0 B15R2.4774 CCc1ccc2ccc(C)cc2c1O Amb27164557 [0,0,0,0,0,0|3,0,0]=3 1 B15R2.4774 COc1ccc2c(c1C)NC(=O)CO2 Amb27879166 [0,0,0,0,0,0|3,0,1]=4 2 B15R2.4774 COc1ccc2c(c1C)OC(=O)C=C2 Amb20247397 [0,0,0,0,0,0|1,0,0]=1 3 B15R2.4774 COc1ccc2c(c1O)OC(=O)C=C2 Amb18511490 [0,0,0,0,0,0|0,0,0]=0 4 B15R2.4774 COc1ccc2ccc(Br)nc2c1F Amb35640509 [0,0,0,0,0,0|3,0,0]=3 5 B15R2.4774 COc1ccc2ccc(C)nc2c1O Amb27612619 [0,0,0,0,0,0|2,0,0]=2 6 B15R2.4774 COc1ccc2ccc(Cl)nc2c1F Amb35643194 [0,0,0,0,0,0|3,0,0]=3 7 B15R2.4774 COc1ccc2ccc(N)nc2c1F Amb29884467 [0,0,0,0,0,0|3,0,0]=3 8 B15R2.4774 COc1ccc2ccc(O)nc2c1F Amb32684853 [0,0,0,0,0,0|2,0,1]=3 9 B15R2.4774 COc1ccc2cnc(Cl)cc2c1F Amb32685495 [0,0,0,0,0,0|4,0,0]=4 10 B15R2.4774 COc1ccc2cnc(Cl)nc2c1C Amb27764204 [0,0,0,0,0,0|4,0,0]=4 11 B15R2.4774 COc1ccc2ncc(Br)cc2c1Cl Amb35788793 [0,0,0,0,0,0|4,0,0]=4 12 B15R2.4774 COc1ccc2ncc(Cl)nc2c1Cl Amb25805214 [0,0,0,0,0,0|4,0,0]=4 13 B15R2.4774 COc1ccc2ncc(F)cc2c1Br Amb27813826 [0,0,0,0,0,0|4,0,0]=4 14 B15R2.4774 COc1ccc2ncc(N)cc2c1F Amb32673401 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.4774 Cc1ccc2ccc(C=O)c(O)c2n1 Amb19958237 [0,0,0,0,0,0|4,0,0]=4 16 B14R2.92 C=Cc1ccc2cccnc2c1O Amb28436506 [1,0,0,0,0,0|2,0,1]=4 17 B14R2.92 CCc1ccc2cccnc2c1N Amb22899681 [1,0,0,0,0,0|3,0,0]=4 18 B14R2.92 CCc1ccc2cccnc2c1O Amb27227018 [1,0,0,0,0,0|2,0,0]=3 19 B14R2.92 CNc1ccc2ccccc2c1N Amb17594325 [1,0,0,0,0,0|3,0,0]=4 20 B14R2.92 CNc1ccc2cccnc2c1N Amb17608146 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.92 COC1=CNc2ccccc2C1=O Amb25679917 [1,0,0,0,0,0|2,0,1]=4 22 B14R2.92 CO[C@@H]1C=Cc2ccccc2[C@@H]1O Amb27197147 [1,0,0,0,0,0|1,0,2]=4 23 B14R2.92 CO[C@@H]1C=Cc2cccnc2[C@H]1O Amb28069684 [1,0,0,0,0,0|1,0,2]=4 24 B14R2.92 COc1ccc2c(c1N)CC=CC2 Amb27224630 [1,0,0,0,0,0|2,0,1]=4 25 B14R2.92 COc1ccc2ccccc2c1Br Amb2618563 [1,0,0,0,0,0|2,0,0]=3 26 B14R2.92 COc1ccc2ccccc2c1C Amb17743960 [1,0,0,0,0,0|2,0,0]=3 27 B14R2.92 COc1ccc2ccccc2c1F Amb28185351 [1,0,0,0,0,0|2,0,0]=3 28 B14R2.92 COc1ccc2ccccc2c1I Amb2477152 [1,0,0,0,0,0|2,0,0]=3 29 B14R2.92 COc1ccc2ccccc2c1N Amb17200200 [1,0,0,0,0,0|2,0,0]=3 30 B14R2.92 COc1ccc2ccccc2c1S Amb32732685 [1,0,0,0,0,0|1,1,0]=3 31 B14R2.92 COc1ccc2cccnc2c1Br Amb16226757 [1,0,0,0,0,0|2,0,0]=3 32 B14R2.92 COc1ccc2cccnc2c1C Amb32651814 [1,0,0,0,0,0|2,0,0]=3 33 B14R2.92 COc1ccc2cccnc2c1Cl Amb23437321 [1,0,0,0,0,0|2,0,0]=3 34 B14R2.92 COc1ccc2cccnc2c1F Amb23403105 [1,0,0,0,0,0|2,0,0]=3 35 B14R2.92 COc1ccc2cccnc2c1I Amb23400932 [1,0,0,0,0,0|2,0,0]=3 36 B14R2.92 COc1ccc2cccnc2c1N Amb20621536 [1,0,0,0,0,0|2,0,0]=3 37 B14R2.92 COc1ccc2cccnc2c1O Amb26880905 [1,0,0,0,0,0|1,0,0]=2 38 B14R2.92 COc1ccc2ccncc2c1Br Amb19100699 [1,0,0,0,0,0|3,0,0]=4 39 B14R2.92 COc1ccc2ccncc2c1I Amb2613187 [1,0,0,0,0,0|3,0,0]=4 40 B14R2.92 COc1ccc2ccncc2c1N Amb8010681 [1,0,0,0,0,0|3,0,0]=4 41 B14R2.92 COc1ccc2cnccc2c1Br Amb19100700 [1,0,0,0,0,0|3,0,0]=4 42 B14R2.92 COc1ccc2cnccc2c1N Amb24062940 [1,0,0,0,0,0|3,0,0]=4 43 B14R2.92 COc1ccc2cnccc2c1O Amb27954682 [1,0,0,0,0,0|2,0,0]=3 44 B14R2.92 COc1ccc2ncccc2c1Br Amb18354242 [1,0,0,0,0,0|3,0,0]=4 45 B14R2.92 COc1ccc2ncccc2c1C Amb35789585 [1,0,0,0,0,0|3,0,0]=4 46 B14R2.92 COc1ccc2ncccc2c1Cl Amb23437324 [1,0,0,0,0,0|3,0,0]=4 47 B14R2.92 COc1ccc2ncccc2c1I Amb23403115 [1,0,0,0,0,0|3,0,0]=4 48 B14R2.92 COc1ccc2ncccc2c1N Amb9676517 [1,0,0,0,0,0|3,0,0]=4 49 B14R2.92 COc1ccc2ncccc2c1O Amb18127369 [1,0,0,0,0,0|2,0,0]=3 50 B14R2.92 COc1ccc2nccnc2c1Br Amb28290675 [1,0,0,0,0,0|3,0,0]=4 51 B14R2.92 COc1ccc2nccnc2c1Cl Amb27800255 [1,0,0,0,0,0|3,0,0]=4 52 B14R2.92 COc1cnc2ccccc2c1Br Amb27405335 [1,0,0,0,0,0|3,0,0]=4 53 B14R2.92 COc1cnc2ccccc2c1N Amb18127237 [1,0,0,0,0,0|3,0,0]=4 54 B14R2.92 COc1cnc2cccnc2c1I Amb21959427 [1,0,0,0,0,0|3,0,0]=4 55 B14R2.92 CSc1ccc2ccccc2c1N Amb27407738 [1,0,0,0,0,0|2,1,0]=4 56 B14R2.92 CSc1ccc2cccnc2c1N Amb18129874 [1,0,0,0,0,0|2,1,0]=4 57 B14R2.92 N#Cc1ccc2ccccc2c1O Amb17594234 [1,0,0,0,0,0|3,0,0]=4 58 B14R2.92 N#Cc1ccc2cccnc2c1O Amb25039577 [1,0,0,0,0,0|3,0,0]=4 59 B14R2.92 NCc1ccc2ccccc2c1O Amb28242155 [1,0,0,0,0,0|3,0,0]=4 60 B14R2.92 NCc1ccc2cccnc2c1O Amb28555930 [1,0,0,0,0,0|3,0,0]=4 61 B14R2.92 NCc1ccc2cccnc2c1O Amb9776170 [1,0,0,0,0,0|3,0,0]=4 62 B14R2.92 NNc1ccc2ccccc2c1O Amb27760649 [1,0,0,0,0,0|3,0,0]=4 63 B14R2.92 O=Cc1ccc2ccccc2c1O Amb4007826 [1,0,0,0,0,0|3,0,0]=4 64 B14R2.92 O=Cc1ccc2cccnc2c1O Amb17933803 [1,0,0,0,0,0|3,0,0]=4 65 B14R2.92 O=Nc1ccc2ccccc2c1O Amb6357361 [1,0,0,0,0,0|3,0,0]=4 66 B14R2.92 OCc1ccc2ccccc2c1O Amb18127195 [1,0,0,0,0,0|3,0,0]=4 67 B14R2.92 ONc1ccc2ccccc2c1O Amb27816554 [1,0,0,0,0,0|3,0,0]=4 68 B14R2.92 Oc1c(CBr)ccc2ccccc12 Amb27876665 [1,0,0,0,0,0|3,0,0]=4 69 B14R2.92 Oc1c(CCl)ccc2ccccc12 Amb25900678 [1,0,0,0,0,0|3,0,0]=4 70 B14R2.134 C#Cc1ccc2c(c1)OC(=O)C=C2 Amb27186317 [1,0,0,0,0,0|1,0,1]=3 71 B14R2.134 C=Cc1ccc2c(c1)OC(=O)C=C2 Amb27462421 [1,0,0,0,0,0|1,0,1]=3 72 B14R2.134 CCc1ccc2c(c1)OC(=O)C=C2 Amb28135747 [1,0,0,0,0,0|1,0,0]=2 73 B14R2.134 CCc1ccc2ccc(N)nc2c1 Amb18126933 [1,0,0,0,0,0|3,0,0]=4 74 B14R2.134 CCc1ccc2ccc(O)cc2c1 Amb26937947 [1,0,0,0,0,0|2,0,1]=4 75 B14R2.134 CNc1ccc2c(c1)NC(=O)C=C2 Amb28410493 [1,0,0,0,0,0|2,0,0]=3 76 B14R2.134 COC1=CC2=CC(=O)NC=C2C=C1 Amb21964171 [1,0,0,0,0,0|2,0,0]=3 77 B14R2.134 COc1cc2cc(Br)ccc2cn1 Amb22498297 [1,0,0,0,0,0|3,0,0]=4 78 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 Amb540612 [1,0,0,0,0,0|1,0,2]=4 79 B14R2.134 COc1ccc2c(c1)CC(=O)CO2 Amb15692716 [1,0,0,0,0,0|2,0,1]=4 80 B14R2.134 COc1ccc2c(c1)CC(=O)N=C2 Amb22015296 [1,0,0,0,0,0|2,0,0]=3 81 B14R2.134 COc1ccc2c(c1)CC(=O)NC2 Amb2697282 [1,0,0,0,0,0|2,0,1]=4 82 B14R2.134 COc1ccc2c(c1)CC(=O)OC2 Amb24760144 [1,0,0,0,0,0|2,0,1]=4 83 B14R2.134 COc1ccc2c(c1)CC(N)C=C2 Amb17470523 [1,0,0,0,0,0|2,0,1]=4 84 B14R2.134 COc1ccc2c(c1)NC(=O)C=N2 Amb21856989 [1,0,0,0,0,0|2,0,0]=3 85 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 Amb17470569 [1,0,0,0,0,0|1,0,2]=4 86 B14R2.134 COc1ccc2c(c1)NC(=O)CO2 Amb962497 [1,0,0,0,0,0|2,0,1]=4 87 B14R2.134 COc1ccc2c(c1)NC(=O)CS2 Amb25072808 [1,0,0,0,0,0|2,0,1]=4 88 B14R2.134 COc1ccc2c(c1)NC(=O)OC2 Amb26375131 [1,0,0,0,0,0|2,0,1]=4 89 B14R2.134 COc1ccc2c(c1)NC(C)C=C2 Amb18559673 [1,0,0,0,0,0|2,0,1]=4 90 B14R2.134 COc1ccc2c(c1)OC(=O)C=C2 Amb18511473 [1,0,0,0,0,0|0,0,0]=1 91 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 Amb21928511 [1,0,0,0,0,0|0,0,2]=3 92 B14R2.134 COc1ccc2c(c1)OC(=S)C=C2 Amb28385461 [1,0,0,0,0,0|0,1,0]=2 93 B14R2.134 COc1ccc2c(c1)OC(O)C=C2 Amb27766566 [1,0,0,0,0,0|0,0,2]=3 94 B14R2.134 COc1ccc2c(n1)NC(=O)C=C2 Amb22753693 [1,0,0,0,0,0|2,0,0]=3 95 B14R2.134 COc1ccc2c(n1)NC(=O)C=N2 Amb21864677 [1,0,0,0,0,0|3,0,0]=4 96 B14R2.134 COc1ccc2cc[n+]([O-])cc2c1 Amb2613189 [1,0,0,0,0,0|2,0,1]=4 97 B14R2.134 COc1ccc2ccc(Br)cc2c1 Amb27252105 [1,0,0,0,0,0|2,0,0]=3 98 B14R2.134 COc1ccc2ccc(Br)cc2n1 Amb22234521 [1,0,0,0,0,0|3,0,0]=4 99 B14R2.134 COc1ccc2ccc(Br)nc2c1 Amb25789005 [1,0,0,0,0,0|2,0,0]=3 100 B14R2.134 COc1ccc2ccc(C)cc2c1 Amb25340236 [1,0,0,0,0,0|2,0,0]=3 101 B14R2.134 COc1ccc2ccc(C)nc2c1 Amb1994820 [1,0,0,0,0,0|2,0,0]=3 102 B14R2.134 COc1ccc2ccc(Cl)cc2c1 Amb25974096 [1,0,0,0,0,0|2,0,0]=3 103 B14R2.134 COc1ccc2ccc(Cl)nc2c1 Amb21864672 [1,0,0,0,0,0|2,0,0]=3 104 B14R2.134 COc1ccc2ccc(F)cc2c1 Amb24725253 [1,0,0,0,0,0|2,0,0]=3 105 B14R2.134 COc1ccc2ccc(I)cc2c1 Amb27667893 [1,0,0,0,0,0|2,0,0]=3 106 B14R2.134 COc1ccc2ccc(N)cc2c1 Amb25187874 [1,0,0,0,0,0|2,0,0]=3 107 B14R2.134 COc1ccc2ccc(N)cc2n1 Amb23401128 [1,0,0,0,0,0|3,0,0]=4 108 B14R2.134 COc1ccc2ccc(N)nc2c1 Amb18127232 [1,0,0,0,0,0|2,0,0]=3 109 B14R2.134 COc1ccc2ccc(N)nc2n1 Amb25900489 [1,0,0,0,0,0|3,0,0]=4 110 B14R2.134 COc1ccc2ccc(O)cc2c1 Amb3939561 [1,0,0,0,0,0|1,0,1]=3 111 B14R2.134 COc1ccc2ccc(O)cc2n1 Amb26317850 [1,0,0,0,0,0|2,0,1]=4 112 B14R2.134 COc1ccc2ccc(S)nc2c1 Amb28429749 [1,0,0,0,0,0|1,1,0]=3 113 B14R2.134 COc1ccc2cnc(C)cc2c1 Amb17778822 [1,0,0,0,0,0|3,0,0]=4 114 B14R2.134 COc1ccc2cnc(C)nc2c1 Amb23401003 [1,0,0,0,0,0|3,0,0]=4 115 B14R2.134 COc1ccc2cnc(Cl)cc2c1 Amb22735858 [1,0,0,0,0,0|3,0,0]=4 116 B14R2.134 COc1ccc2cnc(Cl)nc2c1 Amb22292327 [1,0,0,0,0,0|3,0,0]=4 117 B14R2.134 COc1ccc2cnc(F)cc2c1 Amb26414113 [1,0,0,0,0,0|3,0,0]=4 118 B14R2.134 COc1ccc2cnc(N)nc2c1 Amb23402208 [1,0,0,0,0,0|3,0,0]=4 119 B14R2.134 COc1ccc2ncc(Br)cc2c1 Amb1994330 [1,0,0,0,0,0|3,0,0]=4 120 B14R2.134 COc1ccc2ncc(Br)nc2c1 Amb26500425 [1,0,0,0,0,0|3,0,0]=4 121 B14R2.134 COc1ccc2ncc(Cl)nc2c1 Amb19959203 [1,0,0,0,0,0|3,0,0]=4 122 B14R2.134 COc1ccc2ncc(F)cc2c1 Amb21926929 [1,0,0,0,0,0|3,0,0]=4 123 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb10669512 [1,0,0,0,0,0|3,0,0]=4 124 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb1994860 [1,0,0,0,0,0|3,0,0]=4 125 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb20239407 [1,0,0,0,0,0|3,0,0]=4 126 B14R2.134 COc1ccc2ncc(N)nc2c1 Amb21858805 [1,0,0,0,0,0|3,0,0]=4 127 B14R2.134 COc1ccc2ncc(O)cc2c1 Amb8506041 [1,0,0,0,0,0|2,0,1]=4 128 B14R2.134 COc1cnc2c(c1)NC(=O)C=C2 Amb22234510 [1,0,0,0,0,0|2,0,0]=3 129 B14R2.134 COc1cnc2c(c1)NC(=O)C=N2 Amb25741393 [1,0,0,0,0,0|3,0,0]=4 130 B14R2.134 COc1cnc2ccc(Br)cc2c1 Amb22494759 [1,0,0,0,0,0|3,0,0]=4 131 B14R2.134 COc1cnc2ccc(Cl)cc2c1 Amb22495280 [1,0,0,0,0,0|3,0,0]=4 132 B14R2.134 COc1cnc2ccc(F)cc2c1 Amb22495281 [1,0,0,0,0,0|3,0,0]=4 133 B14R2.134 COc1cnc2ccc(I)cc2c1 Amb22495279 [1,0,0,0,0,0|3,0,0]=4 134 B14R2.134 COc1cnc2ccc(N)cc2c1 Amb26880806 [1,0,0,0,0,0|3,0,0]=4 135 B14R2.134 COc1cnc2ccc(O)cc2c1 Amb28066536 [1,0,0,0,0,0|2,0,1]=4 136 B14R2.134 COc1ncc2c(n1)NC(=O)C=C2 Amb22234516 [1,0,0,0,0,0|3,0,0]=4 137 B14R2.134 CSc1ccc2ccc(N)nc2c1 Amb18129872 [1,0,0,0,0,0|2,1,0]=4 138 B14R2.134 N#Cc1ccc2c(c1)NC(=O)C=C2 Amb21864676 [1,0,0,0,0,0|3,0,0]=4 139 B14R2.134 N#Cc1ccc2c(c1)OC(=O)C=C2 Amb27860260 [1,0,0,0,0,0|2,0,0]=3 140 B14R2.134 NCc1ccc2c(c1)NC(=O)C=C2 Amb27226307 [1,0,0,0,0,0|3,0,0]=4 141 B14R2.134 NCc1ccc2c(c1)OC(=O)C=C2 Amb27403027 [1,0,0,0,0,0|2,0,0]=3 142 B14R2.134 NOc1ccc2c(c1)OC(=O)C=C2 Amb27186422 [1,0,0,0,0,0|1,0,0]=2 143 B14R2.134 O=C1C=Cc2ccc(CO)cc2O1 Amb27442471 [1,0,0,0,0,0|2,0,0]=3 144 B14R2.134 O=Cc1ccc2c(c1)OC(=O)C=C2 Amb27180468 [1,0,0,0,0,0|2,0,0]=3 145 B14R2.134 O=Nc1ccc2c(c1)OC(=O)C=C2 Amb27642751 [1,0,0,0,0,0|2,0,0]=3 146 B14R2.4513 Cc1c(Br)ccc2c1NC(=O)C=C2 Amb27783400 [1,0,0,0,0,0|3,0,0]=4 147 B14R2.4513 