0 B14R2.11645 C=C1Cc2c(OC)cccc2C1=O Amb18063785 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.11645 CCc1cccc2c(O)c(C)sc12 Amb27252518 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.11645 CCc1cccc2c(O)c(F)sc12 Amb27629520 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.11645 CCc1cccc2c1NC(=O)C2=O Amb6486666 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.11645 CCc1cccc2c1NC(=O)C2C Amb18243634 [0,0,0,0,0,0|3,0,0]=3 5 B14R2.11645 CCc1cccc2c1NC(=O)C2N Amb18945290 [0,0,0,0,0,0|3,0,0]=3 6 B14R2.11645 CCc1cccc2c1NC(=O)C2N Amb21959970 [0,0,0,0,0,0|3,0,0]=3 7 B14R2.11645 CCc1cccc2c1NC(=O)C2O Amb18178353 [0,0,0,0,0,0|2,0,0]=2 8 B14R2.11645 CCc1cccc2c1OC(=O)N2C Amb18046746 [0,0,0,0,0,0|3,0,0]=3 9 B14R2.11645 CN1C(=O)Cc2c(C=O)cccc21 Amb18197488 [0,0,0,0,0,0|4,0,0]=4 10 B14R2.11645 CN1C(=O)Nc2c(C=O)cccc21 Amb27640083 [0,0,0,0,0,0|3,0,0]=3 11 B14R2.11645 CN1C(=O)Oc2c(CN)cccc21 Amb28246100 [0,0,0,0,0,0|4,0,0]=4 12 B14R2.11645 CN1C(=O)Sc2c(C=O)cccc21 Amb18190327 [0,0,0,0,0,0|4,0,0]=4 13 B14R2.11645 CNc1ncnc2c1NC(=O)N2C Amb28342291 [0,0,0,0,0,0|4,0,0]=4 14 B14R2.11645 COc1cccc2c(Br)c(Br)sc12 Amb27192740 [0,0,0,0,0,0|4,0,0]=4 15 B14R2.11645 COc1cccc2c(Br)c(N)sc12 Amb27438777 [0,0,0,0,0,0|4,0,0]=4 16 B14R2.11645 COc1cccc2c(Br)c(S)sc12 Amb28142080 [0,0,0,0,0,0|3,1,0]=4 17 B14R2.11645 COc1cccc2c(C)c(Br)oc12 Amb18730246 [0,0,0,0,0,0|4,0,0]=4 18 B14R2.11645 COc1cccc2c(C)c(C)oc12 Amb28046321 [0,0,0,0,0,0|4,0,0]=4 19 B14R2.11645 COc1cccc2c(Cl)c(C)sc12 Amb27446365 [0,0,0,0,0,0|4,0,0]=4 20 B14R2.11645 COc1cccc2c(Cl)c(Cl)sc12 Amb27844974 [0,0,0,0,0,0|4,0,0]=4 21 B14R2.11645 COc1cccc2c(F)c(Br)sc12 Amb28428709 [0,0,0,0,0,0|4,0,0]=4 22 B14R2.11645 COc1cccc2c(I)c(Br)sc12 Amb27643948 [0,0,0,0,0,0|4,0,0]=4 23 B14R2.11645 COc1cccc2c(I)c(Cl)sc12 Amb27962000 [0,0,0,0,0,0|4,0,0]=4 24 B14R2.11645 COc1cccc2c(I)c(F)sc12 Amb27782609 [0,0,0,0,0,0|4,0,0]=4 25 B14R2.11645 COc1cccc2c(I)c(O)sc12 Amb27224454 [0,0,0,0,0,0|3,0,1]=4 26 B14R2.11645 COc1cccc2c(N)c(Br)sc12 Amb27845747 [0,0,0,0,0,0|4,0,0]=4 27 B14R2.11645 COc1cccc2c(N)c(C)sc12 Amb27195121 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.11645 COc1cccc2c(N)c(I)sc12 Amb27258416 [0,0,0,0,0,0|4,0,0]=4 29 B14R2.11645 COc1cccc2c(N)c(O)sc12 Amb27216268 [0,0,0,0,0,0|3,0,1]=4 30 B14R2.11645 COc1cccc2c(O)c(C)sc12 Amb28422855 [0,0,0,0,0,0|3,0,0]=3 31 B14R2.11645 COc1cccc2c(O)c(Cl)sc12 Amb28142029 [0,0,0,0,0,0|3,0,0]=3 32 B14R2.11645 COc1cccc2c(O)c(F)sc12 Amb27196023 [0,0,0,0,0,0|3,0,0]=3 33 B14R2.11645 COc1cccc2c(O)c(S)sc12 Amb27475081 [0,0,0,0,0,0|2,1,0]=3 34 B14R2.11645 COc1cccc2c(S)c(N)sc12 Amb28134255 [0,0,0,0,0,0|3,1,0]=4 35 B14R2.11645 COc1cccc2c1CC(=O)N2C Amb23401984 [0,0,0,0,0,0|2,0,0]=2 36 B14R2.11645 COc1cccc2c1CC(=S)N2C Amb27628775 [0,0,0,0,0,0|2,1,0]=3 37 B14R2.11645 COc1cccc2c1NC(=O)C2=O Amb6515868 [0,0,0,0,0,0|1,0,1]=2 38 B14R2.11645 COc1cccc2c1NC(=O)C2C Amb18243688 [0,0,0,0,0,0|2,0,0]=2 39 B14R2.11645 COc1cccc2c1NC(=O)C2O Amb18791008 [0,0,0,0,0,0|1,0,0]=1 40 B14R2.11645 COc1cccc2c1NC(=O)C2S Amb32788649 [0,0,0,0,0,0|1,1,0]=2 41 B14R2.11645 COc1cccc2c1NC(=O)N2C Amb26316098 [0,0,0,0,0,0|1,0,0]=1 42 B14R2.11645 COc1cccc2c1NC(=O)N2O Amb28246058 [0,0,0,0,0,0|0,0,0]=0 43 B14R2.11645 COc1cccc2c1SC(=O)C2=O Amb27206976 [0,0,0,0,0,0|2,0,1]=3 44 B14R2.11645 COc1cccc2c1cc(C)n2C Amb18065227 [0,0,0,0,0,0|3,0,0]=3 45 B14R2.11645 COc1cccc2c1nc(Cl)n2C Amb26643936 [0,0,0,0,0,0|2,0,1]=3 46 B14R2.11645 COc1cccc2c1nc(N)n2C Amb24070432 [0,0,0,0,0,0|2,0,1]=3 47 B14R2.11645 COc1nccc2c1nc(S)n2C Amb583475 [0,0,0,0,0,0|2,1,1]=4 48 B14R2.11645 CSc1cccc2c(O)c(Cl)sc12 Amb27210362 [0,0,0,0,0,0|3,1,0]=4 49 B14R2.11645 CSc1cccc2c(O)c(I)sc12 Amb27882001 [0,0,0,0,0,0|3,1,0]=4 50 B14R2.11645 CSc1cccc2c(O)c(S)sc12 Amb28347030 [0,0,0,0,0,0|2,2,0]=4 51 B14R2.11645 N#Cc1cccc2c1NC(=O)C2=O Amb6242349 [0,0,0,0,0,0|3,0,1]=4 52 B14R2.11645 O=C1Nc2c(CF)cccc2C1=O Amb19516146 [0,0,0,0,0,0|3,0,1]=4 53 B14R2.11645 O=Cc1cccc2c1NC(=O)C2=O Amb27959066 [0,0,0,0,0,0|3,0,1]=4 54 B13R2.573 COc1cccc2c(N)csc12 Amb23402519 [1,0,0,0,0,0|3,0,0]=4 55 B13R2.573 COc1cccc2c(O)csc12 Amb27634169 [1,0,0,0,0,0|2,0,0]=3 56 B13R2.573 COc1cccc2c1C=CC2=O Amb27177922 [1,0,0,0,0,0|2,0,1]=4 57 B13R2.573 COc1cccc2c1CCC2O Amb17087935 [1,0,0,0,0,0|2,0,1]=4 58 B13R2.573 COc1cccc2c1CCN2C Amb17673961 [1,0,0,0,0,0|2,0,1]=4 59 B13R2.573 COc1cccc2c1COB2O Amb27495717 [1,0,0,0,0,0|3,0,0]=4 60 B13R2.573 COc1cccc2c1NCC2C Amb17040669 [1,0,0,0,0,0|2,0,1]=4 61 B13R2.573 COc1cccc2c1NCC2N Amb27268706 [1,0,0,0,0,0|2,0,1]=4 62 B13R2.573 COc1cccc2c1NNC2=O Amb22235269 [1,0,0,0,0,0|2,0,1]=4 63 B13R2.573 COc1cccc2c1ccn2C Amb8517212 [1,0,0,0,0,0|2,0,0]=3 64 B13R2.573 COc1cccc2c1cnn2C Amb22751752 [1,0,0,0,0,0|3,0,0]=4 65 B13R2.573 COc1ccnc2c1ccn2C Amb23439507 [1,0,0,0,0,0|3,0,0]=4 66 B13R2.573 COc1nccc2c1ccn2C Amb24182067 [1,0,0,0,0,0|3,0,0]=4 67 B13R2.573 N#Cc1cccc2c1ccn2O Amb28250024 [1,0,0,0,0,0|3,0,0]=4 68 B13R2.581 C=Cc1cccc2c1CC(=O)N2 Amb17613838 [1,0,0,0,0,0|2,0,1]=4 69 B13R2.581 CCc1cccc2c1CC(=O)N2 Amb22055211 [1,0,0,0,0,0|2,0,0]=3 70 B13R2.581 CCc1cccc2c1NC(=O)C2 Amb18893456 [1,0,0,0,0,0|2,0,0]=3 71 B13R2.581 CCc1cccc2c1NC(=O)N2 Amb17933375 [1,0,0,0,0,0|1,0,0]=2 72 B13R2.581 CCc1cccc2c1NC(=S)S2 Amb18043597 [1,0,0,0,0,0|2,1,0]=4 73 B13R2.581 CCc1cccc2c1OC(=O)N2 Amb18547327 [1,0,0,0,0,0|2,0,0]=3 74 B13R2.581 CNc1cccc2c1NC(=O)C2 Amb27624965 [1,0,0,0,0,0|2,0,0]=3 75 B13R2.581 COC1=CC=CN2CC(=O)N=C12 Amb29850765 [1,0,0,0,0,0|2,0,1]=4 76 B13R2.581 COc1cccc2c1CC(=O)C2 Amb15692699 [1,0,0,0,0,0|2,0,0]=3 77 B13R2.581 COc1cccc2c1CC(=O)N2 Amb6306523 [1,0,0,0,0,0|1,0,0]=2 78 B13R2.581 COc1cccc2c1CC(C)N2 Amb18062467 [1,0,0,0,0,0|2,0,1]=4 79 B13R2.581 COc1cccc2c1C[C@@H](C)N2 Amb27861464 [1,0,0,0,0,0|2,0,1]=4 80 B13R2.581 COc1cccc2c1NC(=O)C2 Amb8629923 [1,0,0,0,0,0|1,0,0]=2 81 B13R2.581 COc1cccc2c1NC(=O)O2 Amb27193054 [1,0,0,0,0,0|1,0,0]=2 82 B13R2.581 COc1cccc2c1NC(=O)S2 Amb19957945 [1,0,0,0,0,0|1,0,0]=2 83 B13R2.581 COc1cccc2c1NC(=S)O2 Amb22263295 [1,0,0,0,0,0|1,1,0]=3 84 B13R2.581 COc1cccc2c1NC(C)C2 Amb18560743 [1,0,0,0,0,0|2,0,1]=4 85 B13R2.581 COc1cccc2c1OC(=O)N2 Amb26494465 [1,0,0,0,0,0|1,0,0]=2 86 B13R2.581 COc1cccc2nc(=O)nc12 Amb16191902 [1,0,0,0,0,0|0,0,2]=3 87 B13R2.581 COc1cccc2nc(=S)nc12 Amb16192008 [1,0,0,0,0,0|0,1,2]=4 88 B13R2.581 COc1cccc2nc(Br)oc12 Amb27797525 [1,0,0,0,0,0|2,0,1]=4 89 B13R2.581 COc1cccc2nc(C)oc12 Amb25925951 [1,0,0,0,0,0|2,0,1]=4 90 B13R2.581 COc1cccc2nc(Cl)oc12 Amb26527507 [1,0,0,0,0,0|2,0,1]=4 91 B13R2.581 COc1cccc2nc(Cl)sc12 Amb23400032 [1,0,0,0,0,0|2,0,1]=4 92 B13R2.581 COc1cccc2nc(F)oc12 Amb27192622 [1,0,0,0,0,0|2,0,1]=4 93 B13R2.581 COc1cccc2nc(F)sc12 Amb23437206 [1,0,0,0,0,0|2,0,1]=4 94 B13R2.581 COc1cccc2nc(I)oc12 Amb26609195 [1,0,0,0,0,0|2,0,1]=4 95 B13R2.581 COc1cccc2nc(N)sc12 Amb22233921 [1,0,0,0,0,0|2,0,1]=4 96 B13R2.581 COc1cccc2nc(S)sc12 Amb27175770 [1,0,0,0,0,0|1,1,1]=4 97 B13R2.581 COc1cccc2oc(C)nc12 Amb25816342 [1,0,0,0,0,0|2,0,1]=4 98 B13R2.581 COc1cccc2oc(Cl)nc12 Amb26986236 [1,0,0,0,0,0|2,0,1]=4 99 B13R2.581 COc1cccc2oc(F)nc12 Amb26445185 [1,0,0,0,0,0|2,0,1]=4 100 B13R2.581 COc1cccc2oc(I)nc12 Amb27246801 [1,0,0,0,0,0|2,0,1]=4 101 B13R2.581 COc1cccc2oc(N)nc12 Amb26635350 [1,0,0,0,0,0|2,0,1]=4 102 B13R2.581 COc1cccc2oc(O)cc12 Amb24702530 [1,0,0,0,0,0|2,0,1]=4 103 B13R2.581 COc1cccc2sc(Br)cc12 Amb27486751 [1,0,0,0,0,0|3,0,0]=4 104 B13R2.581 COc1cccc2sc(Br)nc12 Amb6307816 [1,0,0,0,0,0|2,0,1]=4 105 B13R2.581 COc1cccc2sc(Cl)nc12 Amb3318914 [1,0,0,0,0,0|2,0,1]=4 106 B13R2.581 COc1cccc2sc(F)nc12 Amb23437202 [1,0,0,0,0,0|2,0,1]=4 107 B13R2.581 COc1cccc2sc(I)nc12 Amb23400010 [1,0,0,0,0,0|2,0,1]=4 108 B13R2.581 COc1cccc2sc(N)cc12 Amb27642746 [1,0,0,0,0,0|3,0,0]=4 109 B13R2.581 COc1cccc2sc(N)nc12 Amb1154883 [1,0,0,0,0,0|2,0,1]=4 110 B13R2.581 COc1cccc2sc(S)nc12 Amb21936854 [1,0,0,0,0,0|1,1,1]=4 111 B13R2.581 COc1ccnc2c1NC(=O)C2 Amb24329871 [1,0,0,0,0,0|2,0,0]=3 112 B13R2.581 COc1cncc2c1NC(=O)N2 Amb28435451 [1,0,0,0,0,0|1,0,0]=2 113 B13R2.581 COc1nccc2c1CC(=O)N2 Amb6308170 [1,0,0,0,0,0|2,0,0]=3 114 B13R2.581 N#Cc1cccc2c1CC(=O)N2 Amb23439676 [1,0,0,0,0,0|3,0,0]=4 115 B13R2.581 N#Cc1cccc2c1NC(=O)C2 Amb8629026 [1,0,0,0,0,0|3,0,0]=4 116 B13R2.581 N#Cc1cccc2c1NC(=O)O2 Amb25257359 [1,0,0,0,0,0|3,0,0]=4 117 B13R2.581 N#Cc1ccnc2c1NC(=O)N2 Amb27966251 [1,0,0,0,0,0|3,0,0]=4 118 B13R2.581 NCc1cccc2c1NC(=O)C2 Amb24331847 [1,0,0,0,0,0|3,0,0]=4 119 B13R2.581 O=C1Cc2c(CO)cccc2N1 Amb28133012 [1,0,0,0,0,0|3,0,0]=4 120 B13R2.581 O=C1Cc2cccc(CO)c2N1 Amb27636206 [1,0,0,0,0,0|3,0,0]=4 121 B13R2.581 O=C1Nc2cccc(CCl)c2N1 Amb25117442 [1,0,0,0,0,0|2,0,0]=3 122 B13R2.581 O=C1Nc2cccc(CO)c2N1 Amb25881987 [1,0,0,0,0,0|2,0,0]=3 123 B13R2.581 O=Cc1cccc2c1CC(=O)N2 Amb18830141 [1,0,0,0,0,0|3,0,0]=4 124 B13R2.581 O=Cc1cccc2c1NC(=O)C2 Amb18830117 [1,0,0,0,0,0|3,0,0]=4 125 B13R2.581 O=Cc1cccc2c1NC(=O)N2 Amb18829869 [1,0,0,0,0,0|2,0,0]=3 126 B13R2.581 O=Cc1cccc2c1OC(=O)N2 Amb33533599 [1,0,0,0,0,0|3,0,0]=4 127 B13R2.581 O=Cc1cccc2c1SC(=O)N2 Amb18824742 [1,0,0,0,0,0|3,0,0]=4 128 B13R2.4825 CC1C(=O)Nc2c(Br)cccc21 Amb18246091 [1,0,0,0,0,0|3,0,0]=4 129 B13R2.4825 CC1C(=O)Nc2c(Cl)cccc21 Amb18243823 [1,0,0,0,0,0|3,0,0]=4 130 B13R2.4825 CC1C(=O)Nc2c(F)cccc21 Amb18893507 [1,0,0,0,0,0|3,0,0]=4 131 B13R2.4825 CC1C(=O)Nc2c(N)cccc21 Amb26577457 [1,0,0,0,0,0|3,0,0]=4 132 B13R2.4825 CC1C(=O)Nc2c(O)cccc21 Amb23571287 [1,0,0,0,0,0|2,0,0]=3 133 B13R2.4825 CN1C(=O)Cc2c(Br)cccc21 Amb10067623 [1,0,0,0,0,0|3,0,0]=4 134 B13R2.4825 CN1C(=O)Cc2c(Cl)cccc21 Amb28244286 [1,0,0,0,0,0|3,0,0]=4 135 B13R2.4825 CN1C(=O)Cc2c(N)cccc21 Amb26854239 [1,0,0,0,0,0|3,0,0]=4 136 B13R2.4825 CN1C(=O)Nc2c(Br)cccc21 Amb22586607 [1,0,0,0,0,0|2,0,0]=3 137 B13R2.4825 CN1C(=O)Nc2c(Br)cncc21 Amb23559953 [1,0,0,0,0,0|3,0,0]=4 138 B13R2.4825 CN1C(=O)Nc2c1ccnc2N Amb18645997 [1,0,0,0,0,0|3,0,0]=4 139 B13R2.4825 CN1C(=O)Oc2c(Br)cccc21 Amb18547407 [1,0,0,0,0,0|3,0,0]=4 140 B13R2.4825 CN1C(=O)Oc2c(Cl)cccc21 Amb18046758 [1,0,0,0,0,0|3,0,0]=4 141 B13R2.4825 CN1C(=O)Oc2c(F)cccc21 Amb18046735 [1,0,0,0,0,0|3,0,0]=4 142 B13R2.4825 CN1C(=O)Oc2c(N)cccc21 Amb18015311 [1,0,0,0,0,0|3,0,0]=4 143 B13R2.4825 CN1C(=O)Oc2c(N)cccc21 Amb30584910 [1,0,0,0,0,0|3,0,0]=4 144 B13R2.4825 CN1C(=O)Oc2c(O)cccc21 Amb28381218 [1,0,0,0,0,0|2,0,0]=3 145 B13R2.4825 CN1C(=S)Nc2c(Br)cccc21 Amb22584180 [1,0,0,0,0,0|2,1,0]=4 146 B13R2.4825 Cc1cccc2c(O)c(I)sc12 Amb27966372 [1,0,0,0,0,0|3,0,0]=4 147 B13R2.4825 Cc1cccc2c1CC(=O)C2C Amb27861350 [1,0,0,0,0,0|3,0,0]=4 148 B13R2.4825 Cc1cccc2c1CC(=O)N2O Amb27413117 [1,0,0,0,0,0|1,0,0]=2 149 B13R2.4825 Cc1cccc2c1CC(=S)N2C Amb28244236 [1,0,0,0,0,0|2,1,0]=4 150 B13R2.4825 Cc1cccc2c1NC(=O)C2=O Amb6315565 [1,0,0,0,0,0|1,0,1]=3 151 B13R2.4825 Cc1cccc2c1NC(=O)C2C Amb17232374 [1,0,0,0,0,0|2,0,0]=3 152 B13R2.4825 Cc1cccc2c1NC(=O)C2N Amb10607561 [1,0,0,0,0,0|2,0,0]=3 153 B13R2.4825 Cc1cccc2c1NC(=O)C2N Amb8503342 [1,0,0,0,0,0|2,0,0]=3 154 B13R2.4825 Cc1cccc2c1NC(=O)C2O Amb18792463 [1,0,0,0,0,0|1,0,0]=2 155 B13R2.4825 Cc1cccc2c1NC(=O)C2S Amb32788155 [1,0,0,0,0,0|1,1,0]=3 156 B13R2.4825 Cc1cccc2c1OC(=O)N2C Amb18547328 [1,0,0,0,0,0|2,0,0]=3 157 B13R2.4825 Cc1cccc2c1nc(C)n2O Amb27615252 [1,0,0,0,0,0|1,0,1]=3 158 B13R2.4825 Cc1cccc2c1nc(N)n2C Amb22500996 [1,0,0,0,0,0|2,0,1]=4 159 B13R2.4825 Cc1nc2c(Cl)cccc2n1O Amb19373208 [1,0,0,0,0,0|2,0,1]=4 160 B13R2.4825 Cc1nc2c(F)cccc2n1O Amb28124077 [1,0,0,0,0,0|2,0,1]=4 161 B13R2.4825 Cc1nc2c(O)cccc2n1C Amb28243900 [1,0,0,0,0,0|2,0,1]=4 162 B13R2.4825 Cc1sc2c(C)cccc2c1O Amb27224433 [1,0,0,0,0,0|3,0,0]=4 163 B13R2.4825 Cn1c(O)nc2c(O)cccc21 Amb24615904 [1,0,0,0,0,0|1,0,2]=4 164 B13R2.4825 NC1C(=O)Nc2c(Cl)cccc21 Amb16186934 [1,0,0,0,0,0|3,0,0]=4 165 B13R2.4825 NC1C(=O)Nc2c(Cl)cccc21 Amb21959809 [1,0,0,0,0,0|3,0,0]=4 166 B13R2.4825 Nc1cccc2c1NC(=O)C2=O Amb27243910 [1,0,0,0,0,0|2,0,1]=4 167 B13R2.4825 O=C1Nc2c(Br)cccc2C1=O Amb1103377 [1,0,0,0,0,0|2,0,1]=4 168 B13R2.4825 O=C1Nc2c(Br)cccc2C1O Amb24706346 [1,0,0,0,0,0|2,0,0]=3 169 B13R2.4825 O=C1Nc2c(Br)cccc2C1S Amb32788321 [1,0,0,0,0,0|2,1,0]=4 