0 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,0,0,0,0,0|1,0,3]=4 1 B12R1.27 C#CC(=O)CSc1ccccc1 Amb27961049 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.27 C#CC(=O)NNc1ccccc1 Amb28317629 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,0,0,0,0,0|2,0,2]=4 5 B12R1.27 C#CC(C)\C=C\c1ccccc1 Amb33080777 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.27 C#CC(O)\C=C\c1ccccc1 Amb3354803 [0,0,0,0,0,0|1,0,3]=4 7 B12R1.27 C#C[C@H](O)\C=C\c1ccccc1 Amb28127146 [0,0,0,0,0,0|1,0,3]=4 8 B12R1.27 C=C(CNc1ccccc1)SC Amb27394285 [0,0,0,0,0,0|2,1,1]=4 9 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,0,0,0,0,0|1,0,3]=4 13 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [0,0,0,0,0,0|1,0,1]=2 17 B12R1.27 C=CC(O)\C=C\c1ccccc1 Amb27478521 [0,0,0,0,0,0|1,0,3]=4 18 B12R1.27 CC(C#N)\C=C\c1ccccc1 Amb33081313 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb33081219 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.27 CC(\C=C\c1ccccc1)=N/O Amb24101081 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.27 CC(\C=C\c1ccccc1)=N\O Amb27204245 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.27 CC(\C=C\c1ccccc1)CBr Amb33080770 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.27 CC(\C=C\c1ccccc1)CN Amb33081132 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.27 CC(\C=C\c1ccccc1)ON Amb33080788 [0,0,0,0,0,0|2,0,1]=3 25 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,0,0,0,0,0|3,0,1]=4 26 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,0,0,0,0,0|1,0,2]=3 27 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [0,0,0,0,0,0|1,0,2]=3 28 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [0,0,0,0,0,0|2,0,1]=3 29 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [0,0,0,0,0,0|2,0,1]=3 30 B12R1.27 CCC(=O)NCc1ccccc1 Amb3097295 [0,0,0,0,0,0|2,0,1]=3 31 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.27 CCC(=O)NNc1ccccc1 Amb2720825 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.27 CCC(=O)NNc1ccccn1 Amb27652531 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.27 CCC(=O)NOc1ccccc1 Amb27827163 [0,0,0,0,0,0|3,0,0]=3 35 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [0,0,0,0,0,0|2,0,1]=3 36 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,0,0,0,0,0|1,0,0]=1 37 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [0,0,0,0,0,0|2,0,0]=2 38 B12R1.27 CCC(=S)OCc1ccccc1 Amb28078330 [0,0,0,0,0,0|2,1,1]=4 39 B12R1.27 CCC(N)\C=C\c1cccnc1 Amb24526364 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,0,0,0,0,0|1,0,2]=3 41 B12R1.27 CCS(=O)\N=C\c1ccccc1 Amb35726562 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.27 CCS(=O)\N=C\c1ccccn1 Amb35726556 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.27 CCS(=O)\N=C\c1cccnc1 Amb35726558 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.27 CCS(=O)\N=C\c1ccncc1 Amb35726600 [0,0,0,0,0,0|4,0,0]=4 45 B12R1.27 CC[C@H](O)\C=C\c1ccccc1 Amb27205385 [0,0,0,0,0,0|1,0,2]=3 46 B12R1.27 CNC(=N)SCc1ccccc1 Amb26537028 [0,0,0,0,0,0|3,0,1]=4 47 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [0,0,0,0,0,0|1,0,2]=3 48 B12R1.27 CNC(=O)CCc1cccnc1 Amb27256880 [0,0,0,0,0,0|2,0,2]=4 49 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [0,0,0,0,0,0|2,0,1]=3 50 B12R1.27 CNC(=O)CSc1ccccn1 Amb13953848 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [0,0,0,0,0,0|3,0,1]=4 53 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,0,0,0,0,0|3,0,0]=3 55 B12R1.27 CNC(=O)NNc1ccccn1 Amb27973634 [0,0,0,0,0,0|4,0,0]=4 56 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [0,0,0,0,0,0|3,0,0]=3 57 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [0,0,0,0,0,0|2,0,1]=3 58 B12R1.27 CNC(=O)OCc1ccccn1 Amb27616729 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.27 CNC(=O)OCc1cccnc1 Amb24532586 [0,0,0,0,0,0|3,0,1]=4 60 B12R1.27 CNC(=O)OCc1ccncc1 Amb27798878 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [0,0,0,0,0,0|2,0,1]=3 62 B12R1.27 CNC(=O)\C=C\c1ccncc1 Amb28454984 [0,0,0,0,0,0|2,0,0]=2 63 B12R1.27 CNC(=S)CCc1ccccc1 Amb4430624 [0,0,0,0,0,0|1,1,2]=4 64 B12R1.27 CNC(=S)NCc1ccccc1 Amb2684640 [0,0,0,0,0,0|2,1,1]=4 65 B12R1.27 CNC(=S)NNc1ccccc1 Amb4005752 [0,0,0,0,0,0|3,1,0]=4 66 B12R1.27 CNC(=S)SCc1ccccc1 Amb27202269 [0,0,0,0,0,0|2,1,1]=4 67 B12R1.27 CNC(=S)SSc1ccccc1 Amb27616718 [0,0,0,0,0,0|3,1,0]=4 68 B12R1.27 COC(=N)CCc1ccccn1 Amb18563625 [0,0,0,0,0,0|2,0,2]=4 69 B12R1.27 COC(=N)CCc1cccnc1 Amb18563630 [0,0,0,0,0,0|2,0,2]=4 70 B12R1.27 COC(=N)CCc1ccncc1 Amb18563635 [0,0,0,0,0,0|2,0,2]=4 71 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [0,0,0,0,0,0|2,0,1]=3 72 B12R1.27 COC(=O)C#Cc1ccccc1 Amb4019367 [0,0,0,0,0,0|0,0,2]=2 73 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [0,0,0,0,0,0|1,0,2]=3 74 B12R1.27 COC(=O)C#Cc1cccnc1 Amb28122840 [0,0,0,0,0,0|1,0,2]=3 75 B12R1.27 COC(=O)C#Cc1cccnn1 Amb33168863 [0,0,0,0,0,0|2,0,2]=4 76 B12R1.27 COC(=O)C#Cc1ccncc1 Amb27227860 [0,0,0,0,0,0|1,0,2]=3 77 B12R1.27 COC(=O)C#Cc1ccncn1 Amb25942047 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.27 COC(=O)C#Cc1ccnnc1 Amb24736910 [0,0,0,0,0,0|2,0,2]=4 79 B12R1.27 COC(=O)C#Cc1cnccn1 Amb24394719 [0,0,0,0,0,0|2,0,2]=4 80 B12R1.27 COC(=O)C#Cc1cncnc1 Amb25896680 [0,0,0,0,0,0|2,0,2]=4 81 B12R1.27 COC(=O)C#Cc1ncccn1 Amb33168860 [0,0,0,0,0,0|2,0,2]=4 82 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [0,0,0,0,0,0|0,0,2]=2 83 B12R1.27 COC(=O)CCc1cccnc1 Amb6357821 [0,0,0,0,0,0|1,0,2]=3 84 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,0,0,0,0,0|1,0,2]=3 85 B12R1.27 COC(=O)CCc1cncnc1 Amb21922892 [0,0,0,0,0,0|2,0,2]=4 86 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [0,0,0,0,0,0|1,0,1]=2 87 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [0,0,0,0,0,0|1,0,1]=2 88 B12R1.27 COC(=O)CNc1ccccn1 Amb6649089 [0,0,0,0,0,0|2,0,1]=3 89 B12R1.27 COC(=O)CNc1cccnc1 Amb18270093 [0,0,0,0,0,0|2,0,1]=3 90 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [0,0,0,0,0,0|2,0,1]=3 91 B12R1.27 COC(=O)CNc1cncnc1 Amb18270088 [0,0,0,0,0,0|3,0,1]=4 92 B12R1.27 COC(=O)CNc1ncccn1 Amb6651392 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [0,0,0,0,0,0|1,0,1]=2 94 B12R1.27 COC(=O)COc1ccccn1 Amb24095859 [0,0,0,0,0,0|2,0,1]=3 95 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [0,0,0,0,0,0|1,0,1]=2 96 B12R1.27 COC(=O)CSc1cnccn1 Amb29845365 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.27 COC(=O)CSc1ncccn1 Amb4330318 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.27 COC(=O)NCc1ccccc1 Amb2746993 [0,0,0,0,0,0|1,0,1]=2 99 B12R1.27 COC(=O)NCc1cccnn1 Amb28197550 [0,0,0,0,0,0|3,0,1]=4 100 B12R1.27 COC(=O)NCc1cnccn1 Amb35654789 [0,0,0,0,0,0|3,0,1]=4 101 B12R1.27 COC(=O)NCc1ncccn1 Amb27766428 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.27 COC(=O)NNc1ccccn1 Amb28350961 [0,0,0,0,0,0|3,0,0]=3 103 B12R1.27 COC(=O)N\C=C1/CC=CCC1 Amb24757713 [0,0,0,0,0,0|1,0,3]=4 104 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,0,0,0,0,0|1,0,1]=2 105 B12R1.27 COC(=O)\C=C\C1=CCCCC1 Amb24488525 [0,0,0,0,0,0|0,0,4]=4 106 B12R1.27 COC(=O)\C=C\N1CC=CCC1 Amb27452569 [0,0,0,0,0,0|1,0,3]=4 107 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [0,0,0,0,0,0|0,0,0]=0 108 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [0,0,0,0,0,0|0,0,0]=0 109 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [0,0,0,0,0,0|1,0,0]=1 110 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [0,0,0,0,0,0|1,0,0]=1 111 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [0,0,0,0,0,0|1,0,0]=1 112 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [0,0,0,0,0,0|1,0,0]=1 113 B12R1.27 COC(=O)\C=C\c1ccncn1 Amb28069217 [0,0,0,0,0,0|2,0,0]=2 114 B12R1.27 COC(=O)\C=C\c1cnccn1 Amb22524637 [0,0,0,0,0,0|2,0,0]=2 115 B12R1.27 COC(=O)\C=C\c1cncnc1 Amb2698637 [0,0,0,0,0,0|2,0,0]=2 116 B12R1.27 COC(=O)\C=C\c1ncccn1 Amb25337205 [0,0,0,0,0,0|2,0,0]=2 117 B12R1.27 COC(=S)NCc1ccccc1 Amb27388388 [0,0,0,0,0,0|1,1,1]=3 118 B12R1.27 COC(Cl)\C=C\c1ccccc1 Amb26371733 [0,0,0,0,0,0|1,0,1]=2 119 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,0,0,0,0,0|2,1,1]=4 120 B12R1.27 CSC(=S)NCc1ccccc1 Amb5716138 [0,0,0,0,0,0|1,2,1]=4 121 B12R1.27 CSC(=S)NNc1ccccc1 Amb27852793 [0,0,0,0,0,0|2,2,0]=4 122 B12R1.27 CSC(=S)OCc1ccccc1 Amb4035354 [0,0,0,0,0,0|1,2,1]=4 123 B12R1.27 C[C@@H](\C=C\c1ccccc1)CO Amb27642008 [0,0,0,0,0,0|3,0,1]=4 124 B12R1.27 C\C(=C/Cc1ccccc1)CN Amb27402545 [0,0,0,0,0,0|3,0,1]=4 125 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [0,0,0,0,0,0|3,0,1]=4 126 B12R1.27 C\C(C#N)=C\Nc1ccccc1 Amb27420007 [0,0,0,0,0,0|4,0,0]=4 127 B12R1.27 C\C(C=O)=C/Nc1ccccc1 Amb18645511 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.27 C\C=C(\C)C#Cc1ccccc1 Amb30621736 [0,0,0,0,0,0|2,0,2]=4 129 B12R1.27 C\N=C(\C)OCc1ccccc1 Amb27784725 [0,0,0,0,0,0|3,0,1]=4 130 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.27 N#CC(=O)OCc1ccccc1 Amb9786353 [0,0,0,0,0,0|3,0,1]=4 132 B12R1.27 N#CC(O)\C=C\c1ccccc1 Amb28208386 [0,0,0,0,0,0|2,0,2]=4 133 B12R1.27 NC(\C=C\c1ccccc1)=N/O Amb27816576 [0,0,0,0,0,0|3,0,0]=3 134 B12R1.27 NC(\C=C\c1ccccc1)=N\O Amb25065269 [0,0,0,0,0,0|3,0,0]=3 135 B12R1.27 NC(\C=C\c1ccccc1)CO Amb32954713 [0,0,0,0,0,0|3,0,1]=4 136 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,0,0,0,0,0|2,0,2]=4 137 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,0,0,0,0,0|2,0,2]=4 138 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [0,0,0,0,0,0|3,0,1]=4 139 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [0,0,0,0,0,0|3,0,1]=4 140 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,0,0,0,0,0|3,0,1]=4 141 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,0,0,0,0,0|3,0,1]=4 142 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [0,0,0,0,0,0|2,0,0]=2 143 B12R1.27 NCC(Cl)\C=C\c1ccccc1 Amb27447294 [0,0,0,0,0,0|3,0,1]=4 144 B12R1.27 NCC(F)\C=C\c1ccccc1 Amb33081747 [0,0,0,0,0,0|3,0,1]=4 145 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb32953205 [0,0,0,0,0,0|2,0,2]=4 146 B12R1.27 NC[C@@H](O)\C=C\c1ccccc1 Amb33080765 [0,0,0,0,0,0|2,0,2]=4 147 B12R1.27 NC[C@H](O)\C=C\c1ccccc1 Amb33080762 [0,0,0,0,0,0|2,0,2]=4 148 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,0,0,0,0,0|2,0,2]=4 149 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,0,0,0,0,0|3,0,1]=4 150 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [0,0,0,0,0,0|3,0,1]=4 151 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,0,0,0,0,0|3,0,1]=4 152 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [0,0,0,0,0,0|3,0,1]=4 153 B12R1.27 NNC(=O)NCc1ccccc1 Amb8853874 [0,0,0,0,0,0|3,0,1]=4 154 B12R1.27 NNC(=O)NNc1ccccc1 Amb28045865 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.27 NNC(=O)OCc1ccccc1 Amb33422006 [0,0,0,0,0,0|3,0,1]=4 156 B12R1.27 NNC(=O)OCc1ccccc1 Amb8516532 [0,0,0,0,0,0|3,0,1]=4 157 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [0,0,0,0,0,0|2,0,0]=2 158 B12R1.27 NNC(=O)\C=C\c1cccnc1 Amb2612884 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.27 NNC(=O)\C=C\c1ccncc1 Amb26611701 [0,0,0,0,0,0|3,0,0]=3 160 B12R1.27 N[C@@H](\C=C\c1ccccc1)CO Amb33081817 [0,0,0,0,0,0|3,0,1]=4 161 B12R1.27 N[C@H](\C=C\c1ccccc1)CO Amb32953226 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.27 O=C(C#Cc1ccccc1)CCl Amb26866804 [0,0,0,0,0,0|2,0,2]=4 163 B12R1.27 O=C(C#Cc1ccccc1)NO Amb27755294 [0,0,0,0,0,0|2,0,2]=4 164 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,0,0,0,0,0|2,0,2]=4 165 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,0,0,0,0,0|3,0,1]=4 166 B12R1.27 O=C(CBr)NCc1ccccc1 Amb2221074 [0,0,0,0,0,0|3,0,1]=4 167 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [0,0,0,0,0,0|3,0,1]=4 168 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,0,0,0,0,0|2,0,2]=4 169 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [0,0,0,0,0,0|2,0,2]=4 170 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [0,0,0,0,0,0|3,0,1]=4 171 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [0,0,0,0,0,0|3,0,1]=4 172 B12R1.27 O=C(CCl)NCc1ccccc1 Amb6324481 [0,0,0,0,0,0|3,0,1]=4 173 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,0,0,0,0,0|4,0,0]=4 174 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [0,0,0,0,0,0|3,0,1]=4 175 B12R1.27 O=C(CF)NCc1ccccc1 Amb27237611 [0,0,0,0,0,0|3,0,1]=4 176 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,0,0,0,0,0|3,0,1]=4 177 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,0,0,0,0,0|3,0,1]=4 178 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [0,0,0,0,0,0|2,0,2]=4 179 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [0,0,0,0,0,0|3,0,1]=4 180 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [0,0,0,0,0,0|3,0,1]=4 181 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [0,0,0,0,0,0|4,0,0]=4 182 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [0,0,0,0,0,0|3,0,1]=4 183 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,0,0,0,0,0|3,0,1]=4 184 B12R1.27 O=C(CS)NNc1ccccc1 Amb8459004 [0,0,0,0,0,0|4,0,0]=4 185 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [0,0,0,0,0,0|3,0,1]=4 186 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,0,0,0,0,0|3,0,1]=4 187 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,0,0,0,0,0|3,0,1]=4 188 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,0,0,0,0,0|3,0,1]=4 189 B12R1.27 O=C(NO)NNc1ccccc1 Amb3427817 [0,0,0,0,0,0|4,0,0]=4 190 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [0,0,0,0,0,0|3,0,1]=4 191 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [0,0,0,0,0,0|2,0,0]=2 192 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [0,0,0,0,0,0|2,0,0]=2 193 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [0,0,0,0,0,0|2,0,0]=2 194 B12R1.27 O=C(\C=C\c1ccccn1)NO Amb28370532 [0,0,0,0,0,0|3,0,0]=3 195 B12R1.27 O=C(\C=C\c1cccnc1)NO Amb28140433 [0,0,0,0,0,0|3,0,0]=3 196 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [0,0,0,0,0,0|3,0,1]=4 197 B12R1.27 O=C\C(Cl)=C\Nc1ccccc1 Amb25797781 [0,0,0,0,0,0|4,0,0]=4 198 B12R1.27 O=C\C(F)=C\Cc1ccccc1 Amb27166149 [0,0,0,0,0,0|3,0,1]=4 199 B12R1.27 O=C\C(O)=C/Nc1ccccc1 Amb27476557 [0,0,0,0,0,0|3,0,1]=4 200 B12R1.27 OC(\C=C\c1ccccc1)CBr Amb33080783 [0,0,0,0,0,0|2,0,2]=4 201 B12R1.27 OC(\C=C\c1ccccc1)CCl Amb26527861 [0,0,0,0,0,0|2,0,2]=4 202 B12R1.27 OC(\C=C\c1ccccc1)CF Amb32953290 [0,0,0,0,0,0|2,0,2]=4 203 B12R1.27 OCC(F)\C=C\c1ccccc1 Amb27593937 [0,0,0,0,0,0|3,0,1]=4 204 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb32953203 [0,0,0,0,0,0|2,0,2]=4 205 B12R1.27 OC[C@H](O)\C=C\c1ccccc1 Amb28410835 [0,0,0,0,0,0|2,0,2]=4 206 B12R1.27 [C-]#[N+]C(C)\C=C\c1ccccc1 Amb33081337 [0,0,0,0,0,0|2,0,2]=4 207 B12R1.27 [C-]#[N+]\C(C)=C/Nc1ccccc1 Amb28398147 [0,0,0,0,0,0|3,0,1]=4 208 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [0,0,0,0,0,0|3,0,1]=4 209 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [1,0,0,0,0,0|2,0,1]=4 210 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [1,0,0,0,0,0|2,0,0]=3 211 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [1,0,0,0,0,0|1,0,2]=4 212 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [1,0,0,0,0,0|1,0,2]=4 213 B11R1.28 C=C\C=C\Sc1ccccc1 Amb28284520 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [1,0,0,0,0,0|1,0,1]=3 215 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,0,0,0,0,0|2,0,1]=4 216 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [1,0,0,0,0,0|2,0,1]=4 217 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [1,0,0,0,0,0|2,0,0]=3 218 B11R1.28 CCO\C=C\c1ccncc1 Amb27253748 [1,0,0,0,0,0|3,0,0]=4 219 B11R1.28 CCO\C=N\c1ccccc1 Amb9786981 [1,0,0,0,0,0|3,0,0]=4 220 B11R1.28 CC\C=C\Cc1ccncc1 Amb27230808 [1,0,0,0,0,0|2,0,1]=4 221 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [1,0,0,0,0,0|3,0,0]=4 222 B11R1.28 CNC\C=C/c1cccnc1 Amb28423371 [1,0,0,0,0,0|2,0,1]=4 223 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,0,0,0,0,0|1,0,1]=3 224 B11R1.28 CNC\C=C\c1ccccn1 Amb26859034 [1,0,0,0,0,0|2,0,1]=4 225 B11R1.28 CNC\C=C\c1cccnc1 Amb23442752 [1,0,0,0,0,0|2,0,1]=4 226 B11R1.28 CNC\C=C\c1ccncc1 Amb26859033 [1,0,0,0,0,0|2,0,1]=4 227 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,0,0,0,0,0|0,0,3]=4 228 B11R1.28 COCCNc1ccccc1 Amb596066 [1,0,0,0,0,0|1,0,2]=4 229 B11R1.28 COCCOc1ccccc1 Amb4018811 [1,0,0,0,0,0|1,0,2]=4 230 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,0,0,0,0,0|1,0,2]=4 231 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [1,0,0,0,0,0|1,0,0]=2 232 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [1,0,0,0,0,0|0,1,1]=3 233 B11R1.28 C\C=C/N=C/c1cccnc1 Amb24486027 [1,0,0,0,0,0|3,0,0]=4 234 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [1,0,0,0,0,0|1,0,0]=2 235 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [1,0,0,0,0,0|1,0,2]=4 236 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [1,0,0,0,0,0|2,0,1]=4 237 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [1,0,0,0,0,0|2,0,1]=4 238 B11R1.28 C\C=C\N=C\c1cccnc1 Amb26566876 [1,0,0,0,0,0|3,0,0]=4 239 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [1,0,0,0,0,0|2,0,1]=4 240 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [1,0,0,0,0,0|3,0,0]=4 241 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [1,0,0,0,0,0|2,0,0]=3 242 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [1,0,0,0,0,0|2,0,1]=4 243 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [1,0,0,0,0,0|2,0,1]=4 244 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [1,0,0,0,0,0|2,0,1]=4 245 B11R1.28 N#C\C=C\Cc1ccccc1 Amb28255392 [1,0,0,0,0,0|2,0,1]=4 246 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [1,0,0,0,0,0|2,0,1]=4 247 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [1,0,0,0,0,0|2,0,1]=4 248 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [1,0,0,0,0,0|2,0,1]=4 249 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [1,0,0,0,0,0|2,0,1]=4 250 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [1,0,0,0,0,0|1,0,1]=3 251 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [1,0,0,0,0,0|2,0,0]=3 252 B11R1.28 N\C=C\C=C\c1ccccn1 Amb27961333 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [1,0,0,0,0,0|2,0,0]=3 254 B11R1.28 N\N=C\C=C\c1ccccn1 Amb27768304 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.28 O=C=C\C=C/c1ccccn1 Amb27434448 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.28 O=C=C\C=C\c1ccccn1 Amb27622513 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [1,0,0,0,0,0|2,0,1]=4 258 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [1,0,0,0,0,0|2,0,1]=4 259 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [1,0,0,0,0,0|2,0,1]=4 262 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [1,0,0,0,0,0|2,0,1]=4 263 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [1,0,0,0,0,0|2,0,1]=4 265 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [1,0,0,0,0,0|2,0,0]=3 266 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [1,0,0,0,0,0|2,0,0]=3 267 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [1,0,0,0,0,0|2,0,0]=3 268 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [1,0,0,0,0,0|2,0,1]=4 269 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [1,0,0,0,0,0|1,0,2]=4 270 B11R1.28 [N-]=[N+]=N\C=C\c1ccccc1 Amb26367041 [1,0,0,0,0,0|3,0,0]=4 271 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [1,0,0,0,0,0|1,0,2]=4 272 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [1,0,0,0,0,0|2,0,1]=4 273 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [1,0,0,0,0,0|2,0,1]=4 274 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [1,0,0,0,0,0|2,0,1]=4 275 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [1,0,0,0,0,0|1,0,0]=2 278 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [1,0,0,0,0,0|2,0,1]=4 279 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,0,0|2,0,1]=4 280 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,0,0|2,0,1]=4 281 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [1,0,0,0,0,0|0,0,2]=3 282 B11R1.91 CC(=O)C#Cc1ccccn1 Amb27267519 [1,0,0,0,0,0|1,0,2]=4 283 B11R1.91 CC(=O)C#Cc1cccnc1 Amb26455637 [1,0,0,0,0,0|1,0,2]=4 284 B11R1.91 CC(=O)C#Cc1ccncc1 Amb27249499 [1,0,0,0,0,0|1,0,2]=4 285 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,0,0,0,0,0|0,0,2]=3 286 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,0,0|1,0,2]=4 287 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,0|1,0,2]=4 288 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,0|1,0,2]=4 289 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,0,0,0,0,0|1,0,2]=4 290 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,0,0|1,0,1]=3 291 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,0,0,0,0,0|1,0,1]=3 293 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [1,0,0,0,0,0|2,0,1]=4 294 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,0,0,0,0,0|1,0,1]=3 295 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [1,0,0,0,0,0|2,0,1]=4 296 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [1,0,0,0,0,0|2,0,1]=4 297 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,0,0|1,0,1]=3 298 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [1,0,0,0,0,0|2,0,1]=4 299 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [1,0,0,0,0,0|2,0,1]=4 300 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [1,0,0,0,0,0|2,0,1]=4 301 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [1,0,0,0,0,0|2,0,0]=3 302 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [1,0,0,0,0,0|2,0,1]=4 303 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,0,0,0,0,0|1,0,1]=3 304 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [1,0,0,0,0,0|2,0,1]=4 305 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [1,0,0,0,0,0|2,0,1]=4 306 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [1,0,0,0,0,0|2,0,0]=3 307 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,0,0,0,0,0|1,0,1]=3 308 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,0,0|0,0,0]=1 309 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,0,0,0,0,0|0,0,0]=1 310 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,0,0,0,0,0|1,0,0]=2 311 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [1,0,0,0,0,0|1,0,0]=2 312 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb33223775 [1,0,0,0,0,0|1,0,0]=2 313 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb33359225 [1,0,0,0,0,0|1,0,0]=2 314 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [1,0,0,0,0,0|2,0,0]=3 315 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [1,0,0,0,0,0|2,0,0]=3 316 B11R1.91 CC(=O)\C=C\c1cncnc1 Amb32876838 [1,0,0,0,0,0|2,0,0]=3 317 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [1,0,0,0,0,0|2,0,0]=3 318 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,0,0|2,0,0]=3 319 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,0,0|1,1,1]=4 320 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [1,0,0,0,0,0|1,0,1]=3 321 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,0,0,0,0,0|1,0,1]=3 322 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [1,0,0,0,0,0|2,0,0]=3 323 B11R1.91 CC(C)=CSc1ccccc1 Amb27767952 [1,0,0,0,0,0|2,0,0]=3 324 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [1,0,0,0,0,0|1,0,1]=3 326 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [1,0,0,0,0,0|1,0,1]=3 327 B11R1.91 CC(C)\N=C\c1ccccc1 Amb4020035 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.91 CC(Cl)\C=C\c1cccnc1 Amb27881248 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.91 CC(Cl)\C=C\c1ccncc1 Amb27768545 [1,0,0,0,0,0|2,0,1]=4 330 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [1,0,0,0,0,0|1,0,1]=3 331 B11R1.91 CC(N)\C=C\c1ccccn1 Amb33172666 [1,0,0,0,0,0|2,0,1]=4 332 B11R1.91 CC(N)\C=C\c1cccnc1 Amb33172475 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.91 CC(N)\C=C\c1ccncc1 Amb33359059 [1,0,0,0,0,0|2,0,1]=4 334 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [1,0,0,0,0,0|0,0,2]=3 335 B11R1.91 CC(O)\C=C\c1ccccn1 Amb576300 [1,0,0,0,0,0|1,0,2]=4 336 B11R1.91 CC(O)\C=C\c1cccnc1 Amb25847379 [1,0,0,0,0,0|1,0,2]=4 337 B11R1.91 CC(O)\C=C\c1ccncc1 Amb616107 [1,0,0,0,0,0|1,0,2]=4 338 B11R1.91 CN(C)\C=C\c1ccncc1 Amb24355668 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.91 CN(C)\C=N\c1ccccc1 Amb33512937 [1,0,0,0,0,0|3,0,0]=4 340 B11R1.91 