Cc1c(Cl)ccc2c1NC(=O)C=C2 Amb20171143 [1,0,0,0,0,0|3,0,0]=4 148 B14R2.4513 Cc1c(I)ccc2c1NC(=O)C=C2 Amb22584090 [1,0,0,0,0,0|3,0,0]=4 149 B14R2.4513 Cc1c(N)ccc2c1NC(=O)C=C2 Amb28129376 [1,0,0,0,0,0|3,0,0]=4 150 B14R2.4513 Cc1c(O)ccc2c1OC(=O)C=C2 Amb18127557 [1,0,0,0,0,0|1,0,0]=2 151 B14R2.4513 Cc1ccc2c(c1C)NC(=O)C=C2 Amb26567235 [1,0,0,0,0,0|2,0,0]=3 152 B14R2.4513 Cc1ccc2c(c1Cl)NC(=O)C=C2 Amb27245550 [1,0,0,0,0,0|2,0,0]=3 153 B14R2.4513 Cc1ccc2ccc(Br)c(O)c2c1 Amb18061801 [1,0,0,0,0,0|3,0,0]=4 154 B14R2.4513 Cc1ccc2ccc(Br)cc2c1O Amb18561800 [1,0,0,0,0,0|2,0,0]=3 155 B14R2.4513 Cc1ccc2ccc(Br)nc2c1F Amb28241665 [1,0,0,0,0,0|3,0,0]=4 156 B14R2.4513 Cc1ccc2ccc(C)c(Br)c2c1 Amb24056462 [1,0,0,0,0,0|3,0,0]=4 157 B14R2.4513 Cc1ccc2ccc(C)c(C)c2c1 Amb6296402 [1,0,0,0,0,0|3,0,0]=4 158 B14R2.4513 Cc1ccc2ccc(C)c(C)c2n1 Amb1994283 [1,0,0,0,0,0|3,0,0]=4 159 B14R2.4513 Cc1ccc2ccc(C)c(N)c2n1 Amb18126936 [1,0,0,0,0,0|3,0,0]=4 160 B14R2.4513 Cc1ccc2ccc(C)c(O)c2c1 Amb18561796 [1,0,0,0,0,0|2,0,0]=3 161 B14R2.4513 Cc1ccc2ccc(Cl)c(O)c2n1 Amb28074779 [1,0,0,0,0,0|3,0,0]=4 162 B14R2.4513 Cc1ccc2ccc(Cl)cc2c1O Amb18561799 [1,0,0,0,0,0|2,0,0]=3 163 B14R2.4513 Cc1ccc2ccc(Cl)nc2c1C Amb27457038 [1,0,0,0,0,0|3,0,0]=4 164 B14R2.4513 Cc1ccc2ccc(F)c(O)c2n1 Amb23448741 [1,0,0,0,0,0|3,0,0]=4 165 B14R2.4513 Cc1ccc2ccc(F)cc2c1O Amb18561798 [1,0,0,0,0,0|2,0,0]=3 166 B14R2.4513 Cc1ccc2ccc(N)c(O)c2n1 Amb25899916 [1,0,0,0,0,0|3,0,0]=4 167 B14R2.4513 Cc1ccc2ccc(O)c(C)c2n1 Amb23412370 [1,0,0,0,0,0|3,0,0]=4 168 B14R2.4513 Cc1ccc2ccc(O)c(Cl)c2n1 Amb27618138 [1,0,0,0,0,0|3,0,0]=4 169 B14R2.4513 Cc1ccc2ccc(O)cc2c1C Amb27750229 [1,0,0,0,0,0|2,0,1]=4 170 B14R2.4513 Cc1ccc2ccc(O)nc2c1N Amb25774397 [1,0,0,0,0,0|2,0,1]=4 171 B14R2.4513 Cc1ccc2ccc(S)nc2c1C Amb25180058 [1,0,0,0,0,0|2,1,0]=4 172 B14R2.4513 Cc1ccc2ncc(C)c(O)c2c1 Amb18063874 [1,0,0,0,0,0|3,0,0]=4 173 B14R2.4513 Cc1cnc2ccc(Cl)cc2c1O Amb18561809 [1,0,0,0,0,0|3,0,0]=4 174 B14R2.4513 Cc1cnc2ccc(F)cc2c1O Amb18063870 [1,0,0,0,0,0|3,0,0]=4 175 B14R2.4513 Cc1cnc2ccc(I)cc2c1O Amb24549844 [1,0,0,0,0,0|3,0,0]=4 176 B14R2.4513 Nc1c(O)ccc2ccc(Cl)cc12 Amb27180250 [1,0,0,0,0,0|3,0,0]=4 177 B14R2.4513 Nc1c(O)ccc2ccc(O)cc12 Amb17594438 [1,0,0,0,0,0|2,0,1]=4 178 B14R2.4513 Nc1ccc2ccc(Cl)nc2c1O Amb27876644 [1,0,0,0,0,0|3,0,0]=4 179 B14R2.4513 Nc1ccc2ccc(O)c(N)c2c1 Amb17594399 [1,0,0,0,0,0|3,0,0]=4 180 B14R2.4513 O=C1C=Cc2ccc(Br)c(Cl)c2N1 Amb29865169 [1,0,0,0,0,0|3,0,0]=4 181 B14R2.4513 O=C1C=Cc2ccc(Br)c(F)c2N1 Amb27631700 [1,0,0,0,0,0|3,0,0]=4 182 B14R2.4513 O=C1C=Cc2ccc(Cl)c(Cl)c2N1 Amb25744588 [1,0,0,0,0,0|3,0,0]=4 183 B14R2.4513 O=C1C=Cc2ccc(F)c(Br)c2N1 Amb21864673 [1,0,0,0,0,0|3,0,0]=4 184 B14R2.4513 O=C1C=Cc2ccc(F)c(Cl)c2N1 Amb30016115 [1,0,0,0,0,0|3,0,0]=4 185 B14R2.4513 O=C1C=Cc2ccc(O)c(F)c2O1 Amb25129002 [1,0,0,0,0,0|1,0,0]=2 186 B14R2.4513 O=C1C=Cc2ccc(O)c(O)c2O1 Amb18511467 [1,0,0,0,0,0|0,0,0]=1 187 B14R2.4513 O=C1CCc2ccc(O)c(O)c2O1 Amb5717745 [1,0,0,0,0,0|0,0,2]=3 188 B14R2.4513 Oc1c(Br)ccc2ccc(Br)cc12 Amb18061808 [1,0,0,0,0,0|3,0,0]=4 189 B14R2.4513 Oc1c(Br)ccc2ccc(Cl)cc12 Amb18061807 [1,0,0,0,0,0|3,0,0]=4 190 B14R2.4513 Oc1c(Br)ccc2ccc(F)cc12 Amb18061799 [1,0,0,0,0,0|3,0,0]=4 191 B14R2.4513 Oc1ccc2ccc(Cl)cc2c1Cl Amb17595768 [1,0,0,0,0,0|3,0,0]=4 192 B14R2.4513 Oc1ccc2ccc(O)c(O)c2c1 Amb17594462 [1,0,0,0,0,0|1,0,1]=3 193 B16R2.7475 COc1ccc2c(c1OC)CC(N)C=C2 Amb17471164 [0,1,0,0,0,0|2,0,1]=4 194 B16R2.7475 COc1ccc2cnc(N)nc2c1OC Amb32792197 [0,1,0,0,0,0|3,0,0]=4 195 B16R2.37659 COc1ccc2cc(C)c(Cl)nc2c1F Amb35643193 [0,1,0,0,0,0|3,0,0]=4 196 B16R2.197098 COc1ccc2c(C)cc(Br)nc2c1F Amb35643196 [0,1,0,0,0,0|3,0,0]=4 197 B16R2.197098 COc1ccc2c(C)cc(Cl)nc2c1F Amb35643195 [0,1,0,0,0,0|3,0,0]=4 198 B16R2.197098 COc1ccc2c(Cl)cc(C)nc2c1F Amb35643191 [0,1,0,0,0,0|3,0,0]=4 199 B16R2.197098 COc1ccc2c(Cl)cc(Cl)nc2c1C Amb20620959 [0,1,0,0,0,0|3,0,0]=4 200 B16R2.197098 COc1ccc2c(Cl)cc(Cl)nc2c1Cl Amb20241063 [0,1,0,0,0,0|3,0,0]=4 201 B16R2.197098 COc1ccc2c(Cl)cc(Cl)nc2c1F Amb35643192 [0,1,0,0,0,0|3,0,0]=4 202 B16R2.197098 COc1ccc2c(O)cc(O)nc2c1Cl Amb32405927 [0,1,0,0,0,0|2,0,1]=4 203 B16R2.197098 COc1ccc2c(c1F)NC(=O)OC2=O Amb32755844 [0,1,0,0,0,0|3,0,0]=4 204 B14R1.83 C=CC(=O)Nc1cccc(OC)c1F Amb35643163 [0,0,1,0,0,0|2,0,0]=3 205 B14R1.83 COC(=O)Cc1cccc(OC)c1O Amb32661054 [0,0,1,0,0,0|2,0,1]=4 206 B14R1.83 COc1cccc(NC(=O)CCl)c1O Amb27596934 [0,0,1,0,0,0|2,0,1]=4 207 B14R1.1361 COc1ccc(CCC=O)c(Br)c1O Amb33006958 [0,0,1,0,0,0|1,0,2]=4 208 B14R1.1361 COc1ccc(\C=C\C=O)c(Br)c1O Amb33006935 [0,0,1,0,0,0|1,0,0]=2 209 B14R1.1361 COc1ccc(\C=C\CN)c(Br)c1O Amb33006939 [0,0,1,0,0,0|2,0,1]=4 210 B14R1.1361 COc1ccc(\C=C\CO)c(Br)c1O Amb33006937 [0,0,1,0,0,0|1,0,2]=4 211 B14R1.2318 COc1ccc(F)c(CC(=O)O)c1O Amb18810904 [0,0,1,0,0,0|3,0,0]=4 212 B14R1.2318 COc1ccc(F)c(CC(C)=O)c1O Amb27193555 [0,0,1,0,0,0|2,0,1]=4 213 B14R1.3653 COC1=COC(\C=C\C(=O)O)=CC1=O Amb31150600 [0,0,1,0,0,0|1,0,1]=3 214 B14R1.3653 COc1ccc(C#CC(=O)O)cc1Br Amb17264222 [0,0,1,0,0,0|1,0,2]=4 215 B14R1.3653 COc1ccc(C#CC(=O)O)cc1C Amb17139241 [0,0,1,0,0,0|1,0,2]=4 216 B14R1.3653 COc1ccc(C#CC(=O)O)cc1Cl Amb17240715 [0,0,1,0,0,0|1,0,2]=4 217 B14R1.3653 COc1ccc(C#CC(=O)O)cc1F Amb17235865 [0,0,1,0,0,0|1,0,2]=4 218 B14R1.3653 COc1ccc(CCC(=O)Cl)cc1O Amb17143624 [0,0,1,0,0,0|1,0,2]=4 219 B14R1.3653 COc1ccc(CCC(=O)O)cc1Br Amb3934536 [0,0,1,0,0,0|1,0,2]=4 220 B14R1.3653 COc1ccc(CCC(=O)O)cc1C Amb2722007 [0,0,1,0,0,0|1,0,2]=4 221 B14R1.3653 COc1ccc(CCC(=O)O)cc1Cl Amb1243468 [0,0,1,0,0,0|1,0,2]=4 222 B14R1.3653 COc1ccc(CCC(=O)O)cc1F Amb1225544 [0,0,1,0,0,0|1,0,2]=4 223 B14R1.3653 COc1ccc(CCC(=O)O)cc1N Amb17462199 [0,0,1,0,0,0|1,0,2]=4 224 B14R1.3653 COc1ccc(CCC(=O)O)cc1O Amb5762086 [0,0,1,0,0,0|0,0,2]=3 225 B14R1.3653 COc1ccc(CCC(C)=O)cc1O Amb28653265 [0,0,1,0,0,0|1,0,2]=4 226 B14R1.3653 COc1ccc(CCC(N)=O)cc1O Amb17143150 [0,0,1,0,0,0|1,0,2]=4 227 B14R1.3653 COc1ccc(CNC(C)=O)cc1O Amb26458569 [0,0,1,0,0,0|2,0,1]=4 228 B14R1.3653 COc1ccc(CNC(N)=O)cc1O Amb28133880 [0,0,1,0,0,0|2,0,1]=4 229 B14R1.3653 COc1ccc(NCC(=O)O)cc1Br Amb18904556 [0,0,1,0,0,0|2,0,1]=4 230 B14R1.3653 COc1ccc(NCC(=O)O)cc1Cl Amb840541 [0,0,1,0,0,0|2,0,1]=4 231 B14R1.3653 COc1ccc(NCC(=O)O)cc1O Amb28137964 [0,0,1,0,0,0|1,0,1]=3 232 B14R1.3653 COc1ccc(OCC(=O)O)cc1Br Amb18668302 [0,0,1,0,0,0|2,0,1]=4 233 B14R1.3653 COc1ccc(OCC(=O)O)cc1C Amb20669485 [0,0,1,0,0,0|2,0,1]=4 234 B14R1.3653 COc1ccc(OCC(=O)O)cc1Cl Amb33220545 [0,0,1,0,0,0|2,0,1]=4 235 B14R1.3653 COc1ccc(OCC(=O)O)cc1F Amb33197250 [0,0,1,0,0,0|2,0,1]=4 236 B14R1.3653 COc1ccc(OCC(=O)O)cc1O Amb33428613 [0,0,1,0,0,0|1,0,1]=3 237 B14R1.3653 COc1ccc(SCC(=O)O)cc1C Amb17082988 [0,0,1,0,0,0|2,0,1]=4 238 B14R1.3653 COc1ccc(SCC(=O)O)cc1Cl Amb17082996 [0,0,1,0,0,0|2,0,1]=4 239 B14R1.3653 COc1ccc(\C=C/C(=O)O)cc1N Amb17462241 [0,0,1,0,0,0|1,0,0]=2 240 B14R1.3653 COc1ccc(\C=C/C(N)=O)cc1N Amb17463955 [0,0,1,0,0,0|2,0,0]=3 241 B14R1.3653 COc1ccc(\C=C/C(N)=O)cc1O Amb27168238 [0,0,1,0,0,0|1,0,0]=2 242 B14R1.3653 COc1ccc(\C=C/[N+](=O)[O-])cc1O Amb27419391 [0,0,1,0,0,0|1,0,1]=3 243 B14R1.3653 COc1ccc(\C=C\C(=O)Cl)cc1Br Amb25338313 [0,0,1,0,0,0|2,0,0]=3 244 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1Br Amb33997741 [0,0,1,0,0,0|1,0,0]=2 245 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1C Amb1967434 [0,0,1,0,0,0|1,0,0]=2 246 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1Cl Amb34116436 [0,0,1,0,0,0|1,0,0]=2 247 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1F Amb7757606 [0,0,1,0,0,0|1,0,0]=2 248 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1N Amb23494479 [0,0,1,0,0,0|1,0,0]=2 249 B14R1.3653 COc1ccc(\C=C\C(=O)O)cc1O Amb1129971 [0,0,1,0,0,0|0,0,0]=1 250 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1Br Amb17507182 [0,0,1,0,0,0|2,0,0]=3 251 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1C Amb32954266 [0,0,1,0,0,0|2,0,0]=3 252 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1Cl Amb18569204 [0,0,1,0,0,0|2,0,0]=3 253 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1F Amb28399971 [0,0,1,0,0,0|2,0,0]=3 254 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1N Amb26420711 [0,0,1,0,0,0|2,0,0]=3 255 B14R1.3653 COc1ccc(\C=C\C(C)=O)cc1O Amb18651087 [0,0,1,0,0,0|1,0,0]=2 256 B14R1.3653 COc1ccc(\C=C\C(C)N)cc1O Amb33428985 [0,0,1,0,0,0|2,0,1]=4 257 B14R1.3653 COc1ccc(\C=C\C(C)O)cc1C Amb25307036 [0,0,1,0,0,0|2,0,1]=4 258 B14R1.3653 COc1ccc(\C=C\C(C)O)cc1Cl Amb25796724 [0,0,1,0,0,0|2,0,1]=4 259 B14R1.3653 COc1ccc(\C=C\C(C)O)cc1F Amb28203270 [0,0,1,0,0,0|2,0,1]=4 260 B14R1.3653 COc1ccc(\C=C\C(N)=O)cc1Br Amb27202224 [0,0,1,0,0,0|2,0,0]=3 261 B14R1.3653 COc1ccc(\C=C\C(N)=O)cc1Cl Amb26460333 [0,0,1,0,0,0|2,0,0]=3 262 B14R1.3653 COc1ccc(\C=C\C(N)=O)cc1I Amb25689672 [0,0,1,0,0,0|2,0,0]=3 263 B14R1.3653 COc1ccc(\C=C\C(N)=O)cc1N Amb23494458 [0,0,1,0,0,0|2,0,0]=3 264 B14R1.3653 COc1ccc(\C=C\C(N)=O)cc1O Amb17143116 [0,0,1,0,0,0|1,0,0]=2 265 B14R1.3653 COc1ccc(\C=C\[N+](=O)[O-])cc1Br Amb3617802 [0,0,1,0,0,0|2,0,1]=4 266 B14R1.3653 COc1ccc(\C=C\[N+](=O)[O-])cc1C Amb33448419 [0,0,1,0,0,0|2,0,1]=4 267 B14R1.3653 COc1ccc(\C=C\[N+](=O)[O-])cc1Cl Amb25676802 [0,0,1,0,0,0|2,0,1]=4 268 B14R1.3653 COc1ccc(\C=C\[N+](=O)[O-])cc1F Amb25303479 [0,0,1,0,0,0|2,0,1]=4 269 B14R1.3653 COc1ccc(\C=C\[N+](=O)[O-])cc1O Amb1040053 [0,0,1,0,0,0|1,0,1]=3 270 B14R1.3653 COc1ccc(\C=N\S(C)=O)cc1O Amb35718865 [0,0,1,0,0,0|3,0,0]=4 271 B14R1.3653 COc1ncc(\C=C\C(=O)O)cc1C Amb33267804 [0,0,1,0,0,0|2,0,0]=3 272 B14R1.3653 COc1ncc(\C=C\C(C)=O)cc1C Amb33141211 [0,0,1,0,0,0|3,0,0]=4 273 B14R1.3653 N#Cc1ccc(\C=C\C(=O)O)cc1O Amb27482923 [0,0,1,0,0,0|2,0,0]=3 274 B14R1.3653 NNc1ccc(\C=C\C(=O)O)cc1Cl Amb26917207 [0,0,1,0,0,0|3,0,0]=4 275 B14R1.3653 NNc1ccc(\C=C\C(=O)O)cc1I Amb27847001 [0,0,1,0,0,0|3,0,0]=4 276 B14R1.3653 NNc1ccc(\C=C\C(=O)O)cc1N Amb27616513 [0,0,1,0,0,0|3,0,0]=4 277 B14R1.9401 C\C=C/c1c(C=O)ccc(OC)c1O Amb28408957 [0,0,1,0,0,0|3,0,0]=4 278 B16R3.11020 Brc1ccc2ccc3c(c2n1)CCO3 Amb35606417 [0,0,0,1,0,0|3,0,0]=4 279 B16R3.11020 Clc1ccc2ccc3c(c2n1)CCO3 Amb35606416 [0,0,0,1,0,0|3,0,0]=4 280 B16R3.11020 Nc1ccc2ccc3c(c2n1)CCO3 Amb35606283 [0,0,0,1,0,0|3,0,0]=4 281 B16R3.11020 O=C1C=Cc2ccc3c(c2N1)CCO3 Amb35592716 [0,0,0,1,0,0|2,0,0]=3 282 B16R3.11020 O=C1C=Cc2ccc3c(c2N1)OCO3 Amb24329370 [0,0,0,1,0,0|1,0,0]=2 283 B16R3.11020 O=C1C=Cc2ccc3c(c2O1)OCO3 Amb22264539 [0,0,0,1,0,0|0,0,0]=1 284 B16R3.11020 O=C1C=Cc2ccc3ccoc3c2O1 Amb28344682 [0,0,0,1,0,0|1,0,1]=3 285 B16R3.11020 O=C1C=Cc2ccc3occc3c2N1 Amb28388648 [0,0,0,1,0,0|2,0,1]=4 286 B16R3.11020 O=C1C=Cc2ccc3occc3c2O1 Amb19130532 [0,0,0,1,0,0|1,0,1]=3 287 B14R2.1060 COc1sc2ccc(I)cc2c1O Amb27194442 [0,0,0,0,1,0|3,0,0]=4 288 B14R2.1060 COc1sc2ccc(O)cc2c1O Amb27783142 [0,0,0,0,1,0|2,0,1]=4 289 B14R2.1060 COc1sc2ccc(S)cc2c1O Amb27788610 [0,0,0,0,1,0|2,1,0]=4 290 B14R2.2495 CCc1ccc2c(c1O)C(=O)CC2 Amb27258090 [0,0,0,0,1,0|1,0,2]=4 291 B14R2.2495 CCc1ccc2scc(F)c2c1O Amb27195651 [0,0,0,0,1,0|3,0,0]=4 292 B14R2.2495 COc1ccc2c(c1Br)C(=O)CC2 Amb16232961 [0,0,0,0,1,0|1,0,2]=4 293 B14R2.2495 COc1ccc2c(c1Br)C(=O)OC2 Amb18726608 [0,0,0,0,1,0|2,0,1]=4 294 B14R2.2495 COc1ccc2c(c1C)C(=O)CC2 Amb23440412 [0,0,0,0,1,0|1,0,2]=4 295 B14R2.2495 COc1ccc2c(c1C)C(=O)NC2 Amb21927590 [0,0,0,0,1,0|2,0,1]=4 296 B14R2.2495 COc1ccc2c(c1Cl)C(=O)CN2 Amb18188175 [0,0,0,0,1,0|2,0,1]=4 297 B14R2.2495 COc1ccc2c(c1F)C(=O)CC2 Amb25302596 [0,0,0,0,1,0|1,0,2]=4 298 B14R2.2495 COc1ccc2c(c1F)C(=O)NC2 Amb20248867 [0,0,0,0,1,0|2,0,1]=4 299 B14R2.2495 COc1ccc2c(c1I)C(=O)CC2 Amb28251282 [0,0,0,0,1,0|1,0,2]=4 300 B14R2.2495 COc1ccc2c(c1N)C(=O)CC2 Amb22728977 [0,0,0,0,1,0|1,0,2]=4 301 B14R2.2495 COc1ccc2c(c1N)C(=O)OC2 Amb28242342 [0,0,0,0,1,0|2,0,1]=4 302 B14R2.2495 COc1ccc2scc(Br)c2c1N Amb27438778 [0,0,0,0,1,0|3,0,0]=4 303 B14R2.2495 COc1ccc2scc(C)c2c1Cl Amb27963941 [0,0,0,0,1,0|3,0,0]=4 304 B14R2.2495 COc1ccc2scc(C)c2c1F Amb28057945 [0,0,0,0,1,0|3,0,0]=4 305 B14R2.2495 COc1ccc2scc(C)c2c1O Amb27475059 [0,0,0,0,1,0|2,0,0]=3 306 B14R2.2495 COc1ccc2scc(Cl)c2c1Br Amb27269036 [0,0,0,0,1,0|3,0,0]=4 307 B14R2.2495 COc1ccc2scc(Cl)c2c1C Amb27253213 [0,0,0,0,1,0|3,0,0]=4 308 B14R2.2495 COc1ccc2scc(Cl)c2c1Cl Amb27844977 [0,0,0,0,1,0|3,0,0]=4 309 B14R2.2495 COc1ccc2scc(F)c2c1C Amb27881997 [0,0,0,0,1,0|3,0,0]=4 310 B14R2.2495 COc1ccc2scc(I)c2c1Cl Amb27779380 [0,0,0,0,1,0|3,0,0]=4 311 B14R2.2495 COc1ccc2scc(I)c2c1F Amb27440607 [0,0,0,0,1,0|3,0,0]=4 312 B14R2.2495 COc1ccc2scc(N)c2c1Br Amb27789144 [0,0,0,0,1,0|3,0,0]=4 313 B14R2.2495 COc1ccc2scc(N)c2c1N Amb27798674 [0,0,0,0,1,0|3,0,0]=4 314 B14R2.2495 COc1ccc2scc(N)c2c1S Amb28410950 [0,0,0,0,1,0|2,1,0]=4 315 B14R2.2495 COc1ccc2scc(O)c2c1O Amb27637259 [0,0,0,0,1,0|1,0,1]=3 316 B14R2.2495 COc1ccc2scc(S)c2c1N Amb27619942 [0,0,0,0,1,0|2,1,0]=4 317 B14R2.2495 COc1ccc2scc(S)c2c1O Amb27630748 [0,0,0,0,1,0|1,1,0]=3 318 B14R2.2495 CSc1ccc2scc(F)c2c1O Amb28055359 [0,0,0,0,1,0|2,1,0]=4 319 B14R2.2495 CSc1ccc2scc(O)c2c1O Amb28292238 [0,0,0,0,1,0|1,1,1]=4 320 B14R2.2495 CSc1ccc2scc(S)c2c1O Amb27216842 [0,0,0,0,1,0|1,2,0]=4 321 B14R2.3302 CCc1ccc2cc(Cl)sc2c1O Amb27430112 [0,0,0,0,1,0|2,1,0]=4 322 B14R2.3302 CCc1ccc2cc(I)sc2c1O Amb27216830 [0,0,0,0,1,0|2,1,0]=4 323 B14R2.3302 CCc1ccc2cc(N)sc2c1O Amb27487679 [0,0,0,0,1,0|2,1,0]=4 324 B14R2.3302 COC1=C(N)C2=NC(=O)N=C2C=C1 Amb27415783 [0,0,0,0,1,0|3,0,0]=4 325 B14R2.3302 COC1C=CC2=CC(=O)OC2C1O Amb27399716 [0,0,0,0,1,0|0,0,3]=4 326 B14R2.3302 COc1ccc2c(c1Br)CC(=O)N2 Amb28185930 [0,0,0,0,1,0|3,0,0]=4 327 B14R2.3302 COc1ccc2c(c1C)NC(=O)C2 Amb28068937 [0,0,0,0,1,0|2,0,1]=4 328 B14R2.3302 COc1ccc2c(c1C)SC(=O)N2 Amb28351360 [0,0,0,0,1,0|2,1,0]=4 329 B14R2.3302 COc1ccc2c(c1Cl)NC(=O)N2 Amb27807482 [0,0,0,0,1,0|3,0,0]=4 330 B14R2.3302 COc1ccc2c(c1F)CC(=O)N2 Amb25096762 [0,0,0,0,1,0|3,0,0]=4 331 B14R2.3302 COc1ccc2c(c1F)NC(=O)N2 Amb28348132 [0,0,0,0,1,0|3,0,0]=4 332 B14R2.3302 COc1ccc2cc(Br)sc2c1Br Amb27966483 [0,0,0,0,1,0|2,1,0]=4 333 B14R2.3302 COc1ccc2cc(Br)sc2c1C Amb28202991 [0,0,0,0,1,0|2,1,0]=4 334 B14R2.3302 COc1ccc2cc(Br)sc2c1Cl Amb28429010 [0,0,0,0,1,0|2,1,0]=4 335 B14R2.3302 COc1ccc2cc(Br)sc2c1F Amb27846115 [0,0,0,0,1,0|2,1,0]=4 336 B14R2.3302 COc1ccc2cc(C)sc2c1Br Amb28290826 [0,0,0,0,1,0|2,1,0]=4 337 B14R2.3302 COc1ccc2cc(C)sc2c1C Amb27971214 [0,0,0,0,1,0|2,1,0]=4 338 B14R2.3302 COc1ccc2cc(C)sc2c1Cl Amb27194766 [0,0,0,0,1,0|2,1,0]=4 339 B14R2.3302 COc1ccc2cc(Cl)sc2c1I Amb27962157 [0,0,0,0,1,0|2,1,0]=4 340 B14R2.3302 COc1ccc2cc(Cl)sc2c1O Amb27265076 [0,0,0,0,1,0|1,1,0]=3 341 B14R2.3302 COc1ccc2cc(F)sc2c1C Amb28290692 [0,0,0,0,1,0|2,1,0]=4 342 B14R2.3302 COc1ccc2cc(F)sc2c1Cl Amb27846415 [0,0,0,0,1,0|2,1,0]=4 343 B14R2.3302 COc1ccc2cc(I)sc2c1Cl Amb27962336 [0,0,0,0,1,0|2,1,0]=4 344 B14R2.3302 COc1ccc2cc(I)sc2c1S Amb27463710 [0,0,0,0,1,0|1,2,0]=4 345 B14R2.3302 COc1ccc2cc(N)sc2c1Br Amb27225240 [0,0,0,0,1,0|2,1,0]=4 346 B14R2.3302 COc1ccc2cc(N)sc2c1Cl Amb27487739 [0,0,0,0,1,0|2,1,0]=4 347 B14R2.3302 COc1ccc2cc(N)sc2c1I Amb27787907 [0,0,0,0,1,0|2,1,0]=4 348 B14R2.3302 COc1ccc2cc(N)sc2c1O Amb27640352 [0,0,0,0,1,0|1,1,0]=3 349 B14R2.3302 COc1ccc2cc(O)sc2c1C Amb27252458 [0,0,0,0,1,0|1,1,1]=4 350 B14R2.3302 COc1ccc2cc(O)sc2c1I Amb27429322 [0,0,0,0,1,0|1,1,1]=4 351 B14R2.3302 COc1ccc2cc(S)sc2c1Br Amb28134826 [0,0,0,0,1,0|1,2,0]=4 352 B14R2.3302 COc1ccc2cc(S)sc2c1C Amb28132514 [0,0,0,0,1,0|1,2,0]=4 353 B14R2.3302 COc1ccc2cc(S)sc2c1Cl Amb27633017 [0,0,0,0,1,0|1,2,0]=4 354 B14R2.3302 COc1ccc2cc(S)sc2c1I Amb27797617 [0,0,0,0,1,0|1,2,0]=4 355 B14R2.3302 COc1ccc2sc(I)cc2c1O Amb27429328 [0,0,0,0,1,0|3,0,0]=4 356 B14R2.3302 COc1ccc2sc(O)cc2c1O Amb27769938 [0,0,0,0,1,0|2,0,1]=4 357 B14R2.3302 CSc1ccc2cc(F)sc2c1O Amb28055357 [0,0,0,0,1,0|1,2,0]=4 358 B14R2.3302 CSc1ccc2cc(O)sc2c1O Amb27799007 [0,0,0,0,1,0|0,2,1]=4 359 B13R1.40 C=CC(=O)Nc1cccc(Cl)c1O Amb27660427 [1,0,1,0,0,0|2,0,0]=4 360 B13R1.40 C=CC(=O)Nc1cccc(O)c1C Amb28364657 [1,0,1,0,0,0|2,0,0]=4 361 B13R1.81 C=CC(=O)Nc1cccc(CC)c1 Amb9280289 [1,0,1,0,0,0|2,0,0]=4 362 B13R1.81 C=CC(=O)Nc1cccc(OC)c1 Amb6843673 [1,0,1,0,0,0|1,0,0]=3 363 B13R1.81 CNC(=O)Oc1cccc(OC)c1 Amb28241328 [1,0,1,0,0,0|1,0,1]=4 364 B13R1.81 COc1cccc(OC(=O)CN)c1 Amb17335476 [1,0,1,0,0,0|1,0,1]=4 365 B13R1.569 COc1cccc(\C=C\C=O)c1O Amb24617889 [1,0,1,0,0,0|2,0,0]=4 366 B13R1.641 C=C(C)Cc1cccc(OC)c1O Amb25336502 [1,0,1,0,0,0|2,0,0]=4 367 B13R1.641 COc1cccc(CC(=O)O)c1O Amb24309996 [1,0,1,0,0,0|2,0,0]=4 368 B13R1.641 COc1cccc(CC(C)=O)c1O Amb6298472 [1,0,1,0,0,0|1,0,1]=4 369 B13R1.641 COc1cccc(OC(=O)Cl)c1C Amb33297356 [1,0,1,0,0,0|2,0,0]=4 370 B13R1.417 COC(\C=C\c1ccccc1)=C\Cl Amb27601252 [1,0,1,0,0,0|2,0,0]=4 371 B13R1.75 COc1ccc(CCC=O)c(O)c1 Amb33171652 [1,0,1,0,0,0|0,0,2]=4 372 B13R1.75 COc1ccc(\C=C\C=O)c(Br)c1 Amb27179674 [1,0,1,0,0,0|1,0,0]=3 373 B13R1.75 COc1ccc(\C=C\C=O)c(C)c1 Amb33270814 [1,0,1,0,0,0|1,0,0]=3 374 B13R1.75 COc1ccc(\C=C\C=O)c(Cl)c1 Amb27185878 [1,0,1,0,0,0|1,0,0]=3 375 B13R1.75 COc1ccc(\C=C\C=O)c(F)c1 Amb29863732 [1,0,1,0,0,0|1,0,0]=3 376 B13R1.75 COc1ccc(\C=C\C=O)c(O)c1 Amb32954651 [1,0,1,0,0,0|0,0,0]=2 377 B13R1.75 COc1ccc(\C=C\CN)c(O)c1 Amb33317270 [1,0,1,0,0,0|1,0,1]=4 378 B13R1.75 COc1ccc(\C=C\CO)c(O)c1 Amb33449198 [1,0,1,0,0,0|0,0,2]=4 379 B13R1.577 CO\C=C\c1ccc(OC)c(O)c1 Amb25094344 [1,0,1,0,0,0|2,0,0]=4 380 B13R1.577 COc1ccc(CCC=O)cc1O Amb17081692 [1,0,1,0,0,0|0,0,2]=4 381 B13R1.577 COc1ccc(CNC=O)cc1O Amb27415756 [1,0,1,0,0,0|1,0,1]=4 382 B13R1.577 COc1ccc(\C=C\C#N)cc1O Amb28078373 [1,0,1,0,0,0|1,0,1]=4 383 B13R1.577 COc1ccc(\C=C\C=O)cc1Br Amb33451792 [1,0,1,0,0,0|1,0,0]=3 384 B13R1.577 COc1ccc(\C=C\C=O)cc1C Amb28070513 [1,0,1,0,0,0|1,0,0]=3 385 B13R1.577 COc1ccc(\C=C\C=O)cc1Cl Amb17236493 [1,0,1,0,0,0|1,0,0]=3 386 B13R1.577 COc1ccc(\C=C\C=O)cc1F Amb28063342 [1,0,1,0,0,0|1,0,0]=3 387 B13R1.577 COc1ccc(\C=C\C=O)cc1O Amb17335207 [1,0,1,0,0,0|0,0,0]=2 388 B13R1.577 COc1ccc(\C=C\CN)cc1O Amb33362549 [1,0,1,0,0,0|1,0,1]=4 389 B13R1.577 COc1ccc(\C=C\CO)cc1Br Amb33240764 [1,0,1,0,0,0|1,0,1]=4 390 B13R1.577 COc1ccc(\C=C\CO)cc1C Amb25816903 [1,0,1,0,0,0|1,0,1]=4 391 B13R1.577 COc1ccc(\C=C\CO)cc1Cl Amb25816904 [1,0,1,0,0,0|1,0,1]=4 392 B13R1.577 COc1ccc(\C=C\CO)cc1F Amb25855868 [1,0,1,0,0,0|1,0,1]=4 393 B13R1.577 COc1ccc(\C=C\CO)cc1O Amb4090374 [1,0,1,0,0,0|0,0,1]=3 394 B13R1.577 COc1ncc(\C=C\C=O)cc1C Amb33141257 [1,0,1,0,0,0|2,0,0]=4 395 B13R1.1254 COc1ccc(CC=O)c(Br)c1O Amb33006915 [1,0,1,0,0,0|1,0,1]=4 396 B13R1.3518 Cc1ccc(\C=C\C=O)c(C)c1Br Amb33009235 [1,0,1,0,0,0|2,0,0]=4 397 B13R1.3518 NC\C=C\c1ccc(O)c(O)c1O Amb33198155 [1,0,1,0,0,0|1,0,1]=4 398 B13R1.3518 O=CCCc1ccc(O)c(O)c1O Amb33225979 [1,0,1,0,0,0|0,0,2]=4 399 B13R1.3518 O=C\C=C\c1ccc(O)c(O)c1O Amb33198156 [1,0,1,0,0,0|0,0,0]=2 400 B13R1.3518 OC\C=C\c1ccc(O)c(O)c1O Amb33474429 [1,0,1,0,0,0|0,0,2]=4 401 B13R1.97 COc1ccc(Br)c(OC(=O)Cl)c1 Amb33297140 [1,0,1,0,0,0|2,0,0]=4 402 B13R1.97 COc1ccc(Cl)c(OC(N)=O)c1 Amb27849038 [1,0,1,0,0,0|2,0,0]=4 403 B13R1.4021 C=CCc1c(Cl)ccc(OC)c1O Amb27589826 [1,0,1,0,0,0|2,0,0]=4 404 B13R1.3 C#Cc1ccc(\C=C\C(=O)O)cc1 Amb33224403 [1,0,1,0,0,0|1,0,1]=4 405 B13R1.3 C=Cc1ccc(\C=C\C(=O)O)cc1 Amb27232985 [1,0,1,0,0,0|1,0,1]=4 406 B13R1.3 CCc1ccc(\C=C\C(=O)Cl)cc1 Amb17143147 [1,0,1,0,0,0|2,0,0]=4 407 B13R1.3 CCc1ccc(\C=C\C(=O)O)cc1 Amb6384691 [1,0,1,0,0,0|1,0,0]=3 408 B13R1.3 CCc1ccc(\C=C\C(C)=O)cc1 Amb33359755 [1,0,1,0,0,0|2,0,0]=4 409 B13R1.3 CCc1ccc(\C=C\C(N)=O)cc1 Amb8998271 [1,0,1,0,0,0|2,0,0]=4 410 B13R1.3 COc1ccc(C#CC(=O)O)cc1 Amb3470709 [1,0,1,0,0,0|0,0,2]=4 411 B13R1.3 COc1ccc(CCC(=O)O)cc1 Amb6335224 [1,0,1,0,0,0|0,0,2]=4 412 B13R1.3 COc1ccc(NCC(=O)O)cc1 Amb1981429 [1,0,1,0,0,0|1,0,1]=4 413 B13R1.3 COc1ccc(OCC(=O)O)cc1 Amb6336451 [1,0,1,0,0,0|1,0,1]=4 414 B13R1.3 COc1ccc(SCC(=O)O)cc1 Amb1197559 [1,0,1,0,0,0|1,0,1]=4 415 B13R1.3 COc1ccc(\C=C/C(=O)O)cc1 Amb24669596 [1,0,1,0,0,0|0,0,0]=2 416 B13R1.3 COc1ccc(\C=C/C(N)=O)cn1 Amb27592393 [1,0,1,0,0,0|2,0,0]=4 417 B13R1.3 COc1ccc(\C=C\B(O)O)cc1 Amb33964172 [1,0,1,0,0,0|1,0,1]=4 418 B13R1.3 COc1ccc(\C=C\C(=N)N)cc1 Amb26602994 [1,0,1,0,0,0|2,0,0]=4 419 B13R1.3 COc1ccc(\C=C\C(=O)Cl)cc1 Amb8394927 [1,0,1,0,0,0|1,0,0]=3 420 B13R1.3 COc1ccc(\C=C\C(=O)O)cc1 Amb6335341 [1,0,1,0,0,0|0,0,0]=2 421 B13R1.3 COc1ccc(\C=C\C(=O)O)cn1 Amb33079455 [1,0,1,0,0,0|1,0,0]=3 422 B13R1.3 COc1ccc(\C=C\C(=O)O)nc1 Amb28556009 [1,0,1,0,0,0|1,0,0]=3 423 B13R1.3 COc1ccc(\C=C\C(C)=O)cc1 Amb1240513 [1,0,1,0,0,0|1,0,0]=3 424 B13R1.3 COc1ccc(\C=C\C(C)=O)cn1 Amb33448501 [1,0,1,0,0,0|2,0,0]=4 425 B13R1.3 COc1ccc(\C=C\C(C)=O)nc1 Amb33204065 [1,0,1,0,0,0|2,0,0]=4 426 B13R1.3 COc1ccc(\C=C\C(C)O)cc1 Amb25896128 [1,0,1,0,0,0|1,0,1]=4 427 B13R1.3 COc1ccc(\C=C\S(C)=O)cc1 Amb2612173 [1,0,1,0,0,0|2,0,0]=4 428 B13R1.3 COc1ccc(\C=C\[C@H](C)O)cc1 