170 B13R2.4825 O=C1Nc2c(Cl)cccc2C1=O Amb6486658 [1,0,0,0,0,0|2,0,1]=4 171 B13R2.4825 O=C1Nc2c(Cl)cccc2C1O Amb19045341 [1,0,0,0,0,0|2,0,0]=3 172 B13R2.4825 O=C1Nc2c(Cl)cccc2C1S Amb32788533 [1,0,0,0,0,0|2,1,0]=4 173 B13R2.4825 O=C1Nc2c(F)cccc2C1=O Amb6549905 [1,0,0,0,0,0|2,0,1]=4 174 B13R2.4825 O=C1Nc2c(F)cccc2C1O Amb18177845 [1,0,0,0,0,0|2,0,0]=3 175 B13R2.4825 O=C1Nc2c(F)cccc2C1S Amb32788613 [1,0,0,0,0,0|2,1,0]=4 176 B13R2.4825 O=C1Nc2c(F)cccc2N1O Amb27633417 [1,0,0,0,0,0|1,0,0]=2 177 B13R2.4825 O=C1Nc2c(I)cccc2C1=O Amb33543163 [1,0,0,0,0,0|2,0,1]=4 178 B13R2.4825 O=C1Nc2c(I)cccc2C1O Amb32677074 [1,0,0,0,0,0|2,0,0]=3 179 B13R2.4825 O=C1Nc2c(O)cccc2C1=O Amb27590902 [1,0,0,0,0,0|1,0,1]=3 180 B13R2.4825 Oc1c(Cl)sc2c(O)cccc12 Amb27192764 [1,0,0,0,0,0|3,0,0]=4 181 B15R2.5747 COc1c(Br)ccc2c1CC(=O)N2C Amb25052304 [0,1,0,0,0,0|2,0,0]=3 182 B15R2.5747 COc1c(Br)ccc2c1NC(=O)C2=O Amb27877626 [0,1,0,0,0,0|1,0,1]=3 183 B15R2.5747 COc1c(F)ccc2c1NC(=O)C2=O Amb27805351 [0,1,0,0,0,0|1,0,1]=3 184 B15R2.11939 CCNc1cccc2c1OC(=O)N2C Amb27456002 [0,1,0,0,0,0|3,0,0]=4 185 B15R2.11939 CCOc1cccc2c1NC(=O)C2=O Amb1132971 [0,1,0,0,0,0|1,0,1]=3 186 B15R2.11939 CCOc1cccc2c1NC(=O)C2O Amb19041967 [0,1,0,0,0,0|1,0,0]=2 187 B15R2.11939 CCOc1cccc2c1NC(=O)N2O Amb28251661 [0,1,0,0,0,0|0,0,0]=1 188 B15R2.11939 CCOc1cccc2c1nc(N)n2C Amb27412092 [0,1,0,0,0,0|2,0,1]=4 189 B15R2.11939 CN1C(=O)Oc2c(CCN)cccc21 Amb18817490 [0,1,0,0,0,0|3,0,0]=4 190 B15R2.20823 CCc1cccc2c1NC(=O)C2C=O Amb28048148 [0,1,0,0,0,0|2,0,1]=4 191 B15R2.20823 CCc1cccc2c1NC(=O)C2CN Amb18063007 [0,1,0,0,0,0|3,0,0]=4 192 B15R2.20823 CCc1cccc2c1NC(=O)\C2=C/O Amb17039816 [0,1,0,0,0,0|2,0,0]=3 193 B15R2.20823 CCc1cccc2c1NC(=O)\C2=N/O Amb3492465 [0,1,0,0,0,0|2,0,0]=3 194 B15R2.20823 CCn1c(S)nc2c(OC)cccc21 Amb28133275 [0,1,0,0,0,0|1,1,1]=4 195 B15R2.20823 COc1c(C)sc2c(OC)cccc12 Amb27489885 [0,1,0,0,0,0|3,0,0]=4 196 B15R2.20823 COc1c(Cl)sc2c(OC)cccc12 Amb27616596 [0,1,0,0,0,0|3,0,0]=4 197 B15R2.20823 COc1c(F)sc2c(OC)cccc12 Amb27623980 [0,1,0,0,0,0|3,0,0]=4 198 B15R2.20823 COc1c(I)sc2c(OC)cccc12 Amb27624017 [0,1,0,0,0,0|3,0,0]=4 199 B15R2.20823 COc1c(N)sc2c(OC)cccc12 Amb27438914 [0,1,0,0,0,0|3,0,0]=4 200 B15R2.20823 COc1c(O)sc2c(OC)cccc12 Amb27192950 [0,1,0,0,0,0|2,0,1]=4 201 B15R2.20823 COc1c(S)sc2c(OC)cccc12 Amb27966538 [0,1,0,0,0,0|2,1,0]=4 202 B15R2.20823 COc1cccc2c(CO)c(Br)sc12 Amb27964001 [0,1,0,0,0,0|3,0,0]=4 203 B15R2.20823 COc1cccc2c(CO)c(F)sc12 Amb27620590 [0,1,0,0,0,0|3,0,0]=4 204 B15R2.20823 COc1cccc2c(CO)c(O)sc12 Amb28290853 [0,1,0,0,0,0|2,0,1]=4 205 B15R2.20823 COc1cccc2c(CO)c(S)sc12 Amb28345813 [0,1,0,0,0,0|2,1,0]=4 206 B15R2.20823 COc1cccc2c1NC(=O)C2C=O Amb8010579 [0,1,0,0,0,0|1,0,1]=3 207 B15R2.20823 COc1cccc2c1NC(=O)C2CN Amb17235357 [0,1,0,0,0,0|2,0,0]=3 208 B15R2.20823 COc1cccc2c1NC(=O)C2SC Amb28388646 [0,1,0,0,0,0|1,1,0]=3 209 B15R2.20823 COc1cccc2c1NC(=O)\C2=N\O Amb26909075 [0,1,0,0,0,0|1,0,0]=2 210 B15R2.20825 CNc1cc2c(OC)cccc2n1C Amb28254676 [0,1,0,0,0,0|3,0,0]=4 211 B15R2.20825 COc1cccc2c(Br)c(C=O)sc12 Amb27430221 [0,1,0,0,0,0|3,0,0]=4 212 B15R2.20825 COc1cccc2c(Cl)c(C=O)sc12 Amb18758490 [0,1,0,0,0,0|3,0,0]=4 213 B15R2.20825 COc1cccc2c(F)c(C=O)sc12 Amb27438771 [0,1,0,0,0,0|3,0,0]=4 214 B15R2.20825 COc1cccc2c(O)c(C#N)oc12 Amb18650078 [0,1,0,0,0,0|3,0,0]=4 215 B15R2.20825 COc1cccc2c(O)c(C#N)sc12 Amb27778946 [0,1,0,0,0,0|3,0,0]=4 216 B15R2.20825 COc1cccc2c(O)c(C=O)sc12 Amb28422814 [0,1,0,0,0,0|2,0,0]=3 217 B15R2.20825 COc1cccc2c1nc(C=O)n2C Amb18819582 [0,1,0,0,0,0|1,0,1]=3 218 B15R2.20825 COc1ccnc2c1nc(C=O)n2C Amb27445252 [0,1,0,0,0,0|2,0,1]=4 219 B15R2.20825 COc1sc2c(OC)cccc2c1O Amb27782779 [0,1,0,0,0,0|2,0,1]=4 220 B15R2.20826 CCc1cccc2c1NC(=O)C2(C)C Amb18893910 [0,1,0,0,0,0|3,0,0]=4 221 B15R2.20826 COc1cccc2c1NC(=O)C2(Br)Br Amb27398351 [0,1,0,0,0,0|2,0,0]=3 222 B15R2.20826 COc1cccc2c1NC(=O)C2(C)C Amb18894079 [0,1,0,0,0,0|2,0,0]=3 223 B15R2.20826 COc1cccc2c1NC(=O)C2(C)N Amb27182792 [0,1,0,0,0,0|2,0,0]=3 224 B15R2.22165 COc1ccc(Br)c2c1NC(=O)C2=O Amb21963929 [0,1,0,0,0,0|1,0,1]=3 225 B15R2.22165 COc1ccc(C)c2c1NC(=O)C2=O Amb33543100 [0,1,0,0,0,0|1,0,1]=3 226 B15R2.22165 COc1ccc(C)c2c1NC(=O)C2C Amb18894085 [0,1,0,0,0,0|2,0,0]=3 227 B15R2.22165 COc1ccc(Cl)c2c1CC(=O)N2C Amb28348615 [0,1,0,0,0,0|2,0,0]=3 228 B15R2.22165 COc1ccc(Cl)c2c1NC(=O)C2=O Amb33552383 [0,1,0,0,0,0|1,0,1]=3 229 B15R2.22165 COc1ccc(Cl)c2c1NC(=O)C2O Amb28141056 [0,1,0,0,0,0|1,0,0]=2 230 B15R2.22624 CCc1cc(Br)cc2c1NC(=O)C2=O Amb1093101 [0,1,0,0,0,0|2,0,1]=4 231 B15R2.22624 CCc1cc(Br)cc2c1NC(=O)C2O Amb28349161 [0,1,0,0,0,0|2,0,0]=3 232 B15R2.22624 CCc1cc(Br)cc2c1OC(=O)N2C Amb18547470 [0,1,0,0,0,0|3,0,0]=4 233 B15R2.22624 CCc1cc(Cl)cc2c1NC(=O)C2=O Amb33469910 [0,1,0,0,0,0|2,0,1]=4 234 B15R2.22624 CCc1cc(N)cc2c1OC(=O)N2C Amb18547366 [0,1,0,0,0,0|3,0,0]=4 235 B15R2.22624 COc1cc(Br)cc2c1NC(=O)C2=O Amb25250747 [0,1,0,0,0,0|1,0,1]=3 236 B15R2.22624 COc1cc(C)cc2c1NC(=O)C2=O Amb18894042 [0,1,0,0,0,0|1,0,1]=3 237 B15R2.22624 COc1cc(C)cc2c1NC(=O)C2C Amb18894082 [0,1,0,0,0,0|2,0,0]=3 238 B15R2.22624 COc1cc(C)cc2c1NC(=O)C2N Amb18894185 [0,1,0,0,0,0|2,0,0]=3 239 B15R2.22624 COc1cc(Cl)cc2c1NC(=O)C2=O Amb33469908 [0,1,0,0,0,0|1,0,1]=3 240 B15R2.22624 COc1cc(F)cc2c1NC(=O)C2=O Amb18321305 [0,1,0,0,0,0|1,0,1]=3 241 B15R2.45730 CC(=O)c1cccc2c1OC(=O)N2C Amb18547347 [0,1,0,0,0,0|3,0,0]=4 242 B15R2.45730 CC(C)c1cccc2c1NC(=O)C2=O Amb1135758 [0,1,0,0,0,0|2,0,1]=4 243 B15R2.45730 CC(C)c1cccc2c1NC(=O)C2N Amb18278969 [0,1,0,0,0,0|3,0,0]=4 244 B15R2.45730 CC(C)c1cccc2c1NC(=O)C2O Amb19041150 [0,1,0,0,0,0|2,0,0]=3 245 B15R2.45730 CC(C)c1cccc2c1OC(=O)N2C Amb18547353 [0,1,0,0,0,0|3,0,0]=4 246 B15R2.45730 CN1C(=O)Nc2c(C(=O)O)cccc21 Amb28066624 [0,1,0,0,0,0|3,0,0]=4 247 B15R2.45730 O=C(O)c1cccc2c1CC(=O)N2O Amb27165687 [0,1,0,0,0,0|3,0,0]=4 248 B15R2.45730 O=C(O)c1cccc2c1NC(=O)C2O Amb24761414 [0,1,0,0,0,0|3,0,0]=4 249 B15R2.45730 O=C1Nc2c(cccc2[N+](=O)[O-])N1O Amb27970901 [0,1,0,0,0,0|2,0,0]=3 250 B15R2.86993 CCc1cccc2c1N(C)C(=O)C2=O Amb18893877 [0,1,0,0,0,0|2,0,1]=4 251 B15R2.86993 CCc1cccc2c1N(C)C(=O)C2N Amb18894018 [0,1,0,0,0,0|3,0,0]=4 252 B15R2.86993 CN1C(=O)N(C)c2c(CCl)cccc21 Amb27747854 [0,1,0,0,0,0|3,0,0]=4 253 B15R2.86993 CN1C(=O)N(C)c2c(CO)cccc21 Amb27257968 [0,1,0,0,0,0|3,0,0]=4 254 B15R2.86993 COc1cccc2c(Br)c(C)n(C)c12 Amb18065248 [0,1,0,0,0,0|3,0,0]=4 255 B15R2.86993 COc1cccc2c1C(=O)C(=O)N2C Amb28042527 [0,1,0,0,0,0|2,0,0]=3 256 B15R2.86993 COc1cccc2c1C(C)C(=N)N2C Amb27481743 [0,1,0,0,0,0|3,0,0]=4 257 B15R2.86993 COc1cccc2c1N(C)C(=O)C2=O Amb18894043 [0,1,0,0,0,0|1,0,1]=3 258 B15R2.86993 COc1cccc2c1N(C)C(=O)C2N Amb18894186 [0,1,0,0,0,0|2,0,0]=3 259 B15R2.86993 COc1cccc2c1c(Br)c(C)n2C Amb18563299 [0,1,0,0,0,0|3,0,0]=4 260 B13R1.82 C=CC(=O)c1cccc(OC)c1N Amb27629921 [0,0,1,0,0,0|2,0,1]=4 261 B13R1.82 C=CC(O)c1cccc(OC)c1Br Amb33387109 [0,0,1,0,0,0|3,0,0]=4 262 B13R1.82 C=CC(O)c1cccc(OC)c1C Amb33269968 [0,0,1,0,0,0|3,0,0]=4 263 B13R1.82 C=CC(O)c1cccc(OC)c1O Amb27805339 [0,0,1,0,0,0|3,0,0]=4 264 B13R1.82 COc1cccc(C(C)C=O)c1Br Amb33387127 [0,0,1,0,0,0|3,0,0]=4 265 B13R1.82 COc1cccc(C(C)C=O)c1C Amb33268403 [0,0,1,0,0,0|3,0,0]=4 266 B13R1.82 COc1cccc(C(C)C=O)c1O Amb33427399 [0,0,1,0,0,0|3,0,0]=4 267 B13R1.82 COc1cccc(C(O)C=O)c1F Amb27426960 [0,0,1,0,0,0|2,0,0]=3 268 B13R1.82 COc1cccc(N(C)OC)c1N Amb27761368 [0,0,1,0,0,0|3,0,0]=4 269 B13R1.82 COc1nccc(C(O)C=O)c1F Amb27454412 [0,0,1,0,0,0|3,0,0]=4 270 B13R1.91 C#CC(=O)Cc1ccccc1OC Amb27391517 [0,0,1,0,0,0|3,0,0]=4 271 B13R1.91 C#CC(=O)Nc1ccccc1OC Amb28282382 [0,0,1,0,0,0|2,0,0]=3 272 B13R1.91 C#CC(=O)Nc1ccccc1SC Amb28251180 [0,0,1,0,0,0|2,1,0]=4 273 B13R1.91 C#CC(=O)Oc1ccccc1OC Amb28051489 [0,0,1,0,0,0|3,0,0]=4 274 B13R1.91 C#Cc1ccccc1CC(=O)NO Amb27467041 [0,0,1,0,0,0|2,0,1]=4 275 B13R1.91 C=CC(=O)Nc1ccccc1OC Amb6843676 [0,0,1,0,0,0|2,0,0]=3 276 B13R1.91 C=CC(=O)Nc1cnccc1OC Amb28078725 [0,0,1,0,0,0|3,0,0]=4 277 B13R1.91 C=Cc1ccccc1NC(=O)NN Amb27166069 [0,0,1,0,0,0|2,0,1]=4 278 B13R1.91 CCC(=O)Cc1ccccc1OC Amb17477454 [0,0,1,0,0,0|3,0,0]=4 279 B13R1.91 CCC(=O)Nc1ccccc1CC Amb2660688 [0,0,1,0,0,0|3,0,0]=4 280 B13R1.91 CCC(=O)Nc1ccccc1OC Amb3097302 [0,0,1,0,0,0|2,0,0]=3 281 B13R1.91 CCC(=O)Nc1ccccc1SC Amb8337442 [0,0,1,0,0,0|2,1,0]=4 282 B13R1.91 CCC(=O)Oc1ccccc1OC Amb24079979 [0,0,1,0,0,0|3,0,0]=4 283 B13R1.91 CCC(=S)Nc1ccccc1OC Amb27596938 [0,0,1,0,0,0|2,1,0]=4 284 B13R1.91 CCc1ccccc1CC(=O)NC Amb28051004 [0,0,1,0,0,0|3,0,0]=4 285 B13R1.91 CCc1ccccc1NC(=N)NC Amb18804671 [0,0,1,0,0,0|3,0,0]=4 286 B13R1.91 CCc1ccccc1NC(=O)CBr Amb16229989 [0,0,1,0,0,0|3,0,0]=4 287 B13R1.91 CCc1ccccc1NC(=O)CCl Amb6337126 [0,0,1,0,0,0|3,0,0]=4 288 B13R1.91 CCc1ccccc1NC(=O)CI Amb16207227 [0,0,1,0,0,0|3,0,0]=4 289 B13R1.91 CCc1ccccc1NC(=O)CN Amb2283961 [0,0,1,0,0,0|3,0,0]=4 290 B13R1.91 CCc1ccccc1NC(=O)CN Amb2370805 [0,0,1,0,0,0|3,0,0]=4 291 B13R1.91 CCc1ccccc1NC(=O)CO Amb1111084 [0,0,1,0,0,0|2,0,0]=3 292 B13R1.91 CCc1ccccc1NC(=O)CS Amb843724 [0,0,1,0,0,0|2,1,0]=4 293 B13R1.91 CCc1ccccc1NC(=O)NC Amb4018380 [0,0,1,0,0,0|2,0,0]=3 294 B13R1.91 CCc1ccccc1NC(=O)NN Amb8854098 [0,0,1,0,0,0|2,0,0]=3 295 B13R1.91 CCc1ccccc1NC(=O)OC Amb17797921 [0,0,1,0,0,0|3,0,0]=4 296 B13R1.91 CCc1ccccc1NC(=S)NN Amb1663431 [0,0,1,0,0,0|2,1,0]=4 297 B13R1.91 CCc1ccccc1N\C(N)=N\O Amb18186381 [0,0,1,0,0,0|2,0,1]=4 298 B13R1.91 CCc1ccccc1OC(=O)NC Amb27849649 [0,0,1,0,0,0|3,0,0]=4 299 B13R1.91 CNC(=N)Cc1ccccc1OC Amb27489338 [0,0,1,0,0,0|3,0,0]=4 300 B13R1.91 CNC(=N)Nc1ccccc1OC Amb18184509 [0,0,1,0,0,0|2,0,0]=3 301 B13R1.91 CNC(=N)Nc1ccccc1SC Amb27750614 [0,0,1,0,0,0|2,1,0]=4 302 B13R1.91 CNC(=O)Cc1ccccc1NC Amb18303208 [0,0,1,0,0,0|3,0,0]=4 303 B13R1.91 CNC(=O)Cc1ccccc1SC Amb27604985 [0,0,1,0,0,0|2,1,0]=4 304 B13R1.91 CNC(=O)Cc1ncccc1OC Amb28126427 [0,0,1,0,0,0|3,0,0]=4 305 B13R1.91 CNC(=O)Nc1ccccc1NC Amb28322110 [0,0,1,0,0,0|2,0,0]=3 306 B13R1.91 CNC(=O)Nc1ccccc1OC Amb4018271 [0,0,1,0,0,0|1,0,0]=2 307 B13R1.91 CNC(=O)Nc1cccnc1OC Amb28198443 [0,0,1,0,0,0|2,0,0]=3 308 B13R1.91 CNC(=O)Nc1cncnc1OC Amb27254999 [0,0,1,0,0,0|3,0,0]=4 309 B13R1.91 CNC(=O)Oc1ccccc1OC Amb26632219 [0,0,1,0,0,0|2,0,0]=3 310 B13R1.91 CNC(=S)Nc1ccccc1SC Amb4880115 [0,0,1,0,0,0|1,2,0]=4 311 B13R1.91 CNC(=S)Nc1cnccc1OC Amb27188322 [0,0,1,0,0,0|2,1,0]=4 312 B13R1.91 COC(=O)Cc1ccccc1OC Amb2209405 [0,0,1,0,0,0|3,0,0]=4 313 B13R1.91 COC(=O)Nc1ccccc1OC Amb17788260 [0,0,1,0,0,0|2,0,0]=3 314 B13R1.91 COC(=S)Nc1ccccc1OC Amb27758817 [0,0,1,0,0,0|2,1,0]=4 315 B13R1.91 COc1ccccc1CC(=O)CCl Amb17139726 [0,0,1,0,0,0|3,0,0]=4 316 B13R1.91 COc1ccccc1CC(=O)CO Amb18065904 [0,0,1,0,0,0|2,0,0]=3 317 B13R1.91 COc1ccccc1CC(=O)NN Amb845414 [0,0,1,0,0,0|2,0,0]=3 318 B13R1.91 COc1ccccc1CC(=O)NO Amb8827858 [0,0,1,0,0,0|1,0,0]=2 319 B13R1.91 COc1ccccc1C\C(N)=N\O Amb4157161 [0,0,1,0,0,0|2,0,1]=4 320 B13R1.91 COc1ccccc1NC(=O)CBr Amb6542254 [0,0,1,0,0,0|2,0,0]=3 321 B13R1.91 COc1ccccc1NC(=O)CCl Amb6337137 [0,0,1,0,0,0|2,0,0]=3 322 B13R1.91 COc1ccccc1NC(=O)CN Amb15740881 [0,0,1,0,0,0|2,0,0]=3 323 B13R1.91 COc1ccccc1NC(=O)CN Amb6336815 [0,0,1,0,0,0|2,0,0]=3 324 B13R1.91 COc1ccccc1NC(=O)CO Amb1111431 [0,0,1,0,0,0|1,0,0]=2 325 B13R1.91 COc1ccccc1NC(=O)CS Amb2589781 [0,0,1,0,0,0|1,1,0]=3 326 B13R1.91 COc1ccccc1NC(=O)NO Amb4002330 [0,0,1,0,0,0|0,0,0]=1 327 B13R1.91 COc1ccccc1NC(=S)NN Amb6355861 [0,0,1,0,0,0|1,1,0]=3 328 B13R1.91 COc1ccccc1N\C(N)=N\O Amb18186797 [0,0,1,0,0,0|1,0,1]=3 329 B13R1.91 COc1ccccc1OC(=O)CN Amb19115310 [0,0,1,0,0,0|3,0,0]=4 330 B13R1.91 COc1ccccc1OC(=O)NN Amb28045705 [0,0,1,0,0,0|2,0,0]=3 331 B13R1.91 COc1cccnc1NC(=O)CCl Amb28207080 [0,0,1,0,0,0|3,0,0]=4 332 B13R1.91 COc1ccncc1NC(=O)CCl Amb27598390 [0,0,1,0,0,0|3,0,0]=4 333 B13R1.91 COc1ncccc1NC(=O)CBr Amb28317834 [0,0,1,0,0,0|3,0,0]=4 334 B13R1.91 CSc1ccccc1NC(=O)CBr Amb17325330 [0,0,1,0,0,0|2,1,0]=4 335 B13R1.91 CSc1ccccc1NC(=O)CCl Amb1641115 [0,0,1,0,0,0|2,1,0]=4 336 B13R1.91 CSc1ccccc1NC(=O)CN Amb9215721 [0,0,1,0,0,0|2,1,0]=4 337 B13R1.91 CSc1ccccc1NC(=O)CO Amb1110515 [0,0,1,0,0,0|1,1,0]=3 338 B13R1.91 CSc1ccccc1NC(=O)NN Amb27475849 [0,0,1,0,0,0|1,1,0]=3 339 B13R1.91 CSc1ccccc1NC(=S)NN Amb27956068 [0,0,1,0,0,0|1,2,0]=4 340 B13R1.91 N#Cc1ccccc1NC(=O)CO Amb1110947 [0,0,1,0,0,0|3,0,0]=4 341 B13R1.91 N#Cc1ccccc1NC(=O)NN Amb18065604 [0,0,1,0,0,0|3,0,0]=4 342 B13R1.91 NCc1ccccc1CC(=O)NO Amb27609057 [0,0,1,0,0,0|3,0,0]=4 343 B13R1.642 C=C(C(=O)O)c1cccc(OC)c1 Amb17322172 [0,0,1,0,0,0|3,0,0]=4 344 B13R1.642 CC(=O)N(O)c1cccc(C=O)c1 Amb28202169 [0,0,1,0,0,0|3,0,0]=4 345 B13R1.642 CCc1cccc(C(O)C(=O)O)c1 Amb25826817 [0,0,1,0,0,0|3,0,0]=4 346 B13R1.642 CN(C(N)=O)c1cccc(C=O)c1 Amb27959039 [0,0,1,0,0,0|3,0,0]=4 347 B13R1.642 CN(C(N)=O)c1cccc(CN)c1 Amb18288180 [0,0,1,0,0,0|3,0,0]=4 348 B13R1.642 CNc1cccc(N(C)C(C)=O)c1 Amb28045401 [0,0,1,0,0,0|3,0,0]=4 349 B13R1.642 COc1cc(C(=O)C(N)=O)ccn1 Amb28145864 [0,0,1,0,0,0|2,0,1]=4 350 B13R1.642 COc1cc(C(O)C(=O)O)ccn1 Amb33320575 [0,0,1,0,0,0|3,0,0]=4 351 B13R1.642 COc1cccc(C(=O)C(=O)Cl)c1 Amb28246093 [0,0,1,0,0,0|2,0,1]=4 352 B13R1.642 COc1cccc(C(=O)C(=O)O)c1 Amb17233652 [0,0,1,0,0,0|2,0,1]=4 353 B13R1.642 COc1cccc(C(=O)C(C)=O)c1 Amb17400648 [0,0,1,0,0,0|2,0,1]=4 354 B13R1.642 COc1cccc(C(Br)C(C)=O)c1 Amb24696782 [0,0,1,0,0,0|3,0,0]=4 355 B13R1.642 COc1cccc(C(C)C(=O)O)c1 Amb10609980 [0,0,1,0,0,0|3,0,0]=4 356 B13R1.642 COc1cccc(C(C)C(N)=O)c1 Amb26974273 [0,0,1,0,0,0|2,0,0]=3 357 B13R1.642 COc1cccc(C(Cl)C(=O)O)c1 Amb17237177 [0,0,1,0,0,0|3,0,0]=4 358 B13R1.642 COc1cccc(C(F)C(=O)O)c1 Amb25697175 [0,0,1,0,0,0|3,0,0]=4 359 B13R1.642 COc1cccc(C(N)C(=O)O)c1 Amb24331707 [0,0,1,0,0,0|3,0,0]=4 360 B13R1.642 COc1cccc(C(N)C(=O)O)c1 Amb9724609 [0,0,1,0,0,0|3,0,0]=4 361 B13R1.642 COc1cccc(C(N)C(N)=O)c1 Amb17335408 [0,0,1,0,0,0|2,0,0]=3 362 B13R1.642 COc1cccc(C(O)C(=O)O)c1 Amb17233884 [0,0,1,0,0,0|2,0,0]=3 363 B13R1.642 COc1cccc(C(O)C(=O)O)n1 Amb33202183 [0,0,1,0,0,0|3,0,0]=4 364 B13R1.642 COc1cccc(C(O)C(C)=O)c1 Amb26022461 [0,0,1,0,0,0|2,0,0]=3 365 B13R1.642 COc1cccc(C(O)C(C)N)c1 Amb33456883 [0,0,1,0,0,0|2,0,1]=4 366 B13R1.642 COc1cccc(C(O)C(C)N)c1 Amb6740241 [0,0,1,0,0,0|2,0,1]=4 367 B13R1.642 COc1cccc(C(O)C(N)=O)c1 Amb18186778 [0,0,1,0,0,0|1,0,0]=2 368 B13R1.642 COc1cccc(C(O)[C@@H](C)N)c1 Amb35617674 [0,0,1,0,0,0|2,0,1]=4 369 B13R1.642 COc1cccc(C(O)[C@H](C)N)c1 Amb35588767 [0,0,1,0,0,0|2,0,1]=4 370 B13R1.642 COc1cccc(N(C)C(=N)N)c1 Amb18791036 [0,0,1,0,0,0|2,0,0]=3 371 B13R1.642 COc1cccc(N(C)C(=S)Cl)c1 Amb2689247 [0,0,1,0,0,0|2,1,0]=4 372 B13R1.642 COc1cccc(N(C)C(N)=O)c1 Amb18178818 [0,0,1,0,0,0|1,0,0]=2 373 B13R1.642 COc1cccc(N(N)C(C)=O)c1 Amb18564125 [0,0,1,0,0,0|2,0,0]=3 374 B13R1.642 COc1cccc([C@@H](C)C(=O)O)c1 Amb25708368 [0,0,1,0,0,0|3,0,0]=4 375 B13R1.642 COc1cccc([C@@H](F)C(=O)O)c1 Amb27974229 [0,0,1,0,0,0|3,0,0]=4 376 B13R1.642 COc1cccc([C@@H](N)C(=O)O)c1 Amb26519833 [0,0,1,0,0,0|3,0,0]=4 377 B13R1.642 COc1cccc([C@@H](N)C(N)=O)c1 Amb27179274 [0,0,1,0,0,0|2,0,0]=3 378 B13R1.642 COc1cccc([C@H](C)C(=O)O)c1 Amb26338005 [0,0,1,0,0,0|3,0,0]=4 379 B13R1.642 COc1cccc([C@H](C)C(C)=O)c1 Amb28246542 [0,0,1,0,0,0|3,0,0]=4 380 B13R1.642 COc1cccc([C@H](N)C(=O)O)c1 Amb25858620 [0,0,1,0,0,0|3,0,0]=4 381 B13R1.642 COc1cccc([C@H](N)C(N)=O)c1 Amb28366199 [0,0,1,0,0,0|2,0,0]=3 382 B13R1.642 COc1cccc([C@H](O)C(=O)O)c1 Amb27477890 [0,0,1,0,0,0|2,0,0]=3 383 B13R1.642 COc1ccnc(C(O)C(=O)O)c1 Amb33319062 [0,0,1,0,0,0|3,0,0]=4 384 B13R1.642 COc1cncc(C(Cl)C(N)=O)c1 Amb35667201 [0,0,1,0,0,0|3,0,0]=4 385 B13R1.642 COc1cncc(C(N)C(N)=O)c1 Amb35667204 [0,0,1,0,0,0|3,0,0]=4 386 B13R1.642 COc1cncc(C(O)C(=O)O)c1 Amb28123869 [0,0,1,0,0,0|3,0,0]=4 387 B13R1.642 COc1cncc(C(O)C(N)=O)c1 Amb35665389 [0,0,1,0,0,0|2,0,0]=3 388 B13R1.642 CSc1cccc(C(O)C(=O)O)c1 Amb26356330 [0,0,1,0,0,0|2,1,0]=4 389 B13R1.642 CSc1cccc(N(C)C(C)=O)c1 Amb27589688 [0,0,1,0,0,0|2,1,0]=4 390 B13R1.642 CSc1cccc(N(C)C(N)=S)c1 Amb20668172 [0,0,1,0,0,0|1,2,0]=4 391 B13R1.3904 CCc1cccc(CC)c1NC=O Amb25824627 [0,0,1,0,0,0|3,0,0]=4 392 B13R1.3904 COc1cccc(OC)c1CC=O Amb33449545 [0,0,1,0,0,0|3,0,0]=4 393 B13R1.3904 COc1cccc(OC)c1NC=O Amb27640756 [0,0,1,0,0,0|2,0,0]=3 394 B15R3.6576 O=C1C(=O)N2CCc3cccc1c32 Amb25370641 [0,0,0,1,0,0|2,0,1]=4 395 B13R2.1628 COc1cccc2c1C(=O)C2=O Amb21948296 [0,0,0,0,1,0|1,0,1]=3 396 B13R2.1628 COc1cccc2c1C(=O)C2C Amb28126607 [0,0,0,0,1,0|2,0,0]=3 397 B15R2.20926 CCc1cccc2c1OCC(=O)N2C Amb17570533 [0,0,0,0,0,1|3,0,0]=4 398 B15R2.20926 COc1cccc2c(O)c(Br)ccc12 Amb18559383 [0,0,0,0,0,1|3,0,0]=4 399 B15R2.20926 COc1cccc2c(O)c(Br)cnc12 Amb10241116 [0,0,0,0,0,1|2,0,1]=4 400 B15R2.20926 COc1cccc2c(O)c(C)ccc12 Amb18063863 [0,0,0,0,0,1|3,0,0]=4 401 B15R2.20926 COc1cccc2c(O)c(C)cnc12 Amb18561807 [0,0,0,0,0,1|2,0,1]=4 402 B15R2.20926 COc1cccc2c(O)c(I)nnc12 Amb32641970 [0,0,0,0,0,1|2,0,1]=4 403 B15R2.20926 COc1cccc2c1CCC(=O)C2C Amb4012266 [0,0,0,0,0,1|3,0,0]=4 404 B15R2.20926 COc1cccc2c1NN=C(Br)C2=O Amb23454439 [0,0,0,0,0,1|2,0,1]=4 405 B15R2.20937 CCc1cccc2c1NC(=O)C=C2O Amb26939824 [0,0,0,0,0,1|2,0,0]=3 406 B15R2.20937 CCc1cccc2c1NC(=O)CC2=O Amb35727418 [0,0,0,0,0,1|2,0,1]=4 407 B15R2.20937 CCc1cccc2c1NC(=O)NC2=O Amb27746938 [0,0,0,0,0,1|2,0,1]=4 408 B15R2.20937 CCc1cccc2c1OC(=O)C=C2O Amb32676116 [0,0,0,0,0,1|3,0,0]=4 409 B15R2.20937 CN1CC(=O)Nc2c(C#N)cccc21 Amb27404695 [0,0,0,0,0,1|3,0,0]=4 410 B15R2.20937 COc1cccc2c(O)cc(C)nc12 Amb1030392 [0,0,0,0,0,1|2,0,1]=4 411 B15R2.20937 COc1cccc2c(O)cc(N)nc12 Amb27482948 [0,0,0,0,0,1|2,0,1]=4 412 B15R2.20937 COc1cccc2c(O)cc(O)nc12 Amb22437589 [0,0,0,0,0,1|1,0,2]=4 413 B15R2.20937 COc1cccc2c(O)nc(O)nc12 Amb22494992 [0,0,0,0,0,1|1,0,2]=4 414 B15R2.20937 COc1cccc2c1CC(=O)NC2=O Amb17470767 [0,0,0,0,0,1|2,0,1]=4 415 B15R2.20937 COc1cccc2c1CC(=O)OC2=O Amb17470805 [0,0,0,0,0,1|2,0,1]=4 416 B15R2.20937 COc1cccc2c1NC(=O)C=C2C Amb18001457 [0,0,0,0,0,1|2,0,0]=3 417 B15R2.20937 COc1cccc2c1NC(=O)C=C2N Amb26944783 [0,0,0,0,0,1|2,0,0]=3 418 B15R2.20937 COc1cccc2c1NC(=O)CC2=O Amb25731808 [0,0,0,0,0,1|1,0,1]=3 419 B15R2.20937 COc1cccc2c1NC(=O)CC2C Amb27464481 [0,0,0,0,0,1|2,0,0]=3 420 B15R2.20937 COc1cccc2c1NC(=O)CN2C Amb23403133 [0,0,0,0,0,1|1,0,0]=2 421 B15R2.20937 COc1cccc2c1NC(=O)OC2=O Amb19888416 [0,0,0,0,0,1|1,0,1]=3 422 B15R2.20937 COc1cccc2c1NC(=S)C=C2C Amb18372528 [0,0,0,0,0,1|2,1,0]=4 423 B15R2.20937 COc1cccc2c1NC(=S)NC2C Amb28397344 [0,0,0,0,0,1|2,1,0]=4 424 B15R2.20937 COc1cccc2c1NC(C)=CC2=O Amb19047363 [0,0,0,0,0,1|2,0,1]=4 425 B15R2.20937 COc1cccc2c1NC(N)=NC2=O Amb24636797 [0,0,0,0,0,1|2,0,1]=4 426 B15R2.20937 COc1cccc2c1OC(=O)C=C2O Amb26858975 [0,0,0,0,0,1|2,0,0]=3 427 B15R2.20937 COc1ncnc2c1NC(=O)CN2C Amb27788900 [0,0,0,0,0,1|3,0,0]=4 428 B15R2.86973 CCc1cccc2c1NC(=O)C(F)=C2 Amb22547232 [0,0,0,0,0,1|3,0,0]=4 429 B15R2.86973 CCc1cccc2c1NC(=O)C(N)C2 Amb25267594 [0,0,0,0,0,1|3,0,0]=4 430 B15R2.86973 CCc1cccc2c1NC(=O)C(O)=C2 Amb28325810 [0,0,0,0,0,1|2,0,0]=3 431 B15R2.86973 COc1cccc2c1NC(=O)C(=O)N2 Amb28042895 [0,0,0,0,0,1|1,0,1]=3 432 B15R2.86973 COc1cccc2c1NC(=O)C(C)C2 Amb27174316 [0,0,0,0,0,1|2,0,0]=3 433 B15R2.86973 COc1cccc2c1NC(=O)C(N)=N2 Amb22496142 [0,0,0,0,0,1|2,0,0]=3 434 B15R2.86973 COc1cccc2c1NC(=O)C(N)C2 Amb25676200 [0,0,0,0,0,1|2,0,0]=3 435 B15R2.86973 COc1cccc2c1NC(C)C(O)C2 Amb33134359 [0,0,0,0,0,1|2,0,1]=4 436 B15R2.86973 COc1cccc2c1OC(=O)C(=O)N2 Amb27173704 [0,0,0,0,0,1|2,0,1]=4 437 B15R2.86973 COc1cccc2c1OC(=O)C(C)=C2 Amb27495681 [0,0,0,0,0,1|3,0,0]=4 438 B15R2.86973 COc1cccc2cc(O)c(C)nc12 Amb33134158 [0,0,0,0,0,1|2,0,1]=4 439 B12R1.280 COc1cccc(CC=O)c1C Amb33268404 [1,0,1,0,0,0|2,0,0]=4 440 B12R1.280 COc1cccc(CC=O)c1F Amb27455690 [1,0,1,0,0,0|2,0,0]=4 441 B12R1.280 COc1cccc(CC=O)c1O Amb25364485 [1,0,1,0,0,0|2,0,0]=4 442 B12R1.280 COc1cccc(N=C=O)c1N Amb25684150 [1,0,1,0,0,0|0,0,2]=4 443 B12R1.280 COc1cccc(NC=O)c1F Amb35643237 [1,0,1,0,0,0|1,0,0]=3 444 B12R1.435 C=CC(O)c1cccc(OC)c1 Amb25882812 [1,0,1,0,0,0|2,0,0]=4 445 B12R1.435 C=C[C@@H](O)c1cccc(OC)c1 Amb28242274 [1,0,1,0,0,0|2,0,0]=4 446 B12R1.435 C=C[C@H](O)c1cccc(OC)c1 Amb27753085 [1,0,1,0,0,0|2,0,0]=4 447 B12R1.435 COc1cccc(C(=O)C=O)c1 Amb10067953 [1,0,1,0,0,0|1,0,1]=4 448 B12R1.435 COc1cccc(C(C)C=O)c1 Amb17232468 [1,0,1,0,0,0|2,0,0]=4 449 B12R1.435 COc1cccc(C(O)CN)c1 Amb1108404 [1,0,1,0,0,0|1,0,1]=4 450 B12R1.435 COc1cccc(C(O)CN)c1 Amb2699086 [1,0,1,0,0,0|1,0,1]=4 451 B12R1.435 COc1cccc([C@@H](O)CN)c1 Amb27862344 [1,0,1,0,0,0|1,0,1]=4 452 B12R1.435 COc1cccc([C@H](O)CN)c1 Amb26967003 [1,0,1,0,0,0|1,0,1]=4 453 B12R1.435 COc1cncc(C(O)C=O)c1 Amb28241740 [1,0,1,0,0,0|2,0,0]=4 454 B12R1.440 CCc1cccc(C(=O)O)c1N Amb28555679 [1,0,1,0,0,0|2,0,0]=4 455 B12R1.440 CCc1cccc(C(=O)O)c1N Amb7784317 [1,0,1,0,0,0|2,0,0]=4 456 B12R1.440 COc1cccc(C(=O)Cl)c1N Amb27453500 [1,0,1,0,0,0|2,0,0]=4 457 B12R1.440 COc1cccc(C(=O)O)c1Br Amb22228665 [1,0,1,0,0,0|2,0,0]=4 458 B12R1.440 COc1cccc(C(=O)O)c1C Amb3941571 [1,0,1,0,0,0|2,0,0]=4 459 B12R1.440 COc1cccc(C(=O)O)c1Cl Amb6366167 [1,0,1,0,0,0|2,0,0]=4 460 B12R1.440 COc1cccc(C(=O)O)c1F Amb8397077 [1,0,1,0,0,0|2,0,0]=4 461 B12R1.440 COc1cccc(C(=O)O)c1N Amb33534756 [1,0,1,0,0,0|1,0,0]=3 462 B12R1.440 COc1cccc(C(=O)O)c1N Amb6297702 [1,0,1,0,0,0|1,0,0]=3 463 B12R1.440 COc1cccc(C(=O)O)c1O Amb2780776 [1,0,1,0,0,0|2,0,0]=4 464 B12R1.440 COc1cccc(C(=O)O)c1S Amb26075231 [1,0,1,0,0,0|2,0,0]=4 465 B12R1.440 COc1cccc(C(C)=O)c1N Amb18646261 [1,0,1,0,0,0|2,0,0]=4 466 B12R1.440 COc1cccc(C(N)=O)c1N Amb17616912 [1,0,1,0,0,0|2,0,0]=4 467 B12R1.440 COc1cccc(N(=O)=O)c1N Amb20621511 [1,0,1,0,0,0|0,0,2]=4 468 B12R1.440 COc1cccc([N+](=O)[O-])c1N Amb10603621 [1,0,1,0,0,0|0,0,2]=4 469 B12R1.440 COc1cccc([N+](=O)[O-])c1N Amb24105790 [1,0,1,0,0,0|0,0,2]=4 470 B12R1.440 COc1ccnc(C(=O)O)c1N Amb22755142 [1,0,1,0,0,0|2,0,0]=4 471 B12R1.440 COc1nccc(C(=O)O)c1N Amb18826803 [1,0,1,0,0,0|2,0,0]=4 472 B12R1.440 CSc1cccc(C(=O)O)c1N Amb24376192 [1,0,1,0,0,0|1,1,0]=4 473 B12R1.75 C#Cc1ccccc1NC(N)=O Amb27983684 [1,0,1,0,0,0|1,0,1]=4 474 B12R1.75 CCc1ccccc1CC(=O)O Amb33543937 [1,0,1,0,0,0|2,0,0]=4 475 B12R1.75 CCc1ccccc1NC(=N)N Amb18798227 [1,0,1,0,0,0|2,0,0]=4 476 B12R1.75 CCc1ccccc1NC(=O)Cl Amb35614607 [1,0,1,0,0,0|2,0,0]=4 477 B12R1.75 CCc1ccccc1NC(C)=O Amb2774187 [1,0,1,0,0,0|2,0,0]=4 478 B12R1.75 CCc1ccccc1NC(N)=O Amb1128108 [1,0,1,0,0,0|1,0,0]=3 479 B12R1.75 CCc1ccccc1NC(N)=S Amb2372778 [1,0,1,0,0,0|1,1,0]=4 480 B12R1.75 CNc1ccccc1CC(=O)O Amb27637755 [1,0,1,0,0,0|2,0,0]=4 481 B12R1.75 COc1ccccc1CC(=N)N Amb7365489 [1,0,1,0,0,0|2,0,0]=4 482 B12R1.75 COc1ccccc1CC(=N)N Amb8503360 [1,0,1,0,0,0|2,0,0]=4 483 B12R1.75 COc1ccccc1CC(=O)Cl Amb2786068 [1,0,1,0,0,0|2,0,0]=4 484 B12R1.75 COc1ccccc1CC(=O)O Amb2209376 [1,0,1,0,0,0|1,0,0]=3 485 B12R1.75 COc1ccccc1CC(C)=O Amb4606012 [1,0,1,0,0,0|2,0,0]=4 486 B12R1.75 COc1ccccc1CC(N)=O Amb1829532 [1,0,1,0,0,0|1,0,0]=3 487 B12R1.75 COc1ccccc1CC(N)=S Amb17233848 [1,0,1,0,0,0|1,1,0]=4 488 B12R1.75 COc1ccccc1NC(=N)N Amb9175312 [1,0,1,0,0,0|1,0,0]=3 489 B12R1.75 COc1ccccc1NC(C)=N Amb28365626 [1,0,1,0,0,0|1,0,1]=4 490 B12R1.75 COc1ccccc1NC(C)=O Amb6539257 [1,0,1,0,0,0|1,0,0]=3 491 B12R1.75 COc1ccccc1NC(N)=O Amb1195897 [1,0,1,0,0,0|0,0,0]=2 492 B12R1.75 COc1ccccc1NC(N)=S Amb6355830 [1,0,1,0,0,0|0,1,0]=3 493 B12R1.75 COc1ccccc1OC(=O)Cl Amb21618687 [1,0,1,0,0,0|2,0,0]=4 494 B12R1.75 COc1ccccc1OC(C)=O Amb2688624 [1,0,1,0,0,0|2,0,0]=4 495 B12R1.75 COc1ccccc1SC(=O)Cl Amb2689202 [1,0,1,0,0,0|2,0,0]=4 496 B12R1.75 COc1ccccc1SC(C)=O Amb26599835 [1,0,1,0,0,0|2,0,0]=4 497 B12R1.75 COc1cccnc1CC(=O)O Amb20247607 [1,0,1,0,0,0|2,0,0]=4 498 B12R1.75 COc1cccnc1CC(=O)O Amb28555763 [1,0,1,0,0,0|2,0,0]=4 499 B12R1.75 COc1cccnc1NC(C)=O Amb27777289 [1,0,1,0,0,0|2,0,0]=4 500 B12R1.75 COc1cccnc1NC(N)=S Amb27268336 [1,0,1,0,0,0|1,1,0]=4 501 B12R1.75 COc1ccncc1CC(=O)O Amb24468546 [1,0,1,0,0,0|2,0,0]=4 502 B12R1.75 COc1ccncc1CC(=O)O Amb33533237 [1,0,1,0,0,0|2,0,0]=4 503 B12R1.75 COc1ccncc1NC(C)=O Amb26566547 [1,0,1,0,0,0|2,0,0]=4 504 B12R1.75 COc1ncccc1CC(=O)O Amb8386288 [1,0,1,0,0,0|2,0,0]=4 505 B12R1.75 COc1ncccc1NC(N)=S Amb27178268 [1,0,1,0,0,0|1,1,0]=4 506 B12R1.75 COc1nnccc1NC(N)=O Amb27443886 [1,0,1,0,0,0|2,0,0]=4 507 B12R1.75 CSc1ccccc1CC(=O)O Amb17106781 [1,0,1,0,0,0|1,1,0]=4 508 B12R1.75 