCCCCSCc1ccccc1 Amb9391663 [0,0,0,0,0,1|3,0,0]=4 687 B13R1.28 NCCCNCCc1ccccc1 Amb17315277 [0,0,0,0,0,1|3,0,0]=4 688 B13R1.28 NCCCOCCc1ccccc1 Amb7764729 [0,0,0,0,0,1|3,0,0]=4 689 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [0,0,0,0,0,1|3,0,0]=4 690 B13R1.28 NCCOCCCc1ccncc1 Amb9208860 [0,0,0,0,0,1|3,0,0]=4 691 B13R1.28 OCCCCCCc1ccccc1 Amb8515378 [0,0,0,0,0,1|2,0,0]=3 692 B13R1.28 OCCCCCCc1ccccn1 Amb32430377 [0,0,0,0,0,1|2,0,0]=3 693 B13R1.28 OCCCCCCc1cccnc1 Amb9805461 [0,0,0,0,0,1|2,0,0]=3 694 B13R1.28 OCCCCCCc1ncccn1 Amb24061347 [0,0,0,0,0,1|2,0,0]=3 695 B13R1.28 OCCCCNCc1ccccc1 Amb6334835 [0,0,0,0,0,1|3,0,0]=4 696 B13R1.28 OCCCCNCc1cccnc1 Amb838401 [0,0,0,0,0,1|3,0,0]=4 697 B13R1.28 OCCCCNCc1ccncc1 Amb837719 [0,0,0,0,0,1|3,0,0]=4 698 B13R1.28 OCCCCOCc1ccccc1 Amb3939246 [0,0,0,0,0,1|3,0,0]=4 699 B13R1.28 OCCCNCCc1ccccc1 Amb6733591 [0,0,0,0,0,1|3,0,0]=4 700 B13R1.28 OCCCOCCc1ccccc1 Amb10609118 [0,0,0,0,0,1|3,0,0]=4 701 B13R1.28 OCCNCCCc1ccccc1 Amb7757048 [0,0,0,0,0,1|3,0,0]=4 702 B13R1.28 OCCSCCCc1ccccc1 Amb9362854 [0,0,0,0,0,1|3,0,0]=4 703 B10R0.71 C=C\C=C/C=C/CCCCC Amb22546765 [1,0,1,0,0,0|0,0,2]=4 704 B10R0.71 CCCCCCC\C=C\C=O Amb8517160 [1,0,1,0,0,0|0,0,1]=3 705 B10R0.71 CCCCCC\C=C\CCO Amb22641690 [1,0,1,0,0,0|0,0,2]=4 706 B10R0.71 CCCCC\C=C\C=C\C=O Amb8392854 [1,0,1,0,0,0|0,0,2]=4 707 B10R0.71 C\C=C\C=C\CCCCCC Amb22546597 [1,0,1,0,0,0|1,0,0]=3 708 B10R0.74 CCCCCCCC(=O)OC Amb8516706 [1,0,1,0,0,0|1,0,1]=4 709 B10R1.21 BrCCCCc1cccs1 Amb25085582 [2,0,0,0,0,0|1,1,0]=4 710 B10R1.21 CCCC#Cc1ccco1 Amb27438081 [2,0,0,0,0,0|0,0,2]=4 711 B10R1.21 CCCCCc1ccco1 Amb8393189 [2,0,0,0,0,0|0,0,0]=2 712 B10R1.21 CCCCCc1cccs1 Amb2779226 [2,0,0,0,0,0|0,1,0]=3 713 B10R1.21 CCCCCc1ccsc1 Amb20621787 [2,0,0,0,0,0|2,0,0]=4 714 B10R1.21 CCCCCc1nccs1 Amb25297177 [2,0,0,0,0,0|1,1,0]=4 715 B10R1.21 CCCCNc1cccs1 Amb28252106 [2,0,0,0,0,0|1,1,0]=4 716 B10R1.21 CCCNCc1ccco1 Amb1127967 [2,0,0,0,0,0|1,0,0]=3 717 B10R1.21 CCCNCc1ccco1 Amb19890265 [2,0,0,0,0,0|1,0,0]=3 718 B10R1.21 CCCNCc1cccs1 Amb19890386 [2,0,0,0,0,0|1,1,0]=4 719 B10R1.21 CCCNCc1cccs1 Amb837811 [2,0,0,0,0,0|1,1,0]=4 720 B10R1.21 CCCSCc1ccco1 Amb24430614 [2,0,0,0,0,0|1,0,0]=3 721 B10R1.21 CCCSCc1ccno1 Amb28126913 [2,0,0,0,0,0|2,0,0]=4 722 B10R1.21 CCNCCc1cccs1 Amb6697855 [2,0,0,0,0,0|1,1,0]=4 723 B10R1.21 CC\C=C\Cc1ccco1 Amb24558353 [2,0,0,0,0,0|0,0,2]=4 724 B10R1.21 CNCCCc1ccco1 Amb534654 [2,0,0,0,0,0|1,0,0]=3 725 B10R1.21 CNCCCc1cccs1 Amb17104498 [2,0,0,0,0,0|1,1,0]=4 726 B10R1.21 CSCOCc1ccco1 Amb27186358 [2,0,0,0,0,0|2,0,0]=4 727 B10R1.21 ClCCCCc1ccco1 Amb17138477 [2,0,0,0,0,0|1,0,0]=3 728 B10R1.21 ClCCCCc1cccs1 Amb8860566 [2,0,0,0,0,0|1,1,0]=4 729 B10R1.21 ClCCNCc1ccco1 Amb17334486 [2,0,0,0,0,0|2,0,0]=4 730 B10R1.21 NCCCCc1ccco1 Amb5735488 [2,0,0,0,0,0|1,0,0]=3 731 B10R1.21 NCCCCc1cccs1 Amb5735489 [2,0,0,0,0,0|1,1,0]=4 732 B10R1.21 NCCCCc1cnco1 Amb18831872 [2,0,0,0,0,0|2,0,0]=4 733 B10R1.21 NCCCOc1ccco1 Amb33360903 [2,0,0,0,0,0|2,0,0]=4 734 B10R1.21 NCCNCc1ccco1 Amb17091023 [2,0,0,0,0,0|2,0,0]=4 735 B10R1.21 NCCSCc1ccco1 Amb2721849 [2,0,0,0,0,0|2,0,0]=4 736 B10R1.21 NOCCCc1ccco1 Amb17089544 [2,0,0,0,0,0|2,0,0]=4 737 B10R1.21 O=CCCCc1ccco1 Amb28050259 [2,0,0,0,0,0|1,0,1]=4 738 B10R1.21 OCCCCc1ccco1 Amb17106038 [2,0,0,0,0,0|1,0,0]=3 739 B10R1.21 OCCCCc1cccs1 Amb9004304 [2,0,0,0,0,0|1,1,0]=4 740 B10R1.21 OCCCSc1ccco1 Amb28065299 [2,0,0,0,0,0|2,0,0]=4 741 B10R1.21 OCCNCc1ccco1 Amb2592326 [2,0,0,0,0,0|2,0,0]=4 742 B10R1.21 SCCCCc1ccco1 Amb18563472 [2,0,0,0,0,0|1,0,0]=3 743 B10R1.21 SCCCCc1cccs1 Amb17400373 [2,0,0,0,0,0|1,1,0]=4 744 B10R1.21 SCCNCc1ccco1 Amb18644955 [2,0,0,0,0,0|2,0,0]=4 745 B10R1.21 SCCSCc1ccco1 Amb27632177 [2,0,0,0,0,0|2,0,0]=4 746 B10R1.21 [NH3+]CCSCc1ccco1 Amb33513003 [2,0,0,0,0,0|2,0,0]=4 747 B12R0.5 CCCCCCC\C=C\C=C\C=O Amb22045171 [0,1,1,0,0,0|0,0,1]=3 748 B12R0.5 CCCCCCC\C=C\C=C\CO Amb33986605 [0,1,1,0,0,0|0,0,0]=2 749 B12R0.234 CCCCCCCC\C=C\C(=O)O Amb33987634 [0,1,1,0,0,0|0,0,1]=3 750 B12R0.234 O=C(O)\C=C\CCCCCCCO Amb33757093 [0,1,1,0,0,0|1,0,1]=4 751 B12R0.248 C=CC(=O)NCCCCCCCC Amb28556071 [0,1,1,0,0,0|1,0,1]=4 752 B12R0.248 C=CC(=O)OCCCCCCCC Amb2778626 [0,1,1,0,0,0|0,0,1]=3 753 B12R1.7 CCCCCCc1cc(Br)cs1 Amb24079075 [1,1,0,0,0,0|0,1,0]=3 754 B12R1.7 CCCCCCc1cc(N)on1 Amb28653055 [1,1,0,0,0,0|2,0,0]=4 755 B12R1.7 CCCCCCc1ccc(Br)s1 Amb22235381 [1,1,0,0,0,0|0,1,0]=3 756 B12R1.7 CCCCCCc1csc(N)n1 Amb22284509 [1,1,0,0,0,0|2,0,0]=4 757 B12R1.7 CCCCCCn1cc(N)cn1 Amb7794734 [1,1,0,0,0,0|2,0,0]=4 758 B12R1.7 CCCCCCn1cc(O)cn1 Amb32412740 [1,1,0,0,0,0|2,0,0]=4 759 B12R1.7 CCCCCCn1ccc(N)n1 Amb18792974 [1,1,0,0,0,0|2,0,0]=4 760 B12R1.7 CCCCNCc1cc(Br)cs1 Amb7757074 [1,1,0,0,0,0|1,1,0]=4 761 B12R1.7 CCCCNCc1ccc(Br)s1 Amb6691103 [1,1,0,0,0,0|1,1,0]=4 762 B12R1.7 CCCCNCc1ccc(C)o1 Amb19890503 [1,1,0,0,0,0|1,0,0]=3 763 B12R1.7 CCCCNCc1ccc(C)o1 Amb2592338 [1,1,0,0,0,0|1,0,0]=3 764 B12R1.7 CCCCNCc1ccc(C)s1 Amb1927259 [1,1,0,0,0,0|1,1,0]=4 765 B12R1.7 CCCCNCc1ccc(C)s1 Amb6864537 [1,1,0,0,0,0|1,1,0]=4 766 B12R1.7 CNCCSCc1ccc(Cl)o1 Amb32789095 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.7 COCCNCc1ccc(C)o1 Amb2592344 [1,1,0,0,0,0|2,0,0]=4 768 B12R1.7 COCCNCc1ccc(N)o1 Amb18107317 [1,1,0,0,0,0|2,0,0]=4 769 B12R1.7 Cc1ccc(CNCCCO)o1 Amb2592346 [1,1,0,0,0,0|2,0,0]=4 770 B12R1.7 ClCCCSCc1ccc(Cl)o1 Amb32789051 [1,1,0,0,0,0|2,0,0]=4 771 B12R1.7 Clc1ccc(CSCCCBr)o1 Amb32789052 [1,1,0,0,0,0|2,0,0]=4 772 B12R1.7 NCCCSCc1ccc(Cl)o1 Amb32788986 [1,1,0,0,0,0|2,0,0]=4 773 B12R1.7 OCCCSCc1ccc(Cl)o1 Amb32788919 [1,1,0,0,0,0|2,0,0]=4 774 B12R1.7 SCCCSCc1ccc(Cl)o1 Amb32789174 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.35 CC(NCCCO)c1ccco1 Amb6733643 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.35 CCCCCC(=O)c1cccs1 Amb8850833 [1,1,0,0,0,0|0,1,1]=4 777 B12R1.35 CCCCCC(=O)c1ncco1 Amb6301568 [1,1,0,0,0,0|1,0,1]=4 778 B12R1.35 CCCCCC(N)c1ccco1 Amb18798871 [1,1,0,0,0,0|0,0,0]=2 779 B12R1.35 CCCCCC(N)c1ccco1 Amb35745646 [1,1,0,0,0,0|0,0,0]=2 780 B12R1.35 CCCCCC(N)c1cccs1 Amb35746820 [1,1,0,0,0,0|0,1,0]=3 781 B12R1.35 CCCCCC(N)c1cccs1 Amb7786626 [1,1,0,0,0,0|0,1,0]=3 782 B12R1.35 CCCCCC(N)c1ccsc1 Amb19068543 [1,1,0,0,0,0|2,0,0]=4 783 B12R1.35 CCCCNC(C)c1ccco1 Amb6691030 [1,1,0,0,0,0|1,0,0]=3 784 B12R1.35 CCCCNC(C)c1cccs1 Amb6691021 [1,1,0,0,0,0|1,1,0]=4 785 B12R1.35 CCCNCC(C)c1cnco1 Amb33295064 [1,1,0,0,0,0|2,0,0]=4 786 B12R1.51 CCCC(C)NCc1ccco1 Amb6249358 [1,1,0,0,0,0|1,0,0]=3 787 B12R1.51 CCCC(N)C#Cc1ccco1 Amb27480750 [1,1,0,0,0,0|0,0,2]=4 788 B12R1.51 CCOC(=O)CCc1ccco1 Amb6357512 [1,1,0,0,0,0|1,0,1]=4 789 B12R1.51 COCC(C)NCc1ccco1 Amb6689553 [1,1,0,0,0,0|2,0,0]=4 790 B12R1.51 N#CCC(O)CCc1ccco1 Amb17232523 [1,1,0,0,0,0|1,0,1]=4 791 B12R1.53 CCCCC(=O)Cc1ccco1 Amb533038 [1,1,0,0,0,0|0,0,1]=3 792 B12R1.53 CN(CCCN)Cc1ccco1 Amb9388019 [1,1,0,0,0,0|2,0,0]=4 793 B12R1.53 COCCC(N)Cc1ccco1 Amb32718689 [1,1,0,0,0,0|1,0,0]=3 794 B12R1.255 CC(C)CCNCc1ccco1 Amb1117364 [1,1,0,0,0,0|1,0,0]=3 795 B12R1.255 CC(C)CCNCc1cccs1 Amb875721 [1,1,0,0,0,0|1,1,0]=4 796 B12R1.255 CC(C)CNCCc1cccs1 Amb6697748 [1,1,0,0,0,0|1,1,0]=4 797 B12R1.255 CC(N)CCCCc1ccco1 Amb22035241 [1,1,0,0,0,0|0,0,0]=2 798 B12R1.255 CC(N)CCCCc1ccsc1 Amb33171682 [1,1,0,0,0,0|2,0,0]=4 799 B12R1.255 CC(N)CCCCn1cccn1 Amb18788698 [1,1,0,0,0,0|2,0,0]=4 800 B12R1.255 CC(O)CCCCc1ccsc1 Amb33449445 [1,1,0,0,0,0|2,0,0]=4 801 B12R1.255 CC(O)CCCCn1cccn1 Amb18788846 [1,1,0,0,0,0|2,0,0]=4 802 B12R1.255 CC(O)CCNCc1ccco1 Amb33496476 [1,1,0,0,0,0|1,0,0]=3 803 B12R1.255 CC(O)CCNCc1cccs1 Amb33496508 [1,1,0,0,0,0|1,1,0]=4 804 B12R1.255 CN(C)CCNCc1ccco1 Amb6565463 [1,1,0,0,0,0|2,0,0]=4 805 B12R1.255 CN(C)CCNCc1ccco1 Amb7078768 [1,1,0,0,0,0|2,0,0]=4 806 B12R1.255 C[C@@H](N)CCCCc1ccsc1 Amb33321220 [1,1,0,0,0,0|2,0,0]=4 807 B12R1.255 C[C@@H](N)CCCCn1cccn1 Amb32726924 [1,1,0,0,0,0|2,0,0]=4 808 B12R1.255 C[C@@H](O)CCCCc1ccsc1 Amb33223692 [1,1,0,0,0,0|2,0,0]=4 809 B12R1.255 C[C@@H](O)CCCCn1cccn1 Amb32726926 [1,1,0,0,0,0|2,0,0]=4 810 B12R1.255 C[C@H](N)CCCCc1ccsc1 Amb33321219 [1,1,0,0,0,0|2,0,0]=4 811 B12R1.255 C[C@H](N)CCCCn1cccn1 Amb32726923 [1,1,0,0,0,0|2,0,0]=4 812 B12R1.255 C[C@H](O)CCCCc1ccsc1 Amb33321221 [1,1,0,0,0,0|2,0,0]=4 813 B12R1.255 C[C@H](O)CCCCn1cccn1 Amb32726927 [1,1,0,0,0,0|2,0,0]=4 814 B12R1.255 O=C(O)CCCCc1ccco1 Amb18646922 [1,1,0,0,0,0|1,0,1]=4 815 B12R1.372 CCCCCCc1ccsc1Br Amb19957831 [1,1,0,0,0,0|2,0,0]=4 816 B12R1.372 CCCCCCn1nccc1Br Amb35745336 [1,1,0,0,0,0|2,0,0]=4 817 B12R1.372 CCCCNCc1cccn1C Amb19890352 [1,1,0,0,0,0|2,0,0]=4 818 B12R1.372 CCCCNCc1cccn1C Amb7758624 [1,1,0,0,0,0|2,0,0]=4 819 B12R1.372 CCCCNCc1sccc1C Amb1927261 [1,1,0,0,0,0|1,1,0]=4 820 B12R1.372 CCCCNCc1sccc1C Amb6864542 [1,1,0,0,0,0|1,1,0]=4 821 B12R1.372 CNCCSCc1occc1C Amb32987515 [1,1,0,0,0,0|2,0,0]=4 822 B12R1.372 Cc1ccoc1CSCCCBr Amb32987586 [1,1,0,0,0,0|2,0,0]=4 823 B12R1.372 Cc1ccoc1CSCCCCl Amb32987584 [1,1,0,0,0,0|2,0,0]=4 824 B12R1.372 Cc1ccoc1CSCCCN Amb32987514 [1,1,0,0,0,0|2,0,0]=4 825 B12R1.372 Cc1ccoc1CSCCCO Amb32987907 [1,1,0,0,0,0|2,0,0]=4 826 B12R1.372 Cc1ccoc1CSCCCS Amb32987790 [1,1,0,0,0,0|2,0,0]=4 827 B12R1.477 CCC(C)CNCc1ccco1 Amb6719045 [1,1,0,0,0,0|1,0,0]=3 828 B12R1.477 CCC(C)CNCc1cccs1 Amb6729532 [1,1,0,0,0,0|1,1,0]=4 829 B12R1.477 CCC(C)NCCc1cccs1 Amb6697862 [1,1,0,0,0,0|1,1,0]=4 830 B12R1.477 NCC(O)COCc1ccco1 Amb1058501 [1,1,0,0,0,0|2,0,0]=4 831 B12R1.477 NCC(O)CSCc1ccco1 Amb9208279 [1,1,0,0,0,0|2,0,0]=4 832 B12R1.477 OC[C@H](O)CNCc1ccco1 Amb33041832 [1,1,0,0,0,0|2,0,0]=4 833 B14R1.14 CCCCCCCc1ccc(Br)cc1 Amb2722819 [0,1,0,0,0,1|1,0,0]=3 834 B14R1.14 CCCCCCCc1ccc(N)cc1 Amb2721128 [0,1,0,0,0,1|1,0,0]=3 835 B14R1.14 CCCCCCCc1ccc(O)cc1 Amb2779885 [0,1,0,0,0,1|1,0,0]=3 836 B14R1.14 CCCCCCCc1cnc(Cl)nc1 Amb9786905 [0,1,0,0,0,1|2,0,0]=4 837 B14R1.14 CCCCCCNc1ccc(Br)cc1 Amb7759753 [0,1,0,0,0,1|2,0,0]=4 838 B14R1.14 CCCCCCNc1ccc(Br)cn1 Amb22896380 [0,1,0,0,0,1|2,0,0]=4 839 B14R1.14 CCCCCCNc1ccc(C)cc1 Amb7759787 [0,1,0,0,0,1|2,0,0]=4 840 B14R1.14 CCCCCCNc1ccc(N)cn1 Amb17042246 [0,1,0,0,0,1|2,0,0]=4 841 B14R1.14 CCCCCCNc1ccc(N)nc1 Amb17041331 [0,1,0,0,0,1|2,0,0]=4 842 B14R1.14 CCCCCCOc1ccc(Br)cc1 Amb2721353 [0,1,0,0,0,1|2,0,0]=4 843 B14R1.14 CCCCCCOc1ccc(C)cc1 Amb32410439 [0,1,0,0,0,1|2,0,0]=4 844 B14R1.14 CCCCCCOc1ccc(I)cc1 Amb32410438 [0,1,0,0,0,1|2,0,0]=4 845 B14R1.14 CCCCCCOc1ccc(N)cc1 Amb2189146 [0,1,0,0,0,1|2,0,0]=4 846 B14R1.14 CCCCCCOc1ccc(N)cn1 Amb7790191 [0,1,0,0,0,1|2,0,0]=4 847 B14R1.14 CCCCCCOc1ccc(N)nn1 Amb8439537 [0,1,0,0,0,1|2,0,0]=4 848 B14R1.14 CCCCCCOc1ccc(O)cc1 Amb2099510 [0,1,0,0,0,1|2,0,0]=4 849 B14R1.14 CCCCCCSc1ccc(N)cn1 Amb8932395 [0,1,0,0,0,1|2,0,0]=4 850 B14R1.14 CCCCCNCc1ccc(Br)cc1 Amb6688061 [0,1,0,0,0,1|2,0,0]=4 851 B14R1.14 CCCCCNCc1ccc(C)cc1 Amb837629 [0,1,0,0,0,1|2,0,0]=4 852 B14R1.14 CCCCCNCc1ccc(Cl)cc1 Amb1548620 [0,1,0,0,0,1|2,0,0]=4 853 B14R1.14 CCCCCNCc1ccc(F)cc1 Amb1657751 [0,1,0,0,0,1|2,0,0]=4 854 B14R1.14 CCCCCSCc1ccc(N)cc1 Amb17498074 [0,1,0,0,0,1|2,0,0]=4 855 B14R1.14 CCCCNCCc1ccc(Br)cc1 Amb18053697 [0,1,0,0,0,1|2,0,0]=4 856 B14R1.14 NCCCCCCc1ccc(F)cc1 Amb17236256 [0,1,0,0,0,1|2,0,0]=4 857 B14R1.26 CCCCCCNc1cccc(Br)c1 Amb7759756 [0,1,0,0,0,1|2,0,0]=4 858 B14R1.26 CCCCCCNc1cccc(F)n1 Amb33044405 [0,1,0,0,0,1|2,0,0]=4 859 B14R1.26 CCCCCCOc1cccc(Br)c1 Amb7794832 [0,1,0,0,0,1|2,0,0]=4 860 B14R1.26 CCCCCCOc1cccc(N)c1 Amb1033055 [0,1,0,0,0,1|2,0,0]=4 861 B14R1.26 CCCCCCOc1nccc(Br)n1 Amb32938568 [0,1,0,0,0,1|2,0,0]=4 862 B14R1.26 CCCCCNCc1cccc(Br)c1 Amb6688064 [0,1,0,0,0,1|2,0,0]=4 863 B14R1.26 CCCCCNCc1cccc(C)c1 Amb6688075 [0,1,0,0,0,1|2,0,0]=4 864 B14R1.26 CCCCCNCc1cccc(Cl)c1 Amb6688178 [0,1,0,0,0,1|2,0,0]=4 865 B14R1.26 CCCCCNCc1cccc(F)c1 Amb6688070 [0,1,0,0,0,1|2,0,0]=4 866 B14R1.26 CCCCCNCc1cccc(O)c1 Amb6688181 [0,1,0,0,0,1|2,0,0]=4 867 B14R1.26 CCCCCOCc1cccc(N)c1 Amb8902761 [0,1,0,0,0,1|2,0,0]=4 868 B14R1.26 CCCCNCCc1cccc(Br)c1 Amb18053729 [0,1,0,0,0,1|2,0,0]=4 869 B14R1.26 CCCCNCCc1cccc(N)c1 Amb18550381 [0,1,0,0,0,1|2,0,0]=4 870 B14R1.38 CCCCCCC(=O)c1ccccc1 Amb6609017 [0,1,0,0,0,1|1,0,1]=4 871 B14R1.38 CCCCCCC(=O)c1ccccn1 Amb533043 [0,1,0,0,0,1|1,0,1]=4 872 B14R1.38 CCCCCCC(=O)c1cccnc1 Amb19073455 [0,1,0,0,0,1|1,0,1]=4 873 B14R1.38 CCCCCCC(=O)c1ccncc1 Amb19073474 [0,1,0,0,0,1|1,0,1]=4 874 B14R1.38 CCCCCNC(C)c1ccccc1 Amb6688105 [0,1,0,0,0,1|2,0,0]=4 875 B14R1.38 CCCCCNC(C)c1ccccn1 Amb6688117 [0,1,0,0,0,1|2,0,0]=4 876 B14R1.38 CCCCCNC(C)c1cccnc1 Amb6688119 [0,1,0,0,0,1|2,0,0]=4 877 B14R1.38 CCCCCNC(C)c1ccncc1 Amb6688118 [0,1,0,0,0,1|2,0,0]=4 878 B14R1.38 CCCCNCC(C)c1ccccc1 Amb2119259 [0,1,0,0,0,1|2,0,0]=4 879 B14R1.38 CCCCNCC(C)c1ccccc1 Amb6729197 [0,1,0,0,0,1|2,0,0]=4 880 B14R1.38 CCCCNCC(O)c1ccccc1 Amb9242095 [0,1,0,0,0,1|2,0,0]=4 881 B14R1.38 CCCNCCC(C)c1ccccc1 Amb19073616 [0,1,0,0,0,1|2,0,0]=4 882 B14R1.38 CCCNCCC(C)c1ccccc1 Amb19890572 [0,1,0,0,0,1|2,0,0]=4 883 B14R1.38 COCCCCC(N)c1ccccc1 Amb19051190 [0,1,0,0,0,1|2,0,0]=4 884 B14R1.38 NCCCCCC(N)c1ccccn1 Amb10606958 [0,1,0,0,0,1|2,0,0]=4 885 B14R1.38 NCCCCCC(N)c1cccnc1 Amb10606957 [0,1,0,0,0,1|2,0,0]=4 886 B14R1.38 NCCCCCC(N)c1ccncc1 Amb10606956 [0,1,0,0,0,1|2,0,0]=4 887 B14R1.123 BrCCCCCCCc1ccccc1 Amb2685410 [0,1,0,0,0,1|1,0,0]=3 888 B14R1.123 BrCCCCCOCc1ccccc1 Amb24089339 [0,1,0,0,0,1|2,0,0]=4 889 B14R1.123 CCCCCCCCc1ccccc1 Amb6619511 [0,1,0,0,0,1|1,0,0]=3 890 B14R1.123 CCCCCCCCc1ccccn1 Amb22235250 [0,1,0,0,0,1|1,0,0]=3 891 B14R1.123 CCCCCCCCc1cccnc1 Amb22235254 [0,1,0,0,0,1|1,0,0]=3 892 B14R1.123 CCCCCCCCc1ccncc1 Amb10553162 [0,1,0,0,0,1|1,0,0]=3 893 B14R1.123 CCCCCCNCc1ccccc1 Amb838135 [0,1,0,0,0,1|1,0,0]=3 894 B14R1.123 CCCCCCNCc1ccccn1 Amb5262449 [0,1,0,0,0,1|1,0,0]=3 895 B14R1.123 CCCCCCNCc1cccnc1 Amb837567 [0,1,0,0,0,1|1,0,0]=3 896 B14R1.123 CCCCCCNCc1ccncc1 Amb837882 [0,1,0,0,0,1|1,0,0]=3 897 B14R1.123 CCCCCCNCc1cncnc1 Amb19062308 [0,1,0,0,0,1|2,0,0]=4 898 B14R1.123 CCCCCNCCc1ccccc1 Amb6688086 [0,1,0,0,0,1|1,0,0]=3 899 B14R1.123 CCCCCNOCc1ccccc1 Amb25943392 [0,1,0,0,0,1|2,0,0]=4 900 B14R1.123 CCCCNCCCc1ccccc1 Amb10559435 [0,1,0,0,0,1|1,0,0]=3 901 B14R1.123 CCCCNCCCc1ccccc1 Amb6709575 [0,1,0,0,0,1|1,0,0]=3 902 B14R1.123 CCCCNCCOc1ccccc1 Amb17235713 [0,1,0,0,0,1|2,0,0]=4 903 B14R1.123 CCCCNCCOc1ccccn1 Amb22534925 [0,1,0,0,0,1|2,0,0]=4 904 B14R1.123 CCCNCCCOc1ccccc1 Amb7761184 [0,1,0,0,0,1|2,0,0]=4 905 B14R1.123 CCCNCCNCc1ccccn1 Amb19062224 [0,1,0,0,0,1|2,0,0]=4 906 B14R1.123 CCCNCCNCc1cccnc1 Amb19062225 [0,1,0,0,0,1|2,0,0]=4 907 B14R1.123 CCCNCCNCc1ccncc1 Amb20573256 [0,1,0,0,0,1|2,0,0]=4 908 B14R1.123 CCCNCCOCc1ccccc1 Amb19079608 [0,1,0,0,0,1|2,0,0]=4 909 B14R1.123 CCNCCCCOc1ccccc1 Amb17561487 [0,1,0,0,0,1|2,0,0]=4 910 B14R1.123 CCNCCCNCc1cccnc1 Amb880407 [0,1,0,0,0,1|2,0,0]=4 911 B14R1.123 CCNCCCOCc1ccccc1 Amb33530508 [0,1,0,0,0,1|2,0,0]=4 912 B14R1.123 CCOCCCNCc1ccccc1 Amb837710 [0,1,0,0,0,1|2,0,0]=4 913 B14R1.123 CCOCCCNCc1ccccn1 Amb5262447 [0,1,0,0,0,1|2,0,0]=4 914 B14R1.123 CCOCCCNCc1cccnc1 Amb837641 [0,1,0,0,0,1|2,0,0]=4 915 B14R1.123 CCOCCCNCc1ccncc1 Amb837852 [0,1,0,0,0,1|2,0,0]=4 916 B14R1.123 CCOCCNCCc1ccccc1 Amb9241005 [0,1,0,0,0,1|2,0,0]=4 917 B14R1.123 CCSCCCNCc1ccccc1 Amb27153761 [0,1,0,0,0,1|2,0,0]=4 918 B14R1.123 CNCCCCNCc1ccccc1 Amb19050856 [0,1,0,0,0,1|2,0,0]=4 919 B14R1.123 CNCCCCOCc1ccccc1 Amb19062004 [0,1,0,0,0,1|2,0,0]=4 920 B14R1.123 CNCCCNCCc1ccccc1 Amb6888027 [0,1,0,0,0,1|2,0,0]=4 921 B14R1.123 COCCCCCNc1ccccc1 Amb33133276 [0,1,0,0,0,1|2,0,0]=4 922 B14R1.123 COCCCCNCc1ccccc1 Amb10610303 [0,1,0,0,0,1|2,0,0]=4 923 B14R1.123 COCCCCNCc1ccccn1 Amb19080202 [0,1,0,0,0,1|2,0,0]=4 924 B14R1.123 COCCCCNCc1cccnc1 Amb19080200 [0,1,0,0,0,1|2,0,0]=4 925 B14R1.123 COCCCCNCc1ccncc1 Amb19080201 [0,1,0,0,0,1|2,0,0]=4 926 B14R1.123 COCCCNCCc1ccccc1 Amb876019 [0,1,0,0,0,1|2,0,0]=4 927 B14R1.123 COCCNCCCc1ccccc1 Amb6707136 [0,1,0,0,0,1|2,0,0]=4 928 B14R1.123 ClCCCCCOCc1ccccc1 Amb9001647 [0,1,0,0,0,1|2,0,0]=4 929 B14R1.123 FCCCCCNCc1ccccc1 Amb27234459 [0,1,0,0,0,1|2,0,0]=4 930 B14R1.123 ICCCCCNCc1ccccc1 Amb27468861 [0,1,0,0,0,1|2,0,0]=4 931 B14R1.123 ICCCCCOCc1ccccc1 Amb25126877 [0,1,0,0,0,1|2,0,0]=4 932 B14R1.123 NCCCCCNCc1ccccc1 Amb27837258 [0,1,0,0,0,1|2,0,0]=4 933 B14R1.123 NCCCCOCCc1ccccc1 Amb7790965 [0,1,0,0,0,1|2,0,0]=4 934 B14R1.123 NCCCNCCCc1ccccc1 Amb19050820 [0,1,0,0,0,1|2,0,0]=4 935 B14R1.123 NCCCSCCCc1ccccc1 Amb17500700 [0,1,0,0,0,1|2,0,0]=4 936 B14R1.123 OCCCCCCCc1ccccc1 Amb10807513 [0,1,0,0,0,1|1,0,0]=3 937 B14R1.123 OCCCCCNCc1ccccc1 Amb875693 [0,1,0,0,0,1|2,0,0]=4 938 B14R1.123 OCCCCCNCc1ccccn1 Amb875995 [0,1,0,0,0,1|2,0,0]=4 939 B14R1.123 OCCCCCNCc1cccnc1 Amb875741 [0,1,0,0,0,1|2,0,0]=4 940 B14R1.123 OCCCCCNCc1ccncc1 Amb2172482 [0,1,0,0,0,1|2,0,0]=4 941 B14R1.123 OCCCCCOCc1ccccc1 Amb3939226 [0,1,0,0,0,1|2,0,0]=4 942 B14R1.123 OCCCNCCCc1ccccc1 Amb6733767 [0,1,0,0,0,1|2,0,0]=4 943 B14R1.123 SCCCCCOCc1ccccc1 Amb27182376 [0,1,0,0,0,1|2,0,0]=4 944 B14R1.156 CCCC[C@@H](C)NCc1ccccc1 Amb27790943 [0,1,0,0,0,1|2,0,0]=4 945 B14R1.156 CCCC[C@H](C)NCc1ccccc1 Amb27796180 [0,1,0,0,0,1|2,0,0]=4 946 B14R1.158 CCCCNC(C)Cc1ccccc1 Amb19041462 [0,1,0,0,0,1|2,0,0]=4 947 B14R1.158 COCCCC(N)Cc1ccccc1 Amb19062060 [0,1,0,0,0,1|2,0,0]=4 948 B14R1.422 CC(C)CCOCCc1ccccc1 Amb22732326 [0,1,0,0,0,1|2,0,0]=4 949 B14R1.422 CC(C)CNCCCc1ccccc1 Amb20673698 [0,1,0,0,0,1|2,0,0]=4 950 B14R1.422 CC(C)CNCCCc1ccccc1 Amb6707256 [0,1,0,0,0,1|2,0,0]=4 951 B14R1.422 CC(O)CCCNCc1ccccc1 Amb27605962 [0,1,0,0,0,1|2,0,0]=4 952 B14R1.422 CC(O)CCCOCc1ccccc1 Amb19042638 [0,1,0,0,0,1|2,0,0]=4 953 B14R1.422 CC(O)CCNCCc1ccccc1 Amb33455982 [0,1,0,0,0,1|2,0,0]=4 954 B14R1.422 C[C@@H](O)CCCOCc1ccccc1 Amb27756440 [0,1,0,0,0,1|2,0,0]=4 955 B14R1.422 C[C@H](O)CCCOCc1ccccc1 Amb27457818 [0,1,0,0,0,1|2,0,0]=4 956 B14R1.520 CCCC(C)CNCc1cccnc1 Amb6729959 [0,1,0,0,0,1|2,0,0]=4 957 B14R1.520 CCCC(C)NCCc1ccccn1 Amb6694519 [0,1,0,0,0,1|2,0,0]=4 958 B14R1.520 CCCC(N)CCSc1ccccc1 Amb13881554 [0,1,0,0,0,1|2,0,0]=4 959 B14R1.520 CCCC(O)CNCc1ccccc1 Amb8630578 [0,1,0,0,0,1|2,0,0]=4 960 B14R1.520 CCC[C@@H](N)CNCc1ccccc1 Amb27610466 [0,1,0,0,0,1|2,0,0]=4 961 B14R1.520 CCC[C@H](N)COCc1ccccc1 Amb27849982 [0,1,0,0,0,1|2,0,0]=4 962 B14R1.520 COCC(N)CCCc1ccccc1 Amb19062066 [0,1,0,0,0,1|2,0,0]=4 963 B14R1.520 COCC(O)CCCc1ccccc1 Amb18324748 [0,1,0,0,0,1|2,0,0]=4 964 B14R1.520 CSCC(N)CCCc1ccccc1 Amb33129325 [0,1,0,0,0,1|2,0,0]=4 965 B14R1.716 CCC(C)CCNCc1ccccc1 Amb27392700 [0,1,0,0,0,1|2,0,0]=4 966 B14R1.716 CCC(C)CNCCc1ccccn1 Amb6720744 [0,1,0,0,0,1|2,0,0]=4 967 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [0,1,0,0,0,1|2,0,0]=4 968 B14R1.716 CCC(C)NCCCc1ccccc1 Amb20673663 [0,1,0,0,0,1|2,0,0]=4 969 B14R1.716 CCC(C)NCCCc1ccccc1 Amb9749932 [0,1,0,0,0,1|2,0,0]=4 970 B14R1.716 CCC(Cl)CCNCc1ccccc1 Amb27406390 [0,1,0,0,0,1|2,0,0]=4 971 B14R1.716 CCC(N)CCNCc1ccccc1 Amb27649623 [0,1,0,0,0,1|2,0,0]=4 972 B14R1.716 CCC(N)CCOCc1ccccc1 Amb28423127 [0,1,0,0,0,1|2,0,0]=4 973 B14R1.882 CCCCCCCc1ncncc1Br Amb10068159 [0,1,0,0,0,1|1,0,0]=3 974 B14R1.882 CCCCCCNc1ccncc1N Amb17094085 [0,1,0,0,0,1|2,0,0]=4 975 B14R1.882 CCCCCCNc1ncccc1N Amb17067312 [0,1,0,0,0,1|2,0,0]=4 976 B14R1.882 CCCCCCNc1ncncc1N Amb32430534 [0,1,0,0,0,1|2,0,0]=4 977 B14R1.882 CCCCCCOc1ccccc1Br Amb7794835 [0,1,0,0,0,1|2,0,0]=4 978 B14R1.882 CCCCCCOc1ccccc1N Amb840075 [0,1,0,0,0,1|2,0,0]=4 979 B14R1.882 CCCCCCOc1cccnc1N Amb7794203 [0,1,0,0,0,1|2,0,0]=4 980 B14R1.882 CCCCCCOc1ncccc1N Amb7790190 [0,1,0,0,0,1|2,0,0]=4 981 B14R1.882 CCCCCCSc1ccccc1N Amb7794931 [0,1,0,0,0,1|2,0,0]=4 982 B14R1.882 CCCCCNCc1ccccc1Br Amb6688197 [0,1,0,0,0,1|2,0,0]=4 983 B14R1.882 CCCCCNCc1ccccc1C Amb6688072 [0,1,0,0,0,1|2,0,0]=4 984 B14R1.882 CCCCCNCc1ccccc1Cl Amb6688060 [0,1,0,0,0,1|2,0,0]=4 985 B14R1.882 CCCCCNCc1ccccc1F Amb10825135 [0,1,0,0,0,1|2,0,0]=4 986 B14R1.882 CCCCCNCc1ccccc1F Amb1934180 [0,1,0,0,0,1|2,0,0]=4 987 B14R1.882 CCCCCNCc1ccccc1O Amb6688100 [0,1,0,0,0,1|2,0,0]=4 988 B14R1.882 CCCCCNCc1cccnc1Cl Amb29848220 [0,1,0,0,0,1|2,0,0]=4 989 B14R1.37 CCCCCCC(C)n1cc(N)cn1 Amb20674903 [0,2,0,0,0,0|2,0,0]=4 990 B14R1.37 CCCCCCC(C)n1ccc(N)n1 Amb20674798 [0,2,0,0,0,0|2,0,0]=4 991 B14R1.37 CCCCCNC(C)c1ccc(Br)s1 Amb33044417 [0,2,0,0,0,0|1,1,0]=4 992 B14R1.37 CCCCCNC(C)c1ccc(C)o1 Amb6688133 [0,2,0,0,0,0|1,0,0]=3 993 B14R1.37 CCCCCNC(C)c1ccc(C)s1 Amb6688193 [0,2,0,0,0,0|1,1,0]=4 994 B14R1.37 CCOCCNC(C)c1ccc(C)o1 Amb9258862 [0,2,0,0,0,0|2,0,0]=4 995 B14R1.37 COCCCNC(C)c1ccc(C)o1 Amb6730238 [0,2,0,0,0,0|2,0,0]=4 996 B14R1.122 CCCCCCCCn1cc(N)cn1 Amb7794732 [0,2,0,0,0,0|2,0,0]=4 997 B14R1.122 CCCCCCCCn1ccc(N)n1 Amb19052808 [0,2,0,0,0,0|2,0,0]=4 998 B14R1.122 CCCCCCCNc1ccn(C)n1 Amb19052789 [0,2,0,0,0,0|2,0,0]=4 999 B14R1.122 CCCCCCNCc1cc(Br)cs1 Amb7757119 [0,2,0,0,0,0|0,1,0]=3 1000 B14R1.122 CCCCCCNCc1ccc(Br)s1 Amb6730568 [0,2,0,0,0,0|0,1,0]=3 1001 B14R1.122 CCCCCCNCc1ccc(C)o1 Amb6730527 [0,2,0,0,0,0|0,0,0]=2 1002 B14R1.122 CCCCCCNCc1ccc(C)s1 Amb838367 [0,2,0,0,0,0|0,1,0]=3 1003 B14R1.122 CCCCCCNCc1ccn(C)n1 Amb31210227 [0,2,0,0,0,0|2,0,0]=4 1004 B14R1.122 CCCNCCSCc1ccc(Cl)o1 Amb32789105 [0,2,0,0,0,0|1,0,0]=3 1005 B14R1.122 CCNCCCSCc1ccc(Cl)o1 Amb32788985 [0,2,0,0,0,0|1,0,0]=3 1006 B14R1.122 CCOCCCNCc1ccc(Br)o1 Amb6700101 [0,2,0,0,0,0|1,0,0]=3 1007 B14R1.122 CCOCCCNCc1ccc(C)o1 Amb2592348 [0,2,0,0,0,0|1,0,0]=3 1008 B14R1.122 CCOCCCNCc1ccc(C)s1 Amb6336216 [0,2,0,0,0,0|1,1,0]=4 1009 B14R1.122 CCOCCCNCc1ccc(N)o1 Amb18107323 [0,2,0,0,0,0|1,0,0]=3 1010 B14R1.122 CNCCCCSCc1ccc(Cl)o1 Amb32789106 [0,2,0,0,0,0|1,0,0]=3 1011 B14R1.122 COCCCCNCc1cc(Br)cs1 Amb33003631 [0,2,0,0,0,0|1,1,0]=4 1012 B14R1.122 COCCCCNCc1ccc(Br)s1 Amb33003627 [0,2,0,0,0,0|1,1,0]=4 1013 B14R1.122 COCCCCNCc1ccc(C)o1 Amb19082606 [0,2,0,0,0,0|1,0,0]=3 1014 B14R1.122 COCCCCNCc1ccc(C)s1 Amb33003630 [0,2,0,0,0,0|1,1,0]=4 1015 B14R1.122 Cc1ccc(CNCCCCCO)o1 Amb19082689 [0,2,0,0,0,0|1,0,0]=3 1016 B14R1.122 Cc1ccc(CNCCCCCO)s1 Amb875791 [0,2,0,0,0,0|1,1,0]=4 1017 B14R1.122 Cc1ccc(CNCCNCCO)o1 Amb22511760 [0,2,0,0,0,0|2,0,0]=4 1018 B14R1.122 Cc1ccc(CNCCOCCO)o1 Amb6736107 [0,2,0,0,0,0|2,0,0]=4 1019 B14R1.122 ClCCCCCSCc1ccc(Cl)o1 Amb32789061 [0,2,0,0,0,0|1,0,0]=3 1020 B14R1.122 ClCCOCCSCc1ccc(Cl)o1 Amb32789049 [0,2,0,0,0,0|2,0,0]=4 1021 B14R1.122 Clc1ccc(CSCCCCCBr)o1 Amb32789065 [0,2,0,0,0,0|1,0,0]=3 1022 B14R1.122 Clc1ccc(CSCCOCCBr)o1 Amb32789071 [0,2,0,0,0,0|2,0,0]=4 1023 B14R1.122 N#CCCCCSCc1ccc(Cl)o1 Amb32789127 [0,2,0,0,0,0|1,0,1]=4 1024 B14R1.122 NCCCCCSCc1ccc(Cl)o1 Amb32789107 [0,2,0,0,0,0|1,0,0]=3 1025 B14R1.122 NCCOCCSCc1ccc(Cl)o1 Amb32789245 [0,2,0,0,0,0|2,0,0]=4 1026 B14R1.122 Nc1ccc(CNCCOCCO)o1 Amb18107320 [0,2,0,0,0,0|2,0,0]=4 1027 B14R1.122 OCCCCCSCc1ccc(Cl)o1 Amb32788940 [0,2,0,0,0,0|1,0,0]=3 1028 B14R1.122 OCCOCCNCc1ccc(Br)o1 Amb6736112 [0,2,0,0,0,0|2,0,0]=4 1029 B14R1.122 OCCOCCSCc1ccc(Cl)o1 Amb32788942 [0,2,0,0,0,0|2,0,0]=4 1030 B14R1.122 SCCCCCSCc1ccc(Cl)o1 Amb32789183 [0,2,0,0,0,0|1,0,0]=3 1031 B14R1.122 SCCOCCSCc1ccc(Cl)o1 Amb32789184 [0,2,0,0,0,0|2,0,0]=4 1032 B14R1.128 CC(=O)CCCSCc1ccc(Cl)o1 Amb32788977 [0,2,0,0,0,0|1,0,1]=4 1033 B14R1.128 CC(C)CCCCCn1cc(N)cn1 Amb32704359 [0,2,0,0,0,0|2,0,0]=4 1034 B14R1.128 CC(C)CCCCCn1ccc(N)n1 Amb32704357 [0,2,0,0,0,0|2,0,0]=4 1035 B14R1.128 CC(C)NCCSCc1ccc(Cl)o1 Amb32789104 [0,2,0,0,0,0|2,0,0]=4 1036 B14R1.128 CC(N)CCCSCc1ccc(Cl)o1 Amb32789322 [0,2,0,0,0,0|1,0,0]=3 1037 B14R1.128 CC(O)CCCSCc1ccc(Cl)o1 Amb32788938 [0,2,0,0,0,0|1,0,0]=3 1038 B14R1.128 CN(C)CCCNCc1ccc(Br)o1 Amb6699251 [0,2,0,0,0,0|2,0,0]=4 1039 B14R1.128 CN(C)CCCNCc1ccc(N)o1 Amb18107160 [0,2,0,0,0,0|2,0,0]=4 1040 B14R1.128 Cc1ccc(CNCCCC(C)C)o1 Amb19043328 [0,2,0,0,0,0|1,0,0]=3 1041 B14R1.128 Cc1ccc(CNCCCN(C)C)o1 Amb6356089 [0,2,0,0,0,0|2,0,0]=4 1042 B14R1.155 CC(CCCN)SCc1ccc(Cl)o1 Amb32789164 [0,2,0,0,0,0|2,0,0]=4 1043 B14R1.155 CCNCC(C)SCc1ccc(Cl)o1 Amb32789013 [0,2,0,0,0,0|2,0,0]=4 1044 B14R1.155 Cc1ccc(CNC(C)CCCO)o1 Amb33363343 [0,2,0,0,0,0|2,0,0]=4 1045 B14R1.519 CCCC(=O)CSCc1ccc(Cl)o1 Amb32788973 [0,2,0,0,0,0|1,0,1]=4 1046 B14R1.519 CCCC(N)CSCc1ccc(Cl)o1 Amb32789318 [0,2,0,0,0,0|1,0,0]=3 1047 B14R1.519 CCNC(C)CSCc1ccc(Cl)o1 Amb32789317 [0,2,0,0,0,0|2,0,0]=4 1048 B14R1.519 CNCC(C)CSCc1ccc(Cl)o1 Amb32788865 [0,2,0,0,0,0|2,0,0]=4 1049 B14R1.519 CNCC(O)CSCc1ccc(Cl)o1 Amb32789168 [0,2,0,0,0,0|2,0,0]=4 1050 B14R1.519 COCC(N)CSCc1ccc(Cl)o1 Amb32789326 [0,2,0,0,0,0|2,0,0]=4 1051 B14R1.519 COCC(O)CSCc1ccc(Cl)o1 Amb32788610 [0,2,0,0,0,0|2,0,0]=4 1052 B14R1.519 NC(CCO)CSCc1ccc(Cl)o1 Amb32789325 [0,2,0,0,0,0|2,0,0]=4 1053 B14R1.519 NCCC(O)CSCc1ccc(Cl)o1 Amb32789244 [0,2,0,0,0,0|2,0,0]=4 1054 B14R1.715 CNC(C)CCSCc1ccc(Cl)o1 Amb32789026 [0,2,0,0,0,0|2,0,0]=4 1055 B14R1.715 NC(CO)CCSCc1ccc(Cl)o1 Amb32788903 [0,2,0,0,0,0|2,0,0]=4 1056 B14R1.715 NCC(O)CCSCc1ccc(Cl)o1 Amb32789034 [0,2,0,0,0,0|2,0,0]=4 1057 B14R1.715 OCC(O)CCSCc1ccc(Cl)o1 Amb32788941 [0,2,0,0,0,0|2,0,0]=4 1058 B14R1.3126 CCCCCCCc1nc(Br)sc1Br Amb24101739 [0,2,0,0,0,0|2,0,0]=4 1059 B14R1.3126 CCCCCCCn1nc(N)cc1C Amb19890598 [0,2,0,0,0,0|2,0,0]=4 1060 B14R1.3126 [*]c1cc(CCCCCCC)c([*])s1 Amb32414730 [0,2,0,0,0,0|2,0,0]=4 1061 B14R1.3127 CCCCCCCc1cc(N)n(C)n1 Amb8848900 [0,2,0,0,0,0|2,0,0]=4 1062 B14R1.3127 CCCCCCCn1cc(Br)c(N)n1 Amb32701997 [0,2,0,0,0,0|2,0,0]=4 1063 B14R1.3127 CCCCCCCn1cc(C)c(N)n1 Amb32701995 [0,2,0,0,0,0|2,0,0]=4 1064 B14R1.3127 CCCCCCCn1cc(Cl)c(N)n1 Amb32701996 [0,2,0,0,0,0|2,0,0]=4 1065 B14R1.3127 CCCCCCCn1cc(N)c(C)n1 Amb32706697 [0,2,0,0,0,0|2,0,0]=4 1066 B14R1.3452 CCCCCCCn1ncc(N)c1C Amb32706988 [0,2,0,0,0,0|2,0,0]=4 1067 B14R1.3454 CCCCCNCc1ccc(CO)o1 Amb33496685 [0,2,0,0,0,0|1,0,0]=3 1068 B14R1.3454 CCNCCSCc1ccc(CC)o1 Amb32987350 [0,2,0,0,0,0|2,0,0]=4 1069 B14R1.3454 CCOCCNCc1ccc(CO)o1 Amb33496703 [0,2,0,0,0,0|2,0,0]=4 1070 B14R1.3454 CCc1ccc(CSCCCCBr)o1 Amb32987240 [0,2,0,0,0,0|2,0,0]=4 1071 B14R1.3454 CCc1ccc(CSCCCCCl)o1 Amb32987237 [0,2,0,0,0,0|2,0,0]=4 1072 B14R1.3454 CCc1ccc(CSCCCCN)o1 Amb32987356 [0,2,0,0,0,0|2,0,0]=4 1073 B14R1.3454 CCc1ccc(CSCCCCO)o1 Amb32789377 [0,2,0,0,0,0|2,0,0]=4 1074 B14R1.3454 CCc1ccc(CSCCCCS)o1 Amb32987443 [0,2,0,0,0,0|2,0,0]=4 1075 B14R1.3454 CCc1ccc(CSCCCNC)o1 Amb32987353 [0,2,0,0,0,0|2,0,0]=4 1076 B14R1.3454 COCCCNCc1ccc(CO)o1 Amb33496697 [0,2,0,0,0,0|2,0,0]=4 1077 B14R1.107 CCCCNC(C)C(O)c1cccs1 Amb18605685 [0,2,0,0,0,0|1,1,0]=4 1078 B14R1.169 CCCCCCCC(=O)c1cccs1 Amb8979018 [0,2,0,0,0,0|0,1,0]=3 1079 B14R1.169 CCCCCCCC(=O)c1ncco1 Amb6301570 [0,2,0,0,0,0|1,0,0]=3 1080 B14R1.169 CCCCCCCC(N)c1ccco1 Amb19063948 [0,2,0,0,0,0|0,0,0]=2 1081 B14R1.169 CCCCCCCC(N)c1ccco1 Amb35745687 [0,2,0,0,0,0|0,0,0]=2 1082 B14R1.169 CCCCCCCC(N)c1cccs1 Amb7786460 [0,2,0,0,0,0|0,1,0]=3 1083 B14R1.169 CCCCCCCC(N)c1ccsc1 Amb22642867 [0,2,0,0,0,0|2,0,0]=4 1084 B14R1.169 CCCCCCNC(C)c1cccs1 Amb6653155 [0,2,0,0,0,0|0,1,0]=3 1085 B14R1.169 CCCCCCNC(C)c1nccs1 Amb33496620 [0,2,0,0,0,0|1,1,0]=4 1086 B14R1.169 CCCCCCOC(=O)c1ccco1 Amb22353267 [0,2,0,0,0,0|0,0,1]=3 1087 B14R1.169 COCCCCNC(C)c1cccs1 Amb33003621 [0,2,0,0,0,0|1,1,0]=4 1088 B14R1.169 NCCCCCNC(=O)c1ccco1 Amb18619798 [0,2,0,0,0,0|1,0,1]=4 1089 B14R1.3360 CCCCCNC(C)c1sccc1C Amb33496418 [0,2,0,0,0,0|1,1,0]=4 1090 B14R1.40 CCCCCCCCCc1ccsc1 Amb22732729 [0,2,0,0,0,0|2,0,0]=4 1091 B14R1.40 CCCCCCCNCc1ccco1 Amb5261473 [0,2,0,0,0,0|0,0,0]=2 1092 B14R1.40 CCCCCCCNCc1cccs1 Amb838005 [0,2,0,0,0,0|0,1,0]=3 1093 B14R1.40 CCOCCCNCCc1nccs1 Amb17315525 [0,2,0,0,0,0|1,1,0]=4 1094 B14R1.40 OCCNCCCNCc1cccs1 Amb879687 [0,2,0,0,0,0|1,1,0]=4 1095 B14R1.216 CCCCCCCCN1SC=CC1=O Amb19133502 [0,2,0,0,0,0|1,1,0]=4 1096 B14R1.216 CCCCCCCCc1ccsc1Br Amb19958978 [0,2,0,0,0,0|2,0,0]=4 1097 B14R1.216 CCCCCCNCc1cccn1C Amb7758627 [0,2,0,0,0,0|1,0,0]=3 1098 B14R1.216 CCCCCCNCc1ccnn1C Amb31210204 [0,2,0,0,0,0|2,0,0]=4 1099 B14R1.216 CCCCCCNCc1sccc1C Amb838123 [0,2,0,0,0,0|0,1,0]=3 1100 B14R1.216 CCCCCCNCc1scnc1C Amb33496280 [0,2,0,0,0,0|1,1,0]=4 1101 B14R1.216 CCCNCCSCc1occc1C Amb32987621 [0,2,0,0,0,0|1,0,0]=3 1102 B14R1.216 CCNCCCSCc1occc1C Amb32987622 [0,2,0,0,0,0|1,0,0]=3 1103 B14R1.216 CCOCCCNCc1cccn1C Amb6465195 [0,2,0,0,0,0|2,0,0]=4 1104 B14R1.216 CCOCCCNCc1sccc1Br Amb33044614 [0,2,0,0,0,0|1,1,0]=4 1105 B14R1.216 CCOCCCNCc1sccc1C Amb6355733 [0,2,0,0,0,0|1,1,0]=4 1106 B14R1.216 CNCCCCSCc1occc1C Amb32987623 [0,2,0,0,0,0|1,0,0]=3 1107 B14R1.216 COCCCCNCc1cccn1C Amb19053666 [0,2,0,0,0,0|2,0,0]=4 1108 B14R1.216 Cc1ccoc1CSCCCCC#N Amb32987664 [0,2,0,0,0,0|1,0,1]=4 1109 B14R1.216 Cc1ccoc1CSCCCCCBr Amb32987601 [0,2,0,0,0,0|1,0,0]=3 1110 B14R1.216 Cc1ccoc1CSCCCCCCl Amb32987597 [0,2,0,0,0,0|1,0,0]=3 1111 B14R1.216 Cc1ccoc1CSCCCCCN Amb32987624 [0,2,0,0,0,0|1,0,0]=3 1112 B14R1.216 Cc1ccoc1CSCCCCCO Amb32987928 [0,2,0,0,0,0|1,0,0]=3 1113 B14R1.216 Cc1ccoc1CSCCCCCS Amb32987799 [0,2,0,0,0,0|1,0,0]=3 1114 B14R1.216 Cc1ccoc1CSCCOCCBr Amb32987606 [0,2,0,0,0,0|2,0,0]=4 1115 B14R1.216 Cc1ccoc1CSCCOCCCl Amb32987588 [0,2,0,0,0,0|2,0,0]=4 1116 B14R1.216 Cc1ccoc1CSCCOCCN Amb32987699 [0,2,0,0,0,0|2,0,0]=4 1117 B14R1.216 Cc1ccoc1CSCCOCCO Amb32987932 [0,2,0,0,0,0|2,0,0]=4 1118 B14R1.216 Cc1ccoc1CSCCOCCS Amb32987789 [0,2,0,0,0,0|2,0,0]=4 1119 B14R1.427 CC(C)OCCCNCc1ccco1 Amb875960 [0,2,0,0,0,0|1,0,0]=3 1120 B14R1.427 CC(O)CNCCNCc1cccs1 Amb6862007 [0,2,0,0,0,0|1,1,0]=4 1121 B14R1.427 O=C(O)CCCCOCc1ccco1 Amb9207784 [0,2,0,0,0,0|1,0,1]=4 1122 B14R1.609 CCNC(=O)CCNCc1ccco1 Amb19081606 [0,2,0,0,0,0|1,0,1]=4 1123 B14R1.609 CCOC(=O)CCNCc1ccco1 Amb2724671 [0,2,0,0,0,0|1,0,1]=4 1124 B14R1.609 CCOC(=O)CCSCc1ccco1 Amb6356909 [0,2,0,0,0,0|1,0,1]=4 1125 B14R1.916 CCNCC(C)SCc1occc1C Amb32987625 [0,2,0,0,0,0|2,0,0]=4 1126 B14R1.916 Cc1ccoc1CSC(C)CCCN Amb32987727 [0,2,0,0,0,0|2,0,0]=4 1127 B14R1.3343 CCCCC(CC)NCc1ccco1 Amb33496388 [0,2,0,0,0,0|1,0,0]=3 1128 B14R1.3343 CCCCC(CC)NCc1cccs1 Amb33496393 [0,2,0,0,0,0|1,1,0]=4 1129 B14R1.4526 CC(C)CCC(C)NCc1cccs1 Amb6724006 [0,2,0,0,0,0|1,1,0]=4 1130 B14R1.4531 CCCCS(=O)(=O)NCc1ccco1 Amb17895359 [0,2,0,0,0,0|2,0,0]=4 1131 B14R1.168 CC(=O)CCCSCc1occc1C Amb32987875 [0,2,0,0,0,0|1,0,1]=4 1132 B14R1.168 Cc1ccoc1CSCCCC(C)N Amb32987818 [0,2,0,0,0,0|1,0,0]=3 1133 B14R1.168 Cc1ccoc1CSCCCC(C)O Amb32987925 [0,2,0,0,0,0|1,0,0]=3 1134 B14R1.168 Cc1ccoc1CSCCNC(C)C Amb32987620 [0,2,0,0,0,0|2,0,0]=4 1135 B14R1.6454 CC(C)CC(C)NCCc1cccs1 Amb6697779 [0,2,0,0,0,0|1,1,0]=4 1136 B14R1.6454 CN(C)CC(O)COCc1ccco1 Amb2778647 [0,2,0,0,0,0|2,0,0]=4 1137 B14R1.948 CCCC(=O)CSCc1occc1C Amb32987870 [0,2,0,0,0,0|1,0,1]=4 1138 B14R1.948 CCCC(N)CSCc1occc1C Amb32987814 [0,2,0,0,0,0|1,0,0]=3 1139 B14R1.948 CCNC(C)CSCc1occc1C Amb32987813 [0,2,0,0,0,0|2,0,0]=4 1140 B14R1.948 CNCC(C)CSCc1occc1C Amb32987761 [0,2,0,0,0,0|2,0,0]=4 1141 B14R1.948 CNCC(O)CSCc1occc1C Amb32987770 [0,2,0,0,0,0|2,0,0]=4 1142 B14R1.948 COCC(N)CSCc1occc1C Amb32987822 [0,2,0,0,0,0|2,0,0]=4 1143 B14R1.948 COCC(O)CSCc1occc1C Amb32987930 [0,2,0,0,0,0|2,0,0]=4 1144 B14R1.948 Cc1ccoc1CSCC(N)CCO Amb32987821 [0,2,0,0,0,0|2,0,0]=4 1145 B14R1.948 Cc1ccoc1CSCC(O)CCN Amb32987683 [0,2,0,0,0,0|2,0,0]=4 1146 B14R1.6715 CNCC(F)(F)COCc1ccco1 Amb33169814 [0,2,0,0,0,0|2,0,0]=4 1147 B14R1.394 CCC(CC)CNCCc1cccs1 Amb6697754 [0,2,0,0,0,0|1,1,0]=4 1148 B14R1.394 CCN(CC)CCNCc1ccco1 Amb2592331 [0,2,0,0,0,0|2,0,0]=4 1149 B14R1.819 CNC(C)CCSCc1occc1C Amb32987480 [0,2,0,0,0,0|2,0,0]=4 1150 B14R1.819 Cc1ccoc1CSCCC(N)CO Amb32987961 [0,2,0,0,0,0|2,0,0]=4 1151 B14R1.819 Cc1ccoc1CSCCC(O)CN Amb32987500 [0,2,0,0,0,0|2,0,0]=4 1152 B14R1.819 Cc1ccoc1CSCCC(O)CO Amb32987931 [0,2,0,0,0,0|2,0,0]=4 1153 B12R1.8 CCCCCCc1ccccc1 Amb6613187 [0,0,1,1,0,0|1,0,1]=4 1154 B12R1.8 CCCCCCc1ccccn1 Amb6357996 [0,0,1,1,0,0|1,0,1]=4 1155 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [0,0,1,1,0,0|1,0,1]=4 1156 B12R1.8 O=C\C=C/C=C/C1CCCCC1 Amb28322065 [0,0,1,1,0,0|0,0,2]=4 1157 B12R1.18 CCCCC1CCCC=CC1=O Amb28199947 [0,0,1,1,0,0|0,0,2]=4 1158 B12R1.121 CCC1CCCCC1\C=C\CO Amb27960104 [0,0,1,1,0,0|0,0,2]=4 1159 B12R1.215 O[C@H]1C=C=CCCCCCCC1 Amb27665486 [0,0,1,1,0,0|0,0,2]=4 1160 B12R1.329 O=C\C=C\C1CCCCCCC1 Amb28315294 [0,0,1,1,0,0|0,0,2]=4 1161 B12R1.1414 OC\C=C\C=C1CCCCCC1 Amb27589681 [0,0,1,1,0,0|0,0,2]=4 1162 B12R1.28 CCCCCc1cccc(O)c1 Amb8388639 [0,0,1,1,0,0|0,0,2]=4 1163 B12R1.141 C=C1CCCCCCCC(O)C1 Amb28345283 [0,0,1,1,0,0|0,0,2]=4 1164 B12R1.141 CC1=CC(=O)CCCCCCC1 Amb28253959 [0,0,1,1,0,0|0,0,2]=4 1165 B12R1.141 O=C1CCCCCCCC(=O)O1 Amb26420851 [0,0,1,1,0,0|2,0,0]=4 1166 B12R1.1482 C=CCC1(O)CCCCCC1C Amb35721160 [0,0,1,1,0,0|0,0,2]=4 1167 B12R1.1564 C=CCC(O)C1CCCCCC1 Amb28381576 [0,0,1,1,0,0|0,0,2]=4 1168 B12R1.1564 C\C=C\C(=O)C1CCCCCC1 Amb27784027 [0,0,1,1,0,0|0,0,2]=4 1169 B12R1.1564 O=C(\C=C\Cl)C1CCCCCC1 Amb29880240 [0,0,1,1,0,0|1,0,1]=4 1170 B12R2.2 c1cc(C2CCCCC2)no1 Amb24486022 [1,0,0,1,0,0|2,0,0]=4 1171 B12R2.2 c1cc(C2CCCCC2)on1 Amb24352143 [1,0,0,1,0,0|1,0,0]=3 1172 B12R2.2 c1cc(C2CCCCN2)on1 Amb23438252 [1,0,0,1,0,0|2,0,0]=4 1173 B12R2.2 c1cc(C2CCCNC2)on1 Amb18201335 [1,0,0,1,0,0|2,0,0]=4 1174 B12R2.2 c1cc(C2CCCNC2)on1 Amb28994113 [1,0,0,1,0,0|2,0,0]=4 1175 B12R2.2 c1cc(C2CCNCC2)on1 Amb18201337 [1,0,0,1,0,0|2,0,0]=4 1176 B12R2.2 c1cc(C2CCNCC2)on1 Amb32411331 [1,0,0,1,0,0|2,0,0]=4 1177 B12R2.2 c1cnn(C2CCCCC2)c1 Amb18177159 [1,0,0,1,0,0|2,0,0]=4 1178 B12R2.2 c1coc(C2CCCCC2)n1 Amb17399919 [1,0,0,1,0,0|1,0,0]=3 1179 B12R2.2 c1coc(C2CCCCN2)c1 Amb2234909 [1,0,0,1,0,0|1,0,0]=3 1180 B12R2.2 c1coc(C2CCCCN2)n1 Amb27474848 [1,0,0,1,0,0|2,0,0]=4 1181 B12R2.2 c1coc(C2CCCNC2)c1 Amb17399921 [1,0,0,1,0,0|1,0,0]=3 1182 B12R2.2 c1coc(C2CCCNC2)n1 Amb18201308 [1,0,0,1,0,0|2,0,0]=4 1183 B12R2.2 c1coc(C2CCNCC2)c1 Amb17232089 [1,0,0,1,0,0|1,0,0]=3 1184 B12R2.2 c1coc(C2CCNCC2)c1 Amb32666621 [1,0,0,1,0,0|1,0,0]=3 1185 B12R2.2 c1coc(C2CCNCC2)n1 Amb18061836 [1,0,0,1,0,0|2,0,0]=4 1186 B12R2.2 c1coc(C2CCNCC2)n1 Amb28872320 [1,0,0,1,0,0|2,0,0]=4 1187 B12R2.2 c1coc(C2CCNCC2)n1 Amb29083440 [1,0,0,1,0,0|2,0,0]=4 1188 B12R2.2 c1coc(C2CCOCC2)n1 Amb33071677 [1,0,0,1,0,0|2,0,0]=4 1189 B12R2.2 c1coc(C2CNCCN2)c1 Amb10070785 [1,0,0,1,0,0|2,0,0]=4 1190 B12R2.2 c1coc(C2CNCCO2)c1 Amb5750915 [1,0,0,1,0,0|2,0,0]=4 1191 B12R2.2 c1coc(C2COCCN2)c1 Amb5750997 [1,0,0,1,0,0|2,0,0]=4 1192 B12R2.2 c1coc(C2NCCCO2)c1 Amb17334340 [1,0,0,1,0,0|2,0,0]=4 1193 B12R2.2 c1coc(C2OCCCO2)c1 Amb17334343 [1,0,0,1,0,0|2,0,0]=4 1194 B12R2.2 c1coc(C2SCCCS2)c1 Amb27663654 [1,0,0,1,0,0|2,0,0]=4 1195 B12R2.2 c1coc([C@@H]2CCCCN2)c1 Amb26345125 [1,0,0,1,0,0|1,0,0]=3 1196 B12R2.2 c1coc([C@H]2CCCCN2)c1 Amb13886455 [1,0,0,1,0,0|1,0,0]=3 1197 B12R2.2 c1coc([C@H]2CNCCN2)c1 Amb28255322 [1,0,0,1,0,0|2,0,0]=4 1198 B12R2.2 c1csc(C2CCCCC2)n1 Amb10601017 [1,0,0,1,0,0|1,1,0]=4 1199 B12R2.2 c1csc(C2CCCCN2)c1 Amb2234701 [1,0,0,1,0,0|1,1,0]=4 1200 B12R2.2 c1csc(C2CCCCO2)c1 Amb27801059 [1,0,0,1,0,0|1,1,0]=4 1201 B12R2.2 c1csc(C2CCCNC2)c1 Amb35746807 [1,0,0,1,0,0|1,1,0]=4 1202 B12R2.2 c1csc(C2CCCNC2)c1 Amb8009562 [1,0,0,1,0,0|1,1,0]=4 1203 B12R2.2 c1csc(C2CCNCC2)c1 Amb35788799 [1,0,0,1,0,0|1,1,0]=4 1204 B12R2.2 c1csc(C2CCNCC2)c1 Amb6806694 [1,0,0,1,0,0|1,1,0]=4 1205 B12R2.2 c1csc([C@@H]2CCCCN2)c1 Amb26403102 [1,0,0,1,0,0|1,1,0]=4 1206 B12R2.2 c1csc([C@H]2CCCCN2)c1 Amb27801281 [1,0,0,1,0,0|1,1,0]=4 1207 B12R2.2 c1ncc(C2CCCCC2)o1 Amb30019090 [1,0,0,1,0,0|1,0,0]=3 1208 B12R2.2 c1ncc(C2CCCCN2)o1 Amb25350904 [1,0,0,1,0,0|2,0,0]=4 1209 B12R2.2 c1ncc(C2CCCCO2)o1 Amb35652474 [1,0,0,1,0,0|2,0,0]=4 1210 B12R2.2 c1ncc(C2CCCNC2)o1 Amb18201309 [1,0,0,1,0,0|2,0,0]=4 1211 B12R2.2 c1ncc(C2CCCNC2)o1 Amb30584725 [1,0,0,1,0,0|2,0,0]=4 1212 B12R2.2 c1ncc(C2CCCOC2)o1 Amb35652464 [1,0,0,1,0,0|2,0,0]=4 1213 B12R2.2 c1ncc(C2CCNCC2)o1 Amb18201331 [1,0,0,1,0,0|2,0,0]=4 1214 B12R2.2 c1ncc(C2CCNCC2)o1 Amb31156553 [1,0,0,1,0,0|2,0,0]=4 1215 B12R2.2 c1ncc(C2CCOCC2)o1 Amb35647896 [1,0,0,1,0,0|2,0,0]=4 1216 B12R2.10 BrC1CCCC1c2ccco2 Amb28063202 [1,0,0,1,0,0|1,0,0]=3 1217 B12R2.10 BrC1COCC1c2ccco2 Amb35736898 [1,0,0,1,0,0|2,0,0]=4 1218 B12R2.10 CC1CCCC1c2cnco2 Amb35652615 [1,0,0,1,0,0|1,0,0]=3 1219 B12R2.10 CC1CCOC1c2cnco2 Amb35655869 [1,0,0,1,0,0|2,0,0]=4 1220 B12R2.10 CC1CNCC1c2ccco2 Amb27850650 [1,0,0,1,0,0|1,0,0]=3 1221 B12R2.10 CC1OCCC1c2cnco2 Amb35655896 [1,0,0,1,0,0|2,0,0]=4 1222 B12R2.10 CN1CCC[C@H]1c2ccco2 Amb27977855 [1,0,0,1,0,0|1,0,0]=3 1223 B12R2.10 CN1CCC[C@H]1c2ccno2 Amb27250693 [1,0,0,1,0,0|2,0,0]=4 1224 B12R2.10 CN1CCOC1c2ccco2 Amb17334341 [1,0,0,1,0,0|2,0,0]=4 1225 B12R2.10 C[C@@H]1CCN[C@H]1c2ccco2 Amb18201646 [1,0,0,1,0,0|1,0,0]=3 1226 B12R2.10 C[C@@H]1CCN[C@H]1c2cccs2 Amb18826825 [1,0,0,1,0,0|1,1,0]=4 1227 B12R2.10 C[C@H]1CCN[C@@H]1c2ccco2 Amb27420252 [1,0,0,1,0,0|1,0,0]=3 1228 B12R2.10 C[C@H]1CCN[C@@H]1c2cccs2 Amb28060010 [1,0,0,1,0,0|1,1,0]=4 1229 B12R2.10 ClC1CCCC1c2cccs2 Amb19070691 [1,0,0,1,0,0|1,1,0]=4 1230 B12R2.10 ClC1COCC1c2ccco2 Amb35736802 [1,0,0,1,0,0|2,0,0]=4 1231 B12R2.10 NC1CCCC1c2ccco2 Amb28138797 [1,0,0,1,0,0|1,0,0]=3 1232 B12R2.10 NC1CCCC1c2cccs2 Amb18947764 [1,0,0,1,0,0|1,1,0]=4 1233 B12R2.10 NC1CNCC1c2ccco2 Amb32756012 [1,0,0,1,0,0|2,0,0]=4 1234 B12R2.10 NC1COCC1c2ccco2 Amb29877086 [1,0,0,1,0,0|2,0,0]=4 1235 B12R2.10 NN1CCCC1c2ccco2 Amb24423406 [1,0,0,1,0,0|2,0,0]=4 1236 B12R2.10 OC1CCCC1c2ccco2 Amb24718657 [1,0,0,1,0,0|1,0,0]=3 1237 B12R2.10 OC1CCCC1c2cccs2 Amb18182687 [1,0,0,1,0,0|1,1,0]=4 1238 B12R2.10 OC1CCNC1c2ccco2 Amb27623734 [1,0,0,1,0,0|2,0,0]=4 1239 B12R2.10 OC1CNCC1c2ccco2 Amb33213398 [1,0,0,1,0,0|2,0,0]=4 1240 B12R2.10 OC1COCC1c2ccco2 Amb23448390 [1,0,0,1,0,0|2,0,0]=4 1241 B12R2.10 O[C@@H]1CCC[C@H]1c2ccco2 Amb24576983 [1,0,0,1,0,0|1,0,0]=3 1242 B12R2.10 O[C@@H]1CCC[C@H]1c2cccs2 Amb28075163 [1,0,0,1,0,0|1,1,0]=4 1243 B12R2.10 O[C@@H]1CNC[C@H]1c2ccco2 Amb33213561 [1,0,0,1,0,0|2,0,0]=4 1244 B12R2.10 O[C@@H]1COC[C@H]1c2ccco2 Amb32945241 [1,0,0,1,0,0|2,0,0]=4 1245 B12R2.10 O[C@H]1CCC[C@@H]1c2ccco2 Amb28130184 [1,0,0,1,0,0|1,0,0]=3 1246 B12R2.10 O[C@H]1CCC[C@H]1c2ccco2 Amb27650469 [1,0,0,1,0,0|1,0,0]=3 1247 B12R2.12 CC1CCC1Cn2cccn2 Amb32419800 [1,0,0,1,0,0|2,0,0]=4 1248 B12R2.12 OC1CCC1Cc2ccco2 Amb32950896 [1,0,0,1,0,0|1,0,0]=3 1249 B12R2.12 OC1CCC1Cc2cccs2 Amb32945077 [1,0,0,1,0,0|1,1,0]=4 1250 B12R2.14 CCCC1CC1n2cccc2 Amb28240848 [1,0,0,1,0,0|2,0,0]=4 1251 B12R2.14 CCOC1CC1c2cnco2 Amb35652463 [1,0,0,1,0,0|2,0,0]=4 1252 B12R2.14 CNCC1CC1c2ccco2 Amb17605470 [1,0,0,1,0,0|1,0,0]=3 1253 B12R2.14 CNCC1CC1c2cccs2 Amb17605466 [1,0,0,1,0,0|1,1,0]=4 1254 B12R2.98 C1=CCC(Cc2ccco2)C1 Amb29887403 [1,0,0,1,0,0|0,0,2]=4 1255 B12R2.98 c1cc(CN2CCCC2)on1 Amb28188014 [1,0,0,1,0,0|2,0,0]=4 1256 B12R2.98 c1ccn(CC2CCCC2)c1 Amb9371396 [1,0,0,1,0,0|2,0,0]=4 1257 B12R2.98 c1cnn(CC2CCCC2)c1 Amb25978601 [1,0,0,1,0,0|2,0,0]=4 1258 B12R2.98 c1coc(CC2CCCN2)c1 Amb28424274 [1,0,0,1,0,0|1,0,0]=3 1259 B12R2.98 c1coc(CC2CCNC2)c1 Amb18563445 [1,0,0,1,0,0|1,0,0]=3 1260 B12R2.98 c1coc(CC2CCNC2)c1 Amb35745586 [1,0,0,1,0,0|1,0,0]=3 1261 B12R2.98 c1coc(CN2CCCC2)c1 Amb27210177 [1,0,0,1,0,0|1,0,0]=3 1262 B12R2.98 c1coc(CN2CCCN2)c1 Amb27631120 [1,0,0,1,0,0|2,0,0]=4 1263 B12R2.98 c1coc(CN2CCCO2)c1 Amb27802231 [1,0,0,1,0,0|2,0,0]=4 1264 B12R2.98 c1coc(OC2CCNC2)c1 Amb33360912 [1,0,0,1,0,0|2,0,0]=4 1265 B12R2.98 c1csc(CC2CCCN2)c1 Amb13951906 [1,0,0,1,0,0|1,1,0]=4 1266 B12R2.98 c1csc(CC2CCCN2)c1 Amb4134993 [1,0,0,1,0,0|1,1,0]=4 1267 B12R2.98 c1csc(CC2CCNC2)c1 Amb18563821 [1,0,0,1,0,0|1,1,0]=4 1268 B12R2.98 c1csc(CN2CCCC2)c1 Amb25308164 [1,0,0,1,0,0|1,1,0]=4 1269 B12R2.98 c1csc(C[C@@H]2CCCN2)c1 Amb33456986 [1,0,0,1,0,0|1,1,0]=4 1270 B12R2.98 c1csc(C[C@H]2CCCN2)c1 Amb27777321 [1,0,0,1,0,0|1,1,0]=4 1271 B12R2.98 c1ncc(CC2CCCC2)o1 Amb30019098 [1,0,0,1,0,0|1,0,0]=3 1272 B12R2.98 c1ncc(CC2CCCN2)o1 Amb33415277 [1,0,0,1,0,0|2,0,0]=4 1273 B12R2.98 c1ncc(CC2CCCO2)o1 Amb35652448 [1,0,0,1,0,0|2,0,0]=4 1274 B12R2.98 c1ncc(CC2CCNC2)o1 Amb33415238 [1,0,0,1,0,0|2,0,0]=4 1275 B12R2.98 c1ncc(CC2CCOC2)o1 Amb35652444 [1,0,0,1,0,0|2,0,0]=4 1276 B12R2.144 CNCC1CCc2occc21 Amb27963175 [1,0,0,1,0,0|1,0,0]=3 1277 B12R2.144 NCCC1CCc2occc21 Amb18201655 [1,0,0,1,0,0|1,0,0]=3 1278 B12R2.144 NCCC1CCc2oncc21 Amb27966256 [1,0,0,1,0,0|2,0,0]=4 1279 B12R2.144 NCCC1CCc2sccc21 Amb18199400 [1,0,0,1,0,0|1,1,0]=4 1280 B12R2.229 CC1CNCCc2occc21 Amb18201639 [1,0,0,1,0,0|1,0,0]=3 1281 B12R2.229 CC1CNCCc2sccc21 Amb18199382 [1,0,0,1,0,0|1,1,0]=4 1282 B12R2.229 NC1CCCCc2sccc21 Amb28282749 [1,0,0,1,0,0|1,1,0]=4 1283 B12R2.315 BrCC1CCCc2cccn21 Amb32681981 [1,0,0,1,0,0|2,0,0]=4 1284 B12R2.315 BrCC1CCCc2sccc21 Amb27805664 [1,0,0,1,0,0|1,1,0]=4 1285 B12R2.315 CCC1CCCc2scnc21 Amb27758947 [1,0,0,1,0,0|1,1,0]=4 1286 B12R2.315 CCC1CNCc2sccc21 Amb26605483 [1,0,0,1,0,0|1,1,0]=4 1287 B12R2.315 CCC1NCCc2occc21 Amb32647471 [1,0,0,1,0,0|1,0,0]=3 1288 B12R2.315 CCC1NCCc2sccc21 Amb52093 [1,0,0,1,0,0|1,1,0]=4 1289 B12R2.315 CCC1NCCc2sccc21 Amb9703887 [1,0,0,1,0,0|1,1,0]=4 1290 B12R2.315 CNC1CCCc2occc21 Amb27839752 [1,0,0,1,0,0|1,0,0]=3 1291 B12R2.315 COC1OCCc2occc21 Amb27823280 [1,0,0,1,0,0|2,0,0]=4 1292 B12R2.315 ClCC1CCCc2cccn21 Amb32681982 [1,0,0,1,0,0|2,0,0]=4 1293 B12R2.315 NCC1CCCc2sccc21 Amb18948477 [1,0,0,1,0,0|1,1,0]=4 1294 B12R2.315 OCC1CCCc2cccn21 Amb27659460 [1,0,0,1,0,0|2,0,0]=4 1295 B12R2.315 OCC1NCCc2occc21 Amb25057457 [1,0,0,1,0,0|2,0,0]=4 1296 B12R2.315 ONC1CCCc2occc21 Amb28048380 [1,0,0,1,0,0|2,0,0]=4 1297 B12R2.382 c1cn2c(n1)CCCCCC2 Amb19892433 [1,0,0,1,0,0|2,0,0]=4 1298 B12R2.2056 c1cnn(CCC2CCC2)c1 Amb28347257 [1,0,0,1,0,0|2,0,0]=4 1299 B12R2.2056 c1coc(CNC2CCC2)c1 Amb18989293 [1,0,0,1,0,0|1,0,0]=3 1300 B12R2.2056 c1coc(COC2CNC2)c1 Amb25991277 [1,0,0,1,0,0|2,0,0]=4 1301 B12R2.2056 c1coc(CSC2CCC2)c1 Amb27768360 [1,0,0,1,0,0|1,0,0]=3 1302 B12R2.2056 c1coc(CSC2CNC2)c1 Amb18801396 [1,0,0,1,0,0|2,0,0]=4 1303 B12R2.2056 c1coc(NCC2CCC2)n1 Amb26948661 [1,0,0,1,0,0|2,0,0]=4 1304 B12R2.2056 c1coc(SCC2CCC2)n1 Amb27653951 [1,0,0,1,0,0|2,0,0]=4 1305 B12R2.2056 c1csc(CCC2CNC2)c1 Amb28424016 [1,0,0,1,0,0|1,1,0]=4 1306 B12R2.2056 c1csc(CCN2CCC2)c1 Amb27956348 [1,0,0,1,0,0|1,1,0]=4 1307 B12R2.2056 c1csc(CNC2CCC2)c1 Amb18989362 [1,0,0,1,0,0|1,1,0]=4 1308 B12R2.2056 c1csc(SCC2CCC2)c1 Amb27176844 [1,0,0,1,0,0|1,1,0]=4 1309 B12R2.2383 c1ccn(CCCC2CC2)c1 Amb27986828 [1,0,0,1,0,0|2,0,0]=4 1310 B12R2.2383 c1coc(CCNC2CC2)c1 Amb27269850 [1,0,0,1,0,0|1,0,0]=3 1311 B12R2.2383 c1coc(CCNC2CC2)n1 Amb18224308 [1,0,0,1,0,0|2,0,0]=4 1312 B12R2.2383 c1coc(CNCC2CC2)c1 Amb6686736 [1,0,0,1,0,0|1,0,0]=3 1313 B12R2.2383 c1coc(COCC2CO2)c1 Amb9722463 [1,0,0,1,0,0|2,0,0]=4 1314 B12R2.2383 c1coc(SCCC2CC2)n1 Amb27270337 [1,0,0,1,0,0|2,0,0]=4 1315 B12R2.2383 c1csc(CCCC2CO2)c1 Amb28387456 [1,0,0,1,0,0|1,1,0]=4 1316 B12R2.2383 c1csc(CCNC2CC2)c1 Amb8853844 [1,0,0,1,0,0|1,1,0]=4 1317 B12R2.2383 c1csc(CNCC2CC2)c1 Amb6686733 [1,0,0,1,0,0|1,1,0]=4 1318 B12R2.2383 c1csc(SCCC2CC2)c1 Amb27270323 [1,0,0,1,0,0|1,1,0]=4 1319 B14R2.3 BrCCCC1CCc2ccccc21 Amb26468554 [0,0,0,1,0,1|2,0,0]=4 1320 B14R2.3 CCCCC1CNc2ccccc21 Amb27830325 [0,0,0,1,0,1|2,0,0]=4 1321 B14R2.3 CCCCN1CCc2ccccc21 Amb6360682 [0,0,0,1,0,1|2,0,0]=4 1322 B14R2.3 CCCCN1CCc2ncccc21 Amb28070384 [0,0,0,1,0,1|2,0,0]=4 1323 B14R2.3 CCCNC1CCc2ccccc21 Amb9718693 [0,0,0,1,0,1|2,0,0]=4 1324 B14R2.3 CCNCC1CCc2cccnc21 Amb27416022 [0,0,0,1,0,1|2,0,0]=4 1325 B14R2.3 CCSCC1CCc2ccccc21 Amb27260140 [0,0,0,1,0,1|2,0,0]=4 1326 B14R2.3 CNCCC1CCc2ccccc21 Amb18127539 [0,0,0,1,0,1|2,0,0]=4 1327 B14R2.3 NCCCC1CCc2cccnc21 Amb27254623 [0,0,0,1,0,1|2,0,0]=4 1328 B14R2.3 OCCCC1CCc2ccccc21 Amb24353166 [0,0,0,1,0,1|2,0,0]=4 1329 B14R2.3 SCCCC1CCc2ccccc21 Amb33144215 [0,0,0,1,0,1|2,0,0]=4 1330 B14R2.6 c1cc(CC2CCCCN2)ccn1 Amb2235427 [0,0,0,1,0,1|2,0,0]=4 1331 B14R2.6 c1cc(CC2CCCNC2)ccn1 Amb23598849 [0,0,0,1,0,1|2,0,0]=4 1332 B14R2.6 c1cc(CC2CCCNC2)ncn1 Amb25711509 [0,0,0,1,0,1|2,0,0]=4 1333 B14R2.6 c1cc(CC2CCNCC2)ccn1 Amb10068864 [0,0,0,1,0,1|2,0,0]=4 1334 B14R2.6 c1cc(CC2CCNCC2)ccn1 Amb3933639 [0,0,0,1,0,1|2,0,0]=4 1335 B14R2.6 c1cc(CC2CCNCC2)ncn1 Amb18195764 [0,0,0,1,0,1|2,0,0]=4 1336 B14R2.6 c1cc(CN2CCCCC2)ccn1 Amb22751939 [0,0,0,1,0,1|2,0,0]=4 1337 B14R2.6 c1cc(NC2CCCCC2)ccn1 Amb1147434 [0,0,0,1,0,1|2,0,0]=4 1338 B14R2.6 c1cc(SC2CCCCC2)ccn1 Amb27802066 [0,0,0,1,0,1|2,0,0]=4 1339 B14R2.6 c1ccc(CC2CCCCC2)cc1 Amb4020088 [0,0,0,1,0,1|1,0,0]=3 1340 B14R2.6 c1ccc(CC2CCCCN2)cc1 Amb17659191 [0,0,0,1,0,1|2,0,0]=4 1341 B14R2.6 c1ccc(CC2CCCCN2)cc1 Amb9768306 [0,0,0,1,0,1|2,0,0]=4 1342 B14R2.6 c1ccc(CC2CCCCN2)nc1 Amb2237229 [0,0,0,1,0,1|2,0,0]=4 1343 B14R2.6 c1ccc(CC2CCCCN2)nc1 Amb32644425 [0,0,0,1,0,1|2,0,0]=4 1344 B14R2.6 c1ccc(CC2CCCC[NH2+]2)cc1 Amb33513128 [0,0,0,1,0,1|2,0,0]=4 1345 B14R2.6 c1ccc(CC2CCCNC2)cc1 Amb10068913 [0,0,0,1,0,1|2,0,0]=4 1346 B14R2.6 c1ccc(CC2CCCNC2)cc1 Amb2695119 [0,0,0,1,0,1|2,0,0]=4 1347 B14R2.6 c1ccc(CC2CCCNC2)nc1 Amb22171199 [0,0,0,1,0,1|2,0,0]=4 1348 B14R2.6 c1ccc(CC2CCCNC2)nc1 Amb35745617 [0,0,0,1,0,1|2,0,0]=4 1349 B14R2.6 c1ccc(CC2CCC[NH2+]C2)cc1 Amb33513127 [0,0,0,1,0,1|2,0,0]=4 1350 B14R2.6 c1ccc(CC2CCNCC2)cc1 Amb20248128 [0,0,0,1,0,1|2,0,0]=4 1351 B14R2.6 c1ccc(CC2CCNCC2)cc1 Amb2792831 [0,0,0,1,0,1|2,0,0]=4 1352 B14R2.6 c1ccc(CC2CCNCC2)nc1 Amb10068862 [0,0,0,1,0,1|2,0,0]=4 1353 B14R2.6 c1ccc(CC2CCNCC2)nc1 Amb19373460 [0,0,0,1,0,1|2,0,0]=4 1354 B14R2.6 c1ccc(CC2CCNCC2)nc1 Amb3933634 [0,0,0,1,0,1|2,0,0]=4 1355 B14R2.6 c1ccc(CN2CCCCC2)cc1 Amb1694839 [0,0,0,1,0,1|2,0,0]=4 1356 B14R2.6 c1ccc(CN2CCCCC2)cc1 Amb24064580 [0,0,0,1,0,1|2,0,0]=4 1357 B14R2.6 c1ccc(CN2CCCCC2)nc1 Amb33718819 [0,0,0,1,0,1|2,0,0]=4 1358 B14R2.6 c1ccc(C[C@@H]2CCCCN2)cc1 Amb22892828 [0,0,0,1,0,1|2,0,0]=4 1359 B14R2.6 c1ccc(C[C@H]2CCCCN2)cc1 Amb27607714 [0,0,0,1,0,1|2,0,0]=4 1360 B14R2.6 c1ccc(C[C@H]2CCCNC2)cc1 Amb25861291 [0,0,0,1,0,1|2,0,0]=4 1361 B14R2.6 c1ccc(NC2CCCCC2)cc1 Amb2725530 [0,0,0,1,0,1|2,0,0]=4 1362 B14R2.6 c1ccc(NC2CCCCC2)cc1 Amb2725642 [0,0,0,1,0,1|2,0,0]=4 1363 B14R2.6 c1ccc(NC2CCCCC2)nc1 Amb1103846 [0,0,0,1,0,1|2,0,0]=4 1364 B14R2.6 c1ccc(OC2CCCCC2)cc1 Amb5717454 [0,0,0,1,0,1|2,0,0]=4 1365 B14R2.6 c1ccc(OC2CCCCC2)nc1 Amb27950028 [0,0,0,1,0,1|2,0,0]=4 1366 B14R2.6 c1ccc(SC2CCCCC2)cc1 Amb25316653 [0,0,0,1,0,1|2,0,0]=4 1367 B14R2.6 c1cnc(CC2CCCCC2)cn1 Amb26855252 [0,0,0,1,0,1|1,0,0]=3 1368 B14R2.6 c1cnc(CC2CCCNC2)cn1 Amb20062048 [0,0,0,1,0,1|2,0,0]=4 1369 B14R2.6 c1cnc(CC2CCCNC2)nc1 Amb20062077 [0,0,0,1,0,1|2,0,0]=4 1370 B14R2.6 c1cnc(CC2CCNCC2)cn1 Amb20062047 [0,0,0,1,0,1|2,0,0]=4 1371 B14R2.6 c1cnc(CC2CCNCC2)nc1 Amb10844930 [0,0,0,1,0,1|2,0,0]=4 1372 B14R2.6 c1cnc(CN2CCCCC2)cn1 Amb29849746 [0,0,0,1,0,1|2,0,0]=4 1373 B14R2.6 c1cnc(NC2CCCCC2)cn1 Amb6625311 [0,0,0,1,0,1|2,0,0]=4 1374 B14R2.6 c1cnc(NC2CCCCC2)nc1 Amb6656678 [0,0,0,1,0,1|2,0,0]=4 1375 B14R2.6 c1cnc(OC2CCCCC2)cn1 Amb31199709 [0,0,0,1,0,1|2,0,0]=4 1376 B14R2.6 c1cnc(OC2CCCCC2)nc1 Amb31199710 [0,0,0,1,0,1|2,0,0]=4 1377 B14R2.6 c1cncc(CC2CCCCN2)c1 Amb24085209 [0,0,0,1,0,1|2,0,0]=4 1378 B14R2.6 c1cncc(CC2CCCNC2)c1 Amb10068907 [0,0,0,1,0,1|2,0,0]=4 1379 B14R2.6 c1cncc(CC2CCCNC2)c1 Amb8009650 [0,0,0,1,0,1|2,0,0]=4 1380 B14R2.6 c1cncc(CC2CCNCC2)c1 Amb10068863 [0,0,0,1,0,1|2,0,0]=4 1381 B14R2.6 c1cncc(CC2CCNCC2)c1 Amb8009636 [0,0,0,1,0,1|2,0,0]=4 1382 B14R2.6 c1cncc(CN2CCCCC2)c1 Amb24184790 [0,0,0,1,0,1|2,0,0]=4 1383 B14R2.6 c1cncc(NC2CCCCC2)c1 Amb6686644 [0,0,0,1,0,1|2,0,0]=4 1384 B14R2.6 c1cnnc(CC2CCNCC2)c1 Amb20062046 [0,0,0,1,0,1|2,0,0]=4 1385 B14R2.6 c1cnnc(NC2CCCCC2)c1 Amb18961843 [0,0,0,1,0,1|2,0,0]=4 1386 B14R2.14 CCC1CCCN1c2ncccn2 Amb27853470 [0,0,0,1,0,1|2,0,0]=4 1387 B14R2.14 CCC1CCNC1c2ccccc2 Amb3788233 [0,0,0,1,0,1|2,0,0]=4 1388 B14R2.14 CCC1CNCC1c2ccccc2 Amb24563782 [0,0,0,1,0,1|2,0,0]=4 1389 B14R2.14 CCC1NCCC1c2ccccn2 Amb18285663 [0,0,0,1,0,1|2,0,0]=4 1390 B14R2.14 CCC1NCCC1c2cccnc2 Amb18285679 [0,0,0,1,0,1|2,0,0]=4 1391 B14R2.14 CCC1NCCC1c2ccncc2 Amb18285677 [0,0,0,1,0,1|2,0,0]=4 1392 B14R2.14 CCC1NCCC1c2cnccn2 Amb35600827 [0,0,0,1,0,1|2,0,0]=4 1393 B14R2.14 CC[C@@H]1CCN[C@H]1c2ccccc2 Amb27437908 [0,0,0,1,0,1|2,0,0]=4 1394 B14R2.14 CC[C@H]1CCN[C@H]1c2ccccc2 Amb27623237 [0,0,0,1,0,1|2,0,0]=4 1395 B14R2.14 CNC1CCCC1c2ccccc2 Amb18286605 [0,0,0,1,0,1|2,0,0]=4 1396 B14R2.14 CN[C@@H]1CCC[C@H]1c2ccccc2 Amb27944980 [0,0,0,1,0,1|2,0,0]=4 1397 B14R2.14 ClCC1CCCC1c2ccccc2 Amb27816406 [0,0,0,1,0,1|2,0,0]=4 1398 B14R2.14 NCC1CCCC1c2ccccc2 Amb26980483 [0,0,0,1,0,1|2,0,0]=4 1399 B14R2.14 NCC1CCCC1c2ccccc2 Amb28556058 [0,0,0,1,0,1|2,0,0]=4 1400 B14R2.14 OC[C@@H]1CCC[C@H]1c2ccccc2 Amb27844164 [0,0,0,1,0,1|2,0,0]=4 1401 B14R2.24 BrC1CCCCC1c2cnccn2 Amb27264251 [0,0,0,1,0,1|2,0,0]=4 1402 B14R2.24 CC1CCCCN1c2ccccc2 Amb27448804 [0,0,0,1,0,1|2,0,0]=4 1403 B14R2.24 CC1CCCCN1c2ccccn2 Amb26500672 [0,0,0,1,0,1|2,0,0]=4 1404 B14R2.24 CC1CCCCN1c2ncccn2 Amb27805993 [0,0,0,1,0,1|2,0,0]=4 1405 B14R2.24 CC1CCCNC1c2ccccc2 Amb6271697 [0,0,0,1,0,1|2,0,0]=4 1406 B14R2.24 CC1CCNCC1c2ccccc2 Amb26855487 [0,0,0,1,0,1|2,0,0]=4 1407 B14R2.24 CC1CCNCC1c2ccccc2 Amb30051609 [0,0,0,1,0,1|2,0,0]=4 1408 B14R2.24 CC1CNCCC1c2ccccc2 Amb19148751 [0,0,0,1,0,1|2,0,0]=4 1409 B14R2.24 CC1CNCCC1c2cccnc2 Amb27664339 [0,0,0,1,0,1|2,0,0]=4 1410 B14R2.24 CC1CNCCC1c2cnccn2 Amb27450864 [0,0,0,1,0,1|2,0,0]=4 1411 B14R2.24 CC1NCCCC1c2ccccc2 Amb18647927 [0,0,0,1,0,1|2,0,0]=4 1412 B14R2.24 CN1CCCCC1c2ccccc2 Amb28250142 [0,0,0,1,0,1|2,0,0]=4 1413 B14R2.24 CN1CCCCC1c2ccccn2 Amb26361640 [0,0,0,1,0,1|2,0,0]=4 1414 B14R2.24 CN1CCCCC1c2ccncc2 Amb23444587 [0,0,0,1,0,1|2,0,0]=4 1415 B14R2.24 CN1CCCC[C@@H]1c2ccccc2 Amb27660897 [0,0,0,1,0,1|2,0,0]=4 1416 B14R2.24 CN1CCCC[C@H]1c2cccnc2 Amb26344183 [0,0,0,1,0,1|2,0,0]=4 1417 B14R2.24 C[C@@H]1CCCN[C@@H]1c2ccccc2 Amb27252172 [0,0,0,1,0,1|2,0,0]=4 1418 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682441 [0,0,0,1,0,1|2,0,0]=4 1419 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682462 [0,0,0,1,0,1|2,0,0]=4 1420 B14R2.24 C[C@H]1CCCCN1c2ccccn2 Amb27172339 [0,0,0,1,0,1|2,0,0]=4 1421 B14R2.24 C[C@H]1CCCN[C@H]1c2ccccc2 Amb28325679 [0,0,0,1,0,1|2,0,0]=4 1422 B14R2.24 NC1CCCCC1c2ccccc2 Amb33553374 [0,0,0,1,0,1|2,0,0]=4 1423 B14R2.24 NC1CCCCC1c2ccccc2 Amb9620845 [0,0,0,1,0,1|2,0,0]=4 1424 B14R2.24 NC1CCCCC1c2cccnc2 Amb18280246 [0,0,0,1,0,1|2,0,0]=4 1425 B14R2.24 NC1CCCCC1c2ccncc2 Amb18196533 [0,0,0,1,0,1|2,0,0]=4 1426 B14R2.24 NC1CCCCC1c2cnccn2 Amb28365816 [0,0,0,1,0,1|2,0,0]=4 1427 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 Amb22757825 [0,0,0,1,0,1|2,0,0]=4 1428 B14R2.24 N[C@H]1CCCC[C@@H]1c2ccccc2 Amb27659258 [0,0,0,1,0,1|2,0,0]=4 1429 B14R2.24 OC1CCCCC1c2ccccc2 Amb4005667 [0,0,0,1,0,1|2,0,0]=4 1430 B14R2.24 OC1CCCCC1c2ccccn2 Amb2792390 [0,0,0,1,0,1|2,0,0]=4 1431 B14R2.24 OC1CCCCC1c2cccnc2 Amb18804651 [0,0,0,1,0,1|2,0,0]=4 1432 B14R2.24 OC1CCCCC1c2cnccn2 Amb27644235 [0,0,0,1,0,1|2,0,0]=4 1433 B14R2.24 O[C@@H]1CCCCC1c2ccccc2 Amb27179098 [0,0,0,1,0,1|2,0,0]=4 1434 B14R2.24 O[C@@H]1CCCC[C@@H]1c2ccccc2 Amb27844166 [0,0,0,1,0,1|2,0,0]=4 1435 B14R2.24 O[C@@H]1CCCC[C@@H]1c2cccnc2 Amb33457487 [0,0,0,1,0,1|2,0,0]=4 1436 B14R2.24 O[C@@H]1CCCC[C@H]1c2ccccc2 Amb8384673 [0,0,0,1,0,1|2,0,0]=4 1437 B14R2.24 O[C@@H]1CCCC[C@H]1c2ccccn2 Amb17934237 [0,0,0,1,0,1|2,0,0]=4 1438 B14R2.24 O[C@@H]1CCCC[C@H]1c2cccnc2 Amb27775465 [0,0,0,1,0,1|2,0,0]=4 1439 B14R2.24 O[C@@H]1CCCC[C@H]1c2cnccn2 Amb33213603 [0,0,0,1,0,1|2,0,0]=4 1440 B14R2.24 O[C@H]1CCCC[C@@H]1c2ccccc2 Amb20242422 [0,0,0,1,0,1|2,0,0]=4 1441 B14R2.24 O[C@H]1CCCC[C@H]1c2ccccc2 Amb28066562 [0,0,0,1,0,1|2,0,0]=4 1442 B14R2.24 O[C@H]1CCCC[C@H]1c2cccnc2 Amb27266039 [0,0,0,1,0,1|2,0,0]=4 1443 B14R2.24 SC1CCCCC1c2ccccc2 Amb26490747 [0,0,0,1,0,1|2,0,0]=4 1444 B14R2.30 BrC1CCCC1Cc2cccnc2 Amb27607039 [0,0,0,1,0,1|2,0,0]=4 1445 B14R2.30 BrC1CCCC1Cc2ccncc2 Amb27832072 [0,0,0,1,0,1|2,0,0]=4 1446 B14R2.30 CC1CCCC1Nc2ccccc2 Amb27470643 [0,0,0,1,0,1|2,0,0]=4 1447 B14R2.30 CC1CCCC1Nc2ccccn2 Amb27272983 [0,0,0,1,0,1|2,0,0]=4 1448 B14R2.30 CC1CCCC1Nc2ccncc2 Amb27221797 [0,0,0,1,0,1|2,0,0]=4 1449 B14R2.30 CC1CCCC1Nc2ccncn2 Amb27171834 [0,0,0,1,0,1|2,0,0]=4 1450 B14R2.30 CC1CCCN1Cc2ccccc2 Amb27771867 [0,0,0,1,0,1|2,0,0]=4 1451 B14R2.30 CC1CCCN1Cc2ccccn2 Amb28400555 [0,0,0,1,0,1|2,0,0]=4 1452 B14R2.30 CC1CCCN1Cc2cccnc2 Amb28349573 [0,0,0,1,0,1|2,0,0]=4 1453 B14R2.30 CC1CCN[C@H]1Cc2ccccc2 Amb27947239 [0,0,0,1,0,1|2,0,0]=4 1454 B14R2.30 CC1CNCC1Cc2ccccc2 Amb28056531 [0,0,0,1,0,1|2,0,0]=4 1455 B14R2.30 CC1NCCC1Cc2ccccc2 Amb18960801 [0,0,0,1,0,1|2,0,0]=4 1456 B14R2.30 C[C@@H]1CCN[C@H]1Cc2ccccc2 Amb18197090 [0,0,0,1,0,1|2,0,0]=4 1457 B14R2.30 C[C@@H]1CNC[C@H]1Cc2ccccc2 Amb33191275 [0,0,0,1,0,1|2,0,0]=4 1458 B14R2.30 C[C@H]1CCN[C@@H]1Cc2ccccc2 Amb27624379 [0,0,0,1,0,1|2,0,0]=4 1459 B14R2.30 ClC1CCCC1Cc2ccncc2 Amb27181063 [0,0,0,1,0,1|2,0,0]=4 1460 B14R2.30 NC1CCCC1Cc2ccccc2 Amb18284144 [0,0,0,1,0,1|2,0,0]=4 1461 B14R2.30 NC1CCCC1Cc2ccccn2 Amb33548687 [0,0,0,1,0,1|2,0,0]=4 1462 B14R2.30 NC1CCCC1Cc2cccnc2 Amb18196515 [0,0,0,1,0,1|2,0,0]=4 1463 