CN(C)\N=C\c1ccccc1 Amb33512938 [1,0,0,0,0,0|3,0,0]=4 341 B11R1.91 CS(=O)\N=C\c1ccccc1 Amb35681663 [1,0,0,0,0,0|2,0,0]=3 342 B11R1.91 CS(=O)\N=C\c1ccccn1 Amb35681655 [1,0,0,0,0,0|3,0,0]=4 343 B11R1.91 CS(=O)\N=C\c1cccnc1 Amb35681658 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.91 CS(=O)\N=C\c1ccncc1 Amb29858755 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [1,0,0,0,0,0|1,0,1]=3 346 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [1,0,0,0,0,0|0,0,2]=3 347 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [1,0,0,0,0,0|1,0,1]=3 348 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [1,0,0,0,0,0|0,0,2]=3 349 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [1,0,0,0,0,0|2,0,0]=3 351 B11R1.91 N=C(N)\C=C\c1cccnc1 Amb25992761 [1,0,0,0,0,0|3,0,0]=4 352 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [1,0,0,0,0,0|1,0,2]=4 353 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,0,0,0,0,0|1,0,2]=4 354 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,0,0|2,0,1]=4 358 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [1,0,0,0,0,0|1,0,0]=2 363 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [1,0,0,0,0,0|2,0,0]=3 364 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [1,0,0,0,0,0|1,0,0]=2 365 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [1,0,0,0,0,0|1,0,0]=2 366 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [1,0,0,0,0,0|2,0,0]=3 367 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [1,0,0,0,0,0|2,0,0]=3 368 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [1,0,0,0,0,0|2,0,0]=3 369 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [1,0,0,0,0,0|2,0,0]=3 370 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [1,0,0,0,0,0|1,1,0]=3 371 B11R1.91 NC(=S)\C=C\c1ccccn1 Amb27233532 [1,0,0,0,0,0|2,1,0]=4 372 B11R1.91 NC(=S)\C=C\c1cccnc1 Amb27232946 [1,0,0,0,0,0|2,1,0]=4 373 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,0,0,0,0,0|1,0,2]=4 374 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [1,0,0,0,0,0|1,0,0]=2 378 B11R1.91 O=C(Cl)\C=C\c1cccnc1 Amb6307270 [1,0,0,0,0,0|2,0,0]=3 379 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [1,0,0,0,0,0|2,0,1]=4 380 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [1,0,0,0,0,0|0,0,2]=3 381 B11R1.91 O=C(O)C#Cc1ccccn1 Amb16233314 [1,0,0,0,0,0|1,0,2]=4 382 B11R1.91 O=C(O)C#Cc1cccnc1 Amb20673066 [1,0,0,0,0,0|1,0,2]=4 383 B11R1.91 O=C(O)C#Cc1ccncc1 Amb20673077 [1,0,0,0,0,0|1,0,2]=4 384 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [1,0,0,0,0,0|1,0,2]=4 385 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,0,0,0,0,0|0,0,2]=3 386 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [1,0,0,0,0,0|1,0,2]=4 387 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [1,0,0,0,0,0|1,0,2]=4 388 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [1,0,0,0,0,0|1,0,2]=4 389 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,0|1,0,2]=4 390 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,0|1,0,2]=4 391 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [1,0,0,0,0,0|1,0,1]=3 392 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [1,0,0,0,0,0|2,0,1]=4 398 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [1,0,0,0,0,0|1,0,1]=3 399 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [1,0,0,0,0,0|1,0,1]=3 400 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [1,0,0,0,0,0|2,0,1]=4 401 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [1,0,0,0,0,0|2,0,1]=4 402 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [1,0,0,0,0,0|2,0,1]=4 403 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [1,0,0,0,0,0|2,0,1]=4 406 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [1,0,0,0,0,0|1,0,1]=3 407 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [1,0,0,0,0,0|2,0,1]=4 408 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [1,0,0,0,0,0|2,0,1]=4 409 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [1,0,0,0,0,0|2,0,1]=4 410 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [1,0,0,0,0,0|0,0,0]=1 411 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [1,0,0,0,0,0|1,0,0]=2 412 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [1,0,0,0,0,0|1,0,0]=2 413 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [1,0,0,0,0,0|1,0,0]=2 414 B11R1.91 O=C(O)\C=C/c1cncnc1 Amb27975406 [1,0,0,0,0,0|2,0,0]=3 415 B11R1.91 O=C(O)\C=C\N1C=CC=CC1 Amb22015329 [1,0,0,0,0,0|1,0,1]=3 416 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [1,0,0,0,0,0|0,0,0]=1 417 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [1,0,0,0,0,0|0,0,0]=1 418 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [1,0,0,0,0,0|1,0,0]=2 419 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [1,0,0,0,0,0|1,0,0]=2 420 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [1,0,0,0,0,0|1,0,0]=2 421 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [1,0,0,0,0,0|1,0,0]=2 423 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [1,0,0,0,0,0|2,0,0]=3 424 B11R1.91 O=C(O)\C=C\c1ccnnc1 Amb18125071 [1,0,0,0,0,0|2,0,0]=3 425 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [1,0,0,0,0,0|2,0,0]=3 426 B11R1.91 O=C(O)\C=C\c1cncnc1 Amb9780324 [1,0,0,0,0,0|2,0,0]=3 427 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [1,0,0,0,0,0|2,0,0]=3 428 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [1,0,0,0,0,0|1,0,2]=4 429 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [1,0,0,0,0,0|1,0,2]=4 430 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [1,0,0,0,0,0|1,0,2]=4 431 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [1,0,0,0,0,0|0,0,1]=2 432 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [1,0,0,0,0,0|0,0,1]=2 433 B11R1.91 O=C([O-])\C=C\c1cccnc1 Amb33512942 [1,0,0,0,0,0|1,0,1]=3 434 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [1,0,0,0,0,0|1,0,2]=4 436 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [1,0,0,0,0,0|1,0,0]=2 437 B11R1.91 O=S([O-])\C=C\c1ccccc1 Amb26016414 [1,0,0,0,0,0|1,0,1]=3 438 B11R1.91 O=[N+]([O-])\C=C/c1ccccc1 Amb4066298 [1,0,0,0,0,0|1,0,1]=3 439 B11R1.91 O=[N+]([O-])\C=C/c1ccncc1 Amb1054083 [1,0,0,0,0,0|2,0,1]=4 440 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb33719275 [1,0,0,0,0,0|1,0,1]=3 441 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb8396046 [1,0,0,0,0,0|1,0,1]=3 442 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb19373998 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb24106744 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb19515469 [1,0,0,0,0,0|2,0,1]=4 445 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb33512945 [1,0,0,0,0,0|2,0,1]=4 446 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb19374504 [1,0,0,0,0,0|2,0,1]=4 447 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb24096963 [1,0,0,0,0,0|2,0,1]=4 448 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [1,0,0,0,0,0|1,0,2]=4 449 B11R1.91 OB(O)\C=C\c1ccccc1 Amb2447227 [1,0,0,0,0,0|1,0,1]=3 450 B11R1.91 OB(O)\C=C\c1ccncc1 Amb26436877 [1,0,0,0,0,0|2,0,1]=4 451 B13R1.11 C=C(NC(=O)CC)c1ccccc1 Amb26619762 [0,1,0,0,0,0|2,0,0]=3 452 B13R1.11 C=C(\C=C(\C)C=O)c1ccccc1 Amb28052708 [0,1,0,0,0,0|3,0,0]=4 453 B13R1.11 C=CC(=O)\C=C(\N)c1ccccc1 Amb27984681 [0,1,0,0,0,0|1,0,1]=3 454 B13R1.11 C=C\C(C)=C/C(=O)c1ccccc1 Amb27256419 [0,1,0,0,0,0|2,0,1]=4 455 B13R1.11 CCC(=O)CC(=O)c1ccccc1 Amb7766301 [0,1,0,0,0,0|1,0,1]=3 456 B13R1.11 CCC(=O)CC(=O)c1ccccn1 Amb7766277 [0,1,0,0,0,0|2,0,1]=4 457 B13R1.11 CCC(=O)CC(=O)c1cccnc1 Amb7766279 [0,1,0,0,0,0|2,0,1]=4 458 B13R1.11 CCC(=O)CC(=O)c1ccncc1 Amb7761964 [0,1,0,0,0,0|2,0,1]=4 459 B13R1.11 CCC(=O)CC(C)c1ccccc1 Amb17594493 [0,1,0,0,0,0|1,0,2]=4 460 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,1,0,0,0,0|2,0,1]=4 461 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,1,0,0,0,0|2,0,0]=3 462 B13R1.11 CCC(=O)OC(C)c1ccccc1 Amb6357162 [0,1,0,0,0,0|2,0,1]=4 463 B13R1.11 CCC(=O)\C=C(/C)c1ccccc1 Amb27802793 [0,1,0,0,0,0|1,0,0]=2 464 B13R1.11 CCC(=O)\C=C(\N)c1ccccc1 Amb27252260 [0,1,0,0,0,0|1,0,0]=2 465 B13R1.11 CCS(=O)\N=C(\C)c1ccccc1 Amb35726570 [0,1,0,0,0,0|3,0,0]=4 466 B13R1.11 CC[C@H](O)\C=C(\C)c1ccccc1 Amb27255183 [0,1,0,0,0,0|1,0,2]=4 467 B13R1.11 CC\C(N)=N\C(=O)c1ccccc1 Amb27232979 [0,1,0,0,0,0|3,0,0]=4 468 B13R1.11 CC\C(N)=N\C(=S)c1ccccc1 Amb27407020 [0,1,0,0,0,0|3,0,0]=4 469 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,1,0,0,0,0|1,0,1]=3 470 B13R1.11 CNC(=O)CC(=O)c1ccncc1 Amb27758803 [0,1,0,0,0,0|2,0,1]=4 471 B13R1.11 CNC(=O)CC(C)c1ccccc1 Amb6846870 [0,1,0,0,0,0|1,0,2]=4 472 B13R1.11 CNC(=O)CC(N)c1ccccc1 Amb6274807 [0,1,0,0,0,0|1,0,2]=4 473 B13R1.11 CNC(=O)C[C@@H](C)c1ccccc1 Amb27624580 [0,1,0,0,0,0|1,0,2]=4 474 B13R1.11 CNC(=O)NC(=O)c1ccccc1 Amb28287343 [0,1,0,0,0,0|2,0,0]=3 475 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,1,0,0,0,0|3,0,0]=4 476 B13R1.11 CNC(=O)SC(C)c1ccccc1 Amb27442996 [0,1,0,0,0,0|2,0,1]=4 477 B13R1.11 CNC(=O)\C=C(/C)c1ccccc1 Amb27860376 [0,1,0,0,0,0|1,0,0]=2 478 B13R1.11 CNC(=O)\C=C(\C)c1ccncc1 Amb27256011 [0,1,0,0,0,0|2,0,0]=3 479 B13R1.11 CNC(=O)\C=C(\O)c1ccccc1 Amb8492599 [0,1,0,0,0,0|1,0,0]=2 480 B13R1.11 CNC(=O)\C=C(\S)c1ccccc1 Amb27464395 [0,1,0,0,0,0|1,0,0]=2 481 B13R1.11 CNC(=S)CC(=O)c1ccccc1 Amb27394060 [0,1,0,0,0,0|1,1,1]=4 482 B13R1.11 CNC(=S)NC(=O)c1ccccc1 Amb1625173 [0,1,0,0,0,0|2,1,0]=4 483 B13R1.11 CNC(=S)SC(=O)c1ccccc1 Amb28287334 [0,1,0,0,0,0|2,1,0]=4 484 B13R1.11 CNC(C)\C=C(\C)c1ccccc1 Amb28247465 [0,1,0,0,0,0|2,0,1]=4 485 B13R1.11 CN\C(C)=C/C(=S)c1ccccc1 Amb27667972 [0,1,0,0,0,0|2,0,0]=3 486 B13R1.11 COC(=O)CC(=O)N1C=CC=CC1 Amb22015167 [0,1,0,0,0,0|1,0,2]=4 487 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,1,0,0,0,0|0,0,1]=2 488 B13R1.11 COC(=O)CC(=O)c1ccccn1 Amb21857821 [0,1,0,0,0,0|1,0,1]=3 489 B13R1.11 COC(=O)CC(=O)c1cccnc1 Amb2691246 [0,1,0,0,0,0|1,0,1]=3 490 B13R1.11 COC(=O)CC(=O)c1ccncc1 Amb33527282 [0,1,0,0,0,0|1,0,1]=3 491 B13R1.11 COC(=O)CC(=O)c1ccncn1 Amb33355632 [0,1,0,0,0,0|2,0,1]=4 492 B13R1.11 COC(=O)CC(=O)c1cnccn1 Amb13893664 [0,1,0,0,0,0|2,0,1]=4 493 B13R1.11 COC(=O)CC(=O)c1cncnc1 Amb22736773 [0,1,0,0,0,0|2,0,1]=4 494 B13R1.11 COC(=O)CC(=O)c1ncccn1 Amb33356227 [0,1,0,0,0,0|2,0,1]=4 495 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,1,0,0,0,0|0,0,2]=3 496 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb1221582 [0,1,0,0,0,0|0,0,2]=3 497 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb2371447 [0,1,0,0,0,0|0,0,2]=3 498 B13R1.11 COC(=O)CC(N)c1ccccn1 Amb2694058 [0,1,0,0,0,0|1,0,2]=4 499 B13R1.11 COC(=O)CC(N)c1ccccn1 Amb7800547 [0,1,0,0,0,0|1,0,2]=4 500 B13R1.11 COC(=O)CC(N)c1cccnc1 Amb7800505 [0,1,0,0,0,0|1,0,2]=4 501 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb2694056 [0,1,0,0,0,0|1,0,2]=4 502 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb31059602 [0,1,0,0,0,0|1,0,2]=4 503 B13R1.11 COC(=O)CC(N)c1ccncc1 Amb7800512 [0,1,0,0,0,0|1,0,2]=4 504 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,1,0,0,0,0|0,0,2]=3 505 B13R1.11 COC(=O)CC(O)c1ccccn1 Amb33172097 [0,1,0,0,0,0|1,0,2]=4 506 B13R1.11 COC(=O)CC(O)c1cccnc1 Amb33450003 [0,1,0,0,0,0|1,0,2]=4 507 B13R1.11 COC(=O)CC(O)c1ccncc1 Amb32953953 [0,1,0,0,0,0|1,0,2]=4 508 B13R1.11 COC(=O)CN(C)c1ccccn1 Amb18186549 [0,1,0,0,0,0|2,0,1]=4 509 B13R1.11 COC(=O)CS(=O)c1ccccc1 Amb2774190 [0,1,0,0,0,0|1,0,1]=3 510 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,0,0,0,0|0,0,2]=3 511 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,0,0,0,0|0,0,2]=3 512 B13R1.11 COC(=O)C[C@@H](N)c1ccccn1 Amb18181074 [0,1,0,0,0,0|1,0,2]=4 513 B13R1.11 COC(=O)C[C@@H](N)c1cccnc1 Amb18181076 [0,1,0,0,0,0|1,0,2]=4 514 B13R1.11 COC(=O)C[C@@H](N)c1ccncc1 Amb18181075 [0,1,0,0,0,0|1,0,2]=4 515 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [0,1,0,0,0,0|0,0,2]=3 516 B13R1.11 COC(=O)C[C@@H](O)c1ccccn1 Amb33360491 [0,1,0,0,0,0|1,0,2]=4 517 B13R1.11 COC(=O)C[C@@H](O)c1cccnc1 Amb33360052 [0,1,0,0,0,0|1,0,2]=4 518 B13R1.11 COC(=O)C[C@@H](O)c1ccncc1 Amb33449714 [0,1,0,0,0,0|1,0,2]=4 519 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb17617178 [0,1,0,0,0,0|0,0,2]=3 520 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,0,0,0,0|0,0,2]=3 521 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb33801673 [0,1,0,0,0,0|0,0,2]=3 522 B13R1.11 COC(=O)C[C@H](N)c1ccccn1 Amb32793676 [0,1,0,0,0,0|1,0,2]=4 523 B13R1.11 COC(=O)C[C@H](N)c1cccnc1 Amb32793678 [0,1,0,0,0,0|1,0,2]=4 524 B13R1.11 COC(=O)C[C@H](N)c1ccncc1 Amb32793680 [0,1,0,0,0,0|1,0,2]=4 525 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [0,1,0,0,0,0|0,0,2]=3 526 B13R1.11 COC(=O)C[C@H](O)c1ccccn1 Amb33360489 [0,1,0,0,0,0|1,0,2]=4 527 B13R1.11 COC(=O)C[C@H](O)c1cccnc1 Amb33360051 [0,1,0,0,0,0|1,0,2]=4 528 B13R1.11 COC(=O)C[C@H](O)c1ccncc1 Amb33079643 [0,1,0,0,0,0|1,0,2]=4 529 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,1,0,0,0,0|1,0,0]=2 530 B13R1.11 COC(=O)NC(C)c1ccncc1 Amb27973719 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.11 COC(=O)NC(O)c1ccccc1 Amb27413659 [0,1,0,0,0,0|1,0,1]=3 532 B13R1.11 COC(=O)N[C@@H](C)c1cccnc1 Amb27810284 [0,1,0,0,0,0|2,0,1]=4 533 B13R1.11 COC(=O)OC(=O)c1ccccn1 Amb32658041 [0,1,0,0,0,0|2,0,0]=3 534 B13R1.11 COC(=O)\C=C(/C)c1ccccn1 Amb33529166 [0,1,0,0,0,0|1,0,0]=2 535 B13R1.11 COC(=O)\C=C(/C)c1cccnc1 Amb33551487 [0,1,0,0,0,0|1,0,0]=2 536 B13R1.11 COC(=O)\C=C(/C)c1ccncc1 Amb32644786 [0,1,0,0,0,0|1,0,0]=2 537 B13R1.11 COC(=O)\C=C(/C)c1cnccn1 Amb33528493 [0,1,0,0,0,0|2,0,0]=3 538 B13R1.11 COC(=O)\C=C(/N)c1ccccc1 Amb26953655 [0,1,0,0,0,0|0,0,0]=1 539 B13R1.11 COC(=O)\C=C(\C)c1ccccc1 Amb4035457 [0,1,0,0,0,0|0,0,0]=1 540 B13R1.11 COC(=O)\C=C(\C)c1ccccn1 Amb28075561 [0,1,0,0,0,0|1,0,0]=2 541 B13R1.11 COC(=O)\C=C(\C)c1cccnc1 Amb25191857 [0,1,0,0,0,0|1,0,0]=2 542 B13R1.11 COC(=O)\C=C(\C)c1ccncc1 Amb26571261 [0,1,0,0,0,0|1,0,0]=2 543 B13R1.11 COC(=O)\C=C(\C)c1cnccn1 Amb26464298 [0,1,0,0,0,0|2,0,0]=3 544 B13R1.11 COC(=O)\C=C(\N)c1cccnc1 Amb27191681 [0,1,0,0,0,0|1,0,0]=2 545 B13R1.11 COC(=S)NC(=O)c1ccccc1 Amb10553666 [0,1,0,0,0,0|1,1,0]=3 546 B13R1.11 CO\C(C)=C\C(=O)c1ccccc1 Amb25988190 [0,1,0,0,0,0|1,0,0]=2 547 B13R1.11 CSC(=N)NC(=O)c1ccccc1 Amb3362080 [0,1,0,0,0,0|2,1,0]=4 548 B13R1.11 CSC(=S)\N=C(/N)c1ccccc1 Amb25991361 [0,1,0,0,0,0|1,2,0]=4 549 B13R1.11 C\C(=C/C(=O)c1ccccc1)CCl Amb28044413 [0,1,0,0,0,0|3,0,0]=4 550 B13R1.11 C\C(=C\C(=O)NO)c1ccccc1 Amb27982484 [0,1,0,0,0,0|2,0,0]=3 551 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [0,1,0,0,0,0|3,0,0]=4 552 B13R1.11 NCC(=S)\C=C(\N)c1ccccc1 Amb24664310 [0,1,0,0,0,0|2,1,0]=4 553 B13R1.11 N\C(=C/C(=O)CO)c1ccccc1 Amb27248345 [0,1,0,0,0,0|2,0,0]=3 554 B13R1.11 N\C(=C\C(=O)CO)c1ccccc1 Amb27436162 [0,1,0,0,0,0|2,0,0]=3 555 B13R1.11 N\C(=C\C(=O)c1ccccc1)CO Amb27493445 [0,1,0,0,0,0|3,0,0]=4 556 B13R1.11 O=C(CCl)NC(=O)c1ccccc1 Amb6374171 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.11 O=C(CCl)NC(=S)c1ccccc1 Amb22285382 [0,1,0,0,0,0|3,0,0]=4 558 B13R1.11 O=C(CO)NC(=O)c1ccccc1 Amb1109639 [0,1,0,0,0,0|3,0,0]=4 559 B13R1.11 O=C(NCl)NC(=O)c1ccccc1 Amb27848986 [0,1,0,0,0,0|3,0,0]=4 560 B13R1.11 O=C(\C=C(/Cl)CCl)c1ccccc1 Amb25780102 [0,1,0,0,0,0|3,0,0]=4 561 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CBr Amb33335990 [0,1,0,0,0,0|3,0,0]=4 562 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CCl Amb33260281 [0,1,0,0,0,0|3,0,0]=4 563 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CN Amb33202422 [0,1,0,0,0,0|3,0,0]=4 564 B13R1.14 C=CC(=O)\C=C\c1ccc(Br)cc1 Amb33503229 [0,1,0,0,0,0|1,0,1]=3 565 B13R1.14 C=CC(=O)\C=C\c1ccc(C)cc1 Amb33503115 [0,1,0,0,0,0|1,0,1]=3 566 B13R1.14 C=CC(=O)\C=C\c1ccc(Cl)cc1 Amb20248598 [0,1,0,0,0,0|1,0,1]=3 567 B13R1.14 C=CC(=O)\C=C\c1ccc(F)cc1 Amb33503230 [0,1,0,0,0,0|1,0,1]=3 568 B13R1.14 CC(\C=C\c1ccc(F)cc1)ON Amb33202745 [0,1,0,0,0,0|2,0,1]=4 569 B13R1.14 CCC(=O)CCc1ccc(Br)cc1 Amb9031662 [0,1,0,0,0,0|1,0,2]=4 570 B13R1.14 CCC(=O)CCc1ccc(C)cc1 Amb9031666 [0,1,0,0,0,0|1,0,2]=4 571 B13R1.14 CCC(=O)CCc1ccc(Cl)cc1 Amb9031684 [0,1,0,0,0,0|1,0,2]=4 572 B13R1.14 CCC(=O)CCc1ccc(F)cc1 Amb8869667 [0,1,0,0,0,0|1,0,2]=4 573 B13R1.14 CCC(=O)CCc1ccc(O)cc1 Amb22547635 [0,1,0,0,0,0|1,0,2]=4 574 B13R1.14 CCC(=O)CNc1ccc(C)cc1 Amb28048870 [0,1,0,0,0,0|2,0,1]=4 575 B13R1.14 CCC(=O)CSc1ccc(Br)cc1 Amb32682959 [0,1,0,0,0,0|2,0,1]=4 576 B13R1.14 CCC(=O)CSc1ccc(C)cc1 Amb18330490 [0,1,0,0,0,0|2,0,1]=4 577 B13R1.14 CCC(=O)CSc1ccc(Cl)cc1 Amb19415865 [0,1,0,0,0,0|2,0,1]=4 578 B13R1.14 CCC(=O)CSc1ccc(F)cc1 Amb19083508 [0,1,0,0,0,0|2,0,1]=4 579 B13R1.14 CCC(=O)NCc1ccc(Br)cc1 Amb27414548 [0,1,0,0,0,0|2,0,1]=4 580 B13R1.14 CCC(=O)NCc1ccc(C)cc1 Amb2660843 [0,1,0,0,0,0|2,0,1]=4 581 B13R1.14 CCC(=O)NCc1ccc(Cl)cc1 Amb3094823 [0,1,0,0,0,0|2,0,1]=4 582 B13R1.14 CCC(=O)NCc1ccc(F)cc1 Amb17790296 [0,1,0,0,0,0|2,0,1]=4 583 B13R1.14 CCC(=O)NCc1ccc(N)cc1 Amb17138876 [0,1,0,0,0,0|2,0,1]=4 584 B13R1.14 CCC(=O)NNc1ccc(Br)cc1 Amb6386297 [0,1,0,0,0,0|3,0,0]=4 585 B13R1.14 CCC(=O)NNc1ccc(C)cc1 Amb3531027 [0,1,0,0,0,0|3,0,0]=4 586 B13R1.14 CCC(=O)NNc1ccc(F)cc1 Amb28294048 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.14 CCC(=O)\C=C\c1ccc(C)cc1 Amb26570561 [0,1,0,0,0,0|1,0,0]=2 588 B13R1.14 CCC(N)\C=C\c1ccc(C)cc1 Amb26609099 [0,1,0,0,0,0|2,0,1]=4 589 B13R1.14 CCC(O)\C=C\c1ccc(N)cc1 Amb35622610 [0,1,0,0,0,0|1,0,2]=4 590 B13R1.14 CCS(=O)\N=C\c1ccc(Br)cc1 Amb35726566 [0,1,0,0,0,0|3,0,0]=4 591 B13R1.14 CCS(=O)\N=C\c1ccc(C)cc1 Amb35734107 [0,1,0,0,0,0|3,0,0]=4 592 B13R1.14 CCS(=O)\N=C\c1ccc(Cl)cc1 Amb35726567 [0,1,0,0,0,0|3,0,0]=4 593 B13R1.14 CCS(=O)\N=C\c1ccc(F)cc1 Amb35726555 [0,1,0,0,0,0|3,0,0]=4 594 B13R1.14 CCS(=O)\N=C\c1ccc(I)cc1 Amb35681699 [0,1,0,0,0,0|3,0,0]=4 595 B13R1.14 CCS(=O)\N=C\c1ccc(O)cc1 Amb35726563 [0,1,0,0,0,0|3,0,0]=4 596 B13R1.14 CNC(=O)CCc1ccc(Br)cc1 Amb22900135 [0,1,0,0,0,0|1,0,2]=4 597 B13R1.14 CNC(=O)CCc1ccc(Cl)cc1 Amb23223308 [0,1,0,0,0,0|1,0,2]=4 598 B13R1.14 CNC(=O)CCc1ccc(F)cc1 Amb8333634 [0,1,0,0,0,0|1,0,2]=4 599 B13R1.14 CNC(=O)CCc1ccc(N)cc1 Amb8941579 [0,1,0,0,0,0|1,0,2]=4 600 B13R1.14 CNC(=O)COc1ccc(Br)cc1 Amb6574047 [0,1,0,0,0,0|2,0,1]=4 601 B13R1.14 CNC(=O)COc1ccc(Cl)cc1 Amb3887039 [0,1,0,0,0,0|2,0,1]=4 602 B13R1.14 CNC(=O)COc1ccc(F)cc1 Amb8050301 [0,1,0,0,0,0|2,0,1]=4 603 B13R1.14 CNC(=O)COc1ccc(I)cc1 Amb15778875 [0,1,0,0,0,0|2,0,1]=4 604 B13R1.14 CNC(=O)COc1ccc(N)cc1 Amb6252154 [0,1,0,0,0,0|2,0,1]=4 605 B13R1.14 CNC(=O)COc1ccc(O)cc1 Amb8837272 [0,1,0,0,0,0|2,0,1]=4 606 B13R1.14 CNC(=O)CSc1ccc(C)cc1 Amb3886966 [0,1,0,0,0,0|2,0,1]=4 607 B13R1.14 CNC(=O)CSc1ccc(Cl)cc1 Amb2716346 [0,1,0,0,0,0|2,0,1]=4 608 B13R1.14 CNC(=O)CSc1ccc(F)cc1 Amb8338167 [0,1,0,0,0,0|2,0,1]=4 609 B13R1.14 CNC(=O)NCc1ccc(Br)cc1 Amb28454960 [0,1,0,0,0,0|2,0,1]=4 610 B13R1.14 CNC(=O)NCc1ccc(C)cc1 Amb27982853 [0,1,0,0,0,0|2,0,1]=4 611 B13R1.14 CNC(=O)NCc1ccc(Cl)cc1 Amb2132765 [0,1,0,0,0,0|2,0,1]=4 612 B13R1.14 CNC(=O)NCc1ccc(F)cc1 Amb2132767 [0,1,0,0,0,0|2,0,1]=4 613 B13R1.14 CNC(=O)NNc1ccc(Cl)cc1 Amb27849690 [0,1,0,0,0,0|3,0,0]=4 614 B13R1.14 CNC(=O)OCc1ccc(Cl)cc1 Amb22469905 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.14 CNC(=O)\C=C\c1ccc(C)cc1 Amb3709791 [0,1,0,0,0,0|1,0,0]=2 616 B13R1.14 CNC(=O)\C=C\c1ccc(F)cc1 Amb3652110 [0,1,0,0,0,0|1,0,0]=2 617 B13R1.14 CNC(=O)\C=C\c1ccc(N)cc1 Amb19844255 [0,1,0,0,0,0|1,0,0]=2 618 B13R1.14 CNC(=O)\C=C\c1ccc(O)cc1 Amb27602328 [0,1,0,0,0,0|1,0,0]=2 619 B13R1.14 CNC(C)\C=C\c1ccc(Br)cc1 Amb27610195 [0,1,0,0,0,0|2,0,1]=4 620 B13R1.14 CNC(C)\C=C\c1ccc(I)cc1 Amb27188928 [0,1,0,0,0,0|2,0,1]=4 621 B13R1.14 CNC(C)\C=C\c1ccc(O)cc1 Amb27170468 [0,1,0,0,0,0|2,0,1]=4 622 B13R1.14 COC(=N)CCc1ccc(Br)cc1 Amb18071193 [0,1,0,0,0,0|1,0,2]=4 623 B13R1.14 COC(=N)CCc1ccc(C)cc1 Amb18065699 [0,1,0,0,0,0|1,0,2]=4 624 B13R1.14 COC(=N)CCc1ccc(Cl)cc1 Amb18066448 [0,1,0,0,0,0|1,0,2]=4 625 B13R1.14 COC(=N)CCc1ccc(F)cc1 Amb18066004 [0,1,0,0,0,0|1,0,2]=4 626 B13R1.14 COC(=N)COc1ccc(Br)cc1 Amb18071477 [0,1,0,0,0,0|2,0,1]=4 627 B13R1.14 COC(=N)COc1ccc(C)cc1 Amb18065839 [0,1,0,0,0,0|2,0,1]=4 628 B13R1.14 COC(=N)COc1ccc(Cl)cc1 Amb18066509 [0,1,0,0,0,0|2,0,1]=4 629 B13R1.14 COC(=N)COc1ccc(F)cc1 Amb18066094 [0,1,0,0,0,0|2,0,1]=4 630 B13R1.14 COC(=O)C#Cc1ccc(Br)cc1 Amb2610346 [0,1,0,0,0,0|0,0,2]=3 631 B13R1.14 COC(=O)C#Cc1ccc(C)cc1 Amb25897551 [0,1,0,0,0,0|0,0,2]=3 632 B13R1.14 COC(=O)C#Cc1ccc(C)cn1 Amb27251489 [0,1,0,0,0,0|1,0,2]=4 633 B13R1.14 COC(=O)C#Cc1ccc(C)nc1 Amb10809260 [0,1,0,0,0,0|1,0,2]=4 634 B13R1.14 COC(=O)C#Cc1ccc(Cl)cc1 Amb2616309 [0,1,0,0,0,0|0,0,2]=3 635 B13R1.14 COC(=O)C#Cc1ccc(Cl)cn1 Amb25897550 [0,1,0,0,0,0|1,0,2]=4 636 B13R1.14 COC(=O)C#Cc1ccc(F)cc1 Amb25726510 [0,1,0,0,0,0|0,0,2]=3 637 B13R1.14 COC(=O)C#Cc1ccc(F)cn1 Amb26463995 [0,1,0,0,0,0|1,0,2]=4 638 B13R1.14 COC(=O)C#Cc1ccc(N)cc1 Amb25257395 [0,1,0,0,0,0|0,0,2]=3 639 B13R1.14 COC(=O)C#Cc1ccc(O)cc1 Amb25262685 [0,1,0,0,0,0|0,0,2]=3 640 B13R1.14 COC(=O)CCc1ccc(Br)cc1 Amb15692693 [0,1,0,0,0,0|0,0,2]=3 641 B13R1.14 COC(=O)CCc1ccc(C)cc1 Amb17400662 [0,1,0,0,0,0|0,0,2]=3 642 B13R1.14 COC(=O)CCc1ccc(Cl)cc1 Amb1093990 [0,1,0,0,0,0|0,0,2]=3 643 B13R1.14 COC(=O)CCc1ccc(Cl)nc1 Amb32757643 [0,1,0,0,0,0|1,0,2]=4 644 B13R1.14 COC(=O)CCc1ccc(F)cc1 Amb17400909 [0,1,0,0,0,0|0,0,2]=3 645 B13R1.14 COC(=O)CCc1ccc(I)cc1 Amb30640065 [0,1,0,0,0,0|0,0,2]=3 646 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb33801551 [0,1,0,0,0,0|0,0,2]=3 647 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb4317820 [0,1,0,0,0,0|0,0,2]=3 648 B13R1.14 COC(=O)CCc1ccc(N)cn1 Amb33727750 [0,1,0,0,0,0|1,0,2]=4 649 B13R1.14 COC(=O)CCc1ccc(N)nc1 Amb24183802 [0,1,0,0,0,0|1,0,2]=4 650 B13R1.14 COC(=O)CCc1ccc(O)cc1 Amb3939191 [0,1,0,0,0,0|0,0,2]=3 651 B13R1.14 COC(=O)CNc1ccc(Br)cc1 Amb1921801 [0,1,0,0,0,0|1,0,1]=3 652 B13R1.14 COC(=O)CNc1ccc(Br)cn1 Amb6644273 [0,1,0,0,0,0|2,0,1]=4 653 B13R1.14 COC(=O)CNc1ccc(C)cc1 Amb6714107 [0,1,0,0,0,0|1,0,1]=3 654 B13R1.14 COC(=O)CNc1ccc(Cl)cc1 Amb6711990 [0,1,0,0,0,0|1,0,1]=3 655 B13R1.14 COC(=O)CNc1ccc(F)cc1 Amb6712342 [0,1,0,0,0,0|1,0,1]=3 656 B13R1.14 COC(=O)CNc1ccc(F)cn1 Amb19045363 [0,1,0,0,0,0|2,0,1]=4 657 B13R1.14 COC(=O)CNc1ccc(N)cc1 Amb7767916 [0,1,0,0,0,0|1,0,1]=3 658 B13R1.14 COC(=O)CNc1ccc(N)cn1 Amb1120232 [0,1,0,0,0,0|2,0,1]=4 659 B13R1.14 COC(=O)CNc1ccc(N)nc1 Amb7767908 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604010 [0,1,0,0,0,0|1,0,1]=3 661 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604138 [0,1,0,0,0,0|1,0,1]=3 662 B13R1.14 COC(=O)COc1ccc(Br)cc1 Amb6361342 [0,1,0,0,0,0|1,0,1]=3 663 B13R1.14 COC(=O)COc1ccc(C)cc1 Amb844177 [0,1,0,0,0,0|1,0,1]=3 664 B13R1.14 COC(=O)COc1ccc(Cl)cc1 Amb7102572 [0,1,0,0,0,0|1,0,1]=3 665 B13R1.14 COC(=O)COc1ccc(F)cc1 Amb7752952 [0,1,0,0,0,0|1,0,1]=3 666 B13R1.14 COC(=O)COc1ccc(I)cc1 Amb1929651 [0,1,0,0,0,0|1,0,1]=3 667 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb23385314 [0,1,0,0,0,0|1,0,1]=3 668 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb6372983 [0,1,0,0,0,0|1,0,1]=3 669 B13R1.14 COC(=O)COc1ccc(O)cc1 Amb10975204 [0,1,0,0,0,0|1,0,1]=3 670 B13R1.14 COC(=O)COc1ccc(O)cn1 Amb24095899 [0,1,0,0,0,0|2,0,1]=4 671 B13R1.14 COC(=O)CSc1ccc(Cl)cc1 Amb6383264 [0,1,0,0,0,0|1,0,1]=3 672 B13R1.14 COC(=O)CSc1ccc(N)cc1 Amb8930379 [0,1,0,0,0,0|1,0,1]=3 673 B13R1.14 COC(=O)CSc1ccc(N)cn1 Amb5786813 [0,1,0,0,0,0|2,0,1]=4 674 B13R1.14 COC(=O)CSc1ccc(O)cc1 Amb18321905 [0,1,0,0,0,0|1,0,1]=3 675 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [0,1,0,0,0,0|1,0,1]=3 676 B13R1.14 COC(=O)NCc1ccc(C)cc1 Amb17869525 [0,1,0,0,0,0|1,0,1]=3 677 B13R1.14 COC(=O)NCc1ccc(C)cn1 Amb27222951 [0,1,0,0,0,0|2,0,1]=4 678 B13R1.14 COC(=O)NCc1ccc(Cl)cc1 Amb6498503 [0,1,0,0,0,0|1,0,1]=3 679 B13R1.14 COC(=O)NCc1ccc(Cl)nc1 Amb28078811 [0,1,0,0,0,0|2,0,1]=4 680 B13R1.14 COC(=O)NCc1ccc(F)cc1 Amb17860018 [0,1,0,0,0,0|1,0,1]=3 681 B13R1.14 COC(=O)NCc1ccc(N)cc1 Amb8390013 [0,1,0,0,0,0|1,0,1]=3 682 B13R1.14 COC(=O)NCc1ccc(N)nc1 Amb27758135 [0,1,0,0,0,0|2,0,1]=4 683 B13R1.14 COC(=O)NNc1ccc(Br)cc1 Amb28047452 [0,1,0,0,0,0|2,0,0]=3 684 B13R1.14 COC(=O)NNc1ccc(Cl)cc1 Amb27603308 [0,1,0,0,0,0|2,0,0]=3 685 B13R1.14 COC(=O)NSc1ccc(N)cc1 Amb27209585 [0,1,0,0,0,0|2,0,0]=3 686 B13R1.14 COC(=O)\C=C/c1ccc(Cl)cc1 Amb26857585 [0,1,0,0,0,0|0,0,0]=1 687 B13R1.14 COC(=O)\C=C\c1ccc(Br)cc1 Amb13883656 [0,1,0,0,0,0|0,0,0]=1 688 