Amb28138411 [1,0,1,0,0,0|1,0,1]=4 429 B13R1.3 COc1ccc(\C=C\[N+](=O)[O-])cc1 Amb6323275 [1,0,1,0,0,0|1,0,1]=4 430 B13R1.3 COc1ccc(\C=N\C(N)=O)cc1 Amb27771859 [1,0,1,0,0,0|2,0,0]=4 431 B13R1.3 COc1ccc(\N=C\C(C)=O)cc1 Amb26463325 [1,0,1,0,0,0|2,0,0]=4 432 B13R1.3 COc1cnc(\C=C\C(=O)O)cn1 Amb35634613 [1,0,1,0,0,0|2,0,0]=4 433 B13R1.3 COc1ncc(\C=C\C(=O)O)cn1 Amb33276242 [1,0,1,0,0,0|2,0,0]=4 434 B13R1.3 CSc1ccc(\C=C\C(=O)Cl)cc1 Amb24567241 [1,0,1,0,0,0|1,1,0]=4 435 B13R1.3 CSc1ccc(\C=C\C(=O)O)cc1 Amb33869500 [1,0,1,0,0,0|0,1,0]=3 436 B13R1.3 CSc1ccc(\C=C\C(=O)O)cn1 Amb27657533 [1,0,1,0,0,0|1,1,0]=4 437 B13R1.3 CSc1ccc(\C=C\C(C)=O)cc1 Amb33079245 [1,0,1,0,0,0|1,1,0]=4 438 B13R1.3 CSc1ccc(\C=C\C(N)=O)cc1 Amb27413527 [1,0,1,0,0,0|1,1,0]=4 439 B13R1.3 N#Cc1ccc(\C=C\C(=O)O)cc1 Amb24078560 [1,0,1,0,0,0|2,0,0]=4 440 B13R1.3 N#[N+]c1ccc(\C=C\C(=O)O)cc1 Amb26856326 [1,0,1,0,0,0|2,0,0]=4 441 B13R1.3 NCc1ccc(\C=C\C(=O)O)cc1 Amb27166960 [1,0,1,0,0,0|2,0,0]=4 442 B13R1.3 O=C(O)\C=C\c1ccc(CBr)cc1 Amb26939689 [1,0,1,0,0,0|2,0,0]=4 443 B13R1.3 O=Cc1ccc(\C=C\C(=O)O)cc1 Amb8513778 [1,0,1,0,0,0|2,0,0]=4 444 B13R1.3 O=Nc1ccc(\C=C\C(=O)O)cc1 Amb27419965 [1,0,1,0,0,0|2,0,0]=4 445 B13R1.511 CC(=O)\C=C\c1ccc(C)c(Br)c1 Amb18071287 [1,0,1,0,0,0|2,0,0]=4 446 B13R1.511 CC(=O)\C=C\c1ccc(C)c(C)c1 Amb18065530 [1,0,1,0,0,0|2,0,0]=4 447 B13R1.511 CC(=O)\C=C\c1ccc(C)c(Cl)c1 Amb18066350 [1,0,1,0,0,0|2,0,0]=4 448 B13R1.511 CC(=O)\C=C\c1ccc(C)c(F)c1 Amb33359193 [1,0,1,0,0,0|2,0,0]=4 449 B13R1.511 CC(=O)\C=C\c1ccc(C)c(N)c1 Amb26346632 [1,0,1,0,0,0|2,0,0]=4 450 B13R1.511 CC(=O)\C=C\c1ccc(C)c(O)c1 Amb33310470 [1,0,1,0,0,0|1,0,0]=3 451 B13R1.511 CC(=O)\C=C\c1ccc(Cl)c(O)c1 Amb25807587 [1,0,1,0,0,0|2,0,0]=4 452 B13R1.511 CC(=O)\C=C\c1ccc(O)c(Br)c1 Amb33388933 [1,0,1,0,0,0|2,0,0]=4 453 B13R1.511 CC(=O)\C=C\c1ccc(O)c(C)c1 Amb28199828 [1,0,1,0,0,0|2,0,0]=4 454 B13R1.511 CC(=O)\C=C\c1ccc(O)c(Cl)c1 Amb33052105 [1,0,1,0,0,0|2,0,0]=4 455 B13R1.511 CC(=O)\C=C\c1ccc(O)c(F)c1 Amb32954205 [1,0,1,0,0,0|2,0,0]=4 456 B13R1.511 CC(=O)\C=C\c1ccc(O)c(O)c1 Amb33448627 [1,0,1,0,0,0|1,0,0]=3 457 B13R1.511 Cc1cc(\C=C/C(N)=O)ccc1O Amb28457265 [1,0,1,0,0,0|2,0,0]=4 458 B13R1.511 Cc1cc(\C=C\C(=O)O)ccc1Br Amb17204663 [1,0,1,0,0,0|2,0,0]=4 459 B13R1.511 Cc1cc(\C=C\C(=O)O)ccc1Cl Amb33052715 [1,0,1,0,0,0|2,0,0]=4 460 B13R1.511 Cc1cc(\C=C\C(=O)O)ccc1F Amb33956837 [1,0,1,0,0,0|2,0,0]=4 461 B13R1.511 Cc1cc(\C=C\C(=O)O)ccc1N Amb24558400 [1,0,1,0,0,0|2,0,0]=4 462 B13R1.511 Cc1cc(\C=C\C(=O)O)ccc1O Amb26314130 [1,0,1,0,0,0|1,0,0]=3 463 B13R1.511 Cc1ccc(CCC(=O)O)cc1O Amb22524477 [1,0,1,0,0,0|0,0,2]=4 464 B13R1.511 Cc1ccc(OCC(=O)O)cc1O Amb33427546 [1,0,1,0,0,0|1,0,1]=4 465 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1Br Amb17204661 [1,0,1,0,0,0|1,0,0]=3 466 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1C Amb6297820 [1,0,1,0,0,0|1,0,0]=3 467 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1Cl Amb33868854 [1,0,1,0,0,0|1,0,0]=3 468 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1F Amb24099983 [1,0,1,0,0,0|1,0,0]=3 469 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1I Amb27259235 [1,0,1,0,0,0|1,0,0]=3 470 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1N Amb25060132 [1,0,1,0,0,0|1,0,0]=3 471 B13R1.511 Cc1ccc(\C=C\C(=O)O)cc1O Amb33473926 [1,0,1,0,0,0|0,0,0]=2 472 B13R1.511 Cc1ccc(\C=C\C(=O)O)nc1C Amb33470101 [1,0,1,0,0,0|2,0,0]=4 473 B13R1.511 Cc1ccc(\C=C\C(N)=O)cc1C Amb28059796 [1,0,1,0,0,0|2,0,0]=4 474 B13R1.511 Cc1ccc(\C=C\C(N)=O)cc1F Amb27843469 [1,0,1,0,0,0|2,0,0]=4 475 B13R1.511 Cc1ccc(\C=C\[N+](=O)[O-])cc1O Amb33310492 [1,0,1,0,0,0|1,0,1]=4 476 B13R1.511 NC(=O)\C=C/c1ccc(O)c(Cl)c1 Amb28046814 [1,0,1,0,0,0|2,0,0]=4 477 B13R1.511 NC(=O)\C=C\c1ccc(O)c(Br)c1 Amb24572851 [1,0,1,0,0,0|2,0,0]=4 478 B13R1.511 NC(=O)\C=C\c1ccc(O)c(O)c1 Amb33756869 [1,0,1,0,0,0|1,0,0]=3 479 B13R1.511 Nc1cc(\C=C/C(=O)O)ccc1Cl Amb22757324 [1,0,1,0,0,0|2,0,0]=4 480 B13R1.511 Nc1cc(\C=C\C(=O)O)ccc1Br Amb23494344 [1,0,1,0,0,0|2,0,0]=4 481 B13R1.511 Nc1cc(\C=C\C(=O)O)ccc1Cl Amb23494478 [1,0,1,0,0,0|2,0,0]=4 482 B13R1.511 Nc1cc(\C=C\C(=O)O)ccc1F Amb25689010 [1,0,1,0,0,0|2,0,0]=4 483 B13R1.511 Nc1cc(\C=C\C(=O)O)ccc1I Amb24385961 [1,0,1,0,0,0|2,0,0]=4 484 B13R1.511 Nc1ccc(\C=C\C(=O)O)cc1Cl Amb22756270 [1,0,1,0,0,0|2,0,0]=4 485 B13R1.511 Nc1ccc(\C=C\C(=O)O)cc1N Amb32652664 [1,0,1,0,0,0|2,0,0]=4 486 B13R1.511 Nc1ccc(\C=C\C(=O)O)cc1N Amb32652666 [1,0,1,0,0,0|2,0,0]=4 487 B13R1.511 Nc1ccc(\C=C\C(=O)O)cc1N Amb32664195 [1,0,1,0,0,0|2,0,0]=4 488 B13R1.511 O=C(O)CCc1ccc(O)c(O)c1 Amb3940331 [1,0,1,0,0,0|0,0,2]=4 489 B13R1.511 O=C(O)CNc1ccc(O)c(O)c1 Amb26880837 [1,0,1,0,0,0|1,0,1]=4 490 B13R1.511 O=C(O)COc1ccc(O)c(O)c1 Amb33378716 [1,0,1,0,0,0|1,0,1]=4 491 B13R1.511 O=C(O)\C=C\c1ccc(Br)c(Cl)c1 Amb1547898 [1,0,1,0,0,0|2,0,0]=4 492 B13R1.511 O=C(O)\C=C\c1ccc(Br)c(F)c1 Amb20171336 [1,0,1,0,0,0|2,0,0]=4 493 B13R1.511 O=C(O)\C=C\c1ccc(Br)c(I)c1 Amb24057378 [1,0,1,0,0,0|2,0,0]=4 494 B13R1.511 O=C(O)\C=C\c1ccc(Cl)c(Br)c1 Amb33242474 [1,0,1,0,0,0|2,0,0]=4 495 B13R1.511 O=C(O)\C=C\c1ccc(Cl)c(Cl)c1 Amb1207499 [1,0,1,0,0,0|2,0,0]=4 496 B13R1.511 O=C(O)\C=C\c1ccc(Cl)c(F)c1 Amb6296200 [1,0,1,0,0,0|2,0,0]=4 497 B13R1.511 O=C(O)\C=C\c1ccc(Cl)c(I)c1 Amb26891025 [1,0,1,0,0,0|2,0,0]=4 498 B13R1.511 O=C(O)\C=C\c1ccc(F)c(Br)c1 Amb1127455 [1,0,1,0,0,0|2,0,0]=4 499 B13R1.511 O=C(O)\C=C\c1ccc(F)c(Cl)c1 Amb34910780 [1,0,1,0,0,0|2,0,0]=4 500 B13R1.511 O=C(O)\C=C\c1ccc(F)c(F)c1 Amb34045295 [1,0,1,0,0,0|2,0,0]=4 501 B13R1.511 O=C(O)\C=C\c1ccc(I)c(Br)c1 Amb26576751 [1,0,1,0,0,0|2,0,0]=4 502 B13R1.511 O=C(O)\C=C\c1ccc(O)c(Br)c1 Amb6296436 [1,0,1,0,0,0|1,0,0]=3 503 B13R1.511 O=C(O)\C=C\c1ccc(O)c(Cl)c1 Amb6297019 [1,0,1,0,0,0|1,0,0]=3 504 B13R1.511 O=C(O)\C=C\c1ccc(O)c(F)c1 Amb8855329 [1,0,1,0,0,0|1,0,0]=3 505 B13R1.511 O=C(O)\C=C\c1ccc(O)c(O)c1 Amb8513129 [1,0,1,0,0,0|0,0,0]=2 506 B13R1.511 O=[N+]([O-])\C=C\c1ccc(O)c(O)c1 Amb3788320 [1,0,1,0,0,0|1,0,1]=4 507 B13R1.2422 C=Cc1ccc(OC)c(I)c1OC Amb28072382 [1,0,1,0,0,0|1,0,1]=4 508 B13R1.2422 CCc1ccc(OC)c(O)c1C=O Amb27642669 [1,0,1,0,0,0|0,0,2]=4 509 B13R1.2422 COc1ccc(C=O)c(OC)c1O Amb3994711 [1,0,1,0,0,0|1,0,1]=4 510 B13R1.2422 COc1ccc(OC)c(C=O)c1O Amb2692129 [1,0,1,0,0,0|1,0,1]=4 511 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [2,0,0,0,0,0|2,0,0]=4 512 B13R2.32 Cc1ccc2ccccc2c1Br Amb3939041 [2,0,0,0,0,0|2,0,0]=4 513 B13R2.32 Cc1ccc2ccccc2c1C Amb6297194 [2,0,0,0,0,0|2,0,0]=4 514 B13R2.32 Cc1ccc2ccccc2c1I Amb27851450 [2,0,0,0,0,0|2,0,0]=4 515 B13R2.32 Cc1ccc2ccccc2c1N Amb2429201 [2,0,0,0,0,0|2,0,0]=4 516 B13R2.32 Cc1ccc2ccccc2c1N Amb6383344 [2,0,0,0,0,0|2,0,0]=4 517 B13R2.32 Cc1ccc2ccccc2c1O Amb3939072 [2,0,0,0,0,0|1,0,0]=3 518 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [2,0,0,0,0,0|1,1,0]=4 519 B13R2.32 Cc1ccc2cccnc2c1Br Amb22584155 [2,0,0,0,0,0|2,0,0]=4 520 B13R2.32 Cc1ccc2cccnc2c1C Amb19101295 [2,0,0,0,0,0|2,0,0]=4 521 B13R2.32 Cc1ccc2cccnc2c1C Amb34202228 [2,0,0,0,0,0|2,0,0]=4 522 B13R2.32 Cc1ccc2cccnc2c1Cl Amb1678477 [2,0,0,0,0,0|2,0,0]=4 523 B13R2.32 Cc1ccc2cccnc2c1F Amb23448791 [2,0,0,0,0,0|2,0,0]=4 524 B13R2.32 Cc1ccc2cccnc2c1N Amb2226936 [2,0,0,0,0,0|2,0,0]=4 525 B13R2.32 Cc1ccc2cccnc2c1O Amb9790954 [2,0,0,0,0,0|1,0,0]=3 526 B13R2.32 Cc1ccc2ncccc2c1O Amb22750813 [2,0,0,0,0,0|2,0,0]=4 527 B13R2.32 Cc1cnc2ccccc2c1O Amb18560317 [2,0,0,0,0,0|2,0,0]=4 528 B13R2.32 Cc1ncc2ccccc2c1O Amb18126185 [2,0,0,0,0,0|2,0,0]=4 529 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [2,0,0,0,0,0|2,0,0]=4 530 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [2,0,0,0,0,0|2,0,0]=4 531 B13R2.32 Nc1c(O)ccc2cccnc12 Amb23440835 [2,0,0,0,0,0|2,0,0]=4 532 B13R2.32 Nc1c(O)ccc2cccnc12 Amb35748746 [2,0,0,0,0,0|2,0,0]=4 533 B13R2.32 Nc1ccc2ccccc2c1O Amb17593980 [2,0,0,0,0,0|2,0,0]=4 534 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [2,0,0,0,0,0|2,0,0]=4 535 B13R2.32 Nc1ccc2cccnc2c1O Amb18645295 [2,0,0,0,0,0|2,0,0]=4 536 B13R2.32 Oc1c(Br)ccc2ccccc12 Amb8394123 [2,0,0,0,0,0|2,0,0]=4 537 B13R2.32 Oc1c(Br)ccc2cccnc12 Amb9807957 [2,0,0,0,0,0|2,0,0]=4 538 B13R2.32 Oc1c(Cl)ccc2ccccc12 Amb17594568 [2,0,0,0,0,0|2,0,0]=4 539 B13R2.32 Oc1c(Cl)ccc2cccnc12 Amb18648300 [2,0,0,0,0,0|2,0,0]=4 540 B13R2.32 Oc1c(Cl)ccc2cccnc12 Amb35747482 [2,0,0,0,0,0|2,0,0]=4 541 B13R2.32 Oc1c(F)ccc2ccccc12 Amb18645623 [2,0,0,0,0,0|2,0,0]=4 542 B13R2.32 Oc1c(F)ccc2cccnc12 Amb15693133 [2,0,0,0,0,0|2,0,0]=4 543 B13R2.32 Oc1c(I)ccc2ccccc12 Amb26478044 [2,0,0,0,0,0|2,0,0]=4 544 B13R2.32 Oc1c(I)ccc2cccnc12 Amb22752325 [2,0,0,0,0,0|2,0,0]=4 545 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [2,0,0,0,0,0|2,0,0]=4 546 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [2,0,0,0,0,0|2,0,0]=4 547 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [2,0,0,0,0,0|2,0,0]=4 548 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [2,0,0,0,0,0|2,0,0]=4 549 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [2,0,0,0,0,0|1,0,0]=3 550 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [2,0,0,0,0,0|1,1,0]=4 551 B13R2.32 Oc1ccc2cccnc2c1Br Amb21864974 [2,0,0,0,0,0|2,0,0]=4 552 B13R2.32 Oc1ccc2cccnc2c1Br Amb28719639 [2,0,0,0,0,0|2,0,0]=4 553 B13R2.32 Oc1ccc2cccnc2c1Cl Amb23437336 [2,0,0,0,0,0|2,0,0]=4 554 B13R2.32 Oc1ccc2cccnc2c1F Amb23437338 [2,0,0,0,0,0|2,0,0]=4 555 B13R2.32 Oc1ccc2cccnc2c1I Amb23437337 [2,0,0,0,0,0|2,0,0]=4 556 B13R2.32 Oc1ccc2ccncc2c1O Amb27460768 [2,0,0,0,0,0|2,0,0]=4 557 B13R2.32 Oc1ccc2ncccc2c1O Amb27442475 [2,0,0,0,0,0|2,0,0]=4 558 B13R2.32 Oc1ccc2ncccc2c1O Amb33802648 [2,0,0,0,0,0|2,0,0]=4 559 B13R2.32 Oc1cnc2ccccc2c1O Amb5718045 [2,0,0,0,0,0|2,0,0]=4 560 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [2,0,0,0,0,0|2,0,0]=4 561 B13R2.32 [NH3+]c1ccc2cccnc2c1O Amb32510249 [2,0,0,0,0,0|2,0,0]=4 562 B13R2.57 CCc1ccc2ccccc2c1 Amb6298320 [2,0,0,0,0,0|2,0,0]=4 563 B13R2.57 CCc1ccc2cccnc2c1 Amb24436476 [2,0,0,0,0,0|2,0,0]=4 564 B13R2.57 CNc1ccc2ccccc2c1 Amb415893 [2,0,0,0,0,0|2,0,0]=4 565 B13R2.57 CNc1ccc2cccnc2c1 Amb5717611 [2,0,0,0,0,0|2,0,0]=4 566 B13R2.57 COc1cc2ccccc2cn1 Amb25861237 [2,0,0,0,0,0|2,0,0]=4 567 B13R2.57 COc1cc2ncccc2cn1 Amb27847145 [2,0,0,0,0,0|2,0,0]=4 568 B13R2.57 COc1ccc2c(c1)CCC=C2 Amb26651800 [2,0,0,0,0,0|1,0,1]=4 569 B13R2.57 COc1ccc2c(c1)NCC=C2 Amb18559644 [2,0,0,0,0,0|1,0,1]=4 570 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [2,0,0,0,0,0|1,0,0]=3 