CSc1ccccc1NC(=O)Cl Amb35637088 [1,0,1,0,0,0|1,1,0]=4 509 B12R1.75 CSc1ccccc1NC(C)=O Amb5557352 [1,0,1,0,0,0|1,1,0]=4 510 B12R1.75 CSc1ccccc1NC(N)=O Amb1218379 [1,0,1,0,0,0|0,1,0]=3 511 B12R1.75 CSc1ccccc1NC(N)=S Amb928266 [1,0,1,0,0,0|0,2,0]=4 512 B12R1.75 N#Cc1ccccc1NC(N)=O Amb514406 [1,0,1,0,0,0|2,0,0]=4 513 B12R1.75 NCc1ccccc1NC(N)=O Amb1109841 [1,0,1,0,0,0|2,0,0]=4 514 B12R1.121 CN\C=C/c1ccccc1OC Amb27828629 [1,0,1,0,0,0|2,0,0]=4 515 B12R1.121 CN\C=C\c1ccccc1OC Amb28051924 [1,0,1,0,0,0|2,0,0]=4 516 B12R1.121 COc1ccccc1NCCO Amb6708268 [1,0,1,0,0,0|1,0,1]=4 517 B12R1.121 COc1ccccc1\C=C\CO Amb1110152 [1,0,1,0,0,0|2,0,0]=4 518 B12R1.371 C#CC(=O)Nc1ccccc1O Amb27238252 [1,0,1,0,0,0|2,0,0]=4 519 B12R1.371 C=CC(=O)Nc1ccccc1C Amb6843670 [1,0,1,0,0,0|2,0,0]=4 520 B12R1.371 CCC(=O)Nc1ccccc1O Amb6540573 [1,0,1,0,0,0|2,0,0]=4 521 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [1,0,1,0,0,0|2,0,0]=4 522 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [1,0,1,0,0,0|2,0,0]=4 523 B12R1.371 CNC(=O)Nc1ccccc1Cl Amb4010921 [1,0,1,0,0,0|2,0,0]=4 524 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [1,0,1,0,0,0|2,0,0]=4 525 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [1,0,1,0,0,0|2,0,0]=4 526 B12R1.371 CNC(=O)Nc1cccnc1C Amb27485791 [1,0,1,0,0,0|2,0,0]=4 527 B12R1.371 CNC(=O)Nc1ncccc1C Amb2132784 [1,0,1,0,0,0|2,0,0]=4 528 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [1,0,1,0,0,0|2,0,0]=4 529 B12R1.371 CNC(=S)Nc1ccccc1C Amb6855667 [1,0,1,0,0,0|1,1,0]=4 530 B12R1.371 CNC(=S)Nc1ccccc1O Amb28368290 [1,0,1,0,0,0|1,1,0]=4 531 B12R1.371 COC(=O)Nc1ccccc1C Amb17846660 [1,0,1,0,0,0|2,0,0]=4 532 B12R1.371 COC(=O)Nc1ccccc1O Amb2611880 [1,0,1,0,0,0|2,0,0]=4 533 B12R1.371 C\C(=N\O)Nc1ccccc1C Amb28251195 [1,0,1,0,0,0|1,0,1]=4 534 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [1,0,1,0,0,0|2,0,0]=4 535 B12R1.371 Cc1ccccc1CC(=O)NN Amb6249209 [1,0,1,0,0,0|2,0,0]=4 536 B12R1.371 Cc1ccccc1CC(=O)NO Amb6257569 [1,0,1,0,0,0|1,0,0]=3 537 B12R1.371 Cc1ccccc1NC(=O)C#N Amb4006107 [1,0,1,0,0,0|2,0,0]=4 538 B12R1.371 Cc1ccccc1NC(=O)CBr Amb8391340 [1,0,1,0,0,0|2,0,0]=4 539 B12R1.371 Cc1ccccc1NC(=O)CCl Amb1644314 [1,0,1,0,0,0|2,0,0]=4 540 B12R1.371 Cc1ccccc1NC(=O)CN Amb6336812 [1,0,1,0,0,0|2,0,0]=4 541 B12R1.371 Cc1ccccc1NC(=O)CO Amb1110662 [1,0,1,0,0,0|1,0,0]=3 542 B12R1.371 Cc1ccccc1NC(=O)CS Amb6761145 [1,0,1,0,0,0|1,1,0]=4 543 B12R1.371 Cc1ccccc1NC(=O)NN Amb7969607 [1,0,1,0,0,0|1,0,0]=3 544 B12R1.371 Cc1ccccc1NC(=O)NO Amb27614514 [1,0,1,0,0,0|0,0,0]=2 545 B12R1.371 Cc1ccccc1NC(=S)NN Amb1634626 [1,0,1,0,0,0|1,1,0]=4 546 B12R1.371 Cc1ccccc1OC(=O)NN Amb28369799 [1,0,1,0,0,0|2,0,0]=4 547 B12R1.371 NNC(=O)Cc1ccccc1O Amb32667213 [1,0,1,0,0,0|2,0,0]=4 548 B12R1.371 NNC(=O)Cc1ccccc1O Amb3988948 [1,0,1,0,0,0|2,0,0]=4 549 B12R1.371 NNC(=O)Nc1ccccc1Cl Amb3427773 [1,0,1,0,0,0|2,0,0]=4 550 B12R1.371 NNC(=O)Nc1ccccc1O Amb6889257 [1,0,1,0,0,0|1,0,0]=3 551 B12R1.371 O=C(CBr)Nc1ccccc1O Amb17325450 [1,0,1,0,0,0|2,0,0]=4 552 B12R1.371 O=C(CCl)Nc1ccccc1O Amb6373974 [1,0,1,0,0,0|2,0,0]=4 553 B12R1.371 O=C(CO)Nc1ccccc1Br Amb1109988 [1,0,1,0,0,0|2,0,0]=4 554 B12R1.371 O=C(CO)Nc1ccccc1Cl Amb1111147 [1,0,1,0,0,0|2,0,0]=4 555 B12R1.371 O=C(CO)Nc1ccccc1F Amb1109775 [1,0,1,0,0,0|2,0,0]=4 556 B12R1.371 O=C(CO)Nc1ccccc1O Amb5798034 [1,0,1,0,0,0|1,0,0]=3 557 B12R1.371 O=C(Cc1ccccc1Cl)NO Amb6273362 [1,0,1,0,0,0|2,0,0]=4 558 B12R1.371 O=C(Cc1ccccc1I)NO Amb28184737 [1,0,1,0,0,0|2,0,0]=4 559 B12R1.371 O=C(NO)Nc1ccccc1Cl Amb4013619 [1,0,1,0,0,0|1,0,0]=3 560 B12R1.371 O=C(NO)Nc1ccccc1F Amb28040914 [1,0,1,0,0,0|1,0,0]=3 561 B12R1.225 C=C(C(N)=O)c1cccc(C)c1 Amb27449286 [1,0,1,0,0,0|2,0,0]=4 562 B12R1.225 CC(=O)C(O)c1cccc(C)c1 Amb25801127 [1,0,1,0,0,0|2,0,0]=4 563 B12R1.225 CC(=O)C(O)c1cccc(O)c1 Amb17594122 [1,0,1,0,0,0|2,0,0]=4 564 B12R1.225 CC(=O)N(N)c1cccc(C)c1 Amb18563637 [1,0,1,0,0,0|2,0,0]=4 565 B12R1.225 CC(=O)[C@H](O)c1cccc(C)c1 Amb27615519 [1,0,1,0,0,0|2,0,0]=4 566 B12R1.225 CN(C(N)=O)c1cccc(Br)c1 Amb28065739 [1,0,1,0,0,0|2,0,0]=4 567 B12R1.225 CN(C(N)=O)c1cccc(N)c1 Amb18944888 [1,0,1,0,0,0|2,0,0]=4 568 B12R1.225 C[C@@H](C(N)=O)c1cccc(O)c1 Amb27473363 [1,0,1,0,0,0|2,0,0]=4 569 B12R1.225 Cc1cccc(C(=O)C(N)=O)c1 Amb26478629 [1,0,1,0,0,0|1,0,1]=4 570 B12R1.225 Cc1cccc(C(C)C(N)=O)c1 Amb27589453 [1,0,1,0,0,0|2,0,0]=4 571 B12R1.225 Cc1cccc(C(N)C(N)=O)c1 Amb17334618 [1,0,1,0,0,0|2,0,0]=4 572 B12R1.225 Cc1cccc(C(O)C(=O)O)c1 Amb2689507 [1,0,1,0,0,0|2,0,0]=4 573 B12R1.225 Cc1cccc(C(O)C(N)=O)c1 Amb18800895 [1,0,1,0,0,0|1,0,0]=3 574 B12R1.225 Cc1cccc(N(C)C(=N)N)c1 Amb18788211 [1,0,1,0,0,0|2,0,0]=4 575 B12R1.225 Cc1cccc(N(C)C(N)=O)c1 Amb18788282 [1,0,1,0,0,0|1,0,0]=3 576 B12R1.225 Cc1cccc(N(O)C(N)=O)c1 Amb28365643 [1,0,1,0,0,0|0,0,0]=2 577 B12R1.225 Cc1cccc([C@@H](N)C(N)=O)c1 Amb27615620 [1,0,1,0,0,0|2,0,0]=4 578 B12R1.225 Cc1cccc([C@H](O)C(=O)O)c1 Amb28138076 [1,0,1,0,0,0|2,0,0]=4 579 B12R1.225 Cc1ccnc(N(C)C(N)=O)c1 Amb27599199 [1,0,1,0,0,0|2,0,0]=4 580 B12R1.225 N=C(N)C(O)c1cccc(O)c1 Amb27597999 [1,0,1,0,0,0|2,0,0]=4 581 B12R1.225 NC(=O)C(N)c1cccc(O)c1 Amb17334666 [1,0,1,0,0,0|2,0,0]=4 582 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [1,0,1,0,0,0|2,0,0]=4 583 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [1,0,1,0,0,0|2,0,0]=4 584 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [1,0,1,0,0,0|2,0,0]=4 585 B12R1.225 NC(=O)N(O)c1cccc(Cl)c1 Amb27845453 [1,0,1,0,0,0|1,0,0]=3 586 B12R1.225 NC(=O)[C@@H](O)c1cccc(Cl)c1 Amb27620331 [1,0,1,0,0,0|2,0,0]=4 587 B12R1.225 O=C(O)C(O)c1cccc(O)c1 Amb6297864 [1,0,1,0,0,0|2,0,0]=4 588 B12R1.438 C#Cc1cccc(NC(N)=O)c1 Amb6267847 [1,0,1,0,0,0|1,0,1]=4 589 B12R1.438 CCc1cccc(NC(=N)N)c1 Amb18798229 [1,0,1,0,0,0|2,0,0]=4 590 B12R1.438 CCc1cccc(NC(=O)Cl)c1 Amb35637102 [1,0,1,0,0,0|2,0,0]=4 591 B12R1.438 CCc1cccc(NC(C)=O)c1 Amb3372524 [1,0,1,0,0,0|2,0,0]=4 592 B12R1.438 CCc1cccc(NC(N)=O)c1 Amb1132162 [1,0,1,0,0,0|1,0,0]=3 593 B12R1.438 CCc1cccc(NC(N)=S)c1 Amb2372779 [1,0,1,0,0,0|1,1,0]=4 594 B12R1.438 CNc1cccc(NC(C)=O)c1 Amb6711403 [1,0,1,0,0,0|2,0,0]=4 595 B12R1.438 COc1cc(NC(N)=S)ccn1 Amb27979492 [1,0,1,0,0,0|1,1,0]=4 596 B12R1.438 COc1cccc(CC(=N)N)c1 Amb2696301 [1,0,1,0,0,0|2,0,0]=4 597 B12R1.438 COc1cccc(CC(=N)N)c1 Amb33551944 [1,0,1,0,0,0|2,0,0]=4 598 B12R1.438 COc1cccc(CC(=O)Cl)c1 Amb2720506 [1,0,1,0,0,0|2,0,0]=4 599 B12R1.438 COc1cccc(CC(=O)O)c1 Amb2722757 [1,0,1,0,0,0|2,0,0]=4 600 B12R1.438 COc1cccc(CC(=O)[O-])c1 Amb33513052 [1,0,1,0,0,0|2,0,0]=4 601 B12R1.438 COc1cccc(CC(C)=O)c1 Amb2689177 [1,0,1,0,0,0|2,0,0]=4 602 B12R1.438 COc1cccc(CC(N)=O)c1 Amb2722759 [1,0,1,0,0,0|1,0,0]=3 603 B12R1.438 COc1cccc(CC(N)=O)n1 Amb28125400 [1,0,1,0,0,0|2,0,0]=4 604 B12R1.438 COc1cccc(CC(N)=S)c1 Amb6247687 [1,0,1,0,0,0|1,1,0]=4 605 B12R1.438 COc1cccc(NC(=N)N)c1 Amb6429693 [1,0,1,0,0,0|1,0,0]=3 606 B12R1.438 COc1cccc(NC(C)=O)c1 Amb1208566 [1,0,1,0,0,0|1,0,0]=3 607 B12R1.438 COc1cccc(NC(C)=S)c1 Amb27490932 [1,0,1,0,0,0|1,1,0]=4 608 B12R1.438 COc1cccc(NC(N)=O)c1 Amb1126089 [1,0,1,0,0,0|0,0,0]=2 609 B12R1.438 COc1cccc(NC(N)=S)c1 Amb1207975 [1,0,1,0,0,0|0,1,0]=3 610 B12R1.438 COc1cccc(NC(N)=S)n1 Amb22292479 [1,0,1,0,0,0|1,1,0]=4 611 B12R1.438 COc1cccc(OC(C)=O)c1 Amb4017885 [1,0,1,0,0,0|2,0,0]=4 612 B12R1.438 COc1cccc(SC(=O)Cl)c1 Amb2689203 [1,0,1,0,0,0|2,0,0]=4 613 B12R1.438 COc1cccc(SC(C)=O)c1 Amb25837474 [1,0,1,0,0,0|2,0,0]=4 614 B12R1.438 COc1cccc(\C=C(\C)N)c1 Amb27860335 [1,0,1,0,0,0|2,0,0]=4 615 B12R1.438 COc1ccnc(NC(N)=S)c1 Amb26550632 [1,0,1,0,0,0|1,1,0]=4 616 B12R1.438 CSc1cccc(CC(N)=O)c1 Amb26503441 [1,0,1,0,0,0|1,1,0]=4 617 B12R1.438 CSc1cccc(NC(=N)N)c1 Amb10879737 [1,0,1,0,0,0|1,1,0]=4 618 B12R1.438 CSc1cccc(NC(=O)Cl)c1 Amb35636943 [1,0,1,0,0,0|1,1,0]=4 619 B12R1.438 CSc1cccc(NC(C)=O)c1 Amb2661171 [1,0,1,0,0,0|1,1,0]=4 620 B12R1.438 CSc1cccc(NC(N)=O)c1 Amb2762964 [1,0,1,0,0,0|0,1,0]=3 621 B12R1.438 CSc1cccc(NC(N)=S)c1 Amb2689739 [1,0,1,0,0,0|0,2,0]=4 622 B12R1.438 N#Cc1cccc(NC(N)=O)c1 Amb6662645 [1,0,1,0,0,0|2,0,0]=4 623 B12R1.438 NCc1cccc(NC(N)=O)c1 Amb33543186 [1,0,1,0,0,0|2,0,0]=4 624 B12R1.1112 C=CCc1c(O)cccc1OC Amb18646030 [1,0,1,0,0,0|2,0,0]=4 625 B12R1.1112 COc1cccc(Br)c1CC=O Amb33451969 [1,0,1,0,0,0|2,0,0]=4 626 B12R1.1112 COc1cccc(C)c1CC=O Amb33447266 [1,0,1,0,0,0|2,0,0]=4 627 B12R1.1112 COc1cccc(C)c1NC=O Amb28368454 [1,0,1,0,0,0|1,0,0]=3 628 B12R1.1112 COc1cccc(Cl)c1CC=O Amb24492909 [1,0,1,0,0,0|2,0,0]=4 629 B12R1.1112 COc1cccc(F)c1CC=O Amb25688117 [1,0,1,0,0,0|2,0,0]=4 630 B12R1.1112 COc1cccc(F)c1NC=O Amb22057481 [1,0,1,0,0,0|1,0,0]=3 631 B12R1.1112 COc1cccc(N)c1CC=O Amb27637599 [1,0,1,0,0,0|1,0,0]=3 632 B12R1.1112 COc1cccc(N)c1N=C=O Amb25877055 [1,0,1,0,0,0|0,0,2]=4 633 B12R1.1879 C=Cc1cccc(OC)c1C=O Amb28199959 [1,0,1,0,0,0|2,0,0]=4 634 B12R1.1879 CCc1cccc(NN)c1C=O Amb25922556 [1,0,1,0,0,0|2,0,0]=4 635 B12R1.1879 COc1cccc(C=O)c1C=O Amb27782450 [1,0,1,0,0,0|1,0,1]=4 636 B12R1.1879 COc1cccc(CO)c1NN Amb24438425 [1,0,1,0,0,0|2,0,0]=4 637 B12R1.1879 COc1cccc(NN)c1C=O Amb24528090 [1,0,1,0,0,0|1,0,0]=3 638 B12R1.1879 COc1cccc(OC)c1C=O Amb845505 [1,0,1,0,0,0|2,0,0]=4 639 B12R1.1879 COc1cccc(SC)c1C=O Amb18648643 [1,0,1,0,0,0|2,0,0]=4 640 B12R2.196 Cc1cccc2c1ccn2C Amb9768354 [2,0,0,0,0,0|2,0,0]=4 641 B12R2.196 Cc1cccc2c1ccn2N Amb18202354 [2,0,0,0,0,0|2,0,0]=4 642 B12R2.196 Cn1ccc2c(O)cccc21 Amb13884900 [2,0,0,0,0,0|2,0,0]=4 643 B12R2.196 Cn1cnc2c(O)cccc21 Amb10561806 [2,0,0,0,0,0|1,0,1]=4 644 B12R2.196 Cn1cnc2c(O)cccc21 Amb28872308 [2,0,0,0,0,0|1,0,1]=4 645 B12R2.196 Nn1ccc2c(O)cccc21 Amb27782519 [2,0,0,0,0,0|2,0,0]=4 646 B12R2.196 Oc1cccc2c1CCN2O Amb27971133 [2,0,0,0,0,0|1,0,1]=4 647 B12R2.196 Oc1cccc2c1ccn2O Amb28051708 [2,0,0,0,0,0|1,0,0]=3 648 B12R2.196 Oc1cccc2c1cnn2O Amb26512100 [2,0,0,0,0,0|2,0,0]=4 649 B12R2.315 COc1cccc2c1CC=C2 Amb2383769 [2,0,0,0,0,0|2,0,0]=4 650 B12R2.315 COc1cccc2c1CCN2 Amb10602754 [2,0,0,0,0,0|1,0,1]=4 651 B12R2.315 COc1cccc2c1CCN2 Amb2383419 [2,0,0,0,0,0|1,0,1]=4 652 B12R2.315 COc1cccc2c1NCC2 Amb1108955 [2,0,0,0,0,0|1,0,1]=4 653 B12R2.315 COc1cccc2ccoc12 Amb2689091 [2,0,0,0,0,0|2,0,0]=4 654 B12R2.315 COc1cccc2ncoc12 Amb25954025 [2,0,0,0,0,0|1,0,1]=4 655 B12R2.315 COc1cccc2ncsc12 Amb22755932 [2,0,0,0,0,0|1,0,1]=4 656 B12R2.315 COc1cccc2occc12 Amb27974613 [2,0,0,0,0,0|2,0,0]=4 657 B12R2.315 COc1cccc2sccc12 Amb23440364 [2,0,0,0,0,0|2,0,0]=4 658 B12R2.315 COc1cccc2scnc12 Amb10603794 [2,0,0,0,0,0|1,0,1]=4 659 B12R2.202 CC1=CC=CC2=CC(=O)N=C12 Amb22015159 [2,0,0,0,0,0|1,0,1]=4 660 B12R2.202 CN1C=CC=C2NC(=O)N=C21 Amb21922525 [2,0,0,0,0,0|1,0,1]=4 661 B12R2.202 Cc1cccc2c1CC(=O)N2 Amb21963242 [2,0,0,0,0,0|1,0,0]=3 662 B12R2.202 Cc1cccc2c1CC(=O)O2 Amb27240434 [2,0,0,0,0,0|2,0,0]=4 663 B12R2.202 Cc1cccc2c1NC(=O)C2 Amb2720647 [2,0,0,0,0,0|1,0,0]=3 664 B12R2.202 Cc1cccc2c1NC(=O)N2 Amb19895585 [2,0,0,0,0,0|0,0,0]=2 665 B12R2.202 Cc1cccc2c1NC(=O)O2 Amb19895586 [2,0,0,0,0,0|1,0,0]=3 666 B12R2.202 Cc1cccc2c1NC(=O)S2 Amb21858016 [2,0,0,0,0,0|1,0,0]=3 667 B12R2.202 Cc1cccc2c1NC(=S)N2 Amb22001670 [2,0,0,0,0,0|0,1,0]=3 668 B12R2.202 Cc1cccc2c1NC(=S)S2 Amb18043596 [2,0,0,0,0,0|1,1,0]=4 669 B12R2.202 Cc1cccc2c1OC(=O)N2 Amb18046723 [2,0,0,0,0,0|1,0,0]=3 670 B12R2.202 Cc1cccc2c1OC(=O)O2 Amb26501447 [2,0,0,0,0,0|2,0,0]=4 671 B12R2.202 Cc1ccnc2c1NC(=O)C2 Amb19958798 [2,0,0,0,0,0|2,0,0]=4 672 B12R2.202 Cc1ccnc2c1NC(=O)N2 Amb20242071 [2,0,0,0,0,0|1,0,0]=3 673 B12R2.202 Cc1ccnc2c1NC(=O)O2 Amb18616372 [2,0,0,0,0,0|2,0,0]=4 674 B12R2.202 Cc1ccnc2c1OC(=O)N2 Amb27969457 [2,0,0,0,0,0|2,0,0]=4 675 B12R2.202 Cc1nccc2c1CC(=O)N2 Amb24329926 [2,0,0,0,0,0|2,0,0]=4 676 B12R2.202 Cc1ncnc2c1NC(=O)N2 Amb22008622 [2,0,0,0,0,0|2,0,0]=4 677 B12R2.202 Nc1cccc2c1CC(=O)N2 Amb18124888 [2,0,0,0,0,0|2,0,0]=4 678 B12R2.202 Nc1cccc2c1NC(=O)C2 Amb18202250 [2,0,0,0,0,0|2,0,0]=4 679 B12R2.202 Nc1cccc2c1NC(=O)N2 Amb22275963 [2,0,0,0,0,0|1,0,0]=3 680 B12R2.202 Nc1cccc2c1NC(=O)N2 Amb33536555 [2,0,0,0,0,0|1,0,0]=3 681 B12R2.202 Nc1cccc2c1NC(=O)O2 Amb18626326 [2,0,0,0,0,0|2,0,0]=4 682 B12R2.202 Nc1cccc2c1NC(=O)S2 Amb24742733 [2,0,0,0,0,0|2,0,0]=4 683 