B13R1.14 COC(=O)\C=C\c1ccc(Br)cn1 Amb25368788 [0,1,0,0,0,0|1,0,0]=2 689 B13R1.14 COC(=O)\C=C\c1ccc(Br)nc1 Amb27449840 [0,1,0,0,0,0|1,0,0]=2 690 B13R1.14 COC(=O)\C=C\c1ccc(C)cc1 Amb17844465 [0,1,0,0,0,0|0,0,0]=1 691 B13R1.14 COC(=O)\C=C\c1ccc(C)cn1 Amb25079372 [0,1,0,0,0,0|1,0,0]=2 692 B13R1.14 COC(=O)\C=C\c1ccc(Cl)cc1 Amb33513295 [0,1,0,0,0,0|0,0,0]=1 693 B13R1.14 COC(=O)\C=C\c1ccc(Cl)cn1 Amb25047046 [0,1,0,0,0,0|1,0,0]=2 694 B13R1.14 COC(=O)\C=C\c1ccc(Cl)nc1 Amb2196616 [0,1,0,0,0,0|1,0,0]=2 695 B13R1.14 COC(=O)\C=C\c1ccc(F)cc1 Amb33997710 [0,1,0,0,0,0|0,0,0]=1 696 B13R1.14 COC(=O)\C=C\c1ccc(F)nc1 Amb32645870 [0,1,0,0,0,0|1,0,0]=2 697 B13R1.14 COC(=O)\C=C\c1ccc(N)cc1 Amb2697308 [0,1,0,0,0,0|0,0,0]=1 698 B13R1.14 COC(=O)\C=C\c1ccc(N)nc1 Amb24558350 [0,1,0,0,0,0|1,0,0]=2 699 B13R1.14 COC(=O)\C=C\c1ccc(O)cc1 Amb845412 [0,1,0,0,0,0|0,0,0]=1 700 B13R1.14 COC(=O)\C=C\c1ccc(O)nc1 Amb31156089 [0,1,0,0,0,0|1,0,0]=2 701 B13R1.14 COC(=O)\C=C\c1ccc(S)cc1 Amb17616841 [0,1,0,0,0,0|0,0,0]=1 702 B13R1.14 COC(=O)\C=C\c1cnc(N)nc1 Amb27863620 [0,1,0,0,0,0|2,0,0]=3 703 B13R1.14 COC(=O)\N=C\c1ccc(F)cc1 Amb27843428 [0,1,0,0,0,0|1,0,0]=2 704 B13R1.14 CSC(=O)\C=C\c1ccc(O)cc1 Amb26984781 [0,1,0,0,0,0|0,1,0]=2 705 B13R1.14 Cc1ccc(\C=C\C(=O)CCl)cc1 Amb27144050 [0,1,0,0,0,0|2,0,0]=3 706 B13R1.14 NC(\C=C\c1ccc(F)cc1)=N\O Amb27477774 [0,1,0,0,0,0|3,0,0]=4 707 B13R1.14 NCC(=O)\C=C\c1ccc(F)cc1 Amb33418855 [0,1,0,0,0,0|2,0,0]=3 708 B13R1.14 NNC(=O)\C=C\c1ccc(F)cc1 Amb16207876 [0,1,0,0,0,0|2,0,0]=3 709 B13R1.14 NNC(=O)\C=C\c1ccc(O)cc1 Amb2612877 [0,1,0,0,0,0|2,0,0]=3 710 B13R1.14 O=C(\C=C\c1ccc(Cl)cc1)NO Amb8371006 [0,1,0,0,0,0|2,0,0]=3 711 B13R1.14 O=C(\C=C\c1ccc(F)cc1)CCl Amb33262390 [0,1,0,0,0,0|2,0,0]=3 712 B13R1.14 O=C(\C=C\c1ccc(F)cc1)NO Amb28045585 [0,1,0,0,0,0|2,0,0]=3 713 B13R1.14 O=C(\C=C\c1ccc(O)cc1)NO Amb24722969 [0,1,0,0,0,0|2,0,0]=3 714 B13R1.14 O=CC(=O)\C=C\c1ccc(Cl)cc1 Amb25212273 [0,1,0,0,0,0|2,0,0]=3 715 B13R1.15 C=CC(=O)\C=C\c1cccc(Br)c1 Amb33503220 [0,1,0,0,0,0|1,0,1]=3 716 B13R1.15 C=CC(=O)\C=C\c1cccc(C)c1 Amb33503234 [0,1,0,0,0,0|1,0,1]=3 717 B13R1.15 C=CC(=O)\C=C\c1cccc(Cl)c1 Amb33503240 [0,1,0,0,0,0|1,0,1]=3 718 B13R1.15 C=CC(=O)\C=C\c1cccc(F)c1 Amb33503227 [0,1,0,0,0,0|1,0,1]=3 719 B13R1.15 CCC(=O)CCc1cccc(Br)c1 Amb8869666 [0,1,0,0,0,0|1,0,2]=4 720 B13R1.15 CCC(=O)CCc1cccc(C)c1 Amb9031665 [0,1,0,0,0,0|1,0,2]=4 721 B13R1.15 CCC(=O)CCc1cccc(Cl)c1 Amb9031683 [0,1,0,0,0,0|1,0,2]=4 722 B13R1.15 CCC(=O)CSc1cccc(Br)c1 Amb32682988 [0,1,0,0,0,0|2,0,1]=4 723 B13R1.15 CCC(=O)CSc1cccc(C)c1 Amb18330491 [0,1,0,0,0,0|2,0,1]=4 724 B13R1.15 CCC(=O)CSc1cccc(Cl)c1 Amb32682967 [0,1,0,0,0,0|2,0,1]=4 725 B13R1.15 CCC(=O)CSc1cccc(F)c1 Amb32682972 [0,1,0,0,0,0|2,0,1]=4 726 B13R1.15 CCC(=O)NCc1cccc(Br)c1 Amb2085744 [0,1,0,0,0,0|2,0,1]=4 727 B13R1.15 CCC(=O)NCc1cccc(Cl)c1 Amb2023613 [0,1,0,0,0,0|2,0,1]=4 728 B13R1.15 CCC(=O)NCc1cccc(F)c1 Amb26369355 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.15 CCS(=O)\N=C\c1cccc(Br)c1 Amb35726561 [0,1,0,0,0,0|3,0,0]=4 730 B13R1.15 CCS(=O)\N=C\c1cccc(C)c1 Amb35733837 [0,1,0,0,0,0|3,0,0]=4 731 B13R1.15 CCS(=O)\N=C\c1cccc(Cl)c1 Amb35726594 [0,1,0,0,0,0|3,0,0]=4 732 B13R1.15 CCS(=O)\N=C\c1cccc(F)c1 Amb35726880 [0,1,0,0,0,0|3,0,0]=4 733 B13R1.15 CCS(=O)\N=C\c1cccc(I)c1 Amb35681724 [0,1,0,0,0,0|3,0,0]=4 734 B13R1.15 CCS(=O)\N=C\c1cccc(O)c1 Amb35726881 [0,1,0,0,0,0|3,0,0]=4 735 B13R1.15 CNC(=O)C#Cc1cccc(F)c1 Amb27587273 [0,1,0,0,0,0|1,0,2]=4 736 B13R1.15 CNC(=O)CCc1cccc(Br)c1 Amb28383985 [0,1,0,0,0,0|1,0,2]=4 737 B13R1.15 CNC(=O)CCc1cccc(Cl)c1 Amb27873385 [0,1,0,0,0,0|1,0,2]=4 738 B13R1.15 CNC(=O)CCc1cccc(F)c1 Amb27254994 [0,1,0,0,0,0|1,0,2]=4 739 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb17622196 [0,1,0,0,0,0|1,0,2]=4 740 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb19959906 [0,1,0,0,0,0|1,0,2]=4 741 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb8941578 [0,1,0,0,0,0|1,0,2]=4 742 B13R1.15 CNC(=O)CNc1cccc(F)c1 Amb6711905 [0,1,0,0,0,0|2,0,1]=4 743 B13R1.15 CNC(=O)COc1cccc(Br)c1 Amb6268275 [0,1,0,0,0,0|2,0,1]=4 744 B13R1.15 CNC(=O)COc1cccc(Cl)c1 Amb3099987 [0,1,0,0,0,0|2,0,1]=4 745 B13R1.15 CNC(=O)COc1cccc(I)c1 Amb8249668 [0,1,0,0,0,0|2,0,1]=4 746 B13R1.15 CNC(=O)COc1cccc(N)c1 Amb6245541 [0,1,0,0,0,0|2,0,1]=4 747 B13R1.15 CNC(=O)COc1cccc(O)c1 Amb8837479 [0,1,0,0,0,0|2,0,1]=4 748 B13R1.15 CNC(=O)CSc1cccc(Cl)c1 Amb28078695 [0,1,0,0,0,0|2,0,1]=4 749 B13R1.15 CNC(=O)NCc1cccc(Br)c1 Amb15366176 [0,1,0,0,0,0|2,0,1]=4 750 B13R1.15 CNC(=O)NCc1cccc(Cl)c1 Amb22584233 [0,1,0,0,0,0|2,0,1]=4 751 B13R1.15 CNC(=O)NCc1cccc(F)c1 Amb27973718 [0,1,0,0,0,0|2,0,1]=4 752 B13R1.15 CNC(=O)NNc1cccc(C)c1 Amb24741035 [0,1,0,0,0,0|3,0,0]=4 753 B13R1.15 CNC(=O)\C=C/c1cccc(F)c1 Amb27793059 [0,1,0,0,0,0|1,0,0]=2 754 B13R1.15 CNC(=O)\C=C\c1cccc(N)c1 Amb17138777 [0,1,0,0,0,0|1,0,0]=2 755 B13R1.15 CNC(=O)\C=C\c1cncc(C)c1 Amb27810299 [0,1,0,0,0,0|2,0,0]=3 756 B13R1.15 CNC(C)\C=C\c1cccc(Br)c1 Amb27610313 [0,1,0,0,0,0|2,0,1]=4 757 B13R1.15 COC(=N)CCc1cccc(Br)c1 Amb18071178 [0,1,0,0,0,0|1,0,2]=4 758 B13R1.15 COC(=N)CCc1cccc(C)c1 Amb18065695 [0,1,0,0,0,0|1,0,2]=4 759 B13R1.15 COC(=N)CCc1cccc(Cl)c1 Amb18066444 [0,1,0,0,0,0|1,0,2]=4 760 B13R1.15 COC(=N)CCc1cccc(F)c1 Amb18564164 [0,1,0,0,0,0|1,0,2]=4 761 B13R1.15 COC(=N)COc1cccc(Br)c1 Amb18577246 [0,1,0,0,0,0|2,0,1]=4 762 B13R1.15 COC(=N)COc1cccc(C)c1 Amb18065838 [0,1,0,0,0,0|2,0,1]=4 763 B13R1.15 COC(=N)COc1cccc(Cl)c1 Amb18066508 [0,1,0,0,0,0|2,0,1]=4 764 B13R1.15 COC(=N)COc1cccc(F)c1 Amb18066093 [0,1,0,0,0,0|2,0,1]=4 765 B13R1.15 COC(=O)C#CC1=CC=CC(=O)N1 Amb28146696 [0,1,0,0,0,0|1,0,2]=4 766 B13R1.15 COC(=O)C#Cc1cc(F)ccn1 Amb27490813 [0,1,0,0,0,0|1,0,2]=4 767 B13R1.15 COC(=O)C#Cc1cccc(Br)c1 Amb26367370 [0,1,0,0,0,0|0,0,2]=3 768 B13R1.15 COC(=O)C#Cc1cccc(C)c1 Amb27169780 [0,1,0,0,0,0|0,0,2]=3 769 B13R1.15 COC(=O)C#Cc1cccc(C)n1 Amb28129177 [0,1,0,0,0,0|1,0,2]=4 770 B13R1.15 COC(=O)C#Cc1cccc(F)c1 Amb25726243 [0,1,0,0,0,0|0,0,2]=3 771 B13R1.15 COC(=O)C#Cc1cccc(N)c1 Amb32989932 [0,1,0,0,0,0|0,0,2]=3 772 B13R1.15 COC(=O)C#Cc1cccc(O)c1 Amb32989938 [0,1,0,0,0,0|0,0,2]=3 773 B13R1.15 COC(=O)C#Cc1ccnc(C)c1 Amb25039572 [0,1,0,0,0,0|1,0,2]=4 774 B13R1.15 COC(=O)C#Cc1cncc(Cl)c1 Amb27829307 [0,1,0,0,0,0|1,0,2]=4 775 B13R1.15 COC(=O)C#Cc1cncc(O)c1 Amb27453656 [0,1,0,0,0,0|1,0,2]=4 776 B13R1.15 COC(=O)CCc1cccc(Br)c1 Amb17410710 [0,1,0,0,0,0|0,0,2]=3 777 B13R1.15 COC(=O)CCc1cccc(C)c1 Amb17400661 [0,1,0,0,0,0|0,0,2]=3 778 B13R1.15 COC(=O)CCc1cccc(Cl)c1 Amb17402276 [0,1,0,0,0,0|0,0,2]=3 779 B13R1.15 COC(=O)CCc1cccc(F)c1 Amb30868064 [0,1,0,0,0,0|0,0,2]=3 780 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb18648245 [0,1,0,0,0,0|0,0,2]=3 781 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb33533668 [0,1,0,0,0,0|0,0,2]=3 782 B13R1.15 COC(=O)CCc1cccc(O)c1 Amb2695338 [0,1,0,0,0,0|0,0,2]=3 783 B13R1.15 COC(=O)CCc1cncc(N)c1 Amb28556110 [0,1,0,0,0,0|1,0,2]=4 784 B13R1.15 COC(=O)CCc1cncc(N)c1 Amb33307156 [0,1,0,0,0,0|1,0,2]=4 785 B13R1.15 COC(=O)CNc1cc(N)ccn1 Amb18184983 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.15 COC(=O)CNc1cccc(Br)c1 Amb6712280 [0,1,0,0,0,0|1,0,1]=3 787 B13R1.15 COC(=O)CNc1cccc(Br)n1 Amb28194646 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.15 COC(=O)CNc1cccc(C)c1 Amb6706758 [0,1,0,0,0,0|1,0,1]=3 789 B13R1.15 COC(=O)CNc1cccc(C)n1 Amb18796228 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.15 COC(=O)CNc1cccc(Cl)c1 Amb6711877 [0,1,0,0,0,0|1,0,1]=3 791 B13R1.15 COC(=O)CNc1cccc(Cl)n1 Amb25187972 [0,1,0,0,0,0|2,0,1]=4 792 B13R1.15 COC(=O)CNc1cccc(F)c1 Amb6711935 [0,1,0,0,0,0|1,0,1]=3 793 B13R1.15 COC(=O)CNc1cccc(F)n1 Amb19011125 [0,1,0,0,0,0|2,0,1]=4 794 B13R1.15 COC(=O)CNc1cccc(N)c1 Amb8825462 [0,1,0,0,0,0|1,0,1]=3 795 B13R1.15 COC(=O)CNc1cccc(N)n1 Amb27799681 [0,1,0,0,0,0|2,0,1]=4 796 B13R1.15 COC(=O)CNc1cccc(O)c1 Amb27202255 [0,1,0,0,0,0|1,0,1]=3 797 B13R1.15 COC(=O)CNc1cncc(Cl)c1 Amb29864722 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.15 COC(=O)COc1cc(Cl)ccn1 Amb22301619 [0,1,0,0,0,0|2,0,1]=4 799 B13R1.15 COC(=O)COc1cccc(Br)c1 Amb7752993 [0,1,0,0,0,0|1,0,1]=3 800 B13R1.15 COC(=O)COc1cccc(I)c1 Amb8830748 [0,1,0,0,0,0|1,0,1]=3 801 B13R1.15 COC(=O)COc1cccc(N)c1 Amb1117898 [0,1,0,0,0,0|1,0,1]=3 802 B13R1.15 COC(=O)COc1cccc(N)c1 Amb6893075 [0,1,0,0,0,0|1,0,1]=3 803 B13R1.15 COC(=O)CSc1cc(Cl)ccn1 Amb22304246 [0,1,0,0,0,0|2,0,1]=4 804 B13R1.15 COC(=O)CSc1cccc(Br)c1 Amb30588444 [0,1,0,0,0,0|1,0,1]=3 805 B13R1.15 COC(=O)CSc1cccc(N)c1 Amb19005104 [0,1,0,0,0,0|1,0,1]=3 806 B13R1.15 COC(=O)NCc1cccc(Br)c1 Amb2135033 [0,1,0,0,0,0|1,0,1]=3 807 B13R1.15 COC(=O)NCc1cccc(C)c1 Amb25133958 [0,1,0,0,0,0|1,0,1]=3 808 B13R1.15 COC(=O)NCc1cccc(Cl)c1 Amb2023614 [0,1,0,0,0,0|1,0,1]=3 809 B13R1.15 COC(=O)NCc1cccc(O)c1 Amb18181287 [0,1,0,0,0,0|1,0,1]=3 810 B13R1.15 COC(=O)NCc1ccnc(C)c1 Amb28193974 [0,1,0,0,0,0|2,0,1]=4 811 B13R1.15 COC(=O)NNc1cccc(C)c1 Amb26991502 [0,1,0,0,0,0|2,0,0]=3 812 B13R1.15 COC(=O)\C=C\C1=CC(=O)CCC1 Amb34891577 [0,1,0,0,0,0|0,0,3]=4 813 B13R1.15 COC(=O)\C=C\c1cc(Cl)ccn1 Amb33469155 [0,1,0,0,0,0|1,0,0]=2 814 B13R1.15 COC(=O)\C=C\c1cccc(Br)c1 Amb2407728 [0,1,0,0,0,0|0,0,0]=1 815 B13R1.15 COC(=O)\C=C\c1cccc(Br)n1 Amb20248559 [0,1,0,0,0,0|1,0,0]=2 816 B13R1.15 COC(=O)\C=C\c1cccc(C)c1 Amb27474091 [0,1,0,0,0,0|0,0,0]=1 817 B13R1.15 COC(=O)\C=C\c1cccc(C)n1 Amb28044037 [0,1,0,0,0,0|1,0,0]=2 818 B13R1.15 COC(=O)\C=C\c1cccc(Cl)c1 Amb34003410 [0,1,0,0,0,0|0,0,0]=1 819 B13R1.15 COC(=O)\C=C\c1cccc(F)c1 Amb10839543 [0,1,0,0,0,0|0,0,0]=1 820 B13R1.15 COC(=O)\C=C\c1cccc(N)c1 Amb34006706 [0,1,0,0,0,0|0,0,0]=1 821 B13R1.15 COC(=O)\C=C\c1cccc(N)n1 Amb26916102 [0,1,0,0,0,0|1,0,0]=2 822 B13R1.15 COC(=O)\C=C\c1cccc(O)c1 Amb18128083 [0,1,0,0,0,0|0,0,0]=1 823 B13R1.15 COC(=O)\C=C\c1ccnc(C)n1 Amb27799554 [0,1,0,0,0,0|2,0,0]=3 824 B13R1.15 COC(=O)\C=C\c1ccnc(Cl)c1 Amb28400500 [0,1,0,0,0,0|1,0,0]=2 825 B13R1.15 COC(=O)\C=C\c1cncc(Br)c1 Amb25880312 [0,1,0,0,0,0|1,0,0]=2 826 B13R1.15 COC(=O)\C=C\c1cncc(F)c1 Amb27207570 [0,1,0,0,0,0|1,0,0]=2 827 B13R1.15 COC(=O)\C=C\c1cncc(F)c1 Amb33715482 [0,1,0,0,0,0|1,0,0]=2 828 B13R1.15 COC(=O)\C=C\c1cncc(O)c1 Amb27649898 [0,1,0,0,0,0|1,0,0]=2 829 B13R1.15 N=C(\C=C\c1cccc(O)c1)NO Amb25176440 [0,1,0,0,0,0|3,0,0]=4 830 B13R1.15 NNC(=O)\C=C\c1cccc(Br)c1 Amb8998051 [0,1,0,0,0,0|2,0,0]=3 831 B13R1.15 O=C(\C=C\c1cncc(F)c1)NO Amb27977385 [0,1,0,0,0,0|3,0,0]=4 832 B13R1.42 C=C(\C=C\c1ccccc1)CCN Amb33081079 [0,1,0,0,0,0|2,0,0]=3 833 B13R1.42 C=CNC(=O)\C=C\c1ccccc1 Amb26908425 [0,1,0,0,0,0|1,0,1]=3 834 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [0,1,0,0,0,0|0,0,3]=4 835 B13R1.42 C=COC(=O)OCc1ccccc1 Amb8471025 [0,1,0,0,0,0|1,0,2]=4 836 B13R1.42 CC#CC(=O)C#Cc1ccccc1 Amb27476271 [0,1,0,0,0,0|1,0,2]=4 837 B13R1.42 CC#CC(=O)CCc1ccccc1 Amb17619342 [0,1,0,0,0,0|1,0,2]=4 838 B13R1.42 CC#CC(=O)NNc1ccccc1 Amb27218830 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.42 CC(\C=C\c1ccccc1)CCN Amb33081133 [0,1,0,0,0,0|2,0,1]=4 840 B13R1.42 CC(\C=C\c1ccccc1)CON Amb33080786 [0,1,0,0,0,0|2,0,1]=4 841 B13R1.42 CCCC(=O)C#Cc1ccccc1 Amb17594320 [0,1,0,0,0,0|1,0,2]=4 842 B13R1.42 CCCC(=O)CCc1ccccc1 Amb9031589 [0,1,0,0,0,0|1,0,2]=4 843 B13R1.42 CCCC(=O)CSc1ccccc1 Amb18330492 [0,1,0,0,0,0|2,0,1]=4 844 B13R1.42 CCCC(=O)NCc1ccccc1 Amb2701481 [0,1,0,0,0,0|2,0,1]=4 845 B13R1.42 CCCC(=O)NNc1ccccc1 Amb4081014 [0,1,0,0,0,0|3,0,0]=4 846 B13R1.42 CCCC(=O)OCc1ccccc1 Amb6357333 [0,1,0,0,0,0|2,0,1]=4 847 B13R1.42 CCNC(=O)C#Cc1ccccc1 Amb27230535 [0,1,0,0,0,0|1,0,2]=4 848 B13R1.42 CCNC(=O)CCc1ccccc1 Amb6542498 [0,1,0,0,0,0|1,0,2]=4 849 B13R1.42 CCNC(=O)CNc1ccccc1 Amb6477739 [0,1,0,0,0,0|2,0,1]=4 850 B13R1.42 CCNC(=O)NNc1ccccc1 Amb24710661 [0,1,0,0,0,0|3,0,0]=4 851 B13R1.42 CCNC(=O)OCc1ccccc1 Amb24375743 [0,1,0,0,0,0|2,0,1]=4 852 B13R1.42 CCNC(=O)\C=C\c1ccccc1 Amb3358403 [0,1,0,0,0,0|1,0,0]=2 853 B13R1.42 CCNC(=O)\C=C\c1ccncn1 Amb28051284 [0,1,0,0,0,0|3,0,0]=4 854 B13R1.42 CCNC(=O)\C=C\c1cnccn1 Amb28051285 [0,1,0,0,0,0|3,0,0]=4 855 B13R1.42 CCOC(=O)C#Cc1ccccc1 Amb2721509 [0,1,0,0,0,0|0,0,2]=3 856 B13R1.42 CCOC(=O)C#Cc1ccccn1 Amb24494363 [0,1,0,0,0,0|1,0,2]=4 857 B13R1.42 CCOC(=O)C#Cc1cccnc1 Amb27259063 [0,1,0,0,0,0|1,0,2]=4 858 B13R1.42 CCOC(=O)C#Cc1ccncc1 Amb26471725 [0,1,0,0,0,0|1,0,2]=4 859 B13R1.42 CCOC(=O)CCc1ccccc1 Amb3940133 [0,1,0,0,0,0|0,0,2]=3 860 B13R1.42 CCOC(=O)CCc1ccccn1 Amb5721889 [0,1,0,0,0,0|1,0,2]=4 861 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,1,0,0,0,0|1,0,1]=3 862 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,1,0,0,0,0|1,0,1]=3 863 B13R1.42 CCOC(=O)CNc1ccccn1 Amb18181060 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.42 CCOC(=O)CNc1cccnc1 Amb24180824 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.42 CCOC(=O)CNc1ccncc1 Amb18181061 [0,1,0,0,0,0|2,0,1]=4 866 B13R1.42 CCOC(=O)COc1ccccc1 Amb2687923 [0,1,0,0,0,0|1,0,1]=3 867 B13R1.42 CCOC(=O)COc1ccccn1 Amb22493952 [0,1,0,0,0,0|2,0,1]=4 868 B13R1.42 CCOC(=O)COc1cccnc1 Amb836907 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,1,0,0,0,0|1,0,1]=3 870 B13R1.42 CCOC(=O)CSc1ccccn1 Amb6504909 [0,1,0,0,0,0|2,0,1]=4 871 B13R1.42 CCOC(=O)CSc1cccnc1 Amb24103483 [0,1,0,0,0,0|2,0,1]=4 872 B13R1.42 CCOC(=O)NCc1ccccc1 Amb2736961 [0,1,0,0,0,0|1,0,1]=3 873 B13R1.42 CCOC(=O)NSc1ccccn1 Amb24103464 [0,1,0,0,0,0|3,0,0]=4 874 B13R1.42 CCOC(=O)OCc1ccccc1 Amb27166327 [0,1,0,0,0,0|1,0,1]=3 875 B13R1.42 CCOC(=O)\C=C\c1ccccc1 Amb6296621 [0,1,0,0,0,0|0,0,0]=1 876 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb33996583 [0,1,0,0,0,0|1,0,0]=2 877 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,1,0,0,0,0|1,0,0]=2 878 B13R1.42 CCOC(=O)\C=C\c1ccncc1 Amb33870677 [0,1,0,0,0,0|1,0,0]=2 879 B13R1.42 CCOC(=O)\C=N\c1ccccc1 Amb2609189 [0,1,0,0,0,0|1,0,0]=2 880 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,1,0,0,0,0|2,0,1]=4 881 B13R1.42 CNCC(=O)NCc1ccccc1 Amb6276572 [0,1,0,0,0,0|2,0,1]=4 882 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,1,0,0,0,0|2,0,1]=4 883 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,1,0,0,0,0|2,0,1]=4 884 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,1,0,0,0,0|2,0,1]=4 885 B13R1.42 CNCC(=O)\C=C\c1ccccc1 Amb33081764 [0,1,0,0,0,0|1,0,0]=2 886 B13R1.42 CNCC(O)\C=C\c1ccccc1 Amb33081784 [0,1,0,0,0,0|1,0,2]=4 887 B13R1.42 CNNC(=O)NCc1ccccc1 Amb26951702 [0,1,0,0,0,0|2,0,1]=4 888 B13R1.42 CNNC(=O)OCc1ccccc1 Amb27441289 [0,1,0,0,0,0|2,0,1]=4 889 B13R1.42 CNNC(=O)OCc1ccccc1 Amb32668702 [0,1,0,0,0,0|2,0,1]=4 890 B13R1.42 COCC(=O)C#Cc1ccccc1 Amb28199861 [0,1,0,0,0,0|0,0,2]=3 891 B13R1.42 COCC(=O)CSc1ccccc1 Amb32683206 [0,1,0,0,0,0|1,0,1]=3 892 B13R1.42 COCC(=O)NCc1ccccc1 Amb2661100 [0,1,0,0,0,0|1,0,1]=3 893 B13R1.42 CONC(=O)C#Cc1ccccc1 Amb27804951 [0,1,0,0,0,0|0,0,2]=3 894 B13R1.42 CONC(=O)CNc1ccccc1 Amb28188422 [0,1,0,0,0,0|1,0,1]=3 895 B13R1.42 CONC(=O)NCc1ccncc1 Amb27651408 [0,1,0,0,0,0|2,0,1]=4 896 B13R1.42 CONC(=O)OCc1ccccc1 Amb16969956 [0,1,0,0,0,0|1,0,1]=3 897 B13R1.42 CONC(=O)\C=C\c1ccccc1 Amb28064704 [0,1,0,0,0,0|0,0,0]=1 898 B13R1.42 CONC(=O)\C=C\c1ccccn1 Amb27834715 [0,1,0,0,0,0|1,0,0]=2 899 B13R1.42 CONC(=O)\C=C\c1cnccn1 Amb28051402 [0,1,0,0,0,0|2,0,0]=3 900 B13R1.42 CONC(=S)NCc1ccccc1 Amb28125628 [0,1,0,0,0,0|1,1,1]=4 901 B13R1.42 CSCC(=O)NCc1ccccc1 Amb19382179 [0,1,0,0,0,0|1,1,1]=4 902 B13R1.42 CSCC(=O)OCc1ccccc1 Amb27769587 [0,1,0,0,0,0|1,1,1]=4 903 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,1,0,0,0,0|2,0,1]=4 904 B13R1.42 C\C=C\C(=O)NNc1ccccc1 Amb17777823 [0,1,0,0,0,0|3,0,0]=4 905 B13R1.42 C\C=C\C(=O)OCc1ccccc1 Amb10572342 [0,1,0,0,0,0|2,0,1]=4 906 B13R1.42 C\C=C\C(=O)\C=C\c1ccccc1 Amb28074660 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.42 C\C=C\C(O)\C=C\c1ccccc1 Amb28079231 [0,1,0,0,0,0|1,0,2]=4 908 B13R1.42 N#CCC(=O)\C=C\c1ccccc1 Amb27759542 [0,1,0,0,0,0|1,0,1]=3 909 B13R1.42 NC(\C=C\c1ccccc1)CCO Amb32954745 [0,1,0,0,0,0|2,0,1]=4 910 B13R1.42 NCCC(=O)NCc1ccccc1 Amb15740949 [0,1,0,0,0,0|2,0,1]=4 911 B13R1.42 NCCC(=O)NCc1ccccc1 Amb5784981 [0,1,0,0,0,0|2,0,1]=4 912 B13R1.42 NCCC(=O)OCc1ccccc1 Amb33549621 [0,1,0,0,0,0|2,0,1]=4 913 B13R1.42 NCCC(=O)OCc1ccccc1 Amb6740279 [0,1,0,0,0,0|2,0,1]=4 914 B13R1.42 NCCC(=O)\C=C\c1ccccc1 Amb33081763 [0,1,0,0,0,0|1,0,0]=2 915 B13R1.42 NCCC(F)\C=C\c1ccccc1 Amb33081748 [0,1,0,0,0,0|2,0,1]=4 916 B13R1.42 NCCC(O)\C=C\c1ccccc1 Amb33081221 [0,1,0,0,0,0|1,0,2]=4 917 B13R1.42 NCC[C@@H](O)\C=C\c1ccccc1 Amb33080768 [0,1,0,0,0,0|1,0,2]=4 918 B13R1.42 NCC[C@H](O)\C=C\c1ccccc1 Amb33080769 [0,1,0,0,0,0|1,0,2]=4 919 B13R1.42 NCNC(=O)OCc1ccccc1 Amb27983552 [0,1,0,0,0,0|2,0,1]=4 920 B13R1.42 NOCC(=O)OCc1ccccc1 Amb25815887 [0,1,0,0,0,0|2,0,1]=4 921 B13R1.42 N\C=C\C(=O)\C=C\c1ccccc1 Amb28385592 [0,1,0,0,0,0|1,0,1]=3 922 B13R1.42 O=C(CCBr)OCc1ccccc1 Amb22232000 [0,1,0,0,0,0|2,0,1]=4 923 B13R1.42 O=C(CCCl)NCc1ccccc1 Amb1931859 [0,1,0,0,0,0|2,0,1]=4 924 B13R1.42 O=C(CCCl)OCc1ccccc1 Amb26951432 [0,1,0,0,0,0|2,0,1]=4 925 B13R1.42 O=C(CCF)OCc1ccccc1 Amb22497154 [0,1,0,0,0,0|2,0,1]=4 926 B13R1.42 O=C(CCO)NCc1ccccc1 Amb17335299 [0,1,0,0,0,0|2,0,1]=4 927 B13R1.42 O=C(CCO)NNc1ccccc1 Amb27180414 [0,1,0,0,0,0|3,0,0]=4 928 B13R1.42 O=C(CCO)OCc1ccccc1 Amb17609079 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.42 O=C(CCS)NCc1ccccc1 Amb27947419 [0,1,0,0,0,0|2,0,1]=4 930 B13R1.42 O=C(CCS)OCc1ccccc1 Amb24495479 [0,1,0,0,0,0|2,0,1]=4 931 B13R1.42 O=C(NCO)OCc1ccccc1 Amb10066979 [0,1,0,0,0,0|2,0,1]=4 932 B13R1.42 O=C(\C=C/O)\C=C\c1ccccc1 Amb27750264 [0,1,0,0,0,0|1,0,1]=3 933 B13R1.42 O=C(\C=C\c1ccccc1)N=C=S Amb2686558 [0,1,0,0,0,0|1,0,1]=3 934 B13R1.42 O=C(\C=C\c1ccccc1)\C=N\O Amb25065153 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.42 O=C=NC(=S)\C=C\c1ccccc1 Amb27238559 [0,1,0,0,0,0|1,1,1]=4 936 B13R1.42 O=C\C=C(Cl)\C=C\c1ccccc1 Amb27643648 [0,1,0,0,0,0|2,0,1]=4 937 B13R1.42 [N-]=[N+]=CC(=O)\C=C\c1ccccc1 Amb20248597 [0,1,0,0,0,0|2,0,0]=3 938 B13R1.135 C=C(CBr)\C(C)=C\c1ccccc1 Amb33381248 [0,1,0,0,0,0|3,0,0]=4 939 B13R1.135 C=C(CCl)\C(C)=C\c1ccccc1 Amb33381253 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.135 C=C(CN)\C(C)=C\c1ccccc1 Amb33380900 [0,1,0,0,0,0|3,0,0]=4 941 B13R1.135 C=C(Cc1ccccc1)C(=O)OC Amb8390348 [0,1,0,0,0,0|0,0,1]=2 942 B13R1.135 C=C(SC)C(=O)Nc1ccccc1 Amb27797309 [0,1,0,0,0,0|2,1,0]=4 943 B13R1.135 C=CC(=O)\C(C)=C\c1ccccc1 Amb33081532 [0,1,0,0,0,0|1,0,1]=3 944 B13R1.135 CCC(=O)C(C)Cc1ccccc1 Amb17233202 [0,1,0,0,0,0|1,0,2]=4 945 B13R1.135 CCC(=O)C(C)Sc1ccccc1 Amb32683032 [0,1,0,0,0,0|2,0,1]=4 946 B13R1.135 CCC(=O)N(C)Cc1ccccc1 Amb3886753 [0,1,0,0,0,0|2,0,1]=4 947 B13R1.135 CCC(=O)\C(C)=C\c1ccccc1 Amb27428384 [0,1,0,0,0,0|1,0,0]=2 948 B13R1.135 CCC(=O)\C(C)=C\c1cccnc1 Amb24633428 [0,1,0,0,0,0|2,0,0]=3 949 B13R1.135 CC[C@@H](O)\C(C)=C\c1ccccc1 Amb27852767 [0,1,0,0,0,0|1,0,2]=4 950 B13R1.135 CC[C@@H](O)\C(Cl)=C\c1ccccc1 Amb27456661 [0,1,0,0,0,0|1,0,2]=4 951 B13R1.135 CC[C@H](O)\C(C)=C\c1ccccc1 Amb28281705 [0,1,0,0,0,0|1,0,2]=4 952 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,0|1,0,1]=3 953 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [0,1,0,0,0,0|2,0,0]=3 954 B13R1.135 CNC(=O)C(=O)Nc1ccccn1 Amb5485137 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.135 CNC(=O)C(Br)Cc1ccccc1 Amb27610156 [0,1,0,0,0,0|1,0,2]=4 956 B13R1.135 CNC(=O)C(C)Oc1ccccc1 Amb3886772 [0,1,0,0,0,0|2,0,1]=4 957 B13R1.135 CNC(=O)C(C)Sc1ccccc1 Amb8328078 [0,1,0,0,0,0|2,0,1]=4 958 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,0|1,0,2]=4 959 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb6279885 [0,1,0,0,0,0|1,0,2]=4 960 B13R1.135 CNC(=O)C(O)Cc1ccccc1 Amb27789590 [0,1,0,0,0,0|1,0,2]=4 961 B13R1.135 CNC(=O)C(S)Cc1ccccc1 Amb27207974 [0,1,0,0,0,0|1,0,2]=4 962 B13R1.135 CNC(=O)N(C)Cc1ccccc1 Amb27168216 [0,1,0,0,0,0|2,0,1]=4 963 B13R1.135 CNC(=O)N(C)Nc1ccccc1 Amb28340775 [0,1,0,0,0,0|3,0,0]=4 964 B13R1.135 CNC(=O)N(O)Cc1ccccc1 Amb28255708 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb10878601 [0,1,0,0,0,0|1,0,2]=4 966 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb15740701 [0,1,0,0,0,0|1,0,2]=4 967 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb10608885 [0,1,0,0,0,0|1,0,2]=4 968 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb33801562 [0,1,0,0,0,0|1,0,2]=4 969 B13R1.135 CNC(=O)\C(C)=C\c1ccccc1 Amb3447584 [0,1,0,0,0,0|1,0,0]=2 970 B13R1.135 CNC(C)\C(C)=C\c1ccccc1 Amb27610314 [0,1,0,0,0,0|2,0,1]=4 971 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,0|0,0,1]=2 972 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,0,0|1,0,1]=3 973 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,0,0|1,0,1]=3 974 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,0,0|1,0,1]=3 975 B13R1.135 COC(=O)C(=O)Nc1ccccn1 Amb2604638 [0,1,0,0,0,0|2,0,0]=3 976 B13R1.135 COC(=O)C(=O)Nc1cccnn1 Amb27963380 [0,1,0,0,0,0|3,0,0]=4 977 B13R1.135 COC(=O)C(=O)Nc1ccncc1 Amb27625625 [0,1,0,0,0,0|2,0,0]=3 978 B13R1.135 COC(=O)C(Br)Cc1ccccc1 Amb9758191 [0,1,0,0,0,0|0,0,2]=3 979 B13R1.135 COC(=O)C(C)Cc1ccccc1 Amb32412695 [0,1,0,0,0,0|0,0,2]=3 980 B13R1.135 COC(=O)C(C)Nc1ccccc1 Amb4137936 [0,1,0,0,0,0|1,0,1]=3 981 B13R1.135 COC(=O)C(C)Nc1cccnc1 Amb18270387 [0,1,0,0,0,0|2,0,1]=4 982 B13R1.135 COC(=O)C(C)Oc1ccccc1 Amb2780660 [0,1,0,0,0,0|1,0,1]=3 983 B13R1.135 COC(=O)C(Cl)Cc1ccccc1 Amb17204377 [0,1,0,0,0,0|0,0,2]=3 984 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb1779248 [0,1,0,0,0,0|0,0,2]=3 985 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,0|0,0,2]=3 986 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb6335185 [0,1,0,0,0,0|0,0,2]=3 987 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb30867720 [0,1,0,0,0,0|1,0,2]=4 988 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb32645721 [0,1,0,0,0,0|1,0,2]=4 989 B13R1.135 COC(=O)C(N)Cc1cccnc1 Amb33042860 [0,1,0,0,0,0|1,0,2]=4 990 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb28555952 [0,1,0,0,0,0|1,0,2]=4 991 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb33506229 [0,1,0,0,0,0|1,0,2]=4 992 B13R1.135 COC(=O)C(O)Cc1ccccc1 Amb17138951 [0,1,0,0,0,0|0,0,2]=3 993 B13R1.135 COC(=O)C(O)Cc1ccccn1 Amb17138998 [0,1,0,0,0,0|1,0,2]=4 994 B13R1.135 COC(=O)C(O)Cc1cccnc1 Amb17138999 [0,1,0,0,0,0|1,0,2]=4 995 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb17139000 [0,1,0,0,0,0|1,0,2]=4 996 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb32663204 [0,1,0,0,0,0|1,0,2]=4 997 B13R1.135 COC(=O)[C@@H](C)Nc1cccnc1 Amb27430339 [0,1,0,0,0,0|2,0,1]=4 998 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb533665 [0,1,0,0,0,0|0,0,2]=3 999 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb6364970 [0,1,0,0,0,0|0,0,2]=3 1000 B13R1.135 COC(=O)[C@@H](N)Cc1cccnc1 Amb22756662 [0,1,0,0,0,0|1,0,2]=4 1001 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 Amb5722454 [0,1,0,0,0,0|0,0,2]=3 1002 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb3939007 [0,1,0,0,0,0|0,0,2]=3 1003 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb8396272 [0,1,0,0,0,0|0,0,2]=3 1004 B13R1.135 COC(=O)[C@H](N)Cc1ccccn1 Amb30527042 [0,1,0,0,0,0|1,0,2]=4 1005 B13R1.135 COC(=O)[C@H](N)Cc1cccnc1 Amb15691971 [0,1,0,0,0,0|1,0,2]=4 1006 B13R1.135 COC(=O)[C@H](O)Cc1ccccc1 Amb8390894 [0,1,0,0,0,0|0,0,2]=3 1007 B13R1.135 COC(=O)\C(Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,0,0|0,0,0]=1 1008 B13R1.135 COC(=O)\C(C)=C\c1cncnc1 Amb27652628 [0,1,0,0,0,0|2,0,0]=3 1009 B13R1.135 CON(C)C(=O)Cc1ccccc1 Amb20673721 [0,1,0,0,0,0|2,0,1]=4 1010 B13R1.135 CON(C)C(=O)Nc1ccccc1 Amb22369280 [0,1,0,0,0,0|3,0,0]=4 1011 B13R1.135 CON(C)C(=S)Nc1ccccc1 Amb25338046 [0,1,0,0,0,0|3,0,0]=4 1012 B13R1.135 C\C(=C/c1ccccc1)C(=O)CCl Amb27657602 [0,1,0,0,0,0|2,0,0]=3 1013 B13R1.135 C\C(=C/c1ccccc1)C(=O)CN Amb33476121 [0,1,0,0,0,0|2,0,0]=3 1014 B13R1.135 C\C(=C/c1ccccc1)C(C)ON Amb33476456 [0,1,0,0,0,0|2,0,1]=4 1015 B13R1.135 C\C=C(\C)C(=O)Nc1ccccc1 Amb27604243 [0,1,0,0,0,0|3,0,0]=4 1016 B13R1.135 C\C=C(\C)C(=O)Oc1ccccc1 Amb28126464 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.135 NNC(=O)C(=O)Nc1ccccc1 Amb2420650 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.135 NNC(=O)\C(F)=C\c1ccccc1 Amb27833930 [0,1,0,0,0,0|2,0,0]=3 1019 B13R1.135 O=C(NO)C(=O)Nc1ccccc1 Amb27439064 [0,1,0,0,0,0|3,0,0]=4 