B14R2.30 NC1CCCC1Cc2ccncc2 Amb18196514 [0,0,0,1,0,1|2,0,0]=4 1464 B14R2.30 N[C@H]1CCC[C@H]1Cc2ccccc2 Amb27244825 [0,0,0,1,0,1|2,0,0]=4 1465 B14R2.30 OC1CCCC1Cc2ccccc2 Amb18808902 [0,0,0,1,0,1|2,0,0]=4 1466 B14R2.30 OC1CCCC1Cc2ccccn2 Amb26968273 [0,0,0,1,0,1|2,0,0]=4 1467 B14R2.30 OC1CCCC1Cc2cccnc2 Amb24672858 [0,0,0,1,0,1|2,0,0]=4 1468 B14R2.30 OC1CCCC1Cc2ccncc2 Amb26333457 [0,0,0,1,0,1|2,0,0]=4 1469 B14R2.30 OC1CCCC1Cc2cnccn2 Amb30007700 [0,0,0,1,0,1|2,0,0]=4 1470 B14R2.30 OC1CCC[C@@H]1Cc2ccccc2 Amb27260244 [0,0,0,1,0,1|2,0,0]=4 1471 B14R2.30 O[C@@H]1CCC[C@@H]1Cc2ccccc2 Amb27452089 [0,0,0,1,0,1|2,0,0]=4 1472 B14R2.30 O[C@@H]1CCC[C@H]1Cc2ccccc2 Amb26905499 [0,0,0,1,0,1|2,0,0]=4 1473 B14R2.30 O[C@@H]1CCC[C@H]1Cc2ccccn2 Amb32945202 [0,0,0,1,0,1|2,0,0]=4 1474 B14R2.30 O[C@@H]1CCC[C@H]1Cc2cccnc2 Amb32944668 [0,0,0,1,0,1|2,0,0]=4 1475 B14R2.30 O[C@@H]1CCC[C@H]1Cc2ccncc2 Amb33213814 [0,0,0,1,0,1|2,0,0]=4 1476 B14R2.30 O[C@H]1CCC[C@@H]1Cc2ccccn2 Amb27880701 [0,0,0,1,0,1|2,0,0]=4 1477 B14R2.31 CC1CCC1CNc2ccccn2 Amb28434846 [0,0,0,1,0,1|2,0,0]=4 1478 B14R2.31 CC1CCC1CNc2ccncc2 Amb27861091 [0,0,0,1,0,1|2,0,0]=4 1479 B14R2.31 CC1CCC1COc2ccccc2 Amb23455994 [0,0,0,1,0,1|2,0,0]=4 1480 B14R2.31 CC1CCC1NCc2ccccc2 Amb27470421 [0,0,0,1,0,1|2,0,0]=4 1481 B14R2.31 CC1CCC1NCc2ccncc2 Amb28399192 [0,0,0,1,0,1|2,0,0]=4 1482 B14R2.31 CC1CCC1NCc2ncccn2 Amb27188565 [0,0,0,1,0,1|2,0,0]=4 1483 B14R2.31 OC1CCC1CCc2ccccc2 Amb32944290 [0,0,0,1,0,1|2,0,0]=4 1484 B14R2.33 NCC[C@@H]1C[C@H]1Cc2ccccc2 Amb32721299 [0,0,0,1,0,1|2,0,0]=4 1485 B14R2.33 OCC[C@@H]1C[C@H]1Cc2ccccc2 Amb32646037 [0,0,0,1,0,1|2,0,0]=4 1486 B14R2.35 CNCC1CCC1c2cccnc2 Amb28346518 [0,0,0,1,0,1|2,0,0]=4 1487 B14R2.35 CNCC1CCC1c2cnccn2 Amb28046631 [0,0,0,1,0,1|2,0,0]=4 1488 B14R2.49 C[C@H]1C[C@@H]1CNCc2ccccc2 Amb27420014 [0,0,0,1,0,1|2,0,0]=4 1489 B14R2.78 CCC1CCC1Nc2cccnc2 Amb28349700 [0,0,0,1,0,1|2,0,0]=4 1490 B14R2.78 CCC1CCN1Cc2cccnc2 Amb27854191 [0,0,0,1,0,1|2,0,0]=4 1491 B14R2.78 NCC1CCC1Cc2ccccc2 Amb27609004 [0,0,0,1,0,1|2,0,0]=4 1492 B14R2.78 NCC1CCC1Cc2ccncc2 Amb27609050 [0,0,0,1,0,1|2,0,0]=4 1493 B14R2.87 CCC1CC1CNc2cccnn2 Amb27858658 [0,0,0,1,0,1|2,0,0]=4 1494 B14R2.87 CC[C@@H]1C[C@H]1CNc2ccncc2 Amb28399725 [0,0,0,1,0,1|2,0,0]=4 1495 B14R2.87 CC[C@@H]1C[C@H]1CNc2ccncn2 Amb27975005 [0,0,0,1,0,1|2,0,0]=4 1496 B14R2.87 NCC1CC1CCc2ccccc2 Amb32951857 [0,0,0,1,0,1|2,0,0]=4 1497 B14R2.87 NC[C@@H]1C[C@H]1CCc2ccccc2 Amb32951856 [0,0,0,1,0,1|2,0,0]=4 1498 B14R2.101 c1cc(CCC2CCCN2)ccn1 Amb8010081 [0,0,0,1,0,1|2,0,0]=4 1499 B14R2.101 c1cc(CCN2CCCC2)ccn1 Amb590690 [0,0,0,1,0,1|2,0,0]=4 1500 B14R2.101 c1cc(CNC2CCCC2)ccn1 Amb6356058 [0,0,0,1,0,1|2,0,0]=4 1501 B14R2.101 c1cc(CNC2CCCC2)ccn1 Amb6767951 [0,0,0,1,0,1|2,0,0]=4 1502 B14R2.101 c1cc(CNC2CCCC2)ncn1 Amb18300828 [0,0,0,1,0,1|2,0,0]=4 1503 B14R2.101 c1cc(CSC2CCCC2)ccn1 Amb27853668 [0,0,0,1,0,1|2,0,0]=4 1504 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb10609225 [0,0,0,1,0,1|2,0,0]=4 1505 B14R2.101 c1ccc(CCC2CCCN2)cc1 Amb3788238 [0,0,0,1,0,1|2,0,0]=4 1506 B14R2.101 c1ccc(CCC2CCCN2)nc1 Amb8010080 [0,0,0,1,0,1|2,0,0]=4 1507 B14R2.101 c1ccc(CCC2CCNC2)cc1 Amb3940961 [0,0,0,1,0,1|2,0,0]=4 1508 B14R2.101 c1ccc(CCC2CCNC2)nc1 Amb27404207 [0,0,0,1,0,1|2,0,0]=4 1509 B14R2.101 c1ccc(CC[C@@H]2CCCN2)cc1 Amb27647579 [0,0,0,1,0,1|2,0,0]=4 1510 B14R2.101 c1ccc(CC[C@@H]2CCCN2)nc1 Amb26590908 [0,0,0,1,0,1|2,0,0]=4 1511 B14R2.101 c1ccc(CC[C@@H]2CCCN2)nc1 Amb33456233 [0,0,0,1,0,1|2,0,0]=4 1512 B14R2.101 c1ccc(CC[C@@H]2CCNC2)cc1 Amb27607109 [0,0,0,1,0,1|2,0,0]=4 1513 B14R2.101 c1ccc(CC[C@H]2CCCN2)nc1 Amb33456310 [0,0,0,1,0,1|2,0,0]=4 1514 B14R2.101 c1ccc(CC[C@H]2CCCN2)nc1 Amb33496169 [0,0,0,1,0,1|2,0,0]=4 1515 B14R2.101 c1ccc(CC[C@H]2CCNC2)cc1 Amb28243392 [0,0,0,1,0,1|2,0,0]=4 1516 B14R2.101 c1ccc(CNC2CCCC2)cc1 Amb1681062 [0,0,0,1,0,1|2,0,0]=4 1517 B14R2.101 c1ccc(CNC2CCCC2)cc1 Amb6542574 [0,0,0,1,0,1|2,0,0]=4 1518 B14R2.101 c1ccc(CNC2CCCC2)nc1 Amb6356057 [0,0,0,1,0,1|2,0,0]=4 1519 B14R2.101 c1ccc(COC2CCCC2)cc1 Amb21856199 [0,0,0,1,0,1|2,0,0]=4 1520 B14R2.101 c1ccc(NCC2CCCC2)cc1 Amb17233131 [0,0,0,1,0,1|2,0,0]=4 1521 B14R2.101 c1ccc(OCC2CCCC2)nc1 Amb27589473 [0,0,0,1,0,1|2,0,0]=4 1522 B14R2.101 c1ccc(SCC2CCCC2)cc1 Amb27188649 [0,0,0,1,0,1|2,0,0]=4 1523 B14R2.101 c1cnc(CCC2CCNC2)cn1 Amb35687810 [0,0,0,1,0,1|2,0,0]=4 1524 B14R2.101 c1cnc(CCN2CCCC2)cn1 Amb29850631 [0,0,0,1,0,1|2,0,0]=4 1525 B14R2.101 c1cnc(OCC2CCCC2)cn1 Amb31199736 [0,0,0,1,0,1|2,0,0]=4 1526 B14R2.101 c1cnc(OCC2CCCC2)nc1 Amb31199737 [0,0,0,1,0,1|2,0,0]=4 1527 B14R2.101 c1cncc(CCC2CCCN2)c1 Amb17400580 [0,0,0,1,0,1|2,0,0]=4 1528 B14R2.101 c1cncc(CNC2CCCC2)c1 Amb6336170 [0,0,0,1,0,1|2,0,0]=4 1529 B14R2.101 c1cncc(CNC2CCCC2)c1 Amb6767948 [0,0,0,1,0,1|2,0,0]=4 1530 B14R2.101 c1cncc(OCC2CCCC2)c1 Amb27474082 [0,0,0,1,0,1|2,0,0]=4 1531 B14R2.101 c1cnnc(NCC2CCCC2)c1 Amb18991533 [0,0,0,1,0,1|2,0,0]=4 1532 B14R2.101 c1cnnc(SCC2CCCC2)c1 Amb27810044 [0,0,0,1,0,1|2,0,0]=4 1533 B14R2.1253 c1cc(C2CCCCCN2)ccn1 Amb2234754 [0,0,0,1,0,1|2,0,0]=4 1534 B14R2.1253 c1cc(C2CCCNCC2)ccn1 Amb28254766 [0,0,0,1,0,1|2,0,0]=4 1535 B14R2.1253 c1cc(C2CCCNCC2)ccn1 Amb32680379 [0,0,0,1,0,1|2,0,0]=4 1536 B14R2.1253 c1ccc(C2CCCCCC2)cc1 Amb27954588 [0,0,0,1,0,1|1,0,0]=3 1537 B14R2.1253 c1ccc(C2CCCCCN2)cc1 Amb10609226 [0,0,0,1,0,1|2,0,0]=4 1538 B14R2.1253 c1ccc(C2CCCCCN2)cc1 Amb2234659 [0,0,0,1,0,1|2,0,0]=4 1539 B14R2.1253 c1ccc(C2CCCCCN2)nc1 Amb2234657 [0,0,0,1,0,1|2,0,0]=4 1540 B14R2.1253 c1ccc(C2CCCCNC2)cc1 Amb21937009 [0,0,0,1,0,1|2,0,0]=4 1541 B14R2.1253 c1ccc(C2CCCCNC2)nc1 Amb27466206 [0,0,0,1,0,1|2,0,0]=4 1542 B14R2.1253 c1ccc(C2CCCNCC2)cc1 Amb31201005 [0,0,0,1,0,1|2,0,0]=4 1543 B14R2.1253 c1ccc(C2CCCNCC2)cc1 Amb33529249 [0,0,0,1,0,1|2,0,0]=4 1544 B14R2.1253 c1ccc(C2CCCNCC2)cc1 Amb8503451 [0,0,0,1,0,1|2,0,0]=4 1545 B14R2.1253 c1ccc(N2CCCCCC2)cc1 Amb26611612 [0,0,0,1,0,1|2,0,0]=4 1546 B14R2.1253 c1ccc(N2CCCCCC2)nc1 Amb10819509 [0,0,0,1,0,1|2,0,0]=4 1547 B14R2.1253 c1ccc([C@H]2CCCCCN2)cc1 Amb27655522 [0,0,0,1,0,1|2,0,0]=4 1548 B14R2.1253 c1ccc([C@H]2CCCNCC2)cc1 Amb27856683 [0,0,0,1,0,1|2,0,0]=4 1549 B14R2.1253 c1cnc(C2CCCCCN2)cn1 Amb4135058 [0,0,0,1,0,1|2,0,0]=4 1550 B14R2.1253 c1cnc(C2CCCNCC2)cn1 Amb28345620 [0,0,0,1,0,1|2,0,0]=4 1551 B14R2.1253 c1cnc(N2CCCCCC2)cn1 Amb10819504 [0,0,0,1,0,1|2,0,0]=4 1552 B14R2.1253 c1cnc(N2CCCCCC2)nc1 Amb25153064 [0,0,0,1,0,1|2,0,0]=4 1553 B14R2.1253 c1cncc(C2CCCCCN2)c1 Amb3788257 [0,0,0,1,0,1|2,0,0]=4 1554 B14R2.1253 c1cnnc(C2CCCCCN2)c1 Amb32416139 [0,0,0,1,0,1|2,0,0]=4 1555 B14R2.2014 CCC1NCCCc2ccccc21 Amb27406843 [0,0,0,1,0,1|2,0,0]=4 1556 B14R2.2014 CNC1CCCCc2cccnc21 Amb27476215 [0,0,0,1,0,1|2,0,0]=4 1557 B14R2.2014 CNC1CCCCc2ncncc21 Amb28120779 [0,0,0,1,0,1|2,0,0]=4 1558 B14R2.2839 c1ccc2c(c1)CCCCCCN2 Amb9783376 [0,0,0,1,0,1|2,0,0]=4 1559 B14R2.2839 c1ccc2c(c1)CCCCCNC2 Amb24740829 [0,0,0,1,0,1|2,0,0]=4 1560 B14R2.3018 c1ccc(CCCNC2CC2)cc1 Amb6249030 [0,0,0,1,0,1|2,0,0]=4 1561 B14R2.3018 c1ccc(CCNCC2CC2)cc1 Amb6686732 [0,0,0,1,0,1|2,0,0]=4 1562 B14R2.3018 c1ccc(CCNCC2CC2)nc1 Amb9423079 [0,0,0,1,0,1|2,0,0]=4 1563 B14R2.3019 c1ccc(CCCC2CNC2)cc1 Amb32952377 [0,0,0,1,0,1|2,0,0]=4 1564 B14R2.3019 c1ccc(CCNC2CCC2)cc1 Amb18308956 [0,0,0,1,0,1|2,0,0]=4 1565 B14R2.3019 c1ccc(CCNC2CCC2)nc1 Amb18808909 [0,0,0,1,0,1|2,0,0]=4 1566 B14R2.3019 c1ccc(CNCC2CCC2)cc1 Amb6487415 [0,0,0,1,0,1|2,0,0]=4 1567 B14R2.3019 c1ccc(NCCC2CCC2)nc1 Amb27255733 [0,0,0,1,0,1|2,0,0]=4 1568 B14R2.3019 c1cnnc(NCCC2CCC2)c1 Amb27837323 [0,0,0,1,0,1|2,0,0]=4 1569 B14R2.7150 BrCCC1CCCc2ccccc21 Amb25882010 [0,0,0,1,0,1|2,0,0]=4 1570 B14R2.7150 CCCC1CCNc2ccccc21 Amb27666797 [0,0,0,1,0,1|2,0,0]=4 1571 B14R2.7150 CCCC1CNCc2ccccc21 Amb17400523 [0,0,0,1,0,1|2,0,0]=4 1572 B14R2.7150 CCCC1NCCc2ccccc21 Amb18961209 [0,0,0,1,0,1|2,0,0]=4 1573 B14R2.7150 CCCC1NCCc2ccccc21 Amb33330006 [0,0,0,1,0,1|2,0,0]=4 1574 B14R2.7150 CCCN1CCCc2ccccc21 Amb16758250 [0,0,0,1,0,1|2,0,0]=4 1575 B14R2.7150 CCNC1CCCc2ccccc21 Amb6277877 [0,0,0,1,0,1|2,0,0]=4 1576 B14R2.7150 CCNC1CCCc2cccnc21 Amb26477230 [0,0,0,1,0,1|2,0,0]=4 1577 B14R2.7150 CCNC1CCCc2ncncc21 Amb18957883 [0,0,0,1,0,1|2,0,0]=4 1578 B14R2.7150 CNCC1CCCc2ccccc21 Amb9513978 [0,0,0,1,0,1|2,0,0]=4 1579 B14R2.7150 ClCCC1CCCc2ccccc21 Amb27645461 [0,0,0,1,0,1|2,0,0]=4 1580 B14R2.7150 ClCCC1CCCc2ncccc21 Amb27466203 [0,0,0,1,0,1|2,0,0]=4 1581 B14R2.7150 NCCC1CCCc2ccccc21 Amb17226685 [0,0,0,1,0,1|2,0,0]=4 1582 B14R2.7150 NCCC1CCCc2cccnc21 Amb27973127 [0,0,0,1,0,1|2,0,0]=4 1583 B14R2.7150 OCCC1CCCc2ccccc21 Amb17233225 [0,0,0,1,0,1|2,0,0]=4 1584 B14R2.7150 OCCC1CCCc2cccnc21 Amb27484231 [0,0,0,1,0,1|2,0,0]=4 1585 B14R2.7150 SCCC1CCCc2ccccc21 Amb33379975 [0,0,0,1,0,1|2,0,0]=4 1586 B14R2.24101 CN1CCCCCc2ccccc21 Amb27605226 [0,0,0,1,0,1|2,0,0]=4 1587 B14R2.24101 NC1CCCCCc2ccccc21 Amb27184614 [0,0,0,1,0,1|2,0,0]=4 1588 B14R2.24101 OC1CCCCCc2ccccc21 Amb28400793 [0,0,0,1,0,1|2,0,0]=4 1589 B14R2.24101 O[C@H]1CCCCCc2ccccc21 Amb27978086 [0,0,0,1,0,1|2,0,0]=4 1590 B14R2.19 Brc1ccc(CC2CCCCN2)o1 Amb27659890 [0,1,0,1,0,0|1,0,0]=3 1591 B14R2.19 Brc1ccc(CC2CCCCN2)s1 Amb18246004 [0,1,0,1,0,0|1,1,0]=4 1592 B14R2.19 Brc1ccc(CC2CCCNC2)o1 Amb26003094 [0,1,0,1,0,0|1,0,0]=3 1593 B14R2.19 Brc1ccc(CC2CCCNC2)s1 Amb17196964 [0,1,0,1,0,0|1,1,0]=4 1594 B14R2.19 Brc1ccc(CC2CCNCC2)o1 Amb33451983 [0,1,0,1,0,0|1,0,0]=3 1595 B14R2.19 Brc1ccc(CC2CCNCC2)s1 Amb17196965 [0,1,0,1,0,0|1,1,0]=4 1596 B14R2.19 Brc1ccc(CN2CCNCC2)o1 Amb9210910 [0,1,0,1,0,0|2,0,0]=4 1597 B14R2.19 Brc1ccc(CN2CCOCC2)o1 Amb8463154 [0,1,0,1,0,0|2,0,0]=4 1598 B14R2.19 Brc1ccc(CN2CCSCC2)o1 Amb10813221 [0,1,0,1,0,0|2,0,0]=4 1599 B14R2.19 Brc1ccc(C[C@@H]2CCCNC2)o1 Amb27792224 [0,1,0,1,0,0|1,0,0]=3 1600 B14R2.19 Brc1ccc(C[C@H]2CCCNC2)s1 Amb27435741 [0,1,0,1,0,0|1,1,0]=4 1601 B14R2.19 Brc1ccc(OC2CCCNC2)o1 Amb33452246 [0,1,0,1,0,0|2,0,0]=4 1602 B14R2.19 Brc1ccc(OC2CCNCC2)o1 Amb33452242 [0,1,0,1,0,0|2,0,0]=4 1603 B14R2.19 Brc1cnn(CC2CCCCC2)c1 Amb21856764 [0,1,0,1,0,0|2,0,0]=4 1604 B14R2.19 Brc1coc(CC2CCCNC2)c1 Amb33431555 [0,1,0,1,0,0|1,0,0]=3 1605 B14R2.19 Brc1coc(CC2CCNCC2)c1 Amb33431524 [0,1,0,1,0,0|1,0,0]=3 1606 B14R2.19 Brc1coc(CN2CCCCC2)c1 Amb28435631 [0,1,0,1,0,0|1,0,0]=3 1607 B14R2.19 Brc1coc(CN2CCNCC2)c1 Amb33333835 [0,1,0,1,0,0|2,0,0]=4 1608 B14R2.19 Brc1coc(OC2CCCNC2)c1 Amb33432334 [0,1,0,1,0,0|2,0,0]=4 1609 B14R2.19 Brc1coc(OC2CCNCC2)c1 Amb33432329 [0,1,0,1,0,0|2,0,0]=4 1610 B14R2.19 Brc1csc(CC2CCCCN2)c1 Amb18904566 [0,1,0,1,0,0|1,1,0]=4 1611 B14R2.19 Brc1csc(CC2CCCNC2)c1 Amb18072931 [0,1,0,1,0,0|1,1,0]=4 1612 B14R2.19 Brc1csc(CC2CCNCC2)c1 Amb18072921 [0,1,0,1,0,0|1,1,0]=4 1613 B14R2.19 Brc1csc(CN2CCCCC2)c1 Amb22263109 [0,1,0,1,0,0|1,1,0]=4 1614 B14R2.19 Brc1csc(C[C@@H]2CCCNC2)c1 Amb27233988 [0,1,0,1,0,0|1,1,0]=4 1615 B14R2.19 Brc1nnc(CC2CCCCC2)o1 Amb28123768 [0,1,0,1,0,0|2,0,0]=4 1616 B14R2.19 Cc1cc(CC2CCCCN2)on1 Amb27448092 [0,1,0,1,0,0|2,0,0]=4 1617 B14R2.19 Cc1cc(CC2CCCNC2)on1 Amb27143266 [0,1,0,1,0,0|2,0,0]=4 1618 B14R2.19 Cc1cc(CC2CCNCC2)on1 Amb18824373 [0,1,0,1,0,0|2,0,0]=4 1619 B14R2.19 Cc1ccc(CC2CCCNC2)o1 Amb27620838 [0,1,0,1,0,0|1,0,0]=3 1620 B14R2.19 Cc1ccc(CC2CCCNC2)s1 Amb26313832 [0,1,0,1,0,0|1,1,0]=4 1621 B14R2.19 Cc1ccc(CC2CCNCC2)o1 Amb33172558 [0,1,0,1,0,0|1,0,0]=3 1622 B14R2.19 Cc1ccc(CC2CCNCC2)s1 Amb25034175 [0,1,0,1,0,0|1,1,0]=4 1623 B14R2.19 Cc1ccc(CN2CCNCC2)o1 Amb22408724 [0,1,0,1,0,0|2,0,0]=4 1624 B14R2.19 Cc1ccc(CN2CCNCC2)o1 Amb6504324 [0,1,0,1,0,0|2,0,0]=4 1625 B14R2.19 Cc1ccc(CN2CCOCC2)o1 Amb1843167 [0,1,0,1,0,0|2,0,0]=4 1626 B14R2.19 Cc1ccc(CN2CCSCC2)o1 Amb24448839 [0,1,0,1,0,0|2,0,0]=4 1627 B14R2.19 Cc1ccc(C[C@@H]2CCCNC2)s1 Amb27489168 [0,1,0,1,0,0|1,1,0]=4 1628 B14R2.19 Cc1ccc(C[C@H]2CCCNC2)o1 Amb27818100 [0,1,0,1,0,0|1,0,0]=3 1629 B14R2.19 Cc1ccc(NC2CCCNC2)o1 Amb27236527 [0,1,0,1,0,0|2,0,0]=4 1630 B14R2.19 Cc1ccc(NC2CCNCC2)o1 Amb25160873 [0,1,0,1,0,0|2,0,0]=4 1631 B14R2.19 Cc1ccc(OC2CCCNC2)o1 Amb33317579 [0,1,0,1,0,0|2,0,0]=4 1632 B14R2.19 Cc1ccc(OC2CCNCC2)o1 Amb33317582 [0,1,0,1,0,0|2,0,0]=4 1633 B14R2.19 Cc1csc(CC2CCCNC2)c1 Amb33427612 [0,1,0,1,0,0|1,1,0]=4 1634 B14R2.19 Cc1csc(CC2CCNCC2)c1 Amb33427969 [0,1,0,1,0,0|1,1,0]=4 1635 B14R2.19 Cc1ncc(CC2CCCCC2)s1 Amb27784587 [0,1,0,1,0,0|1,1,0]=4 1636 B14R2.19 Clc1ccc(CC2CCCNC2)o1 Amb26553030 [0,1,0,1,0,0|1,0,0]=3 1637 B14R2.19 Clc1ccc(CC2CCCNC2)s1 Amb17195217 [0,1,0,1,0,0|1,1,0]=4 1638 B14R2.19 Clc1ccc(CC2CCNCC2)o1 Amb33259220 [0,1,0,1,0,0|1,0,0]=3 1639 B14R2.19 Clc1ccc(CC2CCNCC2)s1 Amb17195218 [0,1,0,1,0,0|1,1,0]=4 1640 B14R2.19 Clc1ccc(CN2CCCCC2)s1 Amb28352169 [0,1,0,1,0,0|1,1,0]=4 1641 B14R2.19 Clc1ccc(CN2CCNCC2)o1 Amb18253397 [0,1,0,1,0,0|2,0,0]=4 1642 B14R2.19 Clc1ccc(C[C@H]2CCCNC2)o1 Amb27430472 [0,1,0,1,0,0|1,0,0]=3 1643 B14R2.19 Clc1ccc(OC2CCCNC2)o1 Amb33258675 [0,1,0,1,0,0|2,0,0]=4 1644 B14R2.19 Clc1ccc(OC2CCNCC2)o1 Amb33259058 [0,1,0,1,0,0|2,0,0]=4 1645 B14R2.19 Clc1csc(CC2CCCNC2)c1 Amb33057824 [0,1,0,1,0,0|1,1,0]=4 1646 B14R2.19 Clc1csc(CC2CCNCC2)c1 Amb33057864 [0,1,0,1,0,0|1,1,0]=4 1647 B14R2.19 Clc1nnc(CC2CCCCC2)o1 Amb27776040 [0,1,0,1,0,0|2,0,0]=4 1648 B14R2.19 Ic1ccn(CC2CCCCC2)n1 Amb27436503 [0,1,0,1,0,0|2,0,0]=4 1649 B14R2.19 Ic1cnn(CC2CCCCC2)c1 Amb24493783 [0,1,0,1,0,0|2,0,0]=4 1650 B14R2.19 Nc1cc(CC2CCCCC2)no1 Amb33529156 [0,1,0,1,0,0|2,0,0]=4 1651 B14R2.19 Nc1cc(CC2CCCCC2)on1 Amb27403961 [0,1,0,1,0,0|1,0,0]=3 1652 B14R2.19 Nc1ccn(CC2CCCCC2)n1 Amb18281114 [0,1,0,1,0,0|2,0,0]=4 1653 B14R2.19 Nc1cnn(CC2CCCCC2)c1 Amb6667099 [0,1,0,1,0,0|2,0,0]=4 1654 B14R2.19 Nc1coc(CN2CCNCC2)c1 Amb18193003 [0,1,0,1,0,0|2,0,0]=4 1655 B14R2.19 Nc1csc(CC2CCCCC2)c1 Amb18143797 [0,1,0,1,0,0|0,1,0]=3 1656 B14R2.19 Nc1nc(CC2CCCCC2)cs1 Amb27630545 [0,1,0,1,0,0|2,0,0]=4 1657 B14R2.19 Nc1ncc(CC2CCCCC2)o1 Amb33422106 [0,1,0,1,0,0|1,0,0]=3 1658 B14R2.19 Nc1ncc(CC2CCCCC2)s1 Amb27800521 [0,1,0,1,0,0|1,1,0]=4 1659 B14R2.19 Nc1ncc(CN2CCCCC2)o1 Amb27751590 [0,1,0,1,0,0|2,0,0]=4 1660 B14R2.19 Nc1nnc(CC2CCCCC2)o1 Amb6744637 [0,1,0,1,0,0|2,0,0]=4 1661 B14R2.19 O=C1C=C(CC2CCCCC2)CC1 Amb28127660 [0,1,0,1,0,0|1,0,1]=4 1662 B14R2.19 O=C1NN=C(CC2CCCCC2)O1 Amb27948162 [0,1,0,1,0,0|2,0,0]=4 1663 B14R2.19 Oc1cc(CC2CCNCC2)on1 Amb18823690 [0,1,0,1,0,0|2,0,0]=4 1664 B14R2.19 Oc1cnn(CC2CCCCC2)c1 Amb27157832 [0,1,0,1,0,0|2,0,0]=4 1665 B14R2.19 Oc1csc(CC2CCCCC2)n1 Amb28253494 [0,1,0,1,0,0|1,1,0]=4 1666 B14R2.19 Sc1ncc(CC2CCCCC2)o1 Amb27192154 [0,1,0,1,0,0|1,0,0]=3 1667 B14R2.97 CNC1CCCC1c2ccc(C)s2 Amb27180849 [0,1,0,1,0,0|1,1,0]=4 1668 B14R2.97 NCC1CCCC1c2ccc(Cl)s2 Amb27862237 [0,1,0,1,0,0|1,1,0]=4 1669 B14R2.99 CCC1CCC1Cn2cc(I)cn2 Amb32419804 [0,1,0,1,0,0|2,0,0]=4 1670 B14R2.99 CCC1CCN1Cc2cc(Br)co2 Amb28054122 [0,1,0,1,0,0|1,0,0]=3 1671 B14R2.99 CCC1CCN1Cc2cc(Br)cs2 Amb28141770 [0,1,0,1,0,0|1,1,0]=4 1672 B14R2.99 CCC1CCN1Cc2cc(C)no2 Amb28382964 [0,1,0,1,0,0|2,0,0]=4 1673 B14R2.99 CCC1CCN1Cc2cc(Cl)cs2 Amb27256148 [0,1,0,1,0,0|1,1,0]=4 1674 B14R2.99 CCC1CCN1Cc2ccc(C)s2 Amb27211796 [0,1,0,1,0,0|1,1,0]=4 1675 B14R2.99 Cc1ccc(CN2CCC2CN)o1 Amb35675348 [0,1,0,1,0,0|2,0,0]=4 1676 B14R2.99 NCC1CCC1Cc2ccc(Br)o2 Amb27261437 [0,1,0,1,0,0|1,0,0]=3 1677 B14R2.99 NCC1CCN1Cc2ccc(Br)o2 Amb33252295 [0,1,0,1,0,0|2,0,0]=4 1678 B14R2.99 NCC1CCN1Cc2ccc(Cl)o2 Amb30020716 [0,1,0,1,0,0|2,0,0]=4 1679 B14R2.107 CNCC1CCC1c2ccc(Cl)s2 Amb28341929 [0,1,0,1,0,0|1,1,0]=4 1680 B14R2.246 CCCC1CC1Nc2nc(C)co2 Amb28064680 [0,1,0,1,0,0|2,0,0]=4 1681 B14R2.251 CC1CCC1NCc2ccc(Cl)o2 Amb27606877 [0,1,0,1,0,0|1,0,0]=3 1682 B14R2.251 Cc1ccc(CNC2CCC2C)o1 Amb28066219 [0,1,0,1,0,0|1,0,0]=3 1683 B14R2.251 Cc1ccc(CNC2CCC2C)s1 Amb27954320 [0,1,0,1,0,0|1,1,0]=4 1684 B14R2.251 Cc1ccc(CN[C@@H]2CC[C@H]2O)o1 Amb27447581 [0,1,0,1,0,0|2,0,0]=4 1685 B14R2.251 Cc1cnc(CNC2CCC2C)o1 Amb28399120 [0,1,0,1,0,0|2,0,0]=4 1686 B14R2.251 OC1CCC1SCc2ccc(Cl)o2 Amb32788951 [0,1,0,1,0,0|2,0,0]=4 1687 B14R2.251 O[C@@H]1CC[C@H]1SCc2ccc(Cl)o2 Amb32788952 [0,1,0,1,0,0|2,0,0]=4 1688 B14R2.252 Brc1ccc(CCC2=CCCC2)o1 Amb27620918 [0,1,0,1,0,0|0,0,2]=4 1689 B14R2.252 Brc1ccc(CCC2CC=CC2)o1 Amb30033006 [0,1,0,1,0,0|0,0,2]=4 1690 B14R2.252 Brc1ccc(CCC2CCCN2)s1 Amb24554649 [0,1,0,1,0,0|1,1,0]=4 1691 B14R2.252 Brc1ccc(CNC2CCCC2)s1 Amb6686270 [0,1,0,1,0,0|1,1,0]=4 1692 B14R2.252 Brc1ccc(CNC2CCSC2)o1 Amb24271328 [0,1,0,1,0,0|2,0,0]=4 1693 B14R2.252 Brc1ccc(CN[C@H]2CCNC2)o1 Amb30040204 [0,1,0,1,0,0|2,0,0]=4 1694 B14R2.252 Brc1ccc(COC2CCCC2)s1 Amb27414529 [0,1,0,1,0,0|1,1,0]=4 1695 B14R2.252 Brc1cnn(CCC2CCCC2)c1 Amb27395064 [0,1,0,1,0,0|2,0,0]=4 1696 B14R2.252 Brc1coc(CNC2CCSC2)c1 Amb27254754 [0,1,0,1,0,0|2,0,0]=4 1697 B14R2.252 Brc1csc(CCC2CCCN2)c1 Amb27466339 [0,1,0,1,0,0|1,1,0]=4 1698 B14R2.252 Brc1csc(CNC2CCCC2)c1 Amb7757128 [0,1,0,1,0,0|1,1,0]=4 1699 B14R2.252 Brc1csc(CSC2CCCC2)c1 Amb27601671 [0,1,0,1,0,0|1,1,0]=4 1700 B14R2.252 CC1CC(NCc2ccco2)CO1 Amb35679137 [0,1,0,1,0,0|2,0,0]=4 1701 B14R2.252 CC1CCC(NCc2ccco2)C1 Amb26376373 [0,1,0,1,0,0|1,0,0]=3 1702 B14R2.252 CC1CCC(NCc2cccs2)C1 Amb28242165 [0,1,0,1,0,0|1,1,0]=4 1703 B14R2.252 CC1CCC(NCc2cnco2)C1 Amb27875815 [0,1,0,1,0,0|2,0,0]=4 1704 B14R2.252 CC1CCC(SCc2ccco2)C1 Amb27451853 [0,1,0,1,0,0|1,0,0]=3 1705 B14R2.252 CN1CCC(NCc2ccco2)C1 Amb18302325 [0,1,0,1,0,0|2,0,0]=4 1706 B14R2.252 Cc1ccc(CCC2CCCN2)o1 Amb26921481 [0,1,0,1,0,0|1,0,0]=3 1707 B14R2.252 Cc1ccc(CCC2CCCN2)s1 Amb27812755 [0,1,0,1,0,0|1,1,0]=4 1708 B14R2.252 Cc1ccc(CNC2CCCC2)o1 Amb6356066 [0,1,0,1,0,0|1,0,0]=3 1709 B14R2.252 Cc1ccc(CNC2CCCC2)s1 Amb1922670 [0,1,0,1,0,0|1,1,0]=4 1710 B14R2.252 Cc1ccc(CNC2CCCC2)s1 Amb6864566 [0,1,0,1,0,0|1,1,0]=4 1711 