B12R2.202 Nc1cccc2c1OC(=O)N2 Amb18363317 [2,0,0,0,0,0|2,0,0]=4 684 B12R2.202 Nc1cccc2c1OC(=O)N2 Amb30586642 [2,0,0,0,0,0|2,0,0]=4 685 B12R2.202 Nc1cccc2c1SC(=O)N2 Amb18827719 [2,0,0,0,0,0|2,0,0]=4 686 B12R2.202 O=C1Cc2c(Br)cccc2N1 Amb2455680 [2,0,0,0,0,0|2,0,0]=4 687 B12R2.202 O=C1Cc2c(Cl)cccc2N1 Amb2429960 [2,0,0,0,0,0|2,0,0]=4 688 B12R2.202 O=C1Cc2c(F)cccc2N1 Amb8386628 [2,0,0,0,0,0|2,0,0]=4 689 B12R2.202 O=C1Cc2c(I)cccc2N1 Amb10975741 [2,0,0,0,0,0|2,0,0]=4 690 B12R2.202 O=C1Cc2c(O)cccc2N1 Amb2699834 [2,0,0,0,0,0|1,0,0]=3 691 B12R2.202 O=C1Cc2c(ccnc2O)N1 Amb24329937 [2,0,0,0,0,0|2,0,0]=4 692 B12R2.202 O=C1Cc2cccc(Br)c2N1 Amb10068560 [2,0,0,0,0,0|2,0,0]=4 693 B12R2.202 O=C1Cc2cccc(Cl)c2N1 Amb6308248 [2,0,0,0,0,0|2,0,0]=4 694 B12R2.202 O=C1Cc2cccc(F)c2N1 Amb8392931 [2,0,0,0,0,0|2,0,0]=4 695 B12R2.202 O=C1Cc2cccc(O)c2C1 Amb18124871 [2,0,0,0,0,0|2,0,0]=4 696 B12R2.202 O=C1Cc2cccc(O)c2N1 Amb23571286 [2,0,0,0,0,0|1,0,0]=3 697 B12R2.202 O=C1Nc2c(Br)cccc2S1 Amb21856963 [2,0,0,0,0,0|2,0,0]=4 698 B12R2.202 O=C1Nc2c(Cl)cccc2S1 Amb20240721 [2,0,0,0,0,0|2,0,0]=4 699 B12R2.202 O=C1Nc2c(F)cccc2O1 Amb24056004 [2,0,0,0,0,0|2,0,0]=4 700 B12R2.202 O=C1Nc2c(F)cccc2S1 Amb21864813 [2,0,0,0,0,0|2,0,0]=4 701 B12R2.202 O=C1Nc2cccc(Br)c2N1 Amb23412383 [2,0,0,0,0,0|1,0,0]=3 702 B12R2.202 O=C1Nc2cccc(Br)c2O1 Amb18046774 [2,0,0,0,0,0|2,0,0]=4 703 B12R2.202 O=C1Nc2cccc(Cl)c2O1 Amb18547329 [2,0,0,0,0,0|2,0,0]=4 704 B12R2.202 O=C1Nc2cccc(Cl)c2S1 Amb22233980 [2,0,0,0,0,0|2,0,0]=4 705 B12R2.202 O=C1Nc2cccc(F)c2N1 Amb20668116 [2,0,0,0,0,0|1,0,0]=3 706 B12R2.202 O=C1Nc2cccc(F)c2O1 Amb18046724 [2,0,0,0,0,0|2,0,0]=4 707 B12R2.202 O=C1Nc2cccc(F)c2S1 Amb23412133 [2,0,0,0,0,0|2,0,0]=4 708 B12R2.202 O=C1Nc2cccc(O)c2N1 Amb22755775 [2,0,0,0,0,0|0,0,0]=2 709 B12R2.202 O=C1Nc2cncc(Br)c2N1 Amb20665660 [2,0,0,0,0,0|2,0,0]=4 710 B12R2.202 O=C1Nc2cncc(Cl)c2N1 Amb22896383 [2,0,0,0,0,0|2,0,0]=4 711 B12R2.202 O=C1Nc2nccc(Cl)c2N1 Amb22896619 [2,0,0,0,0,0|2,0,0]=4 712 B12R2.202 O=C1Oc2c(O)cccc2S1 Amb27813603 [2,0,0,0,0,0|2,0,0]=4 713 B12R2.202 O=C1Oc2cccc(O)c2O1 Amb24377062 [2,0,0,0,0,0|2,0,0]=4 714 B12R2.202 Oc1cccc2c1NC(=S)N2 Amb25275305 [2,0,0,0,0,0|0,1,0]=3 715 B12R2.202 Oc1cccc2c1NC(=S)O2 Amb20242193 [2,0,0,0,0,0|1,1,0]=4 716 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [2,0,0,0,0,0|2,0,0]=4 717 B12R2.18 CC1C(=O)Nc2ccccc21 Amb2612193 [2,0,0,0,0,0|2,0,0]=4 718 B12R2.18 CN1C(=O)Cc2ccccc21 Amb1398903 [2,0,0,0,0,0|2,0,0]=4 719 B12R2.18 CN1C(=O)Nc2ccccc21 Amb18537193 [2,0,0,0,0,0|1,0,0]=3 720 B12R2.18 CN1C(=O)Nc2cccnc21 Amb21963725 [2,0,0,0,0,0|2,0,0]=4 721 B12R2.18 CN1C(=O)Nc2cnccc21 Amb19148095 [2,0,0,0,0,0|2,0,0]=4 722 B12R2.18 CN1C(=O)Nc2ncccc21 Amb20661045 [2,0,0,0,0,0|2,0,0]=4 723 B12R2.18 CN1C(=O)Oc2ccccc21 Amb18043105 [2,0,0,0,0,0|2,0,0]=4 724 B12R2.18 CN1C(=O)Sc2ccccc21 Amb19654015 [2,0,0,0,0,0|2,0,0]=4 725 B12R2.18 CN1C(=S)Nc2ccccc21 Amb19815991 [2,0,0,0,0,0|1,1,0]=4 726 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [2,0,0,0,0,0|2,0,0]=4 727 B12R2.18 NC1C(=O)Nc2ccccc21 Amb1154822 [2,0,0,0,0,0|2,0,0]=4 728 B12R2.18 NC1C(=O)Nc2ccccc21 Amb9745696 [2,0,0,0,0,0|2,0,0]=4 729 B12R2.18 NN1C(=O)Cc2ccccc21 Amb10560115 [2,0,0,0,0,0|2,0,0]=4 730 B12R2.18 NN1C(=O)Oc2ccccc21 Amb18644412 [2,0,0,0,0,0|2,0,0]=4 731 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [2,0,0,0,0,0|1,0,0]=3 732 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [2,0,0,0,0,0|1,0,1]=4 733 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [2,0,0,0,0,0|1,1,0]=4 734 B12R2.18 O=C1Nc2ccccc2C1Br Amb2228105 [2,0,0,0,0,0|2,0,0]=4 735 B12R2.18 O=C1Nc2ccccc2C1Cl Amb27753977 [2,0,0,0,0,0|2,0,0]=4 736 B12R2.18 O=C1Nc2ccccc2C1F Amb32456094 [2,0,0,0,0,0|2,0,0]=4 737 B12R2.18 O=C1Nc2ccccc2C1O Amb9748239 [2,0,0,0,0,0|1,0,0]=3 738 B12R2.18 O=C1Nc2ccccc2C1S Amb32788888 [2,0,0,0,0,0|1,1,0]=4 739 B12R2.18 O=C1Nc2ccccc2N1O Amb26332921 [2,0,0,0,0,0|0,0,0]=2 740 B12R2.18 O=C1Sc2ccccc2C1O Amb27636570 [2,0,0,0,0,0|2,0,0]=4 741 B14R1.1728 COc1cccc(C(Cl)C(C)=O)c1N Amb27441829 [0,1,1,0,0,0|2,0,0]=4 742 B14R1.1728 COc1cccc(C(O)C(=O)O)c1Br Amb27592829 [0,1,1,0,0,0|2,0,0]=4 743 B14R1.1728 COc1cccc(C(O)C(=O)O)c1C Amb28141880 [0,1,1,0,0,0|2,0,0]=4 744 B14R1.1728 COc1cccc(C(O)C(=O)O)c1Cl Amb26636095 [0,1,1,0,0,0|2,0,0]=4 745 B14R1.1728 COc1cccc(C(O)C(=O)O)c1N Amb25096566 [0,1,1,0,0,0|1,0,0]=3 746 B14R1.1728 COc1cccc(C(O)C(=O)O)c1O Amb26495526 [0,1,1,0,0,0|2,0,0]=4 747 B14R1.95 C#CC(=O)N(C)c1ccccc1OC Amb35694370 [0,1,1,0,0,0|2,0,0]=4 748 B14R1.95 CNC(=O)C(=O)c1ccccc1OC Amb17336562 [0,1,1,0,0,0|2,0,0]=4 749 B14R1.95 CNC(=O)C(N)c1ccccc1OC Amb25381416 [0,1,1,0,0,0|2,0,0]=4 750 B14R1.95 CNC(=O)C(N)c1ccccc1OC Amb28208083 [0,1,1,0,0,0|2,0,0]=4 751 B14R1.95 CNC(=O)C(O)c1ccccc1OC Amb26022196 [0,1,1,0,0,0|2,0,0]=4 752 B14R1.95 COc1ccccc1C(O)C(=O)NN Amb27394732 [0,1,1,0,0,0|2,0,0]=4 753 B14R1.95 COc1ccccc1N(C)C(=O)CCl Amb17241545 [0,1,1,0,0,0|2,0,0]=4 754 B14R1.95 COc1ccccc1N(C)C(=O)CN Amb17060284 [0,1,1,0,0,0|2,0,0]=4 755 B14R1.483 C#CC(=O)Nc1ccccc1COC Amb30017821 [0,1,1,0,0,0|2,0,0]=4 756 B14R1.483 C#CC(=O)Nc1ccccc1OCC Amb35694177 [0,1,1,0,0,0|2,0,0]=4 757 B14R1.483 C=CC(=O)Nc1ccccc1OCC Amb9480504 [0,1,1,0,0,0|2,0,0]=4 758 B14R1.483 CCCc1ccccc1NC(=O)NN Amb19051093 [0,1,1,0,0,0|2,0,0]=4 759 B14R1.483 CCOc1ccccc1NC(=O)CBr Amb4311196 [0,1,1,0,0,0|2,0,0]=4 760 B14R1.483 CCOc1ccccc1NC(=O)CC Amb3097303 [0,1,1,0,0,0|2,0,0]=4 761 B14R1.483 CCOc1ccccc1NC(=O)CCl Amb6367047 [0,1,1,0,0,0|2,0,0]=4 762 B14R1.483 CCOc1ccccc1NC(=O)CI Amb27489332 [0,1,1,0,0,0|2,0,0]=4 763 B14R1.483 CCOc1ccccc1NC(=O)CN Amb22435052 [0,1,1,0,0,0|2,0,0]=4 764 B14R1.483 CCOc1ccccc1NC(=O)CN Amb5783090 [0,1,1,0,0,0|2,0,0]=4 765 B14R1.483 CCOc1ccccc1NC(=O)CO Amb1109947 [0,1,1,0,0,0|1,0,0]=3 766 B14R1.483 CCOc1ccccc1NC(=O)CS Amb843718 [0,1,1,0,0,0|1,1,0]=4 767 B14R1.483 CCOc1ccccc1NC(=O)OC Amb17794123 [0,1,1,0,0,0|2,0,0]=4 768 B14R1.483 CCOc1ccccc1NC(=S)NC Amb6334906 [0,1,1,0,0,0|1,1,0]=4 769 B14R1.483 CCOc1ccccc1NC(=S)NN Amb9205781 [0,1,1,0,0,0|1,1,0]=4 770 B14R1.483 CNC(=S)Nc1ccccc1COC Amb27806211 [0,1,1,0,0,0|1,1,0]=4 771 B14R1.483 CNCc1ccccc1NC(=O)NC Amb28139325 [0,1,1,0,0,0|2,0,0]=4 772 B14R1.483 COCc1ccccc1NC(=O)CBr Amb27202134 [0,1,1,0,0,0|2,0,0]=4 773 B14R1.483 COCc1ccccc1NC(=O)CCl Amb9562703 [0,1,1,0,0,0|2,0,0]=4 774 B14R1.483 COCc1ccccc1NC(=O)OC Amb27236825 [0,1,1,0,0,0|2,0,0]=4 775 B14R1.483 COCc1ccccc1N\C(N)=N\O Amb19080692 [0,1,1,0,0,0|1,0,1]=4 776 B14R1.965 C#CCC(=O)Nc1ccccc1OC Amb35727915 [0,1,1,0,0,0|2,0,0]=4 777 B14R1.965 CCCC(=O)Nc1ccccc1OC Amb2660689 [0,1,1,0,0,0|2,0,0]=4 778 B14R1.965 CCNC(=N)Nc1ccccc1OC Amb19061811 [0,1,1,0,0,0|2,0,0]=4 779 B14R1.965 CCNC(=O)Nc1ccccc1CC Amb4018361 [0,1,1,0,0,0|2,0,0]=4 780 B14R1.965 CCNC(=S)Nc1ccccc1OC Amb1845367 [0,1,1,0,0,0|1,1,0]=4 781 B14R1.965 CCc1ccccc1NC(=O)CCO Amb17336615 [0,1,1,0,0,0|2,0,0]=4 782 B14R1.965 CCc1ccccc1NC(=O)CNC Amb2283976 [0,1,1,0,0,0|2,0,0]=4 783 B14R1.965 CCc1ccccc1NC(=O)CNC Amb2370813 [0,1,1,0,0,0|2,0,0]=4 784 B14R1.965 CCc1ccccc1NC(=O)COC Amb2661448 [0,1,1,0,0,0|2,0,0]=4 785 B14R1.965 CCc1ccccc1NC(=O)\C=N\O Amb6360303 [0,1,1,0,0,0|1,0,1]=4 786 B14R1.965 CNCC(=O)Nc1ccccc1OC Amb6245791 [0,1,1,0,0,0|1,0,0]=3 787 B14R1.965 CNCC(=O)Nc1ccccc1SC Amb1105915 [0,1,1,0,0,0|1,1,0]=4 788 B14R1.965 CNCC(=O)Nc1ccccc1SC Amb2276037 [0,1,1,0,0,0|1,1,0]=4 789 B14R1.965 COCC(=O)Nc1ccccc1OC Amb2661449 [0,1,1,0,0,0|1,0,0]=3 790 B14R1.965 COCC(=O)Nc1ccccc1SC Amb23247532 [0,1,1,0,0,0|1,1,0]=4 791 B14R1.965 COCC(=O)Nc1cccnc1OC Amb19410909 [0,1,1,0,0,0|2,0,0]=4 792 B14R1.965 COCC(=O)Nc1ncccc1OC Amb27216445 [0,1,1,0,0,0|2,0,0]=4 793 B14R1.965 COc1ccccc1CC(=O)NC#N Amb27170481 [0,1,1,0,0,0|2,0,0]=4 794 B14R1.965 COc1ccccc1NC(=O)CC#N Amb1103451 [0,1,1,0,0,0|2,0,0]=4 795 B14R1.965 COc1ccccc1NC(=O)CCCl Amb6663182 [0,1,1,0,0,0|2,0,0]=4 796 B14R1.965 COc1ccccc1NC(=O)CCI Amb27458168 [0,1,1,0,0,0|2,0,0]=4 797 B14R1.965 COc1ccccc1NC(=O)CCN Amb15740910 [0,1,1,0,0,0|2,0,0]=4 798 B14R1.965 COc1ccccc1NC(=O)CCN Amb843855 [0,1,1,0,0,0|2,0,0]=4 799 B14R1.965 COc1ccccc1NC(=O)CCO Amb9421426 [0,1,1,0,0,0|1,0,0]=3 800 B14R1.965 COc1ccccc1NC(=O)CNO Amb27254273 [0,1,1,0,0,0|0,0,0]=2 801 B14R1.965 COc1ccccc1NC(=O)CON Amb21929163 [0,1,1,0,0,0|1,0,0]=3 802 B14R1.965 COc1ccccc1NC(=O)N=[N+]=[N-] Amb27407883 [0,1,1,0,0,0|1,0,1]=4 803 B14R1.965 COc1ccccc1NC(=O)OCCl Amb29885947 [0,1,1,0,0,0|2,0,0]=4 804 B14R1.965 COc1ccccc1NC(=O)\C=N\O Amb6467884 [0,1,1,0,0,0|0,0,1]=3 805 B14R1.965 COc1ccccc1NC(=S)NC#N Amb27776655 [0,1,1,0,0,0|1,1,0]=4 806 B14R1.965 COc1ccccc1OC(=O)NC#N Amb28388638 [0,1,1,0,0,0|2,0,0]=4 807 B14R1.965 C\C=C\C(=O)Nc1ccccc1OC Amb8509440 [0,1,1,0,0,0|2,0,0]=4 808 B14R1.965 [C-]#[N+]CC(=O)Nc1ccccc1OC Amb27166513 [0,1,1,0,0,0|1,0,1]=4 809 B14R1.2178 CCc1cccc(C)c1NC(=O)CO Amb1110529 [0,1,1,0,0,0|2,0,0]=4 810 B14R1.2178 CCc1cccc(C)c1NC(=O)NC Amb4020839 [0,1,1,0,0,0|2,0,0]=4 811 B14R1.2178 COc1cccc(C)c1NC(=O)CBr Amb27857210 [0,1,1,0,0,0|2,0,0]=4 812 B14R1.3135 CCc1ccccc1NC(=O)C(=O)O Amb9303997 [0,1,1,0,0,0|2,0,0]=4 813 B14R1.3135 CCc1ccccc1NC(=O)C(C)O Amb17401765 [0,1,1,0,0,0|2,0,0]=4 814 B14R1.3135 CCc1ccccc1NC(=O)N(C)C Amb3098179 [0,1,1,0,0,0|2,0,0]=4 815 B14R1.3135 COc1ccccc1CC(=O)C(=O)O Amb1135187 [0,1,1,0,0,0|2,0,0]=4 816 B14R1.3135 COc1ccccc1NC(=N)C(=O)O Amb18651744 [0,1,1,0,0,0|2,0,0]=4 817 B14R1.3135 COc1ccccc1NC(=O)C(=O)O Amb838967 [0,1,1,0,0,0|1,0,0]=3 818 B14R1.3135 COc1ccccc1NC(=O)C(C)=O Amb17401706 [0,1,1,0,0,0|1,0,1]=4 819 B14R1.3135 COc1ccccc1NC(=O)C(C)Br Amb2725317 [0,1,1,0,0,0|2,0,0]=4 820 B14R1.3135 COc1ccccc1NC(=O)C(C)C Amb1234367 [0,1,1,0,0,0|2,0,0]=4 821 B14R1.3135 COc1ccccc1NC(=O)C(C)Cl Amb2266287 [0,1,1,0,0,0|2,0,0]=4 822 B14R1.3135 COc1ccccc1NC(=O)C(C)O Amb11209042 [0,1,1,0,0,0|1,0,0]=3 823 B14R1.3135 COc1ccccc1NC(=O)C(Cl)Cl Amb3357999 [0,1,1,0,0,0|2,0,0]=4 824 B14R1.3135 COc1ccccc1NC(=O)C(N)=O Amb1859558 [0,1,1,0,0,0|1,0,1]=4 825 B14R1.3135 COc1ccccc1NC(=O)[C@@H](C)N Amb18527918 [0,1,1,0,0,0|2,0,0]=4 826 B14R1.3135 COc1ccccc1NC(=O)[C@H](C)O Amb27957789 [0,1,1,0,0,0|1,0,0]=3 827 B14R1.3135 COc1ccccc1NC(=S)C(=O)O Amb19895263 [0,1,1,0,0,0|1,1,0]=4 828 B14R1.3135 CSc1ccccc1NC(=O)C(=O)O Amb26839846 [0,1,1,0,0,0|1,1,0]=4 829 B14R1.3136 CN\C(=N\N)Nc1ccccc1OC Amb28314619 [0,1,1,0,0,0|2,0,0]=4 830 B14R1.3279 C#CC(=O)Nc1cc(C)ccc1OC Amb30017882 [0,1,1,0,0,0|2,0,0]=4 831 B14R1.3279 C#CC(=O)Nc1cc(Cl)ccc1OC Amb29862717 [0,1,1,0,0,0|2,0,0]=4 832 B14R1.3279 C=CC(=O)Nc1cc(Br)ccc1OC Amb28129737 [0,1,1,0,0,0|2,0,0]=4 833 B14R1.3279 C=CC(=O)Nc1cc(N)ccc1OC Amb27240620 [0,1,1,0,0,0|2,0,0]=4 834 B14R1.3279 CCC(=O)Nc1cc(Br)ccc1OC Amb11466148 [0,1,1,0,0,0|2,0,0]=4 835 B14R1.3279 CCC(=O)Nc1cc(C)ccc1OC Amb6491456 [0,1,1,0,0,0|2,0,0]=4 836 B14R1.3279 CCC(=O)Nc1cc(Cl)ccc1OC Amb1885388 [0,1,1,0,0,0|2,0,0]=4 837 B14R1.3279 CCC(=O)Nc1cc(N)ccc1OC Amb1118539 [0,1,1,0,0,0|2,0,0]=4 838 B14R1.3279 CNC(=O)Cc1cc(C)ccc1OC Amb8333505 [0,1,1,0,0,0|2,0,0]=4 839 B14R1.3279 CNC(=O)Cc1cc(Cl)ccc1OC Amb10190476 [0,1,1,0,0,0|2,0,0]=4 840 B14R1.3279 CNC(=O)Nc1cc(N)ccc1OC Amb28409094 [0,1,1,0,0,0|1,0,0]=3 841 B14R1.3279 CNC(=S)Nc1cc(C)ccc1OC Amb8601740 [0,1,1,0,0,0|1,1,0]=4 842 B14R1.3279 COC(=O)Nc1cc(Cl)ccc1OC Amb6490680 [0,1,1,0,0,0|2,0,0]=4 843 B14R1.3279 COC(=O)Nc1cc(N)ccc1OC Amb6668680 [0,1,1,0,0,0|2,0,0]=4 844 B14R1.3279 COc1ccc(Br)cc1NC(=O)CBr Amb27970689 [0,1,1,0,0,0|2,0,0]=4 845 B14R1.3279 COc1ccc(Br)cc1NC(=O)CCl Amb27605725 [0,1,1,0,0,0|2,0,0]=4 846 B14R1.3279 COc1ccc(Br)cc1NC(=O)CN Amb18246716 [0,1,1,0,0,0|2,0,0]=4 847 B14R1.3279 COc1ccc(C)cc1CC(=O)CO Amb18565476 [0,1,1,0,0,0|2,0,0]=4 848 B14R1.3279 COc1ccc(C)cc1CC(=O)NN Amb2209304 [0,1,1,0,0,0|2,0,0]=4 849 B14R1.3279 COc1ccc(C)cc1NC(=O)CBr Amb4311258 [0,1,1,0,0,0|2,0,0]=4 850 B14R1.3279 COc1ccc(C)cc1NC(=O)CCl Amb1207247 [0,1,1,0,0,0|2,0,0]=4 851 B14R1.3279 COc1ccc(C)cc1NC(=O)CN Amb208336 [0,1,1,0,0,0|2,0,0]=4 852 B14R1.3279 COc1ccc(C)cc1NC(=O)CN Amb2371415 [0,1,1,0,0,0|2,0,0]=4 853 B14R1.3279 COc1ccc(C)cc1NC(=O)CO Amb9421493 [0,1,1,0,0,0|1,0,0]=3 854 B14R1.3279 COc1ccc(C)cc1NC(=O)CS