1020 B13R1.254 CC(C)(\C=C\c1ccccc1)ON Amb33080789 [0,1,0,0,0,0|2,0,1]=4 1021 B13R1.254 CNC(C)(C)\C=C\c1ccccc1 Amb33081074 [0,1,0,0,0,0|2,0,1]=4 1022 B13R1.254 CNS(=O)(=O)\C=C\c1ccccc1 Amb404597 [0,1,0,0,0,0|2,0,0]=3 1023 B13R1.254 NNS(=O)(=O)\C=C\c1ccccc1 Amb9336864 [0,1,0,0,0,0|3,0,0]=4 1024 B13R1.351 C=C(C)C(=O)OCc1ccccc1 Amb10807491 [0,1,0,0,0,0|2,0,1]=4 1025 B13R1.351 C=C(\C=C\c1ccccc1)C(=O)O Amb33081816 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.351 C=C(\C=C\c1ccccc1)C(C)=O Amb27205181 [0,1,0,0,0,0|2,0,0]=3 1027 B13R1.351 C=C(\C=C\c1ccccc1)C(C)O Amb28064123 [0,1,0,0,0,0|2,0,0]=3 1028 B13R1.351 CC(=O)C(=O)NCc1ccccc1 Amb17400597 [0,1,0,0,0,0|2,0,1]=4 1029 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,1,0,0,0,0|2,0,1]=4 1030 B13R1.351 CC(=O)C(O)\C=C\c1ccccc1 Amb27861376 [0,1,0,0,0,0|1,0,2]=4 1031 B13R1.351 CC(=O)\C(C)=C/Nc1ccccc1 Amb17778142 [0,1,0,0,0,0|3,0,0]=4 1032 B13R1.351 CC(=O)\C(Cl)=C\Nc1ccccc1 Amb28290344 [0,1,0,0,0,0|3,0,0]=4 1033 B13R1.351 CC(Br)C(=O)C#Cc1ccccc1 Amb27980682 [0,1,0,0,0,0|1,0,2]=4 1034 B13R1.351 CC(Br)C(=O)NCc1ccccc1 Amb837025 [0,1,0,0,0,0|2,0,1]=4 1035 B13R1.351 CC(C)C(=O)C#Cc1ccccc1 Amb5399008 [0,1,0,0,0,0|1,0,2]=4 1036 B13R1.351 CC(C)C(=O)CCc1ccccc1 Amb33552878 [0,1,0,0,0,0|1,0,2]=4 1037 B13R1.351 CC(C)C(=O)CSc1ccccc1 Amb32941888 [0,1,0,0,0,0|2,0,1]=4 1038 B13R1.351 CC(C)C(=O)NCc1ccccc1 Amb1806323 [0,1,0,0,0,0|2,0,1]=4 1039 B13R1.351 CC(C)C(=O)NNc1ccccc1 Amb5718331 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.351 CC(C)C(=O)\C=C\c1ccncc1 Amb25294423 [0,1,0,0,0,0|2,0,0]=3 1041 B13R1.351 CC(C)C(Cl)\C=C\c1ccccc1 Amb27419922 [0,1,0,0,0,0|2,0,1]=4 1042 B13R1.351 CC(C)C(O)\C=C\c1ccccc1 Amb27405123 [0,1,0,0,0,0|1,0,2]=4 1043 B13R1.351 CC(C)S(=O)\N=C\c1ccccc1 Amb35681776 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.351 CC(Cl)C(=O)CCc1ccccc1 Amb33496212 [0,1,0,0,0,0|1,0,2]=4 1045 B13R1.351 CC(Cl)C(=O)NCc1ccccc1 Amb9723883 [0,1,0,0,0,0|2,0,1]=4 1046 B13R1.351 CC(Cl)C(=O)OCc1ccccc1 Amb27592133 [0,1,0,0,0,0|2,0,1]=4 1047 B13R1.351 CC(N)C(=O)C#Cc1ccccc1 Amb27862794 [0,1,0,0,0,0|1,0,2]=4 1048 B13R1.351 CC(N)C(=O)CCc1ccccc1 Amb32953323 [0,1,0,0,0,0|1,0,2]=4 1049 B13R1.351 CC(N)C(=O)NCc1ccccc1 Amb10610119 [0,1,0,0,0,0|2,0,1]=4 1050 B13R1.351 CC(N)C(=O)NCc1ccccc1 Amb6258226 [0,1,0,0,0,0|2,0,1]=4 1051 B13R1.351 CC(N)C(=O)NNc1ccccc1 Amb28454817 [0,1,0,0,0,0|3,0,0]=4 1052 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb17335303 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb22233549 [0,1,0,0,0,0|2,0,1]=4 1054 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb9825328 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.351 CC(N)C(=O)\C=C\c1ccccc1 Amb32953293 [0,1,0,0,0,0|1,0,0]=2 1056 B13R1.351 CC(O)C(=O)C#Cc1ccccc1 Amb27164720 [0,1,0,0,0,0|1,0,2]=4 1057 B13R1.351 CC(O)C(=O)NCc1ccccc1 Amb10766141 [0,1,0,0,0,0|2,0,1]=4 1058 B13R1.351 CC(O)C(=O)NNc1ccccc1 Amb27457677 [0,1,0,0,0,0|3,0,0]=4 1059 B13R1.351 CC(O)C(=O)OCc1ccccc1 Amb4021021 [0,1,0,0,0,0|2,0,1]=4 1060 B13R1.351 CC(O)C(C)\C=C\c1ccccc1 Amb32950466 [0,1,0,0,0,0|2,0,1]=4 1061 B13R1.351 CC(O)C(O)\C=C\c1ccccc1 Amb27206448 [0,1,0,0,0,0|1,0,2]=4 1062 B13R1.351 CC(S)C(=O)NCc1ccccc1 Amb27864076 [0,1,0,0,0,0|2,0,1]=4 1063 B13R1.351 CN(C)C(=O)C#Cc1ccccc1 Amb2106663 [0,1,0,0,0,0|1,0,2]=4 1064 B13R1.351 CN(C)C(=O)CNc1ccccc1 Amb6707007 [0,1,0,0,0,0|2,0,1]=4 1065 B13R1.351 CN(C)C(=O)NCc1ccccc1 Amb6428312 [0,1,0,0,0,0|2,0,1]=4 1066 B13R1.351 CN(C)C(=O)OCc1ccccc1 Amb26034973 [0,1,0,0,0,0|2,0,1]=4 1067 B13R1.351 CN(C)C(=O)\C=C\c1ccccc1 Amb2610528 [0,1,0,0,0,0|1,0,0]=2 1068 B13R1.351 CN(C)C(=O)\C=C\c1ccncc1 Amb27162427 [0,1,0,0,0,0|2,0,0]=3 1069 B13R1.351 CN(N)C(=O)OCc1ccccc1 Amb19959276 [0,1,0,0,0,0|2,0,1]=4 1070 B13R1.351 CN(O)C(=O)OCc1ccccc1 Amb27216384 [0,1,0,0,0,0|2,0,1]=4 1071 B13R1.351 C[C@@H](N)C(=O)C#Cc1ccccc1 Amb35738255 [0,1,0,0,0,0|1,0,2]=4 1072 B13R1.351 C[C@@H](N)C(=O)NCc1ccccc1 Amb18014651 [0,1,0,0,0,0|2,0,1]=4 1073 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb16183910 [0,1,0,0,0,0|2,0,1]=4 1074 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb2732392 [0,1,0,0,0,0|2,0,1]=4 1075 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb2732394 [0,1,0,0,0,0|2,0,1]=4 1076 B13R1.351 C[C@@H](N)[C@@H](O)\C=C\c1ccccc1 Amb25843898 [0,1,0,0,0,0|1,0,2]=4 1077 B13R1.351 C[C@@H](O)C(=O)OCc1ccccc1 Amb22801052 [0,1,0,0,0,0|2,0,1]=4 1078 B13R1.351 C[C@@H](O)[C@@H](N)\C=C\c1ccccc1 Amb27623283 [0,1,0,0,0,0|2,0,1]=4 1079 B13R1.351 C[C@@H](O)[C@H](C)\C=C\c1ccccc1 Amb28321539 [0,1,0,0,0,0|2,0,1]=4 1080 B13R1.351 C[C@H](N)C(=O)C#Cc1ccccc1 Amb30024790 [0,1,0,0,0,0|1,0,2]=4 1081 B13R1.351 C[C@H](N)C(=O)NCc1ccccc1 Amb5783207 [0,1,0,0,0,0|2,0,1]=4 1082 B13R1.351 C[C@H](N)C(=O)OCc1ccccc1 Amb2732393 [0,1,0,0,0,0|2,0,1]=4 1083 B13R1.351 C[C@H](N)C(=O)OCc1ccccc1 Amb8628594 [0,1,0,0,0,0|2,0,1]=4 1084 B13R1.351 C[C@H](N)[C@H](O)\C=C\c1ccccc1 Amb28367188 [0,1,0,0,0,0|1,0,2]=4 1085 B13R1.351 C[C@H](O)C(=O)OCc1ccccc1 Amb3939684 [0,1,0,0,0,0|2,0,1]=4 1086 B13R1.351 C[C@H](O)C(=O)\C=C\c1ccccc1 Amb27865928 [0,1,0,0,0,0|1,0,0]=2 1087 B13R1.351 C[C@H](O)[C@@H](C)\C=C\c1ccccc1 Amb28319963 [0,1,0,0,0,0|2,0,1]=4 1088 B13R1.351 C\C(=C/Sc1ccccc1)C(C)O Amb27653063 [0,1,0,0,0,0|3,0,0]=4 1089 B13R1.351 C\C(=C/Sc1ccccc1)[C@@H](C)O Amb27593921 [0,1,0,0,0,0|3,0,0]=4 1090 B13R1.351 O=C(O)C(=O)\C=C/c1ccccc1 Amb27628477 [0,1,0,0,0,0|2,0,0]=3 1091 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb16192457 [0,1,0,0,0,0|2,0,0]=3 1092 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb4477338 [0,1,0,0,0,0|2,0,0]=3 1093 B13R1.351 O=C(O)C(=O)\C=C\c1ccccn1 Amb17470558 [0,1,0,0,0,0|3,0,0]=4 1094 B13R1.351 O=C(O)C(=O)\C=C\c1cccnc1 Amb17470559 [0,1,0,0,0,0|3,0,0]=4 1095 B13R1.351 O=C(O)C(=O)\C=C\c1ccncc1 Amb17470560 [0,1,0,0,0,0|3,0,0]=4 1096 B13R1.351 O=C(\C=C\c1ccccc1)C(F)F Amb33081940 [0,1,0,0,0,0|2,0,0]=3 1097 B13R1.417 CC\C(C=O)=C/Nc1ccccc1 Amb18127492 [0,1,0,0,0,0|2,0,0]=3 1098 B13R1.417 CNC(C#N)\C=C\c1ccccc1 Amb27607690 [0,1,0,0,0,0|2,0,1]=4 1099 B13R1.417 CN\C(=C\Cc1ccccc1)OC Amb27947297 [0,1,0,0,0,0|1,0,1]=3 1100 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [0,1,0,0,0,0|0,0,2]=3 1101 B13R1.417 COC(\C=C\c1ccccc1)=C\Cl Amb27601252 [0,1,0,0,0,0|1,0,0]=2 1102 B13R1.417 C\N=C(/N=C/c1ccccc1)NC Amb27633166 [0,1,0,0,0,0|3,0,0]=4 1103 B13R1.417 O=CC(C=O)=CNc1ccccc1 Amb27393211 [0,1,0,0,0,0|3,0,0]=4 1104 B13R1.528 C=CC(=O)\C=C\c1ccccc1Br Amb33503232 [0,1,0,0,0,0|1,0,1]=3 1105 B13R1.528 C=CC(=O)\C=C\c1ccccc1C Amb33503233 [0,1,0,0,0,0|1,0,1]=3 1106 B13R1.528 C=CC(=O)\C=C\c1ccccc1Cl Amb33503120 [0,1,0,0,0,0|1,0,1]=3 1107 B13R1.528 C=CC(=O)\C=C\c1ccccc1F Amb33503119 [0,1,0,0,0,0|1,0,1]=3 1108 B13R1.528 CCC(=O)CCc1ccccc1C Amb9031664 [0,1,0,0,0,0|1,0,2]=4 1109 B13R1.528 CCC(=O)CCc1ccccc1Cl Amb9031682 [0,1,0,0,0,0|1,0,2]=4 1110 B13R1.528 CCC(=O)CCc1ccccc1F Amb9031685 [0,1,0,0,0,0|1,0,2]=4 1111 B13R1.528 CCC(=O)CSc1ccccc1Br Amb32682962 [0,1,0,0,0,0|2,0,1]=4 1112 B13R1.528 CCC(=O)CSc1ccccc1C Amb19080442 [0,1,0,0,0,0|2,0,1]=4 1113 B13R1.528 CCC(=O)CSc1ccccc1Cl Amb32682965 [0,1,0,0,0,0|2,0,1]=4 1114 B13R1.528 CCC(=O)CSc1ccccc1F Amb18331047 [0,1,0,0,0,0|2,0,1]=4 1115 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [0,1,0,0,0,0|2,0,1]=4 1116 B13R1.528 CCC(=O)NCc1ccccc1Cl Amb3094830 [0,1,0,0,0,0|2,0,1]=4 1117 B13R1.528 CCC(=O)NCc1ccccc1F Amb2020111 [0,1,0,0,0,0|2,0,1]=4 1118 B13R1.528 CCC(=O)NCc1ccccc1O Amb27173716 [0,1,0,0,0,0|2,0,1]=4 1119 B13R1.528 CCC(=O)NNc1ccccc1C Amb28398861 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.528 CCC(=O)NNc1ccccc1N Amb18128462 [0,1,0,0,0,0|3,0,0]=4 1121 B13R1.528 CCS(=O)\N=C\c1ccccc1Br Amb35685224 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.528 CCS(=O)\N=C\c1ccccc1C Amb35726858 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.528 CCS(=O)\N=C\c1ccccc1Cl Amb35726552 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.528 CCS(=O)\N=C\c1ccccc1F Amb35726879 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.528 CCS(=O)\N=C\c1ccccc1O Amb35726564 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.528 CNC(=O)C#Cc1ccccc1C Amb27828015 [0,1,0,0,0,0|1,0,2]=4 1127 B13R1.528 CNC(=O)CCc1ccccc1Cl Amb13957943 [0,1,0,0,0,0|1,0,2]=4 1128 B13R1.528 CNC(=O)CCc1ccccc1N Amb8941577 [0,1,0,0,0,0|1,0,2]=4 1129 B13R1.528 CNC(=O)CCc1ccccc1O Amb8333456 [0,1,0,0,0,0|1,0,2]=4 1130 B13R1.528 CNC(=O)CNc1ccccc1C Amb6714259 [0,1,0,0,0,0|2,0,1]=4 1131 B13R1.528 CNC(=O)COc1ccccc1Br Amb1174422 [0,1,0,0,0,0|2,0,1]=4 1132 B13R1.528 CNC(=O)COc1ccccc1Cl Amb8340723 [0,1,0,0,0,0|2,0,1]=4 1133 B13R1.528 CNC(=O)COc1ccccc1N Amb1121495 [0,1,0,0,0,0|2,0,1]=4 1134 B13R1.528 CNC(=O)COc1ccccc1O Amb1199497 [0,1,0,0,0,0|2,0,1]=4 1135 B13R1.528 CNC(=O)CSc1ccccc1C Amb27458330 [0,1,0,0,0,0|2,0,1]=4 1136 B13R1.528 CNC(=O)CSc1ccccc1Cl Amb8246920 [0,1,0,0,0,0|2,0,1]=4 1137 B13R1.528 CNC(=O)CSc1ccccc1F Amb8341742 [0,1,0,0,0,0|2,0,1]=4 1138 B13R1.528 CNC(=O)CSc1ccccc1N Amb6270099 [0,1,0,0,0,0|2,0,1]=4 1139 B13R1.528 CNC(=O)NCc1ccccc1C Amb27949555 [0,1,0,0,0,0|2,0,1]=4 1140 B13R1.528 CNC(=O)NCc1ccccc1Cl Amb2132766 [0,1,0,0,0,0|2,0,1]=4 1141 B13R1.528 CNC(=O)NCc1ccccc1F Amb22584226 [0,1,0,0,0,0|2,0,1]=4 1142 B13R1.528 CNC(=O)NNc1ccccc1C Amb26043673 [0,1,0,0,0,0|3,0,0]=4 1143 B13R1.528 CNC(=O)NNc1ccccc1F Amb25761192 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.528 CNC(=O)\C=C\c1ccccc1Cl Amb3701970 [0,1,0,0,0,0|1,0,0]=2 1145 B13R1.528 CNC(=O)\C=C\c1ccccc1F Amb28249907 [0,1,0,0,0,0|1,0,0]=2 1146 B13R1.528 COC(=N)CCc1ccccc1Br Amb18071214 [0,1,0,0,0,0|1,0,2]=4 1147 B13R1.528 COC(=N)CCc1ccccc1C Amb18065690 [0,1,0,0,0,0|1,0,2]=4 1148 B13R1.528 COC(=N)CCc1ccccc1Cl Amb18066439 [0,1,0,0,0,0|1,0,2]=4 1149 B13R1.528 COC(=N)CCc1ccccc1F Amb18066000 [0,1,0,0,0,0|1,0,2]=4 1150 B13R1.528 COC(=N)COc1ccccc1Br Amb18577242 [0,1,0,0,0,0|2,0,1]=4 1151 B13R1.528 COC(=N)COc1ccccc1C Amb18065837 [0,1,0,0,0,0|2,0,1]=4 1152 B13R1.528 COC(=N)COc1ccccc1Cl Amb18066507 [0,1,0,0,0,0|2,0,1]=4 1153 B13R1.528 COC(=N)COc1ccccc1F Amb18066092 [0,1,0,0,0,0|2,0,1]=4 1154 B13R1.528 COC(=O)C#Cc1ccccc1C Amb26396263 [0,1,0,0,0,0|0,0,2]=3 1155 B13R1.528 COC(=O)C#Cc1ccccc1Cl Amb2610345 [0,1,0,0,0,0|0,0,2]=3 1156 B13R1.528 COC(=O)C#Cc1ccccc1F Amb28120540 [0,1,0,0,0,0|0,0,2]=3 1157 B13R1.528 COC(=O)C#Cc1ccccc1N Amb27179206 [0,1,0,0,0,0|0,0,2]=3 1158 B13R1.528 COC(=O)C#Cc1ccccc1O Amb27859426 [0,1,0,0,0,0|0,0,2]=3 1159 B13R1.528 COC(=O)C#Cc1cccnc1O Amb27592401 [0,1,0,0,0,0|1,0,2]=4 1160 B13R1.528 COC(=O)C#Cc1ccncc1C Amb27759678 [0,1,0,0,0,0|1,0,2]=4 1161 B13R1.528 COC(=O)C#Cc1ccncc1F Amb27863034 [0,1,0,0,0,0|1,0,2]=4 1162 B13R1.528 COC(=O)C#Cc1ncccc1Br Amb27164746 [0,1,0,0,0,0|1,0,2]=4 1163 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [0,1,0,0,0,0|0,0,2]=3 1164 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [0,1,0,0,0,0|0,0,2]=3 1165 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [0,1,0,0,0,0|0,0,2]=3 1166 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [0,1,0,0,0,0|0,0,2]=3 1167 B13R1.528 COC(=O)CCc1ccccc1N Amb33803798 [0,1,0,0,0,0|0,0,2]=3 1168 B13R1.528 COC(=O)CCc1ccccc1O Amb2722678 [0,1,0,0,0,0|0,0,2]=3 1169 B13R1.528 COC(=O)CNc1ccccc1C Amb33527060 [0,1,0,0,0,0|1,0,1]=3 1170 B13R1.528 COC(=O)CNc1ccccc1Cl Amb6712398 [0,1,0,0,0,0|1,0,1]=3 1171 B13R1.528 COC(=O)CNc1ccccc1F Amb6712588 [0,1,0,0,0,0|1,0,1]=3 1172 B13R1.528 COC(=O)CNc1ccccc1N Amb7767918 [0,1,0,0,0,0|1,0,1]=3 1173 B13R1.528 COC(=O)CNc1cccnc1Cl Amb27814365 [0,1,0,0,0,0|2,0,1]=4 1174 B13R1.528 COC(=O)CNc1ccncc1F Amb35655199 [0,1,0,0,0,0|2,0,1]=4 1175 B13R1.528 COC(=O)CNc1ncccc1Br Amb27414522 [0,1,0,0,0,0|2,0,1]=4 1176 B13R1.528 COC(=O)CNc1ncccc1C Amb18809312 [0,1,0,0,0,0|2,0,1]=4 1177 B13R1.528 COC(=O)CNc1ncccc1N Amb7767913 [0,1,0,0,0,0|2,0,1]=4 1178 B13R1.528 COC(=O)COc1ccccc1Br Amb844184 [0,1,0,0,0,0|1,0,1]=3 1179 B13R1.528 COC(=O)COc1ccccc1C Amb844175 [0,1,0,0,0,0|1,0,1]=3 1180 B13R1.528 COC(=O)COc1ccccc1Cl Amb844182 [0,1,0,0,0,0|1,0,1]=3 1181 B13R1.528 COC(=O)COc1ccccc1F Amb7753081 [0,1,0,0,0,0|1,0,1]=3 1182 B13R1.528 COC(=O)COc1cccnc1N Amb9208372 [0,1,0,0,0,0|2,0,1]=4 1183 B13R1.528 COC(=O)COc1ncccc1O Amb24095895 [0,1,0,0,0,0|2,0,1]=4 1184 B13R1.528 COC(=O)CSc1ccccc1O Amb19044958 [0,1,0,0,0,0|1,0,1]=3 1185 B13R1.528 COC(=O)CSc1ncccc1O Amb24095896 [0,1,0,0,0,0|2,0,1]=4 1186 B13R1.528 COC(=O)NCc1ccccc1C Amb27854441 [0,1,0,0,0,0|1,0,1]=3 1187 B13R1.528 COC(=O)NCc1ccccc1Cl Amb22469956 [0,1,0,0,0,0|1,0,1]=3 1188 B13R1.528 COC(=O)NCc1ccccc1O Amb8390014 [0,1,0,0,0,0|1,0,1]=3 1189 B13R1.528 COC(=O)NCc1ccncc1C Amb28381085 [0,1,0,0,0,0|2,0,1]=4 1190 B13R1.528 COC(=O)NCc1cnccc1C Amb28249706 [0,1,0,0,0,0|2,0,1]=4 1191 B13R1.528 COC(=O)NCc1ncccc1C Amb27854091 [0,1,0,0,0,0|2,0,1]=4 1192 B13R1.528 COC(=O)NCc1ncccc1F Amb27977571 [0,1,0,0,0,0|2,0,1]=4 1193 B13R1.528 COC(=O)NCc1ncccc1O Amb28283614 [0,1,0,0,0,0|2,0,1]=4 1194 B13R1.528 COC(=O)\C=C\c1ccccc1Br Amb34002036 [0,1,0,0,0,0|0,0,0]=1 1195 B13R1.528 COC(=O)\C=C\c1ccccc1C Amb26325862 [0,1,0,0,0,0|0,0,0]=1 1196 B13R1.528 COC(=O)\C=C\c1ccccc1Cl Amb10808396 [0,1,0,0,0,0|0,0,0]=1 1197 B13R1.528 COC(=O)\C=C\c1ccccc1F Amb2432760 [0,1,0,0,0,0|0,0,0]=1 1198 B13R1.528 COC(=O)\C=C\c1ccccc1N Amb18127873 [0,1,0,0,0,0|0,0,0]=1 1199 B13R1.528 COC(=O)\C=C\c1cccnc1Br Amb22584147 [0,1,0,0,0,0|1,0,0]=2 1200 B13R1.528 COC(=O)\C=C\c1cccnc1N Amb4560893 [0,1,0,0,0,0|1,0,0]=2 1201 B13R1.528 COC(=O)\C=C\c1ccncc1F Amb24623916 [0,1,0,0,0,0|1,0,0]=2 1202 B13R1.528 COC(=O)\C=C\c1cnccc1Cl Amb13890041 [0,1,0,0,0,0|1,0,0]=2 1203 B13R1.528 COC(=O)\C=C\c1cnccc1N Amb4560910 [0,1,0,0,0,0|1,0,0]=2 1204 B13R1.528 COC(=O)\C=C\c1ncccc1C Amb28185662 [0,1,0,0,0,0|1,0,0]=2 1205 B13R1.528 COC(=O)\C=C\c1ncccc1F Amb33469154 [0,1,0,0,0,0|1,0,0]=2 1206 B13R1.528 COC(=O)\C=C\c1nccnc1C Amb35600947 [0,1,0,0,0,0|2,0,0]=3 1207 B13R1.528 COC(O)\C=C\c1ccccc1S Amb27206105 [0,1,0,0,0,0|0,0,2]=3 1208 B13R1.528 Cc1ccccc1\C=C\C(=N)NO Amb24656007 [0,1,0,0,0,0|3,0,0]=4 1209 B13R1.528 N=C(\C=C\c1ccccc1F)NO Amb27204805 [0,1,0,0,0,0|3,0,0]=4 1210 B13R1.528 NC(\C=C\c1ccccc1Cl)=N\O Amb28385568 [0,1,0,0,0,0|3,0,0]=4 1211 B13R1.528 NNC(=O)\C=C\c1ccccc1Br Amb8998118 [0,1,0,0,0,0|2,0,0]=3 1212 B13R1.528 O=C(\C=C\c1ccccc1Cl)NO Amb28369653 [0,1,0,0,0,0|2,0,0]=3 1213 B13R2.10 Brc1cc(-c2ccccc2)co1 Amb10600637 [0,0,0,1,0,0|1,0,1]=3 1214 B13R2.10 Brc1cc(-c2ccccc2)cs1 Amb2642792 [0,0,0,1,0,0|1,1,1]=4 1215 B13R2.10 Brc1cc(-c2ccccc2)no1 Amb22491894 [0,0,0,1,0,0|2,0,0]=3 1216 B13R2.10 Brc1cc(-c2ccccc2)on1 Amb21856489 [0,0,0,1,0,0|3,0,0]=4 1217 B13R2.10 Brc1cc(-c2ccccc2)sn1 Amb27631528 [0,0,0,1,0,0|3,0,0]=4 1218 B13R2.10 Brc1cc(-c2ccncc2)no1 Amb27268316 [0,0,0,1,0,0|3,0,0]=4 1219 B13R2.10 Brc1nc(-c2ccccc2)co1 Amb28400187 [0,0,0,1,0,0|2,0,1]=4 1220 B13R2.10 Brc1nc(-c2ccccc2)no1 Amb22304287 [0,0,0,1,0,0|3,0,0]=4 1221 B13R2.10 Cc1cc(-c2ccccc2)no1 Amb10553849 [0,0,0,1,0,0|2,0,0]=3 1222 B13R2.10 Cc1cc(-c2ccccc2)on1 Amb1893875 [0,0,0,1,0,0|3,0,0]=4 1223 B13R2.10 Cc1cc(-c2ccccc2)sn1 Amb24410959 [0,0,0,1,0,0|3,0,0]=4 1224 B13R2.10 Cc1cc(-c2ccccn2)no1 Amb24101122 [0,0,0,1,0,0|3,0,0]=4 1225 B13R2.10 Cc1csc(-c2ccccc2)c1 Amb2778539 [0,0,0,1,0,0|3,0,0]=4 1226 B13R2.10 Cc1nc(-c2ccccc2)co1 Amb17400054 [0,0,0,1,0,0|2,0,1]=4 1227 B13R2.10 Cc1nc(-c2ccccc2)no1 Amb2766523 [0,0,0,1,0,0|3,0,0]=4 1228 B13R2.10 Clc1cc(-c2ccccc2)no1 Amb2615454 [0,0,0,1,0,0|2,0,0]=3 1229 B13R2.10 Clc1cc(-c2ccccc2)on1 Amb534686 [0,0,0,1,0,0|3,0,0]=4 1230 B13R2.10 Clc1cc(-c2ccccc2)sn1 Amb27200611 [0,0,0,1,0,0|3,0,0]=4 1231 B13R2.10 Clc1coc(-c2ccccc2)c1 Amb28401506 [0,0,0,1,0,0|3,0,0]=4 1232 B13R2.10 Clc1nc(-c2ccccc2)no1 Amb6892636 [0,0,0,1,0,0|3,0,0]=4 1233 B13R2.10 Ic1cc(-c2ccccc2)on1 Amb27478674 [0,0,0,1,0,0|3,0,0]=4 1234 B13R2.10 Ic1nc(-c2ccccc2)co1 Amb25095972 [0,0,0,1,0,0|2,0,1]=4 1235 B13R2.10 N=C1N[C@@H](c2ccccc2)CO1 Amb25326051 [0,0,0,1,0,0|2,0,1]=4 1236 B13R2.10 NC1=CC(c2ccccc2)=CC1 Amb27179592 [0,0,0,1,0,0|2,0,1]=4 1237 B13R2.10 NC1=CN(c2ccccc2)CC1 Amb3986221 [0,0,0,1,0,0|3,0,0]=4 1238 B13R2.10 NC1=NC(c2ccccc2)CO1 Amb33548336 [0,0,0,1,0,0|2,0,1]=4 1239 B13R2.10 NC1=N[C@H](c2ccccc2)CO1 Amb26946059 [0,0,0,1,0,0|2,0,1]=4 1240 B13R2.10 NC1C=C(c2ccccc2)CC1 Amb27642483 [0,0,0,1,0,0|2,0,1]=4 1241 B13R2.10 Nc1cc(-c2ccccc2)co1 Amb10600638 [0,0,0,1,0,0|1,0,1]=3 1242 B13R2.10 Nc1cc(-c2ccccc2)cs1 Amb10600636 [0,0,0,1,0,0|1,1,1]=4 1243 B13R2.10 Nc1cc(-c2ccccc2)no1 Amb1156941 [0,0,0,1,0,0|2,0,0]=3 1244 B13R2.10 Nc1cc(-c2ccccc2)ns1 Amb18647982 [0,0,0,1,0,0|2,1,0]=4 1245 B13R2.10 Nc1cc(-c2ccccc2)on1 Amb10553656 [0,0,0,1,0,0|3,0,0]=4 1246 B13R2.10 Nc1cc(-c2ccccc2)sn1 Amb28397257 [0,0,0,1,0,0|3,0,0]=4 1247 B13R2.10 Nc1cc(-c2ccccn2)no1 Amb18948476 [0,0,0,1,0,0|3,0,0]=4 1248 B13R2.10 Nc1cc(-c2cccnc2)no1 Amb33528628 [0,0,0,1,0,0|3,0,0]=4 1249 B13R2.10 Nc1cc(-c2ccncc2)no1 Amb33528623 [0,0,0,1,0,0|3,0,0]=4 1250 B13R2.10 Nc1nc(-c2ccccc2)co1 Amb33529509 [0,0,0,1,0,0|2,0,1]=4 1251 B13R2.10 Nc1nc(-c2ccccc2)no1 Amb6439807 [0,0,0,1,0,0|3,0,0]=4 1252 B13R2.10 O=C1C=C(c2ccccc2)CC1 Amb10669546 [0,0,0,1,0,0|1,0,0]=2 1253 B13R2.10 O=C1C=C(c2ccccc2)CN1 Amb25881513 [0,0,0,1,0,0|1,0,0]=2 1254 B13R2.10 O=C1C=C(c2ccccc2)CO1 Amb24633865 [0,0,0,1,0,0|0,0,0]=1 1255 B13R2.10 O=C1C=C(c2ccccc2)NN1 Amb18800327 [0,0,0,1,0,0|2,0,0]=3 1256 B13R2.10 O=C1C=C(c2ccccc2)SC1 Amb27164569 [0,0,0,1,0,0|2,0,0]=3 1257 B13R2.10 O=C1C=C(c2ccccc2)SS1 Amb19517525 [0,0,0,1,0,0|1,1,0]=3 1258 B13R2.10 O=C1C=C(c2ccccn2)CC1 Amb17138484 [0,0,0,1,0,0|2,0,0]=3 1259 B13R2.10 O=C1C=C(c2ccccn2)CS1 Amb2611798 [0,0,0,1,0,0|1,1,0]=3 1260 B13R2.10 O=C1C=C(c2ccccn2)ON1 Amb26846535 [0,0,0,1,0,0|3,0,0]=4 1261 B13R2.10 O=C1C=C(c2cccnc2)CC1 Amb17138485 [0,0,0,1,0,0|2,0,0]=3 1262 B13R2.10 O=C1C=C(c2ccncc2)CC1 Amb17138486 [0,0,0,1,0,0|2,0,0]=3 1263 B13R2.10 O=C1C=C(c2cnccn2)CC1 Amb27438419 [0,0,0,1,0,0|3,0,0]=4 1264 B13R2.10 O=C1C=[N+](c2ccccc2)[N-]O1 Amb21934019 [0,0,0,1,0,0|2,0,0]=3 1265 B13R2.10 O=C1CC(c2ccccc2)=NN1 Amb2731501 [0,0,0,1,0,0|2,0,1]=4 1266 B13R2.10 O=C1CC(c2ccccc2)=NO1 Amb622006 [0,0,0,1,0,0|1,0,1]=3 1267 B13R2.10 O=C1CC(c2ccccc2)CN1 Amb1772919 [0,0,0,1,0,0|1,0,2]=4 1268 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [0,0,0,1,0,0|0,0,2]=3 1269 B13R2.10 O=C1CC(c2ccccn2)=NO1 Amb26512125 [0,0,0,1,0,0|2,0,1]=4 1270 B13R2.10 O=C1CC(c2cccnc2)=NO1 Amb22496083 [0,0,0,1,0,0|2,0,1]=4 1271 B13R2.10 O=C1CC(c2ccncc2)=NO1 Amb2405318 [0,0,0,1,0,0|2,0,1]=4 1272 B13R2.10 O=C1CCC(c2ccccc2)C1 Amb17138497 [0,0,0,1,0,0|1,0,2]=4 1273 B13R2.10 O=C1CCC(c2ccccc2)N1 Amb17470413 [0,0,0,1,0,0|2,0,1]=4 1274 B13R2.10 O=C1CCC(c2ccccc2)O1 Amb4393092 [0,0,0,1,0,0|2,0,1]=4 1275 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb32410134 [0,0,0,1,0,0|2,0,1]=4 1276 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb33528256 [0,0,0,1,0,0|2,0,1]=4 1277 B13R2.10 O=C1CCN(c2ccccc2)N1 Amb6315525 [0,0,0,1,0,0|3,0,0]=4 1278 B13R2.10 O=C1CC[C@@H](c2ccccc2)C1 Amb24323281 [0,0,0,1,0,0|1,0,2]=4 1279 B13R2.10 O=C1CC[C@@H](c2ccccc2)N1 Amb27242426 [0,0,0,1,0,0|2,0,1]=4 1280 B13R2.10 O=C1CC[C@H](c2ccccc2)C1 Amb24484347 [0,0,0,1,0,0|1,0,2]=4 1281 B13R2.10 O=C1CC[C@H](c2ccccc2)N1 Amb27227911 [0,0,0,1,0,0|2,0,1]=4 1282 B13R2.10 O=C1CC[C@H](c2ccccc2)O1 Amb28437127 [0,0,0,1,0,0|2,0,1]=4 1283 B13R2.10 O=C1CN=C(c2ccccc2)N1 Amb17842816 [0,0,0,1,0,0|3,0,0]=4 1284 B13R2.10 O=C1CN=C(c2ccccc2)O1 Amb3987291 [0,0,0,1,0,0|3,0,0]=4 1285 B13R2.10 O=C1COC(c2ccccc2)=N1 Amb27606825 [0,0,0,1,0,0|3,0,0]=4 1286 B13R2.10 O=C1CSC(c2ccccc2)=N1 Amb16231550 [0,0,0,1,0,0|3,0,0]=4 1287 B13R2.10 O=C1CSC(c2ccccc2)=N1 Amb2384341 [0,0,0,1,0,0|3,0,0]=4 1288 B13R2.10 O=C1C[C@@H](c2ccccc2)CN1 Amb25277165 [0,0,0,1,0,0|1,0,2]=4 1289 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [0,0,0,1,0,0|0,0,2]=3 1290 B13R2.10 O=C1C[C@H](c2ccccc2)CN1 Amb23401452 [0,0,0,1,0,0|1,0,2]=4 1291 B13R2.10 O=C1N=C(c2ccccc2)NN1 Amb22520685 [0,0,0,1,0,0|3,0,0]=4 1292 B13R2.10 O=C1N=C(c2ccccc2)ON1 Amb26446802 [0,0,0,1,0,0|3,0,0]=4 1293 B13R2.10 O=C1N=C(c2ccccc2)SS1 Amb24467190 [0,0,0,1,0,0|2,1,0]=4 1294 B13R2.10 O=C1NC(c2ccccc2)=CS1 Amb18808971 [0,0,0,1,0,0|1,1,1]=4 1295 B13R2.10 O=C1NC(c2ccccc2)=NO1 Amb18788105 [0,0,0,1,0,0|2,0,0]=3 1296 B13R2.10 O=C1NC(c2ccccc2)=NS1 Amb22432316 [0,0,0,1,0,0|2,1,0]=4 1297 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [0,0,0,1,0,0|1,0,1]=3 1298 B13R2.10 O=C1NC(c2ccccc2)CS1 Amb23439132 [0,0,0,1,0,0|1,1,1]=4 1299 B13R2.10 O=C1NC(c2ccccn2)=NO1 Amb19372943 [0,0,0,1,0,0|3,0,0]=4 1300 B13R2.10 O=C1NC(c2ccccn2)CO1 Amb27828129 [0,0,0,1,0,0|2,0,1]=4 1301 B13R2.10 O=C1NC(c2cccnc2)=NO1 Amb19514618 [0,0,0,1,0,0|3,0,0]=4 1302 B13R2.10 O=C1NC(c2cccnc2)CO1 Amb26970930 [0,0,0,1,0,0|2,0,1]=4 1303 B13R2.10 O=C1NC(c2ccncc2)=NO1 Amb19514619 [0,0,0,1,0,0|3,0,0]=4 1304 B13R2.10 O=C1NC(c2ccncc2)CO1 Amb26484901 [0,0,0,1,0,0|2,0,1]=4 1305 B13R2.10 O=C1NC=C(c2ccccc2)N1 Amb19516863 [0,0,0,1,0,0|2,0,1]=4 1306 B13R2.10 O=C1NC=C(c2ccccc2)S1 Amb18808972 [0,0,0,1,0,0|2,0,1]=4 1307 B13R2.10 O=C1NCC(c2ccccc2)N1 Amb22056050 [0,0,0,1,0,0|2,0,1]=4 1308 B13R2.10 O=C1NCC(c2ccccc2)O1 Amb16232576 [0,0,0,1,0,0|2,0,1]=4 1309 B13R2.10 O=C1NCC(c2ccccc2)S1 Amb27614799 [0,0,0,1,0,0|2,0,1]=4 1310 B13R2.10 O=C1NC[C@@H](c2ccccc2)O1 Amb24574681 [0,0,0,1,0,0|2,0,1]=4 1311 B13R2.10 O=C1NN=C(c2ccccc2)O1 Amb19654483 [0,0,0,1,0,0|3,0,0]=4 1312 B13R2.10 O=C1NN=C(c2ccccc2)S1 Amb27225981 [0,0,0,1,0,0|3,0,0]=4 1313 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [0,0,0,1,0,0|1,0,1]=3 1314 B13R2.10 O=C1N[C@@H](c2ccccc2)CS1 Amb28143674 [0,0,0,1,0,0|1,1,1]=4 1315 B13R2.10 O=C1N[C@@H](c2ccccn2)CO1 Amb27783384 [0,0,0,1,0,0|2,0,1]=4 1316 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [0,0,0,1,0,0|1,0,1]=3 1317 B13R2.10 O=C1N[C@H](c2ccccc2)CS1 Amb24653499 [0,0,0,1,0,0|1,1,1]=4 1318 B13R2.10 O=C1N[C@H](c2cccnc2)CO1 Amb27389439 [0,0,0,1,0,0|2,0,1]=4 1319 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [0,0,0,1,0,0|1,0,1]=3 1320 B13R2.10 O=C1SC=C(c2ccccc2)S1 Amb21993101 [0,0,0,1,0,0|1,1,1]=4 1321 B13R2.10 Oc1cc(-c2ccccc2)cs1 Amb20617906 [0,0,0,1,0,0|0,1,2]=4 1322 B13R2.10 Oc1cc(-c2ccccc2)no1 Amb6889229 [0,0,0,1,0,0|1,0,1]=3 1323 B13R2.10 Oc1cc(-c2ccccc2)on1 Amb10553149 [0,0,0,1,0,0|2,0,1]=4 1324 B13R2.10 Oc1cc(-c2ccccn2)no1 Amb25124398 [0,0,0,1,0,0|2,0,1]=4 1325 B13R2.10 Oc1cc(-c2cccnc2)no1 Amb20672881 [0,0,0,1,0,0|2,0,1]=4 1326 B13R2.10 Oc1cc(-c2ccncc2)no1 Amb20672935 [0,0,0,1,0,0|2,0,1]=4 1327 B13R2.10 Oc1nc(-c2ccccc2)co1 Amb22370821 [0,0,0,1,0,0|1,0,2]=4 1328 B13R2.10 Oc1nc(-c2ccccc2)no1 Amb19651317 [0,0,0,1,0,0|2,0,1]=4 1329 B13R2.10 S=C1C=C(c2ccccc2)SS1 Amb19705248 [0,0,0,1,0,0|1,2,0]=4 1330 B13R2.10 S=C1NC(c2ccccc2)=NO1 Amb22343187 [0,0,0,1,0,0|2,1,0]=4 1331 B13R2.10 S=C1NC(c2ccccc2)CO1 Amb26880718 [0,0,0,1,0,0|1,1,1]=4 1332 B13R2.10 Sc1nc(-c2ccccc2)co1 Amb19943960 [0,0,0,1,0,0|1,1,1]=4 1333 B13R2.10 Sc1nc(-c2ccccc2)no1 Amb18790934 [0,0,0,1,0,0|2,1,0]=4 1334 B13R2.10 [O-][n+]1cc(-c2ccccc2)no1 Amb2369020 [0,0,0,1,0,0|2,0,1]=4 1335 B13R2.17 CC1OC1\C=C\c2ccccc2 Amb25328517 [0,0,0,1,0,0|1,0,2]=4 1336 B13R2.27 O=C1CCC1Cc2ccccc2 Amb27177755 [0,0,0,1,0,0|1,0,2]=4 1337 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [0,0,0,1,0,0|2,0,1]=4 1338 B13R2.27 O=C1CC\C1=C/c2ccccc2 Amb25366584 [0,0,0,1,0,0|1,0,0]=2 1339 B13R2.27 O=C1CS\C1=C\c2ccccc2 Amb17594489 [0,0,0,1,0,0|2,0,0]=3 1340 B13R2.27 O=C1NCC1Cc2ccccc2 Amb27855620 [0,0,0,1,0,0|1,0,2]=4 1341 B13R2.32 Brc1ccc2ccccc2c1I Amb24594397 [0,0,0,1,0,0|3,0,0]=4 1342 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [0,0,0,1,0,0|1,0,1]=3 1343 B13R2.32 C=C1C=Cc2ccccc2N1C Amb25918137 [0,0,0,1,0,0|2,0,0]=3 1344 B13R2.32 CC1=C2C=CC=CC2=CNC1=O Amb27857230 [0,0,0,1,0,0|2,0,0]=3 1345 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [0,0,0,1,0,0|1,0,2]=4 1346 B13R2.32 CN1C(=O)C=Cc2ccccc21 Amb19116112 [0,0,0,1,0,0|1,0,0]=2 1347 B13R2.32 CN1C(=O)C=Cc2cccnc21 Amb28365713 [0,0,0,1,0,0|2,0,0]=3 1348 B13R2.32 CN1C(=O)C=Cc2cnccc21 Amb22491898 [0,0,0,1,0,0|2,0,0]=3 1349 B13R2.32 CN1C(=O)C=Cc2ncccc21 Amb28254581 [0,0,0,1,0,0|2,0,0]=3 1350 B13R2.32 CN1C(=O)CCc2ccccc21 Amb17322846 [0,0,0,1,0,0|1,0,2]=4 1351 B13R2.32 CN1C(=O)CNc2ccccc21 Amb8471882 [0,0,0,1,0,0|2,0,1]=4 1352 B13R2.32 CN1C(=O)COc2ccccc21 Amb1351378 [0,0,0,1,0,0|2,0,1]=4 1353 B13R2.32 