B14R2.252 Cc1ccc(CNC2CCOC2)o1 Amb27760859 [0,1,0,1,0,0|2,0,0]=4 1712 B14R2.252 Cc1ccc(CN[C@H]2CCNC2)o1 Amb29892658 [0,1,0,1,0,0|2,0,0]=4 1713 B14R2.252 Cc1cnn(CCC2CCCC2)c1 Amb27485850 [0,1,0,1,0,0|2,0,0]=4 1714 B14R2.252 Cc1ncc(CNC2CCCC2)o1 Amb28058047 [0,1,0,1,0,0|2,0,0]=4 1715 B14R2.252 ClC1CCC(CCc2cccs2)C1 Amb27254421 [0,1,0,1,0,0|0,1,0]=3 1716 B14R2.252 Clc1ccc(CCC2CCCN2)s1 Amb26632247 [0,1,0,1,0,0|1,1,0]=4 1717 B14R2.252 Clc1ccc(CNC2CCCC2)s1 Amb6707341 [0,1,0,1,0,0|1,1,0]=4 1718 B14R2.252 Clc1ccc(CNC2CCNC2)o1 Amb30036261 [0,1,0,1,0,0|2,0,0]=4 1719 B14R2.252 Clc1ccc(CNC2CCOC2)o1 Amb28363594 [0,1,0,1,0,0|2,0,0]=4 1720 B14R2.252 Clc1ccc(CN[C@H]2CCNC2)o1 Amb30039873 [0,1,0,1,0,0|2,0,0]=4 1721 B14R2.252 Clc1ccc(CSC2CCNC2)o1 Amb32788905 [0,1,0,1,0,0|2,0,0]=4 1722 B14R2.252 FC1CCC(NCc2ccco2)C1 Amb27399342 [0,1,0,1,0,0|1,0,0]=3 1723 B14R2.252 Ic1ccc(CNC2CCOC2)o1 Amb27465439 [0,1,0,1,0,0|2,0,0]=4 1724 B14R2.252 Ic1ccc(CNC2CCSC2)o1 Amb27662493 [0,1,0,1,0,0|2,0,0]=4 1725 B14R2.252 NC1CCC(CCc2ccsc2)C1 Amb28239386 [0,1,0,1,0,0|2,0,0]=4 1726 B14R2.252 NC1CCC(CSc2ncco2)C1 Amb27617657 [0,1,0,1,0,0|2,0,0]=4 1727 B14R2.252 NC1CCC(NCc2cccs2)C1 Amb27229743 [0,1,0,1,0,0|1,1,0]=4 1728 B14R2.252 NC1CCC(OCc2cccs2)C1 Amb27412209 [0,1,0,1,0,0|1,1,0]=4 1729 B14R2.252 NC1CCN(CCc2cccs2)C1 Amb17470942 [0,1,0,1,0,0|1,1,0]=4 1730 B14R2.252 Nc1cc(CCC2CCCC2)no1 Amb9205389 [0,1,0,1,0,0|2,0,0]=4 1731 B14R2.252 Nc1cc(CCC2CCCC2)on1 Amb27390381 [0,1,0,1,0,0|1,0,0]=3 1732 B14R2.252 Nc1cc(CCC2CCOC2)on1 Amb27960118 [0,1,0,1,0,0|2,0,0]=4 1733 B14R2.252 Nc1cc(CCN2CCCC2)on1 Amb33274814 [0,1,0,1,0,0|2,0,0]=4 1734 B14R2.252 Nc1ccc(CNC2CCCC2)o1 Amb18107305 [0,1,0,1,0,0|1,0,0]=3 1735 B14R2.252 Nc1ccn(CCC2CCCC2)n1 Amb23511773 [0,1,0,1,0,0|2,0,0]=4 1736 B14R2.252 Nc1cnn(CCC2CCCC2)c1 Amb27870866 [0,1,0,1,0,0|2,0,0]=4 1737 B14R2.252 Nc1nc(CCC2CCCC2)cs1 Amb26520236 [0,1,0,1,0,0|2,0,0]=4 1738 B14R2.252 Nc1ncc(CCC2CCCC2)o1 Amb33379867 [0,1,0,1,0,0|1,0,0]=3 1739 B14R2.252 Nc1ncc(CCN2CCCC2)o1 Amb33274805 [0,1,0,1,0,0|2,0,0]=4 1740 B14R2.252 Nc1nnc(CCC2CCCC2)o1 Amb6249207 [0,1,0,1,0,0|2,0,0]=4 1741 B14R2.252 O=C1CCC(CCc2ccco2)N1 Amb27868410 [0,1,0,1,0,0|1,0,1]=4 1742 B14R2.252 O=C1CCC(NCc2ccco2)C1 Amb27762927 [0,1,0,1,0,0|1,0,1]=4 1743 B14R2.252 O=C1CCC(SCc2ccco2)C1 Amb27393876 [0,1,0,1,0,0|1,0,1]=4 1744 B14R2.252 O=C1NN=C(CCC2CCCC2)O1 Amb24732294 [0,1,0,1,0,0|2,0,0]=4 1745 B14R2.252 OC1CCC(OCc2ccco2)C1 Amb35695408 [0,1,0,1,0,0|1,0,0]=3 1746 B14R2.252 OC1CCC(OCc2cccs2)C1 Amb35695683 [0,1,0,1,0,0|1,1,0]=4 1747 B14R2.252 O[C@@H]1CC[C@H](NCc2ccco2)C1 Amb27205881 [0,1,0,1,0,0|1,0,0]=3 1748 B14R2.252 O[C@@H]1CC[C@H](NCc2cccs2)C1 Amb27448654 [0,1,0,1,0,0|1,1,0]=4 1749 B14R2.256 CC1CCCCC1c2cnc(N)s2 Amb27231951 [0,1,0,1,0,0|1,1,0]=4 1750 B14R2.256 CC1CCCCC1c2nc(N)cs2 Amb28199679 [0,1,0,1,0,0|1,1,0]=4 1751 B14R2.256 CC1CCCCC1n2cc(Br)cn2 Amb28242442 [0,1,0,1,0,0|2,0,0]=4 1752 B14R2.256 CC1CCCCC1n2cc(N)cn2 Amb25675522 [0,1,0,1,0,0|2,0,0]=4 1753 B14R2.256 CC1CCCCC1n2ccc(N)n2 Amb32705382 [0,1,0,1,0,0|2,0,0]=4 1754 B14R2.256 CC1CCCCN1c2ccc(Br)o2 Amb24317611 [0,1,0,1,0,0|1,0,0]=3 1755 B14R2.256 CC1CCCCN1c2ccc(Br)s2 Amb24317610 [0,1,0,1,0,0|1,1,0]=4 1756 B14R2.256 CC1CNCCC1c2cc(Br)cs2 Amb27953412 [0,1,0,1,0,0|1,1,0]=4 1757 B14R2.256 CC1CNCCC1c2ccc(Cl)s2 Amb28256072 [0,1,0,1,0,0|1,1,0]=4 1758 B14R2.256 CC1OCCNC1c2ccc(Br)o2 Amb18717861 [0,1,0,1,0,0|2,0,0]=4 1759 B14R2.256 CN1CCCCC1c2cc(N)no2 Amb33322045 [0,1,0,1,0,0|2,0,0]=4 1760 B14R2.256 CN1CCCCC1c2cnc(N)o2 Amb33322039 [0,1,0,1,0,0|2,0,0]=4 1761 B14R2.256 CN1CCNCC1c2cc(Br)co2 Amb33431509 [0,1,0,1,0,0|2,0,0]=4 1762 B14R2.256 CN1CCNCC1c2ccc(Br)o2 Amb18155620 [0,1,0,1,0,0|2,0,0]=4 1763 B14R2.256 CN1CCNCC1c2ccc(Cl)o2 Amb33258323 [0,1,0,1,0,0|2,0,0]=4 1764 B14R2.256 Cc1ccc(C2CCCCC2Br)s1 Amb27406274 [0,1,0,1,0,0|1,1,0]=4 1765 B14R2.256 Cc1ccc(C2CCCCC2N)o1 Amb27772688 [0,1,0,1,0,0|1,0,0]=3 1766 B14R2.256 Cc1ccc(C2CCCCC2O)s1 Amb25850611 [0,1,0,1,0,0|1,1,0]=4 1767 B14R2.256 Cc1ccc(C2CCCCN2C)o1 Amb28319805 [0,1,0,1,0,0|1,0,0]=3 1768 B14R2.256 Cc1ccc(C2CCNCC2F)o1 Amb27772687 [0,1,0,1,0,0|2,0,0]=4 1769 B14R2.256 Cc1ccc(C2CNCCN2C)o1 Amb18193619 [0,1,0,1,0,0|2,0,0]=4 1770 B14R2.256 Cc1ccc(C2NCCCC2O)o1 Amb18193120 [0,1,0,1,0,0|2,0,0]=4 1771 B14R2.256 Cc1ccc(N2CCNCC2C)o1 Amb24685078 [0,1,0,1,0,0|2,0,0]=4 1772 B14R2.256 Cc1ccc([C@@H]2CCCC[C@H]2O)s1 Amb32945563 [0,1,0,1,0,0|1,1,0]=4 1773 B14R2.256 Cc1coc(C2CCCCC2O)c1 Amb32945341 [0,1,0,1,0,0|1,0,0]=3 1774 B14R2.256 Cc1coc([C@@H]2CCCC[C@H]2O)c1 Amb33213169 [0,1,0,1,0,0|1,0,0]=3 1775 B14R2.256 NC1CCCCC1c2cc(Br)cs2 Amb27811888 [0,1,0,1,0,0|1,1,0]=4 1776 B14R2.256 NC1CCCCC1c2ccc(Br)s2 Amb27868721 [0,1,0,1,0,0|1,1,0]=4 1777 B14R2.256 NC1CCCCC1c2ccc(Cl)s2 Amb27791578 [0,1,0,1,0,0|1,1,0]=4 1778 B14R2.256 O=C1CCCCC1c2ccc(Br)o2 Amb27410365 [0,1,0,1,0,0|1,0,1]=4 1779 B14R2.256 OC1CCCCC1c2ccc(Cl)s2 Amb27392804 [0,1,0,1,0,0|1,1,0]=4 1780 B14R2.256 O[C@@H]1CCCC[C@H]1c2ccc(Cl)s2 Amb32945790 [0,1,0,1,0,0|1,1,0]=4 1781 B14R2.259 Brc1ccc(CC2CCCC2Br)s1 Amb28291247 [0,1,0,1,0,0|1,1,0]=4 1782 B14R2.259 Brc1ccc(CC2COCC2Br)o1 Amb35736896 [0,1,0,1,0,0|2,0,0]=4 1783 B14R2.259 Brc1ccc(CC2CSCC2Br)o1 Amb27434052 [0,1,0,1,0,0|2,0,0]=4 1784 B14R2.259 CC1CCCN1Cc2cc(Br)cs2 Amb27426679 [0,1,0,1,0,0|1,1,0]=4 1785 B14R2.259 CC1CCCN1Cc2cc(Br)no2 Amb27388451 [0,1,0,1,0,0|2,0,0]=4 1786 B14R2.259 CN1CCCC1Cc2cc(N)no2 Amb33325935 [0,1,0,1,0,0|2,0,0]=4 1787 B14R2.259 CN1CCCC1Cc2cnc(N)o2 Amb33325927 [0,1,0,1,0,0|2,0,0]=4 1788 B14R2.259 Cc1cc(CC2CCCC2N)on1 Amb9132955 [0,1,0,1,0,0|2,0,0]=4 1789 B14R2.259 Cc1ccc(CC2CCCC2O)o1 Amb33213817 [0,1,0,1,0,0|1,0,0]=3 1790 B14R2.259 Cc1ccc(CC2CNCC2O)o1 Amb32950574 [0,1,0,1,0,0|2,0,0]=4 1791 B14R2.259 Cc1ccc(CC2COCC2O)o1 Amb32944412 [0,1,0,1,0,0|2,0,0]=4 1792 B14R2.259 Cc1ccc(CN2CCCC2C)s1 Amb28382090 [0,1,0,1,0,0|1,1,0]=4 1793 B14R2.259 Cc1ccc(C[C@@H]2CCC[C@H]2O)o1 Amb32944818 [0,1,0,1,0,0|1,0,0]=3 1794 B14R2.259 Cc1ccc(C[C@@H]2CNC[C@H]2O)o1 Amb32950708 [0,1,0,1,0,0|2,0,0]=4 1795 B14R2.259 Cc1ccc(C[C@@H]2COC[C@H]2O)o1 Amb32945960 [0,1,0,1,0,0|2,0,0]=4 1796 B14R2.259 ClC1CCCC1Cc2cc(Br)cs2 Amb27455228 [0,1,0,1,0,0|1,1,0]=4 1797 B14R2.259 ClC1COCC1Cc2ccc(Br)o2 Amb35589965 [0,1,0,1,0,0|2,0,0]=4 1798 B14R2.259 NC1COCC1Cc2ccc(Br)o2 Amb35736935 [0,1,0,1,0,0|2,0,0]=4 1799 B14R2.259 OC1CCCC1Cc2cc(Br)cs2 Amb25718261 [0,1,0,1,0,0|1,1,0]=4 1800 B14R2.259 OC1CCCC1Cc2ccc(Br)o2 Amb27245900 [0,1,0,1,0,0|1,0,0]=3 1801 B14R2.259 OC1CCCC1Cc2ccc(Br)s2 Amb25236229 [0,1,0,1,0,0|1,1,0]=4 1802 B14R2.259 OC1CCCC1Cc2ccc(Cl)s2 Amb25885864 [0,1,0,1,0,0|1,1,0]=4 1803 B14R2.259 OC1CNCC1Cc2ccc(Br)o2 Amb33213829 [0,1,0,1,0,0|2,0,0]=4 1804 B14R2.259 OC1COCC1Cc2ccc(Br)o2 Amb33213471 [0,1,0,1,0,0|2,0,0]=4 1805 B14R2.259 O[C@@H]1CCC[C@H]1Cc2cc(Br)cs2 Amb33212802 [0,1,0,1,0,0|1,1,0]=4 1806 B14R2.259 O[C@@H]1CCC[C@H]1Cc2ccc(Br)o2 Amb32944852 [0,1,0,1,0,0|1,0,0]=3 1807 B14R2.259 O[C@@H]1CCC[C@H]1Cc2ccc(Br)s2 Amb33213586 [0,1,0,1,0,0|1,1,0]=4 1808 B14R2.259 O[C@@H]1CCC[C@H]1Cc2ccc(Cl)s2 Amb33213414 [0,1,0,1,0,0|1,1,0]=4 1809 B14R2.259 O[C@@H]1CNC[C@H]1Cc2ccc(Br)o2 Amb32944941 [0,1,0,1,0,0|2,0,0]=4 1810 B14R2.259 O[C@@H]1COC[C@H]1Cc2ccc(Br)o2 Amb32945153 [0,1,0,1,0,0|2,0,0]=4 1811 B14R2.535 CCCC1NCCc2sc(Br)cc21 Amb27601149 [0,1,0,1,0,0|1,1,0]=4 1812 B14R2.535 CCCC1NCCc2sc(Cl)cc21 Amb25158342 [0,1,0,1,0,0|1,1,0]=4 1813 B14R2.535 Cc1cc2c(o1)CCNC2CCN Amb18824367 [0,1,0,1,0,0|2,0,0]=4 1814 B14R2.859 CCCNC1CCc2sc(Br)cc21 Amb28283642 [0,1,0,1,0,0|1,1,0]=4 1815 B14R2.4359 Brc1ccc(C2CCCCCN2)s1 Amb3792507 [0,1,0,1,0,0|1,1,0]=4 1816 B14R2.4359 Brc1ccc(C2CCCNCC2)s1 Amb18073294 [0,1,0,1,0,0|1,1,0]=4 1817 B14R2.4359 Brc1cnn(C2CCCCCC2)c1 Amb18724502 [0,1,0,1,0,0|2,0,0]=4 1818 B14R2.4359 Brc1csc(C2CCCNCC2)c1 Amb18073239 [0,1,0,1,0,0|1,1,0]=4 1819 B14R2.4359 Brc1nc(C2CCCCCC2)cs1 Amb32660439 [0,1,0,1,0,0|2,0,0]=4 1820 B14R2.4359 Cc1ccc(C2CCCCCN2)o1 Amb19374492 [0,1,0,1,0,0|1,0,0]=3 1821 B14R2.4359 Cc1ccc(C2CCCCCN2)s1 Amb2235951 [0,1,0,1,0,0|1,1,0]=4 1822 B14R2.4359 Cc1ccc(C2CNCCCO2)o1 Amb9358483 [0,1,0,1,0,0|2,0,0]=4 1823 B14R2.4359 Cc1coc(C2CCCCCN2)n1 Amb27163267 [0,1,0,1,0,0|2,0,0]=4 1824 B14R2.4359 Cc1csc(C2CCCCCN2)c1 Amb3788580 [0,1,0,1,0,0|1,1,0]=4 1825 B14R2.4359 Cc1nc(C2CCCCCC2)cs1 Amb27255132 [0,1,0,1,0,0|2,0,0]=4 1826 B14R2.4359 Cc1ncc(C2CCCCCC2)s1 Amb27191549 [0,1,0,1,0,0|1,1,0]=4 1827 B14R2.4359 Clc1cc(C2CCCCCC2)no1 Amb27461770 [0,1,0,1,0,0|2,0,0]=4 1828 B14R2.4359 Clc1ccc(C2CCCNCC2)s1 Amb18569899 [0,1,0,1,0,0|1,1,0]=4 1829 B14R2.4359 Ic1cnn(C2CCCCCC2)c1 Amb27668403 [0,1,0,1,0,0|2,0,0]=4 1830 B14R2.4359 Ic1noc(C2CCCCCC2)n1 Amb27979874 [0,1,0,1,0,0|2,0,0]=4 1831 B14R2.4359 Nc1cc(C2CCCCCC2)no1 Amb18947733 [0,1,0,1,0,0|2,0,0]=4 1832 B14R2.4359 Nc1cc(C2CCCCCC2)on1 Amb27864706 [0,1,0,1,0,0|1,0,0]=3 1833 B14R2.4359 Nc1ccc(C2CCCCCC2)s1 Amb18189173 [0,1,0,1,0,0|0,1,0]=3 1834 B14R2.4359 Nc1ccn(C2CCCCCC2)n1 Amb18948028 [0,1,0,1,0,0|2,0,0]=4 1835 B14R2.4359 Nc1cnn(C2CCCCCC2)c1 Amb18278703 [0,1,0,1,0,0|2,0,0]=4 1836 B14R2.4359 Nc1nc(C2CCCCCC2)cs1 Amb25678014 [0,1,0,1,0,0|2,0,0]=4 1837 B14R2.4359 Nc1ncc(C2CCCCCC2)o1 Amb32881846 [0,1,0,1,0,0|1,0,0]=3 1838 B14R2.4359 O=C1NN=C(C2CCCCCC2)O1 Amb27593035 [0,1,0,1,0,0|2,0,0]=4 1839 B14R2.4359 Oc1cnn(C2CCCCCC2)c1 Amb27166305 [0,1,0,1,0,0|2,0,0]=4 1840 B14R2.4359 Oc1csc(C2CCCCCC2)n1 Amb28410679 [0,1,0,1,0,0|1,1,0]=4 1841 B14R2.4359 Sc1ncc(C2CCCCCC2)o1 Amb27191525 [0,1,0,1,0,0|1,0,0]=3 1842 B14R2.4374 Clc1ccc(CSCCC2CO2)o1 Amb32789087 [0,1,0,1,0,0|2,0,0]=4 1843 B14R2.4390 Clc1ccc(CSCC2CCN2)o1 Amb32789249 [0,1,0,1,0,0|2,0,0]=4 1844 B14R2.4390 Clc1ccc(CSCC2CNC2)o1 Amb32789251 [0,1,0,1,0,0|2,0,0]=4 1845 B14R2.4390 Nc1ccn(CCCC2CCC2)n1 Amb32706470 [0,1,0,1,0,0|2,0,0]=4 1846 B14R2.4390 Nc1cnn(CCCC2CCC2)c1 Amb32706471 [0,1,0,1,0,0|2,0,0]=4 1847 B14R2.4526 Cc1coc2c1C(O)CCCCC2 Amb27472793 [0,1,0,1,0,0|1,0,0]=3 1848 B14R2.5594 O=C1C=CC2=CCCCCCCC12 Amb28351676 [0,1,0,1,0,0|1,0,1]=4 1849 B14R2.10 CCC1CCNC(c2cccs2)C1 Amb28121738 [0,1,0,1,0,0|1,1,0]=4 1850 B14R2.10 CCC1NC(c2ccco2)CCO1 Amb33193804 [0,1,0,1,0,0|1,0,0]=3 1851 B14R2.10 CCC1NC(c2cccs2)CCO1 Amb33194362 [0,1,0,1,0,0|1,1,0]=4 1852 B14R2.10 CNC1CCCC(c2cccs2)C1 Amb28256160 [0,1,0,1,0,0|1,1,0]=4 1853 B14R2.10 ICC1CCCC(c2ccco2)O1 Amb27795545 [0,1,0,1,0,0|1,0,0]=3 1854 B14R2.10 ICC1CCCC(c2cccs2)O1 Amb28387767 [0,1,0,1,0,0|1,1,0]=4 1855 B14R2.10 NCC1CCCC(c2cccs2)O1 Amb28243059 [0,1,0,1,0,0|1,1,0]=4 1856 B14R2.10 OCC1CCCC(c2ccco2)O1 Amb28384938 [0,1,0,1,0,0|1,0,0]=3 1857 B14R2.56 CCNC1CCC(c2ccco2)C1 Amb28370241 [0,1,0,1,0,0|1,0,0]=3 1858 B14R2.56 CCNC1COC(c2ccco2)C1 Amb35614830 [0,1,0,1,0,0|2,0,0]=4 1859 B14R2.56 N#CCC1CCC(c2ccco2)O1 Amb27587198 [0,1,0,1,0,0|1,0,1]=4 1860 B14R2.56 NCCC1CCC(c2cccs2)O1 Amb27179411 [0,1,0,1,0,0|1,1,0]=4 1861 B14R2.56 NCCC1OCC(c2ccco2)O1 Amb17470654 [0,1,0,1,0,0|2,0,0]=4 1862 B14R2.56 OCCC1CSC(c2ccco2)N1 Amb32946588 [0,1,0,1,0,0|2,0,0]=4 1863 B14R2.56 OCC[C@@H]1CC[C@@H](c2cccs2)N1 Amb32946602 [0,1,0,1,0,0|1,1,0]=4 1864 B14R2.114 BrC(c1cccs1)C2CCCCC2 Amb27178988 [0,1,0,1,0,0|0,1,0]=3 1865 B14R2.114 CC(c1ccco1)C2CCNCC2 Amb28281085 [0,1,0,1,0,0|1,0,0]=3 1866 B14R2.114 CC(c1ccco1)N2CCNCC2 Amb17061039 [0,1,0,1,0,0|2,0,0]=4 1867 B14R2.114 CC(c1cccs1)C2CCNCC2 Amb28139625 [0,1,0,1,0,0|1,1,0]=4 1868 B14R2.114 CC(c1cccs1)N2CCCCC2 Amb27981176 [0,1,0,1,0,0|1,1,0]=4 1869 B14R2.114 CC(c1cnco1)C2CCNCC2 Amb33319909 [0,1,0,1,0,0|2,0,0]=4 1870 B14R2.114 C[C@@H](c1ccco1)N2CCOCC2 Amb28056072 [0,1,0,1,0,0|2,0,0]=4 1871 B14R2.114 C[C@H](c1ccco1)N2CCOCC2 Amb27960641 [0,1,0,1,0,0|2,0,0]=4 1872 B14R2.114 ClC(c1cccs1)C2CCCCC2 Amb28129164 [0,1,0,1,0,0|0,1,0]=3 1873 B14R2.114 N=C(c1ccco1)N2CCCCC2 Amb28366032 [0,1,0,1,0,0|1,0,1]=4 1874 B14R2.114 NC(C1=CCCCC1)c2ccco2 Amb18284448 [0,1,0,1,0,0|0,0,2]=4 1875 B14R2.114 NC(c1ccco1)C2CCCCC2 Amb18283655 [0,1,0,1,0,0|0,0,0]=2 1876 B14R2.114 NC(c1ccco1)C2CCCCC2 Amb35745581 [0,1,0,1,0,0|0,0,0]=2 1877 B14R2.114 NC(c1ccco1)C2CCCCO2 Amb18959599 [0,1,0,1,0,0|1,0,0]=3 1878 B14R2.114 NC(c1ccco1)C2CCCCS2 Amb27609515 [0,1,0,1,0,0|1,0,0]=3 1879 B14R2.114 NC(c1ccco1)C2CCOCC2 Amb18965458 [0,1,0,1,0,0|1,0,0]=3 1880 B14R2.114 NC(c1ccco1)C2CCOCC2 Amb32662373 [0,1,0,1,0,0|1,0,0]=3 1881 B14R2.114 NC(c1ccco1)C2CCSCC2 Amb35698518 [0,1,0,1,0,0|1,0,0]=3 1882 B14R2.114 NC(c1ccco1)C2CSCCO2 Amb27771884 [0,1,0,1,0,0|2,0,0]=4 1883 B14R2.114 NC(c1ccco1)[C@@H]2C=CCCC2 Amb27644543 [0,1,0,1,0,0|0,0,2]=4 1884 B14R2.114 NC(c1cccs1)C2CCCCC2 Amb22587181 [0,1,0,1,0,0|0,1,0]=3 1885 B14R2.114 NC(c1cccs1)C2CCCCC2 Amb6673616 [0,1,0,1,0,0|0,1,0]=3 1886 B14R2.114 NC(c1cccs1)C2CCNCC2 Amb18066404 [0,1,0,1,0,0|1,1,0]=4 1887 B14R2.114 NC(c1cccs1)C2CCOCC2 Amb18965450 [0,1,0,1,0,0|1,1,0]=4 1888 B14R2.114 NC(c1cccs1)C2CCOCC2 Amb29083282 [0,1,0,1,0,0|1,1,0]=4 1889 B14R2.114 NC(c1cccs1)C2CCSCC2 Amb35698522 [0,1,0,1,0,0|1,1,0]=4 1890 B14R2.114 NC(c1ccsc1)C2CCCCC2 Amb18949714 [0,1,0,1,0,0|2,0,0]=4 1891 B14R2.114 NC(c1cscn1)C2CCCCC2 Amb27663113 [0,1,0,1,0,0|2,0,0]=4 1892 B14R2.114 NC(c1ncco1)C2CCCNC2 Amb18192917 [0,1,0,1,0,0|2,0,0]=4 1893 B14R2.114 N[C@@H](c1ccco1)C2CCOCC2 Amb27430346 [0,1,0,1,0,0|1,0,0]=3 1894 B14R2.114 N[C@H](c1cccs1)C2CCCCC2 Amb27196410 [0,1,0,1,0,0|0,1,0]=3 1895 B14R2.114 N[C@H](c1ccsc1)C2CCCCC2 Amb27236994 [0,1,0,1,0,0|2,0,0]=4 1896 B14R2.114 O=C(c1ccco1)C2CCCCC2 Amb18804745 [0,1,0,1,0,0|0,0,1]=3 1897 B14R2.114 O=C(c1ccco1)C2CCSCC2 Amb35714073 [0,1,0,1,0,0|1,0,1]=4 1898 B14R2.114 O=C(c1ccco1)N2CCCCC2 Amb6317790 [0,1,0,1,0,0|1,0,1]=4 1899 B14R2.114 O=C(c1ccco1)[C@@H]2CCCCN2 Amb35617580 [0,1,0,1,0,0|1,0,1]=4 1900 B14R2.114 O=C(c1ccco1)[C@@H]2CCCNC2 Amb35617501 [0,1,0,1,0,0|1,0,1]=4 1901 B14R2.114 O=C(c1ccco1)[C@H]2CCCCN2 Amb35588374 [0,1,0,1,0,0|1,0,1]=4 1902 B14R2.114 O=C(c1ccco1)[C@H]2CCCNC2 Amb35588254 [0,1,0,1,0,0|1,0,1]=4 1903 B14R2.114 O=C(c1cccs1)C2CCCCC2 Amb2734515 [0,1,0,1,0,0|0,1,1]=4 1904 B14R2.114 OC(C1=CCCCC1)c2ccco2 Amb18186200 [0,1,0,1,0,0|0,0,2]=4 1905 B14R2.114 OC(C1=CCCO1)C2CCCCC2 Amb27617742 [0,1,0,1,0,0|0,0,2]=4 1906 B14R2.114 OC(c1ccco1)C2CCCCC2 Amb17138974 [0,1,0,1,0,0|0,0,0]=2 1907 B14R2.114 OC(c1ccco1)C2CCCCS2 Amb28123415 [0,1,0,1,0,0|1,0,0]=3 1908 B14R2.114 OC(c1ccco1)C2CCCNC2 Amb24489626 [0,1,0,1,0,0|1,0,0]=3 1909 B14R2.114 OC(c1ccco1)C2CCCOC2 Amb28281055 [0,1,0,1,0,0|1,0,0]=3 1910 B14R2.114 OC(c1ccco1)C2CCCSC2 Amb28066322 [0,1,0,1,0,0|1,0,0]=3 1911 B14R2.114 OC(c1ccco1)C2CCNCC2 Amb17079176 [0,1,0,1,0,0|1,0,0]=3 1912 B14R2.114 OC(c1ccco1)C2CCOCC2 Amb27462711 [0,1,0,1,0,0|1,0,0]=3 1913 B14R2.114 OC(c1ccco1)C2CCSCC2 Amb35698493 [0,1,0,1,0,0|1,0,0]=3 1914 B14R2.114 OC(c1ccco1)C2CNCCO2 Amb35581917 [0,1,0,1,0,0|2,0,0]=4 1915 B14R2.114 OC(c1ccco1)C2CNCCS2 Amb35601743 [0,1,0,1,0,0|2,0,0]=4 1916 B14R2.114 OC(c1ccco1)C2COCCN2 Amb35583068 [0,1,0,1,0,0|2,0,0]=4 1917 B14R2.114 OC(c1ccco1)C2CSCCN2 Amb35740448 [0,1,0,1,0,0|2,0,0]=4 1918 B14R2.114 OC(c1ccco1)C2CSCCO2 Amb27458201 [0,1,0,1,0,0|2,0,0]=4 1919 B14R2.114 OC(c1ccco1)[C@@H]2CCCCN2 Amb35737361 [0,1,0,1,0,0|1,0,0]=3 1920 B14R2.114 OC(c1ccco1)[C@@H]2CCCNC2 Amb35617450 [0,1,0,1,0,0|1,0,0]=3 1921 B14R2.114 OC(c1ccco1)[C@H]2CCCCN2 Amb35588410 [0,1,0,1,0,0|1,0,0]=3 1922 B14R2.114 OC(c1ccco1)[C@H]2CCCNC2 Amb35623603 [0,1,0,1,0,0|1,0,0]=3 1923 B14R2.114 OC(c1cccs1)C2CCCCC2 Amb17139618 [0,1,0,1,0,0|0,1,0]=3 1924 B14R2.114 OC(c1cccs1)C2CCCNC2 Amb9211448 [0,1,0,1,0,0|1,1,0]=4 1925 B14R2.114 OC(c1cccs1)C2CCCOC2 Amb18316562 [0,1,0,1,0,0|1,1,0]=4 1926 B14R2.114 OC(c1cccs1)C2CCNCC2 Amb5739718 [0,1,0,1,0,0|1,1,0]=4 1927 B14R2.114 OC(c1cccs1)C2CCOCC2 Amb18316558 [0,1,0,1,0,0|1,1,0]=4 1928 B14R2.114 OC(c1cccs1)C2CCSCC2 Amb35694717 [0,1,0,1,0,0|1,1,0]=4 1929 B14R2.114 OC(c1cccs1)[C@@H]2CCCCN2 Amb35737354 [0,1,0,1,0,0|1,1,0]=4 1930 B14R2.114 OC(c1cccs1)[C@@H]2CCCNC2 Amb35588369 [0,1,0,1,0,0|1,1,0]=4 1931 B14R2.114 OC(c1cccs1)[C@H]2CCCCN2 Amb35588302 [0,1,0,1,0,0|1,1,0]=4 1932 B14R2.114 OC(c1cccs1)[C@H]2CCCNC2 Amb35617699 [0,1,0,1,0,0|1,1,0]=4 1933 B14R2.114 OC(c1ccoc1)C2CCCCC2 Amb28241857 [0,1,0,1,0,0|2,0,0]=4 1934 B14R2.114 OC(c1ccsn1)C2CCCCC2 Amb27973869 [0,1,0,1,0,0|2,0,0]=4 1935 B14R2.114 OC(c1cnco1)C2CCCNC2 Amb27968755 [0,1,0,1,0,0|2,0,0]=4 1936 B14R2.114 OC(c1cscn1)C2CCCCC2 Amb27647497 [0,1,0,1,0,0|2,0,0]=4 1937 B14R2.114 OC(c1ncco1)C2CCNCC2 Amb28292389 [0,1,0,1,0,0|2,0,0]=4 1938 B14R2.114 OC(c1ncco1)N2CCCCC2 Amb26932483 [0,1,0,1,0,0|2,0,0]=4 1939 B14R2.114 OC(c1nccs1)C2CCCCC2 Amb27835283 [0,1,0,1,0,0|1,1,0]=4 1940 B14R2.114 O[C@@H](c1ccco1)[C@@H]2C=CCCC2 Amb27853880 [0,1,0,1,0,0|0,0,2]=4 1941 B14R2.114 O[C@@H](c1cccs1)C2CCCCC2 Amb27861742 [0,1,0,1,0,0|0,1,0]=3 1942 B14R2.114 O[C@H](c1ccco1)C2CCCCC2 Amb27220227 [0,1,0,1,0,0|0,0,0]=2 1943 B14R2.114 O[C@H](c1ccco1)[C@H]2C=CCCC2 Amb27184385 [0,1,0,1,0,0|0,0,2]=4 1944 B14R2.166 CCC1CCCC1(O)c2cccs2 Amb28046144 [0,1,0,1,0,0|0,1,0]=3 1945 B14R2.166 CCC1CCCC1(O)c2ccoc2 Amb27772346 [0,1,0,1,0,0|2,0,0]=4 1946 B14R2.166 CCC1CCCC1(O)c2ccsc2 Amb28324881 [0,1,0,1,0,0|2,0,0]=4 1947 B14R2.166 CCC1CCCC1(O)c2cncs2 Amb30026972 [0,1,0,1,0,0|1,1,0]=4 1948 B14R2.166 CCC1COCC1(O)c2ccco2 Amb29882758 [0,1,0,1,0,0|1,0,0]=3 1949 B14R2.166 CCC1COCC1(O)c2cccs2 Amb29882890 [0,1,0,1,0,0|1,1,0]=4 1950 B14R2.292 CC1CCCCC1(N)c2ccco2 Amb27399918 [0,1,0,1,0,0|0,0,0]=2 1951 B14R2.292 CC1CCCCC1(N)c2cccs2 Amb18321381 [0,1,0,1,0,0|0,1,0]=3 1952 B14R2.292 CC1CCCCC1(N)c2ccsn2 Amb27661281 [0,1,0,1,0,0|2,0,0]=4 1953 B14R2.292 CC1CCCCC1(N)c2cncs2 Amb35640473 [0,1,0,1,0,0|1,1,0]=4 1954 B14R2.292 CC1CCCCC1(N)c2cscn2 Amb28323949 [0,1,0,1,0,0|2,0,0]=4 1955 B14R2.292 CC1CCCCC1(O)c2ccco2 