Amb843723 [0,1,1,0,0,0|1,1,0]=4 855 B14R1.3279 COc1ccc(C)cc1NC(=O)NN Amb8853953 [0,1,1,0,0,0|1,0,0]=3 856 B14R1.3279 COc1ccc(C)cc1NC(=S)NN Amb2689152 [0,1,1,0,0,0|1,1,0]=4 857 B14R1.3279 COc1ccc(C)cc1N\C(N)=N\O Amb19080677 [0,1,1,0,0,0|1,0,1]=4 858 B14R1.3279 COc1ccc(Cl)cc1CC(=O)CO Amb18066841 [0,1,1,0,0,0|2,0,0]=4 859 B14R1.3279 COc1ccc(Cl)cc1NC(=O)CBr Amb4311186 [0,1,1,0,0,0|2,0,0]=4 860 B14R1.3279 COc1ccc(Cl)cc1NC(=O)CCl Amb1644312 [0,1,1,0,0,0|2,0,0]=4 861 B14R1.3279 COc1ccc(Cl)cc1NC(=O)CN Amb5783087 [0,1,1,0,0,0|2,0,0]=4 862 B14R1.3279 COc1ccc(Cl)cc1NC(=O)CO Amb9421506 [0,1,1,0,0,0|1,0,0]=3 863 B14R1.3279 COc1ccc(F)cc1CC(=O)CO Amb18566005 [0,1,1,0,0,0|2,0,0]=4 864 B14R1.3279 COc1ccc(F)cc1NC(=O)CCl Amb28191069 [0,1,1,0,0,0|2,0,0]=4 865 B14R1.3279 COc1ccc(F)cc1NC(=O)CN Amb18244101 [0,1,1,0,0,0|2,0,0]=4 866 B14R1.3302 C=C(C)c1ccccc1NC(=O)NC Amb27868444 [0,1,1,0,0,0|2,0,0]=4 867 B14R1.3302 CC(=O)c1ccccc1NC(=O)CO Amb1111281 [0,1,1,0,0,0|2,0,0]=4 868 B14R1.3302 CC(C)c1ccccc1NC(=O)CO Amb9421477 [0,1,1,0,0,0|2,0,0]=4 869 B14R1.3302 CNC(=O)Nc1ccccc1C(C)=O Amb28060195 [0,1,1,0,0,0|2,0,0]=4 870 B14R1.3302 CNC(=O)Nc1ccccc1C(C)C Amb28198417 [0,1,1,0,0,0|2,0,0]=4 871 B14R1.3302 CNC(=O)Nc1ccccc1C(C)N Amb28409131 [0,1,1,0,0,0|2,0,0]=4 872 B14R1.3302 CNC(=O)Nc1ccccc1C(C)O Amb28188991 [0,1,1,0,0,0|2,0,0]=4 873 B14R1.3417 C#CC(=O)Nc1ccc(C)cc1OC Amb30017823 [0,1,1,0,0,0|2,0,0]=4 874 B14R1.3417 C#CC(=O)Nc1ccc(F)cc1OC Amb30017592 [0,1,1,0,0,0|2,0,0]=4 875 B14R1.3417 C=CC(=O)Nc1ccc(F)cc1OC Amb19052159 [0,1,1,0,0,0|2,0,0]=4 876 B14R1.3417 CCC(=O)Nc1ccc(F)cc1OC Amb10717146 [0,1,1,0,0,0|2,0,0]=4 877 B14R1.3417 CCC(=O)Nc1ccc(N)cc1OC Amb1114060 [0,1,1,0,0,0|2,0,0]=4 878 B14R1.3417 CCC(=O)Nc1ccc(N)cc1OC Amb22587053 [0,1,1,0,0,0|2,0,0]=4 879 B14R1.3417 CCc1cc(Br)ccc1NC(=O)NC Amb27603959 [0,1,1,0,0,0|2,0,0]=4 880 B14R1.3417 CCc1cc(Br)ccc1NC(=O)NN Amb27250325 [0,1,1,0,0,0|2,0,0]=4 881 B14R1.3417 CNC(=O)Nc1ccc(F)cc1OC Amb28121718 [0,1,1,0,0,0|1,0,0]=3 882 B14R1.3417 CNC(=O)Nc1ccc(N)cc1OC Amb28409095 [0,1,1,0,0,0|1,0,0]=3 883 B14R1.3417 CNC(=O)Oc1ccc(N)cc1OC Amb27433702 [0,1,1,0,0,0|2,0,0]=4 884 B14R1.3417 CNC(=S)Nc1ccc(F)cc1OC Amb27790533 [0,1,1,0,0,0|1,1,0]=4 885 B14R1.3417 COC(=O)Nc1ccc(N)cc1OC Amb1094726 [0,1,1,0,0,0|2,0,0]=4 886 B14R1.3417 COc1cc(C)ccc1NC(=S)NN Amb27203691 [0,1,1,0,0,0|1,1,0]=4 887 B14R1.3417 COc1cc(F)ccc1NC(=O)CN Amb18978733 [0,1,1,0,0,0|2,0,0]=4 888 B14R1.3995 CNC(=O)Nc1cccc(Cl)c1OC Amb4036123 [0,1,1,0,0,0|1,0,0]=3 889 B14R1.3995 COC(=O)Nc1cccc(Cl)c1OC Amb4001699 [0,1,1,0,0,0|2,0,0]=4 890 B14R1.3995 COc1c(Cl)cccc1NC(=O)CCl Amb4008878 [0,1,1,0,0,0|2,0,0]=4 891 B14R1.3995 COc1c(F)cccc1NC(=O)CCl Amb27209698 [0,1,1,0,0,0|2,0,0]=4 892 B14R1.41 COc1cc(C(N)C(N)=O)ccc1O Amb17337067 [0,1,1,0,0,0|2,0,0]=4 893 B14R1.41 COc1cc(C(O)C(=O)O)ccc1Br Amb26074333 [0,1,1,0,0,0|2,0,0]=4 894 B14R1.41 COc1cc(C(O)C(=O)O)ccc1C Amb25861873 [0,1,1,0,0,0|2,0,0]=4 895 B14R1.41 COc1cc(C(O)C(=O)O)ccc1Cl Amb25664377 [0,1,1,0,0,0|2,0,0]=4 896 B14R1.41 COc1cc(C(O)C(=O)O)ccc1F Amb18810905 [0,1,1,0,0,0|2,0,0]=4 897 B14R1.41 COc1cc(C(O)C(=O)O)ccc1N Amb27417625 [0,1,1,0,0,0|2,0,0]=4 898 B14R1.41 COc1cc(C(O)C(=O)O)ccc1O Amb540926 [0,1,1,0,0,0|2,0,0]=4 899 B14R1.41 COc1cc(C(O)C(=O)[O-])ccc1O Amb22263098 [0,1,1,0,0,0|2,0,0]=4 900 B14R1.41 COc1cc(N(C)C(C)=O)ccc1O Amb18652095 [0,1,1,0,0,0|2,0,0]=4 901 B14R1.41 COc1cc([C@@H](O)C(=O)O)ccc1O Amb25200997 [0,1,1,0,0,0|2,0,0]=4 902 B14R1.79 C#CC(=O)N(C)c1cccc(OC)c1 Amb35702181 [0,1,1,0,0,0|2,0,0]=4 903 B14R1.79 CNC(=O)C(=O)c1cccc(OC)c1 Amb17336563 [0,1,1,0,0,0|1,0,1]=4 904 B14R1.79 CNC(=O)C(N)c1cccc(OC)c1 Amb26500619 [0,1,1,0,0,0|2,0,0]=4 905 B14R1.79 CNC(=O)C(O)c1cccc(OC)c1 Amb27812262 [0,1,1,0,0,0|1,0,0]=3 906 B14R1.79 CNC(=O)N(C)c1cccc(OC)c1 Amb27484535 [0,1,1,0,0,0|1,0,0]=3 907 B14R1.79 COC(=O)C(O)c1cccc(OC)c1 Amb19081477 [0,1,1,0,0,0|2,0,0]=4 908 B14R1.79 COc1cccc(C(C)C(=O)NN)c1 Amb26327285 [0,1,1,0,0,0|2,0,0]=4 909 B14R1.79 COc1cccc(C(O)C(=O)NN)c1 Amb24615347 [0,1,1,0,0,0|1,0,0]=3 910 B14R1.79 COc1cccc(N(C)C(=O)CCl)c1 Amb17241546 [0,1,1,0,0,0|2,0,0]=4 911 B14R1.79 COc1cccc(N(C)C(=O)CN)c1 Amb17060285 [0,1,1,0,0,0|1,0,0]=3 912 B14R1.79 COc1cccc(N(C)C(=O)NN)c1 Amb19043011 [0,1,1,0,0,0|1,0,0]=3 913 B14R1.79 COc1cccc(N(C)\C(N)=N\N)c1 Amb27253764 [0,1,1,0,0,0|2,0,0]=4 914 B14R1.79 CSc1cccc(N(C)C(=O)CN)c1 Amb31102952 [0,1,1,0,0,0|1,1,0]=4 915 B14R1.80 CNC(C(N)=O)c1cccc(OC)c1 Amb17336823 [0,1,1,0,0,0|2,0,0]=4 916 B14R1.80 COc1cccc(C(OC)C(=O)O)c1 Amb32667536 [0,1,1,0,0,0|2,0,0]=4 917 B14R1.382 COc1cc(Br)cc(C(O)C(=O)O)c1 Amb24435199 [0,1,1,0,0,0|2,0,0]=4 918 B14R1.382 COc1cc(C)cc(C(O)C(=O)O)c1 Amb26359840 [0,1,1,0,0,0|2,0,0]=4 919 B14R1.382 COc1cc(Cl)cc(C(O)C(=O)O)c1 Amb27773695 [0,1,1,0,0,0|2,0,0]=4 920 B14R1.382 COc1cc(F)cc(C(O)C(=O)O)c1 Amb27633206 [0,1,1,0,0,0|2,0,0]=4 921 B14R1.382 COc1cc(N)cc(C(O)C(=O)O)c1 Amb24357377 [0,1,1,0,0,0|2,0,0]=4 922 B14R1.382 COc1cc(O)cc(C(O)C(=O)O)c1 Amb25774342 [0,1,1,0,0,0|2,0,0]=4 923 B14R1.2340 COc1ccc(Br)c(C(O)C(=O)O)c1 Amb26536122 [0,1,1,0,0,0|2,0,0]=4 924 B14R1.2340 COc1ccc(Br)c(C(O)C(N)=O)c1 Amb27812561 [0,1,1,0,0,0|1,0,0]=3 925 B14R1.2340 COc1ccc(C)c(C(O)C(=O)O)c1 Amb27471903 [0,1,1,0,0,0|2,0,0]=4 926 B14R1.2340 COc1ccc(F)c(C(O)C(=O)O)c1 Amb28185979 [0,1,1,0,0,0|2,0,0]=4 927 B14R1.2340 COc1ccc(N)c(C(O)C(=O)O)c1 Amb27753160 [0,1,1,0,0,0|2,0,0]=4 928 B14R1.2340 COc1ccc(O)c(C(O)C(=O)O)c1 Amb27431973 [0,1,1,0,0,0|2,0,0]=4 929 B14R1.3326 CCOc1cccc(C(N)C(N)=O)c1 Amb17336826 [0,1,1,0,0,0|2,0,0]=4 930 B14R1.3326 CCOc1cccc(C(O)C(=O)O)c1 Amb19011231 [0,1,1,0,0,0|2,0,0]=4 931 B14R1.3326 COCc1cccc(C(O)C(=O)O)c1 Amb33080456 [0,1,1,0,0,0|2,0,0]=4 932 B14R1.3583 COc1cccc(C(C)(O)C(=O)O)c1 Amb17310104 [0,1,1,0,0,0|2,0,0]=4 933 B14R1.3583 COc1cccc(C(C)(O)C(C)=O)c1 Amb27198523 [0,1,1,0,0,0|2,0,0]=4 934 B14R1.3583 COc1cccc(C(C)(O)C(N)=O)c1 Amb19080610 [0,1,1,0,0,0|1,0,0]=3 935 B14R1.3583 COc1cccc([C@](C)(N)C(N)=O)c1 Amb28135421 [0,1,1,0,0,0|2,0,0]=4 936 B14R1.2180 COc1cccc(C#N)c1NC(C)=O Amb27194241 [0,1,1,0,0,0|2,0,0]=4 937 B14R1.2180 COc1cccc(C=O)c1NC(C)=O Amb18651438 [0,1,1,0,0,0|1,0,1]=4 938 B14R1.2180 COc1cccc(CN)c1NC(N)=O Amb27257493 [0,1,1,0,0,0|2,0,0]=4 939 B14R1.2180 COc1cccc(CO)c1OC(C)=O Amb23576040 [0,1,1,0,0,0|2,0,0]=4 940 B14R1.2180 COc1cccc(OC)c1NC(C)=O Amb25814455 [0,1,1,0,0,0|2,0,0]=4 941 B14R1.3100 COc1cccc(C(C)=O)c1NC=O Amb25858836 [0,1,1,0,0,0|1,0,1]=4 942 B14R1.14884 COc1cc(C)cc(OC)c1NC=O Amb27395887 [0,1,1,0,0,0|2,0,0]=4 943 B14R2.1072 COc1cccc2c(CO)csc12 Amb22296246 [1,1,0,0,0,0|2,0,0]=4 944 B14R2.1072 COc1cccc2c1NCC2CO Amb18063469 [1,1,0,0,0,0|1,0,1]=4 945 B14R2.1745 COc1ccc(S)c2c(O)csc12 Amb27618665 [1,1,0,0,0,0|2,0,0]=4 946 B14R2.1938 COc1cc(Br)cc2c(O)csc12 Amb28057239 [1,1,0,0,0,0|2,0,0]=4 947 B14R2.1938 COc1cc(Cl)cc2c(O)csc12 Amb28131735 [1,1,0,0,0,0|2,0,0]=4 948 B14R2.1938 COc1cc(F)cc2c(O)csc12 Amb27784359 [1,1,0,0,0,0|2,0,0]=4 949 B14R2.3818 COc1c(C)ccc2c1ccn2C Amb27966250 [1,1,0,0,0,0|2,0,0]=4 950 B14R2.3818 COc1c(N)ccc2c(O)csc12 Amb27493199 [1,1,0,0,0,0|2,0,0]=4 951 B14R2.11691 COc1cccc2c(C)cn(C)c12 Amb18243619 [1,1,0,0,0,0|2,0,0]=4 952 B14R2.11691 COc1cccc2c1c(C)cn2C Amb10558865 [1,1,0,0,0,0|2,0,0]=4 953 B14R2.535 CCOc1cccc2c1NC(=O)C2 Amb25701911 [1,1,0,0,0,0|1,0,0]=3 954 B14R2.535 CCOc1cccc2c1NC(=O)S2 Amb27187490 [1,1,0,0,0,0|1,0,0]=3 955 B14R2.535 CCOc1cccc2c1NC(=S)S2 Amb18043610 [1,1,0,0,0,0|1,1,0]=4 956 B14R2.535 CCOc1cccc2c1SC(=O)N2 Amb24737590 [1,1,0,0,0,0|1,0,0]=3 957 B14R2.535 CNCc1cccc2c1OC(=O)N2 Amb32698253 [1,1,0,0,0,0|2,0,0]=4 958 B14R2.535 NCCc1cccc2c1NC(=O)C2 Amb18196765 [1,1,0,0,0,0|2,0,0]=4 959 B14R2.535 NCCc1cccc2c1NC(=O)N2 Amb18196139 [1,1,0,0,0,0|1,0,0]=3 960 B14R2.535 O=C1Cc2c(CCBr)cccc2N1 Amb8396109 [1,1,0,0,0,0|2,0,0]=4 961 B14R2.535 O=C1Cc2c(CCCl)cccc2N1 Amb28436435 [1,1,0,0,0,0|2,0,0]=4 962 B14R2.535 O=C1Cc2c(CCO)cccc2N1 Amb8393102 [1,1,0,0,0,0|2,0,0]=4 963 B14R2.535 O=C1Nc2cccc(CCO)c2O1 Amb22411465 [1,1,0,0,0,0|2,0,0]=4 964 B14R2.712 CC(=O)c1cccc2c1NC(=O)N2 Amb23412229 [1,1,0,0,0,0|1,0,0]=3 965 B14R2.712 CC(=O)c1cccc2c1NC(=O)O2 Amb20663539 [1,1,0,0,0,0|2,0,0]=4 966 B14R2.712 CC(=O)c1cccc2c1OC(=O)N2 Amb18547332 [1,1,0,0,0,0|2,0,0]=4 967 B14R2.712 CC(=O)c1nccc2c1NC(=O)N2 Amb28193307 [1,1,0,0,0,0|2,0,0]=4 968 B14R2.712 CC(C)c1cccc2c1NC(=O)C2 Amb24461265 [1,1,0,0,0,0|2,0,0]=4 969 B14R2.712 CC(C)c1cccc2c1NC(=O)N2 Amb25980875 [1,1,0,0,0,0|1,0,0]=3 970 B14R2.712 CC(C)c1cccc2c1OC(=O)N2 Amb18547333 [1,1,0,0,0,0|2,0,0]=4 971 B14R2.712 CC(N)c1cccc2c1OC(=O)N2 Amb27421890 [1,1,0,0,0,0|2,0,0]=4 972 B14R2.712 O=C1Nc2cccc(B(O)O)c2N1 Amb24529630 [1,1,0,0,0,0|2,0,0]=4 973 B14R2.712 O=C1Nc2cccc(C(=O)O)c2N1 Amb22001975 [1,1,0,0,0,0|2,0,0]=4 974 B14R2.712 O=C1Nc2cccc([N+](=O)[O-])c2N1 Amb19892401 [1,1,0,0,0,0|2,0,0]=4 975 B14R2.1726 COc1ccc(Br)c2c1NC(=O)C2 Amb22896597 [1,1,0,0,0,0|1,0,0]=3 976 B14R2.1726 COc1ccc(Br)c2c1NC(=O)N2 Amb28124962 [1,1,0,0,0,0|0,0,0]=2 977 B14R2.1726 COc1ccc(Br)c2c1NC(=O)S2 Amb27641072 [1,1,0,0,0,0|1,0,0]=3 978 B14R2.1726 COc1ccc(C)c2c1CC(=O)N2 Amb24329123 [1,1,0,0,0,0|1,0,0]=3 979 B14R2.1726 COc1ccc(C)c2c1NC(=O)C2 Amb18243687 [1,1,0,0,0,0|1,0,0]=3 980 B14R2.1726 COc1ccc(C)c2c1NC(=O)O2 Amb27166354 [1,1,0,0,0,0|1,0,0]=3 981 B14R2.1726 COc1ccc(C)c2c1NC(=O)S2 Amb24624661 [1,1,0,0,0,0|1,0,0]=3 982 B14R2.1726 COc1ccc(C)c2c1SC(=O)N2 Amb28366960 [1,1,0,0,0,0|1,0,0]=3 983 B14R2.1726 COc1ccc(Cl)c2c1CC(=O)N2 Amb18244100 [1,1,0,0,0,0|1,0,0]=3 984 B14R2.1726 COc1ccc(Cl)c2c1NC(=O)C2 Amb33547347 [1,1,0,0,0,0|1,0,0]=3 985 B14R2.1726 COc1ccc(F)c2c1NC(=O)N2 Amb27264238 [1,1,0,0,0,0|0,0,0]=2 986 B14R2.1726 Cc1ccc(C#N)c2c1NC(=O)N2 Amb27586943 [1,1,0,0,0,0|2,0,0]=4 987 B14R2.1925 CCc1cc(Br)cc2c1NC(=O)C2 Amb27661835 [1,1,0,0,0,0|2,0,0]=4 988 B14R2.1925 CCc1cc(Br)cc2c1OC(=O)N2 Amb18547438 [1,1,0,0,0,0|2,0,0]=4 989 B14R2.1925 CCc1cc(N)cc2c1OC(=O)N2 Amb18046752 [1,1,0,0,0,0|2,0,0]=4 990 B14R2.1925 COc1cc(Br)cc2c1NC(=O)C2 Amb25085189 [1,1,0,0,0,0|1,0,0]=3 991 B14R2.1925 COc1cc(C)cc2c1NC(=O)C2 Amb18243685 [1,1,0,0,0,0|1,0,0]=3 992 B14R2.1925 COc1cc(Cl)cc2c1NC(=O)N2 Amb28367060 [1,1,0,0,0,0|0,0,0]=2 993 B14R2.1925 COc1cc(O)cc2c1NC(=O)O2 Amb27463333 [1,1,0,0,0,0|1,0,0]=3 994 B14R2.1925 COc1cc(O)cc2c1OC(=O)S2 Amb25049397 [1,1,0,0,0,0|2,0,0]=4 995 B14R2.1925 N#Cc1cc(Cl)cc2c1NC(=O)N2 Amb27494992 [1,1,0,0,0,0|2,0,0]=4 996 B14R2.1925 O=Cc1cc(Br)cc2c1NC(=O)N2 Amb33746156 [1,1,0,0,0,0|2,0,0]=4 997 B14R2.3809 COc1c(C)ccc2c1NC(=S)N2 Amb25242618 [1,1,0,0,0,0|0,1,0]=3 998 B14R2.3809 COc1c(Cl)ccc2c1NC(=O)N2 Amb27852486 [1,1,0,0,0,0|0,0,0]=2 999 B14R2.3809 COc1c(F)ccc2c1NC(=O)N2 Amb27784172 [1,1,0,0,0,0|0,0,0]=2 1000 B14R2.3809 COc1c(O)ccc2c1SC(=O)O2 Amb27431702 [1,1,0,0,0,0|2,0,0]=4 1001 B14R2.3809 Cc1ccc2c(c1C#N)NC(=O)N2 Amb28124765 [1,1,0,0,0,0|2,0,0]=4 1002 B14R2.3809 N#Cc1c(F)ccc2c1NC(=O)N2 Amb27236966 [1,1,0,0,0,0|2,0,0]=4 1003 B14R2.11646 COc1cccc2c1CS(=O)(=O)N2 Amb32666957 [1,1,0,0,0,0|2,0,0]=4 1004 B14R2.11647 COc1cccc2c1S\C(=N/N)N2 Amb25668027 [1,1,0,0,0,0|2,0,0]=4 1005 B14R2.11647 COc1cccc2cc(C=O)oc12 Amb1104840 [1,1,0,0,0,0|2,0,0]=4 1006 B14R2.11647 COc1cccc2cc(C=O)sc12 Amb18141135 [1,1,0,0,0,0|2,0,0]=4 1007 B14R2.11647 COc1cccc2nc(C=O)sc12 Amb26512099 [1,1,0,0,0,0|1,0,1]=4 1008 B14R2.11647 COc1cccc2oc(C=O)cc12 Amb18197067 [1,1,0,0,0,0|2,0,0]=4 1009 B14R2.11647 COc1cccc2oc(C=O)nc12 Amb27248854 [1,1,0,0,0,0|1,0,1]=4 1010 B14R2.11647 COc1cccc2sc(C=O)cc12 Amb18675007 [1,1,0,0,0,0|2,0,0]=4 1011 B14R2.11690 CCc1cccc2c1C(=O)C(=O)N2 Amb22008624 [1,1,0,0,0,0|2,0,0]=4 1012 B14R2.11690 CCc1cccc2c1C(O)C(=O)N2 Amb22008625 [1,1,0,0,0,0|2,0,0]=4 1013 B14R2.11690 CCc1cccc2c1N(C)C(=O)C2 Amb25674782 [1,1,0,0,0,0|2,0,0]=4 1014 B14R2.11690 CNc1cccc2c1C(=O)C(=O)N2 Amb32680239 [1,1,0,0,0,0|2,0,0]=4 1015 B14R2.11690 COc1cccc2c1C(=O)C(=O)C2 Amb27828840 [1,1,0,0,0,0|2,0,0]=4 1016 B14R2.11690 COc1cccc2c1C(=O)C(=O)N2 Amb33543987 [1,1,0,0,0,0|1,0,0]=3 1017 B14R2.11690 COc1cccc2c1N(C)C(=N)N2 Amb25996370 [1,1,0,0,0,0|1,0,0]=3 1018 B14R2.11690 COc1cccc2c1N(C)C(=N)S2 Amb21936886 [1,1,0,0,0,0|2,0,0]=4 1019 B14R2.11690 COc1cccc2c1N(C)C(=O)C2 Amb27250529 [1,1,0,0,0,0|1,0,0]=3 1020 B14R2.11690 COc1cccc2cc(C)n(C)c12 Amb18065231 [1,1,0,0,0,0|2,0,0]=4 1021 B14R2.11690 COc1cccc2nc(Cl)n(C)c12 Amb27228871 [1,1,0,0,0,0|1,0,1]=4 1022 B14R2.2151 Cc1cccc2c(O)c(C=O)sc12 Amb28196761 [1,1,0,0,0,0|2,0,0]=4 1023 B14R2.4220 CCC1C(=O)Nc2c(C)cccc21 Amb17233123 [1,1,0,0,0,0|2,0,0]=4 1024 B14R2.4220 CCN1C(=O)Cc2c(O)cccc21 Amb22227947 [1,1,0,0,0,0|2,0,0]=4 1025 B14R2.4220 CON1C(=O)Cc2c(C)cccc21 Amb27954252 [1,1,0,0,0,0|1,0,0]=3 1026 B14R2.4220 Cc1cccc2c1CC(=O)\C2=N/O Amb27854945 [1,1,0,0,0,0|2,0,0]=4 1027 B14R2.4220 Cc1cccc2c1NC(=O)C2C=O Amb27641505 [1,1,0,0,0,0|1,0,1]=4 1028 B14R2.4220 Cc1cccc2c1NC(=O)C2CN Amb17233196 [1,1,0,0,0,0|2,0,0]=4 1029 B14R2.4220 Cc1cccc2c1NC(=O)\C2=C/O Amb17039812 [1,1,0,0,0,0|1,0,0]=3 1030 B14R2.4220 Cc1cccc2c1NC(=O)\C2=N/N Amb24534410 [1,1,0,0,0,0|2,0,0]=4 1031 B14R2.4220 Cc1cccc2c1NC(=O)\C2=N/O Amb2370608 [1,1,0,0,0,0|1,0,0]=3 1032 B14R2.4220 O=C1Nc2c(Br)cccc2\C1=C\O Amb24055794 [1,1,0,0,0,0|2,0,0]=4 1033 B14R2.4220 O=C1Nc2c(Br)cccc2\C1=N\O Amb22757088 [1,1,0,0,0,0|2,0,0]=4 1034 B14R2.4220 O=C1Nc2c(Cl)cccc2\C1=N\O Amb19650784 [1,1,0,0,0,0|2,0,0]=4 1035 B14R2.4220 O=C1Nc2c(F)cccc2\C1=N\O Amb22735467 [1,1,0,0,0,0|2,0,0]=4 1036 B14R2.7970 CC1(O)C(=O)Nc2c(Cl)cccc21 Amb27224799 [1,1,0,0,0,0|2,0,0]=4 1037 B14R2.7970 CC1(O)C(=O)Nc2c(F)cccc21 Amb27238563 [1,1,0,0,0,0|2,0,0]=4 1038 B14R2.7970 Cc1cccc2c1NC(=O)C2(C)C Amb5494130 [1,1,0,0,0,0|2,0,0]=4 1039 B14R2.7970 Cc1cccc2c1NC(=O)C2(C)N Amb27240879 [1,1,0,0,0,0|2,0,0]=4 1040 B14R2.7970 Cc1cccc2c1NC(=O)[C@@]2(C)N Amb27764124 [1,1,0,0,0,0|2,0,0]=4 1041 B14R2.8620 Cc1ccc(Br)c2c1C(O)C(=O)N2 Amb27591248 [1,1,0,0,0,0|2,0,0]=4 1042 B14R2.8620 Cc1ccc(Br)c2c1NC(=O)C2=O Amb6297678 [1,1,0,0,0,0|1,0,1]=4 1043 B14R2.8620 Cc1ccc(Br)c2c1NC(=O)C2O Amb25277362 [1,1,0,0,0,0|1,0,0]=3 1044 B14R2.8620 Cc1ccc(C)c2c1CC(=O)N2C Amb28188860 [1,1,0,0,0,0|2,0,0]=4 1045 B14R2.8620 Cc1ccc(C)c2c1NC(=O)C2=O Amb6358820 [1,1,0,0,0,0|1,0,1]=4 1046 B14R2.8620 Cc1ccc(C)c2c1NC(=O)C2C Amb18243633 [1,1,0,0,0,0|2,0,0]=4 1047 B14R2.8620 Cc1ccc(C)c2c1NC(=O)C2O Amb18178350 [1,1,0,0,0,0|1,0,0]=3 1048 B14R2.8620 Cc1ccc(C)c2c1NC(=O)C2S Amb32788398 [1,1,0,0,0,0|1,1,0]=4 1049 B14R2.8620 Cc1ccc(C)c2c1NC(=O)N2C Amb26974462 [1,1,0,0,0,0|1,0,0]=3 1050 B14R2.8620 Cc1ccc(C)c2c1OC(=O)N2C Amb18046743 [1,1,0,0,0,0|2,0,0]=4 1051 B14R2.8620 Cc1ccc(Cl)c2c1C(O)C(=O)N2 Amb28144252 [1,1,0,0,0,0|2,0,0]=4 1052 B14R2.8620 Cc1ccc(Cl)c2c1NC(=O)C2=O Amb1141947 [1,1,0,0,0,0|1,0,1]=4 1053 B14R2.8620 Cc1ccc(Cl)c2c1NC(=O)C2O Amb18318315 [1,1,0,0,0,0|1,0,0]=3 1054 B14R2.8620 Cc1ccc(F)c2c1C(O)C(=O)N2 Amb18178970 [1,1,0,0,0,0|2,0,0]=4 1055 B14R2.8620 Cc1ccc(F)c2c1NC(=O)C2=O Amb1136370 [1,1,0,0,0,0|1,0,1]=4 1056 B14R2.8620 O=C1Nc2c(Br)ccc(F)c2C1O Amb27599623 [1,1,0,0,0,0|2,0,0]=4 1057 B14R2.8620 O=C1Nc2c(Cl)ccc(Cl)c2C1O Amb25857524 [1,1,0,0,0,0|2,0,0]=4 1058 B14R2.8620 O=C1Nc2c(F)ccc(Br)c2C1O Amb28184352 [1,1,0,0,0,0|2,0,0]=4 1059 B14R2.8620 O=C1Nc2c(F)ccc(Cl)c2C1O Amb26654319 [1,1,0,0,0,0|2,0,0]=4 1060 B14R2.8620 O=C1Nc2c(F)ccc(F)c2C1O Amb19045666 [1,1,0,0,0,0|2,0,0]=4 1061 B14R2.8620 O=C1Nc2c(O)ccc(O)c2C1=O Amb27979801 [1,1,0,0,0,0|1,0,1]=4 1062 B14R2.8737 Cc1c(Br)ccc2c1CC(=O)N2C Amb32641780 [1,1,0,0,0,0|2,0,0]=4 1063 B14R2.8737 Cc1c(Br)ccc2c1NC(=O)C2=O Amb25375925 [1,1,0,0,0,0|1,0,1]=4 1064 B14R2.8737 Cc1c(Br)ccc2c1NC(=O)C2O Amb24372421 [1,1,0,0,0,0|1,0,0]=3 1065 B14R2.8737 Cc1c(Cl)ccc2c1NC(=O)C2=O Amb6548829 [1,1,0,0,0,0|1,0,1]=4 1066 B14R2.8737 Cc1c(Cl)ccc2c1NC(=O)C2C Amb18894541 [1,1,0,0,0,0|2,0,0]=4 1067 B14R2.8737 Cc1c(F)ccc2c1NC(=O)C2=O Amb16232288 [1,1,0,0,0,0|1,0,1]=4 1068 B14R2.8737 Cc1c(F)ccc2c1NC(=O)N2O Amb28251358 [1,1,0,0,0,0|0,0,0]=2 1069 B14R2.8737 Cc1ccc2c(c1C)NC(=O)C2=O Amb6323585 [1,1,0,0,0,0|1,0,1]=4 1070 B14R2.8737 Cc1ccc2c(c1C)NC(=O)C2C Amb18243630 [1,1,0,0,0,0|2,0,0]=4 1071 B14R2.8737 Cc1ccc2c(c1C)NC(=O)C2N Amb17039796 [1,1,0,0,0,0|2,0,0]=4 1072 B14R2.8737 Cc1ccc2c(c1C)NC(=O)C2S Amb32788887 [1,1,0,0,0,0|1,1,0]=4 1073 B14R2.8737 Cc1ccc2c(c1C)OC(=O)N2C Amb18046744 [1,1,0,0,0,0|2,0,0]=4 1074 B14R2.8737 Cc1ccc2c(c1C)SC(=O)C2O Amb27833678 [1,1,0,0,0,0|2,0,0]=4 1075 B14R2.8737 O=C1Nc2c(ccc(Br)c2Cl)C1O Amb35721663 [1,1,0,0,0,0|2,0,0]=4 1076 B14R2.8737 O=C1Nc2c(ccc(Br)c2F)C1O Amb30029442 [1,1,0,0,0,0|2,0,0]=4 1077 B14R2.8737 O=C1Nc2c(ccc(Cl)c2Br)C1O Amb27238402 [1,1,0,0,0,0|2,0,0]=4 1078 B14R2.8737 O=C1Nc2c(ccc(Cl)c2Cl)C1O Amb19514843 [1,1,0,0,0,0|2,0,0]=4 1079 B14R2.8737 O=C1Nc2c(ccc(Cl)c2F)C1O Amb28365926 [1,1,0,0,0,0|2,0,0]=4 1080 B14R2.8737 O=C1Nc2c(ccc(F)c2Cl)C1O Amb30016243 [1,1,0,0,0,0|2,0,0]=4 1081 B14R2.8737 O=C1Nc2c(ccc(F)c2F)C1O Amb19045668 [1,1,0,0,0,0|2,0,0]=4 1082 B14R2.9184 Cc1cc(Br)c2c(c1)C(O)C(=O)N2 Amb28365924 [1,1,0,0,0,0|2,0,0]=4 1083 B14R2.9184 Cc1cc(Br)cc2c1NC(=O)C2=O Amb1068362 [1,1,0,0,0,0|1,0,1]=4 1084 B14R2.9184 Cc1cc(Br)cc2c1NC(=O)C2S Amb32788232 [1,1,0,0,0,0|1,1,0]=4 1085 B14R2.9184 Cc1cc(Br)cc2c1OC(=O)N2C Amb18545102 [1,1,0,0,0,0|2,0,0]=4 1086 B14R2.9184 Cc1cc(C)c2c(c1)C(=O)C(=O)N2 Amb1144391 [1,1,0,0,0,0|1,0,1]=4 1087 B14R2.9184 Cc1cc(C)c2c(c1)C(C)C(=O)N2 Amb18243631 [1,1,0,0,0,0|2,0,0]=4 1088 B14R2.9184 Cc1cc(C)c2c(c1)C(O)C(=O)N2 Amb18178354 [1,1,0,0,0,0|1,0,0]=3 1089 B14R2.9184 Cc1cc(C)c2c(c1)C(S)C(=O)N2 Amb32788483 [1,1,0,0,0,0|1,1,0]=4 1090 B14R2.9184 Cc1cc(C)c2c(c1)N(C)C(=O)C2 Amb26035325 [1,1,0,0,0,0|2,0,0]=4 1091 B14R2.9184 Cc1cc(C)c2c(c1)N(C)C(=O)O2 Amb18043112 [1,1,0,0,0,0|2,0,0]=4 1092 B14R2.9184 Cc1cc(Cl)c2c(c1)C(O)C(=O)N2 Amb18318313 [1,1,0,0,0,0|2,0,0]=4 1093 B14R2.9184 Cc1cc(Cl)cc2c1NC(=O)C2=O Amb1139767 [1,1,0,0,0,0|1,0,1]=4 1094 B14R2.9184 Cc1cc(Cl)cc2c1OC(=O)N2C Amb18043113 [1,1,0,0,0,0|2,0,0]=4 1095 B14R2.9184 Cc1cc(F)cc2c1NC(=O)C2=O Amb1126360 [1,1,0,0,0,0|1,0,1]=4 1096 B14R2.9184 Cc1cc(F)cc2c1NC(=O)C2O Amb18178971 [1,1,0,0,0,0|1,0,0]=3 1097 B14R2.9184 Cc1cc(F)cc2c1NC(=O)C2S Amb32788678 [1,1,0,0,0,0|1,1,0]=4 1098 B14R2.9184 Cc1cc(N)cc2c1OC(=O)N2C Amb18046754 [1,1,0,0,0,0|2,0,0]=4 1099 B14R2.9184 Cc1cc(O)cc2c1NC(=O)C2=O Amb25936375 [1,1,0,0,0,0|1,0,1]=4 1100 B14R2.9184 O=C1Nc2c(Br)cc(F)cc2C1O Amb27414502 [1,1,0,0,0,0|2,0,0]=4 1101 B14R2.9184 O=C1Nc2c(Cl)cc(Br)cc2C1O Amb27799966 [1,1,0,0,0,0|2,0,0]=4 1102 B14R2.9184 O=C1Nc2c(F)cc(Br)cc2C1O Amb27169543 [1,1,0,0,0,0|2,0,0]=4 1103 B14R2.9184 O=C1Nc2c(F)cc(Cl)cc2C1O Amb27169542 [1,1,0,0,0,0|2,0,0]=4 1104 B14R2.28485 CC1C(=O)N(C)c2cccc(O)c21 Amb27954104 [1,1,0,0,0,0|2,0,0]=4 1105 B14R2.28485 CN1C(=O)N(C)c2c(N)cccc21 Amb27179332 [1,1,0,0,0,0|2,0,0]=4 1106 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2=O Amb1085871 [1,1,0,0,0,0|1,0,1]=4 1107 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2N Amb16187113 [1,1,0,0,0,0|2,0,0]=4 1108 B14R2.28485 Cc1cccc2c1N(C)C(=O)C2N Amb21959837 [1,1,0,0,0,0|2,0,0]=4 1109 B14R2.7166 CCOc1cccc2c1C(=O)C2=O Amb21948304 [0,1,0,0,1,0|1,0,1]=4 1110 B14R2.11688 COc1cccc2c1C(=O)C2(C)C Amb27261983 [0,1,0,0,1,0|2,0,0]=4 1111 B16R2.36854 COc1cccc2c1C(=O)OC(=O)N2C Amb21943639 [0,1,0,0,0,1|2,0,0]=4 1112 B16R2.36854 COc1cccc2c1C(O)=CC(=O)N2C Amb32405046 [0,1,0,0,0,1|2,0,0]=4 1113 B16R2.36854 COc1ccnc2c1C(=O)NC(=O)N2C Amb21936587 [0,1,0,0,0,1|2,0,0]=4 1114 B16R2.39188 COc1ccc(Cl)c2c1CCC(=O)N2C Amb31124585 [0,1,0,0,0,1|2,0,0]=4 1115 B16R2.20017 CCOc1cccc2c1NC(=O)C=C2O Amb32455779 [0,1,0,0,0,1|1,0,0]=3 1116 B16R2.36833 COc1cccc2c1NC(=O)C=C2C#N Amb31096482 [0,1,0,0,0,1|2,0,0]=4 1117 B16R2.36833 COc1cccc2c1NC(=O)C=C2C=O Amb31142568 [0,1,0,0,0,1|1,0,1]=4 1118 B16R2.36833 COc1cccc2c1NC(=O)C=C2CBr Amb18528432 [0,1,0,0,0,1|2,0,0]=4 1119 B16R2.36833 COc1cccc2c1NC(=O)CC2CN Amb31132870 [0,1,0,0,0,1|2,0,0]=4 1120 B16R2.36855 COc1cccc2c1N(C)C(=O)OC2=O Amb22754370 [0,1,0,0,0,1|1,0,1]=4 1121 B16R2.40108 COc1cc(Br)cc2c1NC(=O)NC2=O Amb33624246 [0,1,0,0,0,1|1,0,1]=4 1122 B16R2.40108 COc1cc(N)cc2c1NC(=O)C=C2C Amb22740168 [0,1,0,0,0,1|2,0,0]=4 1123 B16R2.40108 COc1cc(N)cc2c1NC(=O)C=C2C Amb31116642 [0,1,0,0,0,1|2,0,0]=4 1124 B16R2.40108 COc1cc(N)cc2c1NC(=O)CC2C Amb31117251 [0,1,0,0,0,1|2,0,0]=4 1125 B16R2.189542 COc1cccc2c1NC(=O)NS2(=O)=O Amb17248116 [0,1,0,0,0,1|1,0,1]=4 1126 B16R2.189529 CCc1cccc2c1NC(=O)C(CO)=C2 Amb18528804 [0,1,0,0,0,1|2,0,0]=4 1127 B16R2.189529 COc1cccc2c1NC(=O)C(C#N)=C2 Amb18003108 [0,1,0,0,0,1|2,0,0]=4 1128 B16R2.189529 COc1cccc2c1NC(=O)C(C#N)C2 Amb5744837 [0,1,0,0,0,1|2,0,0]=4 1129 B16R2.189529 COc1cccc2c1NC(=O)C(C=O)=C2 Amb18014596 [0,1,0,0,0,1|1,0,1]=4 1130 B16R2.189529 COc1cccc2c1NC(=O)C(CCl)=C2 Amb18528561 [0,1,0,0,0,1|2,0,0]=4 1131 B16R2.189529 COc1cccc2c1NC(=O)C(CN)=C2 Amb18015336 [0,1,0,0,0,1|2,0,0]=4 1132 B16R2.189529 COc1cccc2c1NC(=O)C(CN)C2 Amb5744702 [0,1,0,0,0,1|2,0,0]=4 1133 B16R2.189577 COc1cccc2c1N(C)C(=O)C(N)C2 Amb31132875 [0,1,0,0,0,1|2,0,0]=4 1134 B16R2.196441 COc1ccc(C)c2c1NC(=O)C(N)C2 Amb31132879 [0,1,0,0,0,1|2,0,0]=4 1135 B16R2.198795 COc1cc(C)cc2c1NC(=O)C(N)C2 Amb31132876 [0,1,0,0,0,1|2,0,0]=4 1136 B16R2.198795 COc1cc(N)cc2c1NC(=O)C(C)=C2 Amb31116640 [0,1,0,0,0,1|2,0,0]=4 1137 B16R2.198795 COc1cc(N)cc2c1NC(=O)C(C)C2 Amb31117249 [0,1,0,0,0,1|2,0,0]=4 1138 B16R2.19890 CCOc1cccc2c1NC(=O)\C2=C/O Amb17039824 [0,2,0,0,0,0|1,0,0]=3 1139 B16R2.25657 O=C1Nc2c(OC(F)F)cccc2C1=O Amb1129574 [0,2,0,0,0,0|1,0,1]=4 1140 B16R2.116070 CN1C(=O)N(C)c2c(CCN)cccc21 Amb18782709 [0,2,0,0,0,0|2,0,0]=4 1141 B16R2.172725 COC(=O)c1cccc2c1NC(=O)C2=O Amb774556 [0,2,0,0,0,0|1,0,1]=4 1142 B16R2.19609 CCc1cccc2c1NC(=O)C2CCO Amb31142867 [0,2,0,0,0,0|2,0,0]=4 1143 B16R2.19609 CNCC1C(=O)Nc2c(OC)cccc21 Amb31142981 [0,2,0,0,0,0|2,0,0]=4 1144 B16R2.19609 COc1cccc2c1NC(=O)C2CCN Amb18560648 [0,2,0,0,0,0|2,0,0]=4 1145 B16R2.19609 COc1cccc2c1NC(=O)C2CCO Amb31143103 [0,2,0,0,0,0|1,0,0]=3 1146 B16R2.76047 COc1ccc(C)c2c1NC(=O)C2C=O Amb31112823 [0,2,0,0,0,0|1,0,1]=4 1147 B16R2.190040 CNC1C(=O)N(C)c2c(OC)cccc21 Amb18895551 [0,2,0,0,0,0|2,0,0]=4 1148 B16R2.190040 COc1cccc2c(CO)c(Cl)n(C)c12 Amb18058482 [0,2,0,0,0,0|2,0,0]=4 1149 B16R2.190040 COc1cccc2c1N(C)C(=O)C2CN Amb31132881 [0,2,0,0,0,0|2,0,0]=4 1150 B16R2.198148 CNC1C(=O)Nc2c(OC)cc(C)cc21 Amb18895550 [0,2,0,0,0,0|2,0,0]=4 1151 B16R2.198148 COc1cc(C)cc2c1NC(=O)C2C=O Amb31112820 [0,2,0,0,0,0|1,0,1]=4 1152 B16R2.198148 COc1cc(C)cc2c1NC(=O)C2CN Amb31132882 [0,2,0,0,0,0|2,0,0]=4 1153 B16R2.36584 COc1cccc2c1cc(C(=O)O)n2C Amb7088946 [0,2,0,0,0,0|2,0,0]=4 1154 B16R2.190042 COc1cccc2c(C)c(C=O)n(C)c12 Amb18894989 [0,2,0,0,0,0|2,0,0]=4 1155 B16R2.189812 COc1cccc2c1N(C)C(=O)C2(C)C Amb18895371 [0,2,0,0,0,0|2,0,0]=4 1156 B16R2.196517 COc1ccc(C)c2c1NC(=O)C2(C)C Amb18895368 [0,2,0,0,0,0|2,0,0]=4 1157 B16R2.198863 COc1cc(C)cc2c1NC(=O)C2(C)C Amb18895366 [0,2,0,0,0,0|2,0,0]=4 1158 B16R2.76048 COc1ccc(OC)c2c1CC(=O)N2C Amb31133004 [0,2,0,0,0,0|2,0,0]=4 1159 B16R2.76048 COc1ccc(OC)c2c1NC(=O)C2=O Amb1134141 [0,2,0,0,0,0|1,0,1]=4 1160 B16R2.76048 COc1ccc(OC)c2c1NC(=O)C2C Amb18895730 [0,2,0,0,0,0|2,0,0]=4 1161 B16R2.196491 COc1ccc(C)c2c1N(C)C(=O)C2=O Amb18895321 [0,2,0,0,0,0|1,0,1]=4 1162 B16R2.196491 COc1ccc(C)c2c1N(C)C(=O)C2N Amb18895549 [0,2,0,0,0,0|2,0,0]=4 1163 B16R2.196491 COc1ccc(Cl)c2c1C(=O)C(=O)N2C Amb18245477 [0,2,0,0,0,0|2,0,0]=4 1164 B16R2.196491 COc1ccc(Cl)c2c1C(N)C(=O)N2C Amb18896792 [0,2,0,0,0,0|2,0,0]=4 1165 B16R2.41830 COc1cc(OC)c2c(c1)C(C)C(=O)N2 Amb18895731 [0,2,0,0,0,0|2,0,0]=4 1166 B16R2.41830 COc1cc(OC)c2c(c1)N(C)C(=O)C2 Amb31133006 [0,2,0,0,0,0|2,0,0]=4 1167 B16R2.198839 COc1cc(C)cc2c1N(C)C(=O)C2=O Amb18895319 [0,2,0,0,0,0|1,0,1]=4 1168 B16R2.198839 COc1cc(C)cc2c1N(C)C(=O)C2N Amb18895547 [0,2,0,0,0,0|2,0,0]=4 1169 B16R2.190041 CCN1C(=O)C(=O)c2cccc(OC)c21 Amb28139627 [0,2,0,0,0,0|1,0,1]=4 1170 B14R2.95 O=C(CCl)N1COc2ccccc21 Amb24496938 [0,0,1,1,0,0|2,0,0]=4 1171 B14R2.95 O=C(CO)N1CCc2ccccc21 Amb9421614 [0,0,1,1,0,0|2,0,0]=4 1172 B14R2.95 O=C(NO)C1CNc2ccccc21 Amb27226261 [0,0,1,1,0,0|2,0,0]=4 1173 B14R2.95 O=C(NO)C1COc2ccccc21 Amb25128026 [0,0,1,1,0,0|1,0,0]=3 1174 B14R2.741 CC1COc2ccccc2NC1=O Amb17570221 [0,0,1,1,0,0|2,0,0]=4 1175 B14R2.741 NC1COc2ccccc2NC1=O