571 B13R2.57 COc1ccc2ccccc2n1 Amb20171196 [2,0,0,0,0,0|2,0,0]=4 572 B13R2.57 COc1ccc2cccnc2c1 Amb17617089 [2,0,0,0,0,0|1,0,0]=3 573 B13R2.57 COc1ccc2cccnc2c1 Amb24183299 [2,0,0,0,0,0|1,0,0]=3 574 B13R2.57 COc1ccc2cccnc2n1 Amb27624881 [2,0,0,0,0,0|2,0,0]=4 575 B13R2.57 COc1ccc2ccncc2c1 Amb10610318 [2,0,0,0,0,0|2,0,0]=4 576 B13R2.57 COc1ccc2ccncc2c1 Amb5638098 [2,0,0,0,0,0|2,0,0]=4 577 B13R2.57 COc1ccc2cnccc2c1 Amb10071944 [2,0,0,0,0,0|2,0,0]=4 578 B13R2.57 COc1ccc2cnccc2c1 Amb22236031 [2,0,0,0,0,0|2,0,0]=4 579 B13R2.57 COc1ccc2cncnc2c1 Amb22745180 [2,0,0,0,0,0|2,0,0]=4 580 B13R2.57 COc1ccc2ncccc2c1 Amb1156981 [2,0,0,0,0,0|2,0,0]=4 581 B13R2.57 COc1ccc2nccnc2c1 Amb10068725 [2,0,0,0,0,0|2,0,0]=4 582 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [2,0,0,0,0,0|2,0,0]=4 583 B13R2.57 COc1cnc2cccnc2c1 Amb21959422 [2,0,0,0,0,0|2,0,0]=4 584 B13R2.57 CSc1ccc2ccccc2c1 Amb2609071 [2,0,0,0,0,0|1,1,0]=4 585 B13R2.155 CC1=CC2=CC(=O)NC=C2C=C1 Amb22371048 [2,0,0,0,0,0|2,0,0]=4 586 B13R2.155 CC1C=Cc2ccc(O)cc2O1 Amb6840059 [2,0,0,0,0,0|1,0,1]=4 587 B13R2.155 Cc1cc2c(cn1)C=CC(=O)N2 Amb27790702 [2,0,0,0,0,0|2,0,0]=4 588 B13R2.155 Cc1ccc2c(c1)NC(=O)C=C2 Amb21857833 [2,0,0,0,0,0|1,0,0]=3 589 B13R2.155 Cc1ccc2c(c1)NC(=O)N=C2 Amb24468183 [2,0,0,0,0,0|2,0,0]=4 590 B13R2.155 Cc1ccc2c(c1)OC(=O)C=C2 Amb18511476 [2,0,0,0,0,0|0,0,0]=2 591 B13R2.155 Cc1ccc2c(c1)OC(=O)CC2 Amb27975901 [2,0,0,0,0,0|0,0,2]=4 592 B13R2.155 Cc1ccc2c(c1)OC(=O)NC2 Amb27967408 [2,0,0,0,0,0|1,0,1]=4 593 B13R2.155 Cc1ccc2c(c1)OC(=O)OC2 Amb27861046 [2,0,0,0,0,0|1,0,1]=4 594 B13R2.155 Cc1ccc2ccc(Br)cc2c1 Amb21864772 [2,0,0,0,0,0|2,0,0]=4 595 B13R2.155 Cc1ccc2ccc(C)cc2c1 Amb2687557 [2,0,0,0,0,0|2,0,0]=4 596 B13R2.155 Cc1ccc2ccc(C)nc2c1 Amb22002033 [2,0,0,0,0,0|2,0,0]=4 597 B13R2.155 Cc1ccc2ccc(Cl)cc2c1 Amb24626109 [2,0,0,0,0,0|2,0,0]=4 598 B13R2.155 Cc1ccc2ccc(Cl)nc2c1 Amb22007944 [2,0,0,0,0,0|2,0,0]=4 599 B13R2.155 Cc1ccc2ccc(F)cc2c1 Amb24429006 [2,0,0,0,0,0|2,0,0]=4 600 B13R2.155 Cc1ccc2ccc(N)cc2c1 Amb24707712 [2,0,0,0,0,0|2,0,0]=4 601 B13R2.155 Cc1ccc2ccc(N)nc2c1 Amb25982717 [2,0,0,0,0,0|2,0,0]=4 602 B13R2.155 Cc1ccc2ccc(O)cc2c1 Amb18645051 [2,0,0,0,0,0|1,0,1]=4 603 B13R2.155 Cc1ccc2ccc(O)cc2n1 Amb18353419 [2,0,0,0,0,0|2,0,0]=4 604 B13R2.155 Cc1ccc2ccc(S)nc2c1 Amb23536151 [2,0,0,0,0,0|1,1,0]=4 605 B13R2.155 Cc1cnc2c(c1)NC(=O)C=C2 Amb24556512 [2,0,0,0,0,0|2,0,0]=4 606 B13R2.155 Nc1ccc2c(c1)NC(=O)C=C2 Amb18545106 [2,0,0,0,0,0|2,0,0]=4 607 B13R2.155 Nc1ccc2c(c1)OC(=O)C=C2 Amb19130409 [2,0,0,0,0,0|1,0,0]=3 608 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb21955697 [2,0,0,0,0,0|2,0,0]=4 609 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb9173657 [2,0,0,0,0,0|2,0,0]=4 610 B13R2.155 Nc1ccc2ccc(O)cc2n1 Amb27471897 [2,0,0,0,0,0|2,0,0]=4 611 B13R2.155 O=C1C=Cc2ccc(Br)cc2N1 Amb20248087 [2,0,0,0,0,0|2,0,0]=4 612 B13R2.155 O=C1C=Cc2ccc(Br)cc2O1 Amb26841310 [2,0,0,0,0,0|1,0,0]=3 613 B13R2.155 O=C1C=Cc2ccc(Cl)cc2N1 Amb19894727 [2,0,0,0,0,0|2,0,0]=4 614 B13R2.155 O=C1C=Cc2ccc(F)cc2N1 Amb23412015 [2,0,0,0,0,0|2,0,0]=4 615 B13R2.155 O=C1C=Cc2ccc(F)cc2O1 Amb24736406 [2,0,0,0,0,0|1,0,0]=3 616 B13R2.155 O=C1C=Cc2ccc(I)cc2O1 Amb26420862 [2,0,0,0,0,0|1,0,0]=3 617 B13R2.155 O=C1C=Cc2ccc(O)cc2N1 Amb18645438 [2,0,0,0,0,0|1,0,0]=3 618 B13R2.155 O=C1C=Cc2ccc(O)cc2O1 Amb18511480 [2,0,0,0,0,0|0,0,0]=2 619 B13R2.155 O=C1C=Cc2ccc(O)nc2O1 Amb18645755 [2,0,0,0,0,0|1,0,0]=3 620 B13R2.155 O=C1C=Cc2ccc(S)cc2O1 Amb27963071 [2,0,0,0,0,0|0,1,0]=3 621 B13R2.155 O=C1CCc2ccc(O)cc2O1 Amb5717908 [2,0,0,0,0,0|0,0,2]=4 622 B13R2.155 O=C1CNc2ccc(O)cc2O1 Amb28060911 [2,0,0,0,0,0|1,0,1]=4 623 B13R2.155 O=C1COc2ccc(O)cc2O1 Amb27229107 [2,0,0,0,0,0|1,0,1]=4 624 B13R2.155 O=C1NCc2ccc(O)cc2O1 Amb26575833 [2,0,0,0,0,0|1,0,1]=4 625 B13R2.155 O=c1ccc2ccc(Cl)cc2o1 Amb5717858 [2,0,0,0,0,0|1,0,0]=3 626 B13R2.155 Oc1ccc2ccc(Br)cc2c1 Amb17596083 [2,0,0,0,0,0|2,0,0]=4 627 B13R2.155 Oc1ccc2ccc(Cl)cc2c1 Amb17594576 [2,0,0,0,0,0|2,0,0]=4 628 B13R2.155 Oc1ccc2ccc(Cl)nc2c1 Amb613542 [2,0,0,0,0,0|2,0,0]=4 629 B13R2.155 Oc1ccc2ccc(F)cc2c1 Amb24589653 [2,0,0,0,0,0|2,0,0]=4 630 B13R2.155 Oc1ccc2ccc(F)nc2c1 Amb24485536 [2,0,0,0,0,0|2,0,0]=4 631 B13R2.155 Oc1ccc2ccc(I)cc2c1 Amb24429632 [2,0,0,0,0,0|2,0,0]=4 632 B13R2.155 Oc1ccc2ccc(I)nc2c1 Amb27667715 [2,0,0,0,0,0|2,0,0]=4 633 B13R2.155 Oc1ccc2ccc(O)cc2c1 Amb6357388 [2,0,0,0,0,0|1,0,1]=4 634 B13R2.155 Oc1ccc2ccc(O)nc2c1 Amb10602568 [2,0,0,0,0,0|1,0,1]=4 635 B13R2.155 [CH2+]c1ccc2ccc(O)cc2n1 Amb28129015 [2,0,0,0,0,0|2,0,0]=4 636 B13R2.162 Cc1ccc2cccc(O)c2c1 Amb17689149 [2,0,0,0,0,0|2,0,0]=4 637 B13R2.162 Cc1ccc2cccc(O)c2n1 Amb1210122 [2,0,0,0,0,0|2,0,0]=4 638 B13R2.162 Cc1ccc2cccc(O)c2n1 Amb24081196 [2,0,0,0,0,0|2,0,0]=4 639 B13R2.162 Cc1cccc2c1NC(=O)C=C2 Amb18546019 [2,0,0,0,0,0|2,0,0]=4 640 B13R2.162 Cc1cccc2c1OC(=O)C=C2 Amb28429789 [2,0,0,0,0,0|1,0,0]=3 641 B13R2.162 Nc1ccc2cccc(O)c2c1 Amb17593982 [2,0,0,0,0,0|2,0,0]=4 642 B13R2.162 Nc1ccc2cccc(O)c2n1 Amb2720259 [2,0,0,0,0,0|2,0,0]=4 643 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb18645297 [2,0,0,0,0,0|2,0,0]=4 644 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb22548256 [2,0,0,0,0,0|2,0,0]=4 645 B13R2.162 Nc1cccc2c1OC(=O)C=C2 Amb18547323 [2,0,0,0,0,0|1,0,0]=3 646 B13R2.162 O=C1C=CC2=CC=CC(=O)C2=C1 Amb27256369 [2,0,0,0,0,0|1,0,1]=4 647 B13R2.162 O=C1C=Cc2cccc(Br)c2N1 Amb17933211 [2,0,0,0,0,0|2,0,0]=4 648 B13R2.162 O=C1C=Cc2cccc(Br)c2O1 Amb19957580 [2,0,0,0,0,0|1,0,0]=3 649 B13R2.162 O=C1C=Cc2cccc(Cl)c2O1 Amb28073885 [2,0,0,0,0,0|1,0,0]=3 650 B13R2.162 O=C1C=Cc2cccc(F)c2N1 Amb18546026 [2,0,0,0,0,0|2,0,0]=4 651 B13R2.162 O=C1C=Cc2cccc(F)c2O1 Amb27272596 [2,0,0,0,0,0|1,0,0]=3 652 B13R2.162 O=C1C=Cc2cccc(I)c2N1 Amb24579898 [2,0,0,0,0,0|2,0,0]=4 653 B13R2.162 O=C1C=Cc2cccc(I)c2O1 Amb25206611 [2,0,0,0,0,0|1,0,0]=3 654 B13R2.162 O=C1C=Cc2cccc(O)c2N1 Amb18038432 [2,0,0,0,0,0|1,0,0]=3 655 B13R2.162 O=C1C=Cc2cccc(O)c2O1 Amb18645571 [2,0,0,0,0,0|0,0,0]=2 656 B13R2.162 O=C1NCc2cccc(O)c2O1 Amb25287566 [2,0,0,0,0,0|1,0,1]=4 657 B13R2.162 O=C1OCc2cccc(O)c2O1 Amb27964323 [2,0,0,0,0,0|1,0,1]=4 658 B13R2.162 O=c1ccc2cccc(Br)c2o1 Amb22230172 [2,0,0,0,0,0|1,0,0]=3 659 B13R2.162 Oc1ccc2cccc(O)c2c1 Amb8516929 [2,0,0,0,0,0|1,0,1]=4 660 B13R2.162 Oc1ccc2cccc(O)c2n1 Amb4324700 [2,0,0,0,0,0|1,0,1]=4 661 B13R2.162 Oc1cccc2ccc(Br)cc12 Amb17596078 [2,0,0,0,0,0|2,0,0]=4 662 B13R2.162 Oc1cccc2ccc(Br)nc12 Amb22501093 [2,0,0,0,0,0|2,0,0]=4 663 B13R2.162 Oc1cccc2ccc(Cl)cc12 Amb17594572 [2,0,0,0,0,0|2,0,0]=4 664 B13R2.162 Oc1cccc2ccc(Cl)nc12 Amb6369471 [2,0,0,0,0,0|2,0,0]=4 665 B13R2.162 Oc1cccc2ccc(F)cc12 Amb18559372 [2,0,0,0,0,0|2,0,0]=4 666 B13R2.162 Oc1cccc2ccc(F)nc12 Amb25793521 [2,0,0,0,0,0|2,0,0]=4 667 B13R2.162 Oc1cccc2ccc(S)nc12 Amb17322674 [2,0,0,0,0,0|1,1,0]=4 668 B15R1.69 C=C(Cl)C(=O)Nc1cccc(OC)c1F Amb29884296 [0,1,1,0,0,0|2,0,0]=4 669 B15R1.69 COc1cccc(CC(=O)C(=O)O)c1O Amb33428496 [0,1,1,0,0,0|2,0,0]=4 670 B15R1.1270 C\C=C\C(=O)Nc1cccc(OC)c1F Amb30017908 [0,1,1,0,0,0|2,0,0]=4 671 B15R1.1876 COc1ccc(\C=C\C(=O)O)c(Br)c1O Amb33240206 [0,1,1,0,0,0|1,0,0]=3 672 B15R1.1876 COc1ccc(\C=C\C(=O)O)c(C)c1C Amb18895492 [0,1,1,0,0,0|2,0,0]=4 673 B15R1.1876 COc1ccc(\C=C\C(=O)O)c(Cl)c1Cl Amb31095757 [0,1,1,0,0,0|2,0,0]=4 674 B15R1.1876 COc1ccc(\C=C\C(=O)O)c(F)c1F Amb22737966 [0,1,1,0,0,0|2,0,0]=4 675 B15R1.1876 COc1ccc(\C=C\C(C)=O)c(Br)c1O Amb33006959 [0,1,1,0,0,0|1,0,0]=3 676 B15R1.1876 COc1ccc(\C=C\[N+](=O)[O-])c(Br)c1O Amb33006857 [0,1,1,0,0,0|2,0,0]=4 677 B15R1.23243 COc1ccc(\C=C\C=O)c(Br)c1OC Amb33337088 [0,1,1,0,0,0|1,0,0]=3 678 B15R1.23243 COc1ccc(\C=C\C=O)c(Cl)c1OC Amb33220548 [0,1,1,0,0,0|1,0,0]=3 679 B15R1.1818 COc1cc(Br)c(CCC(=O)O)cc1O Amb33009408 [0,1,1,0,0,0|0,0,2]=4 680 B15R1.1818 COc1cc(Br)c(OCC(=O)O)cc1O Amb33005567 [0,1,1,0,0,0|1,0,1]=4 681 B15R1.1818 COc1cc(Br)c(\C=C\C(=O)O)cc1O Amb33004965 [0,1,1,0,0,0|0,0,0]=2 682 B15R1.1818 COc1cc(Br)c(\C=C\C(C)=O)cc1O Amb33005298 [0,1,1,0,0,0|1,0,0]=3 683 B15R1.1818 COc1cc(Br)c(\C=C\[N+](=O)[O-])cc1O Amb33006398 [0,1,1,0,0,0|1,0,1]=4 684 B15R1.1818 COc1cc(C)c(\C=C\C(=O)O)cc1C Amb4007564 [0,1,1,0,0,0|1,0,0]=3 685 B15R1.1818 COc1cc(C)c(\C=C\C(=O)O)cc1Cl Amb18245536 [0,1,1,0,0,0|1,0,0]=3 686 B15R1.1818 COc1cc(Cl)c(\C=C\C(=O)O)cc1Cl Amb18246528 [0,1,1,0,0,0|1,0,0]=3 687 B15R1.1818 COc1cc(F)c(\C=C\C(=O)O)cc1F Amb31095758 [0,1,1,0,0,0|1,0,0]=3 688 B15R1.3776 COc1ccc(C(C)CC(=O)O)cc1O Amb33362557 [0,1,1,0,0,0|0,0,2]=4 689 B15R1.3776 COc1ccc(C(N)CC(=O)O)cc1O Amb2697440 [0,1,1,0,0,0|0,0,2]=4 690 B15R1.3776 COc1ccc(C(O)CC(=O)O)cc1O Amb19022361 [0,1,1,0,0,0|0,0,2]=4 691 B15R1.3776 COc1ccc([C@@H](O)CC(=O)O)cc1O Amb33362587 [0,1,1,0,0,0|0,0,2]=4 692 B15R1.3776 COc1ccc([C@H](O)CC(=O)O)cc1O Amb33362586 [0,1,1,0,0,0|0,0,2]=4 693 B15R1.3776 COc1ccc(\C(C)=C\C(=O)O)cc1Br Amb17197452 [0,1,1,0,0,0|1,0,0]=3 694 B15R1.3776 COc1ccc(\C(C)=C\C(=O)O)cc1C Amb5738395 [0,1,1,0,0,0|1,0,0]=3 695 B15R1.3776 COc1ccc(\C(C)=C\C(=O)O)cc1Cl Amb17195621 [0,1,1,0,0,0|1,0,0]=3 696 B15R1.3776 COc1ccc(\C(C)=C\C(=O)O)cc1F Amb17195097 [0,1,1,0,0,0|1,0,0]=3 697 B15R1.3776 COc1ccc(\C(Cl)=C\C(=O)O)cc1F Amb27947149 [0,1,1,0,0,0|1,0,0]=3 698 B15R1.3777 COc1ccc(CC(=O)C(=O)O)cc1Br Amb33242456 [0,1,1,0,0,0|1,0,1]=4 699 B15R1.3777 COc1ccc(CC(=O)C(=O)O)cc1C Amb33172346 [0,1,1,0,0,0|1,0,1]=4 700 B15R1.3777 COc1ccc(CC(=O)C(=O)O)cc1Cl Amb33052753 [0,1,1,0,0,0|1,0,1]=4 701 B15R1.3777 COc1ccc(CC(=O)C(=O)O)cc1F Amb32954260 [0,1,1,0,0,0|1,0,1]=4 702 B15R1.3777 COc1ccc(CC(=O)C(=O)O)cc1O Amb1132461 [0,1,1,0,0,0|0,0,1]=3 703 B15R1.3777 COc1ccc(CC(C)C(=O)O)cc1O Amb33362551 [0,1,1,0,0,0|0,0,2]=4 704 B15R1.3777 COc1ccc(CC(N)C(=O)O)cc1O Amb6258269 [0,1,1,0,0,0|0,0,2]=4 705 B15R1.3777 COc1ccc(CC(O)C(=O)O)cc1O Amb33353026 [0,1,1,0,0,0|0,0,2]=4 706 B15R1.3777 COc1ccc(C[C@@H](N)C(=O)O)cc1O Amb30666611 [0,1,1,0,0,0|0,0,2]=4 707 B15R1.3777 COc1ccc(NC(=O)C(=O)O)cc1Br Amb18906726 [0,1,1,0,0,0|2,0,0]=4 708 B15R1.3777 COc1ccc(NC(=O)C(=O)O)cc1Cl Amb9303832 [0,1,1,0,0,0|2,0,0]=4 709 B15R1.3777 COc1ccc(\C=C(/C)C(=O)O)cc1Cl Amb31182425 [0,1,1,0,0,0|1,0,0]=3 710 B15R1.3777 COc1ccc(\C=C(/C)C(=O)O)cc1F Amb34202062 [0,1,1,0,0,0|1,0,0]=3 711 B15R1.3777 COc1ccc(\C=C(\C)C(=O)O)cc1C Amb28204198 [0,1,1,0,0,0|1,0,0]=3 712 B15R1.3777 COc1ccc(\C=C(\C)C(=O)O)cc1F Amb27241819 [0,1,1,0,0,0|1,0,0]=3 713 