CN1C(=O)CSc2ccccc21 Amb3484441 [0,0,0,1,0,0|2,0,1]=4 1354 B13R2.32 CN1C(=O)NCc2ccccc21 Amb28243973 [0,0,0,1,0,0|2,0,1]=4 1355 B13R2.32 CN1C(=S)C=Cc2ccccc21 Amb19651670 [0,0,0,1,0,0|1,1,0]=3 1356 B13R2.32 CN1c2ccccc2C=CC1O Amb27484700 [0,0,0,1,0,0|1,0,2]=4 1357 B13R2.32 C[n+]1c(I)ccc2ccccc21 Amb348184 [0,0,0,1,0,0|2,0,0]=3 1358 B13R2.32 C[n+]1c(N)ccc2ccccc21 Amb2609713 [0,0,0,1,0,0|2,0,0]=3 1359 B13R2.32 Cc1c(Br)ccc2ccccc12 Amb21929204 [0,0,0,1,0,0|2,0,0]=3 1360 B13R2.32 Cc1c(Br)ccc2cccnc12 Amb19895195 [0,0,0,1,0,0|3,0,0]=4 1361 B13R2.32 Cc1c(Br)ccc2ncccc12 Amb27230462 [0,0,0,1,0,0|3,0,0]=4 1362 B13R2.32 Cc1c(Br)cnc2ccccc12 Amb22263020 [0,0,0,1,0,0|3,0,0]=4 1363 B13R2.32 Cc1c(Cl)ccc2ccccc12 Amb26843093 [0,0,0,1,0,0|2,0,0]=3 1364 B13R2.32 Cc1c(Cl)ccc2cccnc12 Amb10607058 [0,0,0,1,0,0|3,0,0]=4 1365 B13R2.32 Cc1c(F)ccc2ccccc12 Amb26880002 [0,0,0,1,0,0|2,0,0]=3 1366 B13R2.32 Cc1c(F)ccc2cccnc12 Amb24454469 [0,0,0,1,0,0|3,0,0]=4 1367 B13R2.32 Cc1c(F)cnc2ccccc12 Amb25872717 [0,0,0,1,0,0|3,0,0]=4 1368 B13R2.32 Cc1c(I)ccc2ccccc12 Amb26367182 [0,0,0,1,0,0|2,0,0]=3 1369 B13R2.32 Cc1c(N)ccc2ccccc12 Amb17593938 [0,0,0,1,0,0|2,0,0]=3 1370 B13R2.32 Cc1c(N)ccc2ccncc12 Amb22753791 [0,0,0,1,0,0|3,0,0]=4 1371 B13R2.32 Cc1c(N)ccc2cnccc12 Amb27175658 [0,0,0,1,0,0|3,0,0]=4 1372 B13R2.32 Cc1c(N)cnc2ccccc12 Amb4016185 [0,0,0,1,0,0|3,0,0]=4 1373 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [0,0,0,1,0,0|1,0,1]=3 1374 B13R2.32 Cc1c(O)ccc2ccncc12 Amb4013117 [0,0,0,1,0,0|2,0,1]=4 1375 B13R2.32 Cc1c(O)ccc2ncccc12 Amb18645164 [0,0,0,1,0,0|2,0,1]=4 1376 B13R2.32 Cc1c(O)ccc2ncccc12 Amb35748094 [0,0,0,1,0,0|2,0,1]=4 1377 B13R2.32 Cc1c(O)cnc2ccccc12 Amb18645166 [0,0,0,1,0,0|2,0,1]=4 1378 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [0,0,0,1,0,0|2,0,0]=3 1379 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb2540178 [0,0,0,1,0,0|2,0,0]=3 1380 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb4322944 [0,0,0,1,0,0|2,0,0]=3 1381 B13R2.32 Cc1ccc2ccccc2c1Br Amb3939041 [0,0,0,1,0,0|3,0,0]=4 1382 B13R2.32 Cc1ccc2ccccc2c1C Amb6297194 [0,0,0,1,0,0|2,0,0]=3 1383 B13R2.32 Cc1ccc2ccccc2c1I Amb27851450 [0,0,0,1,0,0|3,0,0]=4 1384 B13R2.32 Cc1ccc2ccccc2c1N Amb2429201 [0,0,0,1,0,0|3,0,0]=4 1385 B13R2.32 Cc1ccc2ccccc2c1N Amb6383344 [0,0,0,1,0,0|3,0,0]=4 1386 B13R2.32 Cc1ccc2ccccc2c1O Amb3939072 [0,0,0,1,0,0|3,0,0]=4 1387 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [0,0,0,1,0,0|3,0,0]=4 1388 B13R2.32 Cc1ccc2cccnc2c1C Amb19101295 [0,0,0,1,0,0|3,0,0]=4 1389 B13R2.32 Cc1ccc2cccnc2c1C Amb34202228 [0,0,0,1,0,0|3,0,0]=4 1390 B13R2.32 Cc1ccc2cnccc2c1C Amb25940951 [0,0,0,1,0,0|3,0,0]=4 1391 B13R2.32 Cc1ccc2ncccc2c1C Amb2612996 [0,0,0,1,0,0|3,0,0]=4 1392 B13R2.32 Cc1cnc2ccccc2c1C Amb2612997 [0,0,0,1,0,0|3,0,0]=4 1393 B13R2.32 Cc1ncc2ccccc2c1C Amb23560126 [0,0,0,1,0,0|3,0,0]=4 1394 B13R2.32 Clc1c(Br)ccc2ccccc12 Amb24444356 [0,0,0,1,0,0|3,0,0]=4 1395 B13R2.32 Clc1c(I)ccc2ccccc12 Amb25866644 [0,0,0,1,0,0|3,0,0]=4 1396 B13R2.32 Clc1ccc2ccccc2c1Br Amb25082370 [0,0,0,1,0,0|3,0,0]=4 1397 B13R2.32 Clc1ccc2ccccc2c1Cl Amb25189491 [0,0,0,1,0,0|3,0,0]=4 1398 B13R2.32 Clc1ccc2ccccc2c1I Amb25309391 [0,0,0,1,0,0|3,0,0]=4 1399 B13R2.32 Cn1c(=N)ccc2ccccc21 Amb8439002 [0,0,0,1,0,0|2,0,0]=3 1400 B13R2.32 Cn1c(=O)cnc2ccccc21 Amb2612192 [0,0,0,1,0,0|2,0,0]=3 1401 B13R2.32 Fc1c(Br)ccc2ccccc12 Amb16186009 [0,0,0,1,0,0|3,0,0]=4 1402 B13R2.32 Fc1c(I)ccc2ccccc12 Amb22547558 [0,0,0,1,0,0|3,0,0]=4 1403 B13R2.32 Fc1ccc2ccccc2c1Br Amb25068848 [0,0,0,1,0,0|3,0,0]=4 1404 B13R2.32 Fc1ccc2ccccc2c1Cl Amb25232022 [0,0,0,1,0,0|3,0,0]=4 1405 B13R2.32 Fc1ccc2ccccc2c1I Amb28250690 [0,0,0,1,0,0|3,0,0]=4 1406 B13R2.32 Ic1ccc2ccccc2c1I Amb8392015 [0,0,0,1,0,0|3,0,0]=4 1407 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [0,0,0,1,0,0|2,0,0]=3 1408 B13R2.32 N=C1C=Cc2ccccc2C1=O Amb27948681 [0,0,0,1,0,0|3,0,0]=4 1409 B13R2.32 Nc1c(Br)ccc2ccccc12 Amb17596049 [0,0,0,1,0,0|3,0,0]=4 1410 B13R2.32 Nc1c(Cl)ccc2ccccc12 Amb17594523 [0,0,0,1,0,0|3,0,0]=4 1411 B13R2.32 Nc1c(F)ccc2ccccc12 Amb17594017 [0,0,0,1,0,0|3,0,0]=4 1412 B13R2.32 Nc1c(I)ccc2ccccc12 Amb22491989 [0,0,0,1,0,0|3,0,0]=4 1413 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [0,0,0,1,0,0|2,0,1]=4 1414 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [0,0,0,1,0,0|2,0,1]=4 1415 B13R2.32 Nc1c(P)ccc2ccccc12 Amb28186928 [0,0,0,1,0,0|3,0,0]=4 1416 B13R2.32 Nc1c(S)ccc2ccccc12 Amb17594453 [0,0,0,1,0,0|2,1,0]=4 1417 B13R2.32 Nc1ccc2ccccc2c1Br Amb19374680 [0,0,0,1,0,0|3,0,0]=4 1418 B13R2.32 Nc1ccc2ccccc2c1Br Amb4012961 [0,0,0,1,0,0|3,0,0]=4 1419 B13R2.32 Nc1ccc2ccccc2c1Cl Amb4006312 [0,0,0,1,0,0|3,0,0]=4 1420 B13R2.32 Nc1ccc2ccccc2c1F Amb22497545 [0,0,0,1,0,0|3,0,0]=4 1421 B13R2.32 Nc1ccc2ccccc2c1I Amb27407346 [0,0,0,1,0,0|3,0,0]=4 1422 B13R2.32 Nc1ccc2ccccc2c1N Amb16191900 [0,0,0,1,0,0|3,0,0]=4 1423 B13R2.32 Nc1ccc2ccccc2c1O Amb17593980 [0,0,0,1,0,0|3,0,0]=4 1424 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [0,0,0,1,0,0|3,0,0]=4 1425 B13R2.32 Nc1ccc2ccccc2c1S Amb18647914 [0,0,0,1,0,0|3,0,0]=4 1426 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [0,0,0,1,0,0|2,0,0]=3 1427 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [0,0,0,1,0,0|2,0,0]=3 1428 B13R2.32 O=C1C=Cc2ccccc2N1O Amb22723451 [0,0,0,1,0,0|2,0,0]=3 1429 B13R2.32 O=C1N=Cc2ccccc2N1O Amb28248668 [0,0,0,1,0,0|3,0,0]=4 1430 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [0,0,0,1,0,0|3,0,0]=4 1431 B13R2.32 OC1C(=S)C=Cc2ccccc21 Amb26035492 [0,0,0,1,0,0|2,1,0]=4 1432 B13R2.32 Oc1c(Br)ccc2ccccc12 Amb8394123 [0,0,0,1,0,0|3,0,0]=4 1433 B13R2.32 Oc1c(Cl)ccc2ccccc12 Amb17594568 [0,0,0,1,0,0|3,0,0]=4 1434 B13R2.32 Oc1c(F)ccc2ccccc12 Amb18645623 [0,0,0,1,0,0|3,0,0]=4 1435 B13R2.32 Oc1c(I)ccc2ccccc12 Amb26478044 [0,0,0,1,0,0|3,0,0]=4 1436 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [0,0,0,1,0,0|2,0,1]=4 1437 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [0,0,0,1,0,0|2,0,1]=4 1438 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [0,0,0,1,0,0|2,0,1]=4 1439 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [0,0,0,1,0,0|2,0,1]=4 1440 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [0,0,0,1,0,0|2,0,1]=4 1441 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [0,0,0,1,0,0|2,0,1]=4 1442 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [0,0,0,1,0,0|2,0,1]=4 1443 B13R2.32 [NH3+]c1c([O-])ccc2ccccc12 Amb4268650 [0,0,0,1,0,0|2,0,1]=4 1444 B13R2.32 [O-][n+]1c(Cl)ccc2ccccc21 Amb27439580 [0,0,0,1,0,0|3,0,0]=4 1445 B13R2.32 [O-][n+]1c(S)ccc2ccccc21 Amb27438214 [0,0,0,1,0,0|2,1,0]=4 1446 B13R2.33 C=C1CNc2ccccc2CO1 Amb27669840 [0,0,0,1,0,0|2,0,1]=4 1447 B13R2.33 CC1=NNc2ccccc2C=C1 Amb27421335 [0,0,0,1,0,0|3,0,0]=4 1448 B13R2.33 NC1=NNc2ccccc2C=C1 Amb27974235 [0,0,0,1,0,0|3,0,0]=4 1449 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [0,0,0,1,0,0|1,0,1]=3 1450 B13R2.33 O=C1C=Cc2ccccc2CC1 Amb17593958 [0,0,0,1,0,0|1,0,0]=2 1451 B13R2.33 O=C1C=Cc2ccccc2CN1 Amb8630983 [0,0,0,1,0,0|1,0,0]=2 1452 B13R2.33 O=C1C=Cc2ccccc2OC1 Amb27175937 [0,0,0,1,0,0|2,0,0]=3 1453 B13R2.33 O=C1C=Cc2cccnc2C=C1 Amb27854920 [0,0,0,1,0,0|2,0,1]=4 1454 B13R2.33 O=C1C=Nc2ccccc2C=N1 Amb22489908 [0,0,0,1,0,0|2,0,1]=4 1455 B13R2.33 O=C1C=Nc2ccccc2CN1 Amb27643583 [0,0,0,1,0,0|2,0,0]=3 1456 B13R2.33 O=C1CCc2ccccc2CC1 Amb6359959 [0,0,0,1,0,0|1,0,2]=4 1457 B13R2.33 O=C1CCc2ccccc2CN1 Amb610462 [0,0,0,1,0,0|1,0,2]=4 1458 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [0,0,0,1,0,0|2,0,1]=4 1459 B13R2.33 O=C1CNc2ccccc2CN1 Amb17620443 [0,0,0,1,0,0|2,0,1]=4 1460 B13R2.33 O=C1COc2ccccc2CN1 Amb2137257 [0,0,0,1,0,0|2,0,1]=4 1461 B13R2.33 O[C@@H]1C=Cc2ccccc2CC1 Amb27197625 [0,0,0,1,0,0|1,0,2]=4 1462 B13R2.57 BrCc1ccc2ccccc2c1 Amb2609043 [0,0,0,1,0,0|3,0,0]=4 1463 B13R2.57 BrCc1ccc2ccccc2n1 Amb21857522 [0,0,0,1,0,0|3,0,0]=4 1464 B13R2.57 BrCc1ccc2ccccc2n1 Amb8397282 [0,0,0,1,0,0|3,0,0]=4 1465 B13R2.57 C#Cc1ccc2ccccc2c1 Amb10071054 [0,0,0,1,0,0|2,0,1]=4 1466 B13R2.57 C#Cc1ccc2ccccc2n1 Amb22490538 [0,0,0,1,0,0|2,0,1]=4 1467 B13R2.57 C=Cc1ccc2ccccc2c1 Amb8394029 [0,0,0,1,0,0|2,0,1]=4 1468 B13R2.57 C=Cc1ccc2ccccc2n1 Amb10071967 [0,0,0,1,0,0|2,0,1]=4 1469 B13R2.57 CCC1C=Cc2ccccc2N1 Amb27949234 [0,0,0,1,0,0|2,0,1]=4 1470 B13R2.57 CC[n+]1ccc2ccccc2c1 Amb27649764 [0,0,0,1,0,0|3,0,0]=4 1471 B13R2.57 CCc1ccc2ccccc2c1 Amb6298320 [0,0,0,1,0,0|2,0,0]=3 1472 B13R2.57 CCc1ccc2ccccc2n1 Amb20667571 [0,0,0,1,0,0|2,0,0]=3 1473 B13R2.57 CCc1ccc2cccnc2c1 Amb24436476 [0,0,0,1,0,0|3,0,0]=4 1474 B13R2.57 CCc1ccc2cccnc2n1 Amb28141810 [0,0,0,1,0,0|3,0,0]=4 1475 B13R2.57 CCc1ccc2ccncc2c1 Amb19100642 [0,0,0,1,0,0|3,0,0]=4 1476 B13R2.57 CCc1ccc2cnccc2c1 Amb24091669 [0,0,0,1,0,0|3,0,0]=4 1477 B13R2.57 CCc1ccc2cnccc2n1 Amb24648881 [0,0,0,1,0,0|3,0,0]=4 1478 B13R2.57 CCc1ccc2ncccc2c1 Amb18355325 [0,0,0,1,0,0|3,0,0]=4 1479 B13R2.57 CCc1cnc2ccccc2c1 Amb15691863 [0,0,0,1,0,0|3,0,0]=4 1480 B13R2.57 CNc1ccc2ccccc2c1 Amb415893 [0,0,0,1,0,0|2,0,0]=3 1481 B13R2.57 CNc1ccc2ccccc2n1 Amb6627062 [0,0,0,1,0,0|2,0,0]=3 1482 B13R2.57 CNc1ccc2cccnc2c1 Amb5717611 [0,0,0,1,0,0|3,0,0]=4 1483 B13R2.57 CNc1ccc2cnccc2c1 Amb19109233 [0,0,0,1,0,0|3,0,0]=4 1484 B13R2.57 CNc1ccc2cnccc2c1 Amb33532500 [0,0,0,1,0,0|3,0,0]=4 1485 B13R2.57 CNc1ccc2cnccc2c1 Amb35789161 [0,0,0,1,0,0|3,0,0]=4 1486 B13R2.57 CNc1ccc2ncccc2c1 Amb18949283 [0,0,0,1,0,0|3,0,0]=4 1487 B13R2.57 CNc1ccc2ncccc2n1 Amb22751196 [0,0,0,1,0,0|3,0,0]=4 1488 B13R2.57 CNc1cnc2ccccc2c1 Amb18948972 [0,0,0,1,0,0|3,0,0]=4 1489 B13R2.57 CNc1cnc2ccccc2n1 Amb18947325 [0,0,0,1,0,0|3,0,0]=4 1490 B13R2.57 CNc1ncc2ccccc2n1 Amb25363322 [0,0,0,1,0,0|3,0,0]=4 1491 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [0,0,0,1,0,0|1,0,2]=4 1492 B13R2.57 COC1=Nc2ccccc2OC1 Amb33218462 [0,0,0,1,0,0|2,0,1]=4 1493 B13R2.57 COC1=Nc2ccccc2SC1 Amb24116116 [0,0,0,1,0,0|2,0,1]=4 1494 B13R2.57 COc1cc2ccccc2cn1 Amb25861237 [0,0,0,1,0,0|2,0,0]=3 1495 B13R2.57 COc1cc2ccncc2cn1 Amb28250059 [0,0,0,1,0,0|3,0,0]=4 1496 B13R2.57 COc1cc2ncccc2cn1 Amb27847145 [0,0,0,1,0,0|3,0,0]=4 1497 B13R2.57 COc1ccc2c(c1)C=CCC2 Amb2383773 [0,0,0,1,0,0|1,0,2]=4 1498 B13R2.57 COc1ccc2c(c1)C=CCN2 Amb18062202 [0,0,0,1,0,0|2,0,1]=4 1499 B13R2.57 COc1ccc2c(c1)C=CCO2 Amb23441461 [0,0,0,1,0,0|2,0,1]=4 1500 B13R2.57 COc1ccc2c(c1)CCC=C2 Amb26651800 [0,0,0,1,0,0|1,0,2]=4 1501 B13R2.57 COc1ccc2c(c1)NCC=C2 Amb18559644 [0,0,0,1,0,0|2,0,1]=4 1502 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [0,0,0,1,0,0|1,0,0]=2 1503 B13R2.57 COc1ccc2ccccc2n1 Amb20171196 [0,0,0,1,0,0|1,0,0]=2 1504 B13R2.57 COc1ccc2cccnc2c1 Amb17617089 [0,0,0,1,0,0|2,0,0]=3 1505 B13R2.57 COc1ccc2cccnc2c1 Amb24183299 [0,0,0,1,0,0|2,0,0]=3 1506 B13R2.57 COc1ccc2cccnc2n1 Amb27624881 [0,0,0,1,0,0|2,0,0]=3 1507 B13R2.57 COc1ccc2ccncc2c1 Amb10610318 [0,0,0,1,0,0|2,0,0]=3 1508 B13R2.57 COc1ccc2ccncc2c1 Amb5638098 [0,0,0,1,0,0|2,0,0]=3 1509 B13R2.57 COc1ccc2cnccc2c1 Amb10071944 [0,0,0,1,0,0|2,0,0]=3 1510 B13R2.57 COc1ccc2cnccc2c1 Amb22236031 [0,0,0,1,0,0|2,0,0]=3 1511 B13R2.57 COc1ccc2cncnc2c1 Amb22745180 [0,0,0,1,0,0|3,0,0]=4 1512 B13R2.57 COc1ccc2cnncc2c1 Amb26464081 [0,0,0,1,0,0|3,0,0]=4 1513 B13R2.57 COc1ccc2ncccc2c1 Amb1156981 [0,0,0,1,0,0|2,0,0]=3 1514 B13R2.57 COc1ccc2ncccc2n1 Amb27453648 [0,0,0,1,0,0|2,0,0]=3 1515 B13R2.57 COc1ccc2nccnc2c1 Amb10068725 [0,0,0,1,0,0|3,0,0]=4 1516 B13R2.57 COc1ccc2nccnc2n1 Amb22497790 [0,0,0,1,0,0|3,0,0]=4 1517 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [0,0,0,1,0,0|2,0,0]=3 1518 B13R2.57 COc1cnc2cccnc2c1 Amb21959422 [0,0,0,1,0,0|3,0,0]=4 1519 B13R2.57 COc1ncc2ccccc2n1 Amb22745160 [0,0,0,1,0,0|2,0,0]=3 1520 B13R2.57 CSc1ccc2ccccc2c1 Amb2609071 [0,0,0,1,0,0|1,1,0]=3 1521 B13R2.57 CSc1ccc2ccccc2n1 Amb6477854 [0,0,0,1,0,0|1,1,0]=3 1522 B13R2.57 CSc1ccc2cccnc2n1 Amb27186169 [0,0,0,1,0,0|2,1,0]=4 1523 B13R2.57 CSc1ccc2ccncc2c1 Amb27968016 [0,0,0,1,0,0|2,1,0]=4 1524 B13R2.57 ClCc1ccc2ccccc2[nH+]1 Amb24113853 [0,0,0,1,0,0|3,0,0]=4 1525 B13R2.57 ClCc1ccc2ccccc2c1 Amb2796492 [0,0,0,1,0,0|3,0,0]=4 1526 B13R2.57 ClCc1ccc2ccccc2n1 Amb6892745 [0,0,0,1,0,0|3,0,0]=4 1527 B13R2.57 FCc1ccc2ccccc2c1 Amb28139672 [0,0,0,1,0,0|3,0,0]=4 1528 B13R2.57 ICc1ccc2ccccc2n1 Amb28141827 [0,0,0,1,0,0|3,0,0]=4 1529 B13R2.57 N#Cc1ccc2ccccc2c1 Amb4009131 [0,0,0,1,0,0|3,0,0]=4 1530 B13R2.57 N#Cc1ccc2ccccc2n1 Amb1063463 [0,0,0,1,0,0|3,0,0]=4 1531 B13R2.57 N=Cc1ccc2ccccc2n1 Amb27642853 [0,0,0,1,0,0|3,0,0]=4 1532 B13R2.57 NCc1ccc2ccccc2c1 Amb1120053 [0,0,0,1,0,0|3,0,0]=4 1533 B13R2.57 NCc1ccc2ccccc2c1 Amb19957972 [0,0,0,1,0,0|3,0,0]=4 1534 B13R2.57 NCc1ccc2ccccc2c1 Amb7969859 [0,0,0,1,0,0|3,0,0]=4 1535 B13R2.57 NCc1ccc2ccccc2n1 Amb1139476 [0,0,0,1,0,0|3,0,0]=4 1536 B13R2.57 NCc1ccc2ccccc2n1 Amb15695438 [0,0,0,1,0,0|3,0,0]=4 1537 B13R2.57 NCc1ccc2ccccc2n1 Amb7990033 [0,0,0,1,0,0|3,0,0]=4 1538 B13R2.57 NNc1ccc2ccccc2c1 Amb1772358 [0,0,0,1,0,0|3,0,0]=4 1539 B13R2.57 NNc1ccc2ccccc2c1 Amb6296513 [0,0,0,1,0,0|3,0,0]=4 1540 B13R2.57 NNc1ccc2ccccc2n1 Amb1105542 [0,0,0,1,0,0|3,0,0]=4 1541 B13R2.57 NOc1ccc2ncccc2c1 Amb24397483 [0,0,0,1,0,0|3,0,0]=4 1542 B13R2.57 O=Cc1ccc2ccccc2c1 Amb3939951 [0,0,0,1,0,0|3,0,0]=4 1543 B13R2.57 O=Cc1ccc2ccccc2n1 Amb533663 [0,0,0,1,0,0|3,0,0]=4 1544 B13R2.57 O=Nc1ccc2ccccc2c1 Amb27170669 [0,0,0,1,0,0|3,0,0]=4 1545 B13R2.57 OCc1ccc2ccccc2c1 Amb2389960 [0,0,0,1,0,0|3,0,0]=4 1546 B13R2.57 OCc1ccc2ccccc2n1 Amb1154605 [0,0,0,1,0,0|3,0,0]=4 1547 B13R2.57 SCc1ccc2ccccc2c1 Amb21943705 [0,0,0,1,0,0|3,0,0]=4 1548 B13R2.57 SCc1ccc2ccccc2n1 Amb28200238 [0,0,0,1,0,0|3,0,0]=4 1549 B13R2.57 [C-]#[N+]c1ccc2ccccc2c1 Amb22348022 [0,0,0,1,0,0|2,0,1]=4 1550 B13R2.57 [C-]#[N+]c1ccc2ccccc2n1 Amb33200400 [0,0,0,1,0,0|2,0,1]=4 1551 B13R2.373 CC1C(=O)C=C1c2ccccc2 Amb27770129 [0,0,0,1,0,0|1,0,0]=2 1552 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [0,0,0,1,0,0|1,0,2]=4 1553 B13R2.373 CC1C(=O)CN1c2ccccc2 Amb27471934 [0,0,0,1,0,0|2,0,1]=4 1554 B13R2.373 CC1C(=O)NC1c2ccccc2 Amb19149073 [0,0,0,1,0,0|2,0,1]=4 1555 B13R2.373 CN1C(O)=CC1c2ccccc2 Amb27424055 [0,0,0,1,0,0|1,0,2]=4 1556 B13R2.373 C[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb28286725 [0,0,0,1,0,0|2,0,1]=4 1557 B13R2.373 C[C@H]1C(=O)N[C@H]1c2ccccc2 Amb27849042 [0,0,0,1,0,0|2,0,1]=4 1558 B13R2.373 O=C1C=C(c2ccccc2)C1=O Amb22172059 [0,0,0,1,0,0|2,0,0]=3 1559 B13R2.2383 C(=C\C1CCN1)/c2ccccc2 Amb32954170 [0,0,0,1,0,0|2,0,1]=4 1560 B13R2.3203 CC1(\C=C\c2ccccc2)CO1 Amb33080798 [0,0,0,1,0,0|1,0,1]=3 1561 B13R2.3203 NC1(\C=C\c2ccccc2)CC1 Amb33081456 [0,0,0,1,0,0|2,0,1]=4 1562 B13R2.3203 OC1(\C=C/c2ccccc2)CC1 Amb26873373 [0,0,0,1,0,0|1,0,2]=4 1563 B13R2.3203 OC1(\C=C\c2ccccc2)CC1 Amb27967099 [0,0,0,1,0,0|1,0,2]=4 1564 B13R2.15272 CCC(=O)C1Cc2ccccc21 Amb28250023 [0,0,0,1,0,0|1,0,2]=4 1565 B13R2.15272 CNC(=O)C1Cc2ccccc21 Amb27166885 [0,0,0,1,0,0|1,0,2]=4 1566 B13R2.15272 COC(=O)C1Cc2ccccc21 Amb27616823 [0,0,0,1,0,0|0,0,2]=3 1567 B11R1.25 CCC(=O)\C=C\c1ccco1 Amb25233726 [0,0,0,0,1,0|2,0,0]=3 1568 B11R1.25 COC(=N)\C=C\c1ccco1 Amb27201924 [0,0,0,0,1,0|2,0,0]=3 1569 B11R1.25 COC(=O)C#Cc1ccco1 Amb27855944 [0,0,0,0,1,0|1,0,2]=4 1570 B11R1.25 COC(=O)C#Cc1ccoc1 Amb22723411 [0,0,0,0,1,0|1,0,2]=4 1571 B11R1.25 COC(=O)C#Cc1ccsc1 Amb28281036 [0,0,0,0,1,0|1,0,2]=4 1572 B11R1.25 COC(=O)CCc1ccoc1 Amb27272302 [0,0,0,0,1,0|1,0,2]=4 1573 B11R1.25 COC(=O)CCc1ccsc1 Amb27491907 [0,0,0,0,1,0|1,0,2]=4 1574 B11R1.25 COC(=O)CCn1cccc1 Amb18799453 [0,0,0,0,1,0|1,0,2]=4 1575 B11R1.25 COC(=O)COc1ccsc1 Amb27988863 [0,0,0,0,1,0|2,0,1]=4 1576 B11R1.25 COC(=O)NCc1ccco1 Amb3363702 [0,0,0,0,1,0|2,0,1]=4 1577 B11R1.25 COC(=O)NCc1ccoc1 Amb27485865 [0,0,0,0,1,0|2,0,1]=4 1578 B11R1.25 COC(=O)\C=C\C1=CCCC1 Amb24392864 [0,0,0,0,1,0|0,0,3]=4 1579 B11R1.25 COC(=O)\C=C\c1ccco1 Amb26473604 [0,0,0,0,1,0|1,0,0]=2 1580 B11R1.25 COC(=O)\C=C\c1cccs1 Amb2724557 [0,0,0,0,1,0|1,0,0]=2 1581 B11R1.25 COC(=O)\C=C\c1cccs1 Amb33714728 [0,0,0,0,1,0|1,0,0]=2 1582 B11R1.25 COC(=O)\C=C\c1ccno1 Amb27782507 [0,0,0,0,1,0|2,0,0]=3 1583 B11R1.25 COC(=O)\C=C\c1ccns1 Amb30013692 [0,0,0,0,1,0|2,0,0]=3 1584 B11R1.25 COC(=O)\C=C\c1ccsc1 Amb8630327 [0,0,0,0,1,0|1,0,0]=2 1585 B11R1.25 COC(=O)\C=C\c1cncs1 Amb25909810 [0,0,0,0,1,0|2,0,0]=3 1586 B11R1.25 COC(=O)\C=C\c1cocn1 Amb25208802 [0,0,0,0,1,0|2,0,0]=3 1587 B11R1.25 COC(=O)\C=C\c1cscn1 Amb24409150 [0,0,0,0,1,0|2,0,0]=3 1588 B11R1.25 COC(=O)\C=C\c1csnn1 Amb27176718 [0,0,0,0,1,0|3,0,0]=4 1589 B11R1.25 COC(=O)\C=C\c1ncco1 Amb27398431 [0,0,0,0,1,0|2,0,0]=3 1590 B11R1.25 COC(=O)\C=C\c1nccs1 Amb25758463 [0,0,0,0,1,0|2,0,0]=3 1591 B11R1.25 COC(=O)\C=C\n1ccnc1 Amb25976817 [0,0,0,0,1,0|2,0,0]=3 1592 B11R1.25 N#CC(=O)\C=C\c1ccco1 Amb26627118 [0,0,0,0,1,0|3,0,0]=4 1593 B11R1.25 N#CC(=O)\C=C\c1cccs1 Amb24372667 [0,0,0,0,1,0|3,0,0]=4 1594 B11R1.25 NNC(=O)\C=C\c1ccco1 Amb27211757 [0,0,0,0,1,0|3,0,0]=4 1595 B11R1.25 O=C(\C=C\c1ccco1)CCl Amb26476618 [0,0,0,0,1,0|3,0,0]=4 1596 B11R1.25 O=C(\C=C\c1cccs1)CCl Amb28347537 [0,0,0,0,1,0|3,0,0]=4 1597 B11R1.25 O=C(\C=C\c1cccs1)NO Amb27479337 [0,0,0,0,1,0|3,0,0]=4 1598 B11R1.25 O=CC(=O)\C=C\c1ccco1 Amb26331989 [0,0,0,0,1,0|3,0,0]=4 1599 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,1,0|1,0,2]=4 1600 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,0,0,0,1,0|2,0,1]=4 1601 B11R1.40 C#C\C(C)=C\c1ccccc1 Amb33476742 [0,0,0,0,1,0|2,0,1]=4 1602 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [0,0,0,0,1,0|3,0,0]=4 1603 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,1,0|1,0,2]=4 1604 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [0,0,0,0,1,0|2,0,1]=4 1605 B11R1.40 C=C\C(C)=C/c1ccccc1 Amb27428211 [0,0,0,0,1,0|2,0,1]=4 1606 B11R1.40 C=C\C(C)=C\c1ccccc1 Amb27950688 [0,0,0,0,1,0|2,0,1]=4 1607 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,0,0,0,1,0|1,0,1]=3 1608 B11R1.40 CCC(=O)Cc1ccccn1 Amb9205933 [0,0,0,0,1,0|2,0,1]=4 1609 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,0,0,0,1,0|2,0,1]=4 1610 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,0,0,0,1,0|2,0,0]=3 1611 B11R1.40 CCC(=O)Nc1ccccn1 Amb3361354 [0,0,0,0,1,0|3,0,0]=4 1612 B11R1.40 CCC(=O)Nc1cccnc1 Amb5797495 [0,0,0,0,1,0|3,0,0]=4 1613 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,0,0,0,1,0|2,0,0]=3 1614 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,0,0,0,1,0|2,0,0]=3 1615 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [0,0,0,0,1,0|2,0,0]=3 1616 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [0,0,0,0,1,0|2,0,0]=3 1617 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [0,0,0,0,1,0|2,0,0]=3 1618 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [0,0,0,0,1,0|3,0,0]=4 1619 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,0,0,0,1,0|2,0,1]=4 1620 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [0,0,0,0,1,0|1,0,1]=3 1621 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [0,0,0,0,1,0|2,0,1]=4 1622 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,0,0,0,1,0|2,0,1]=4 1623 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,0,0,0,1,0|2,0,1]=4 1624 B11R1.40 CNC(=O)Nc1ccccn1 Amb2132780 [0,0,0,0,1,0|3,0,0]=4 1625 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,0,0,0,1,0|2,0,0]=3 1626 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [0,0,0,0,1,0|2,0,0]=3 1627 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [0,0,0,0,1,0|2,1,0]=4 1628 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [0,0,0,0,1,0|2,1,0]=4 1629 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [0,0,0,0,1,0|2,0,0]=3 1630 B11R1.40 CN\C(C)=C\c1ccccn1 Amb28423447 [0,0,0,0,1,0|3,0,0]=4 1631 B11R1.40 CN\C(C)=C\c1cccnc1 Amb27170157 [0,0,0,0,1,0|3,0,0]=4 1632 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,0,0,0,1,0|1,0,1]=3 1633 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,0,0,0,1,0|1,0,1]=3 1634 B11R1.40 COC(=N)Cc1ccncc1 Amb18182737 [0,0,0,0,1,0|2,0,1]=4 1635 B11R1.40 COC(=O)C[n+]1ccccc1 Amb26880684 [0,0,0,0,1,0|1,0,1]=3 1636 B11R1.40 COC(=O)C[n+]1ccccc1 Amb3433634 [0,0,0,0,1,0|1,0,1]=3 1637 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [0,0,0,0,1,0|0,0,1]=2 1638 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,0,0,0,1,0|1,0,1]=3 1639 B11R1.40 COC(=O)Cc1cccnc1 Amb22497118 [0,0,0,0,1,0|1,0,1]=3 1640 B11R1.40 COC(=O)Cc1cccnc1 Amb4017567 [0,0,0,0,1,0|1,0,1]=3 1641 B11R1.40 COC(=O)Cc1cccnn1 Amb4296987 [0,0,0,0,1,0|2,0,1]=4 1642 B11R1.40 COC(=O)Cc1ccncc1 Amb20240688 [0,0,0,0,1,0|1,0,1]=3 1643 B11R1.40 COC(=O)Cc1ccncc1 Amb6892645 [0,0,0,0,1,0|1,0,1]=3 1644 B11R1.40 COC(=O)Cc1ccncn1 Amb22500240 [0,0,0,0,1,0|2,0,1]=4 1645 B11R1.40 COC(=O)Cc1ccnnc1 Amb22405879 [0,0,0,0,1,0|2,0,1]=4 1646 B11R1.40 COC(=O)Cc1cnccn1 Amb2695469 [0,0,0,0,1,0|2,0,1]=4 1647 B11R1.40 COC(=O)Cc1cncnc1 Amb25763089 [0,0,0,0,1,0|2,0,1]=4 1648 B11R1.40 COC(=O)Cc1ncccn1 Amb17912090 [0,0,0,0,1,0|2,0,1]=4 1649 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,1,0|1,0,0]=2 1650 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [0,0,0,0,1,0|2,0,0]=3 1651 B11R1.40 COC(=O)Nc1ccncc1 Amb8439516 [0,0,0,0,1,0|2,0,0]=3 1652 B11R1.40 COC(=O)Nc1cnccn1 Amb35708043 [0,0,0,0,1,0|3,0,0]=4 1653 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,1,0|1,0,0]=2 1654 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [0,0,0,0,1,0|1,1,0]=3 1655 B11R1.40 COC(=S)Nc1ccccn1 Amb27402996 [0,0,0,0,1,0|2,1,0]=4 1656 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [0,0,0,0,1,0|1,0,0]=2 1657 B11R1.40 CO\C(C)=N/c1ccccn1 Amb24095834 [0,0,0,0,1,0|3,0,0]=4 1658 B11R1.40 CO\C(C)=N\c1ccccn1 Amb27484618 [0,0,0,0,1,0|3,0,0]=4 1659 B11R1.40 CO\C([O-])=N\c1ccccc1 Amb8488213 [0,0,0,0,1,0|1,0,1]=3 1660 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,0,0,0,1,0|1,1,0]=3 1661 B11R1.40 CSC(=S)Nc1ccccc1 Amb5716125 [0,0,0,0,1,0|1,2,0]=4 1662 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [0,0,0,0,1,0|3,0,0]=4 1663 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [0,0,0,0,1,0|3,0,0]=4 1664 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [0,0,0,0,1,0|3,0,0]=4 1665 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [0,0,0,0,1,0|3,0,0]=4 1666 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [0,0,0,0,1,0|3,0,0]=4 1667 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [0,0,0,0,1,0|3,0,0]=4 1668 B11R1.40 C\C(C#N)=C\c1ccccc1 Amb27421076 [0,0,0,0,1,0|3,0,0]=4 1669 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,0,0,0,1,0|3,0,0]=4 1670 B11R1.40 C\C=C(\C)Nc1ccccc1 Amb27597055 [0,0,0,0,1,0|3,0,0]=4 1671 B11R1.40 C\N=C(\C)Oc1ccccc1 Amb27260339 [0,0,0,0,1,0|3,0,0]=4 1672 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [0,0,0,0,1,0|2,0,1]=4 1673 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [0,0,0,0,1,0|3,0,0]=4 1674 B11R1.40 N#CC(=O)Cc1ccccc1 Amb26498532 [0,0,0,0,1,0|2,0,1]=4 1675 B11R1.40 N#CC(=O)Nc1ccccc1 Amb4006113 [0,0,0,0,1,0|3,0,0]=4 1676 B11R1.40 N#CC(=O)Oc1ccccc1 Amb27813575 [0,0,0,0,1,0|3,0,0]=4 1677 B11R1.40 N#C\C(F)=C\c1ccccc1 Amb18644314 [0,0,0,0,1,0|3,0,0]=4 1678 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,1,0|2,0,1]=4 1679 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,0,0,0,1,0|2,0,1]=4 1680 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,0,0,0,1,0|3,0,0]=4 1681 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,0,0,0,1,0|3,0,0]=4 1682 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,0,0,0,1,0|3,0,0]=4 1683 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [0,0,0,0,1,0|2,0,1]=4 1684 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,0,0,0,1,0|3,0,0]=4 1685 B11R1.40 NNC(=O)Nc1ccccc1 Amb9825866 [0,0,0,0,1,0|3,0,0]=4 1686 B11R1.40 NNC(=O)Oc1ccccc1 Amb2737176 [0,0,0,0,1,0|3,0,0]=4 1687 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,0,0,0,1,0|2,0,0]=3 1688 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,0,0,0,1,0|2,0,1]=4 1689 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,0,0,0,1,0|3,0,0]=4 1690 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [0,0,0,0,1,0|3,0,0]=4 1691 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,0,0,0,1,0|2,0,1]=4 1692 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,0,0,0,1,0|3,0,0]=4 1693 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [0,0,0,0,1,0|3,0,0]=4 1694 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,0,0,0,1,0|3,0,0]=4 1695 