Amb21962443 [0,0,1,1,0,0|2,0,0]=4 1176 B14R2.741 NC1COc2ccccc2NC1=O Amb33483719 [0,0,1,1,0,0|2,0,0]=4 1177 B14R2.741 N[C@@H]1COc2ccccc2NC1=O Amb24708380 [0,0,1,1,0,0|2,0,0]=4 1178 B14R2.741 N[C@@H]1COc2ccccc2NC1=O Amb33483910 [0,0,1,1,0,0|2,0,0]=4 1179 B14R2.741 N[C@H]1COc2ccccc2NC1=O Amb26548336 [0,0,1,1,0,0|2,0,0]=4 1180 B14R2.741 N[C@H]1COc2ccccc2NC1=O Amb33484191 [0,0,1,1,0,0|2,0,0]=4 1181 B14R2.741 O=C1Nc2ccccc2CCC1O Amb25226835 [0,0,1,1,0,0|2,0,0]=4 1182 B14R2.741 O=C1Nc2ccccc2CC[C@H]1O Amb28340942 [0,0,1,1,0,0|2,0,0]=4 1183 B14R2.8188 CC1=C(O)C(=O)Nc2ccccc21 Amb22752590 [0,0,1,1,0,0|2,0,0]=4 1184 B14R2.11684 COc1cccc2c1CC(=O)CO2 Amb15692698 [0,0,1,1,0,0|2,0,0]=4 1185 B14R2.11684 COc1cccc2c1NC(=O)C=C2 Amb18540603 [0,0,1,1,0,0|2,0,0]=4 1186 B14R2.11684 COc1cccc2c1NC(=O)CC2 Amb17545226 [0,0,1,1,0,0|2,0,0]=4 1187 B14R2.11684 COc1cccc2c1NC(=O)CN2 Amb24596339 [0,0,1,1,0,0|2,0,0]=4 1188 B14R2.11684 COc1cccc2c1NC(=O)CO2 Amb26549184 [0,0,1,1,0,0|1,0,0]=3 1189 B14R2.11684 COc1cccc2c1NC(=O)CS2 Amb24433421 [0,0,1,1,0,0|1,1,0]=4 1190 B14R2.11684 COc1cccc2c1NC(=O)N=C2 Amb25211722 [0,0,1,1,0,0|1,0,1]=4 1191 B14R2.11684 COc1cccc2c1NC(=O)OC2 Amb26400306 [0,0,1,1,0,0|2,0,0]=4 1192 B14R2.128 COc1cccc(C2OCC2=O)c1 Amb32685416 [0,0,1,1,0,0|2,0,0]=4 1193 B14R2.3274 CCc1ccc2c(c1)C(O)C(=O)N2 Amb18178352 [0,0,1,1,0,0|2,0,0]=4 1194 B14R2.3274 COc1ccc2c(c1)C(=O)C(=O)N2 Amb1151290 [0,0,1,1,0,0|1,0,1]=4 1195 B14R2.3274 COc1ccc2c(c1)C(C)C(=O)N2 Amb17233261 [0,0,1,1,0,0|2,0,0]=4 1196 B14R2.3274 COc1ccc2c(c1)C(F)C(=O)N2 Amb32456097 [0,0,1,1,0,0|2,0,0]=4 1197 B14R2.3274 COc1ccc2c(c1)C(N)C(=O)N2 Amb10607562 [0,0,1,1,0,0|2,0,0]=4 1198 B14R2.3274 COc1ccc2c(c1)C(N)C(=O)N2 Amb13949077 [0,0,1,1,0,0|2,0,0]=4 1199 B14R2.3274 COc1ccc2c(c1)C(S)C(=O)N2 Amb32788558 [0,0,1,1,0,0|1,1,0]=4 1200 B14R2.3274 COc1ccc2c(c1)N(C)C(=O)C2 Amb17138810 [0,0,1,1,0,0|2,0,0]=4 1201 B14R2.3274 COc1ccc2c(c1)N(C)C(=O)N2 Amb25301771 [0,0,1,1,0,0|1,0,0]=3 1202 B14R2.3274 COc1ccc2c(c1)N(C)C(=O)O2 Amb18043111 [0,0,1,1,0,0|2,0,0]=4 1203 B14R2.3274 COc1ccc2c(n1)N(C)C(=O)N2 Amb27831476 [0,0,1,1,0,0|2,0,0]=4 1204 B14R2.3274 COc1ccc2nc(C)n(O)c2c1 Amb25694072 [0,0,1,1,0,0|1,0,1]=4 1205 B14R2.3274 COc1ccc2nc(N)n(C)c2c1 Amb25709833 [0,0,1,1,0,0|2,0,0]=4 1206 B14R3.8004 O=C1Cc2cccc3c2N1CC3 Amb17334458 [1,0,0,1,0,0|2,0,0]=4 1207 B14R3.8004 O=C1Nc2cccc3c2C1CC3 Amb18559244 [1,0,0,1,0,0|2,0,0]=4 1208 B16R3.13071 O=C1Nc2c(ccc3c2CCO3)C1O Amb35606300 [0,1,0,1,0,0|2,0,0]=4 1209 B16R3.13071 O=C1Nc2c(ccc3c2COC3)C1=O Amb27975841 [0,1,0,1,0,0|1,0,1]=4 1210 B16R3.13071 O=C1Nc2c(ccc3c2OCO3)C1=O Amb28068574 [0,1,0,1,0,0|1,0,1]=4 1211 B16R3.51217 CN1C(=O)N2CCCc3cccc1c32 Amb18034021 [0,1,0,1,0,0|2,0,0]=4 1212 B16R3.257231 COc1cccc2c1NC(=O)C23CC3 Amb25070521 [0,1,0,1,0,0|2,0,0]=4 1213 B12R1.77 C#CC(=O)c1ccccc1OC Amb27465312 [0,0,1,0,1,0|2,0,0]=4 1214 B12R1.77 C=CC(=O)c1ccccc1OC Amb18563546 [0,0,1,0,1,0|2,0,0]=4 1215 B12R1.77 CCC(=O)c1ccccc1OC Amb6272927 [0,0,1,0,1,0|2,0,0]=4 1216 B12R1.77 CCc1ccccc1C(=O)CO Amb28381108 [0,0,1,0,1,0|2,0,0]=4 1217 B12R1.77 CCc1cnccc1C(=O)NO Amb28283403 [0,0,1,0,1,0|2,0,0]=4 1218 B12R1.77 CNC(=N)c1ccccc1OC Amb27587629 [0,0,1,0,1,0|2,0,0]=4 1219 B12R1.77 CNC(=O)c1ccccc1NC Amb18953571 [0,0,1,0,1,0|2,0,0]=4 1220 B12R1.77 CNC(=O)c1cccnc1OC Amb10710104 [0,0,1,0,1,0|2,0,0]=4 1221 B12R1.77 CNc1ccccc1C(=O)NN Amb31156153 [0,0,1,0,1,0|2,0,0]=4 1222 B12R1.77 CNc1ccccc1C(=O)NN Amb841739 [0,0,1,0,1,0|2,0,0]=4 1223 B12R1.77 COC(=O)c1ccccc1OC Amb4380371 [0,0,1,0,1,0|2,0,0]=4 1224 B12R1.77 COc1ccccc1C(=O)C#N Amb17232348 [0,0,1,0,1,0|2,0,0]=4 1225 B12R1.77 COc1ccccc1C(=O)C=O Amb9826945 [0,0,1,0,1,0|1,0,1]=4 1226 B12R1.77 COc1ccccc1C(=O)CBr Amb1229838 [0,0,1,0,1,0|2,0,0]=4 1227 B12R1.77 COc1ccccc1C(=O)CCl Amb1105181 [0,0,1,0,1,0|2,0,0]=4 1228 B12R1.77 COc1ccccc1C(=O)CF Amb24084123 [0,0,1,0,1,0|2,0,0]=4 1229 B12R1.77 COc1ccccc1C(=O)CN Amb18971070 [0,0,1,0,1,0|2,0,0]=4 1230 B12R1.77 COc1ccccc1C(=O)CN Amb19373362 [0,0,1,0,1,0|2,0,0]=4 1231 B12R1.77 COc1ccccc1C(=O)CN Amb20668080 [0,0,1,0,1,0|2,0,0]=4 1232 B12R1.77 COc1ccccc1C(=O)CO Amb18800999 [0,0,1,0,1,0|1,0,0]=3 1233 B12R1.77 COc1ccccc1C(=O)CS Amb17400927 [0,0,1,0,1,0|1,1,0]=4 1234 B12R1.77 COc1ccccc1C(=O)NN Amb6409376 [0,0,1,0,1,0|1,0,0]=3 1235 B12R1.77 COc1ccccc1C(=O)NO Amb6266857 [0,0,1,0,1,0|0,0,0]=2 1236 B12R1.77 COc1ccccc1C(=S)NN Amb27862923 [0,0,1,0,1,0|1,1,0]=4 1237 B12R1.77 COc1ccccc1[C@@H](C)NO Amb27411380 [0,0,1,0,1,0|1,0,1]=4 1238 B12R1.77 COc1ccccc1\C(C)=N/O Amb4020878 [0,0,1,0,1,0|1,0,1]=4 1239 B12R1.77 COc1ccccc1\C(Cl)=N/O Amb27807954 [0,0,1,0,1,0|1,0,1]=4 1240 B12R1.77 COc1ccccc1\C(N)=N/O Amb2696248 [0,0,1,0,1,0|1,0,1]=4 1241 B12R1.77 COc1ccccc1\C(N)=N\O Amb1212420 [0,0,1,0,1,0|1,0,1]=4 1242 B12R1.77 COc1cnccc1C(=O)NO Amb27258754 [0,0,1,0,1,0|1,0,0]=3 1243 B12R1.77 COc1ncccc1C(=N)NO Amb15694829 [0,0,1,0,1,0|2,0,0]=4 1244 B12R1.77 COc1ncccc1C(=O)NN Amb8999063 [0,0,1,0,1,0|2,0,0]=4 1245 B12R1.77 CSc1ccccc1C(=O)NN Amb6384135 [0,0,1,0,1,0|1,1,0]=4 1246 B12R2.1806 COc1cccc2c1C(=O)C2 Amb17850795 [1,0,0,0,1,0|1,0,0]=3 1247 B12R2.591 Cc1csc2c1NC(=O)C2O Amb28322144 [1,0,0,0,1,0|2,0,0]=4 1248 B12R2.1094 Cc1cccc2c1C(=O)C2=O Amb21948301 [1,0,0,0,1,0|1,0,1]=4 1249 B14R1.863 C#CC(=O)NCc1ccccc1OC Amb35713472 [0,0,1,0,0,1|2,0,0]=4 1250 B14R1.863 CCc1ccccc1NCC(=O)NC Amb6713248 [0,0,1,0,0,1|2,0,0]=4 1251 B14R1.863 CNC(=N)NCc1ccccc1OC Amb19061796 [0,0,1,0,0,1|2,0,0]=4 1252 B14R1.863 CNC(=O)NCc1ccccc1OC Amb2132756 [0,0,1,0,0,1|1,0,0]=3 1253 B14R1.863 CNC(=O)NCc1cnccc1OC Amb30028153 [0,0,1,0,0,1|2,0,0]=4 1254 B14R1.863 CNC(=S)NNc1ccccc1OC Amb26068659 [0,0,1,0,0,1|1,1,0]=4 1255 B14R1.863 COC(=O)CNc1ccccc1OC Amb1043473 [0,0,1,0,0,1|2,0,0]=4 1256 B14R1.863 COc1ccccc1CCC(=O)NN Amb8998080 [0,0,1,0,0,1|2,0,0]=4 1257 B14R1.863 COc1ccccc1CNC(=O)CBr Amb17324159 [0,0,1,0,0,1|2,0,0]=4 1258 B14R1.863 COc1ccccc1CNC(=O)CCl Amb6573281 [0,0,1,0,0,1|2,0,0]=4 1259 B14R1.863 COc1ccccc1CNC(=O)CN Amb5783050 [0,0,1,0,0,1|2,0,0]=4 1260 B14R1.863 COc1ccccc1CNC(=O)CO Amb9421494 [0,0,1,0,0,1|1,0,0]=3 1261 B14R1.863 COc1ccccc1CNC(=O)NN Amb8853890 [0,0,1,0,0,1|1,0,0]=3 1262 B14R1.863 COc1ccccc1CN\C(N)=N\O Amb19080679 [0,0,1,0,0,1|1,0,1]=4 1263 B14R1.863 COc1ccccc1NCC(=O)NN Amb6345919 [0,0,1,0,0,1|1,0,0]=3 1264 B14R1.863 COc1ccccc1OCC(=O)NN Amb6337237 [0,0,1,0,0,1|2,0,0]=4 1265 B14R1.863 COc1ccccc1OCC(=O)NO Amb17236541 [0,0,1,0,0,1|1,0,0]=3 1266 B14R1.863 COc1ccccc1SCC(=O)NN Amb22059271 [0,0,1,0,0,1|2,0,0]=4 1267 B14R1.863 COc1ccncc1CNC(=O)NN Amb35614444 [0,0,1,0,0,1|2,0,0]=4 1268 B14R1.74 COc1cccc(C(C)CC(N)=O)c1 Amb17235628 [0,0,1,0,0,1|2,0,0]=4 1269 B14R1.74 COc1cccc(C(O)CC(=O)O)c1 Amb17236353 [0,0,1,0,0,1|2,0,0]=4 1270 B14R1.74 COc1cccc(N(C)CC(=O)O)c1 Amb17336943 [0,0,1,0,0,1|2,0,0]=4 1271 B14R1.74 COc1cccc([C@@H](O)CC(=O)O)c1 Amb33358964 [0,0,1,0,0,1|2,0,0]=4 1272 B14R1.74 COc1cccc([C@H](O)CC(=O)O)c1 Amb33380495 [0,0,1,0,0,1|2,0,0]=4 1273 B14R1.75 COc1cccc(CC(Cl)C(N)=O)c1 Amb17204454 [0,0,1,0,0,1|2,0,0]=4 1274 B14R1.75 COc1cccc(CC(O)C(=O)O)c1 Amb17139588 [0,0,1,0,0,1|2,0,0]=4 1275 B14R1.75 COc1cccc(CN(C)C(=N)N)c1 Amb22586974 [0,0,1,0,0,1|2,0,0]=4 1276 B14R1.75 COc1cccc(NC(=O)C(N)=O)c1 Amb6417009 [0,0,1,0,0,1|1,0,1]=4 1277 B14R1.75 COc1cccc(NC(=S)C(N)=O)c1 Amb27957893 [0,0,1,0,0,1|1,1,0]=4 1278 B14R1.75 COc1cccc(SC(C)C(N)=O)c1 Amb11289923 [0,0,1,0,0,1|2,0,0]=4 1279 B14R2.1073 COc1cccc2c1NCC(O)C2 Amb26916989 [1,0,0,0,0,1|1,0,1]=4 1280 B14R2.1073 COc1cccc2cc(O)ccc12 Amb28127656 [1,0,0,0,0,1|2,0,0]=4 1281 B14R2.1073 COc1cccc2cc(O)cnc12 Amb24470386 [1,0,0,0,0,1|1,0,1]=4 1282 B14R2.8038 CN1C(=O)C=Cc2c(O)cccc21 Amb26476600 [1,0,0,0,0,1|2,0,0]=4 1283 B14R2.8038 CN1C(=O)NCc2c(Br)cccc21 Amb25939653 [1,0,0,0,0,1|2,0,0]=4 1284 B14R2.8038 CN1C(=O)NCc2c(N)cccc21 Amb24413927 [1,0,0,0,0,1|2,0,0]=4 1285 B14R2.8038 Cc1cccc2c1NCC(=O)C2=O Amb28041510 [1,0,0,0,0,1|1,0,1]=4 1286 B14R2.8038 Cc1cccc2c1NCC(=O)N2C Amb25158334 [1,0,0,0,0,1|1,0,0]=3 1287 B14R2.8038 Cc1cccc2c1OCC(=O)N2C Amb17570219 [1,0,0,0,0,1|2,0,0]=4 1288 B14R2.8038 O=C1COc2c(Cl)cccc2N1O Amb5265211 [1,0,0,0,0,1|2,0,0]=4 1289 B14R2.8045 CC1=CC(=O)Nc2c(C)cccc21 Amb19789098 [1,0,0,0,0,1|2,0,0]=4 1290 B14R2.8045 CC1=CC(=O)Nc2c(O)cccc21 Amb18127367 [1,0,0,0,0,1|2,0,0]=4 1291 B14R2.8045 CC1=NC(=O)Nc2c(C)cccc21 Amb27793546 [1,0,0,0,0,1|2,0,0]=4 1292 B14R2.8045 CC1=NC(=O)Nc2c(O)cccc21 Amb18127611 [1,0,0,0,0,1|2,0,0]=4 1293 B14R2.8045 CN1CC(=O)Nc2c(Br)cccc21 Amb23403135 [1,0,0,0,0,1|2,0,0]=4 1294 B14R2.8045 CN1CC(=O)Nc2c(Cl)cccc21 Amb23403134 [1,0,0,0,0,1|2,0,0]=4 1295 B14R2.8045 CN1CC(=O)Nc2c(F)cccc21 Amb23437301 [1,0,0,0,0,1|2,0,0]=4 1296 B14R2.8045 CN1CC(=O)Nc2c(I)cccc21 Amb23403136 [1,0,0,0,0,1|2,0,0]=4 1297 B14R2.8045 CN1CC(=O)Nc2c(N)cccc21 Amb23403131 [1,0,0,0,0,1|2,0,0]=4 1298 B14R2.8045 Cc1cccc2c1NC(=O)C=C2O Amb19517153 [1,0,0,0,0,1|1,0,0]=3 1299 B14R2.8045 Cc1cccc2c1NC(=O)C=C2S Amb28128471 [1,0,0,0,0,1|1,1,0]=4 1300 B14R2.8045 Cc1cccc2c1NC(=O)CC2=O Amb27985627 [1,0,0,0,0,1|1,0,1]=4 1301 B14R2.8045 Cc1cccc2c1NC(=O)CC2C Amb27751297 [1,0,0,0,0,1|2,0,0]=4 1302 B14R2.8045 Cc1cccc2c1NC(=O)CN2C Amb23403129 [1,0,0,0,0,1|1,0,0]=3 1303 B14R2.8045 Cc1cccc2c1NC(=O)N=C2N Amb26014451 [1,0,0,0,0,1|2,0,0]=4 1304 B14R2.8045 Cc1cccc2c1NC(=O)NC2=O Amb20243383 [1,0,0,0,0,1|1,0,1]=4 1305 B14R2.8045 Cc1cccc2c1NC(=O)OC2=O Amb18061619 [1,0,0,0,0,1|1,0,1]=4 1306 B14R2.8045 Cc1cccc2c1OC(=O)C=C2O Amb19667408 [1,0,0,0,0,1|2,0,0]=4 1307 B14R2.8045 Cc1ccnc2c1NC(=O)CN2C Amb27763176 [1,0,0,0,0,1|2,0,0]=4 1308 B14R2.8045 NN1CC(=O)Nc2c(F)cccc21 Amb27631671 [1,0,0,0,0,1|2,0,0]=4 1309 B14R2.8045 O=C1C=C(O)c2cccc(Br)c2N1 Amb23571494 [1,0,0,0,0,1|2,0,0]=4 1310 B14R2.8045 O=C1C=C(O)c2cccc(F)c2N1 Amb24662699 [1,0,0,0,0,1|2,0,0]=4 1311 B14R2.8045 O=C1C=C(O)c2cccc(I)c2N1 Amb28368282 [1,0,0,0,0,1|2,0,0]=4 1312 B14R2.8045 O=C1C=C(O)c2cccc(O)c2N1 Amb18127814 [1,0,0,0,0,1|1,0,0]=3 1313 B14R2.8045 O=C1C=C(O)c2cccc(O)c2O1 Amb18128038 [1,0,0,0,0,1|2,0,0]=4 1314 B14R2.8045 O=C1NC(=O)c2cccc(O)c2N1 Amb28323179 [1,0,0,0,0,1|1,0,1]=4 1315 B14R2.8045 O=C1Nc2c(O)cccc2C(=O)O1 Amb28364288 [1,0,0,0,0,1|1,0,1]=4 1316 B14R2.8045 OC1=NC(=S)Nc2c(O)cccc21 Amb28204052 [1,0,0,0,0,1|1,1,0]=4 1317 B14R2.28472 CC1=Cc2cccc(C)c2NC1=O Amb24425415 [1,0,0,0,0,1|2,0,0]=4 1318 B14R2.28472 CC1=Cc2cccc(O)c2NC1=O Amb22752602 [1,0,0,0,0,1|2,0,0]=4 1319 B14R2.28472 CN1Cc2cccc(N)c2NC1=O Amb25805247 [1,0,0,0,0,1|2,0,0]=4 1320 B14R2.28472 Cc1cccc2c1NC(=O)C(C)C2 Amb17335058 [1,0,0,0,0,1|2,0,0]=4 1321 B14R2.28472 Cc1cccc2c1NC(=O)C(C)N2 Amb27455129 [1,0,0,0,0,1|2,0,0]=4 1322 B14R2.28472 Cc1cccc2c1NC(=O)C(C)O2 Amb26374847 [1,0,0,0,0,1|2,0,0]=4 1323 B14R2.28472 Cc1cccc2c1NC(=O)C(F)=C2 Amb22547233 [1,0,0,0,0,1|2,0,0]=4 1324 B14R2.28472 Cc1cccc2c1NC(=O)C(N)C2 Amb27632324 [1,0,0,0,0,1|2,0,0]=4 1325 B14R2.28472 Cc1cccc2c1NC(=O)C(O)=C2 Amb22752607 [1,0,0,0,0,1|1,0,0]=3 1326 B14R2.28472 Cc1cccc2c1NC(=O)C(O)C2 Amb28243418 [1,0,0,0,0,1|1,0,0]=3 1327 B14R2.28472 NC1Cc2cccc(O)c2NC1=O Amb27231835 [1,0,0,0,0,1|2,0,0]=4 1328 B14R2.28472 O=C1Nc2c(Br)cccc2C=C1O Amb25800197 [1,0,0,0,0,1|2,0,0]=4 1329 B14R2.28472 O=C1Nc2c(F)cccc2C=C1O Amb24697603 [1,0,0,0,0,1|2,0,0]=4 1330 B14R2.28472 O=C1Nc2cccc(O)c2NC1=O Amb22234954 [1,0,0,0,0,1|1,0,1]=4 1331 B14R2.28472 O=C1Oc2c(O)cccc2C=C1O Amb26476553 [1,0,0,0,0,1|2,0,0]=4 1332 B14R2.1815 COc1ccc2c(c1)CC(=O)N2C Amb459482 [0,0,0,0,1,1|2,0,0]=4 1333 B14R2.1815 COc1ccc2c(c1)NC(=O)C2=O Amb1290097 [0,0,0,0,1,1|1,0,1]=4 1334 B14R2.1815 COc1ccc2c(c1)NC(=O)C2C Amb18243689 [0,0,0,0,1,1|2,0,0]=4 1335 B14R2.1815 COc1ccc2c(c1)NC(=O)C2N Amb10607563 [0,0,0,0,1,1|2,0,0]=4 1336 B14R2.1815 COc1ccc2c(c1)NC(=O)C2N Amb13949078 [0,0,0,0,1,1|2,0,0]=4 1337 B14R2.1815 COc1ccc2c(c1)NC(=O)C2O Amb18178630 [0,0,0,0,1,1|1,0,0]=3 1338 B14R2.1815 COc1ccc2c(c1)NC(=O)C2S Amb32788759 [0,0,0,0,1,1|1,1,0]=4 1339 B14R2.1815 COc1ccc2c(c1)NC(=O)N2C Amb22756166 [0,0,0,0,1,1|1,0,0]=3 1340 B14R2.1815 COc1ccc2c(c1)NC(=O)N2N Amb27945973 [0,0,0,0,1,1|1,0,0]=3 1341 B14R2.1815 CSc1ccc2c(c1)NC(=O)C2O Amb28317800 [0,0,0,0,1,1|1,1,0]=4