B15R1.3777 COc1ccc(\C=C(\C)C(C)=O)cc1C Amb28192538 [0,1,1,0,0,0|2,0,0]=4 714 B15R1.3777 COc1ccc(\C=C(\C)C(C)=O)cc1F Amb27246035 [0,1,1,0,0,0|2,0,0]=4 715 B15R1.3777 COc1ccc(\C=C(\C)C(C)=O)cc1O Amb27649334 [0,1,1,0,0,0|1,0,0]=3 716 B15R1.3777 COc1ccc(\C=C(\F)C(=O)O)cc1O Amb28401260 [0,1,1,0,0,0|0,0,0]=2 717 B15R1.3779 C=CC(=O)\C=C\c1ccc(OC)c(Cl)c1 Amb33503236 [0,1,1,0,0,0|2,0,0]=4 718 B15R1.3779 CNC(=O)\C=C\c1ccc(OC)c(N)c1 Amb17140068 [0,1,1,0,0,0|2,0,0]=4 719 B15R1.3779 COC(=O)CCc1ccc(OC)c(O)c1 Amb17778367 [0,1,1,0,0,0|0,0,2]=4 720 B15R1.3779 COC(=O)\C=C\c1ccc(OC)c(Br)c1 Amb23504492 [0,1,1,0,0,0|1,0,0]=3 721 B15R1.3779 COC(=O)\C=C\c1ccc(OC)c(F)c1 Amb33358059 [0,1,1,0,0,0|1,0,0]=3 722 B15R1.3779 COC(=O)\C=C\c1ccc(OC)c(O)c1 Amb17617487 [0,1,1,0,0,0|0,0,0]=2 723 B15R1.5380 CN(C)c1ccc(\C=C\C(=O)O)cc1F Amb7799984 [0,1,1,0,0,0|2,0,0]=4 724 B15R1.5380 O=C(O)\C=C\c1ccc([N+](=O)[O-])c(O)c1 Amb33480794 [0,1,1,0,0,0|2,0,0]=4 725 B15R1.9550 CCOc1ccc(\C=C/C(=O)O)cc1N Amb17462242 [0,1,1,0,0,0|1,0,0]=3 726 B15R1.9550 CCOc1ccc(\C=C/C(N)=O)cc1N Amb17464007 [0,1,1,0,0,0|2,0,0]=4 727 B15R1.9550 CCOc1ccc(\C=C\C(=O)O)cc1C Amb33038283 [0,1,1,0,0,0|1,0,0]=3 728 B15R1.9550 CCOc1ccc(\C=C\C(=O)O)cc1Cl Amb23583582 [0,1,1,0,0,0|1,0,0]=3 729 B15R1.9550 CCOc1ccc(\C=C\C(=O)O)cc1F Amb18896173 [0,1,1,0,0,0|1,0,0]=3 730 B15R1.9550 CCOc1ccc(\C=C\C(C)=O)cc1Br Amb34002096 [0,1,1,0,0,0|2,0,0]=4 731 B15R1.9550 CCOc1ccc(\C=C\C(N)=O)cc1Cl Amb23583583 [0,1,1,0,0,0|2,0,0]=4 732 B15R1.12854 CCc1cc(\C=C\C(=O)O)ccc1OC Amb18895488 [0,1,1,0,0,0|1,0,0]=3 733 B15R1.12854 COc1ccc(C#CC(=O)O)cc1OC Amb3988045 [0,1,1,0,0,0|0,0,2]=4 734 B15R1.12854 COc1ccc(CCC(=O)O)cc1OC Amb6346387 [0,1,1,0,0,0|0,0,2]=4 735 B15R1.12854 COc1ccc(SCC(=O)O)cc1OC Amb3428576 [0,1,1,0,0,0|1,0,1]=4 736 B15R1.12854 COc1ccc(\C=C/[N+](=O)[O-])cc1OC Amb2550323 [0,1,1,0,0,0|1,0,1]=4 737 B15R1.12854 COc1ccc(\C=C\C(=O)Cl)cc1OC Amb6307289 [0,1,1,0,0,0|1,0,0]=3 738 B15R1.12854 COc1ccc(\C=C\C(=O)O)cc1OC Amb1206805 [0,1,1,0,0,0|0,0,0]=2 739 B15R1.12854 COc1ccc(\C=C\C(=O)O)cc1OC Amb33716966 [0,1,1,0,0,0|0,0,0]=2 740 B15R1.12854 COc1ccc(\C=C\C(C)=O)cc1OC Amb3989876 [0,1,1,0,0,0|1,0,0]=3 741 B15R1.12854 COc1ccc(\C=C\C(N)=O)cc1OC Amb3447271 [0,1,1,0,0,0|1,0,0]=3 742 B15R1.12854 COc1ccc(\C=C\C(N)=S)cc1OC Amb18108294 [0,1,1,0,0,0|1,1,0]=4 743 B15R1.12854 COc1ccc(\C=C\[N+](=O)[O-])cc1OC Amb1011539 [0,1,1,0,0,0|1,0,1]=4 744 B15R1.21573 COc1c(C)cc(\C=C\C(=O)O)cc1C Amb7799318 [0,1,1,0,0,0|1,0,0]=3 745 B15R1.21573 COc1c(C)cc(\C=C\C(C)=O)cc1C Amb32733049 [0,1,1,0,0,0|2,0,0]=4 746 B15R1.21573 COc1c(Cl)cc(\C=C\C(=O)Cl)cc1Cl Amb23513386 [0,1,1,0,0,0|2,0,0]=4 747 B15R1.21573 COc1c(Cl)cc(\C=C\C(=O)O)cc1Cl Amb23584061 [0,1,1,0,0,0|1,0,0]=3 748 B15R1.21573 COc1c(Cl)cc(\C=C\C(N)=O)cc1Cl Amb23514047 [0,1,1,0,0,0|2,0,0]=4 749 B15R1.21573 COc1c(F)cc(\C=C\C(=O)O)cc1Cl Amb22738363 [0,1,1,0,0,0|1,0,0]=3 750 B15R1.21573 COc1c(F)cc(\C=C\C(=O)O)cc1F Amb22738025 [0,1,1,0,0,0|1,0,0]=3 751 B15R1.21573 COc1c(O)cc(CCC(=O)O)cc1O Amb32419639 [0,1,1,0,0,0|0,0,2]=4 752 B15R2.274 CCc1c(C)cc2ccccc2c1O Amb28365146 [1,1,0,0,0,0|2,0,0]=4 753 B15R2.274 COC1=C(O)c2ccccc2OC1=O Amb22753606 [1,1,0,0,0,0|2,0,0]=4 754 B15R2.274 COc1c(Br)cc2ccccc2c1C Amb23448508 [1,1,0,0,0,0|2,0,0]=4 755 B15R2.627 CC(=O)c1ccc2ccccc2c1O Amb1804666 [1,1,0,0,0,0|2,0,0]=4 756 B15R2.627 CC(C)c1ccc2cccnc2c1O Amb28061463 [1,1,0,0,0,0|2,0,0]=4 757 B15R2.627 CC(O)c1ccc2ccccc2c1O Amb1110590 [1,1,0,0,0,0|2,0,0]=4 758 B15R2.627 CC(S)c1ccc2ccccc2c1O Amb7784709 [1,1,0,0,0,0|2,0,0]=4 759 B15R2.2115 C#Cc1c(OC)ccc2ccccc12 Amb33542588 [1,1,0,0,0,0|2,0,0]=4 760 B15R2.2115 C#Cc1c(OC)ccc2cccnc12 Amb35652904 [1,1,0,0,0,0|2,0,0]=4 761 B15R2.2115 C=Cc1c(OC)ccc2ccccc12 Amb25358297 [1,1,0,0,0,0|2,0,0]=4 762 B15R2.2115 CCc1ccc2ccccc2c1CO Amb27603246 [1,1,0,0,0,0|2,0,0]=4 763 B15R2.2115 COc1ccc2ccccc2c1C#N Amb6357422 [1,1,0,0,0,0|2,0,0]=4 764 B15R2.2115 COc1ccc2ccccc2c1C=O Amb2589525 [1,1,0,0,0,0|1,0,1]=4 765 B15R2.2115 COc1ccc2ccccc2c1CBr Amb8963681 [1,1,0,0,0,0|2,0,0]=4 766 B15R2.2115 COc1ccc2ccccc2c1CCl Amb8438893 [1,1,0,0,0,0|2,0,0]=4 767 B15R2.2115 COc1ccc2ccccc2c1CN Amb1971450 [1,1,0,0,0,0|2,0,0]=4 768 B15R2.2115 COc1ccc2ccccc2c1CN Amb29083246 [1,1,0,0,0,0|2,0,0]=4 769 B15R2.2115 COc1ccc2ccccc2c1CO Amb3545686 [1,1,0,0,0,0|1,0,0]=3 770 B15R2.2115 COc1ccc2ccccc2c1CS Amb25354035 [1,1,0,0,0,0|1,1,0]=4 771 B15R2.2115 COc1ccc2ccccc2c1NN Amb32732684 [1,1,0,0,0,0|2,0,0]=4 772 B15R2.2115 COc1ccc2ccccc2c1[Mg]Br Amb6300446 [1,1,0,0,0,0|2,0,0]=4 773 B15R2.2115 COc1ccc2cccnc2c1C=O Amb24570399 [1,1,0,0,0,0|1,0,1]=4 774 B15R2.2115 COc1ccc2cccnc2c1CN Amb32669734 [1,1,0,0,0,0|2,0,0]=4 775 B15R2.2115 COc1ccc2cccnc2c1CO Amb32669733 [1,1,0,0,0,0|1,0,0]=3 776 B15R2.2115 COc1ccc2ccncc2c1CO Amb19104919 [1,1,0,0,0,0|2,0,0]=4 777 B15R2.2115 COc1ccc2cnccc2c1CO Amb19104920 [1,1,0,0,0,0|2,0,0]=4 778 B15R2.2115 COc1ccc2ncccc2c1CO Amb18353543 [1,1,0,0,0,0|2,0,0]=4 779 B15R2.2115 COc1ccc2nccnc2c1OC Amb27965753 [1,1,0,0,0,0|2,0,0]=4 780 B15R2.2115 COc1cnc2ccccc2c1OC Amb22173941 [1,1,0,0,0,0|2,0,0]=4 781 B15R2.2115 COc1cnc2cccnc2c1CO Amb27248554 [1,1,0,0,0,0|2,0,0]=4 782 B15R2.2115 [C-]#[N+]c1c(OC)ccc2ccccc12 Amb33340265 [1,1,0,0,0,0|2,0,0]=4 783 B15R2.2220 CCOc1ccc2ccccc2c1Br Amb22490058 [1,1,0,0,0,0|2,0,0]=4 784 B15R2.2220 CCOc1ccc2ccccc2c1C Amb25167822 [1,1,0,0,0,0|2,0,0]=4 785 B15R2.2220 CCOc1ccc2ccccc2c1Cl Amb26331921 [1,1,0,0,0,0|2,0,0]=4 786 B15R2.2220 CCOc1ccc2ccccc2c1F Amb26861348 [1,1,0,0,0,0|2,0,0]=4 787 B15R2.2220 CCOc1ccc2ccccc2c1I Amb26857682 [1,1,0,0,0,0|2,0,0]=4 788 B15R2.2220 CCOc1ccc2ccccc2c1N Amb17200241 [1,1,0,0,0,0|2,0,0]=4 789 B15R2.2220 CCOc1ccc2ccccc2c1O Amb17200242 [1,1,0,0,0,0|1,0,0]=3 790 B15R2.2220 CCOc1ccc2ccccc2c1S Amb26413934 [1,1,0,0,0,0|1,1,0]=4 791 B15R2.2220 COCc1ccc2ccccc2c1Br Amb3939644 [1,1,0,0,0,0|2,0,0]=4 792 B15R2.2220 NCCc1ccc2ccccc2c1O Amb18191126 [1,1,0,0,0,0|2,0,0]=4 793 B15R2.4778 COc1ccc2cc(Br)ccc2c1Br Amb3193934 [1,1,0,0,0,0|2,0,0]=4 794 B15R2.4778 COc1ccc2cc(Br)ccc2c1C Amb22749230 [1,1,0,0,0,0|2,0,0]=4 795 B15R2.4778 COc1ccc2cc(Br)ccc2c1Cl Amb22728883 [1,1,0,0,0,0|2,0,0]=4 796 B15R2.4778 COc1ccc2cc(C)ccc2c1Cl Amb23580546 [1,1,0,0,0,0|2,0,0]=4 797 B15R2.4778 COc1ccc2cc(N)ccc2c1Cl Amb23580544 [1,1,0,0,0,0|2,0,0]=4 798 B15R2.4778 COc1ccc2cc(N)cnc2c1F Amb32673396 [1,1,0,0,0,0|2,0,0]=4 799 B15R2.4778 COc1ccc2cc(O)ccc2c1Br Amb18137076 [1,1,0,0,0,0|2,0,0]=4 800 B15R2.4778 COc1ccc2cc(O)cnc2c1F Amb26538397 [1,1,0,0,0,0|2,0,0]=4 801 B15R2.4778 COc1cnc2cc(Cl)ccc2c1O Amb26850745 [1,1,0,0,0,0|2,0,0]=4 802 B15R2.4844 COc1ccc2c(c1O)C(=O)NC=C2 Amb19100730 [1,1,0,0,0,0|2,0,0]=4 803 B15R2.4844 COc1ccc2c(c1O)C(=O)SC=C2 Amb28351429 [1,1,0,0,0,0|2,0,0]=4 804 B15R2.4844 COc1ccc2cccc(C)c2c1O Amb18649851 [1,1,0,0,0,0|1,0,0]=3 805 B15R2.19973 CNc1cc(O)c2ccccc2c1O Amb28397264 [1,1,0,0,0,0|2,0,0]=4 806 B15R2.19973 COC1=CC(=O)c2ccccc2C1=O Amb4019015 [1,1,0,0,0,0|1,0,1]=4 807 B15R2.19973 COC1=CC(=O)c2cccnc2C1=O Amb27459642 [1,1,0,0,0,0|1,0,1]=4 808 B15R2.19973 COc1cc(Br)c2ccccc2c1N Amb27431668 [1,1,0,0,0,0|2,0,0]=4 809 B15R2.19973 COc1cc(N)c2ccccc2c1O Amb25227492 [1,1,0,0,0,0|1,0,0]=3 810 B15R2.19973 COc1cc(N)c2ccccc2c1O Amb28653247 [1,1,0,0,0,0|1,0,0]=3 811 B15R2.19973 COc1cc(O)c2c(c1O)CC=CC2 Amb27486127 [1,1,0,0,0,0|1,0,1]=4 812 B15R2.19973 COc1cc(O)c2ccccc2c1O Amb18650360 [1,1,0,0,0,0|1,0,0]=3 813 B15R2.22378 COc1ccc2c(Br)ccnc2c1F Amb35643160 [1,1,0,0,0,0|2,0,0]=4 814 B15R2.22378 COc1ccc2c(Cl)ccnc2c1Cl Amb27600774 [1,1,0,0,0,0|2,0,0]=4 815 B15R2.22378 COc1ccc2c(Cl)ccnc2c1F Amb33133148 [1,1,0,0,0,0|2,0,0]=4 816 B15R2.22378 COc1ccc2c(Cl)nccc2c1O Amb27966222 [1,1,0,0,0,0|2,0,0]=4 817 B15R2.22378 COc1ccc2c(F)cccc2c1O Amb26987026 [1,1,0,0,0,0|1,0,0]=3 818 B15R2.22378 COc1ccc2c(N)ccnc2c1F Amb35643183 [1,1,0,0,0,0|2,0,0]=4 819 B15R2.22378 COc1ccc2c(O)cccc2c1F Amb28053825 [1,1,0,0,0,0|2,0,0]=4 820 B15R2.22378 COc1ccc2c(c1F)NC=CC2=O Amb35643198 [1,1,0,0,0,0|2,0,0]=4 821 B15R2.22378 COc1ccc2c(c1O)C=CNC2=O Amb19100732 [1,1,0,0,0,0|2,0,0]=4 822 B15R2.1282 CCNc1ccc2ccc(=O)oc2c1 Amb4096006 [1,1,0,0,0,0|1,0,0]=3 823 B15R2.1282 CCOc1ccc2c(c1)OC(=O)C=C2 Amb18511472 [1,1,0,0,0,0|0,0,0]=2 824 B15R2.1282 CCOc1ccc2ccc(Br)cc2c1 Amb28388711 [1,1,0,0,0,0|2,0,0]=4 825 B15R2.1282 CCOc1ccc2ccc(C)cc2c1 Amb26510964 [1,1,0,0,0,0|2,0,0]=4 826 B15R2.1282 CCOc1ccc2ccc(O)cc2c1 Amb8837549 [1,1,0,0,0,0|1,0,1]=4 827 B15R2.1282 COCc1ccc2ccc(O)cc2c1 Amb27612763 [1,1,0,0,0,0|1,0,1]=4 828 B15R2.1282 O=CNc1ccc2c(c1)OC(=O)C=C2 Amb28138066 [1,1,0,0,0,0|1,0,1]=4 829 B15R2.1824 COc1cc2c(cc1Br)C=CC(=O)O2 Amb27602473 [1,1,0,0,0,0|0,0,0]=2 830 B15R2.1824 COc1cc2c(cc1F)N=CC(=O)N2 Amb27667046 [1,1,0,0,0,0|2,0,0]=4 831 B15R2.1824 COc1cc2c(cc1O)C=CC(=O)O2 Amb18511475 [1,1,0,0,0,0|0,0,0]=2 832 B15R2.1824 COc1cc2nc(C)ccc2cc1O Amb27189455 [1,1,0,0,0,0|2,0,0]=4 833 B15R2.1824 COc1cc2nc(Cl)ccc2cc1Cl Amb28191185 [1,1,0,0,0,0|2,0,0]=4 834 B15R2.4775 COc1ccc2c(c1)OC(C)(C)C=C2 Amb3774706 [1,1,0,0,0,0|1,0,1]=4 835 B15R2.4776 C#Cc1ccc2ccc(OC)cc2c1 Amb27854231 [1,1,0,0,0,0|2,0,0]=4 836 B15R2.4776 COc1ccc2c(c1)OC(CN)=CO2 Amb27638103 [1,1,0,0,0,0|2,0,0]=4 837 B15R2.4776 COc1ccc2ccc(C#N)cc2c1 Amb24356943 [1,1,0,0,0,0|2,0,0]=4 838 B15R2.4776 COc1ccc2ccc(C#N)nc2c1 Amb17578345 [1,1,0,0,0,0|2,0,0]=4 839 B15R2.4776 COc1ccc2ccc(C=O)cc2c1 Amb25114596 [1,1,0,0,0,0|1,0,0]=3 840 B15R2.4776 COc1ccc2ccc(C=O)nc2c1 Amb3931397 [1,1,0,0,0,0|1,0,0]=3 841 B15R2.4776 COc1ccc2ccc(CBr)cc2c1 Amb26065586 [1,1,0,0,0,0|2,0,0]=4 842 B15R2.4776 COc1ccc2ccc(CCl)cc2c1 Amb25964190 [1,1,0,0,0,0|2,0,0]=4 843 B15R2.4776 COc1ccc2ccc(CN)cc2c1 Amb25808574 [1,1,0,0,0,0|2,0,0]=4 844 B15R2.4776 COc1ccc2ccc(CO)cc2c1 Amb25724303 [1,1,0,0,0,0|1,0,1]=4 845 B15R2.4776 COc1ccc2ccc(OC)cc2c1 Amb1233204 [1,1,0,0,0,0|1,0,1]=4 846 B15R2.4776 COc1ccc2ncc(C=O)cc2c1 Amb1994328 [1,1,0,0,0,0|2,0,0]=4 847 B15R2.4807 CNc1ccc2c(c1)N(C)C(=O)C=C2 Amb28061307 [1,1,0,0,0,0|2,0,0]=4 848 B15R2.4807 COc1ccc2ccc(Br)c(O)c2c1 Amb18559385 [1,1,0,0,0,0|2,0,0]=4 849 B15R2.4807 COc1ccc2ccc(C)c(O)c2c1 Amb18063856 [1,1,0,0,0,0|2,0,0]=4 850 B15R2.4807 COc1ccc2ccc(O)c(C)c2c1 Amb28074601 [1,1,0,0,0,0|1,0,1]=4 851 B15R2.4807 COc1ccc2ccc(O)c(Cl)c2c1 Amb18656343 [1,1,0,0,0,0|1,0,1]=4 852 B15R2.4807 COc1ccc2ccc(O)c(N)c2c1 Amb27494220 [1,1,0,0,0,0|1,0,1]=4 853 B15R2.7174 CC(=O)c1ccc2c(c1)OC(=O)C=C2 