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,0,0,0,1,0|3,0,0]=4 1696 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,0,0,0,1,0|3,0,0]=4 1697 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,0,0,0,1,0|3,0,0]=4 1698 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,0,0,0,1,0|3,0,0]=4 1699 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,0,0,0,1,0|3,0,0]=4 1700 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,1,0|2,0,1]=4 1701 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,0,0,0,1,0|3,0,0]=4 1702 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,0,0,0,1,0|3,0,0]=4 1703 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,0,0,0,1,0|3,0,0]=4 1704 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,0,0,0,1,0|3,0,0]=4 1705 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,0,0,0,1,0|3,0,0]=4 1706 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,0,0,0,1,0|2,0,1]=4 1707 B11R1.40 O=N\C(Br)=C/c1ccccc1 Amb27862869 [0,0,0,0,1,0|3,0,0]=4 1708 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [0,0,0,0,1,0|3,0,0]=4 1709 B13R1.718 CCC(=O)CNCc1ccccc1 Amb33131575 [0,0,0,0,0,1|1,0,2]=4 1710 B13R1.718 CCC(=O)COCc1ccccc1 Amb18186198 [0,0,0,0,0,1|1,0,2]=4 1711 B13R1.718 CCC(=O)CSCc1ccccc1 Amb4165971 [0,0,0,0,0,1|1,0,2]=4 1712 B13R1.718 CCC(=O)N\N=C\c1ccccc1 Amb6775189 [0,0,0,0,0,1|2,0,0]=3 1713 B13R1.718 CCC(=O)N\N=C\c1ccncc1 Amb6775477 [0,0,0,0,0,1|3,0,0]=4 1714 B13R1.718 CCC(=O)OCCc1ccccc1 Amb6357956 [0,0,0,0,0,1|1,0,2]=4 1715 B13R1.718 CCC(=O)\C=N\Nc1ccccc1 Amb25979225 [0,0,0,0,0,1|2,0,0]=3 1716 B13R1.718 CNC(=O)CCCc1ccccc1 Amb3886751 [0,0,0,0,0,1|1,0,2]=4 1717 B13R1.718 CNC(=O)CNCc1ccccc1 Amb32674790 [0,0,0,0,0,1|1,0,2]=4 1718 B13R1.718 CNC(=O)CNCc1ccccc1 Amb6707691 [0,0,0,0,0,1|1,0,2]=4 1719 B13R1.718 CNC(=O)C\C=C\c1ccccc1 Amb25857434 [0,0,0,0,0,1|1,0,0]=2 1720 B13R1.718 CNC(=O)NCCc1ccccc1 Amb2132768 [0,0,0,0,0,1|1,0,2]=4 1721 B13R1.718 CNC(=O)NOCc1ccccc1 Amb27463347 [0,0,0,0,0,1|2,0,1]=4 1722 B13R1.718 CNC(=O)N\N=C\c1ccccn1 Amb27401175 [0,0,0,0,0,1|3,0,0]=4 1723 B13R1.718 CNC(=O)N\N=C\c1ccncc1 Amb27224810 [0,0,0,0,0,1|3,0,0]=4 1724 B13R1.718 CNC(=O)O\N=C\c1ccccc1 Amb27827371 [0,0,0,0,0,1|2,0,0]=3 1725 B13R1.718 CNC(=O)\C=C\Sc1ccccc1 Amb27443864 [0,0,0,0,0,1|1,0,0]=2 1726 B13R1.718 CNC(=O)\C=N\Nc1ccccc1 Amb24444432 [0,0,0,0,0,1|2,0,0]=3 1727 B13R1.718 COC(=O)C#CCc1ccccn1 Amb27610103 [0,0,0,0,0,1|1,0,2]=4 1728 B13R1.718 COC(=O)C=C=Cc1ccccc1 Amb27635444 [0,0,0,0,0,1|0,0,0]=1 1729 B13R1.718 COC(=O)CCCc1ccccc1 Amb2720838 [0,0,0,0,0,1|0,0,2]=3 1730 B13R1.718 COC(=O)CCCc1cccnc1 Amb24066737 [0,0,0,0,0,1|1,0,2]=4 1731 B13R1.718 COC(=O)CCCc1ccncc1 Amb19888651 [0,0,0,0,0,1|1,0,2]=4 1732 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,0,0,0,0,1|0,0,2]=3 1733 B13R1.718 COC(=O)CCNc1ccccn1 Amb1243208 [0,0,0,0,0,1|1,0,2]=4 1734 B13R1.718 COC(=O)CCNc1cccnc1 Amb18933308 [0,0,0,0,0,1|1,0,2]=4 1735 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,0,0,0,0,1|0,0,2]=3 1736 B13R1.718 COC(=O)CNCc1ccccc1 Amb6687129 [0,0,0,0,0,1|0,0,2]=3 1737 B13R1.718 COC(=O)CNCc1ccccn1 Amb6687148 [0,0,0,0,0,1|1,0,2]=4 1738 B13R1.718 COC(=O)CNCc1cccnc1 Amb6686979 [0,0,0,0,0,1|1,0,2]=4 1739 B13R1.718 COC(=O)CNCc1ccncc1 Amb6686985 [0,0,0,0,0,1|1,0,2]=4 1740 B13R1.718 COC(=O)COCc1ccccc1 Amb7755418 [0,0,0,0,0,1|0,0,2]=3 1741 B13R1.718 COC(=O)CSCc1ccccn1 Amb29848210 [0,0,0,0,0,1|1,0,2]=4 1742 B13R1.718 COC(=O)NNCc1ccccc1 Amb27972025 [0,0,0,0,0,1|1,0,1]=3 1743 B13R1.718 COC(=O)NOCc1ccccc1 Amb25359225 [0,0,0,0,0,1|1,0,1]=3 1744 B13R1.718 COC(=O)N\C=C\c1cccnc1 Amb27751361 [0,0,0,0,0,1|1,0,0]=2 1745 B13R1.718 COC(=O)N\N=C\c1ccccc1 Amb2411289 [0,0,0,0,0,1|1,0,0]=2 1746 B13R1.718 COC(=O)N\N=C\c1ccncc1 Amb6558121 [0,0,0,0,0,1|2,0,0]=3 1747 B13R1.718 COC(=O)\C=C\Cc1ccccc1 Amb30647398 [0,0,0,0,0,1|0,0,0]=1 1748 B13R1.718 COC(=O)\C=C\Nc1ccccc1 Amb2386662 [0,0,0,0,0,1|0,0,0]=1 1749 B13R1.718 COC(=O)\C=C\Sc1ccccc1 Amb33473610 [0,0,0,0,0,1|0,0,0]=1 1750 B13R1.718 COC(=O)\C=N\Nc1ccccc1 Amb28131043 [0,0,0,0,0,1|1,0,0]=2 1751 B13R1.718 CSC(=S)N\N=C\c1ccccc1 Amb1148482 [0,0,0,0,0,1|1,2,0]=4 1752 B13R1.718 CS\C(N)=N\N=C\c1ccccc1 Amb25233191 [0,0,0,0,0,1|2,1,0]=4 1753 B13R1.718 C\C(=C/C=C/c1ccccc1)CBr Amb28140679 [0,0,0,0,0,1|3,0,0]=4 1754 B13R1.718 C\C(=C/C=C/c1ccccc1)CCl Amb27455495 [0,0,0,0,0,1|3,0,0]=4 1755 B13R1.718 C\C(C=O)=C/C=C/c1ccccc1 Amb18126919 [0,0,0,0,0,1|3,0,0]=4 1756 B13R1.718 NCC(=O)\C=N\Nc1ccccc1 Amb27804018 [0,0,0,0,0,1|3,0,0]=4 1757 B13R1.718 NNC(=O)C\C=C\c1ccccc1 Amb24540797 [0,0,0,0,0,1|2,0,0]=3 1758 B13R1.718 NNC(=O)N\N=C\c1ccccc1 Amb20093354 [0,0,0,0,0,1|3,0,0]=4 1759 B13R1.718 NNC(=O)\C=C\Sc1ccccc1 Amb27163745 [0,0,0,0,0,1|2,0,0]=3 1760 B13R1.718 O=C(CCCc1ccccc1)O[Na] Amb8393622 [0,0,0,0,0,1|1,0,2]=4 1761 B13R1.718 O=C(\C=C\Sc1ccccc1)NO Amb28182995 [0,0,0,0,0,1|2,0,0]=3 1762 B13R1.718 O=C(\C=N\Nc1ccccc1)CCl Amb27187376 [0,0,0,0,0,1|3,0,0]=4 1763 B13R1.718 O=C\C(F)=C/C=C/c1ccccc1 Amb27629668 [0,0,0,0,0,1|3,0,0]=4 1764 B13R1.718 O=C\C(F)=C\C=C\c1ccccc1 Amb27974016 [0,0,0,0,0,1|3,0,0]=4 1765 B13R1.718 O=C\C(O)=C\C=C\c1ccccc1 Amb18127198 [0,0,0,0,0,1|2,0,1]=4 1766 B10R0.71 C\C=C\C=C\C=C\C=C\C=O Amb25384138 [1,0,1,0,0,0|2,0,0]=4 1767 B10R0.74 C\C=C\C=C\C=C\C(=O)CC Amb27672615 [1,0,1,0,0,0|1,0,1]=4 1768 B10R0.108 C\C=C\C(=O)\C=C\C(=O)OC Amb27673776 [1,0,1,0,0,0|1,0,1]=4 1769 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [2,0,0,0,0,0|1,0,1]=4 1770 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [2,0,0,0,0,0|1,0,1]=4 1771 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [2,0,0,0,0,0|2,0,0]=4 1772 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [2,0,0,0,0,0|2,0,0]=4 1773 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [2,0,0,0,0,0|0,0,2]=4 1774 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [2,0,0,0,0,0|0,0,1]=3 1775 B10R1.17 C=C\C=C\c1cccnc1 Amb27976078 [2,0,0,0,0,0|1,0,1]=4 1776 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [2,0,0,0,0,0|0,0,1]=3 1777 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [2,0,0,0,0,0|1,0,1]=4 1778 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [2,0,0,0,0,0|0,0,1]=3 1779 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [2,0,0,0,0,0|1,0,1]=4 1780 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [2,0,0,0,0,0|1,0,1]=4 1781 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [2,0,0,0,0,0|1,0,1]=4 1782 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [2,0,0,0,0,0|2,0,0]=4 1783 B10R1.17 COCCc1ccccc1 Amb4020014 [2,0,0,0,0,0|0,0,2]=4 1784 B10R1.17 COCOc1ccccc1 Amb2608594 [2,0,0,0,0,0|1,0,1]=4 1785 B10R1.17 CONCc1ccccc1 Amb26432339 [2,0,0,0,0,0|1,0,1]=4 1786 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [2,0,0,0,0,0|1,0,0]=3 1787 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [2,0,0,0,0,0|0,0,0]=2 1788 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [2,0,0,0,0,0|1,0,0]=3 1789 B10R1.17 CO\N=C\c1ccccn1 Amb24719324 [2,0,0,0,0,0|2,0,0]=4 1790 B10R1.17 CO\N=C\c1cccnc1 Amb26847062 [2,0,0,0,0,0|2,0,0]=4 1791 B10R1.17 CO\N=C\c1ccncc1 Amb25173617 [2,0,0,0,0,0|2,0,0]=4 1792 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [2,0,0,0,0,0|0,1,0]=3 1793 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [2,0,0,0,0,0|1,0,1]=4 1794 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [2,0,0,0,0,0|0,0,1]=3 1795 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [2,0,0,0,0,0|1,0,0]=3 1796 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [2,0,0,0,0,0|2,0,0]=4 1797 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [2,0,0,0,0,0|1,0,1]=4 1798 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [2,0,0,0,0,0|2,0,0]=4 1799 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [2,0,0,0,0,0|1,0,1]=4 1800 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [2,0,0,0,0,0|1,0,1]=4 1801 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [2,0,0,0,0,0|1,0,1]=4 1802 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [2,0,0,0,0,0|1,0,1]=4 1803 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [2,0,0,0,0,0|1,0,1]=4 1804 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [2,0,0,0,0,0|1,0,1]=4 1805 B10R1.17 O=C=C\C=C1/C=CC=CN1 Amb27779702 [2,0,0,0,0,0|1,0,1]=4 1806 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [2,0,0,0,0,0|0,0,2]=4 1807 B10R1.17 O=CCCc1ccccc1 Amb2720576 [2,0,0,0,0,0|0,0,2]=4 1808 B10R1.17 O=CCOc1ccccc1 Amb3465095 [2,0,0,0,0,0|1,0,1]=4 1809 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|1,0,1]=4 1810 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,1]=4 1811 B10R1.17 O=CNNc1ccccc1 Amb2721099 [2,0,0,0,0,0|2,0,0]=4 1812 B10R1.17 O=COCc1ccccc1 Amb4605893 [2,0,0,0,0,0|1,0,1]=4 1813 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [2,0,0,0,0,0|0,0,2]=4 1814 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|0,0,0]=2 1815 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [2,0,0,0,0,0|0,0,0]=2 1816 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [2,0,0,0,0,0|1,0,0]=3 1817 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [2,0,0,0,0,0|1,0,0]=3 1818 B10R1.17 O=C\C=C\c1cccnn1 Amb18642956 [2,0,0,0,0,0|2,0,0]=4 1819 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [2,0,0,0,0,0|1,0,0]=3 1820 B10R1.17 O=C\C=C\c1ccncn1 Amb18642951 [2,0,0,0,0,0|2,0,0]=4 1821 B10R1.17 O=C\C=C\c1cnccn1 Amb35600870 [2,0,0,0,0,0|2,0,0]=4 1822 B10R1.17 O=C\C=C\c1cncnc1 Amb25130263 [2,0,0,0,0,0|2,0,0]=4 1823 B10R1.17 O=C\C=C\c1ncccn1 Amb33270347 [2,0,0,0,0,0|2,0,0]=4 1824 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [2,0,0,0,0,0|1,0,1]=4 1825 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [2,0,0,0,0,0|1,0,1]=4 1826 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [2,0,0,0,0,0|0,0,1]=3 1827 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [2,0,0,0,0,0|1,0,1]=4 1828 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [2,0,0,0,0,0|1,0,1]=4 1829 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [2,0,0,0,0,0|1,0,1]=4 1830 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [2,0,0,0,0,0|1,0,1]=4 1831 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [2,0,0,0,0,0|2,0,0]=4 1832 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [2,0,0,0,0,0|0,1,1]=4 1833 B12R1.1 CCC\C=C\c1ccc(Cl)cc1 Amb10566844 [1,1,0,0,0,0|1,0,1]=4 1834 B12R1.1 CCC\C=C\c1ccc(N)cc1 Amb27644670 [1,1,0,0,0,0|1,0,1]=4 1835 B12R1.1 CNC\C=C\c1ccc(Br)cc1 Amb23555646 [1,1,0,0,0,0|1,0,1]=4 1836 B12R1.1 CNC\C=C\c1ccc(C)cc1 Amb23442830 [1,1,0,0,0,0|1,0,1]=4 1837 B12R1.1 CNC\C=C\c1ccc(Cl)cc1 Amb23555634 [1,1,0,0,0,0|1,0,1]=4 1838 B12R1.1 CNC\C=C\c1ccc(F)cc1 Amb33136447 [1,1,0,0,0,0|1,0,1]=4 1839 B12R1.1 C\C=C\C=C\c1ccc(O)cc1 Amb28285927 [1,1,0,0,0,0|1,0,0]=3 1840 B12R1.1 C\C=C\C=N\c1ccc(O)cc1 Amb27626909 [1,1,0,0,0,0|2,0,0]=4 1841 B12R1.1 NOC\C=C\c1ccc(F)cc1 Amb33203068 [1,1,0,0,0,0|1,0,1]=4 1842 B12R1.1 N\N=C\C=C\c1ccc(F)cc1 Amb28078412 [1,1,0,0,0,0|2,0,0]=4 1843 B12R1.8 BrCCC\C=C\c1ccccc1 Amb33081215 [1,1,0,0,0,0|1,0,1]=4 1844 B12R1.8 BrC\C=C\C=C\c1ccccc1 Amb8394285 [1,1,0,0,0,0|1,0,0]=3 1845 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [1,1,0,0,0,0|1,0,1]=4 1846 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [1,1,0,0,0,0|1,0,1]=4 1847 B12R1.8 CCNC\C=C\c1ccccc1 Amb6864716 [1,1,0,0,0,0|1,0,1]=4 1848 B12R1.8 CCNC\C=C\c1ccccc1 Amb837817 [1,1,0,0,0,0|1,0,1]=4 1849 B12R1.8 CNCC\C=C\c1ccccc1 Amb32954379 [1,1,0,0,0,0|1,0,1]=4 1850 B12R1.8 CO\N=C\C=C\c1ccccc1 Amb27396673 [1,1,0,0,0,0|0,0,0]=2 1851 B12R1.8 CO\N=C\C=C\c1ccncc1 Amb27809416 [1,1,0,0,0,0|1,0,0]=3 1852 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [1,1,0,0,0,0|1,0,1]=4 1853 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [1,1,0,0,0,0|1,0,0]=3 1854 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [1,1,0,0,0,0|1,0,1]=4 1855 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [1,1,0,0,0,0|0,0,2]=4 1856 B12R1.8 O=C\C=C\C=C\c1ccccc1 Amb17593956 [1,1,0,0,0,0|1,0,1]=4 1857 B12R1.8 OCC#C\C=C\c1ccccc1 Amb27977863 [1,1,0,0,0,0|1,0,1]=4 1858 B12R1.8 OCCC=C=Cc1ccccc1 Amb27972290 [1,1,0,0,0,0|1,0,1]=4 1859 B12R1.8 OCCC\C=C\c1ccccc1 Amb33082089 [1,1,0,0,0,0|1,0,1]=4 1860 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [1,1,0,0,0,0|2,0,0]=4 1861 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [1,1,0,0,0,0|1,0,0]=3 1862 B12R1.8 SCCC\C=C\c1ccccc1 Amb33081102 [1,1,0,0,0,0|1,0,1]=4 1863 B12R1.28 CNC\C=C\c1cccc(Br)c1 Amb26547783 [1,1,0,0,0,0|1,0,1]=4 1864 B12R1.28 CNC\C=C\c1cccc(C)c1 Amb23442961 [1,1,0,0,0,0|1,0,1]=4 1865 B12R1.28 CNC\C=C\c1cccc(F)c1 Amb23442889 [1,1,0,0,0,0|1,0,1]=4 1866 B12R1.30 C#C\C=C\C(=O)c1ccccc1 Amb8389984 [1,1,0,0,0,0|1,0,1]=4 1867 B12R1.30 C=C\C=C\C(=O)c1ccccc1 Amb27267134 [1,1,0,0,0,0|1,0,1]=4 1868 B12R1.30 CC=C=CC(=O)c1ccccc1 Amb28144211 [1,1,0,0,0,0|1,0,1]=4 1869 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [1,1,0,0,0,0|1,0,1]=4 1870 B12R1.30 CCN\C=C(/N)c1ccccc1 Amb27668811 [1,1,0,0,0,0|2,0,0]=4 1871 B12R1.30 CC\C=C\C(N)c1ccccc1 Amb27790820 [1,1,0,0,0,0|1,0,1]=4 1872 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,1,0,0,0,0|1,0,1]=4 1873 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [1,1,0,0,0,0|1,0,1]=4 1874 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [1,1,0,0,0,0|1,0,1]=4 1875 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [1,1,0,0,0,0|1,0,1]=4 1876 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [1,1,0,0,0,0|1,0,0]=3 1877 B12R1.30 CN\C=C\C(=S)c1ccccc1 Amb27462236 [1,1,0,0,0,0|1,0,0]=3 1878 B12R1.30 COCCC(=O)c1ccccc1 Amb33538573 [1,1,0,0,0,0|0,0,2]=4 1879 B12R1.30 CO\N=C\[C@H](O)c1ccccc1 Amb27766548 [1,1,0,0,0,0|1,0,1]=4 1880 B12R1.30 CS\C=C\C(=O)c1ccccc1 Amb27973048 [1,1,0,0,0,0|0,1,0]=3 1881 B12R1.30 C\C=C\NC(=O)c1ccccc1 Amb27800283 [1,1,0,0,0,0|2,0,0]=4 1882 B12R1.30 O=C(\C=C\CCl)c1ccccc1 Amb27983598 [1,1,0,0,0,0|2,0,0]=4 1883 B12R1.30 O=C(\C=C\O[Na])c1ccccc1 Amb2370899 [1,1,0,0,0,0|1,0,0]=3 1884 B12R1.32 CC(=C\c1ccccc1)\C=C\N Amb27788151 [1,1,0,0,0,0|2,0,0]=4 1885 B12R1.32 CC(\C=N\O)=C/c1ccccc1 Amb4036028 [1,1,0,0,0,0|2,0,0]=4 1886 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [1,1,0,0,0,0|1,0,1]=4 1887 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [1,1,0,0,0,0|1,0,1]=4 1888 B12R1.32 COCC(=O)Cc1ccccc1 Amb9665963 [1,1,0,0,0,0|0,0,2]=4 1889 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [1,1,0,0,0,0|1,0,1]=4 1890 B12R1.32 CONC(=N)Nc1ccccc1 Amb27395144 [1,1,0,0,0,0|2,0,0]=4 1891 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [1,1,0,0,0,0|1,0,1]=4 1892 B12R1.32 CO\N=C(\N)Cc1ccccc1 Amb27827154 [1,1,0,0,0,0|1,0,1]=4 1893 B12R1.32 C\C(=C/c1ccccc1)CON Amb33476431 [1,1,0,0,0,0|1,0,1]=4 1894 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [1,1,0,0,0,0|2,0,0]=4 1895 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [1,1,0,0,0,0|2,0,0]=4 1896 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [1,1,0,0,0,0|2,0,0]=4 1897 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,1,0,0,0,0|1,0,1]=4 1898 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [1,1,0,0,0,0|2,0,0]=4 1899 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [1,1,0,0,0,0|2,0,0]=4 1900 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [1,1,0,0,0,0|1,0,1]=4 1901 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [1,1,0,0,0,0|2,0,0]=4 1902 B12R1.252 CC(=O)\C=C\Oc1ccccc1 Amb26528572 [1,1,0,0,0,0|2,0,0]=4 1903 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb35789855 [1,1,0,0,0,0|2,0,0]=4 1904 B12R1.252 CC(Br)C\C=C\c1ccccc1 Amb33080969 [1,1,0,0,0,0|1,0,1]=4 1905 B12R1.252 CC(C)=C\C=C/c1ccccn1 Amb22546609 [1,1,0,0,0,0|2,0,0]=4 1906 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb28143072 [1,1,0,0,0,0|1,0,0]=3 1907 B12R1.252 CC(Cl)\C=C\Sc1ccccc1 Amb27401898 [1,1,0,0,0,0|2,0,0]=4 1908 B12R1.252 CC(N)C\C=C\c1ccccc1 Amb25970039 [1,1,0,0,0,0|1,0,1]=4 1909 B12R1.252 CC(N)\C=C\Cc1ccccc1 Amb32953143 [1,1,0,0,0,0|1,0,1]=4 1910 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb32954303 [1,1,0,0,0,0|1,0,1]=4 1911 B12R1.252 CC(O)\C=C\Sc1ccccc1 Amb28294251 [1,1,0,0,0,0|2,0,0]=4 1912 B12R1.252 CN(O)C\C=C\c1ccccc1 Amb33081135 [1,1,0,0,0,0|1,0,1]=4 1913 B12R1.252 C[C@@H](N)C\C=C\c1ccccc1 Amb33080763 [1,1,0,0,0,0|1,0,1]=4 1914 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb32954522 [1,1,0,0,0,0|1,0,1]=4 1915 B12R1.252 C[C@H](N)C\C=C\c1ccccc1 Amb33080767 [1,1,0,0,0,0|1,0,1]=4 1916 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb32954836 [1,1,0,0,0,0|1,0,1]=4 1917 B12R1.252 C\C(N)=N\C=C\c1ccccc1 Amb28457490 [1,1,0,0,0,0|2,0,0]=4 1918 B12R1.267 CCO\C=C\c1ccccc1Cl Amb24603799 [1,1,0,0,0,0|2,0,0]=4 1919 B12R1.267 CNC\C=C\c1ccccc1C Amb23442941 [1,1,0,0,0,0|1,0,1]=4 1920 B12R1.267 CNC\C=C\c1ccccc1F Amb23442841 [1,1,0,0,0,0|1,0,1]=4 1921 B12R1.267 CO\N=C\Cc1ccccc1F Amb28138336 [1,1,0,0,0,0|1,0,1]=4 1922 B12R1.267 CO\N=C\Nc1ccccc1C Amb27205477 [1,1,0,0,0,0|2,0,0]=4 1923 B12R1.267 C\C=C/C=C\c1ccccc1O Amb28122369 [1,1,0,0,0,0|1,0,0]=3 1924 B12R1.21 CC(=O)CCc1ccc(Br)cc1 Amb5740059 [1,1,0,0,0,0|0,0,2]=4 1925 B12R1.21 CC(=O)CCc1ccc(C)cc1 Amb5740050 [1,1,0,0,0,0|0,0,2]=4 1926 B12R1.21 CC(=O)CCc1ccc(Cl)cc1 Amb5740058 [1,1,0,0,0,0|0,0,2]=4 1927 B12R1.21 CC(=O)CCc1ccc(F)cc1 Amb5740057 [1,1,0,0,0,0|0,0,2]=4 1928 B12R1.21 CC(=O)CCc1ccc(I)cc1 Amb26325783 [1,1,0,0,0,0|0,0,2]=4 1929 B12R1.21 CC(=O)CCc1ccc(N)cc1 Amb27637738 [1,1,0,0,0,0|0,0,2]=4 1930 B12R1.21 CC(=O)CCc1ccc(O)cc1 Amb533055 [1,1,0,0,0,0|0,0,2]=4 1931 B12R1.21 CC(=O)COc1ccc(Cl)cc1 Amb1094739 [1,1,0,0,0,0|1,0,1]=4 1932 B12R1.21 CC(=O)COc1ccc(F)cc1 Amb9269853 [1,1,0,0,0,0|1,0,1]=4 1933 B12R1.21 CC(=O)COc1ccc(I)cc1 Amb26363908 [1,1,0,0,0,0|1,0,1]=4 1934 B12R1.21 CC(=O)COc1ccc(N)cc1 Amb17110083 [1,1,0,0,0,0|1,0,1]=4 1935 B12R1.21 CC(=O)CSc1ccc(Br)cc1 Amb2608948 [1,1,0,0,0,0|1,0,1]=4 1936 B12R1.21 CC(=O)CSc1ccc(C)cc1 Amb2725052 [1,1,0,0,0,0|1,0,1]=4 1937 B12R1.21 CC(=O)CSc1ccc(Cl)cc1 Amb2686419 [1,1,0,0,0,0|1,0,1]=4 1938 B12R1.21 CC(=O)CSc1ccc(F)cc1 Amb3429089 [1,1,0,0,0,0|1,0,1]=4 1939 B12R1.21 CC(=O)CSc1ccc(N)cc1 Amb28255271 [1,1,0,0,0,0|1,0,1]=4 1940 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [1,1,0,0,0,0|1,0,1]=4 1941 B12R1.21 CC(=O)NCc1ccc(C)cc1 Amb3358096 [1,1,0,0,0,0|1,0,1]=4 1942 B12R1.21 CC(=O)NCc1ccc(Cl)cc1 Amb3094821 [1,1,0,0,0,0|1,0,1]=4 1943 B12R1.21 CC(=O)NCc1ccc(F)cc1 Amb8020832 [1,1,0,0,0,0|1,0,1]=4 1944 B12R1.21 CC(=O)NCc1ccc(N)cc1 Amb4017045 [1,1,0,0,0,0|1,0,1]=4 1945 B12R1.21 CC(=O)NCc1ccc(O)cc1 Amb10549495 [1,1,0,0,0,0|1,0,1]=4 1946 B12R1.21 CC(=O)NNc1ccc(Br)cc1 Amb1040272 [1,1,0,0,0,0|2,0,0]=4 1947 B12R1.21 CC(=O)NNc1ccc(F)cc1 Amb4362485 [1,1,0,0,0,0|2,0,0]=4 1948 B12R1.21 CC(=O)NNc1ccc(I)cc1 Amb4362486 [1,1,0,0,0,0|2,0,0]=4 1949 B12R1.21 CC(=O)OCc1ccc(Cl)cc1 Amb2421366 [1,1,0,0,0,0|1,0,1]=4 1950 B12R1.21 CC(=O)ON=C1C=CC(=O)C=C1 Amb27175819 [1,1,0,0,0,0|2,0,0]=4 1951 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [1,1,0,0,0,0|1,0,1]=4 1952 B12R1.21 CC(=O)SCc1ccc(O)cc1 Amb27256344 [1,1,0,0,0,0|1,0,1]=4 1953 B12R1.21 CC(=O)\C=C\c1cc[n+](C)cc1 Amb4248214 [1,1,0,0,0,0|1,0,0]=3 1954 B12R1.21 CC(=O)\C=C\c1ccc(Br)cc1 Amb534305 [1,1,0,0,0,0|0,0,0]=2 1955 B12R1.21 CC(=O)\C=C\c1ccc(Br)cn1 Amb27803623 [1,1,0,0,0,0|1,0,0]=3 1956 B12R1.21 CC(=O)\C=C\c1ccc(Br)nc1 Amb33388886 [1,1,0,0,0,0|1,0,0]=3 1957 B12R1.21 CC(=O)\C=C\c1ccc(C)cc1 Amb4421820 [1,1,0,0,0,0|0,0,0]=2 1958 B12R1.21 CC(=O)\C=C\c1ccc(C)cn1 Amb24527877 [1,1,0,0,0,0|1,0,0]=3 1959 B12R1.21 CC(=O)\C=C\c1ccc(C)nc1 Amb27487978 [1,1,0,0,0,0|1,0,0]=3 1960 B12R1.21 CC(=O)\C=C\c1ccc(Cl)cc1 Amb33870385 [1,1,0,0,0,0|0,0,0]=2 1961 B12R1.21 CC(=O)\C=C\c1ccc(Cl)cn1 Amb33223976 [1,1,0,0,0,0|1,0,0]=3 1962 B12R1.21 CC(=O)\C=C\c1ccc(Cl)nc1 Amb33261607 [1,1,0,0,0,0|1,0,0]=3 1963 B12R1.21 CC(=O)\C=C\c1ccc(F)cc1 Amb3428861 [1,1,0,0,0,0|0,0,0]=2 1964 B12R1.21 CC(=O)\C=C\c1ccc(F)cn1 Amb33317373 [1,1,0,0,0,0|1,0,0]=3 1965 B12R1.21 CC(=O)\C=C\c1ccc(F)nc1 Amb33425140 [1,1,0,0,0,0|1,0,0]=3 1966 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [1,1,0,0,0,0|0,0,0]=2 1967 B12R1.21 CC(=O)\C=C\c1ccc(O)cc1 Amb6357952 [1,1,0,0,0,0|0,0,0]=2 1968 B12R1.21 CC(=O)\C=C\c1cnc(C)cn1 Amb33376977 [1,1,0,0,0,0|2,0,0]=4 1969 B12R1.21 CC(=O)\C=C\c1ncc(Br)cn1 Amb33335104 [1,1,0,0,0,0|2,0,0]=4 1970 B12R1.21 CC(=O)\C=C\c1ncc(F)cn1 Amb26075862 [1,1,0,0,0,0|2,0,0]=4 1971 B12R1.21 CC(=O)\N=C/c1ccc(Cl)cc1 Amb24073008 [1,1,0,0,0,0|1,0,0]=3 1972 B12R1.21 CC(Br)\C=C\c1ccc(Br)cc1 Amb27416893 [1,1,0,0,0,0|1,0,1]=4 1973 B12R1.21 CC(Br)\C=C\c1ccc(I)cc1 Amb27659558 [1,1,0,0,0,0|1,0,1]=4 1974 B12R1.21 CC(C)\C=C\c1ccc(O)cc1 Amb18645701 [1,1,0,0,0,0|1,0,1]=4 1975 B12R1.21 CC(N)\C=C\c1ccc(Br)cc1 Amb33450910 [1,1,0,0,0,0|1,0,1]=4 1976 B12R1.21 CC(N)\C=C\c1ccc(Cl)cc1 Amb27759797 [1,1,0,0,0,0|1,0,1]=4 1977 B12R1.21 CC(N)\C=C\c1ccc(F)cc1 Amb27663585 [1,1,0,0,0,0|1,0,1]=4 1978 B12R1.21 CC(N)\C=C\c1ccc(I)cc1 Amb28146161 [1,1,0,0,0,0|1,0,1]=4 1979 B12R1.21 CC(N)\C=C\c1ccc(O)cc1 Amb33361052 [1,1,0,0,0,0|1,0,1]=4 1980 B12R1.21 CC(O)\C=C\c1ccc(Br)cc1 Amb26842748 [1,1,0,0,0,0|0,0,2]=4 1981 B12R1.21 CC(O)\C=C\c1ccc(Cl)cc1 Amb26363210 [1,1,0,0,0,0|0,0,2]=4 1982 B12R1.21 CC(O)\C=C\c1ccc(F)cc1 Amb26392384 [1,1,0,0,0,0|0,0,2]=4 1983 B12R1.21 CC(O)\C=C\c1ccc(N)cc1 Amb35622609 [1,1,0,0,0,0|0,0,2]=4 1984 B12R1.21 CN(C)\C=C\c1ccc(Cl)cc1 Amb27616221 [1,1,0,0,0,0|2,0,0]=4 1985 B12R1.21 CS(=O)\C=C/c1ccc(Cl)cc1 Amb24309137 [1,1,0,0,0,0|1,0,0]=3 1986 B12R1.21 CS(=O)\N=C\c1ccc(Br)cc1 Amb35681670 [1,1,0,0,0,0|2,0,0]=4 1987 B12R1.21 CS(=O)\N=C\c1ccc(Cl)cc1 Amb35681671 [1,1,0,0,0,0|2,0,0]=4 1988 B12R1.21 CS(=O)\N=C\c1ccc(F)cc1 Amb35681675 [1,1,0,0,0,0|2,0,0]=4 1989 B12R1.21 CS(=O)\N=C\c1ccc(I)cc1 Amb35692841 [1,1,0,0,0,0|2,0,0]=4 1990 B12R1.21 CS(=O)\N=C\c1ccc(O)cc1 Amb35681664 [1,1,0,0,0,0|2,0,0]=4 1991 B12R1.21 C[C@@H](N)\C=C\c1ccc(Cl)cc1 Amb27880882 [1,1,0,0,0,0|1,0,1]=4 1992 B12R1.21 C[C@@H](N)\C=C\c1ccc(F)cc1 Amb33326717 [1,1,0,0,0,0|1,0,1]=4 1993 B12R1.21 C[C@@H](O)\C=C\c1ccc(F)cc1 Amb33474738 [1,1,0,0,0,0|0,0,2]=4 1994 B12R1.21 C[C@H](N)\C=C\c1ccc(F)cc1 Amb33326714 [1,1,0,0,0,0|1,0,1]=4 1995 B12R1.21 C[C@H](O)\C=C\c1ccc(Br)cc1 Amb27495626 [1,1,0,0,0,0|0,0,2]=4 1996 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb33080147 [1,1,0,0,0,0|0,0,2]=4 1997 B12R1.21 Cc1ccc(C#CC(=O)O)cc1 Amb17138496 [1,1,0,0,0,0|0,0,2]=4 1998 B12R1.21 Cc1ccc(CCC(=O)O)cc1 Amb1225383 [1,1,0,0,0,0|0,0,2]=4 1999 B12R1.21 Cc1ccc(NCC(=O)O)cc1 Amb1106469 [1,1,0,0,0,0|1,0,1]=4 2000 B12R1.21 Cc1ccc(OCC(=O)O)cc1 Amb6336447 [1,1,0,0,0,0|1,0,1]=4 2001 B12R1.21 Cc1ccc(SCC(=O)O)cc1 Amb1197696 [1,1,0,0,0,0|1,0,1]=4 2002 B12R1.21 Cc1ccc(\C=C/C(=O)O)cc1 Amb27474899 [1,1,0,0,0,0|0,0,0]=2 2003 B12R1.21 Cc1ccc(\C=C/C(N)=O)cc1 Amb27974609 [1,1,0,0,0,0|1,0,0]=3 2004 B12R1.21 Cc1ccc(\C=C/[N+](=O)[O-])cc1 Amb2714244 [1,1,0,0,0,0|1,0,1]=4 2005 B12R1.21 Cc1ccc(\C=C\B(O)O)cc1 Amb20671353 [1,1,0,0,0,0|1,0,1]=4 2006 B12R1.21 Cc1ccc(\C=C\C(=O)Cl)cc1 Amb16230247 [1,1,0,0,0,0|1,0,0]=3 2007 B12R1.21 Cc1ccc(\C=C\C(=O)O)cc1 Amb8513247 [1,1,0,0,0,0|0,0,0]=2 2008 B12R1.21 Cc1ccc(\C=C\C(=O)O)cn1 Amb18645813 [1,1,0,0,0,0|1,0,0]=3 2009 B12R1.21 Cc1ccc(\C=C\C(=O)O)cn1 Amb28555739 [1,1,0,0,0,0|1,0,0]=3 2010 B12R1.21 Cc1ccc(\C=C\C(=O)O)nc1 Amb30584979 [1,1,0,0,0,0|1,0,0]=3 2011 B12R1.21 Cc1ccc(\C=C\C(=O)O)nn1 Amb33470102 [1,1,0,0,0,0|2,0,0]=4 2012 B12R1.21 Cc1ccc(\C=C\C(C)Br)cc1 Amb27854032 [1,1,0,0,0,0|1,0,1]=4 2013 B12R1.21 Cc1ccc(\C=C\C(C)Cl)cc1 Amb27260599 [1,1,0,0,0,0|1,0,1]=4 2014 B12R1.21 Cc1ccc(\C=C\C(C)N)cc1 Amb33359227 [1,1,0,0,0,0|1,0,1]=4 2015 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [1,1,0,0,0,0|0,0,2]=4 2016 B12R1.21 Cc1ccc(\C=C\C(N)=S)cc1 Amb18106294 [1,1,0,0,0,0|1,1,0]=4 2017 B12R1.21 Cc1ccc(\C=C\S(=O)[O-])cc1 Amb32753899 [1,1,0,0,0,0|1,0,1]=4 2018 B12R1.21 Cc1ccc(\C=C\[N+](=O)[O-])cc1 Amb2689571 [1,1,0,0,0,0|1,0,1]=4 2019 B12R1.21 Cc1ccc(\C=N\C(N)=O)cc1 Amb28385505 [1,1,0,0,0,0|2,0,0]=4 2020 B12R1.21 Cc1ccc(\C=N\S(C)=O)cc1 Amb29858778 [1,1,0,0,0,0|2,0,0]=4 2021 B12R1.21 Cc1cnc(\C=C\C(=O)O)cn1 Amb33223719 [1,1,0,0,0,0|2,0,0]=4 2022 B12R1.21 Cc1ncc(\C=C\C(=O)O)cn1 Amb12805675 [1,1,0,0,0,0|2,0,0]=4 2023 B12R1.21 N=C(N)\C=C\c1ccc(F)cc1 Amb24567885 [1,1,0,0,0,0|2,0,0]=4 2024 B12R1.21 NC(=O)\C=C/c1ccc(Cl)cc1 Amb17142990 [1,1,0,0,0,0|1,0,0]=3 2025 B12R1.21 NC(=O)\C=C/c1ccc(F)nc1 Amb28437309 [1,1,0,0,0,0|2,0,0]=4 2026 B12R1.21 NC(=O)\C=C/c1ccc(O)nc1 Amb27640274 [1,1,0,0,0,0|2,0,0]=4 2027 B12R1.21 NC(=O)\C=C\c1cc[n+]([O-])cc1 Amb28384346 [1,1,0,0,0,0|2,0,0]=4 2028 B12R1.21 NC(=O)\C=C\c1ccc(Br)cc1 Amb8858355 [1,1,0,0,0,0|1,0,0]=3 2029 B12R1.21 NC(=O)\C=C\c1ccc(Br)nc1 Amb27239372 [1,1,0,0,0,0|2,0,0]=4 2030 B12R1.21 NC(=O)\C=C\c1ccc(Cl)cc1 Amb2720976 [1,1,0,0,0,0|1,0,0]=3 2031 B12R1.21 NC(=O)\C=C\c1ccc(F)cc1 Amb3736713 [1,1,0,0,0,0|1,0,0]=3 2032 B12R1.21 NC(=O)\C=C\c1ccc(I)cc1 Amb24758181 [1,1,0,0,0,0|1,0,0]=3 2033 B12R1.21 NC(=S)\C=C\c1ccc(Cl)cc1 Amb18108355 [1,1,0,0,0,0|1,1,0]=4 2034 B12R1.21 NC(=S)\C=C\c1ccc(F)cc1 Amb18627061 [1,1,0,0,0,0|1,1,0]=4 2035 B12R1.21 Nc1ccc(C#CC(=O)O)cc1 Amb25111179 [1,1,0,0,0,0|0,0,2]=4 2036 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb30588024 [1,1,0,0,0,0|0,0,2]=4 2037 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb6315800 [1,1,0,0,0,0|0,0,2]=4 2038 B12R1.21 Nc1ccc(NCC(=O)O)cc1 Amb18296058 [1,1,0,0,0,0|1,0,1]=4 2039 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb1034889 [1,1,0,0,0,0|1,0,1]=4 2040 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb2608856 [1,1,0,0,0,0|1,0,1]=4 2041 B12R1.21 Nc1ccc(SCC(=O)O)cc1 Amb2684510 [1,1,0,0,0,0|1,0,1]=4 2042 B12R1.21 Nc1ccc(\C=C/C(=O)O)cn1 Amb28134108 [1,1,0,0,0,0|1,0,0]=3 2043 B12R1.21 Nc1ccc(\C=C\B(O)O)cc1 Amb24642812 [1,1,0,0,0,0|1,0,1]=4 2044 B12R1.21 Nc1ccc(\C=C\C(=O)O)cc1 Amb30584953 [1,1,0,0,0,0|0,0,0]=2 2045 B12R1.21 Nc1ccc(\C=C\C(=O)O)cn1 Amb19958812 [1,1,0,0,0,0|1,0,0]=3 2046 B12R1.21 Nc1ncc(\C=C\C(=O)O)cn1 Amb837214 [1,1,0,0,0,0|2,0,0]=4 2047 B12R1.21 O=C(Cl)\C=C\c1ccc(Br)cc1 Amb16230246 [1,1,0,0,0,0|1,0,0]=3 2048 B12R1.21 O=C(Cl)\C=C\c1ccc(Cl)cc1 Amb16186540 [1,1,0,0,0,0|1,0,0]=3 2049 B12R1.21 O=C(Cl)\C=C\c1ccc(F)cc1 Amb2688311 [1,1,0,0,0,0|1,0,0]=3 2050 B12R1.21 O=C(Cl)\C=C\c1ccc(O)cc1 Amb26652435 [1,1,0,0,0,0|1,0,0]=3 2051 B12R1.21 O=C(O)C#Cc1ccc(Br)cc1 Amb2610347 [1,1,0,0,0,0|0,0,2]=4 2052 B12R1.21 O=C(O)C#Cc1ccc(Cl)cc1 Amb10575987 [1,1,0,0,0,0|0,0,2]=4 2053 B12R1.21 O=C(O)C#Cc1ccc(F)cc1 Amb17138570 [1,1,0,0,0,0|0,0,2]=4 2054 B12R1.21 O=C(O)C#Cc1ccc(O)cc1 Amb23569631 [1,1,0,0,0,0|0,0,2]=4 2055 B12R1.21 O=C(O)CCc1ccc(Br)cc1 Amb1220330 [1,1,0,0,0,0|0,0,2]=4 2056 B12R1.21 O=C(O)CCc1ccc(Cl)cc1 Amb1093991 [1,1,0,0,0,0|0,0,2]=4 2057 B12R1.21 O=C(O)CCc1ccc(F)cc1 Amb1214879 [1,1,0,0,0,0|0,0,2]=4 2058 B12R1.21 O=C(O)CCc1ccc(I)cc1 Amb6297807 [1,1,0,0,0,0|0,0,2]=4 2059 B12R1.21 O=C(O)CCc1ccc(O)cc1 Amb533172 [1,1,0,0,0,0|0,0,2]=4 2060 B12R1.21 O=C(O)CCc1ccc(S)cc1 Amb6296145 [1,1,0,0,0,0|0,0,2]=4 2061 B12R1.21 O=C(O)CNc1ccc(Br)cc1 Amb1981434 [1,1,0,0,0,0|1,0,1]=4 2062 B12R1.21 O=C(O)CNc1ccc(Cl)cc1 Amb1486152 [1,1,0,0,0,0|1,0,1]=4 2063 B12R1.21 O=C(O)CNc1ccc(F)cc1 Amb840523 [1,1,0,0,0,0|1,0,1]=4 2064 B12R1.21 O=C(O)CNc1ccc(I)cc1 Amb4598598 [1,1,0,0,0,0|1,0,1]=4 2065 B12R1.21 O=C(O)CNc1ccc(O)cc1 Amb1950558 [1,1,0,0,0,0|1,0,1]=4 2066 B12R1.21 O=C(O)COc1ccc(Br)cc1 Amb6336449 [1,1,0,0,0,0|1,0,1]=4 2067 B12R1.21 O=C(O)COc1ccc(Cl)cc1 Amb1830178 [1,1,0,0,0,0|1,0,1]=4 2068 B12R1.21 O=C(O)COc1ccc(F)cc1 Amb1210357 [1,1,0,0,0,0|1,0,1]=4 2069 B12R1.21 O=C(O)COc1ccc(I)cc1 Amb1152251 [1,1,0,0,0,0|1,0,1]=4 2070 B12R1.21 O=C(O)COc1ccc(O)cc1 Amb2819510 [1,1,0,0,0,0|1,0,1]=4 2071 B12R1.21 O=C(O)CSc1ccc(Br)cc1 Amb1208368 [1,1,0,0,0,0|1,0,1]=4 2072 B12R1.21 O=C(O)CSc1ccc(Cl)cc1 Amb6335201 [1,1,0,0,0,0|1,0,1]=4 2073 B12R1.21 O=C(O)CSc1ccc(F)cc1 Amb1209262 [1,1,0,0,0,0|1,0,1]=4 2074 B12R1.21 O=C(O)CSc1ccc(O)cc1 Amb18291566 [1,1,0,0,0,0|1,0,1]=4 2075 B12R1.21 O=C(O)\C=C/c1ccc(Cl)cc1 Amb2553273 [1,1,0,0,0,0|0,0,0]=2 2076 B12R1.21 O=C(O)\C=C/c1ccc(F)cc1 Amb24712642 [1,1,0,0,0,0|0,0,0]=2 2077 B12R1.21 O=C(O)\C=C\C1=NNC(=O)C=C1 Amb18212061 [1,1,0,0,0,0|2,0,0]=4 2078 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb33714741 [1,1,0,0,0,0|0,0,0]=2 2079 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb8517406 [1,1,0,0,0,0|0,0,0]=2 2080 B12R1.21 O=C(O)\C=C\c1ccc(Br)cn1 Amb24593980 [1,1,0,0,0,0|1,0,0]=3 2081 B12R1.21 O=C(O)\C=C\c1ccc(Br)nc1 Amb33451134 [1,1,0,0,0,0|1,0,0]=3 2082 B12R1.21 O=C(O)\C=C\c1ccc(Cl)cc1 Amb6608688 [1,1,0,0,0,0|0,0,0]=2 2083 B12R1.21 O=C(O)\C=C\c1ccc(Cl)cn1 Amb26946002 [1,1,0,0,0,0|1,0,0]=3 2084 B12R1.21 O=C(O)\C=C\c1ccc(Cl)nc1 Amb22002669 [1,1,0,0,0,0|1,0,0]=3 2085 B12R1.21 O=C(O)\C=C\c1ccc(F)cc1 Amb6608746 [1,1,0,0,0,0|0,0,0]=2 2086 B12R1.21 O=C(O)\C=C\c1ccc(F)cn1 Amb21962831 [1,1,0,0,0,0|1,0,0]=3 2087 B12R1.21 O=C(O)\C=C\c1ccc(F)cn1 Amb33171971 [1,1,0,0,0,0|1,0,0]=3 2088 B12R1.21 O=C(O)\C=C\c1ccc(F)nc1 Amb32645871 [1,1,0,0,0,0|1,0,0]=3 2089 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb24079623 [1,1,0,0,0,0|0,0,0]=2 2090 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb35826750 [1,1,0,0,0,0|0,0,0]=2 2091 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 Amb1207922 [1,1,0,0,0,0|0,0,0]=2 2092 B12R1.21 O=C(O)\C=C\c1ccc(O)nc1 Amb25111280 [1,1,0,0,0,0|1,0,0]=3 2093 B12R1.21 O=C(O)\C=C\c1ncc(Br)cn1 Amb33470108 [1,1,0,0,0,0|2,0,0]=4 2094 B12R1.21 O=C1C=CC(=NCC(=O)O)C=C1 Amb26847942 [1,1,0,0,0,0|1,0,1]=4 2095 B12R1.21 O=N(=O)\C=C\c1ccc(Cl)cc1 Amb20620832 [1,1,0,0,0,0|1,0,1]=4 2096 B12R1.21 O=N(=O)\C=C\c1ccc(O)cc1 Amb2793622 [1,1,0,0,0,0|1,0,1]=4 2097 B12R1.21 O=S(O)\C=C\c1ccc(Br)cc1 Amb32753690 [1,1,0,0,0,0|1,0,0]=3 2098 B12R1.21 O=S([O-])\C=C\c1ccc(Br)cc1 Amb24629048 [1,1,0,0,0,0|1,0,1]=4 2099 B12R1.21 O=S([O-])\C=C\c1ccc(Cl)cc1 Amb32753904 [1,1,0,0,0,0|1,0,1]=4 2100 B12R1.21 O=S([O-])\C=C\c1ccc(F)cc1 Amb25180163 [1,1,0,0,0,0|1,0,1]=4 2101 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Br)cc1 Amb24078358 [1,1,0,0,0,0|1,0,1]=4 2102 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)cc1 Amb33715892 [1,1,0,0,0,0|1,0,1]=4 2103 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)cc1 Amb6374141 [1,1,0,0,0,0|1,0,1]=4 2104 B12R1.21 O=[N+]([O-])\C=C\c1ccc(F)cc1 Amb33513055 [1,1,0,0,0,0|1,0,1]=4 2105 B12R1.21 O=[N+]([O-])\C=C\c1ccc(I)cc1 Amb24641629 [1,1,0,0,0,0|1,0,1]=4 2106 B12R1.21 O=[N+]([O-])\C=C\c1ccc(O)cc1 Amb2459904 [1,1,0,0,0,0|1,0,1]=4 2107 B12R1.21 OB(O)\C=C\c1ccc(Br)cc1 Amb26553688 [1,1,0,0,0,0|1,0,1]=4 2108 B12R1.21 OB(O)\C=C\c1ccc(Cl)cc1 Amb2455790 [1,1,0,0,0,0|1,0,1]=4 2109 B12R1.21 OB(O)\C=C\c1ccc(F)cc1 Amb2455999 [1,1,0,0,0,0|1,0,1]=4 2110 B12R1.43 C=C(C)C(=O)Nc1ccccc1 Amb6384289 [1,1,0,0,0,0|2,0,0]=4 2111 B12R1.43 C=C(C)C(=O)Oc1ccccc1 Amb8394675 [1,1,0,0,0,0|2,0,0]=4 2112 B12R1.43 C=C(C)C(=S)Nc1ccccc1 Amb28243811 [1,1,0,0,0,0|2,0,0]=4 2113 B12R1.43 C=C(Cc1ccccc1)C(=O)Cl Amb27416413 [1,1,0,0,0,0|1,0,1]=4 2114 B12R1.43 C=C(Cc1ccccc1)C(=O)O Amb8393733 [1,1,0,0,0,0|0,0,1]=3 2115 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [1,1,0,0,0,0|1,0,1]=4 2116 B12R1.43 C=C(Cc1ccncc1)C(=O)O Amb27389258 [1,1,0,0,0,0|1,0,1]=4 2117 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [1,1,0,0,0,0|0,0,1]=3 2118 B12R1.43 CC(=O)C(=O)Cc1ccccn1 Amb26923275 [1,1,0,0,0,0|1,0,1]=4 2119 B12R1.43 CC(=O)C(=O)Cc1cccnc1 Amb24556780 [1,1,0,0,0,0|1,0,1]=4 2120 B12R1.43 CC(=O)C(=O)Cc1ccncc1 Amb24555440 [1,1,0,0,0,0|1,0,1]=4 2121 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [1,1,0,0,0,0|1,0,0]=3 2122 B12R1.43 CC(=O)C(=O)Nc1cccnc1 Amb28319843 [1,1,0,0,0,0|2,0,0]=4 2123 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [1,1,0,0,0,0|0,0,2]=4 2124 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [1,1,0,0,0,0|0,0,2]=4 2125 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [1,1,0,0,0,0|1,0,1]=4 2126 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [1,1,0,0,0,0|1,0,1]=4 2127 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [1,1,0,0,0,0|1,0,1]=4 2128 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [1,1,0,0,0,0|0,0,2]=4 2129 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [1,1,0,0,0,0|1,0,1]=4 2130 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [1,1,0,0,0,0|0,0,2]=4 2131 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [1,1,0,0,0,0|0,0,2]=4 2132 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [1,1,0,0,0,0|0,0,2]=4 2133 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [1,1,0,0,0,0|0,0,2]=4 2134 B12R1.43 CC(=O)N(C)Cc1ccccc1 Amb3886652 [1,1,0,0,0,0|1,0,1]=4 2135 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [1,1,0,0,0,0|2,0,0]=4 2136 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [1,1,0,0,0,0|0,0,2]=4 2137 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [1,1,0,0,0,0|0,0,2]=4 2138 B12R1.43 CC(=O)\C(Br)=C\c1ccccc1 Amb17596166 [1,1,0,0,0,0|0,0,0]=2 2139 B12R1.43 CC(=O)\C(C)=C\c1ccccc1 Amb17594004 [1,1,0,0,0,0|0,0,0]=2 2140 B12R1.43 CC(=O)\C(C)=C\c1cccnc1 Amb25373091 [1,1,0,0,0,0|1,0,0]=3 2141 B12R1.43 CC(=O)\C(C)=C\c1cnccn1 Amb35601037 [1,1,0,0,0,0|2,0,0]=4 2142 B12R1.43 CC(=O)\C(C)=N\c1ccccc1 Amb24537849 [1,1,0,0,0,0|1,0,0]=3 2143 B12R1.43 CC(C)=C(C)Sc1ccccc1 Amb28284519 [1,1,0,0,0,0|2,0,0]=4 2144 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [1,1,0,0,0,0|0,0,2]=4 2145 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [1,1,0,0,0,0|1,0,1]=4 2146 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [1,1,0,0,0,0|1,0,1]=4 2147 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [1,1,0,0,0,0|1,0,1]=4 2148 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [1,1,0,0,0,0|0,0,2]=4 2149 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [1,1,0,0,0,0|1,0,1]=4 2150 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [1,1,0,0,0,0|1,0,1]=4 2151 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [1,1,0,0,0,0|1,0,1]=4 2152 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [1,1,0,0,0,0|0,0,2]=4 2153 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [1,1,0,0,0,0|1,0,1]=4 2154 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [1,1,0,0,0,0|1,0,1]=4 2155 B12R1.43 C\C(=C/c1ccccc1)B(O)O Amb26348065 [1,1,0,0,0,0|1,0,1]=4 2156 B12R1.43 C\C(=C/c1ccccc1)C(=N)N Amb32952072 [1,1,0,0,0,0|2,0,0]=4 2157 B12R1.43 C\C(=C/c1ccccc1)C(=O)Cl Amb24061289 [1,1,0,0,0,0|1,0,0]=3 2158 B12R1.43 C\C(=C/c1ccccc1)C(=O)O Amb8513246 [1,1,0,0,0,0|0,0,0]=2 2159 B12R1.43 C\C(=C/c1ccccc1)C(C)Br Amb27654847 [1,1,0,0,0,0|1,0,1]=4 2160 B12R1.43 C\C(=C/c1ccccc1)C(C)Cl Amb27779593 [1,1,0,0,0,0|1,0,1]=4 2161 B12R1.43 C\C(=C/c1ccccc1)C(C)N Amb33329380 [1,1,0,0,0,0|1,0,1]=4 2162 B12R1.43 C\C(=C/c1ccccc1)C(C)O Amb27762014 [1,1,0,0,0,0|0,0,2]=4 2163 B12R1.43 C\C(=C/c1ccccc1)C(N)=S Amb33082670 [1,1,0,0,0,0|1,1,0]=4 2164 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)N Amb33476129 [1,1,0,0,0,0|1,0,1]=4 2165 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)O Amb32952077 [1,1,0,0,0,0|0,0,2]=4 2166 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)N Amb27261769 [1,1,0,0,0,0|1,0,1]=4 2167 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)O Amb27589732 [1,1,0,0,0,0|0,0,2]=4 2168 B12R1.43 C\C(=C/c1ccccc1)[N+](=O)[O-] Amb6320973 [1,1,0,0,0,0|1,0,1]=4 2169 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb30584914 [1,1,0,0,0,0|1,0,0]=3 2170 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb33995393 [1,1,0,0,0,0|1,0,0]=3 2171 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb30584915 [1,1,0,0,0,0|1,0,0]=3 2172 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb5743927 [1,1,0,0,0,0|1,0,0]=3 2173 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb30584913 [1,1,0,0,0,0|1,0,0]=3 2174 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb5743928 [1,1,0,0,0,0|1,0,0]=3 2175 B12R1.43 C\C(=C/c1cncnc1)C(=O)O Amb27755121 [1,1,0,0,0,0|2,0,0]=4 2176 B12R1.43 C\C(=C\c1ccccc1)C(=O)O Amb24603461 [1,1,0,0,0,0|0,0,0]=2 2177 B12R1.43 C\C(=C\c1ccccc1)C(N)=S Amb27466528 [1,1,0,0,0,0|1,1,0]=4 2178 B12R1.43 C\C(=C\c1ccccc1)[N+](=O)[O-] Amb21520351 [1,1,0,0,0,0|1,0,1]=4 2179 B12R1.43 C\C(=C\c1cccnc1)C(=O)O Amb27837141 [1,1,0,0,0,0|1,0,0]=3 2180 B12R1.43 C\C(=C\c1ccncc1)C(=O)O Amb27882270 [1,1,0,0,0,0|1,0,0]=3 2181 B12R1.43 C\C(=C\c1cnccn1)C(=O)O Amb27622051 [1,1,0,0,0,0|2,0,0]=4 2182 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [1,1,0,0,0,0|1,0,0]=3 2183 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [1,1,0,0,0,0|1,0,1]=4 2184 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [1,1,0,0,0,0|2,0,0]=4 2185 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [1,1,0,0,0,0|2,0,0]=4 2186 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [1,1,0,0,0,0|2,0,0]=4 2187 B12R1.43 NC(=O)\C(Cl)=C\c1ccccc1 Amb3724521 [1,1,0,0,0,0|1,0,0]=3 2188 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [1,1,0,0,0,0|0,0,2]=4 2189 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [1,1,0,0,0,0|0,0,2]=4 2190 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [1,1,0,0,0,0|0,0,2]=4 2191 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [1,1,0,0,0,0|0,0,2]=4 2192 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [1,1,0,0,0,0|0,0,2]=4 2193 B12R1.43 N\C(=C/c1ccccc1)C(=O)O Amb24081025 [1,1,0,0,0,0|0,0,0]=2 2194 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [1,1,0,0,0,0|2,0,0]=4 2195 B12R1.43 N\C(=C\c1ccccc1)C(=O)O Amb27148014 [1,1,0,0,0,0|0,0,0]=2 2196 B12R1.43 N\C(=C\c1ccccn1)C(=O)O Amb27770994 [1,1,0,0,0,0|1,0,0]=3 2197 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [1,1,0,0,0,0|2,0,0]=4 2198 B12R1.43 O=C(Cl)\C(F)=C/c1ccccc1 Amb27416385 [1,1,0,0,0,0|1,0,0]=3 2199 B12R1.43 O=C(O)C(=O)C[n+]1ccccc1 Amb28287668 [1,1,0,0,0,0|1,0,1]=4 2200 B12R1.43 O=C(O)C(=O)Cc1ccccc1 Amb2718694 [1,1,0,0,0,0|0,0,1]=3 2201 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb17477815 [1,1,0,0,0,0|1,0,1]=4 2202 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb32952891 [1,1,0,0,0,0|1,0,1]=4 2203 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [1,1,0,0,0,0|1,0,1]=4 2204 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [1,1,0,0,0,0|1,0,1]=4 2205 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [1,1,0,0,0,0|1,0,0]=3 2206 B12R1.43 O=C(O)C(=O)Nc1ccccn1 Amb9303802 [1,1,0,0,0,0|2,0,0]=4 2207 B12R1.43 O=C(O)C(=O)Nc1cccnc1 Amb9303807 [1,1,0,0,0,0|2,0,0]=4 2208 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [1,1,0,0,0,0|2,0,0]=4 2209 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [1,1,0,0,0,0|1,0,0]=3 2210 B12R1.43 O=C(O)C(=S)Oc1ccccc1 Amb27484078 [1,1,0,0,0,0|1,0,0]=3 2211 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [1,1,0,0,0,0|0,0,2]=4 2212 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [1,1,0,0,0,0|0,0,2]=4 2213 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [1,1,0,0,0,0|1,0,1]=4 2214 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [1,1,0,0,0,0|0,0,2]=4 2215 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [1,1,0,0,0,0|0,0,2]=4 2216 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [1,1,0,0,0,0|1,0,1]=4 2217 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [1,1,0,0,0,0|0,0,2]=4 2218 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [1,1,0,0,0,0|0,0,2]=4 2219 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [1,1,0,0,0,0|0,0,2]=4 2220 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [1,1,0,0,0,0|0,0,2]=4 2221 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [1,1,0,0,0,0|0,0,2]=4 2222 B12R1.43 O=C(O)\C(Br)=C\c1ccccc1 Amb2794045 [1,1,0,0,0,0|0,0,0]=2 2223 B12R1.43 O=C(O)\C(Cl)=C/c1ccccc1 Amb18648695 [1,1,0,0,0,0|0,0,0]=2 2224 B12R1.43 O=C(O)\C(Cl)=C\c1ccccc1 Amb19651416 [1,1,0,0,0,0|0,0,0]=2 2225 B12R1.43 O=C(O)\C(Cl)=C\c1cccnc1 Amb26448364 [1,1,0,0,0,0|1,0,0]=3 2226 B12R1.43 O=C(O)\C(F)=C\c1ccccc1 Amb24093652 [1,1,0,0,0,0|0,0,0]=2 2227 B12R1.43 O=C(O)\C(F)=C\c1ccccn1 Amb27977069 [1,1,0,0,0,0|1,0,0]=3 2228 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb17614474 [1,1,0,0,0,0|1,0,0]=3 2229 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb31339126 [1,1,0,0,0,0|1,0,0]=3 2230 B12R1.43 O=C(O)\C(F)=C\c1cnccn1 Amb35600945 [1,1,0,0,0,0|2,0,0]=4 2231 B12R1.43 O=C(O)\C(S)=C/c1ccccc1 Amb2550972 [1,1,0,0,0,0|0,0,0]=2 2232 B12R1.43 O=C(O)\C(S)=C\c1ccccc1 Amb1250109 [1,1,0,0,0,0|0,0,0]=2 2233 B12R1.43 O=C(O)\C(S)=C\c1ccccn1 Amb1761004 [1,1,0,0,0,0|1,0,0]=3 2234 B12R1.43 O=C(O)\C(S)=C\c1ccncc1 Amb1761003 [1,1,0,0,0,0|1,0,0]=3 2235 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb19884048 [1,1,0,0,0,0|0,0,2]=4 2236 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb6365780 [1,1,0,0,0,0|0,0,2]=4 2237 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb8393076 [1,1,0,0,0,0|0,0,2]=4 2238 B12R1.43 O=[N+]([O-])\C(F)=C\c1ccccc1 Amb27843539 [1,1,0,0,0,0|1,0,1]=4 2239 B12R1.43 OB(O)\C(F)=C\c1ccccc1 Amb25667549 [1,1,0,0,0,0|1,0,1]=4 2240 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [1,1,0,0,0,0|1,0,1]=4 2241 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [1,1,0,0,0,0|0,0,1]=3 2242 B12R1.107 C=C(NC(C)=O)c1ccccc1 Amb8394362 [1,1,0,0,0,0|1,0,0]=3 2243 B12R1.107 C=C(NC(C)=O)c1ccccn1 Amb28243818 [1,1,0,0,0,0|2,0,0]=4 2244 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [1,1,0,0,0,0|1,0,1]=4 2245 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [1,1,0,0,0,0|0,0,1]=3 2246 B12R1.107 CC(=O)CC(=O)c1ccccn1 Amb9204928 [1,1,0,0,0,0|1,0,1]=4 2247 B12R1.107 CC(=O)CC(=O)c1cccnc1 Amb33528506 [1,1,0,0,0,0|1,0,1]=4 2248 B12R1.107 CC(=O)CC(=O)c1ccncc1 Amb9204940 [1,1,0,0,0,0|1,0,1]=4 2249 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [1,1,0,0,0,0|0,0,2]=4 2250 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [1,1,0,0,0,0|0,0,2]=4 2251 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [1,1,0,0,0,0|0,0,2]=4 2252 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [1,1,0,0,0,0|0,0,2]=4 2253 B12R1.107 CC(=O)NC(C)c1ccccc1 Amb6390965 [1,1,0,0,0,0|1,0,1]=4 2254 B12R1.107 CC(=O)NN(C)c1ccccc1 Amb6400375 [1,1,0,0,0,0|2,0,0]=4 2255 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 Amb8516282 [1,1,0,0,0,0|1,0,1]=4 2256 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 Amb2742666 [1,1,0,0,0,0|1,0,1]=4 2257 B12R1.107 CC(=O)OC(C)c1ccccc1 Amb4037062 [1,1,0,0,0,0|1,0,1]=4 2258 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [1,1,0,0,0,0|1,0,1]=4 2259 B12R1.107 CC(=O)\C=C(/N)c1ccncc1 Amb27616615 [1,1,0,0,0,0|1,0,0]=3 2260 B12R1.107 CC(=O)\C=C(/O)c1ccccn1 Amb24309430 [1,1,0,0,0,0|1,0,0]=3 2261 B12R1.107 CC(=O)\C=C(\C)c1ccncn1 Amb27803171 [1,1,0,0,0,0|2,0,0]=4 2262 B12R1.107 CC(=O)\C=C(\C)c1cnccn1 Amb28124096 [1,1,0,0,0,0|2,0,0]=4 2263 B12R1.107 CC(=O)\C=C(\N)c1cccnc1 Amb27875125 [1,1,0,0,0,0|1,0,0]=3 2264 B12R1.107 CC(=O)\C=C(\S)c1ccccc1 Amb27428395 [1,1,0,0,0,0|0,0,0]=2 2265 B12R1.107 CC(=O)\N=C(\N)c1ccccc1 Amb25150972 [1,1,0,0,0,0|1,0,0]=3 2266 B12R1.107 CC(C)=CC(=O)c1ccccc1 Amb10874044 [1,1,0,0,0,0|1,0,0]=3 2267 B12R1.107 CC(C)=C[C@@H](O)c1ccccc1 Amb27432272 [1,1,0,0,0,0|1,0,1]=4 2268 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [1,1,0,0,0,0|0,0,2]=4 2269 B12R1.107 CC(O)\C=C(\Cl)c1ccccc1 Amb27451951 [1,1,0,0,0,0|0,0,2]=4 2270 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [1,1,0,0,0,0|2,0,0]=4 2271 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [1,1,0,0,0,0|1,0,1]=4 2272 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [1,1,0,0,0,0|1,0,1]=4 2273 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [1,1,0,0,0,0|0,0,2]=4 2274 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [1,1,0,0,0,0|0,0,2]=4 2275 B12R1.107 C\C(=C/B(O)O)c1ccccc1 Amb27389405 [1,1,0,0,0,0|1,0,1]=4 2276 B12R1.107 C\C(=C/C(=O)O)c1ccccc1 Amb6749182 [1,1,0,0,0,0|0,0,0]=2 2277 B12R1.107 C\C(=C/C(=O)O)c1cccnc1 Amb26839028 [1,1,0,0,0,0|1,0,0]=3 2278 B12R1.107 C\C(=C/C(=O)O)c1ccncc1 Amb34203576 [1,1,0,0,0,0|1,0,0]=3 2279 B12R1.107 C\C(=C/C(=O)O)c1cnccn1 Amb33292425 [1,1,0,0,0,0|2,0,0]=4 2280 B12R1.107 C\C(=C/C(N)=O)c1ccccc1 Amb24648875 [1,1,0,0,0,0|1,0,0]=3 2281 B12R1.107 C\C(=C\C(=O)O)c1ccccn1 Amb24393080 [1,1,0,0,0,0|1,0,0]=3 2282 B12R1.107 C\C(=C\C(=O)O)c1cccnc1 Amb20626498 [1,1,0,0,0,0|1,0,0]=3 2283 B12R1.107 C\C(=C\C(=O)O)c1ccncc1 Amb20626499 [1,1,0,0,0,0|1,0,0]=3 2284 B12R1.107 C\C(=C\C(=O)O)c1cnccn1 Amb27825968 [1,1,0,0,0,0|2,0,0]=4 2285 B12R1.107 C\C(=C\C(C)C)c1ccccc1 Amb4018527 [1,1,0,0,0,0|1,0,1]=4 2286 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [1,1,0,0,0,0|0,0,2]=4 2287 B12R1.107 C\C(=N\S(C)=O)c1ccccc1 Amb35681678 [1,1,0,0,0,0|2,0,0]=4 2288 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [1,1,0,0,0,0|1,0,0]=3 2289 B12R1.107 C\C(N)=C/C(=O)c1ccccn1 Amb10242646 [1,1,0,0,0,0|2,0,0]=4 2290 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [1,1,0,0,0,0|1,0,0]=3 2291 B12R1.107 C\C(N)=C\C(=O)c1cccnc1 Amb28052006 [1,1,0,0,0,0|2,0,0]=4 2292 B12R1.107 C\C(N)=C\C(=O)c1ccncc1 Amb26338235 [1,1,0,0,0,0|2,0,0]=4 2293 B12R1.107 C\C(N)=C\S(=O)c1ccccc1 Amb26974071 [1,1,0,0,0,0|2,0,0]=4 2294 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [1,1,0,0,0,0|1,0,1]=4 2295 B12R1.107 NC(=O)CC(=S)c1ccccc1 Amb28384134 [1,1,0,0,0,0|1,0,1]=4 2296 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [1,1,0,0,0,0|2,0,0]=4 2297 B12R1.107 NC(=O)\C=C(\O)c1cccnc1 Amb28291337 [1,1,0,0,0,0|2,0,0]=4 2298 B12R1.107 NC(=O)\C=C(\O)c1ccncc1 Amb27165220 [1,1,0,0,0,0|2,0,0]=4 2299 B12R1.107 NC(=O)\C=C(\S)c1ccccc1 Amb27862500 [1,1,0,0,0,0|1,0,0]=3 2300 B12R1.107 NC(=S)\C=C(/N)c1ccccc1 Amb19374001 [1,1,0,0,0,0|1,1,0]=4 2301 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [1,1,0,0,0,0|0,0,2]=4 2302 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [1,1,0,0,0,0|0,0,2]=4 2303 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [1,1,0,0,0,0|2,0,0]=4 2304 B12R1.107 NN(CC(=O)O)c1ccccc1 Amb22757137 [1,1,0,0,0,0|1,0,1]=4 2305 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [1,1,0,0,0,0|0,0,2]=4 2306 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [1,1,0,0,0,0|0,0,2]=4 2307 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [1,1,0,0,0,0|0,0,2]=4 2308 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [1,1,0,0,0,0|0,0,2]=4 2309 B12R1.107 O=C(C=C(Cl)Cl)c1ccccc1 Amb27753874 [1,1,0,0,0,0|2,0,0]=4 2310 B12R1.107 O=C(O)CC(=S)c1ccccc1 Amb27433886 [1,1,0,0,0,0|0,0,1]=3 2311 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [1,1,0,0,0,0|0,0,2]=4 2312 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [1,1,0,0,0,0|0,0,2]=4 2313 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [1,1,0,0,0,0|0,0,2]=4 2314 B12R1.107 O=C(O)CN(Cl)c1ccccc1 Amb27984830 [1,1,0,0,0,0|1,0,1]=4 2315 B12R1.107 O=C(O)CN(O)c1ccccc1 Amb27984844 [1,1,0,0,0,0|1,0,1]=4 2316 B12R1.107 O=C(O)CS(=O)c1ccccc1 Amb18290924 [1,1,0,0,0,0|1,0,1]=4 2317 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [1,1,0,0,0,0|0,0,2]=4 2318 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [1,1,0,0,0,0|0,0,2]=4 2319 B12R1.107 O=C(O)\C=C(/Cl)c1ccccc1 Amb17594707 [1,1,0,0,0,0|0,0,0]=2 2320 B12R1.107 O=C(O)\C=C(/I)c1ccccc1 Amb33620462 [1,1,0,0,0,0|0,0,0]=2 2321 B12R1.107 O=C(O)\C=C(\O)c1ccccc1 Amb28052099 [1,1,0,0,0,0|0,0,0]=2 2322 B12R1.107 O=S([O-])\C=C(/F)c1ccccc1 Amb32754936 [1,1,0,0,0,0|1,0,1]=4 2323 B12R1.125 C=C(C)\C=C\c1ccccc1N Amb27627468 [1,1,0,0,0,0|1,0,0]=3 2324 B12R1.125 C=C(C)\C=C\c1ccccc1O Amb25915366 [1,1,0,0,0,0|1,0,0]=3 2325 B12R1.125 CC(=O)C#Cc1ccccc1C Amb23438225 [1,1,0,0,0,0|0,0,2]=4 2326 B12R1.125 CC(=O)CCc1ccccc1Br Amb9031563 [1,1,0,0,0,0|0,0,2]=4 2327 B12R1.125 CC(=O)CCc1ccccc1C Amb9031558 [1,1,0,0,0,0|0,0,2]=4 2328 B12R1.125 CC(=O)CCc1ccccc1Cl Amb9031570 [1,1,0,0,0,0|0,0,2]=4 2329 B12R1.125 CC(=O)CCc1ccccc1F Amb9031573 [1,1,0,0,0,0|0,0,2]=4 2330 B12R1.125 CC(=O)CCc1ccccc1N Amb27246247 [1,1,0,0,0,0|0,0,2]=4 2331 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [1,1,0,0,0,0|0,0,2]=4 2332 B12R1.125 CC(=O)CNc1ccccc1C Amb25062983 [1,1,0,0,0,0|1,0,1]=4 2333 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [1,1,0,0,0,0|1,0,1]=4 2334 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [1,1,0,0,0,0|1,0,1]=4 2335 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [1,1,0,0,0,0|1,0,1]=4 2336 B12R1.125 CC(=O)CSc1ccccc1Br Amb9229574 [1,1,0,0,0,0|1,0,1]=4 2337 B12R1.125 CC(=O)CSc1ccccc1C Amb18796318 [1,1,0,0,0,0|1,0,1]=4 2338 B12R1.125 CC(=O)CSc1ccccc1Cl Amb4744662 [1,1,0,0,0,0|1,0,1]=4 2339 B12R1.125 CC(=O)CSc1ccccc1F Amb9268572 [1,1,0,0,0,0|1,0,1]=4 2340 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [1,1,0,0,0,0|1,0,1]=4 