Amb27759773 [0,1,0,1,0,0|0,0,0]=2 1956 B14R2.292 CC1CCCCC1(O)c2ccns2 Amb28058676 [0,1,0,1,0,0|1,1,0]=4 1957 B14R2.292 CC1CCCCC1(O)c2cncs2 Amb35608811 [0,1,0,1,0,0|1,1,0]=4 1958 B14R2.292 CC1CCCCC1(O)c2cscn2 Amb27945097 [0,1,0,1,0,0|2,0,0]=4 1959 B14R2.292 CC1CNCCC1(F)c2cccs2 Amb28242757 [0,1,0,1,0,0|1,1,0]=4 1960 B14R2.292 CC1CNCCC1(O)c2cccs2 Amb27604715 [0,1,0,1,0,0|1,1,0]=4 1961 B14R2.292 CC1COCCC1(O)c2ccco2 Amb27475598 [0,1,0,1,0,0|1,0,0]=3 1962 B14R2.292 CC1NCCCC1(O)c2cccs2 Amb28134951 [0,1,0,1,0,0|1,1,0]=4 1963 B14R2.292 CC1SCCCC1(O)c2ccco2 Amb27476912 [0,1,0,1,0,0|1,0,0]=3 1964 B14R2.292 C[C@@H]1CCCC[C@@]1(N)c2cccs2 Amb27482588 [0,1,0,1,0,0|0,1,0]=3 1965 B14R2.308 CC1CCCC1C(Cl)c2cccs2 Amb28061663 [0,1,0,1,0,0|0,1,0]=3 1966 B14R2.308 CC1CCCC1C(N)C2=CCCO2 Amb28128773 [0,1,0,1,0,0|0,0,2]=4 1967 B14R2.308 CC1CCCC1C(N)c2ccns2 Amb27235049 [0,1,0,1,0,0|1,1,0]=4 1968 B14R2.308 CC1CCCC1C(N)c2ccoc2 Amb27448204 [0,1,0,1,0,0|2,0,0]=4 1969 B14R2.308 CC1CCCC1C(N)c2ccsc2 Amb27648802 [0,1,0,1,0,0|2,0,0]=4 1970 B14R2.308 CC1CCCC1C(N)c2cncs2 Amb29878044 [0,1,0,1,0,0|1,1,0]=4 1971 B14R2.308 CC1CCCC1C(O)c2ccns2 Amb28293224 [0,1,0,1,0,0|1,1,0]=4 1972 B14R2.308 CC1CCCC1C(O)c2ccoc2 Amb27198571 [0,1,0,1,0,0|2,0,0]=4 1973 B14R2.308 CC1CCCC1C(O)c2ccsn2 Amb27404686 [0,1,0,1,0,0|2,0,0]=4 1974 B14R2.308 CC1CCCC1C(O)c2cncs2 Amb35616570 [0,1,0,1,0,0|1,1,0]=4 1975 B14R2.308 CC1CCOC1C(Cl)c2cccs2 Amb28369005 [0,1,0,1,0,0|1,1,0]=4 1976 B14R2.308 CC1CCOC1C(N)c2cccs2 Amb28398274 [0,1,0,1,0,0|1,1,0]=4 1977 B14R2.308 CC1CCOC1C(O)c2ccco2 Amb27756827 [0,1,0,1,0,0|1,0,0]=3 1978 B14R2.308 CC1CNCC1C(=O)c2ccco2 Amb27398789 [0,1,0,1,0,0|1,0,1]=4 1979 B14R2.308 CC1CNCC1C(O)c2ccco2 Amb30026966 [0,1,0,1,0,0|1,0,0]=3 1980 B14R2.308 CC1CNCC1C(O)c2cccs2 Amb29875137 [0,1,0,1,0,0|1,1,0]=4 1981 B14R2.308 CC1NCCC1C(O)c2ccco2 Amb35741685 [0,1,0,1,0,0|1,0,0]=3 1982 B14R2.308 CC1NCCC1C(O)c2cccs2 Amb35584625 [0,1,0,1,0,0|1,1,0]=4 1983 B14R2.308 CN1CCCC1C(=O)c2ccco2 Amb35600334 [0,1,0,1,0,0|1,0,1]=4 1984 B14R2.308 CN1CCCC1C(N)c2ccco2 Amb35666129 [0,1,0,1,0,0|1,0,0]=3 1985 B14R2.308 CN1CCCC1C(N)c2cccs2 Amb30039725 [0,1,0,1,0,0|1,1,0]=4 1986 B14R2.308 CN1CCCC1C(O)c2ccco2 Amb35664391 [0,1,0,1,0,0|1,0,0]=3 1987 B14R2.308 CN1CCCC1C(O)c2cccs2 Amb35664398 [0,1,0,1,0,0|1,1,0]=4 1988 B14R2.308 NC1CCCC1C(O)c2ccco2 Amb18824113 [0,1,0,1,0,0|1,0,0]=3 1989 B14R2.308 NC1CCCC1C(O)c2cccs2 Amb18188343 [0,1,0,1,0,0|1,1,0]=4 1990 B14R2.308 NC1COCC1C(O)c2ccco2 Amb35586900 [0,1,0,1,0,0|2,0,0]=4 1991 B14R2.308 N[C@@H]1CCC[C@@H]1C(=O)c2ccco2 Amb35662725 [0,1,0,1,0,0|1,0,1]=4 1992 B14R2.308 N[C@@H]1CCC[C@@H]1C(O)c2ccco2 Amb30039546 [0,1,0,1,0,0|1,0,0]=3 1993 B14R2.308 N[C@@H]1CCC[C@@H]1C(O)c2cccs2 Amb30039521 [0,1,0,1,0,0|1,1,0]=4 1994 B14R2.308 O=C1CCC[C@H]1[C@H](O)c2ccco2 Amb27978603 [0,1,0,1,0,0|1,0,1]=4 1995 B14R2.308 OC1OCCC1C(O)c2ccco2 Amb27653193 [0,1,0,1,0,0|2,0,0]=4 1996 B14R2.388 BrC1CCCCC(c2cncs2)C1 Amb35635980 [0,1,0,1,0,0|1,1,0]=4 1997 B14R2.388 BrC1CCCCC(c2cscn2)C1 Amb27660088 [0,1,0,1,0,0|2,0,0]=4 1998 B14R2.388 CC1CCSCC(c2ccco2)N1 Amb27212079 [0,1,0,1,0,0|1,0,0]=3 1999 B14R2.388 ClC1C=C(c2ccco2)CCCC1 Amb28317130 [0,1,0,1,0,0|0,0,2]=4 2000 B14R2.388 ClC1CCCCC(c2cccs2)C1 Amb27833247 [0,1,0,1,0,0|0,1,0]=3 2001 B14R2.388 ClC1CCCCC(c2ccsc2)C1 Amb27977149 [0,1,0,1,0,0|2,0,0]=4 2002 B14R2.388 ClC1CCCCC(c2ccsn2)C1 Amb27412274 [0,1,0,1,0,0|2,0,0]=4 2003 B14R2.388 ClC1CCCCC(c2cncs2)C1 Amb35635979 [0,1,0,1,0,0|1,1,0]=4 2004 B14R2.388 NC1CCCCC(c2ccco2)C1 Amb27667368 [0,1,0,1,0,0|0,0,0]=2 2005 B14R2.388 NC1CCCCC(c2cncs2)C1 Amb35612984 [0,1,0,1,0,0|1,1,0]=4 2006 B14R2.388 NC1CCCCC(c2cscn2)C1 Amb27648265 [0,1,0,1,0,0|2,0,0]=4 2007 B14R2.388 OC1C=C(c2ccco2)CCCC1 Amb27805649 [0,1,0,1,0,0|0,0,2]=4 2008 B14R2.388 OC1CCCCC(c2cccs2)C1 Amb27798124 [0,1,0,1,0,0|0,1,0]=3 2009 B14R2.388 OC1CCCCC(c2ccns2)C1 Amb27247512 [0,1,0,1,0,0|1,1,0]=4 2010 B14R2.388 OC1CCCCC(c2ccoc2)C1 Amb27870499 [0,1,0,1,0,0|2,0,0]=4 2011 B14R2.388 OC1CCCCC(c2cncs2)C1 Amb35590286 [0,1,0,1,0,0|1,1,0]=4 2012 B14R2.724 CC(N[C@@H]1CC[C@H]1O)c2ccco2 Amb27198265 [0,1,0,1,0,0|2,0,0]=4 2013 B14R2.793 CC(Cc1cccs1)N2CCCC2 Amb27457310 [0,1,0,1,0,0|1,1,0]=4 2014 B14R2.793 CC(NC1CCCC1)c2ccco2 Amb2601535 [0,1,0,1,0,0|1,0,0]=3 2015 B14R2.793 CC(NC1CCCC1)c2cccs2 Amb9741444 [0,1,0,1,0,0|1,1,0]=4 2016 B14R2.793 CC(NC1CCOC1)c2ccco2 Amb28242230 [0,1,0,1,0,0|2,0,0]=4 2017 B14R2.793 CC(NC1CCSC1)c2ccco2 Amb9255094 [0,1,0,1,0,0|2,0,0]=4 2018 B14R2.793 CC(N[C@H]1CCNC1)c2ccco2 Amb27216471 [0,1,0,1,0,0|2,0,0]=4 2019 B14R2.793 CN(Cc1ccco1)C2CCNC2 Amb18988539 [0,1,0,1,0,0|2,0,0]=4 2020 B14R2.793 C[C@@H](NC1CCCC1)c2cccs2 Amb27748699 [0,1,0,1,0,0|1,1,0]=4 2021 B14R2.793 C[C@@H](NC1CCNC1)c2ccco2 Amb27772052 [0,1,0,1,0,0|2,0,0]=4 2022 B14R2.793 C[C@H](NC1CCCC1)c2ccco2 Amb28315365 [0,1,0,1,0,0|1,0,0]=3 2023 B14R2.793 C[C@H](NC1CCOC1)c2ccco2 Amb27609189 [0,1,0,1,0,0|2,0,0]=4 2024 B14R2.793 C[C@H](NC1CCSC1)c2ccco2 Amb28128445 [0,1,0,1,0,0|2,0,0]=4 2025 B14R2.793 ClC(CN1CCCC1)c2ccco2 Amb17548190 [0,1,0,1,0,0|1,0,0]=3 2026 B14R2.793 ClC(CN1CCCC1)c2cccs2 Amb17547905 [0,1,0,1,0,0|1,1,0]=4 2027 B14R2.793 FC(Cc1ccco1)C2CCCN2 Amb28242459 [0,1,0,1,0,0|1,0,0]=3 2028 B14R2.793 FC(Cc1cccs1)C2CCCN2 Amb27830720 [0,1,0,1,0,0|1,1,0]=4 2029 B14R2.793 NC(CC1=CCCC1)c2ccco2 Amb27246983 [0,1,0,1,0,0|0,0,2]=4 2030 B14R2.793 NC(CC1CC=CC1)c2ccco2 Amb35630364 [0,1,0,1,0,0|0,0,2]=4 2031 B14R2.793 NC(CC1CCCC1)c2ccco2 Amb18981695 [0,1,0,1,0,0|0,0,0]=2 2032 B14R2.793 NC(CC1CCCC1)c2ccsn2 Amb27968324 [0,1,0,1,0,0|2,0,0]=4 2033 B14R2.793 NC(CC1CCCC1)c2cscn2 Amb27825949 [0,1,0,1,0,0|2,0,0]=4 2034 B14R2.793 NC(CC1CCCC1)c2nccs2 Amb27191586 [0,1,0,1,0,0|1,1,0]=4 2035 B14R2.793 NC(CC1CCCO1)c2cccs2 Amb18300052 [0,1,0,1,0,0|1,1,0]=4 2036 B14R2.793 NC(CC1CCOC1)c2ccco2 Amb27868923 [0,1,0,1,0,0|1,0,0]=3 2037 B14R2.793 NC(CC1OCCO1)c2ccco2 Amb27650840 [0,1,0,1,0,0|2,0,0]=4 2038 B14R2.793 NC(CN1CCCC1)c2ccco2 Amb1138009 [0,1,0,1,0,0|1,0,0]=3 2039 B14R2.793 NC(CN1CCCC1)c2cccs2 Amb5724512 [0,1,0,1,0,0|1,1,0]=4 2040 B14R2.793 NC(Cc1ccco1)C2CCCS2 Amb27877714 [0,1,0,1,0,0|1,0,0]=3 2041 B14R2.793 NC(Cc1ccco1)C2CCOC2 Amb27947047 [0,1,0,1,0,0|1,0,0]=3 2042 B14R2.793 NC(Cc1ccco1)C2CCSC2 Amb28320620 [0,1,0,1,0,0|1,0,0]=3 2043 B14R2.793 NC(Cc1cccs1)C2CCCS2 Amb27194233 [0,1,0,1,0,0|1,1,0]=4 2044 B14R2.793 NC(Cc1ccns1)C2CCCC2 Amb35673692 [0,1,0,1,0,0|1,1,0]=4 2045 B14R2.793 NC(Cc1nccs1)C2CCCC2 Amb25893891 [0,1,0,1,0,0|1,1,0]=4 2046 B14R2.793 NC(Cn1cccn1)C2CCCC2 Amb27264331 [0,1,0,1,0,0|2,0,0]=4 2047 B14R2.793 O=C(CC1CCCN1)c2ccco2 Amb20668835 [0,1,0,1,0,0|1,0,1]=4 2048 B14R2.793 O=C(CC1CCCN1)c2ccco2 Amb22157206 [0,1,0,1,0,0|1,0,1]=4 2049 B14R2.793 O=C(CC1CCOC1)c2ccco2 Amb27587292 [0,1,0,1,0,0|1,0,1]=4 2050 B14R2.793 O=C(Cc1ccco1)C2CCCC2 Amb27478428 [0,1,0,1,0,0|0,0,1]=3 2051 B14R2.793 O=C(Cc1ccco1)C2CCCN2 Amb27641971 [0,1,0,1,0,0|1,0,1]=4 2052 B14R2.793 O=C(Cc1ccco1)[C@@H]2CCCN2 Amb35662347 [0,1,0,1,0,0|1,0,1]=4 2053 B14R2.793 O=C(Cc1ccco1)[C@@H]2CCNC2 Amb29891721 [0,1,0,1,0,0|1,0,1]=4 2054 B14R2.793 O=C(Cc1ccco1)[C@H]2CCCN2 Amb29891501 [0,1,0,1,0,0|1,0,1]=4 2055 B14R2.793 O=C(Cc1ccco1)[C@H]2CCNC2 Amb35659878 [0,1,0,1,0,0|1,0,1]=4 2056 B14R2.793 O=C(NC1CCCC1)c2ccco2 Amb2674361 [0,1,0,1,0,0|1,0,1]=4 2057 B14R2.793 O=C(OC1CCCC1)c2ccco2 Amb28454977 [0,1,0,1,0,0|1,0,1]=4 2058 B14R2.793 OC(CC1=CCCC1)c2ccco2 Amb27222903 [0,1,0,1,0,0|0,0,2]=4 2059 B14R2.793 OC(CC1CC=CC1)c2ccco2 Amb29885838 [0,1,0,1,0,0|0,0,2]=4 2060 B14R2.793 OC(CC1CCCC1)c2ccco2 Amb18805046 [0,1,0,1,0,0|0,0,0]=2 2061 B14R2.793 OC(CC1CCCC1)c2cccs2 Amb18321539 [0,1,0,1,0,0|0,1,0]=3 2062 B14R2.793 OC(CC1CCCC1)c2ccsc2 Amb18325098 [0,1,0,1,0,0|2,0,0]=4 2063 B14R2.793 OC(CC1CCCC1)c2ccsn2 Amb27852350 [0,1,0,1,0,0|2,0,0]=4 2064 B14R2.793 OC(CC1CCCC1)c2nccs2 Amb28206387 [0,1,0,1,0,0|1,1,0]=4 2065 B14R2.793 OC(CC1CCCN1)c2ccco2 Amb20668878 [0,1,0,1,0,0|1,0,0]=3 2066 B14R2.793 OC(CC1CCCN1)c2cccs2 Amb20622683 [0,1,0,1,0,0|1,1,0]=4 2067 B14R2.793 OC(CC1CCCO1)c2cccs2 Amb19055327 [0,1,0,1,0,0|1,1,0]=4 2068 B14R2.793 OC(CC1CCNC1)c2ccco2 Amb35740585 [0,1,0,1,0,0|1,0,0]=3 2069 B14R2.793 OC(CC1CCNC1)c2cccs2 Amb35740327 [0,1,0,1,0,0|1,1,0]=4 2070 B14R2.793 OC(CC1CCOC1)c2ccco2 Amb27247003 [0,1,0,1,0,0|1,0,0]=3 2071 B14R2.793 OC(CC1CCOC1)c2cccs2 Amb27868905 [0,1,0,1,0,0|1,1,0]=4 2072 B14R2.793 OC(CN1CCCC1)c2ccco2 Amb17104335 [0,1,0,1,0,0|1,0,0]=3 2073 B14R2.793 OC(CN1CCCC1)c2cccs2 Amb17104336 [0,1,0,1,0,0|1,1,0]=4 2074 B14R2.793 OC(Cc1ccco1)C2CCCN2 Amb27489368 [0,1,0,1,0,0|1,0,0]=3 2075 B14R2.793 OC(Cc1ccco1)C2CCCO2 Amb27883557 [0,1,0,1,0,0|1,0,0]=3 2076 B14R2.793 OC(Cc1ccco1)C2CCCS2 Amb28347597 [0,1,0,1,0,0|1,0,0]=3 2077 B14R2.793 OC(Cc1ccco1)C2CCNC2 Amb35620873 [0,1,0,1,0,0|1,0,0]=3 2078 B14R2.793 OC(Cc1ccco1)[C@@H]2CCCN2 Amb29891694 [0,1,0,1,0,0|1,0,0]=3 2079 B14R2.793 OC(Cc1ccco1)[C@@H]2CCNC2 Amb30039413 [0,1,0,1,0,0|1,0,0]=3 2080 B14R2.793 OC(Cc1ccco1)[C@H]2CCCN2 Amb30038995 [0,1,0,1,0,0|1,0,0]=3 2081 B14R2.793 OC(Cc1ccco1)[C@H]2CCNC2 Amb35664000 [0,1,0,1,0,0|1,0,0]=3 2082 B14R2.793 OC(Cc1cccs1)C2CCNC2 Amb35620649 [0,1,0,1,0,0|1,1,0]=4 2083 B14R2.793 OC(Cc1cccs1)[C@@H]2CCCN2 Amb29891537 [0,1,0,1,0,0|1,1,0]=4 2084 B14R2.793 OC(Cc1cccs1)[C@@H]2CCNC2 Amb29893161 [0,1,0,1,0,0|1,1,0]=4 2085 B14R2.793 OC(Cc1cccs1)[C@H]2CCCN2 Amb30039094 [0,1,0,1,0,0|1,1,0]=4 2086 B14R2.793 OC(Cc1cccs1)[C@H]2CCNC2 Amb35663905 [0,1,0,1,0,0|1,1,0]=4 2087 B14R2.793 OC(Cc1ccns1)C2CCCC2 Amb35733346 [0,1,0,1,0,0|1,1,0]=4 2088 B14R2.793 OC(Cc1ccoc1)C2CCCC2 Amb28369090 [0,1,0,1,0,0|2,0,0]=4 2089 B14R2.793 O[C@H](CN1CCCC1)c2ccco2 Amb27397048 [0,1,0,1,0,0|1,0,0]=3 2090 B14R2.1035 CCC1CC1NC(=O)c2ccco2 Amb28073612 [0,1,0,1,0,0|1,0,1]=4 2091 B14R2.1205 CC(c1ccco1)N2CCC2CN Amb35661382 [0,1,0,1,0,0|2,0,0]=4 2092 B14R2.1255 c1coc(C2CCCCCCN2)c1 Amb27644957 [0,1,0,1,0,0|0,0,0]=2 2093 B14R2.1255 c1ncc(C2CCCCCCC2)o1 Amb35655880 [0,1,0,1,0,0|1,0,0]=3 2094 B14R2.1255 c1noc(C2CCCCCCN2)n1 Amb27812459 [0,1,0,1,0,0|2,0,0]=4 2095 B14R2.3096 CCCC1CCC(=O)c2cccn21 Amb26006627 [0,1,0,1,0,0|1,0,1]=4 2096 B14R2.4887 CC1(c2ccco2)CCCCCN1 Amb27624343 [0,1,0,1,0,0|1,0,0]=3 2097 B14R2.4887 NC1(c2cccs2)CCCCCC1 Amb19052968 [0,1,0,1,0,0|0,1,0]=3 2098 B14R2.4887 NC1(c2cccs2)CCCOCC1 Amb28243301 [0,1,0,1,0,0|1,1,0]=4 2099 B14R2.4887 NC1(c2ccns2)CCCCCC1 Amb28073504 [0,1,0,1,0,0|1,1,0]=4 2100 B14R2.4887 NC1(c2ccsc2)CCCCCC1 Amb28457046 [0,1,0,1,0,0|2,0,0]=4 2101 B14R2.4887 NC1(c2cncs2)CCCCCC1 Amb35640474 [0,1,0,1,0,0|1,1,0]=4 2102 B14R2.4887 OC1(c2ccco2)CCCSCC1 Amb29860831 [0,1,0,1,0,0|1,0,0]=3 2103 B14R2.4887 OC1(c2cccs2)CCCSCC1 Amb29860847 [0,1,0,1,0,0|1,1,0]=4 2104 B14R2.4887 OC1(c2ccns2)CCCCCC1 Amb27785336 [0,1,0,1,0,0|1,1,0]=4 2105 B14R2.4887 OC1(c2ccsc2)CCCCCC1 Amb27207490 [0,1,0,1,0,0|2,0,0]=4 2106 B14R2.4887 OC1(c2cncs2)CCCCCC1 Amb30026971 [0,1,0,1,0,0|1,1,0]=4 2107 B14R2.5313 OC1CCCCCCc2occc21 Amb27484767 [0,1,0,1,0,0|0,0,0]=2 2108 B14R2.48 BrC1CCCCCC1c2ccco2 Amb28057618 [0,1,0,1,0,0|0,0,0]=2 2109 B14R2.48 BrC1CCCCCC1c2ccsc2 Amb27465161 [0,1,0,1,0,0|2,0,0]=4 2110 B14R2.48 BrC1CCCCCC1c2cncs2 Amb35632695 [0,1,0,1,0,0|1,1,0]=4 2111 B14R2.48 CC1NCCCOC1c2ccco2 Amb18280266 [0,1,0,1,0,0|1,0,0]=3 2112 B14R2.48 CC1SCCCNC1c2ccco2 Amb27403954 [0,1,0,1,0,0|1,0,0]=3 2113 B14R2.48 CN1CCNCCC1c2ccco2 Amb18065934 [0,1,0,1,0,0|1,0,0]=3 2114 B14R2.48 CN1CCNCCC1c2cccs2 Amb18066402 [0,1,0,1,0,0|1,1,0]=4 2115 B14R2.48 ClC1CCCCCC1c2ccns2 Amb27785341 [0,1,0,1,0,0|1,1,0]=4 2116 B14R2.48 ClC1CCCCCC1c2cncs2 Amb35632694 [0,1,0,1,0,0|1,1,0]=4 2117 B14R2.48 NC1CCCCCC1c2cccs2 Amb18280262 [0,1,0,1,0,0|0,1,0]=3 2118 B14R2.48 NC1CCCCCC1c2ccns2 Amb27449544 [0,1,0,1,0,0|1,1,0]=4 2119 B14R2.48 NC1CCCCCC1c2ccsn2 Amb27463901 [0,1,0,1,0,0|2,0,0]=4 2120 B14R2.48 NC1CCCCCC1c2cncs2 Amb35608577 [0,1,0,1,0,0|1,1,0]=4 2121 B14R2.48 NC1CCCCCC1c2cscn2 Amb28201877 [0,1,0,1,0,0|2,0,0]=4 2122 B14R2.48 OC1CCCCCC1c2ccco2 Amb28282739 [0,1,0,1,0,0|0,0,0]=2 2123 B14R2.48 OC1CCCCCC1c2cccs2 Amb18325091 [0,1,0,1,0,0|0,1,0]=3 2124 B14R2.48 OC1CCCCCC1c2ccns2 Amb27653778 [0,1,0,1,0,0|1,1,0]=4 2125 B14R2.48 OC1CCCCCC1c2ccoc2 Amb26859569 [0,1,0,1,0,0|2,0,0]=4 2126 B14R2.48 OC1CCCCCC1c2ccsc2 Amb24368138 [0,1,0,1,0,0|2,0,0]=4 2127 B14R2.48 OC1CCCCCC1c2ccsn2 Amb25083217 [0,1,0,1,0,0|2,0,0]=4 2128 B14R2.48 OC1CCCCCC1c2cncs2 Amb32944667 [0,1,0,1,0,0|1,1,0]=4 2129 B14R2.48 OC1CCCCCC1c2cscn2 Amb25912877 [0,1,0,1,0,0|2,0,0]=4 2130 B14R2.48 OC1CCCCCC1c2nccs2 Amb33213108 [0,1,0,1,0,0|1,1,0]=4 2131 B14R2.48 OC1CCCCCC1n2cccc2 Amb27794106 [0,1,0,1,0,0|2,0,0]=4 2132 B14R2.48 O[C@@H]1CCCCC[C@H]1c2ccco2 Amb32944789 [0,1,0,1,0,0|0,0,0]=2 2133 B14R2.48 O[C@@H]1CCCCC[C@H]1c2cccs2 Amb32945235 [0,1,0,1,0,0|0,1,0]=3 2134 B14R2.48 O[C@@H]1CCCCC[C@H]1c2ccns2 Amb32945594 [0,1,0,1,0,0|1,1,0]=4 2135 B14R2.48 O[C@@H]1CCCCC[C@H]1c2ccoc2 Amb32950715 [0,1,0,1,0,0|2,0,0]=4 2136 B14R2.48 O[C@@H]1CCCCC[C@H]1c2ccsc2 Amb33212901 [0,1,0,1,0,0|2,0,0]=4 2137 B14R2.48 O[C@@H]1CCCCC[C@H]1c2ccsn2 Amb33213977 [0,1,0,1,0,0|2,0,0]=4 2138 B14R2.48 O[C@@H]1CCCCC[C@H]1c2cncs2 Amb32944626 [0,1,0,1,0,0|1,1,0]=4 2139 B14R2.48 O[C@@H]1CCCCC[C@H]1c2cscn2 Amb32944328 [0,1,0,1,0,0|2,0,0]=4 2140 B14R2.48 O[C@@H]1CCCCC[C@H]1c2nccs2 Amb33213102 [0,1,0,1,0,0|1,1,0]=4 2141 B14R2.50 BrC1CCCCC1Cc2ccns2 Amb29887271 [0,1,0,1,0,0|1,1,0]=4 2142 B14R2.50 BrC1CCCCC1Cc2ccsc2 Amb27854397 [0,1,0,1,0,0|2,0,0]=4 2143 B14R2.50 CC1CCCCC1Nc2nccs2 Amb4304124 [0,1,0,1,0,0|1,1,0]=4 2144 B14R2.50 CC1CCCCC1Nn2cccc2 Amb28396431 [0,1,0,1,0,0|2,0,0]=4 2145 B14R2.50 CC1CCCCN1Cc2ccco2 Amb27661667 [0,1,0,1,0,0|0,0,0]=2 2146 B14R2.50 CC1CCCCN1Cc2cscn2 Amb28318689 [0,1,0,1,0,0|2,0,0]=4 2147 B14R2.50 CC1CCCCN1Cc2nccs2 Amb27766409 [0,1,0,1,0,0|1,1,0]=4 2148 B14R2.50 CC1CCCNC1Cn2cccn2 Amb27758540 [0,1,0,1,0,0|2,0,0]=4 2149 B14R2.50 CC1CNCCN1Cc2ccco2 Amb17233750 [0,1,0,1,0,0|1,0,0]=3 2150 B14R2.50 CC1CNCCN1Cc2ccno2 Amb18963089 [0,1,0,1,0,0|2,0,0]=4 2151 B14R2.50 CC1COCCN1Cc2cccs2 Amb27219771 [0,1,0,1,0,0|1,1,0]=4 2152 B14R2.50 CC1COCCN1Cc2ccno2 Amb28078566 [0,1,0,1,0,0|2,0,0]=4 2153 B14R2.50 CC1CSCCN1Cc2ccco2 Amb28078795 [0,1,0,1,0,0|1,0,0]=3 2154 B14R2.50 CC1CSCCN1Cc2cccs2 Amb27761237 [0,1,0,1,0,0|1,1,0]=4 2155 B14R2.50 CC1NCCCC1Cn2cccn2 Amb28198726 [0,1,0,1,0,0|2,0,0]=4 2156 B14R2.50 CN1CCCCC1Cn2cccc2 Amb18809111 [0,1,0,1,0,0|2,0,0]=4 2157 B14R2.50 CN1CCNCC1Cc2cccs2 Amb18188676 [0,1,0,1,0,0|1,1,0]=4 2158 B14R2.50 C[C@H]1CNCCN1Cc2cccs2 Amb28368077 [0,1,0,1,0,0|1,1,0]=4 2159 B14R2.50 ClC1CCCCC1Cc2ccns2 Amb29887245 [0,1,0,1,0,0|1,1,0]=4 2160 B14R2.50 ClC1CCCCC1Cc2ccsc2 Amb27414519 [0,1,0,1,0,0|2,0,0]=4 2161 B14R2.50 ClC1CCCCC1Cc2nccs2 Amb27448947 [0,1,0,1,0,0|1,1,0]=4 2162 B14R2.50 ClC1CCOCC1Cc2cccs2 Amb27595135 [0,1,0,1,0,0|1,1,0]=4 2163 B14R2.50 N=C1CCCCN1Cc2ccco2 Amb18180804 [0,1,0,1,0,0|1,0,1]=4 2164 B14R2.50 NC1CCCCC1Cc2ccco2 Amb1107542 [0,1,0,1,0,0|0,0,0]=2 2165 B14R2.50 NC1CCCCC1Cc2cccs2 Amb17508943 [0,1,0,1,0,0|0,1,0]=3 2166 B14R2.50 NC1CCCCC1Cc2ccns2 Amb29870859 [0,1,0,1,0,0|1,1,0]=4 2167 B14R2.50 NC1CCCCC1Cc2ccoc2 Amb27658591 [0,1,0,1,0,0|2,0,0]=4 2168 B14R2.50 O=C1CCCCN1Cc2ccco2 Amb28242401 [0,1,0,1,0,0|1,0,1]=4 2169 B14R2.50 O=C1CCNCC1Cc2ccco2 Amb27657503 [0,1,0,1,0,0|1,0,1]=4 2170 B14R2.50 O=C1NCCCC1Cc2ccco2 Amb27810872 [0,1,0,1,0,0|1,0,1]=4 2171 B14R2.50 OC1CCCCC1Cc2ccco2 Amb18178849 [0,1,0,1,0,0|0,0,0]=2 2172 B14R2.50 OC1CCCCC1Cc2cccs2 Amb17508819 [0,1,0,1,0,0|0,1,0]=3 2173 B14R2.50 OC1CCCCC1Cc2ccns2 Amb30008532 [0,1,0,1,0,0|1,1,0]=4 2174 B14R2.50 OC1CCCCC1Cc2ccoc2 Amb25824953 [0,1,0,1,0,0|2,0,0]=4 2175 B14R2.50 OC1CCCCC1Cc2ccsc2 Amb19082081 [0,1,0,1,0,0|2,0,0]=4 2176 B14R2.50 OC1CCCCC1Cc2cncs2 Amb27174862 [0,1,0,1,0,0|1,1,0]=4 2177 B14R2.50 OC1CCCCC1Cc2cscn2 Amb26941248 [0,1,0,1,0,0|2,0,0]=4 2178 B14R2.50 OC1CCCCC1Cc2nccs2 Amb28070016 [0,1,0,1,0,0|1,1,0]=4 2179 B14R2.50 OC1CCCCC1Cn2cccc2 Amb27477351 [0,1,0,1,0,0|2,0,0]=4 2180 B14R2.50 OC1CCOCC1Cc2ccco2 Amb28242479 [0,1,0,1,0,0|1,0,0]=3 2181 B14R2.50 OC1CCOCC1Cc2cccs2 Amb28048557 [0,1,0,1,0,0|1,1,0]=4 2182 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2ccco2 Amb33213273 [0,1,0,1,0,0|0,0,0]=2 2183 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2cccs2 Amb32950754 [0,1,0,1,0,0|0,1,0]=3 2184 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2ccns2 Amb32945691 [0,1,0,1,0,0|1,1,0]=4 2185 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2ccoc2 Amb33212807 [0,1,0,1,0,0|2,0,0]=4 2186 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2ccsc2 Amb32945968 [0,1,0,1,0,0|2,0,0]=4 2187 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2cncs2 Amb32944752 [0,1,0,1,0,0|1,1,0]=4 2188 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2cscn2 Amb32945001 [0,1,0,1,0,0|2,0,0]=4 2189 B14R2.50 O[C@@H]1CCCC[C@H]1Cc2nccs2 Amb32950831 [0,1,0,1,0,0|1,1,0]=4 2190 B14R2.50 O[C@H]1CCCC[C@@H]1Cc2ccco2 Amb27432268 [0,1,0,1,0,0|0,0,0]=2 2191 B14R2.50 O[C@H]1CCCC[C@@H]1Sc2ncco2 Amb27973890 [0,1,0,1,0,0|2,0,0]=4 2192 B14R2.50 O[C@H]1CCCC\C1=C/c2ccco2 Amb27394790 [0,1,0,1,0,0|0,0,2]=4 2193 B14R2.83 BrC[C@@H]1CCCN1Cc2cccs2 Amb29851389 [0,1,0,1,0,0|1,1,0]=4 2194 B14R2.83 BrC[C@H]1CCCN1Cc2cccs2 Amb30012499 [0,1,0,1,0,0|1,1,0]=4 2195 B14R2.83 CCC1CCCN1Cc2ccno2 Amb27431245 [0,1,0,1,0,0|1,0,0]=3 2196 B14R2.83 CCC1CCCN1Cc2ccsc2 Amb27615730 [0,1,0,1,0,0|2,0,0]=4 2197 B14R2.83 CCC1CCCN1Cc2cocn2 Amb28293976 [0,1,0,1,0,0|2,0,0]=4 2198 B14R2.83 CNC1CCCC1Cc2ccns2 Amb29870858 [0,1,0,1,0,0|1,1,0]=4 2199 B14R2.83 CNC1CCCC1Cc2ccoc2 Amb27984344 [0,1,0,1,0,0|2,0,0]=4 2200 B14R2.83 CNC1CCCC1Cc2nccs2 Amb27265507 [0,1,0,1,0,0|1,1,0]=4 2201 B14R2.83 CNC1CCCC1Sc2ncco2 Amb27475751 [0,1,0,1,0,0|2,0,0]=4 2202 B14R2.83 CNC1COCC1Cc2cccs2 Amb35608440 [0,1,0,1,0,0|1,1,0]=4 2203 B14R2.83 CNC1CSCC1Cc2cccs2 Amb27753336 [0,1,0,1,0,0|1,1,0]=4 2204 B14R2.83 COC1CCCC1Sc2cccs2 Amb27256014 [0,1,0,1,0,0|1,1,0]=4 2205 B14R2.83 ClC[C@@H]1CCCN1Cc2cccs2 Amb29851083 [0,1,0,1,0,0|1,1,0]=4 2206 B14R2.83 ClC[C@H]1CCCN1Cc2cccs2 Amb29851505 [0,1,0,1,0,0|1,1,0]=4 2207 B14R2.83 FCC1CCCN1Cc2ccno2 Amb28385194 [0,1,0,1,0,0|2,0,0]=4 2208 B14R2.83 NCC1CCCC1Cc2ccns2 Amb35643719 [0,1,0,1,0,0|1,1,0]=4 2209 B14R2.83 NCC1CCCC1Cc2ccsc2 Amb27609049 [0,1,0,1,0,0|2,0,0]=4 2210 B14R2.83 NCC1CCCC1Cc2cncs2 Amb27412688 [0,1,0,1,0,0|1,1,0]=4 2211 B14R2.83 NCC1CCCC1Cc2nccs2 Amb28385257 [0,1,0,1,0,0|1,1,0]=4 2212 B14R2.83 NCC1CCCN1Cc2cccs2 Amb5754721 [0,1,0,1,0,0|1,1,0]=4 2213 B14R2.83 NCC1CCNC1Cc2ccco2 Amb18193680 [0,1,0,1,0,0|1,0,0]=3 2214 B14R2.83 NCC1CCNC1Cc2cccs2 Amb18188723 [0,1,0,1,0,0|1,1,0]=4 2215 B14R2.83 NC[C@H]1CCCN1Cc2cccs2 Amb28198095 [0,1,0,1,0,0|1,1,0]=4 2216 B14R2.83 OCC1CCCN1Cc2ccco2 Amb5755857 [0,1,0,1,0,0|1,0,0]=3 2217 B14R2.83 OCC1CCCN1Cc2cccs2 Amb5755858 [0,1,0,1,0,0|1,1,0]=4 2218 B14R2.83 OCC1CCCN1Cc2ccno2 Amb18187110 [0,1,0,1,0,0|2,0,0]=4 2219 B14R2.98 CCC1CCCCC1n2cccc2 Amb18180710 [0,1,0,1,0,0|2,0,0]=4 2220 B14R2.98 CCC1CCCCC1n2cccn2 Amb28241849 [0,1,0,1,0,0|2,0,0]=4 2221 B14R2.98 CCC1CCCCN1c2nnco2 Amb28190139 [0,1,0,1,0,0|2,0,0]=4 2222 B14R2.98 CCC1CNCCC1c2ccco2 Amb27754704 [0,1,0,1,0,0|0,0,0]=2 2223 B14R2.98 CCC1CNCCC1c2ccoc2 Amb28387756 [0,1,0,1,0,0|2,0,0]=4 2224 B14R2.98 CCC1CNCCC1c2cscn2 Amb27414692 [0,1,0,1,0,0|2,0,0]=4 2225 B14R2.98 CCN1CCCCC1c2cccs2 Amb23578331 [0,1,0,1,0,0|0,1,0]=3 2226 B14R2.98 CCN1CCCCC1c2ccoc2 Amb23578305 [0,1,0,1,0,0|2,0,0]=4 2227 B14R2.98 CCN1CCCCC1c2ccsc2 Amb23578359 [0,1,0,1,0,0|2,0,0]=4 2228 B14R2.98 CCN1CCCCC1c2nnco2 Amb27586485 [0,1,0,1,0,0|2,0,0]=4 2229 B14R2.98 CCN1CCNCC1c2ccco2 Amb18065932 [0,1,0,1,0,0|1,0,0]=3 2230 B14R2.98 CCN1CCNCC1c2cccs2 Amb18066400 [0,1,0,1,0,0|1,1,0]=4 2231 B14R2.98 CNC1CCCCC1c2cncs2 Amb35608578 [0,1,0,1,0,0|1,1,0]=4 2232 B14R2.98 N#CC1CCCCC1c2cccs2 Amb17578577 [0,1,0,1,0,0|0,1,1]=4 2233 B14R2.98 NCC1CCCCC1c2ccns2 Amb27450119 [0,1,0,1,0,0|1,1,0]=4 2234 B14R2.98 NCC1CCCCC1c2cncs2 Amb29878040 [0,1,0,1,0,0|1,1,0]=4 2235 B14R2.98 NCC1CCCCC1c2cscn2 Amb27648266 [0,1,0,1,0,0|2,0,0]=4 2236 B14R2.98 NCC1CCCCC1c2ncno2 Amb27225568 [0,1,0,1,0,0|2,0,0]=4 2237 B14R2.98 NCC1CCCNC1c2cccs2 Amb24558618 [0,1,0,1,0,0|1,1,0]=4 2238 B14R2.98 NCC1CCCOC1c2cccs2 Amb28193505 [0,1,0,1,0,0|1,1,0]=4 2239 B14R2.98 NC[C@@H]1CCCN[C@H]1c2cccs2 Amb18188692 [0,1,0,1,0,0|1,1,0]=4 2240 B14R2.98 O=CN1CCCCC1c2ccco2 Amb23578287 [0,1,0,1,0,0|1,0,1]=4 2241 B14R2.98 OCC1CCCNC1c2cccs2 Amb27617904 [0,1,0,1,0,0|1,1,0]=4 2242 B14R2.137 NCC1CCN1CCc2cccs2 Amb33252063 [0,1,0,1,0,0|1,1,0]=4 2243 B14R2.245 CCCC1COCC1n2cccc2 Amb35636440 [0,1,0,1,0,0|2,0,0]=4 2244 B14R2.245 CCNC1CCCC1c2ccco2 Amb27812707 [0,1,0,1,0,0|0,0,0]=2 2245 B14R2.245 CCNC1CCCC1c2ccns2 Amb28074336 [0,1,0,1,0,0|1,1,0]=4 2246 B14R2.245 CCNC1CCCC1c2ccsc2 Amb27232324 [0,1,0,1,0,0|2,0,0]=4 2247 B14R2.245 CCNC1CCCC1c2ccsn2 Amb27873151 [0,1,0,1,0,0|2,0,0]=4 2248 B14R2.245 CCNC1CCCC1c2cncs2 Amb35608576 [0,1,0,1,0,0|1,1,0]=4 2249 B14R2.245 CCNC1CCCC1n2cccn2 Amb18982098 [0,1,0,1,0,0|2,0,0]=4 2250 B14R2.245 CCNC1COCC1c2ccco2 Amb35632021 [0,1,0,1,0,0|1,0,0]=3 2251 B14R2.245 CCNC1COCC1c2cccs2 Amb29877521 [0,1,0,1,0,0|1,1,0]=4 2252 B14R2.245 CNCC1CCCC1c2cccs2 Amb27748702 [0,1,0,1,0,0|0,1,0]=3 2253 B14R2.245 CNCC1CCCC1c2ccoc2 Amb27830793 [0,1,0,1,0,0|2,0,0]=4 2254 B14R2.245 CNCC1CCCC1c2ccsc2 Amb27609252 [0,1,0,1,0,0|2,0,0]=4 2255 B14R2.245 CNCC1CCCC1c2cncs2 Amb29878041 [0,1,0,1,0,0|1,1,0]=4 2256 B14R2.245 FCCN1CCCC1c2ccco2 Amb27448666 [0,1,0,1,0,0|1,0,0]=3 2257 B14R2.245 NCCC1CCCN1c2cccs2 Amb18188724 [0,1,0,1,0,0|1,1,0]=4 2258 B14R2.245 NCCC1CCCN1c2cnco2 Amb18193028 [0,1,0,1,0,0|2,0,0]=4 2259 B14R2.245 NCCN1CCCC1c2ccco2 Amb6891278 [0,1,0,1,0,0|1,0,0]=3 2260 B14R2.245 NCCN1CCCC1c2cccs2 Amb6891308 [0,1,0,1,0,0|1,1,0]=4 2261 B14R2.245 OCCN1CCOC1c2ccco2 Amb27197644 [0,1,0,1,0,0|2,0,0]=4 2262 B14R2.322 C(=N\NC1CCCC1)/c2ccco2 Amb27810047 [0,1,0,1,0,0|1,0,1]=4 2263 B14R2.322 c1cc(CCCC2CCCN2)cs1 Amb33322021 [0,1,0,1,0,0|2,0,0]=4 2264 B14R2.322 c1cc(CCCC2CCNC2)cs1 Amb33321997 [0,1,0,1,0,0|2,0,0]=4 2265 B14R2.322 c1cnn(CCCC2CCCN2)c1 Amb6891275 [0,1,0,1,0,0|2,0,0]=4 2266 B14R2.322 c1cnn(CCCC2CCNC2)c1 Amb32727117 [0,1,0,1,0,0|2,0,0]=4 2267 B14R2.322 c1cnn(CCNC2CCCC2)c1 Amb19024654 [0,1,0,1,0,0|2,0,0]=4 2268 B14R2.322 c1coc(CCNC2=NCCC2)c1 Amb27797956 [0,1,0,1,0,0|1,0,1]=4 2269 B14R2.322 c1coc(CNCC2CCCC2)c1 Amb8953843 [0,1,0,1,0,0|0,0,0]=2 2270 B14R2.322 c1coc(CNCC2CCCN2)c1 Amb17233736 [0,1,0,1,0,0|1,0,0]=3 2271 B14R2.322 c1coc(CNCC2CCCO2)c1 Amb7077059 [0,1,0,1,0,0|1,0,0]=3 2272 B14R2.322 c1coc(CNCC2CCCO2)c1 Amb9751618 [0,1,0,1,0,0|1,0,0]=3 2273 B14R2.322 c1csc(CCNC2CCCC2)c1 Amb6697734 [0,1,0,1,0,0|0,1,0]=3 2274 B14R2.322 c1csc(CCNC2CCCC2)n1 Amb17315497 [0,1,0,1,0,0|1,1,0]=4 2275 B14R2.322 c1csc(CCNC2CCSC2)c1 Amb6697740 [0,1,0,1,0,0|1,1,0]=4 2276 B14R2.322 c1csc(CNCC2CCCO2)c1 Amb1154124 [0,1,0,1,0,0|1,1,0]=4 2277 B14R2.322 c1csc(CNCC2CCCO2)c1 Amb6335702 [0,1,0,1,0,0|1,1,0]=4 2278 B14R2.384 BrC1COCC1CCc2cccs2 Amb35590012 [0,1,0,1,0,0|1,1,0]=4 2279 B14R2.384 BrC1CSCC1CCc2cccs2 Amb27457145 [0,1,0,1,0,0|1,1,0]=4 2280 B14R2.384 Brc1ccoc1CNC2CCNC2 Amb35601848 [0,1,0,1,0,0|2,0,0]=4 2281 B14R2.384 Brc1ccoc1CNC2CCOC2 Amb27618007 [0,1,0,1,0,0|2,0,0]=4 2282 B14R2.384 Brc1ccoc1CN[C@H]2CCNC2 Amb29890462 [0,1,0,1,0,0|2,0,0]=4 2283 B14R2.384 CC1CCCC1NCc2ccns2 Amb35733278 [0,1,0,1,0,0|1,1,0]=4 2284 B14R2.384 CC1CCCC1NCc2ccoc2 Amb27648668 [0,1,0,1,0,0|2,0,0]=4 2285 B14R2.384 CC1CCCC1NCc2cscn2 Amb28317863 [0,1,0,1,0,0|2,0,0]=4 2286 B14R2.384 CC1COCC1NCc2ccco2 Amb35590887 [0,1,0,1,0,0|1,0,0]=3 2287 B14R2.384 CC1COCC1NCc2cccs2 Amb30027193 [0,1,0,1,0,0|1,1,0]=4 2288 B14R2.384 CC1COCC1NCc2ccno2 Amb35590897 [0,1,0,1,0,0|2,0,0]=4 2289 B14R2.384 CC1COCC1NCc2cnco2 Amb35613337 [0,1,0,1,0,0|2,0,0]=4 2290 B14R2.384 CC1CSCC1NCc2ccco2 Amb27633551 [0,1,0,1,0,0|1,0,0]=3 2291 B14R2.384 CC1CSCC1NCc2ccno2 Amb27165014 [0,1,0,1,0,0|2,0,0]=4 2292 B14R2.384 CC1CSCC1NCc2cnco2 Amb27774399 [0,1,0,1,0,0|2,0,0]=4 2293 B14R2.384 CC1OCCC1NCc2cccs2 Amb28242054 [0,1,0,1,0,0|1,1,0]=4 2294 B14R2.384 CN1CCCC1CCn2cccc2 Amb35692165 [0,1,0,1,0,0|2,0,0]=4 2295 B14R2.384 Cc1ccoc1CN[C@H]2CCNC2 Amb29892655 [0,1,0,1,0,0|2,0,0]=4 2296 B14R2.384 Cc1ccoc1CSC2CCNC2 Amb32987479 [0,1,0,1,0,0|2,0,0]=4 2297 B14R2.384 Cc1ccsc1CNC2CCCC2 Amb1922671 [0,1,0,1,0,0|1,1,0]=4 2298 B14R2.384 Cc1ccsc1CNC2CCCC2 Amb6864567 [0,1,0,1,0,0|1,1,0]=4 2299 B14R2.384 Cc1ncoc1CNC2CCCC2 Amb27262726 [0,1,0,1,0,0|2,0,0]=4 2300 B14R2.384 ClC1CCCC1CCc2ccsc2 Amb27412725 [0,1,0,1,0,0|2,0,0]=4 2301 B14R2.384 ClC1COCC1CCc2cccs2 Amb35589926 [0,1,0,1,0,0|1,1,0]=4 2302 B14R2.384 Cn1cccc1CCC2CCCN2 Amb25723033 [0,1,0,1,0,0|2,0,0]=4 2303 B14R2.384 Cn1cccc1CNC2CCCC2 Amb6861971 [0,1,0,1,0,0|2,0,0]=4 2304 B14R2.384 Cn1cccc1CSC2CCCC2 Amb28047941 [0,1,0,1,0,0|2,0,0]=4 2305 B14R2.384 Ic1ccsc1CNC2CCCC2 Amb28042730 [0,1,0,1,0,0|1,1,0]=4 2306 B14R2.384 N=C1CCCN1CCc2ccco2 Amb18180801 [0,1,0,1,0,0|1,0,1]=4 2307 B14R2.384 NC1CCCC1CCc2cccs2 Amb28241879 [0,1,0,1,0,0|0,1,0]=3 2308 B14R2.384 NC1CCCC1OCc2cccs2 Amb27165273 [0,1,0,1,0,0|1,1,0]=4 2309 B14R2.384 NC1COCC1CCc2cccs2 Amb29882705 [0,1,0,1,0,0|1,1,0]=4 2310 B14R2.384 NN1CCCC1CCc2ccco2 Amb24593571 [0,1,0,1,0,0|1,0,0]=3 2311 B14R2.384 Nc1cnoc1CCC2CCCC2 Amb33379871 [0,1,0,1,0,0|1,0,0]=3 2312 B14R2.384 Nc1cnoc1CCN2CCCC2 Amb18824087 [0,1,0,1,0,0|2,0,0]=4 2313 B14R2.384 O=C1CCCC1CCc2cccs2 Amb28241877 [0,1,0,1,0,0|0,1,1]=4 2314 B14R2.384 OC1CCCC1CCc2cccs2 Amb26055763 [0,1,0,1,0,0|0,1,0]=3 2315 B14R2.384 OC1CCCC1CCc2ccns2 Amb32944459 [0,1,0,1,0,0|1,1,0]=4 2316 B14R2.384 OC1CCCC1CCc2ccsc2 Amb26015773 [0,1,0,1,0,0|2,0,0]=4 2317 B14R2.384 OC1CCCC1OCc2ccco2 Amb35695407 [0,1,0,1,0,0|1,0,0]=3 2318 B14R2.384 OC1CCCC1OCc2cccs2 Amb35695721 [0,1,0,1,0,0|1,1,0]=4 2319 B14R2.384 OC1CNCC1CCc2cccs2 Amb32950863 [0,1,0,1,0,0|1,1,0]=4 2320 B14R2.384 OC1COCC1CCc2cccs2 Amb32945139 [0,1,0,1,0,0|1,1,0]=4 2321 B14R2.384 O[C@@H]1CCC[C@H]1CCc2cccs2 Amb32950026 [0,1,0,1,0,0|0,1,0]=3 2322 B14R2.384 O[C@@H]1CCC[C@H]1CCc2ccns2 Amb32950775 [0,1,0,1,0,0|1,1,0]=4 2323 B14R2.384 O[C@@H]1CCC[C@H]1CCc2ccsc2 Amb32945094 [0,1,0,1,0,0|2,0,0]=4 2324 B14R2.384 O[C@@H]1CCC[C@H]1SCc2ccco2 Amb27822797 [0,1,0,1,0,0|1,0,0]=3 2325 B14R2.384 O[C@@H]1CNC[C@H]1CCc2cccs2 Amb32945117 [0,1,0,1,0,0|1,1,0]=4 2326 B14R2.384 O[C@@H]1COC[C@H]1CCc2cccs2 Amb32945492 [0,1,0,1,0,0|1,1,0]=4 2327 B14R2.384 O[C@@H]1COC[C@H]1NCc2ccco2 Amb27250920 [0,1,0,1,0,0|2,0,0]=4 2328 B14R2.384 O[C@@H]1COC[C@H]1SCc2ccco2 Amb35632230 [0,1,0,1,0,0|2,0,0]=4 2329 B14R2.384 O[C@H]1CCC[C@@H]1NCc2cccs2 Amb27981996 [0,1,0,1,0,0|1,1,0]=4 2330 B14R2.726 OC1CCC1CCCn2cccn2 Amb33213213 [0,1,0,1,0,0|2,0,0]=4 2331 B14R2.892 C#CCNC1CCCc2occc21 Amb27187170 [0,1,0,1,0,0|0,0,2]=4 2332 B14R2.892 C=CCNC1CCCc2occc21 Amb27602006 [0,1,0,1,0,0|0,0,2]=4 2333 B14R2.892 CCCCC1CNCc2ccsc21 Amb25683932 [0,1,0,1,0,0|2,0,0]=4 2334 B14R2.892 CCCCC1CNCc2sccc21 Amb25320360 [0,1,0,1,0,0|0,1,0]=3 2335 B14R2.892 CCCCC1NCCc2ccoc21 Amb32647806 [0,1,0,1,0,0|2,0,0]=4 2336 B14R2.892 CCCCC1NCCc2ccsc21 Amb32646944 [0,1,0,1,0,0|2,0,0]=4 2337 B14R2.892 CCCCC1NCCc2occc21 Amb32647472 [0,1,0,1,0,0|0,0,0]=2 2338 B14R2.892 CCCCC1NCCc2sccc21 Amb17236301 [0,1,0,1,0,0|0,1,0]=3 2339 B14R2.892 CCCCC1NCCn2cccc21 Amb27165155 [0,1,0,1,0,0|2,0,0]=4 2340 B14R2.892 CCCCN1CCCn2nccc21 Amb27652404 [0,1,0,1,0,0|2,0,0]=4 2341 B14R2.892 CCCNC1CCCc2ncsc21 Amb18985614 [0,1,0,1,0,0|2,0,0]=4 2342 B14R2.892 CCCNC1CCCc2occc21 Amb6737522 [0,1,0,1,0,0|0,0,0]=2 2343 B14R2.892 CCNCC1CCCc2sccc21 Amb27258658 [0,1,0,1,0,0|0,1,0]=3 2344 B14R2.892 CCNCC1OCCc2sccc21 Amb25075138 [0,1,0,1,0,0|1,1,0]=4 2345 B14R2.892 CCONC1CCCc2sccc21 Amb27591397 [0,1,0,1,0,0|1,1,0]=4 2346 B14R2.892 CSCCC1NCCc2occc21 Amb32647503 [0,1,0,1,0,0|1,0,0]=3 2347 B14R2.892 CSCCC1NCCc2sccc21 Amb27204659 [0,1,0,1,0,0|1,1,0]=4 2348 B14R2.892 FCCNC1CCCc2sccc21 Amb27172509 [0,1,0,1,0,0|1,1,0]=4 2349 B14R2.892 NCCNC1CCCc2occc21 Amb27832868 [0,1,0,1,0,0|1,0,0]=3 2350 B14R2.892 OCCNC1CCCc2sccc21 Amb18998678 [0,1,0,1,0,0|1,1,0]=4 2351 B14R2.2840 c1cc(CC2CCCCCN2)sn1 Amb35733225 [0,1,0,1,0,0|1,1,0]=4 2352 B14R2.2840 c1cc(CC2CCCCNC2)co1 Amb27404780 [0,1,0,1,0,0|2,0,0]=4 2353 B14R2.2840 c1cc(CC2CCCCNC2)sn1 Amb35643806 [0,1,0,1,0,0|1,1,0]=4 2354 B14R2.2840 c1cc(CC2CCCNCC2)co1 Amb28411357 [0,1,0,1,0,0|2,0,0]=4 2355 B14R2.2840 c1cc(CN2CCCCCC2)co1 Amb27652827 [0,1,0,1,0,0|2,0,0]=4 2356 B14R2.2840 c1cc(CN2CCCCCC2)cs1 Amb8510289 [0,1,0,1,0,0|2,0,0]=4 2357 B14R2.2840 c1cc(CN2CCCCCC2)no1 Amb27586138 [0,1,0,1,0,0|2,0,0]=4 2358 B14R2.2840 c1cc(CN2CCCCCC2)sn1 Amb35733218 [0,1,0,1,0,0|1,1,0]=4 2359 B14R2.2840 c1ccn(CC2CCCSCC2)c1 Amb35627019 [0,1,0,1,0,0|2,0,0]=4 2360 B14R2.2840 c1cnn(CC2CCCCCC2)c1 Amb28194436 [0,1,0,1,0,0|2,0,0]=4 2361 B14R2.2840 c1cnn(CC2CCCCNC2)c1 Amb35611305 [0,1,0,1,0,0|2,0,0]=4 2362 B14R2.2840 c1coc(CN2CCCNCC2)c1 Amb9210907 [0,1,0,1,0,0|1,0,0]=3 2363 B14R2.2840 c1coc(SC2CCCNCC2)n1 Amb27951847 [0,1,0,1,0,0|2,0,0]=4 2364 B14R2.2840 c1csc(CC2CCCCCN2)c1 Amb19374423 [0,1,0,1,0,0|0,1,0]=3 2365 B14R2.2840 c1csc(CC2CCCCCN2)c1 Amb4135048 [0,1,0,1,0,0|0,1,0]=3 2366 B14R2.2840 c1csc(CC2CCCNCC2)c1 Amb28136220 [0,1,0,1,0,0|0,1,0]=3 2367 B14R2.2840 c1csc(CN2CCCCCC2)c1 Amb8509645 [0,1,0,1,0,0|0,1,0]=3 2368 B14R2.2840 c1csc(CN2CCCNCC2)c1 Amb13949029 [0,1,0,1,0,0|1,1,0]=4 2369 B14R2.2840 c1csc(CN2CCCNCC2)c1 Amb6254464 [0,1,0,1,0,0|1,1,0]=4 2370 B14R2.2840 c1csc(CN2CCCOCC2)c1 Amb28436037 [0,1,0,1,0,0|1,1,0]=4 2371 B14R2.2840 c1csc(CN2CCCSCC2)c1 Amb25833173 [0,1,0,1,0,0|1,1,0]=4 2372 B14R2.2840 c1csc(SC2CCCNCC2)c1 Amb27223794 [0,1,0,1,0,0|1,1,0]=4 2373 B14R2.2840 c1nc(CN2CCCCCC2)cs1 Amb27415424 [0,1,0,1,0,0|2,0,0]=4 2374 B14R2.2840 c1ncc(CC2CCCCCC2)o1 Amb35652434 [0,1,0,1,0,0|1,0,0]=3 2375 B14R2.2840 c1ncc(CN2CCCCCC2)s1 Amb27407417 [0,1,0,1,0,0|1,1,0]=4 2376 B14R2.3017 c1cc(NCCCCC2CC2)cs1 Amb32675855 [0,1,0,1,0,0|2,0,0]=4 2377 B14R2.3106 CCCC1NCCCc2sccc21 Amb26969993 [0,1,0,1,0,0|0,1,0]=3 2378 B14R2.3106 CCCN1CCCCc2sccc21 Amb27651263 [0,1,0,1,0,0|0,1,0]=3 2379 B14R2.3106 FCCN1CCCCc2sccc21 Amb27946689 [0,1,0,1,0,0|1,1,0]=4 2380 B14R2.3106 ICCN1CCCCc2sccc21 Amb28125512 [0,1,0,1,0,0|1,1,0]=4 2381 B14R2.3106 OCCC1CCCCc2cccn21 Amb27646381 [0,1,0,1,0,0|1,0,0]=3 2382 B14R2.124 CN1CC(CN)C(c2ccco2)C1 Amb23535603 [0,1,0,1,0,0|2,0,0]=4 2383 B14R2.306 CC1CCC(=O)CC1c2ccco2 Amb32865267 [0,1,0,1,0,0|0,0,1]=3 2384 B14R2.306 CC1CCC(=O)CC1c2cccs2 Amb32865295 [0,1,0,1,0,0|0,1,1]=4 2385 B14R2.306 CC1CCC(Br)CC1c2ccco2 Amb32866042 [0,1,0,1,0,0|0,0,0]=2 2386 B14R2.306 CC1CCC(Br)CC1c2ccns2 Amb32866068 [0,1,0,1,0,0|1,1,0]=4 2387 B14R2.306 CC1CCC(Br)CC1c2ccoc2 Amb32864572 [0,1,0,1,0,0|2,0,0]=4 2388 B14R2.306 CC1CCC(Br)CC1c2ccsn2 Amb32866009 [0,1,0,1,0,0|2,0,0]=4 2389 B14R2.306 CC1CCC(Br)CC1c2cncs2 Amb32866076 [0,1,0,1,0,0|1,1,0]=4 2390 B14R2.306 CC1CCC(Br)CC1c2cscn2 Amb32866061 [0,1,0,1,0,0|2,0,0]=4 2391 B14R2.306 CC1CCC(Br)CC1c2nccs2 Amb32866093 [0,1,0,1,0,0|1,1,0]=4 2392 B14R2.306 CC1CCC(Cl)CC1c2ccco2 Amb32865819 [0,1,0,1,0,0|0,0,0]=2 2393 B14R2.306 CC1CCC(Cl)CC1c2ccns2 Amb32865844 [0,1,0,1,0,0|1,1,0]=4 2394 B14R2.306 CC1CCC(Cl)CC1c2ccoc2 Amb32865817 [0,1,0,1,0,0|2,0,0]=4 2395 B14R2.306 CC1CCC(Cl)CC1c2ccsn2 Amb32865784 [0,1,0,1,0,0|2,0,0]=4 2396 B14R2.306 CC1CCC(Cl)CC1c2cncs2 Amb32865852 [0,1,0,1,0,0|1,1,0]=4 2397 B14R2.306 CC1CCC(Cl)CC1c2cscn2 Amb32865841 [0,1,0,1,0,0|2,0,0]=4 2398 B14R2.306 CC1CCC(Cl)CC1c2nccs2 Amb32865872 [0,1,0,1,0,0|1,1,0]=4 2399 B14R2.306 CC1CCC(N)C(c2ccco2)C1 Amb27609133 [0,1,0,1,0,0|1,0,0]=3 2400 B14R2.306 CC1CCC(N)C(c2cccs2)C1 Amb27609212 [0,1,0,1,0,0|1,1,0]=4 2401 B14R2.306 CC1CCC(N)CC1c2ccco2 Amb32866267 [0,1,0,1,0,0|0,0,0]=2 2402 B14R2.306 CC1CCC(N)CC1c2cccs2 Amb32866277 [0,1,0,1,0,0|0,1,0]=3 2403 B14R2.306 CC1CCC(N)CC1c2ccns2 Amb32866328 [0,1,0,1,0,0|1,1,0]=4 2404 B14R2.306 CC1CCC(N)CC1c2ccoc2 Amb32866261 [0,1,0,1,0,0|2,0,0]=4 2405 B14R2.306 CC1CCC(N)CC1c2ccsc2 Amb32866284 [0,1,0,1,0,0|2,0,0]=4 2406 B14R2.306 CC1CCC(N)CC1c2ccsn2 Amb32866295 [0,1,0,1,0,0|2,0,0]=4 2407 B14R2.306 CC1CCC(N)CC1c2cncs2 Amb32866339 [0,1,0,1,0,0|1,1,0]=4 2408 B14R2.306 CC1CCC(N)CC1c2cscn2 Amb32866313 [0,1,0,1,0,0|2,0,0]=4 2409 B14R2.306 CC1CCC(N)CC1c2nccs2 Amb32866373 [0,1,0,1,0,0|1,1,0]=4 2410 B14R2.306 CC1CCC(O)CC1n2cccn2 Amb32867221 [0,1,0,1,0,0|2,0,0]=4 2411 B14R2.306 CC1NCC(N)CC1c2cccs2 Amb33299195 [0,1,0,1,0,0|1,1,0]=4 2412 B14R2.306 CN1CCC(=O)CC1c2ccco2 Amb25157270 [0,1,0,1,0,0|1,0,1]=4 2413 B14R2.674 CC1CC1C(=O)NCc2ccco2 Amb8335698 [0,1,0,1,0,0|1,0,1]=4 2414 B14R2.674 C[C@@H]1C[C@H]1C(=O)NCc2ccco2 Amb27779725 [0,1,0,1,0,0|1,0,1]=4 2415 B14R2.735 CC1CCC1(O)CCc2ccsc2 Amb27451709 [0,1,0,1,0,0|2,0,0]=4 2416 B14R2.991 CCCCN1CCc2sccc2C1 Amb27456215 [0,1,0,1,0,0|1,1,0]=4 2417 B14R2.4572 CC1OCC(=O)C1Cc2ccco2 Amb35682824 [0,1,0,1,0,0|1,0,1]=4 2418 B14R2.4572 CC1OCC(Br)C1Cc2cccs2 Amb35697934 [0,1,0,1,0,0|1,1,0]=4 2419 B14R2.4572 CC1OCC(Cl)C1Cc2cccs2 Amb35689735 [0,1,0,1,0,0|1,1,0]=4 2420 B14R2.4572 CC1OCC(N)C1Cc2ccco2 Amb29864172 [0,1,0,1,0,0|1,0,0]=3 2421 B14R2.4572 CC1OCC(N)C1Cc2cccs2 Amb29864176 [0,1,0,1,0,0|1,1,0]=4 2422 B14R2.4572 CC1OCC(O)C1Cc2ccco2 Amb29863962 [0,1,0,1,0,0|1,0,0]=3 2423 B14R2.4572 CC1OCC(O)C1Cc2cccs2 Amb29864025 [0,1,0,1,0,0|1,1,0]=4 2424 B14R2.5478 CC1(NCc2ccco2)CCCC1 Amb18291922 [0,1,0,1,0,0|1,0,0]=3 2425 B14R2.5478 CC1(NCc2cnco2)CCCC1 Amb27585521 [0,1,0,1,0,0|2,0,0]=4 2426 B14R2.5478 NC1(CCc2cccs2)CCCC1 Amb27234452 [0,1,0,1,0,0|0,1,0]=3 2427 B14R2.5478 NC1(CCc2ccsc2)CCCC1 Amb26474454 [0,1,0,1,0,0|2,0,0]=4 2428 B14R2.5478 NC1(CCn2cccn2)CCCC1 Amb32727039 [0,1,0,1,0,0|2,0,0]=4 2429 B14R2.5478 OC1(CCc2cccs2)CCSC1 Amb27878095 [0,1,0,1,0,0|1,1,0]=4 2430 B14R2.5478 OC1(CCn2cccc2)CCCC1 Amb35704720 [0,1,0,1,0,0|2,0,0]=4 2431 B14R2.5478 OC1(CSc2ncco2)CCCC1 Amb28397594 [0,1,0,1,0,0|2,0,0]=4 2432 B14R2.6188 CN1CCc2occc2C1CCN Amb18193706 [0,1,0,1,0,0|2,0,0]=4 2433 B14R2.40225 O=C(NCc1ccco1)C2CCC2 Amb6536036 [0,1,0,1,0,0|1,0,1]=4 2434 B14R2.119 CCC1CCN(Cc2ccno2)C1 Amb28138190 [0,1,0,1,0,0|2,0,0]=4 2435 B14R2.119 CNC1CCC(Cc2cccs2)C1 Amb27587791 [0,1,0,1,0,0|1,1,0]=4 2436 B14R2.119 COC1CCN(Cc2ccco2)C1 Amb31199912 [0,1,0,1,0,0|2,0,0]=4 2437 B14R2.119 CO[C@@H]1CCN(Cc2ccco2)C1 Amb28078837 [0,1,0,1,0,0|2,0,0]=4 2438 B14R2.119 NCC1CCN(Cc2ccco2)C1 Amb9724416 [0,1,0,1,0,0|2,0,0]=4 2439 B14R2.119 OCC1CCN(Cc2ccco2)C1 Amb5755216 [0,1,0,1,0,0|2,0,0]=4 2440 B14R2.119 OC[C@@H]1CCN(Cc2ccco2)C1 Amb27748868 [0,1,0,1,0,0|2,0,0]=4 2441 B14R2.310 CC1CCCC1(N)Cc2ccns2 Amb35643603 [0,1,0,1,0,0|1,1,0]=4 2442 B14R2.310 CC1CCCC1(N)Cc2nccs2 Amb27432986 [0,1,0,1,0,0|1,1,0]=4 2443 B14R2.310 CC1CCCC1(O)Cc2ccco2 Amb28387689 [0,1,0,1,0,0|0,0,0]=2 2444 B14R2.310 CC1CCCC1(O)Cc2cccs2 Amb27826695 [0,1,0,1,0,0|0,1,0]=3 2445 B14R2.310 CC1CCCC1(O)Cc2ccns2 Amb29887093 [0,1,0,1,0,0|1,1,0]=4 2446 B14R2.310 CC1CCCC1(O)Cc2ccoc2 Amb27817052 [0,1,0,1,0,0|2,0,0]=4 2447 B14R2.310 CC1CNCC1(C)Cc2cccs2 Amb29859788 [0,1,0,1,0,0|1,1,0]=4 2448 B14R2.310 CC1COCC1(O)Cc2ccco2 Amb29877611 [0,1,0,1,0,0|1,0,0]=3 2449 B14R2.310 CC1COCC1(O)Cc2cccs2 Amb29877631 [0,1,0,1,0,0|1,1,0]=4 2450 B14R2.310 CC1OCCC1(O)Cc2cccs2 Amb27772477 [0,1,0,1,0,0|1,1,0]=4 2451 B14R2.523 CCCC1CC(Cn2cccn2)C1 Amb32419803 [0,1,0,1,0,0|2,0,0]=4 2452 B14R2.716 BrC1CCCC(Cc2cccs2)C1 Amb28194345 [0,1,0,1,0,0|0,1,0]=3 2453 B14R2.716 BrC1CCCC(Cc2ccns2)C1 Amb29887286 [0,1,0,1,0,0|1,1,0]=4 2454 B14R2.716 BrC1CCCC(Cc2ccsc2)C1 Amb28320074 [0,1,0,1,0,0|2,0,0]=4 2455 B14R2.716 BrC1CCCC(Cc2nccs2)C1 Amb27837018 [0,1,0,1,0,0|1,1,0]=4 2456 B14R2.716 BrC1CCCN(Cc2cccs2)C1 Amb27609319 [0,1,0,1,0,0|1,1,0]=4 2457 B14R2.716 C=C1CCCN(Cc2ccco2)C1 Amb24720279 [0,1,0,1,0,0|1,0,1]=4 2458 B14R2.716 CC1CCCC(Cn2cccc2)O1 Amb35648519 [0,1,0,1,0,0|2,0,0]=4 2459 B14R2.716 CC1CCCN(Cc2ccno2)C1 Amb28190524 [0,1,0,1,0,0|2,0,0]=4 2460 B14R2.716 CC1CN(Cc2ccco2)CCN1 Amb18564138 [0,1,0,1,0,0|2,0,0]=4 2461 B14R2.716 CC1CN(Cc2ccco2)CCO1 Amb28185707 [0,1,0,1,0,0|2,0,0]=4 2462 B14R2.716 CC1CN(Cc2ccco2)CCS1 Amb27594421 [0,1,0,1,0,0|2,0,0]=4 2463 B14R2.716 CN1CCNC(Cc2ccco2)C1 Amb18065933 [0,1,0,1,0,0|2,0,0]=4 2464 B14R2.716 C[C@H]1CN(Cc2ccco2)CCN1 Amb27835725 [0,1,0,1,0,0|2,0,0]=4 2465 B14R2.716 ClC1CCCC(Cc2cccs2)C1 Amb28206621 [0,1,0,1,0,0|0,1,0]=3 2466 B14R2.716 ClC1CCCC(Cc2ccns2)C1 Amb29887281 [0,1,0,1,0,0|1,1,0]=4 2467 B14R2.716 NC1CCCC(Cc2ccns2)C1 Amb29871005 [0,1,0,1,0,0|1,1,0]=4 2468 B14R2.716 NC1CCCC(Cn2cccn2)C1 Amb35695908 [0,1,0,1,0,0|2,0,0]=4 2469 B14R2.716 NC1CCCC(Sc2cccs2)C1 Amb27433503 [0,1,0,1,0,0|1,1,0]=4 2470 B14R2.716 NC1CCCN(Cc2ccco2)C1 Amb17470639 [0,1,0,1,0,0|1,0,0]=3 2471 B14R2.716 NC1CCCN(Cc2cccs2)C1 Amb6760477 [0,1,0,1,0,0|1,1,0]=4 2472 B14R2.716 NC1CCCN(Cc2cccs2)C1 Amb9901802 [0,1,0,1,0,0|1,1,0]=4 2473 B14R2.716 O=C1CCCC(Cc2cccs2)C1 Amb28246708 [0,1,0,1,0,0|0,1,1]=4 2474 B14R2.716 OC1CCCC(Cc2cccs2)C1 Amb28143985 [0,1,0,1,0,0|0,1,0]=3 2475 B14R2.716 OC1CCCC(Cc2ccns2)C1 Amb35733468 [0,1,0,1,0,0|1,1,0]=4 2476 B14R2.716 OC1CCCN(Cc2ccco2)C1 Amb18186818 [0,1,0,1,0,0|1,0,0]=3 2477 B14R2.716 OC1CCCN(Cc2cccs2)C1 Amb18330888 [0,1,0,1,0,0|1,1,0]=4 2478 B14R2.3104 CCCC1CC(=O)Cc2cccn21 Amb27828971 [0,1,0,1,0,0|1,0,1]=4 2479 B14R2.3104 CCC[C@@H]1CC(=O)Cc2cccn21 Amb27828889 [0,1,0,1,0,0|1,0,1]=4 2480 B14R2.3292 CCC1NCC(C)C1c2ccco2 Amb28056314 [0,1,0,1,0,0|1,0,0]=3 2481 B14R2.3292 CCN1CCC(N)C1c2ccco2 Amb26519846 [0,1,0,1,0,0|1,0,0]=3 2482 B14R2.3292 CCN1CCC(N)C1c2cccs2 Amb26325741 [0,1,0,1,0,0|1,1,0]=4 2483 B14R2.5543 CC1(Cc2ccco2)CCCNC1 Amb28383288 [0,1,0,1,0,0|1,0,0]=3 2484 B14R2.5543 CC1(Cc2cccs2)CCCNC1 Amb35690738 [0,1,0,1,0,0|1,1,0]=4 2485 B14R2.5543 CC1(Cc2cccs2)CCNCC1 Amb35690730 [0,1,0,1,0,0|1,1,0]=4 2486 B14R2.5543 CC1(Oc2ccco2)CCNCC1 Amb33360914 [0,1,0,1,0,0|2,0,0]=4 2487 B14R2.5543 FC1(Cc2cnco2)CCCNC1 Amb28254716 [0,1,0,1,0,0|2,0,0]=4 2488 B14R2.5543 FC1(Cc2cnco2)CCNCC1 Amb27481193 [0,1,0,1,0,0|2,0,0]=4 2489 B14R2.5543 NC1(Cc2ccco2)CC=CCC1 Amb27655822 [0,1,0,1,0,0|0,0,2]=4 2490 B14R2.5543 NC1(Cc2ccco2)CCCCC1 Amb5737648 [0,1,0,1,0,0|0,0,0]=2 2491 B14R2.5543 NC1(Cc2ccco2)CCOCC1 Amb5737676 [0,1,0,1,0,0|1,0,0]=3 2492 B14R2.5543 NC1(Cc2cccs2)CCCCC1 Amb5737649 [0,1,0,1,0,0|0,1,0]=3 2493 B14R2.5543 NC1(Cc2cccs2)CCOCC1 Amb5737677 [0,1,0,1,0,0|1,1,0]=4 2494 B14R2.5543 NC1(Cc2ccns2)CCCCC1 Amb35658472 [0,1,0,1,0,0|1,1,0]=4 2495 B14R2.5543 NC1(Cc2ccsc2)CCCCC1 Amb18286583 [0,1,0,1,0,0|2,0,0]=4 2496 B14R2.5543 NC1(Cc2cncs2)CCCCC1 Amb18188712 [0,1,0,1,0,0|1,1,0]=4 2497 B14R2.5543 NC1(Cn2cccc2)CCCCC1 Amb27948801 [0,1,0,1,0,0|2,0,0]=4 2498 B14R2.5543 OC1(Cc2ccco2)CCCCC1 Amb28124355 [0,1,0,1,0,0|0,0,0]=2 2499 B14R2.5543 OC1(Cc2ccco2)CCCNC1 Amb26968396 [0,1,0,1,0,0|1,0,0]=3 2500 B14R2.5543 OC1(Cc2ccco2)CCCSC1 Amb35720783 [0,1,0,1,0,0|1,0,0]=3 2501 B14R2.5543 OC1(Cc2ccco2)CCNCC1 Amb26520222 [0,1,0,1,0,0|1,0,0]=3 2502 B14R2.5543 OC1(Cc2ccco2)CCSCC1 Amb35714836 [0,1,0,1,0,0|1,0,0]=3 2503 B14R2.5543 OC1(Cc2cccs2)CCCCC1 Amb27179930 [0,1,0,1,0,0|0,1,0]=3 2504 B14R2.5543 OC1(Cc2cccs2)CCCNC1 Amb25695843 [0,1,0,1,0,0|1,1,0]=4 2505 B14R2.5543 OC1(Cc2cccs2)CCCSC1 Amb35720807 [0,1,0,1,0,0|1,1,0]=4 2506 B14R2.5543 OC1(Cc2cccs2)CCNCC1 Amb28071955 [0,1,0,1,0,0|1,1,0]=4 2507 B14R2.5543 OC1(Cc2cccs2)CCSCC1 Amb35714855 [0,1,0,1,0,0|1,1,0]=4 2508 B14R2.5543 OC1(Cc2ccns2)CCCCC1 Amb35733370 [0,1,0,1,0,0|1,1,0]=4 2509 B14R2.5543 OC1(Cc2ccsc2)CCCCC1 Amb27226322 [0,1,0,1,0,0|2,0,0]=4 2510 B14R2.5543 OC1(Cc2cnco2)CCCNC1 Amb27495607 [0,1,0,1,0,0|2,0,0]=4 2511 B14R2.5543 OC1(Cc2cnco2)CCNCC1 Amb25157100 [0,1,0,1,0,0|2,0,0]=4 2512 B14R2.5543 OC1(Cc2nccs2)CCCCC1 Amb27456818 [0,1,0,1,0,0|1,1,0]=4 2513 B14R2.5543 OC1(Cn2cccn2)CCCCC1 Amb25864164 [0,1,0,1,0,0|2,0,0]=4 2514 B14R2.31918 O=C(Cc1ccco1)NC2CCC2 Amb27399444 [0,1,0,1,0,0|1,0,1]=4 2515 B14R2.763 CC(=O)N1CCCC1c2ccco2 Amb23578267 [0,1,0,1,0,0|1,0,1]=4 2516 B14R2.763 O=C(O)C1CCCC1c2ccco2 Amb27608738 [0,1,0,1,0,0|1,0,1]=4 2517 B14R2.765 CC(C)C1CCN1Cc2ccco2 Amb27443479 [0,1,0,1,0,0|1,0,0]=3 2518 B14R2.4671 CC1(C)CCCC1Sc2ncco2 Amb27457231 [0,1,0,1,0,0|2,0,0]=4 2519 B14R2.4671 CC1(O)CCCC1Sc2cccs2 Amb27817566 [0,1,0,1,0,0|1,1,0]=4 2520 B14R2.4671 CC1(O)CCCC1Sc2ncco2 Amb28245678 [0,1,0,1,0,0|2,0,0]=4 2521 B14R2.4885 CC1(C)CCCCC1c2cnco2 Amb35655889 [0,1,0,1,0,0|1,0,0]=3 2522 B14R2.4885 CC1(C)CCCCC1n2cccc2 Amb27401552 [0,1,0,1,0,0|2,0,0]=4 2523 B14R2.4885 CC1(C)NCCOC1c2ccco2 Amb18066024 [0,1,0,1,0,0|2,0,0]=4 2524 B14R2.4885 CC1(O)CCCCC1c2ccco2 Amb32946000 [0,1,0,1,0,0|0,0,0]=2 2525 B14R2.4885 CC1(O)CCCCC1c2cccs2 Amb32944635 [0,1,0,1,0,0|0,1,0]=3 2526 B14R2.4885 CC1(O)CCCCC1c2ccns2 Amb33213235 [0,1,0,1,0,0|1,1,0]=4 2527 B14R2.4885 CC1(O)CCCCC1c2ccoc2 Amb33213302 [0,1,0,1,0,0|2,0,0]=4 2528 B14R2.4885 CC1(O)CCCCC1c2ccsc2 Amb32950606 [0,1,0,1,0,0|2,0,0]=4 2529 B14R2.4885 CC1(O)CCCCC1c2ccsn2 Amb32950581 [0,1,0,1,0,0|2,0,0]=4 2530 B14R2.4885 CC1(O)CCCCC1c2cncs2 Amb33213334 [0,1,0,1,0,0|1,1,0]=4 2531 B14R2.4885 CC1(O)CCCCC1c2cscn2 Amb32950733 [0,1,0,1,0,0|2,0,0]=4 2532 B14R2.4885 CC1(O)CCCCC1c2nccs2 Amb33213165 [0,1,0,1,0,0|1,1,0]=4 2533 B14R2.4885 CC1(O)CCCCC1n2cccn2 Amb35669171 [0,1,0,1,0,0|2,0,0]=4 2534 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2ccco2 Amb32944984 [0,1,0,1,0,0|0,0,0]=2 2535 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2cccs2 Amb33213161 [0,1,0,1,0,0|0,1,0]=3 2536 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2ccns2 Amb33212858 [0,1,0,1,0,0|1,1,0]=4 2537 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2ccoc2 Amb32950411 [0,1,0,1,0,0|2,0,0]=4 2538 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2ccsc2 Amb32945285 [0,1,0,1,0,0|2,0,0]=4 2539 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2ccsn2 Amb32944681 [0,1,0,1,0,0|2,0,0]=4 2540 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2cncs2 Amb33213185 [0,1,0,1,0,0|1,1,0]=4 2541 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2cscn2 Amb32950702 [0,1,0,1,0,0|2,0,0]=4 2542 B14R2.4885 C[C@@]1(O)CCCC[C@H]1c2nccs2 Amb32944443 [0,1,0,1,0,0|1,1,0]=4 2543 B14R2.4885 C[C@@]1(O)CCCC[C@H]1n2cccn2 Amb35669098 [0,1,0,1,0,0|2,0,0]=4 2544 B14R2.4885 FC1(F)CCCCC1c2cnco2 Amb35655919 [0,1,0,1,0,0|2,0,0]=4 2545 B14R2.5549 CC1(C)CCC1NCc2cnco2 Amb28396990 [0,1,0,1,0,0|2,0,0]=4 2546 B14R2.9440 CC(C)CC1CNCc2sccc21 Amb27495668 [0,1,0,1,0,0|1,1,0]=4 2547 B14R2.9440 CC(C)CC1NCCc2occc21 Amb32647476 [0,1,0,1,0,0|1,0,0]=3 2548 B14R2.9440 CC(C)CC1NCCc2sccc21 Amb17236302 [0,1,0,1,0,0|1,1,0]=4 2549 B14R2.9440 CC(C)NC1CCCc2occc21 Amb6737490 [0,1,0,1,0,0|1,0,0]=3 2550 B14R2.9440 CN(C)CC1NCCc2occc21 Amb27409136 [0,1,0,1,0,0|2,0,0]=4 2551 B14R2.9440 CN(C)NC1CCCc2occc21 Amb27761834 [0,1,0,1,0,0|2,0,0]=4 2552 B14R2.9516 CC(C)N1CCCCc2sccc21 Amb28454652 [0,1,0,1,0,0|1,1,0]=4 2553 B14R2.393 CC1CNC(c2ccco2)CSC1 Amb27761411 [0,1,0,1,0,0|2,0,0]=4 2554 B14R2.393 CN1CCNC(c2ccco2)CC1 Amb18065935 [0,1,0,1,0,0|2,0,0]=4 2555 B14R2.458 CCCN1CCCc2occc2C1 Amb28070328 [0,1,0,1,0,0|1,0,0]=3 2556 B14R2.458 ICCN1CCCc2occc2C1 Amb28045502 [0,1,0,1,0,0|2,0,0]=4 2557 B14R2.739 CC1CC(N)CNC1c2cccs2 Amb33500900 [0,1,0,1,0,0|1,1,0]=4 2558 B14R2.739 CC1CNC(c2cccs2)C(C)C1 Amb33500903 [0,1,0,1,0,0|1,1,0]=4 2559 B14R2.739 CC1COC(c2ccco2)C(C)N1 Amb18185060 [0,1,0,1,0,0|2,0,0]=4 2560 B14R2.4458 CC1CC(C)N(Cc2cccs2)C1 Amb28349604 [0,1,0,1,0,0|1,1,0]=4 2561 B14R2.4458 CC1CC(Cl)CN1Cc2cccs2 Amb28192011 [0,1,0,1,0,0|1,1,0]=4 2562 B14R2.9756 C#CCC1(O)CCCc2occc21 Amb27427030 [0,1,0,1,0,0|0,0,2]=4 2563 B14R2.9756 CCCC1(C)CNCc2sccc21 Amb25953608 [0,1,0,1,0,0|1,1,0]=4 2564 B14R2.9756 CCCC1(C)NCCc2occc21 Amb32647521 [0,1,0,1,0,0|1,0,0]=3 2565 B14R2.9756 CCCC1(C)NCCc2sccc21 Amb28457287 [0,1,0,1,0,0|1,1,0]=4 2566 B14R2.9756 COCC1(C)NCCc2occc21 Amb32647566 [0,1,0,1,0,0|2,0,0]=4 2567 B14R2.9756 NCCC1(O)CCCc2sccc21 Amb18188327 [0,1,0,1,0,0|1,1,0]=4 2568 B14R2.31850 CC(NCCc1cccs1)C2CC2 Amb6697795 [0,1,0,1,0,0|1,1,0]=4 2569 B14R2.23 C[C@@H]1CNCC(c2ccco2)N1C Amb18193620 [0,1,0,1,0,0|2,0,0]=4 2570 B14R2.23 C[C@H]1CNCC(c2ccco2)N1C Amb27618293 [0,1,0,1,0,0|2,0,0]=4 2571 B14R2.72 CC1CCN(Cc2ccco2)CC1 Amb27207594 [0,1,0,1,0,0|1,0,0]=3 2572 B14R2.72 CC1CCN(Cc2cccs2)CC1 Amb25039502 [0,1,0,1,0,0|1,1,0]=4 2573 B14R2.72 NC1CCC(Cc2cccs2)CC1 Amb27833811 [0,1,0,1,0,0|0,1,0]=3 2574 B14R2.72 NC1CCC(Cc2cncs2)CC1 Amb27813070 [0,1,0,1,0,0|1,1,0]=4 2575 B14R2.72 NC1CCN(Cc2ccco2)CC1 Amb17622096 [0,1,0,1,0,0|1,0,0]=3 2576 B14R2.72 NC1CCN(Cc2ccco2)CC1 Amb2183327 [0,1,0,1,0,0|1,0,0]=3 2577 B14R2.72 NC1CCN(Cc2ccco2)CC1 Amb844527 [0,1,0,1,0,0|1,0,0]=3 2578 B14R2.72 NC1CCN(Cc2cccs2)CC1 Amb13949156 [0,1,0,1,0,0|1,1,0]=4 2579 B14R2.72 NC1CCN(Cc2cccs2)CC1 Amb2183326 [0,1,0,1,0,0|1,1,0]=4 2580 B14R2.72 NC1CCN(Cc2cccs2)CC1 Amb844526 [0,1,0,1,0,0|1,1,0]=4 2581 B14R2.72 O=C1CCN(Cc2ccco2)CC1 Amb6277721 [0,1,0,1,0,0|1,0,1]=4 2582 B14R2.72 O=S1CCN(Cc2ccco2)CC1 Amb28256442 [0,1,0,1,0,0|2,0,0]=4 2583 B14R2.72 OC1CCC(Cn2cccc2)CC1 Amb28342903 [0,1,0,1,0,0|2,0,0]=4 2584 B14R2.72 OC1CCN(Cc2ccco2)CC1 Amb17233813 [0,1,0,1,0,0|1,0,0]=3 2585 B14R2.72 OC1CCN(Cc2cccs2)CC1 Amb10813098 [0,1,0,1,0,0|1,1,0]=4 2586 B14R2.72 OC1CCN(Cc2ccno2)CC1 Amb18187089 [0,1,0,1,0,0|2,0,0]=4 2587 B14R2.659 CC1CC(NCc2ccco2)C1C Amb27833391 [0,1,0,1,0,0|1,0,0]=3 2588 B14R2.2946 CC1C(Br)CCC1Cc2ccns2 Amb29887285 [0,1,0,1,0,0|1,1,0]=4 2589 B14R2.2946 CC1C(Cl)CCC1Cc2ccns2 Amb29887283 [0,1,0,1,0,0|1,1,0]=4 2590 B14R2.2946 CC1C(N)CCC1Cc2cccs2 Amb27180410 [0,1,0,1,0,0|0,1,0]=3 2591 B14R2.2946 CC1C(N)CCC1Cc2ccns2 Amb29871004 [0,1,0,1,0,0|1,1,0]=4 2592 B14R2.2946 CC1C(N)CCC1Sc2ncco2 Amb28320667 [0,1,0,1,0,0|2,0,0]=4 2593 B14R2.2946 CC1C(O)CCC1Cc2ccns2 Amb35733469 [0,1,0,1,0,0|1,1,0]=4 2594 B14R2.2946 CC1C(O)CCC1Cc2ccsc2 Amb28243734 [0,1,0,1,0,0|2,0,0]=4 2595 B14R2.2946 CC1CCN(Cc2ccco2)C1C Amb28185771 [0,1,0,1,0,0|1,0,0]=3 2596 B14R2.2946 CC1CCN(Cc2ccno2)C1C Amb28349645 [0,1,0,1,0,0|2,0,0]=4 2597 B14R2.4665 NC1(CCCCc2ccsc2)CC1 Amb33321635 [0,1,0,1,0,0|2,0,0]=4 2598 B14R2.4665 NC1(CCCCn2cccn2)CC1 Amb32726928 [0,1,0,1,0,0|2,0,0]=4 2599 B14R2.4665 OC1(CCCCc2ccsc2)CC1 Amb33320885 [0,1,0,1,0,0|2,0,0]=4 2600 B14R2.4665 OC1(CCCCn2cccn2)CC1 Amb32727329 [0,1,0,1,0,0|2,0,0]=4 2601 B14R2.10782 CCC(C)C1NCCc2occc21 Amb32647531 [0,1,0,1,0,0|1,0,0]=3 2602 B14R2.10782 CCC(C)C1NCCc2sccc21 Amb28134855 [0,1,0,1,0,0|1,1,0]=4 2603 B14R2.10782 COC(C)C1NCCc2occc21 Amb32647452 [0,1,0,1,0,0|2,0,0]=4 2604 B14R2.170 CCN1CCCC1c2cccn2C Amb28187902 [0,1,0,1,0,0|2,0,0]=4 2605 B14R2.170 CNC1CCCC1c2sccc2Br Amb27657012 [0,1,0,1,0,0|1,1,0]=4 2606 B14R2.170 CNC1CCCC1c2sccc2C Amb27431276 [0,1,0,1,0,0|1,1,0]=4 2607 B14R2.170 CNC1COCC1c2occc2Br Amb35608453 [0,1,0,1,0,0|2,0,0]=4 2608 B14R2.170 Cn1cccc1[C@@H]2CCC[C@H]2CO Amb27801519 [0,1,0,1,0,0|2,0,0]=4 2609 B14R2.296 Brc1ccsc1C2CCCCC2Br Amb27609458 [0,1,0,1,0,0|1,1,0]=4 2610 B14R2.296 CC1CCCCC1n2nccc2N Amb1142189 [0,1,0,1,0,0|2,0,0]=4 2611 B14R2.296 CN1CCCCC1c2oncc2N Amb33322042 [0,1,0,1,0,0|2,0,0]=4 2612 B14R2.296 Cc1ccoc1C2CNCCN2C Amb33343954 [0,1,0,1,0,0|2,0,0]=4 2613 B14R2.296 Cc1ccsc1C2CCCCC2O Amb26009177 [0,1,0,1,0,0|1,1,0]=4 2614 B14R2.296 Cc1ccsc1[C@@H]2CCCC[C@H]2O Amb32944422 [0,1,0,1,0,0|1,1,0]=4 2615 B14R2.296 ClC1CCCCC1c2occc2Br Amb28387796 [0,1,0,1,0,0|1,0,0]=3 2616 B14R2.296 Cn1cccc1C2CCCCC2N Amb27832567 [0,1,0,1,0,0|2,0,0]=4 2617 B14R2.296 NC1CCCCC1c2occc2Br Amb28186800 [0,1,0,1,0,0|1,0,0]=3 2618 B14R2.296 OC1CCCCC1c2occc2Br Amb27877795 [0,1,0,1,0,0|1,0,0]=3 2619 B14R2.296 OC1CCCCC1c2sccc2Br Amb25107226 [0,1,0,1,0,0|1,1,0]=4 2620 B14R2.296 OC1CCCCC1c2sccc2Cl Amb28316983 [0,1,0,1,0,0|1,1,0]=4 2621 B14R2.296 O[C@@H]1CCCC[C@H]1c2occc2Br Amb32950648 [0,1,0,1,0,0|1,0,0]=3 2622 B14R2.296 O[C@@H]1CCCC[C@H]1c2sccc2Br Amb32945176 [0,1,0,1,0,0|1,1,0]=4 2623 B14R2.296 O[C@@H]1CCCC[C@H]1c2sccc2Cl Amb32945184 [0,1,0,1,0,0|1,1,0]=4 2624 B14R2.309 CN1CCCC1Cc2oncc2N Amb33325930 [0,1,0,1,0,0|2,0,0]=4 2625 B14R2.309 Clc1ccsc1CC2CCCC2Br Amb27790589 [0,1,0,1,0,0|1,1,0]=4 2626 B14R2.309 Clc1ccsc1CC2CCCC2Cl Amb27235485 [0,1,0,1,0,0|1,1,0]=4 2627 B14R2.309 NC1CCCC1Cc2sccc2Br Amb28366101 [0,1,0,1,0,0|1,1,0]=4 2628 B14R2.309 OC1CCCC1Cc2sccc2Br Amb24724469 [0,1,0,1,0,0|1,1,0]=4 2629 B14R2.309 OC1CCCC1Cc2sccc2Cl Amb26862816 [0,1,0,1,0,0|1,1,0]=4 2630 B14R2.309 O[C@@H]1CCC[C@H]1Cc2sccc2Br Amb33213309 [0,1,0,1,0,0|1,1,0]=4 2631 B14R2.309 O[C@@H]1CCC[C@H]1Cc2sccc2Cl Amb32945702 [0,1,0,1,0,0|1,1,0]=4 2632 B14R2.319 CC1CCC1NCc2sccc2Br Amb27834044 [0,1,0,1,0,0|1,1,0]=4 2633 B14R2.319 Cc1ccoc1CSC2CCC2O Amb32987953 [0,1,0,1,0,0|2,0,0]=4 2634 B14R2.319 Cc1ccoc1CS[C@@H]2CC[C@H]2O Amb32987954 [0,1,0,1,0,0|2,0,0]=4 2635 B14R2.1206 CCC1CCN1Cc2cccn2C Amb28182941 [0,1,0,1,0,0|2,0,0]=4 2636 B14R2.1206 Cc1ccoc1CN2CCC2CN Amb35675647 [0,1,0,1,0,0|2,0,0]=4 2637 B14R2.1206 NCC1CCC1Cc2sccc2Cl Amb28388579 [0,1,0,1,0,0|1,1,0]=4 2638 B14R2.4734 Cc1ccoc1CSCCC2CO2 Amb32987650 [0,1,0,1,0,0|2,0,0]=4 2639 B14R2.5202 Brc1ccnn1C2CCCCCC2 Amb18155934 [0,1,0,1,0,0|2,0,0]=4 2640 B14R2.5202 Brc1ccsc1C2CCCCCN2 Amb3792508 [0,1,0,1,0,0|1,1,0]=4 2641 B14R2.5202 Cc1ccnn1C2CCCCCC2 Amb18180893 [0,1,0,1,0,0|2,0,0]=4 2642 B14R2.5202 Cc1ccsc1C2CCCCCN2 Amb3788581 [0,1,0,1,0,0|1,1,0]=4 2643 B14R2.5202 Cc1ccsc1C2CCCNCC2 Amb28120837 [0,1,0,1,0,0|1,1,0]=4 2644 B14R2.5202 Clc1ccnn1C2CCCCCC2 Amb27394371 [0,1,0,1,0,0|2,0,0]=4 2645 B14R2.5202 Cn1cccc1C2CCCCCN2 Amb444021 [0,1,0,1,0,0|2,0,0]=4 2646 B14R2.5202 Nc1cnoc1C2CCCCCC2 Amb32881847 [0,1,0,1,0,0|1,0,0]=3 2647 B14R2.5216 Cc1ccoc1CSCC2CCN2 Amb32987701 [0,1,0,1,0,0|2,0,0]=4 2648 B14R2.5216 Cc1ccoc1CSCC2CNC2 Amb32987703 [0,1,0,1,0,0|2,0,0]=4 2649 B14R3.49 c1cc2c(s1)C3CNCCC3C2 Amb27640638 [0,0,0,2,0,0|1,1,0]=4 2650 B14R3.49 c1cc2c(s1)CC3CNCCC23 Amb27637664 [0,0,0,2,0,0|1,1,0]=4 2651 B14R3.2912 c1ccn(C23CCCCC2C3)c1 Amb35724232 [0,0,0,2,0,0|2,0,0]=4 2652 B14R3.2912 c1ncc(C23CCCCC2C3)o1 Amb35655866 [0,0,0,2,0,0|1,0,0]=3 2653 B14R3.2916 c1ccn(C2CCCC3CC32)c1 Amb30008922 [0,0,0,2,0,0|2,0,0]=4 2654 B14R3.2916 c1csc(C2CCCC3CC32)n1 Amb35611003 [0,0,0,2,0,0|1,1,0]=4 2655 B14R3.2916 c1ncc(C2CCCC3CC32)o1 Amb35655917 [0,0,0,2,0,0|1,0,0]=3 2656 B14R3.2922 c1cc(C2CC3CCC2C3)on1 Amb25031311 [0,0,0,2,0,0|1,0,0]=3 2657 B14R3.2922 c1cc([C@H]2C[C@@H]3CC[C@H]2N3)on1 Amb27200342 [0,0,0,2,0,0|2,0,0]=4 2658 B14R3.2922 c1ccn(C2CC3CCC2C3)c1 Amb27770215 [0,0,0,2,0,0|2,0,0]=4 2659 B14R3.2922 c1cnn(C2CC3CCC2C3)c1 Amb28244151 [0,0,0,2,0,0|2,0,0]=4 2660 B14R3.2922 c1csc(C2CC3CCC2C3)n1 Amb27458481 [0,0,0,2,0,0|1,1,0]=4 2661 B14R3.2922 c1nc(C2CC3CCC2C3)cs1 Amb28143108 [0,0,0,2,0,0|2,0,0]=4 2662 B14R3.2922 c1ncc(C2CC3CCC2C3)o1 Amb35647912 [0,0,0,2,0,0|1,0,0]=3 2663 B14R3.2922 c1ncc(C2CC3CCC2O3)o1 Amb35652503 [0,0,0,2,0,0|2,0,0]=4 2664 B14R3.3022 c1cc2c(o1)CC3CCCN3C2 Amb27178109 [0,0,0,2,0,0|1,0,0]=3 2665 B14R3.3022 c1cc2c(o1)CN3CCCC3C2 Amb28143594 [0,0,0,2,0,0|1,0,0]=3 2666 B14R3.3022 c1cc2c(o1)CN3CCC[C@H]3C2 Amb24738392 [0,0,0,2,0,0|1,0,0]=3 2667 B14R3.3022 c1cc2c(o1)C[C@@H]3CCCN3C2 Amb25837484 [0,0,0,2,0,0|1,0,0]=3 2668 B14R3.20477 c1ccn(CC23CCCC2C3)c1 Amb35692093 [0,0,0,2,0,0|2,0,0]=4 2669 B14R3.28 c1ncc(C2C3CCCCC32)o1 Amb35647977 [0,0,0,2,0,0|1,0,0]=3 2670 B14R3.33 c1ccn(C2CCC3CC3C2)c1 Amb35703947 [0,0,0,2,0,0|2,0,0]=4 2671 B14R3.33 c1ncc(C2CCC3CC3C2)o1 Amb35655918 [0,0,0,2,0,0|1,0,0]=3 2672 B14R3.414 NC1C2CNC(c3ccco3)C12 Amb18828854 [0,0,0,2,0,0|2,0,0]=4 2673 B14R3.2915 c1coc([C@]23CC[C@H]2CCN3)c1 Amb32687502 [0,0,0,2,0,0|1,0,0]=3 2674 B14R3.2915 c1csc(C23CCC2CCN3)c1 Amb32665272 [0,0,0,2,0,0|1,1,0]=4 2675 B14R3.2915 c1csc(C23CCC2CCN3)c1 Amb32665274 [0,0,0,2,0,0|1,1,0]=4 2676 B14R3.2915 c1csc([C@]23CC[C@H]2CCN3)c1 Amb32755926 [0,0,0,2,0,0|1,1,0]=4 2677 B14R3.2915 c1csc([C@]23CC[C@H]2CCN3)c1 Amb32755927 [0,0,0,2,0,0|1,1,0]=4 2678 B14R3.3046 c1cc2c(s1)CCN3CCCC23 Amb27660810 [0,0,0,2,0,0|1,1,0]=4 2679 B14R3.36 c1ccn(CC2CC3CC3C2)c1 Amb30024839 [0,0,0,2,0,0|2,0,0]=4 2680 B14R3.36 c1cnn(CC2CC3CC3C2)c1 Amb29872706 [0,0,0,2,0,0|2,0,0]=4 2681 B14R3.2919 c1coc(C2NCC2C3CC3)c1 Amb27184560 [0,0,0,2,0,0|1,0,0]=3 2682 B14R3.2919 c1csc(C2NCC2C3CC3)c1 Amb27613465 [0,0,0,2,0,0|1,1,0]=4 2683 B14R3.14827 c1coc(C2NCC23CCC3)c1 Amb27252606 [0,0,0,2,0,0|1,0,0]=3 2684 B14R3.2930 c1ccn(CC2CC2C3CC3)c1 Amb30037244 [0,0,0,2,0,0|2,0,0]=4 2685 B14R3.164 C1Cc2noc3c2C(C1)CCC3 Amb26444057 [0,0,0,2,0,0|1,0,0]=3 2686 B14R3.3044 c1cc2c(o1)CCNC2C3CC3 Amb32647537 [0,0,0,2,0,0|1,0,0]=3 2687 B14R3.3044 c1cc2c(s1)CCNC2C3CC3 Amb9703889 [0,0,0,2,0,0|1,1,0]=4 2688 B14R3.4146 c1cc2c(o1)CCNC23CCC3 Amb32647529 [0,0,0,2,0,0|1,0,0]=3 2689 B14R3.4146 c1cc2c(o1)CCNC23COC3 Amb32647580 [0,0,0,2,0,0|2,0,0]=4 2690 B14R3.4146 c1cc2c(o1)CCNC23CSC3 Amb32647386 [0,0,0,2,0,0|2,0,0]=4 2691 B14R3.4146 c1cc2c(s1)CCNC23CCC3 Amb26540301 [0,0,0,2,0,0|1,1,0]=4 2692 B10R1.177 CCCCCCCC1CO1 Amb26986702 [0,0,0,0,2,0|0,0,2]=4 2693 B10R1.177 CCCCCCC[C@@H]1CO1 Amb27175386 [0,0,0,0,2,0|0,0,2]=4