Amb28246862 [1,1,0,0,0,0|1,0,0]=3 854 B15R2.7174 CC(C)c1ccc2c(c1)OC(=O)C=C2 Amb27963157 [1,1,0,0,0,0|1,0,0]=3 855 B15R2.7174 CN(C)c1ccc2c(c1)OC(=O)C=C2 Amb20247403 [1,1,0,0,0,0|1,0,0]=3 856 B15R2.7174 O=C1C=Cc2ccc(B(O)O)cc2O1 Amb25024284 [1,1,0,0,0,0|2,0,0]=4 857 B15R2.7174 O=C1C=Cc2ccc(C(=O)O)cc2O1 Amb24390786 [1,1,0,0,0,0|2,0,0]=4 858 B15R2.7174 O=C1C=Cc2ccc([N+](=O)[O-])cc2O1 Amb19133409 [1,1,0,0,0,0|2,0,0]=4 859 B15R2.21336 COc1ccc2c(c1)NC(=O)C(=O)N2 Amb18545067 [1,1,0,0,0,0|2,0,0]=4 860 B15R2.21336 COc1ccc2c(c1)NC(=O)C(Br)=C2 Amb25342187 [1,1,0,0,0,0|1,0,0]=3 861 B15R2.21336 COc1ccc2c(c1)NC(=O)C(C)=C2 Amb18049043 [1,1,0,0,0,0|1,0,0]=3 862 B15R2.21336 COc1ccc2c(c1)NC(=O)C(Cl)=N2 Amb28208318 [1,1,0,0,0,0|2,0,0]=4 863 B15R2.21336 COc1ccc2c(c1)OC(=O)C(=O)N2 Amb27830094 [1,1,0,0,0,0|1,0,0]=3 864 B15R2.21336 COc1ccc2c(c1)OC(=O)C(Br)=C2 Amb23580467 [1,1,0,0,0,0|0,0,0]=2 865 B15R2.21336 COc1ccc2c(c1)OC(=O)C(C)=C2 Amb27222195 [1,1,0,0,0,0|0,0,0]=2 866 B15R2.21336 COc1ccc2c(c1)OC(=O)C(N)=C2 Amb18650742 [1,1,0,0,0,0|0,0,0]=2 867 B15R2.21336 COc1ccc2cc(C)c(Br)nc2c1 Amb17161400 [1,1,0,0,0,0|2,0,0]=4 868 B15R2.21336 COc1ccc2cc(C)c(Cl)nc2c1 Amb1994543 [1,1,0,0,0,0|2,0,0]=4 869 B15R2.21336 COc1ccc2cc(C)c(N)nc2c1 Amb9134107 [1,1,0,0,0,0|2,0,0]=4 870 B15R2.21336 COc1ccc2cc(C)c(S)nc2c1 Amb2785439 [1,1,0,0,0,0|1,1,0]=4 871 B15R2.21336 COc1ccc2cc(F)c(Br)nc2c1 Amb22547368 [1,1,0,0,0,0|2,0,0]=4 872 B15R2.21336 COc1ccc2cc(N)c(O)cc2c1 Amb28119190 [1,1,0,0,0,0|1,0,1]=4 873 B15R2.21336 COc1ccc2cc(O)c(C)nc2c1 Amb33134105 [1,1,0,0,0,0|2,0,0]=4 874 B15R2.89396 CC1=CC(=O)Oc2cc(C=O)ccc21 Amb19517114 [1,1,0,0,0,0|2,0,0]=4 875 B15R2.89396 CC1=CC(=O)Oc2cc(CBr)ccc21 Amb19886606 [1,1,0,0,0,0|2,0,0]=4 876 B15R2.89396 CC1=CC(=O)Oc2cc(NN)ccc21 Amb27956905 [1,1,0,0,0,0|2,0,0]=4 877 B15R2.89396 CC1=CC(=O)Oc2cc(ON)ccc21 Amb28457172 [1,1,0,0,0,0|1,0,0]=3 878 B15R2.89396 CCc1ccc2c(c1)NC(=O)C=C2C Amb25112094 [1,1,0,0,0,0|2,0,0]=4 879 B15R2.89396 CCc1ccc2c(c1)OC(=O)C=C2C Amb21927336 [1,1,0,0,0,0|1,0,0]=3 880 B15R2.89396 CNc1ccc2c(C)cc(=O)oc2c1 Amb2720036 [1,1,0,0,0,0|1,0,0]=3 881 B15R2.89396 CNc1ccc2c(c1)OC(=O)C=C2C Amb26304337 [1,1,0,0,0,0|1,0,0]=3 882 B15R2.89396 COC1=CC2=CC(=O)NC(Cl)=C2C=C1 Amb28409881 [1,1,0,0,0,0|2,0,0]=4 883 B15R2.89396 COc1ccc2c(Br)cc(C)nc2c1 Amb9134366 [1,1,0,0,0,0|2,0,0]=4 884 B15R2.89396 COc1ccc2c(C)cc(Br)nc2c1 Amb19108218 [1,1,0,0,0,0|2,0,0]=4 885 B15R2.89396 COc1ccc2c(C)cc(Cl)nc2c1 Amb1106737 [1,1,0,0,0,0|2,0,0]=4 886 B15R2.89396 COc1ccc2c(C)cc(N)nc2c1 Amb22432400 [1,1,0,0,0,0|2,0,0]=4 887 B15R2.89396 COc1ccc2c(C)cc(O)cc2c1 Amb27189448 [1,1,0,0,0,0|1,0,1]=4 888 B15R2.89396 COc1ccc2c(C)cc(O)nc2c1 Amb2370512 [1,1,0,0,0,0|1,0,1]=4 889 B15R2.89396 COc1ccc2c(C)cc(S)nc2c1 Amb1106992 [1,1,0,0,0,0|1,1,0]=4 890 B15R2.89396 COc1ccc2c(Cl)cc(C)nc2c1 Amb1994638 [1,1,0,0,0,0|2,0,0]=4 891 B15R2.89396 COc1ccc2c(Cl)cc(Cl)nc2c1 Amb6479187 [1,1,0,0,0,0|2,0,0]=4 892 B15R2.89396 COc1ccc2c(F)cc(F)nc2c1 Amb27778615 [1,1,0,0,0,0|2,0,0]=4 893 B15R2.89396 COc1ccc2c(N)cc(C)nc2c1 Amb1994610 [1,1,0,0,0,0|2,0,0]=4 894 B15R2.89396 COc1ccc2c(O)cc(C)nc2c1 Amb4011788 [1,1,0,0,0,0|2,0,0]=4 895 B15R2.89396 COc1ccc2c(S)cc(C)nc2c1 Amb9833959 [1,1,0,0,0,0|2,0,0]=4 896 B15R2.89396 COc1ccc2c(c1)CC(=O)NC2=O Amb17212869 [1,1,0,0,0,0|2,0,0]=4 897 B15R2.89396 COc1ccc2c(c1)CC(=O)NC2=S Amb27441100 [1,1,0,0,0,0|2,0,0]=4 898 B15R2.89396 COc1ccc2c(c1)CC(=O)OC2=O Amb17470806 [1,1,0,0,0,0|2,0,0]=4 899 B15R2.89396 COc1ccc2c(c1)NC(=O)C=C2C Amb19420263 [1,1,0,0,0,0|1,0,0]=3 900 B15R2.89396 COc1ccc2c(c1)NC(=O)C=C2N Amb27419429 [1,1,0,0,0,0|1,0,0]=3 901 B15R2.89396 COc1ccc2c(c1)NC(=O)C=C2O Amb19515895 [1,1,0,0,0,0|1,0,0]=3 902 B15R2.89396 COc1ccc2c(c1)NC(=O)CC2=O Amb22490756 [1,1,0,0,0,0|1,0,1]=4 903 B15R2.89396 COc1ccc2c(c1)NC(=O)N=C2C Amb24574063 [1,1,0,0,0,0|2,0,0]=4 904 B15R2.89396 COc1ccc2c(c1)NC(=O)N=C2N Amb27588237 [1,1,0,0,0,0|2,0,0]=4 905 B15R2.89396 COc1ccc2c(c1)NC(=O)NC2=O Amb20243329 [1,1,0,0,0,0|2,0,0]=4 906 B15R2.89396 COc1ccc2c(c1)NC(=O)OC2=O Amb22500124 [1,1,0,0,0,0|2,0,0]=4 907 B15R2.89396 COc1ccc2c(c1)NC(=S)C=C2C Amb17988973 [1,1,0,0,0,0|1,1,0]=4 908 B15R2.89396 COc1ccc2c(c1)OC(=O)C=C2C Amb18511507 [1,1,0,0,0,0|0,0,0]=2 909 B15R2.89396 COc1ccc2c(c1)OC(=O)C=C2Cl Amb22433760 [1,1,0,0,0,0|0,0,0]=2 910 B15R2.89396 COc1ccc2c(c1)OC(=O)C=C2O Amb19132639 [1,1,0,0,0,0|0,0,0]=2 911 B15R2.89396 COc1ccc2c(c1)OC(=O)NC2=O Amb20243313 [1,1,0,0,0,0|1,0,0]=3 912 B15R2.89396 COc1ccc2c(c1)OC(=S)C=C2C Amb22740175 [1,1,0,0,0,0|0,1,0]=3 913 B15R2.89396 COc1ccc2c(c1)OC(=S)NC2=O Amb27816462 [1,1,0,0,0,0|1,1,0]=4 914 B15R2.89396 COc1ccc2c(c1)OC(C)=CC2O Amb27764933 [1,1,0,0,0,0|1,0,1]=4 915 B15R2.1007 Cc1c(F)cc2c(c1Br)NC(=O)C=C2 Amb23448971 [1,1,0,0,0,0|2,0,0]=4 916 B15R2.1007 Cc1ccc2cc(F)c(C)c(O)c2n1 Amb23448789 [1,1,0,0,0,0|2,0,0]=4 917 B15R2.1007 O=C1C=Cc2cc(F)c(F)c(F)c2O1 Amb28044218 [1,1,0,0,0,0|2,0,0]=4 918 B15R2.1007 O=C1C=Cc2cc(O)c(O)c(O)c2O1 Amb18651647 [1,1,0,0,0,0|0,0,0]=2 919 B15R2.7217 Cc1ccc2c(c1N)C(=O)C(=O)C=C2 Amb18649494 [1,1,0,0,0,0|2,0,0]=4 920 B15R2.7217 O=C1C=Cc2ccc(O)c(O)c2C1=O Amb28365142 [1,1,0,0,0,0|1,0,0]=3 921 B15R2.13981 O=C1Oc2c(ccc(O)c2O)C=C1O Amb28351365 [1,1,0,0,0,0|0,0,0]=2 922 B15R2.36352 COc1c(Br)ccc2c1NC(=O)C=C2 Amb27171443 [1,1,0,0,0,0|2,0,0]=4 923 B15R2.36352 COc1c(O)ccc2c1OC(=O)C=C2 Amb18650989 [1,1,0,0,0,0|0,0,0]=2 924 B15R2.36352 O=Cc1c(O)ccc2ccc(=O)oc12 Amb7172742 [1,1,0,0,0,0|0,0,1]=3 925 B15R2.63910 CC1=CC(=O)Nc2c1ccc(C)c2Br Amb35690352 [1,1,0,0,0,0|2,0,0]=4 926 B15R2.63910 CC1=CC(=O)Nc2c1ccc(C)c2C Amb20665730 [1,1,0,0,0,0|2,0,0]=4 927 B15R2.63910 CC1=CC(=O)Nc2c1ccc(C)c2Cl Amb35690339 [1,1,0,0,0,0|2,0,0]=4 928 B15R2.63910 CC1=CC(=O)Nc2c1ccc(C)c2F Amb29857477 [1,1,0,0,0,0|2,0,0]=4 929 B15R2.63910 CC1=CC(=O)Nc2c1ccc(N)c2O Amb27386817 [1,1,0,0,0,0|2,0,0]=4 930 B15R2.63910 CC1=CC(=O)Nc2c1ccc(O)c2C Amb25752592 [1,1,0,0,0,0|2,0,0]=4 931 B15R2.63910 CC1=CC(=O)Oc2c1ccc(O)c2C Amb19204687 [1,1,0,0,0,0|1,0,0]=3 932 B15R2.63910 CC1=CC(=O)Oc2c1ccc(O)c2F Amb22739553 [1,1,0,0,0,0|1,0,0]=3 933 B15R2.63910 CC1=CC(=O)Oc2c1ccc(O)c2N Amb18008196 [1,1,0,0,0,0|1,0,0]=3 934 B15R2.63910 CC1=CC(=O)Oc2c1ccc(O)c2O Amb18511477 [1,1,0,0,0,0|0,0,0]=2 935 B15R2.63910 Cc1c(O)ccc2c1OC(=O)C=C2N Amb18048578 [1,1,0,0,0,0|1,0,0]=3 936 B15R2.63910 Cc1c(O)ccc2c1OC(=O)C=C2O Amb18650999 [1,1,0,0,0,0|1,0,0]=3 937 B15R2.63910 Cc1cc(C)c2ccc(C)c(O)c2c1 Amb18561802 [1,1,0,0,0,0|2,0,0]=4 938 B15R2.63910 Cc1ccc2c(c1C)OC(=O)C=C2O Amb25982686 [1,1,0,0,0,0|1,0,0]=3 939 B15R2.63927 Cc1cc(C)c2ccc(Cl)nc2c1O Amb4466934 [1,1,0,0,0,0|2,0,0]=4 940 B15R2.63927 Cc1cc(C)c2ccc(N)nc2c1O Amb10811007 [1,1,0,0,0,0|2,0,0]=4 941 B15R2.63927 Cc1ccc2c(C)cc(C)c(O)c2c1 Amb27612565 [1,1,0,0,0,0|2,0,0]=4 942 B15R2.63927 Cc1ccc2c(C)cc(C)c(O)c2n1 Amb5494047 [1,1,0,0,0,0|2,0,0]=4 943 B15R2.63927 Cc1ccc2c(Cl)cc(O)c(O)c2n1 Amb27854572 [1,1,0,0,0,0|2,0,0]=4 944 B15R2.63927 Oc1ccc2c(O)cc(O)c(O)c2c1 Amb17595017 [1,1,0,0,0,0|1,0,1]=4 945 B15R2.4799 COc1sc2ccc(C=O)cc2c1O Amb28422818 [0,1,0,0,1,0|2,0,0]=4 946 B15R2.3136 COc1ccc2c(c1OC)C(=O)CC2 Amb21962990 [0,1,0,0,1,0|0,0,2]=4 947 B15R2.3136 COc1ccc2c(c1OC)C(=O)NC2 Amb8388355 [0,1,0,0,1,0|1,0,1]=4 948 B15R2.3136 COc1ccc2c(c1OC)C(=O)NS2 Amb32710032 [0,1,0,0,1,0|2,0,0]=4 949 B15R2.3136 COc1ccc2c(c1OC)C(=O)OC2 Amb1161570 [0,1,0,0,1,0|1,0,1]=4 950 B15R2.3136 COc1ccc2c(c1OC)C(N)C=C2 Amb17470773 [0,1,0,0,1,0|1,0,1]=4 951 B15R2.3136 COc1ccc2ccn(C)c2c1OC Amb27622652 [0,1,0,0,1,0|2,0,0]=4 952 B15R2.3136 COc1ccc2scc(Br)c2c1OC Amb27845024 [0,1,0,0,1,0|2,0,0]=4 953 B15R2.3136 COc1ccc2scc(Cl)c2c1CO Amb27654388 [0,1,0,0,1,0|2,0,0]=4 954 B15R2.3136 COc1ccc2scc(I)c2c1CO Amb27784409 [0,1,0,0,1,0|2,0,0]=4 955 B15R2.3136 COc1ccc2scc(O)c2c1OC Amb27798531 [0,1,0,0,1,0|1,0,1]=4 956 B15R2.3138 COc1ccc2scc(C=O)c2c1C Amb18780760 [0,1,0,0,1,0|2,0,0]=4 957 B15R2.3138 COc1ccc2scc(C=O)c2c1Cl Amb27793201 [0,1,0,0,1,0|2,0,0]=4 958 B15R2.3138 COc1ccc2scc(C=O)c2c1I Amb27779621 [0,1,0,0,1,0|2,0,0]=4 959 B15R2.3138 COc1ccc2scc(C=O)c2c1N Amb27627650 [0,1,0,0,1,0|2,0,0]=4 960 B15R2.3138 COc1ccc2scc(CBr)c2c1O Amb28134705 [0,1,0,0,1,0|2,0,0]=4 961 B15R2.3138 COc1ccc2scc(CO)c2c1O Amb27205278 [0,1,0,0,1,0|1,0,1]=4 962 B15R2.3138 COc1ccc2scc(SC)c2c1O Amb27630735 [0,1,0,0,1,0|1,1,0]=4 963 B15R2.4798 COc1ccc2c(c1Br)C(=O)C(=O)N2 Amb22723418 [0,1,0,0,1,0|2,0,0]=4 964 B15R2.4798 COc1ccc2c(c1F)C(=O)C(=O)N2 Amb24713597 [0,1,0,0,1,0|2,0,0]=4 965 B15R2.6643 COc1c(O)cc2c(c1O)C(=O)CC2 Amb27258602 [0,1,0,0,1,0|0,0,2]=4 966 B15R2.10452 CCOc1ccc2scc(Br)c2c1O Amb27624280 [0,1,0,0,1,0|2,0,0]=4 967 B15R2.10452 CCOc1ccc2scc(C)c2c1O Amb27493293 [0,1,0,0,1,0|2,0,0]=4 968 B15R2.10452 CCOc1ccc2scc(I)c2c1O Amb27216340 [0,1,0,0,1,0|2,0,0]=4 969 B15R2.10452 CCOc1ccc2scc(O)c2c1O Amb27643937 [0,1,0,0,1,0|1,0,1]=4 970 B15R2.22358 COc1ccc2c(c1C)C(=O)NC2=O Amb27239665 [0,1,0,0,1,0|2,0,0]=4 971 B15R2.22358 COc1ccc2c(c1O)C(=O)OC2O Amb28183736 [0,1,0,0,1,0|1,0,1]=4 972 B15R2.39258 COc1cc(Br)c2c(c1O)C(=O)CC2 Amb25047400 [0,1,0,0,1,0|0,0,2]=4 973 B15R2.39258 COc1cc(Br)c2scc(Cl)c2c1O Amb27181982 [0,1,0,0,1,0|2,0,0]=4 974 B15R2.4833 COc1ccc2c(c1OC)SC(=O)N2 Amb27239803 [0,1,0,0,1,0|1,1,0]=4 975 B15R2.4833 COc1ccc2cc(Br)sc2c1OC Amb28292352 [0,1,0,0,1,0|1,1,0]=4 976 B15R2.4833 COc1ccc2cc(C)oc2c1C=O Amb18819742 [0,1,0,0,1,0|1,0,1]=4 977 B15R2.4833 COc1ccc2cc(Cl)sc2c1OC Amb28423732 [0,1,0,0,1,0|1,1,0]=4 978 B15R2.4833 COc1ccc2cc(I)sc2c1CO Amb28196747 [0,1,0,0,1,0|1,1,0]=4 979 B15R2.4833 COc1ccc2cc(N)sc2c1OC Amb28252616 [0,1,0,0,1,0|1,1,0]=4 980 B15R2.4833 COc1ccc2cc(O)sc2c1CO Amb27446871 [0,1,0,0,1,0|0,1,1]=4 981 B15R2.4833 COc1ccc2nc(C)oc2c1CO Amb27807459 [0,1,0,0,1,0|2,0,0]=4 982 B15R2.4835 CCc1cc2ccc(OC)c(O)c2s1 Amb27818335 [0,1,0,0,1,0|1,1,0]=4 983 B15R2.4835 COc1ccc2cc(C#N)sc2c1O Amb27489951 [0,1,0,0,1,0|1,1,0]=4 984 B15R2.4835 COc1ccc2cc(C=O)oc2c1N Amb18818976 [0,1,0,0,1,0|1,0,0]=3 985 B15R2.4835 COc1ccc2cc(C=O)sc2c1Br Amb27783226 [0,1,0,0,1,0|1,1,0]=4 986 B15R2.4835 COc1ccc2cc(C=O)sc2c1O Amb27818264 [0,1,0,0,1,0|0,1,0]=3 987 B15R2.4835 COc1ccc2cc(C=O)sc2c1S Amb27214747 [0,1,0,0,1,0|0,2,0]=4 988 B15R2.4835 COc1ccc2cc(CCl)sc2c1O Amb27880493 [0,1,0,0,1,0|1,1,0]=4 989 B15R2.4835 COc1ccc2cc(SC)sc2c1O Amb27850152 [0,1,0,0,1,0|0,2,0]=4 990 B15R2.16673 CCOc1ccc2cc(F)sc2c1O Amb27493259 [0,1,0,0,1,0|1,1,0]=4 991 B15R2.16673 CCOc1ccc2cc(N)sc2c1O Amb27474697 [0,1,0,0,1,0|1,1,0]=4 992 B15R2.22370 COc1ccc2c(c1F)NC(=O)C2=O Amb26657867 [0,1,0,0,1,0|2,0,0]=4 993 B17R2.11711 COc1ccc2c(c1C(C)=O)OC(=O)C=C2 Amb18511501 [0,2,0,0,0,0|0,0,1]=3 994 B17R2.11833 COc1ccc2ccc(OC)c(CO)c2c1 Amb837488 [0,2,0,0,0,0|1,0,1]=4 995 B17R2.412884 COc1ccc2c(c1OC)CC(=O)NC2=O Amb17471792 [0,2,0,0,0,0|2,0,0]=4 996 B17R2.412884 COc1ccc2c(c1OC)CC(=O)OC2=O Amb17471874 [0,2,0,0,0,0|2,0,0]=4 997 B17R2.412884 COc1ccc2c(c1OC)NC(=O)C=C2O Amb32455765 [0,2,0,0,0,0|1,0,0]=3 998 B17R2.412884 COc1ccc2c(c1OC)NC(=O)NC2=O Amb22886649 [0,2,0,0,0,0|2,0,0]=4 999 B17R2.62661 COc1cc2c(c(O)c1OC)OC(=O)C=C2 Amb18133967 [0,2,0,0,0,0|0,0,0]=2 1000 B15R2.19139 C=CC(=O)Nc1cccc2c1CCO2 Amb33289951 [0,0,1,1,0,0|2,0,0]=4 1001 B15R2.19139 CNC(=O)Oc1cccc2c1OCO2 Amb27799810 [0,0,1,1,0,0|1,0,1]=4 1002 B15R2.86973 COc1cccc2c1C=C(N)C(=O)O2 Amb27746878 [0,0,1,1,0,0|2,0,0]=4 1003 B15R2.86973 COc1cccc2c1OC(=O)C(=O)N2 Amb27173704 [0,0,1,1,0,0|2,0,0]=4 1004 B15R2.21243 COc1cc2ccccc2c(Br)c1O Amb21926717 [0,0,1,1,0,0|2,0,0]=4 1005 B15R2.21243 COc1cc2ccccc2c(O)c1C Amb27189246 [0,0,1,1,0,0|2,0,0]=4 1006 B15R2.21243 COc1cc2ccccc2c(O)c1F Amb35825502 [0,0,1,1,0,0|2,0,0]=4 1007 B15R2.2039 COc1cc2c(cc1O)C(=O)NC=C2 Amb19100731 [0,0,1,1,0,0|2,0,0]=4 1008 B15R2.22226 COc1ccc(O)c2c1C=CC(=O)O2 Amb27612762 [0,0,1,1,0,0|2,0,0]=4 1009 B15R2.7688 CC(=O)\C=C\c1ccc2c(c1)CCO2 Amb33358878 [0,0,1,1,0,0|2,0,0]=4 1010 B15R2.7688 CC(=O)\C=C\c1ccc2c(c1)OCO2 Amb31267737 [0,0,1,1,0,0|1,0,0]=3 1011 B15R2.7688 CC(O)\C=C\c1ccc2c(c1)OCO2 Amb25185927 [0,0,1,1,0,0|1,0,1]=4 1012 B15R2.7688 N=C(N)\C=C\c1ccc2c(c1)OCO2 Amb27644694 [0,0,1,1,0,0|2,0,0]=4 1013 B15R2.7688 NC(=O)\C=C\c1ccc2c(c1)OCO2 Amb6410707 [0,0,1,1,0,0|1,0,0]=3 1014 B15R2.7688 NC(=O)\C=C\c1cnc2c(c1)OCO2 Amb27645307 [0,0,1,1,0,0|2,0,0]=4 1015 B15R2.7688 O=C(Cl)\C=C\c1ccc2c(c1)OCO2 Amb16186544 [0,0,1,1,0,0|1,0,0]=3 1016 B15R2.7688 O=C(O)C#Cc1ccc2c(c1)OCO2 Amb3989626 [0,0,1,1,0,0|0,0,2]=4 1017 B15R2.7688 O=C(O)CCc1ccc2c(c1)OCO2 Amb1225386 [0,0,1,1,0,0|0,0,2]=4 1018 B15R2.7688 O=C(O)CNc1ccc2c(c1)OCO2 Amb2819576 [0,0,1,1,0,0|1,0,1]=4 1019 B15R2.7688 O=C(O)COc1ccc2c(c1)OCO2 Amb6335268 [0,0,1,1,0,0|1,0,1]=4 1020 B15R2.7688 O=C(O)CSc1ccc2c(c1)OCO2 Amb17082992 [0,0,1,1,0,0|1,0,1]=4 1021 B15R2.7688 O=C(O)\C=C/c1ccc2c(c1)CCO2 Amb10071727 [0,0,1,1,0,0|1,0,0]=3 1022 B15R2.7688 O=C(O)\C=C\c1ccc2c(c1)CCC2 Amb2417108 [0,0,1,1,0,0|2,0,0]=4 1023 B15R2.7688 O=C(O)\C=C\c1ccc2c(c1)CCO2 Amb34092779 [0,0,1,1,0,0|1,0,0]=3 1024 B15R2.7688 O=C(O)\C=C\c1ccc2c(c1)OCO2 Amb1630294 [0,0,1,1,0,0|0,0,0]=2 1025 B15R2.7688 O=C(O)\C=C\c1ccc2ncoc2c1 Amb18243911 [0,0,1,1,0,0|1,0,1]=4 1026 B15R2.7688 O=C(O)\C=C\c1ccc2occc2c1 Amb32953470 [0,0,1,1,0,0|1,0,1]=4 1027 B15R2.7688 O=C(O)\C=C\c1ccc2ocnc2c1 Amb18243912 [0,0,1,1,0,0|1,0,1]=4 1028 B15R2.7688 O=[N+]([O-])\C=C/c1ccc2c(c1)OCO2 Amb2713962 [0,0,1,1,0,0|1,0,1]=4 1029 B15R2.7688 O=[N+]([O-])\C=C\c1ccc2c(c1)OCO2 Amb8517281 [0,0,1,1,0,0|1,0,1]=4 1030 B15R2.7688 OB(O)\C=C\c1ccc2c(c1)OCO2 Amb25320430 [0,0,1,1,0,0|1,0,1]=4 1031 B15R2.22166 COc1ccc(C=O)c2c1NC(=O)O2 Amb18651371 [0,0,1,1,0,0|2,0,0]=4 1032 B15R3.1739 c1cc2ccc3c(c2cn1)OCO3 Amb28316410 [1,0,0,1,0,0|2,0,0]=4 1033 B15R3.43766 O=C1C=Cc2ccc3c(c21)CCO3 Amb28386501 [0,0,0,1,1,0|1,0,0]=3 1034 B15R3.43766 O=C1NCc2ccc3c(c21)OCO3 Amb22230080 [0,0,0,1,1,0|1,0,1]=4 1035 B15R3.43766 O=C1OCc2ccc3c(c21)OCO3 Amb5718246 [0,0,0,1,1,0|1,0,1]=4 1036 B17R3.19053 Cc1coc2ccc3c(c12)OC(=O)C=C3 Amb26304536 [0,1,0,1,0,0|1,0,1]=4 1037 B17R3.202536 O=C1C=Cc2cc3c(c(O)c2O1)OCC3 Amb18048629 [0,1,0,1,0,0|0,0,0]=2 1038 B17R3.202536 O=C1C=Cc2cc3ccoc3c(O)c2O1 Amb18511484 [0,1,0,1,0,0|0,0,1]=3 1039 B13R1.82 C=CC(=O)c1cccc(OC)c1Br Amb33387112 [0,0,1,0,1,0|1,0,0]=3 1040 B13R1.82 C=CC(=O)c1cccc(OC)c1C Amb33269966 [0,0,1,0,1,0|1,0,0]=3 1041 B13R1.82 C=CC(=O)c1cccc(OC)c1N Amb27629921 [0,0,1,0,1,0|1,0,0]=3 1042 B13R1.82 C=CC(=O)c1cccc(OC)c1O Amb33310508 [0,0,1,0,1,0|0,0,0]=2 1043 B13R1.82 C=CC(=O)c1ccnc(OC)c1F Amb27225433 [0,0,1,0,1,0|2,0,0]=4 1044 B13R1.82 C=CC(N)c1cccc(OC)c1O Amb28325920 [0,0,1,0,1,0|1,0,1]=4 1045 B13R1.82 C=CC(O)c1cccc(OC)c1O Amb27805339 [0,0,1,0,1,0|0,0,2]=4 1046 B13R1.82 COC(=O)c1cccc(OC)c1O Amb3940191 [0,0,1,0,1,0|1,0,1]=4 1047 B13R1.82 COc1cccc(C(=O)CCl)c1O Amb18653410 [0,0,1,0,1,0|1,0,1]=4 1048 B13R1.82 COc1cccc(C(=O)CN)c1O Amb33372452 [0,0,1,0,1,0|1,0,1]=4 1049 B13R1.82 COc1cccc(C(=O)NN)c1O Amb6276241 [0,0,1,0,1,0|2,0,0]=4 1050 B13R1.3097 COc1ccc(Br)c(C(=O)O)c1O Amb22752269 [0,0,1,0,1,0|2,0,0]=4 1051 B13R1.3097 COc1ccc(F)c(C(=O)O)c1O Amb27631673 [0,0,1,0,1,0|2,0,0]=4 1052 B13R1.35 CCc1ccc(CC(=O)O)cc1O Amb25875042 [0,0,1,0,1,0|1,0,1]=4 1053 B13R1.35 COc1ccc(C=C(Br)Br)cc1O Amb8396467 [0,0,1,0,1,0|2,0,0]=4 1054 B13R1.35 COc1ccc(CC(=O)O)cc1Br Amb2542765 [0,0,1,0,1,0|1,0,1]=4 1055 B13R1.35 COc1ccc(CC(=O)O)cc1C Amb1830256 [0,0,1,0,1,0|1,0,1]=4 1056 B13R1.35 COc1ccc(CC(=O)O)cc1Cl Amb1102441 [0,0,1,0,1,0|1,0,1]=4 1057 B13R1.35 COc1ccc(CC(=O)O)cc1F Amb1216490 [0,0,1,0,1,0|1,0,1]=4 1058 B13R1.35 COc1ccc(CC(=O)O)cc1I Amb26881660 [0,0,1,0,1,0|1,0,1]=4 1059 B13R1.35 COc1ccc(CC(=O)O)cc1N Amb19001507 [0,0,1,0,1,0|1,0,1]=4 1060 B13R1.35 COc1ccc(CC(=O)O)cc1O Amb2688757 [0,0,1,0,1,0|0,0,1]=3 1061 B13R1.35 COc1ccc(CC(C)=O)cc1O Amb6298058 [0,0,1,0,1,0|1,0,1]=4 1062 B13R1.35 COc1ccc(NC(N)=O)cc1O Amb24489143 [0,0,1,0,1,0|2,0,0]=4 1063 B13R1.35 CSc1ccc(CC(=O)O)cc1O Amb26908481 [0,0,1,0,1,0|0,1,1]=4 1064 B13R1.69 COc1sc(\C=C\C(=O)O)cc1Br Amb33432031 [0,0,1,0,1,0|2,0,0]=4 1065 B13R2.84 COc1ccc2ccoc2c1F Amb27416333 [1,0,0,0,1,0|1,0,0]=3 1066 B13R2.84 COc1ccc2cnoc2c1F Amb27641156 [1,0,0,0,1,0|2,0,0]=4 1067 B13R2.669 COc1ccc2c(c1)C(=O)C=C2 Amb27596573 [1,0,0,0,1,0|0,0,0]=2 1068 B13R2.669 COc1ccc2c(c1)C(=O)CC2 Amb2383533 [1,0,0,0,1,0|0,0,2]=4 1069 B13R2.669 COc1ccc2c(c1)C(=O)CN2 Amb18829473 [1,0,0,0,1,0|1,0,1]=4 1070 B13R2.669 COc1ccc2c(c1)C(=O)CO2 Amb33534387 [1,0,0,0,1,0|1,0,1]=4 1071 B13R2.669 COc1ccc2c(c1)C(=O)CS2 Amb18824510 [1,0,0,0,1,0|1,0,1]=4 1072 B13R2.669 COc1ccc2c(c1)C(=O)NC2 Amb17942823 [1,0,0,0,1,0|1,0,1]=4 1073 B13R2.669 COc1ccc2c(c1)C(=O)OC2 Amb2692666 [1,0,0,0,1,0|1,0,1]=4 1074 B13R2.669 COc1ccc2c(c1)C(C)=CC2 Amb32671214 [1,0,0,0,1,0|1,0,1]=4 1075 B13R2.669 COc1ccc2c(c1)C(N)C=C2 Amb17470416 [1,0,0,0,1,0|1,0,1]=4 1076 B13R2.669 COc1ccc2ccn(N)c2c1 Amb18829729 [1,0,0,0,1,0|2,0,0]=4 1077 B13R2.669 COc1ccc2occ(Br)c2c1 Amb18159604 [1,0,0,0,1,0|2,0,0]=4 1078 B13R2.669 COc1ccc2occ(C)c2c1 Amb22229996 [1,0,0,0,1,0|2,0,0]=4 1079 B13R2.669 COc1ccc2occ(N)c2c1 Amb18829457 [1,0,0,0,1,0|2,0,0]=4 1080 B13R2.669 COc1ccc2scc(Br)c2c1 Amb27462570 [1,0,0,0,1,0|2,0,0]=4 1081 B13R2.669 COc1ccc2scc(C)c2c1 Amb25751508 [1,0,0,0,1,0|2,0,0]=4 1082 B13R2.669 COc1ccc2scc(N)c2c1 Amb23402518 [1,0,0,0,1,0|2,0,0]=4 1083 B13R2.669 COc1ccn2ccc(N)c2c1 Amb28457937 [1,0,0,0,1,0|2,0,0]=4 1084 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 Amb2237085 [1,0,0,0,1,0|2,0,0]=4 1085 B13R2.2121 COc1ccc2c(c1)CC(=O)S2 Amb20242264 [1,0,0,0,1,0|2,0,0]=4 1086 B13R2.2121 COc1ccc2c(c1)NC(=O)C2 Amb6306511 [1,0,0,0,1,0|1,0,1]=4 1087 B13R2.2121 COc1ccc2c(c1)NC(=O)N2 Amb18043078 [1,0,0,0,1,0|2,0,0]=4 1088 B13R2.2121 COc1ccc2c(c1)NC(=O)O2 Amb18043103 [1,0,0,0,1,0|2,0,0]=4 1089 B13R2.2121 COc1ccc2c(c1)NC(=O)S2 Amb21857280 [1,0,0,0,1,0|2,0,0]=4 1090 B13R2.2121 COc1ccc2c(c1)OC(=O)N2 Amb18046732 [1,0,0,0,1,0|1,0,0]=3 1091 B13R2.2121 COc1ccc2c(c1)SC(=O)N2 Amb19957540 [1,0,0,0,1,0|1,1,0]=4 1092 B13R2.2121 COc1ccc2c(c1)SC(=O)O2 Amb20001514 [1,0,0,0,1,0|1,1,0]=4 1093 B13R2.2121 COc1ccc2c(n1)OC(=O)N2 Amb28246585 [1,0,0,0,1,0|2,0,0]=4 1094 B13R2.2121 COc1ccc2cc(Br)sc2c1 Amb27215336 [1,0,0,0,1,0|1,1,0]=4 1095 B13R2.2121 COc1ccc2cc(I)sc2c1 Amb24093070 [1,0,0,0,1,0|1,1,0]=4 1096 B13R2.2121 COc1ccc2nc(C)oc2c1 Amb4004996 [1,0,0,0,1,0|2,0,0]=4 1097 B13R2.2121 COc1ccc2nc(Cl)oc2c1 Amb27193058 [1,0,0,0,1,0|2,0,0]=4 1098 B13R2.2121 COc1ccc2nc(F)oc2c1 Amb25942493 [1,0,0,0,1,0|2,0,0]=4 1099 B13R2.2121 COc1ccc2nc(I)oc2c1 Amb28044192 [1,0,0,0,1,0|2,0,0]=4 1100 B13R2.2121 COc1ccc2nc(N)oc2c1 Amb22371620 [1,0,0,0,1,0|2,0,0]=4 1101 B13R2.2121 COc1ccc2nc(S)oc2c1 Amb26870554 [1,0,0,0,1,0|1,1,0]=4 1102 B13R2.2121 CSc1ccc2c(c1)OC(=O)N2 Amb24619461 [1,0,0,0,1,0|1,1,0]=4 1103 B13R2.3050 Cc1cc2ccc(C)c(C)c2o1 Amb24738461 [1,0,0,0,1,0|2,0,0]=4 1104 B13R2.3050 Cc1cc2ccc(C)c(O)c2s1 Amb28286989 [1,0,0,0,1,0|1,1,0]=4 1105 B13R2.3050 Cc1ccc2c(c1C)OC(=O)N2 Amb18547325 [1,0,0,0,1,0|2,0,0]=4 1106 B13R2.3050 Cc1ccc2cc(Br)sc2c1O Amb28131139 [1,0,0,0,1,0|1,1,0]=4 1107 B13R2.3050 Cc1ccc2cc(I)sc2c1O Amb28252544 [1,0,0,0,1,0|1,1,0]=4 1108 B13R2.3050 Cc1nc2ccc(O)c(O)c2o1 Amb18646199 [1,0,0,0,1,0|2,0,0]=4 1109 B13R2.3050 Nc1cc2ccc(O)c(O)c2s1 Amb27194057 [1,0,0,0,1,0|1,1,0]=4 1110 B13R2.3050 O=C1Cc2ccc(O)c(O)c2N1 Amb28346823 [1,0,0,0,1,0|1,0,1]=4 1111 B13R2.3050 Oc1ccc2cc(Br)sc2c1O Amb27782716 [1,0,0,0,1,0|1,1,0]=4 1112 B13R2.3790 Cc1ccc2scc(N)c2c1O Amb27798775 [1,0,0,0,1,0|2,0,0]=4 1113 B13R2.3790 Cc1ccc2scc(O)c2c1O Amb28198137 [1,0,0,0,1,0|1,0,1]=4 1114 B13R2.3790 Cc1ccc2scc(S)c2c1O Amb27440646 [1,0,0,0,1,0|1,1,0]=4 1115 B13R2.3790 Cc1csc2ccc(O)c(O)c12 Amb28198228 [1,0,0,0,1,0|2,0,0]=4 1116 B13R2.3790 O=C1COc2ccc(O)c(O)c21 Amb27593380 [1,0,0,0,1,0|1,0,1]=4 1117 B13R2.2131 COc1ccc2c(c1C)CC2=O Amb17843964 [0,0,0,0,2,0|2,0,0]=4 1118 B15R1.3778 CCc1ccc(N\C=C\C(=O)O)cc1Cl Amb35671523 [0,0,1,0,0,1|2,0,0]=4 1119 B15R1.3778 COc1ccc(CCCC(=O)O)cc1O Amb33449222 [0,0,1,0,0,1|0,0,2]=4 1120 B15R1.3778 COc1ccc(N\C=C\C(=O)O)cc1C Amb27628512 [0,0,1,0,0,1|1,0,0]=3 1121 B15R1.3778 COc1ccc(\C=C\CC(=O)O)cc1Br Amb18075423 [0,0,1,0,0,1|1,0,0]=3 1122 B15R1.3778 COc1ccc(\C=C\CC(=O)O)cc1C Amb18567678 [0,0,1,0,0,1|1,0,0]=3 1123 B15R1.3778 COc1ccc(\C=C\CC(=O)O)cc1Cl Amb18070176 [0,0,1,0,0,1|1,0,0]=3 1124 B15R1.3778 COc1ccc(\C=C\CC(=O)O)cc1F Amb18569011 [0,0,1,0,0,1|1,0,0]=3 1125 B15R2.2284 COC1=CC=Cc2ccccc2C1O Amb27651834 [1,0,0,0,0,1|1,0,1]=4 1126 B15R2.2880 COc1ccc2c(c1)CC(=O)NC=C2 Amb2439236 [1,0,0,0,0,1|1,0,0]=3 1127 B15R2.2880 COc1ccc2c(c1)OC(=O)CCO2 Amb27480874 [1,0,0,0,0,1|0,0,2]=4 1128 B15R2.31105 COc1ccc2c(c1)CNC(=O)C=C2 Amb27466211 [1,0,0,0,0,1|1,0,0]=3 1129 B15R2.1754 COc1cc2c(cc1O)OC(=O)C=C2 Amb18511479 [0,0,0,0,1,1|0,0,0]=2 1130 B15R2.1754 COc1cc2c(cc1O)OC(=O)CC2 Amb27612775 [0,0,0,0,1,1|0,0,2]=4