2341 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [1,1,0,0,0,0|1,0,1]=4 2342 B12R1.125 CC(=O)NCc1ccccc1Cl Amb3094828 [1,1,0,0,0,0|1,0,1]=4 2343 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [1,1,0,0,0,0|1,0,1]=4 2344 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [1,1,0,0,0,0|1,0,1]=4 2345 B12R1.125 CC(=O)NNc1ccccc1C Amb4362488 [1,1,0,0,0,0|2,0,0]=4 2346 B12R1.125 CC(=O)NNc1ccccc1F Amb27414447 [1,1,0,0,0,0|2,0,0]=4 2347 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [1,1,0,0,0,0|2,0,0]=4 2348 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [1,1,0,0,0,0|1,0,1]=4 2349 B12R1.125 CC(=O)OCc1ccccc1N Amb27985013 [1,1,0,0,0,0|1,0,1]=4 2350 B12R1.125 CC(=O)SCc1ccccc1Cl Amb27767953 [1,1,0,0,0,0|1,0,1]=4 2351 B12R1.125 CC(=O)\C=C\C1=CC=CNC1=O Amb25780424 [1,1,0,0,0,0|1,0,0]=3 2352 B12R1.125 CC(=O)\C=C\c1cccc[n+]1C Amb3428953 [1,1,0,0,0,0|1,0,0]=3 2353 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [1,1,0,0,0,0|0,0,0]=2 2354 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb32954781 [1,1,0,0,0,0|0,0,0]=2 2355 B12R1.125 CC(=O)\C=C\c1ccccc1Cl Amb2724535 [1,1,0,0,0,0|0,0,0]=2 2356 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [1,1,0,0,0,0|0,0,0]=2 2357 B12R1.125 CC(=O)\C=C\c1ccccc1N Amb25975457 [1,1,0,0,0,0|0,0,0]=2 2358 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb24065680 [1,1,0,0,0,0|0,0,0]=2 2359 B12R1.125 CC(=O)\C=C\c1cccnc1Br Amb33388125 [1,1,0,0,0,0|1,0,0]=3 2360 B12R1.125 CC(=O)\C=C\c1cccnc1C Amb32878339 [1,1,0,0,0,0|1,0,0]=3 2361 B12R1.125 CC(=O)\C=C\c1cccnc1Cl Amb33257396 [1,1,0,0,0,0|1,0,0]=3 2362 B12R1.125 CC(=O)\C=C\c1cccnc1F Amb33377142 [1,1,0,0,0,0|1,0,0]=3 2363 B12R1.125 CC(=O)\C=C\c1ccncc1Br Amb33388703 [1,1,0,0,0,0|1,0,0]=3 2364 B12R1.125 CC(=O)\C=C\c1ccncc1C Amb33426426 [1,1,0,0,0,0|1,0,0]=3 2365 B12R1.125 CC(=O)\C=C\c1ccncc1Cl Amb33413822 [1,1,0,0,0,0|1,0,0]=3 2366 B12R1.125 CC(=O)\C=C\c1ccncc1F Amb33316817 [1,1,0,0,0,0|1,0,0]=3 2367 B12R1.125 CC(=O)\C=C\c1cnccc1C Amb33474389 [1,1,0,0,0,0|1,0,0]=3 2368 B12R1.125 CC(=O)\C=C\c1cncnc1C Amb33149095 [1,1,0,0,0,0|2,0,0]=4 2369 B12R1.125 CC(=O)\C=C\c1ncccc1Br Amb33336115 [1,1,0,0,0,0|1,0,0]=3 2370 B12R1.125 CC(=O)\C=C\c1ncccc1C Amb33360223 [1,1,0,0,0,0|1,0,0]=3 2371 B12R1.125 CC(=O)\C=C\c1ncccc1F Amb33419610 [1,1,0,0,0,0|1,0,0]=3 2372 B12R1.125 CC(=O)\C=C\c1nccnc1C Amb35601038 [1,1,0,0,0,0|2,0,0]=4 2373 B12R1.125 CC(=O)\N=C/c1ccccc1Cl Amb27616938 [1,1,0,0,0,0|1,0,0]=3 2374 B12R1.125 CC(=O)\N=C\c1ccccc1O Amb27592432 [1,1,0,0,0,0|1,0,0]=3 2375 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [1,1,0,0,0,0|1,0,1]=4 2376 B12R1.125 CC(N)\C=C\c1ccccc1Br Amb33242295 [1,1,0,0,0,0|1,0,1]=4 2377 B12R1.125 CC(N)\C=C\c1ccccc1Cl Amb33406514 [1,1,0,0,0,0|1,0,1]=4 2378 B12R1.125 CC(N)\C=C\c1ccccc1F Amb33448885 [1,1,0,0,0,0|1,0,1]=4 2379 B12R1.125 CC(N)\C=C\c1ccccc1O Amb33429328 [1,1,0,0,0,0|1,0,1]=4 2380 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [1,1,0,0,0,0|0,0,2]=4 2381 B12R1.125 CC(O)\C=C\c1ccccc1Cl Amb26073532 [1,1,0,0,0,0|0,0,2]=4 2382 B12R1.125 CC(O)\C=C\c1ccccc1F Amb26539993 [1,1,0,0,0,0|0,0,2]=4 2383 B12R1.125 CS(=O)\C=C/c1ccccc1N Amb28254539 [1,1,0,0,0,0|1,0,0]=3 2384 B12R1.125 CS(=O)\N=C\c1ccccc1Br Amb35718864 [1,1,0,0,0,0|2,0,0]=4 2385 B12R1.125 CS(=O)\N=C\c1ccccc1Cl Amb35681665 [1,1,0,0,0,0|2,0,0]=4 2386 B12R1.125 CS(=O)\N=C\c1ccccc1F Amb29858758 [1,1,0,0,0,0|2,0,0]=4 2387 B12R1.125 Cc1cccc[n+]1\C=C\C(=O)O Amb28366211 [1,1,0,0,0,0|1,0,0]=3 2388 B12R1.125 Cc1ccccc1C#CC(=O)O Amb20673097 [1,1,0,0,0,0|0,0,2]=4 2389 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [1,1,0,0,0,0|0,0,2]=4 2390 B12R1.125 Cc1ccccc1NCC(=O)O Amb1258286 [1,1,0,0,0,0|1,0,1]=4 2391 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [1,1,0,0,0,0|1,0,1]=4 2392 B12R1.125 Cc1ccccc1SCC(=O)O Amb1205492 [1,1,0,0,0,0|1,0,1]=4 2393 B12R1.125 Cc1ccccc1\C=C/C(=O)O Amb27871584 [1,1,0,0,0,0|0,0,0]=2 2394 B12R1.125 Cc1ccccc1\C=C/[N+](=O)[O-] Amb24537629 [1,1,0,0,0,0|1,0,1]=4 2395 B12R1.125 Cc1ccccc1\C=C\B(O)O Amb22011802 [1,1,0,0,0,0|1,0,1]=4 2396 B12R1.125 Cc1ccccc1\C=C\C(=O)Cl Amb2690621 [1,1,0,0,0,0|1,0,0]=3 2397 B12R1.125 Cc1ccccc1\C=C\C(=O)O Amb6555165 [1,1,0,0,0,0|0,0,0]=2 2398 B12R1.125 Cc1ccccc1\C=C\C(C)N Amb33475216 [1,1,0,0,0,0|1,0,1]=4 2399 B12R1.125 Cc1ccccc1\C=C\C(C)O Amb27748478 [1,1,0,0,0,0|0,0,2]=4 2400 B12R1.125 Cc1ccccc1\C=C\C(N)=O Amb8997714 [1,1,0,0,0,0|1,0,0]=3 2401 B12R1.125 Cc1ccccc1\C=C\[N+](=O)[O-] Amb33868901 [1,1,0,0,0,0|1,0,1]=4 2402 B12R1.125 Cc1ccccc1\C=N\S(C)=O Amb29858776 [1,1,0,0,0,0|2,0,0]=4 2403 B12R1.125 Cc1cccnc1\C=C\C(=O)O Amb30584981 [1,1,0,0,0,0|1,0,0]=3 2404 B12R1.125 Cc1cccnc1\C=C\C(=O)O Amb32990226 [1,1,0,0,0,0|1,0,0]=3 2405 B12R1.125 Cc1cccnc1\C=C\C(N)=O Amb28127171 [1,1,0,0,0,0|2,0,0]=4 2406 B12R1.125 Cc1ccncc1\C=C\C(=O)O Amb17844101 [1,1,0,0,0,0|1,0,0]=3 2407 B12R1.125 Cc1ccncc1\C=C\C(=O)O Amb32718732 [1,1,0,0,0,0|1,0,0]=3 2408 B12R1.125 Cc1cnccc1\C=C\C(=O)O Amb30584980 [1,1,0,0,0,0|1,0,0]=3 2409 B12R1.125 Cc1ncccc1\C=C\C(=O)O Amb28653059 [1,1,0,0,0,0|1,0,0]=3 2410 B12R1.125 Cc1ncccc1\C=C\C(=O)O Amb32662803 [1,1,0,0,0,0|1,0,0]=3 2411 B12R1.125 Cc1nccnc1\C=C\C(=O)O Amb35600937 [1,1,0,0,0,0|2,0,0]=4 2412 B12R1.125 Cc1ncncc1\C=C\C(=O)O Amb27193885 [1,1,0,0,0,0|2,0,0]=4 2413 B12R1.125 Cc1nnccc1\C=C\C(=O)O Amb33470115 [1,1,0,0,0,0|2,0,0]=4 2414 B12R1.125 NC(=O)\C=C\c1ccccc1Br Amb8997717 [1,1,0,0,0,0|1,0,0]=3 2415 B12R1.125 NC(=O)\C=C\c1ccccc1F Amb8997697 [1,1,0,0,0,0|1,0,0]=3 2416 B12R1.125 NC(=O)\C=C\c1ccccc1I Amb26608900 [1,1,0,0,0,0|1,0,0]=3 2417 B12R1.125 NC(=O)\C=C\c1ccccc1N Amb28202728 [1,1,0,0,0,0|1,0,0]=3 2418 B12R1.125 NC(=O)\C=C\c1ccccc1O Amb18645808 [1,1,0,0,0,0|1,0,0]=3 2419 B12R1.125 NC(=O)\C=C\c1cnccc1N Amb27878871 [1,1,0,0,0,0|2,0,0]=4 2420 B12R1.125 NC(=O)\N=C\c1ccccc1O Amb27256381 [1,1,0,0,0,0|2,0,0]=4 2421 B12R1.125 NC(=S)\C=C\c1ccccc1Cl Amb27984695 [1,1,0,0,0,0|1,1,0]=4 2422 B12R1.125 NC(=S)\C=C\c1ccccc1O Amb27399525 [1,1,0,0,0,0|1,1,0]=4 2423 B12R1.125 Nc1ccccc1C#CC(=O)O Amb24355867 [1,1,0,0,0,0|0,0,2]=4 2424 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [1,1,0,0,0,0|0,0,2]=4 2425 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [1,1,0,0,0,0|0,0,2]=4 2426 B12R1.125 Nc1ccccc1OCC(=O)O Amb4065760 [1,1,0,0,0,0|1,0,1]=4 2427 B12R1.125 Nc1ccccc1SCC(=O)O Amb6267584 [1,1,0,0,0,0|1,0,1]=4 2428 B12R1.125 Nc1ccccc1\C=C\C(=O)O Amb17777291 [1,1,0,0,0,0|0,0,0]=2 2429 B12R1.125 Nc1cnccc1\C=C\C(=O)O Amb4560900 [1,1,0,0,0,0|1,0,0]=3 2430 B12R1.125 Nc1ncccc1\C=C\C(=O)O Amb2697575 [1,1,0,0,0,0|1,0,0]=3 2431 B12R1.125 O=C(Cl)\C=C/c1ccccc1Cl Amb10070071 [1,1,0,0,0,0|1,0,0]=3 2432 B12R1.125 O=C(Cl)\C=C\c1ccccc1Br Amb16230254 [1,1,0,0,0,0|1,0,0]=3 2433 B12R1.125 O=C(Cl)\C=C\c1ccccc1Cl Amb8629219 [1,1,0,0,0,0|1,0,0]=3 2434 B12R1.125 O=C(Cl)\C=C\c1ccccc1F Amb2688309 [1,1,0,0,0,0|1,0,0]=3 2435 B12R1.125 O=C(O)C#Cc1ccccc1Br Amb25266206 [1,1,0,0,0,0|0,0,2]=4 2436 B12R1.125 O=C(O)C#Cc1ccccc1Cl Amb2616696 [1,1,0,0,0,0|0,0,2]=4 2437 B12R1.125 O=C(O)C#Cc1ccccc1F Amb7172545 [1,1,0,0,0,0|0,0,2]=4 2438 B12R1.125 O=C(O)C#Cc1ccccc1O Amb25921689 [1,1,0,0,0,0|0,0,2]=4 2439 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [1,1,0,0,0,0|0,0,2]=4 2440 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [1,1,0,0,0,0|0,0,2]=4 2441 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [1,1,0,0,0,0|0,0,2]=4 2442 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [1,1,0,0,0,0|0,0,2]=4 2443 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [1,1,0,0,0,0|0,0,2]=4 2444 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [1,1,0,0,0,0|0,0,2]=4 2445 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [1,1,0,0,0,0|1,0,1]=4 2446 B12R1.125 O=C(O)CNc1ccccc1Cl Amb33528017 [1,1,0,0,0,0|1,0,1]=4 2447 B12R1.125 O=C(O)CNc1ccccc1F Amb840521 [1,1,0,0,0,0|1,0,1]=4 2448 B12R1.125 O=C(O)CNc1ccccc1O Amb842591 [1,1,0,0,0,0|1,0,1]=4 2449 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [1,1,0,0,0,0|1,0,1]=4 2450 B12R1.125 O=C(O)COc1ccccc1Cl Amb6336452 [1,1,0,0,0,0|1,0,1]=4 2451 B12R1.125 O=C(O)COc1ccccc1F Amb6335614 [1,1,0,0,0,0|1,0,1]=4 2452 B12R1.125 O=C(O)COc1ccccc1I Amb9339538 [1,1,0,0,0,0|1,0,1]=4 2453 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [1,1,0,0,0,0|1,0,1]=4 2454 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [1,1,0,0,0,0|1,0,1]=4 2455 B12R1.125 O=C(O)CSc1ccccc1Cl Amb1105912 [1,1,0,0,0,0|1,0,1]=4 2456 B12R1.125 O=C(O)CSc1ccccc1F Amb1105913 [1,1,0,0,0,0|1,0,1]=4 2457 B12R1.125 O=C(O)CSc1ccccc1O Amb18294823 [1,1,0,0,0,0|1,0,1]=4 2458 B12R1.125 O=C(O)\C=C\C1=CN=CNC1=O Amb18646423 [1,1,0,0,0,0|2,0,0]=4 2459 B12R1.125 O=C(O)\C=C\N1C=CC=CC1=S Amb27657743 [1,1,0,0,0,0|1,0,0]=3 2460 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb33718813 [1,1,0,0,0,0|0,0,0]=2 2461 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb6664185 [1,1,0,0,0,0|0,0,0]=2 2462 B12R1.125 O=C(O)\C=C\c1ccccc1Cl Amb6336512 [1,1,0,0,0,0|0,0,0]=2 2463 B12R1.125 O=C(O)\C=C\c1ccccc1F Amb6545502 [1,1,0,0,0,0|0,0,0]=2 2464 B12R1.125 O=C(O)\C=C\c1ccccc1I Amb22584152 [1,1,0,0,0,0|0,0,0]=2 2465 B12R1.125 O=C(O)\C=C\c1ccccc1O Amb8513188 [1,1,0,0,0,0|0,0,0]=2 2466 B12R1.125 O=C(O)\C=C\c1cccnc1Br Amb33451204 [1,1,0,0,0,0|1,0,0]=3 2467 B12R1.125 O=C(O)\C=C\c1cccnc1F Amb33473819 [1,1,0,0,0,0|1,0,0]=3 2468 B12R1.125 O=C(O)\C=C\c1ccncc1Br Amb18659757 [1,1,0,0,0,0|1,0,0]=3 2469 B12R1.125 O=C(O)\C=C\c1ccncc1Cl Amb33261635 [1,1,0,0,0,0|1,0,0]=3 2470 B12R1.125 O=C(O)\C=C\c1ccncc1F Amb26946507 [1,1,0,0,0,0|1,0,0]=3 2471 B12R1.125 O=C(O)\C=C\c1cnccc1O Amb18646198 [1,1,0,0,0,0|1,0,0]=3 2472 B12R1.125 O=C(O)\C=C\c1ncccc1Br Amb25975550 [1,1,0,0,0,0|1,0,0]=3 2473 B12R1.125 O=C(O)\C=C\c1ncccc1Cl Amb26552463 [1,1,0,0,0,0|1,0,0]=3 2474 B12R1.125 O=C(O)\C=C\c1ncccc1F Amb32662908 [1,1,0,0,0,0|1,0,0]=3 2475 B12R1.125 O=C(O)\C=C\c1ncncc1Br Amb33470080 [1,1,0,0,0,0|2,0,0]=4 2476 B12R1.125 O=S([O-])\C=C\c1ccccc1Br Amb32754055 [1,1,0,0,0,0|1,0,1]=4 2477 B12R1.125 O=S([O-])\C=C\c1ccccc1F Amb32754864 [1,1,0,0,0,0|1,0,1]=4 2478 B12R1.125 O=[N+]([O-])\C=C/c1ccccc1F Amb10839832 [1,1,0,0,0,0|1,0,1]=4 2479 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1Cl Amb2762665 [1,1,0,0,0,0|1,0,1]=4 2480 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1Cl Amb33714745 [1,1,0,0,0,0|1,0,1]=4 2481 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1F Amb6876254 [1,1,0,0,0,0|1,0,1]=4 2482 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1O Amb32953488 [1,1,0,0,0,0|1,0,1]=4 2483 B12R1.226 CC(=O)C#Cc1cccc(F)c1 Amb27177631 [1,1,0,0,0,0|0,0,2]=4 2484 B12R1.226 CC(=O)CCc1cccc(Br)c1 Amb9031557 [1,1,0,0,0,0|0,0,2]=4 2485 B12R1.226 CC(=O)CCc1cccc(C)c1 Amb8869632 [1,1,0,0,0,0|0,0,2]=4 2486 B12R1.226 CC(=O)CCc1cccc(Cl)c1 Amb9031572 [1,1,0,0,0,0|0,0,2]=4 2487 B12R1.226 CC(=O)CCc1cccc(F)c1 Amb9031555 [1,1,0,0,0,0|0,0,2]=4 2488 B12R1.226 CC(=O)CCc1cccc(N)c1 Amb26452029 [1,1,0,0,0,0|0,0,2]=4 2489 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [1,1,0,0,0,0|0,0,2]=4 2490 B12R1.226 CC(=O)COc1cccc(Br)c1 Amb17226706 [1,1,0,0,0,0|1,0,1]=4 2491 B12R1.226 CC(=O)COc1cccc(I)c1 Amb27829069 [1,1,0,0,0,0|1,0,1]=4 2492 B12R1.226 CC(=O)COc1cccc(N)c1 Amb17110084 [1,1,0,0,0,0|1,0,1]=4 2493 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [1,1,0,0,0,0|1,0,1]=4 2494 B12R1.226 CC(=O)CSc1cccc(C)c1 Amb18791171 [1,1,0,0,0,0|1,0,1]=4 2495 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [1,1,0,0,0,0|1,0,1]=4 2496 B12R1.226 CC(=O)CSc1cccc(F)c1 Amb28386048 [1,1,0,0,0,0|1,0,1]=4 2497 B12R1.226 CC(=O)NCc1cccc(Br)c1 Amb2085743 [1,1,0,0,0,0|1,0,1]=4 2498 B12R1.226 CC(=O)NCc1cccc(Cl)c1 Amb2023612 [1,1,0,0,0,0|1,0,1]=4 2499 B12R1.226 CC(=O)NCc1cccc(F)c1 Amb33546305 [1,1,0,0,0,0|1,0,1]=4 2500 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [1,1,0,0,0,0|1,0,1]=4 2501 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [1,1,0,0,0,0|1,0,1]=4 2502 B12R1.226 CC(=O)NNc1cccc(Br)c1 Amb27414445 [1,1,0,0,0,0|2,0,0]=4 2503 B12R1.226 CC(=O)NNc1cccc(Cl)c1 Amb4362483 [1,1,0,0,0,0|2,0,0]=4 2504 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [1,1,0,0,0,0|1,0,1]=4 2505 B12R1.226 CC(=O)OCc1cccc(O)c1 Amb26427066 [1,1,0,0,0,0|1,0,1]=4 2506 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [1,1,0,0,0,0|1,0,1]=4 2507 B12R1.226 CC(=O)SCc1cccc(I)c1 Amb27770074 [1,1,0,0,0,0|1,0,1]=4 2508 B12R1.226 CC(=O)\C=C\c1cc(C)ccn1 Amb33317813 [1,1,0,0,0,0|1,0,0]=3 2509 B12R1.226 CC(=O)\C=C\c1cc(F)ccn1 Amb33325518 [1,1,0,0,0,0|1,0,0]=3 2510 B12R1.226 CC(=O)\C=C\c1cccc(Br)c1 Amb10601440 [1,1,0,0,0,0|0,0,0]=2 2511 B12R1.226 CC(=O)\C=C\c1cccc(Br)n1 Amb25233145 [1,1,0,0,0,0|1,0,0]=3 2512 B12R1.226 CC(=O)\C=C\c1cccc(C)c1 Amb33079187 [1,1,0,0,0,0|0,0,0]=2 2513 B12R1.226 CC(=O)\C=C\c1cccc(C)n1 Amb33474924 [1,1,0,0,0,0|1,0,0]=3 2514 B12R1.226 CC(=O)\C=C\c1cccc(Cl)c1 Amb2724236 [1,1,0,0,0,0|0,0,0]=2 2515 B12R1.226 CC(=O)\C=C\c1cccc(Cl)n1 Amb33222648 [1,1,0,0,0,0|1,0,0]=3 2516 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [1,1,0,0,0,0|0,0,0]=2 2517 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [1,1,0,0,0,0|0,0,0]=2 2518 B12R1.226 CC(=O)\C=C\c1cccc(O)c1 Amb17615740 [1,1,0,0,0,0|0,0,0]=2 2519 B12R1.226 CC(=O)\C=C\c1ccnc(C)c1 Amb33172588 [1,1,0,0,0,0|1,0,0]=3 2520 B12R1.226 CC(=O)\C=C\c1cncc(Br)c1 Amb33430082 [1,1,0,0,0,0|1,0,0]=3 2521 B12R1.226 CC(=O)\C=C\c1cncc(C)c1 Amb33317647 [1,1,0,0,0,0|1,0,0]=3 2522 B12R1.226 CC(=O)\C=C\c1cncc(F)c1 Amb33195632 [1,1,0,0,0,0|1,0,0]=3 2523 B12R1.226 CC(Br)\C=C\c1cccc(Cl)c1 Amb27591061 [1,1,0,0,0,0|1,0,1]=4 2524 B12R1.226 CC(Br)\C=C\c1cccc(F)c1 Amb28207845 [1,1,0,0,0,0|1,0,1]=4 2525 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [1,1,0,0,0,0|1,0,1]=4 2526 B12R1.226 CC(N)\C=C\c1cccc(Br)c1 Amb33241203 [1,1,0,0,0,0|1,0,1]=4 2527 B12R1.226 CC(N)\C=C\c1cccc(Cl)c1 Amb33220774 [1,1,0,0,0,0|1,0,1]=4 2528 B12R1.226 CC(N)\C=C\c1cccc(F)c1 Amb33450002 [1,1,0,0,0,0|1,0,1]=4 2529 B12R1.226 CC(N)\C=C\c1cccc(I)c1 Amb27590388 [1,1,0,0,0,0|1,0,1]=4 2530 B12R1.226 CC(N)\C=C\c1cccc(O)c1 Amb27615369 [1,1,0,0,0,0|1,0,1]=4 2531 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [1,1,0,0,0,0|0,0,2]=4 2532 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [1,1,0,0,0,0|0,0,2]=4 2533 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [1,1,0,0,0,0|0,0,2]=4 2534 B12R1.226 CC(O)\C=C\c1cccc(I)c1 Amb27644961 [1,1,0,0,0,0|0,0,2]=4 2535 B12R1.226 CS(=O)\N=C\c1cccc(Br)c1 Amb35681676 [1,1,0,0,0,0|2,0,0]=4 2536 B12R1.226 CS(=O)\N=C\c1cccc(Cl)c1 Amb35681711 [1,1,0,0,0,0|2,0,0]=4 2537 B12R1.226 CS(=O)\N=C\c1cccc(F)c1 Amb29858703 [1,1,0,0,0,0|2,0,0]=4 2538 B12R1.226 CS(=O)\N=C\c1cccc(I)c1 Amb35692840 [1,1,0,0,0,0|2,0,0]=4 2539 B12R1.226 CS(=O)\N=C\c1cccc(O)c1 Amb29858760 [1,1,0,0,0,0|2,0,0]=4 2540 B12R1.226 Cc1cc(\C=C\C(=O)O)ccn1 Amb32953957 [1,1,0,0,0,0|1,0,0]=3 2541 B12R1.226 Cc1cc(\C=C\C(=O)O)ncn1 Amb27224407 [1,1,0,0,0,0|2,0,0]=4 2542 B12R1.226 Cc1cc(\C=C\C(N)=O)ccn1 Amb27445433 [1,1,0,0,0,0|2,0,0]=4 2543 B12R1.226 Cc1cccc(C#CC(=O)O)c1 Amb20673071 [1,1,0,0,0,0|0,0,2]=4 2544 B12R1.226 Cc1cccc(CCC(=O)O)c1 Amb1106242 [1,1,0,0,0,0|0,0,2]=4 2545 B12R1.226 Cc1cccc(NCC(=O)O)c1 Amb840514 [1,1,0,0,0,0|1,0,1]=4 2546 B12R1.226 Cc1cccc(OCC(=O)O)c1 Amb6336446 [1,1,0,0,0,0|1,0,1]=4 2547 B12R1.226 Cc1cccc(SCC(=O)O)c1 Amb5768509 [1,1,0,0,0,0|1,0,1]=4 2548 B12R1.226 Cc1cccc(\C=C/C(N)=O)c1 Amb27490834 [1,1,0,0,0,0|1,0,0]=3 2549 B12R1.226 Cc1cccc(\C=C/[N+](=O)[O-])c1 Amb26891002 [1,1,0,0,0,0|1,0,1]=4 2550 B12R1.226 Cc1cccc(\C=C\C(=O)Cl)c1 Amb33513162 [1,1,0,0,0,0|1,0,0]=3 2551 B12R1.226 Cc1cccc(\C=C\C(=O)O)c1 Amb2720533 [1,1,0,0,0,0|0,0,0]=2 2552 B12R1.226 Cc1cccc(\C=C\C(=O)O)n1 Amb10669513 [1,1,0,0,0,0|1,0,0]=3 2553 B12R1.226 Cc1cccc(\C=C\C(=O)[O-])c1 Amb33513024 [1,1,0,0,0,0|0,0,1]=3 2554 B12R1.226 Cc1cccc(\C=C\C(C)N)c1 Amb33450114 [1,1,0,0,0,0|1,0,1]=4 2555 B12R1.226 Cc1cccc(\C=C\C(C)O)c1 Amb25683937 [1,1,0,0,0,0|0,0,2]=4 2556 B12R1.226 Cc1cccc(\C=C\[N+](=O)[O-])c1 Amb6296910 [1,1,0,0,0,0|1,0,1]=4 2557 B12R1.226 Cc1cccc(\C=N\S(C)=O)c1 Amb29858792 [1,1,0,0,0,0|2,0,0]=4 2558 B12R1.226 Cc1ccnc(\C=C\C(=O)O)c1 Amb33079454 [1,1,0,0,0,0|1,0,0]=3 2559 B12R1.226 Cc1ccnc(\C=C\C(N)=O)c1 Amb28421771 [1,1,0,0,0,0|2,0,0]=4 2560 B12R1.226 Cc1cncc(\C=C\C(=O)O)c1 Amb22059615 [1,1,0,0,0,0|1,0,0]=3 2561 B12R1.226 Cc1nccc(\C=C\C(=O)O)n1 Amb23592256 [1,1,0,0,0,0|2,0,0]=4 2562 B12R1.226 NC(=O)\C=C\c1cccc(Br)c1 Amb8997726 [1,1,0,0,0,0|1,0,0]=3 2563 B12R1.226 NC(=O)\C=C\c1cccc(F)c1 Amb8997747 [1,1,0,0,0,0|1,0,0]=3 2564 B12R1.226 NC(=O)\C=C\c1cccc(I)c1 Amb25338405 [1,1,0,0,0,0|1,0,0]=3 2565 B12R1.226 NC(=O)\C=C\c1cccc(O)c1 Amb27854413 [1,1,0,0,0,0|1,0,0]=3 2566 B12R1.226 NC(=O)\C=C\c1ccnc(Br)c1 Amb24451667 [1,1,0,0,0,0|2,0,0]=4 2567 B12R1.226 NC(=O)\C=C\c1ccnc(Cl)c1 Amb27598185 [1,1,0,0,0,0|2,0,0]=4 2568 B12R1.226 NC(=O)\C=C\c1cncc(O)c1 Amb27178630 [1,1,0,0,0,0|2,0,0]=4 2569 B12R1.226 NC(=O)\N=C\c1cccc(F)c1 Amb27848231 [1,1,0,0,0,0|2,0,0]=4 2570 B12R1.226 NC(=S)\C=C\c1cccc(Cl)c1 Amb27637700 [1,1,0,0,0,0|1,1,0]=4 2571 B12R1.226 Nc1cccc(C#CC(=O)O)c1 Amb24650985 [1,1,0,0,0,0|0,0,2]=4 2572 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2684507 [1,1,0,0,0,0|0,0,2]=4 2573 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2692058 [1,1,0,0,0,0|0,0,2]=4 2574 B12R1.226 Nc1cccc(OCC(=O)O)c1 Amb839769 [1,1,0,0,0,0|1,0,1]=4 2575 B12R1.226 Nc1cccc(\C=C\C(=O)O)c1 Amb34916041 [1,1,0,0,0,0|0,0,0]=2 2576 B12R1.226 Nc1cncc(\C=C\C(=O)O)c1 Amb27840658 [1,1,0,0,0,0|1,0,0]=3 2577 B12R1.226 O=C(Cl)\C=C\c1cccc(Br)c1 Amb17145216 [1,1,0,0,0,0|1,0,0]=3 2578 B12R1.226 O=C(Cl)\C=C\c1cccc(Cl)c1 Amb16230245 [1,1,0,0,0,0|1,0,0]=3 2579 B12R1.226 O=C(Cl)\C=C\c1cccc(O)c1 Amb26344668 [1,1,0,0,0,0|1,0,0]=3 2580 B12R1.226 O=C(O)C#Cc1cccc(Br)c1 Amb23504362 [1,1,0,0,0,0|0,0,2]=4 2581 B12R1.226 O=C(O)C#Cc1cccc(Cl)c1 Amb20673086 [1,1,0,0,0,0|0,0,2]=4 2582 B12R1.226 O=C(O)C#Cc1cccc(F)c1 Amb20673102 [1,1,0,0,0,0|0,0,2]=4 2583 B12R1.226 O=C(O)C#Cc1cccc(O)c1 Amb23569602 [1,1,0,0,0,0|0,0,2]=4 2584 B12R1.226 O=C(O)CCc1cccc(Br)c1 Amb1209216 [1,1,0,0,0,0|0,0,2]=4 2585 B12R1.226 O=C(O)CCc1cccc(Cl)c1 Amb1672952 [1,1,0,0,0,0|0,0,2]=4 2586 B12R1.226 O=C(O)CCc1cccc(F)c1 Amb1091868 [1,1,0,0,0,0|0,0,2]=4 2587 B12R1.226 O=C(O)CCc1cccc(I)c1 Amb16232982 [1,1,0,0,0,0|0,0,2]=4 2588 B12R1.226 O=C(O)CCc1cccc(O)c1 Amb2688781 [1,1,0,0,0,0|0,0,2]=4 2589 B12R1.226 O=C(O)CNc1cccc(Br)c1 Amb840527 [1,1,0,0,0,0|1,0,1]=4 2590 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb10609174 [1,1,0,0,0,0|1,0,1]=4 2591 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb840525 [1,1,0,0,0,0|1,0,1]=4 2592 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb19341704 [1,1,0,0,0,0|1,0,1]=4 2593 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb840522 [1,1,0,0,0,0|1,0,1]=4 2594 B12R1.226 O=C(O)COc1cccc(Br)c1 Amb6336684 [1,1,0,0,0,0|1,0,1]=4 2595 B12R1.226 O=C(O)COc1cccc(Cl)c1 Amb1211231 [1,1,0,0,0,0|1,0,1]=4 2596 B12R1.226 O=C(O)COc1cccc(F)c1 Amb1102803 [1,1,0,0,0,0|1,0,1]=4 2597 B12R1.226 O=C(O)COc1cccc(I)c1 Amb4574102 [1,1,0,0,0,0|1,0,1]=4 2598 B12R1.226 O=C(O)COc1cccc(O)c1 Amb6360813 [1,1,0,0,0,0|1,0,1]=4 2599 B12R1.226 O=C(O)CSc1cccc(Br)c1 Amb2372547 [1,1,0,0,0,0|1,0,1]=4 2600 B12R1.226 O=C(O)CSc1cccc(Cl)c1 Amb2794096 [1,1,0,0,0,0|1,0,1]=4 2601 B12R1.226 O=C(O)CSc1cccc(F)c1 Amb19887452 [1,1,0,0,0,0|1,0,1]=4 2602 B12R1.226 O=C(O)CSc1cccc(O)c1 Amb28385688 [1,1,0,0,0,0|1,0,1]=4 2603 B12R1.226 O=C(O)\C=C\C1=CC=CC(=O)N1 Amb25705720 [1,1,0,0,0,0|1,0,0]=3 2604 B12R1.226 O=C(O)\C=C\c1cc(Cl)ccn1 Amb33469130 [1,1,0,0,0,0|1,0,0]=3 2605 B12R1.226 O=C(O)\C=C\c1cc(F)ccn1 Amb33414575 [1,1,0,0,0,0|1,0,0]=3 2606 B12R1.226 O=C(O)\C=C\c1cccc(Br)c1 Amb1207365 [1,1,0,0,0,0|0,0,0]=2 2607 B12R1.226 O=C(O)\C=C\c1cccc(Br)n1 Amb33240785 [1,1,0,0,0,0|1,0,0]=3 2608 B12R1.226 O=C(O)\C=C\c1cccc(Cl)c1 Amb33513177 [1,1,0,0,0,0|0,0,0]=2 2609 B12R1.226 O=C(O)\C=C\c1cccc(F)c1 Amb1210956 [1,1,0,0,0,0|0,0,0]=2 2610 B12R1.226 O=C(O)\C=C\c1cccc(I)c1 Amb2236388 [1,1,0,0,0,0|0,0,0]=2 2611 B12R1.226 O=C(O)\C=C\c1cccc(O)c1 Amb8513189 [1,1,0,0,0,0|0,0,0]=2 2612 B12R1.226 O=C(O)\C=C\c1ccnc(Br)c1 Amb19929893 [1,1,0,0,0,0|1,0,0]=3 2613 B12R1.226 O=C(O)\C=C\c1ccnc(Cl)c1 Amb20668239 [1,1,0,0,0,0|1,0,0]=3 2614 B12R1.226 O=C(O)\C=C\c1ccnc(O)c1 Amb24682988 [1,1,0,0,0,0|1,0,0]=3 2615 B12R1.226 O=C(O)\C=C\c1cncc(Br)c1 Amb33242916 [1,1,0,0,0,0|1,0,0]=3 2616 B12R1.226 O=C(O)\C=C\c1cncc(Cl)c1 Amb26004618 [1,1,0,0,0,0|1,0,0]=3 2617 B12R1.226 O=C(O)\C=C\c1cncc(F)c1 Amb18283058 [1,1,0,0,0,0|1,0,0]=3 2618 B12R1.226 O=C(O)\C=C\c1cncc(O)c1 Amb27868737 [1,1,0,0,0,0|1,0,0]=3 2619 B12R1.226 O=S([O-])\C=C\c1cccc(Br)c1 Amb32754056 [1,1,0,0,0,0|1,0,1]=4 2620 B12R1.226 O=S([O-])\C=C\c1cccc(Cl)c1 Amb32755654 [1,1,0,0,0,0|1,0,1]=4 2621 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Br)c1 Amb3905133 [1,1,0,0,0,0|1,0,1]=4 2622 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Cl)c1 Amb2763380 [1,1,0,0,0,0|1,0,1]=4 2623 B12R1.226 O=[N+]([O-])\C=C\c1cccc(F)c1 Amb2764632 [1,1,0,0,0,0|1,0,1]=4 2624 B12R1.226 O=[N+]([O-])\C=C\c1cccc(I)c1 Amb1144728 [1,1,0,0,0,0|1,0,1]=4 2625 B12R1.226 O=[N+]([O-])\C=C\c1cccc(O)c1 Amb6296329 [1,1,0,0,0,0|1,0,1]=4 2626 B12R1.226 OB(O)\C=C\c1cccc(Br)c1 Amb25208384 [1,1,0,0,0,0|1,0,1]=4 2627 B12R1.226 OB(O)\C=C\c1cccc(Cl)c1 Amb10603469 [1,1,0,0,0,0|1,0,1]=4 2628 B12R1.891 CC(C)(C)\C=C/c1ccccc1 Amb22546614 [1,1,0,0,0,0|1,0,1]=4 2629 B12R1.891 CC(C)(N)\C=C\c1ccccc1 Amb32951520 [1,1,0,0,0,0|1,0,1]=4 2630 B12R1.891 CC(C)(O)\C=C\c1ccccc1 Amb32954377 [1,1,0,0,0,0|0,0,2]=4 2631 B12R1.891 CS(=O)(=O)\C=C\c1ccccc1 Amb4006709 [1,1,0,0,0,0|1,0,0]=3 2632 B12R1.891 C[Si](C)(C)\C=C\c1ccccc1 Amb26530802 [1,1,0,0,0,0|1,1,0]=4 2633 B12R1.891 NS(=O)(=O)\C=C\c1ccccc1 Amb34104901 [1,1,0,0,0,0|1,0,1]=4 2634 B12R1.891 O=P(Cl)(Cl)\C=C\c1ccccc1 Amb4297294 [1,1,0,0,0,0|2,0,0]=4 2635 B12R1.891 O=S(=O)(Cl)\C=C\c1ccccc1 Amb1149990 [1,1,0,0,0,0|1,0,1]=4 2636 B12R1.891 O=S(=O)(F)\C=C\c1ccccc1 Amb32661076 [1,1,0,0,0,0|1,0,1]=4 2637 B12R1.891 O=S(=O)(O)\C=C\c1ccccc1 Amb32664784 [1,1,0,0,0,0|1,0,0]=3 2638 B12R1.891 O=S(=O)([O-])\C=C\c1ccccc1 Amb8512119 [1,1,0,0,0,0|1,0,1]=4 2639 B12R1.15 COC(=O)CC(=O)c1ccco1 Amb2688611 [0,1,0,0,1,0|1,0,1]=4 2640 B12R1.15 COC(=O)CC(=O)c1cccs1 Amb2689992 [0,1,0,0,1,0|1,0,1]=4 2641 B12R1.15 COC(=O)CC(=O)c1ccoc1 Amb33292459 [0,1,0,0,1,0|1,0,1]=4 2642 B12R1.15 COC(=O)CC(=O)c1ccsc1 Amb19737337 [0,1,0,0,1,0|1,0,1]=4 2643 B12R1.15 COC(=O)\C=C(\C)c1cccs1 Amb26845102 [0,1,0,0,1,0|1,0,0]=3 2644 B12R1.15 COC(=O)\C=C(\C)c1ccsc1 Amb26643262 [0,1,0,0,1,0|1,0,0]=3 2645 B12R1.15 COC(=O)\C=C(\C)c1cncs1 Amb33492927 [0,1,0,0,1,0|2,0,0]=4 2646 B12R1.15 COC(=O)\C=C(\C)c1cscn1 Amb33492935 [0,1,0,0,1,0|2,0,0]=4 2647 B12R1.15 COC(=O)\C=C(\C)c1ncco1 Amb33492940 [0,1,0,0,1,0|2,0,0]=4 2648 B12R1.15 COC(=O)\C=C(\C)c1nccs1 Amb25837502 [0,1,0,0,1,0|2,0,0]=4 2649 B12R1.15 COC(=O)\C=C(\N)c1cccs1 Amb27268299 [0,1,0,0,1,0|1,0,0]=3 2650 B12R1.26 CNC(=O)\C=C\c1cc(Br)cs1 Amb27861729 [0,1,0,0,1,0|2,0,0]=4 2651 B12R1.26 CNC(=O)\C=C\c1ccc(Br)o1 Amb27389224 [0,1,0,0,1,0|2,0,0]=4 2652 B12R1.26 COC(=O)\C=C\C1=CC(=O)CC1 Amb24625806 [0,1,0,0,1,0|0,0,2]=4 2653 B12R1.26 COC(=O)\C=C\c1cc(Br)cs1 Amb27266167 [0,1,0,0,1,0|1,0,0]=3 2654 B12R1.26 COC(=O)\C=C\c1cc(C)co1 Amb27438727 [0,1,0,0,1,0|1,0,0]=3 2655 B12R1.26 COC(=O)\C=C\c1cc(C)no1 Amb28286950 [0,1,0,0,1,0|2,0,0]=4 2656 B12R1.26 COC(=O)\C=C\c1cc(C)ns1 Amb35704278 [0,1,0,0,1,0|2,0,0]=4 2657 B12R1.26 COC(=O)\C=C\c1cc(C)on1 Amb27474835 [0,1,0,0,1,0|2,0,0]=4 2658 B12R1.26 COC(=O)\C=C\c1ccc(Br)o1 Amb22342228 [0,1,0,0,1,0|1,0,0]=3 2659 B12R1.26 COC(=O)\C=C\c1ccc(Br)s1 Amb8631122 [0,1,0,0,1,0|1,0,0]=3 2660 B12R1.26 COC(=O)\C=C\c1ccc(C)o1 Amb22009458 [0,1,0,0,1,0|1,0,0]=3 2661 B12R1.26 COC(=O)\C=C\c1ccc(C)s1 Amb24487446 [0,1,0,0,1,0|1,0,0]=3 2662 B12R1.26 COC(=O)\C=C\c1ccc(Cl)o1 Amb25723979 [0,1,0,0,1,0|1,0,0]=3 2663 B12R1.26 COC(=O)\C=C\c1ccc(Cl)s1 Amb25070249 [0,1,0,0,1,0|1,0,0]=3 2664 B12R1.26 COC(=O)\C=C\c1cn(C)cn1 Amb28127903 [0,1,0,0,1,0|2,0,0]=4 2665 B12R1.26 COC(=O)\C=C\c1cnc(C)s1 Amb27213325 [0,1,0,0,1,0|2,0,0]=4 2666 B12R1.26 COC(=O)\C=C\c1cnc(Cl)s1 Amb33469142 [0,1,0,0,1,0|2,0,0]=4 2667 B12R1.26 COC(=O)\C=C\c1cnn(C)c1 Amb28367743 [0,1,0,0,1,0|2,0,0]=4 2668 B12R1.26 COC(=O)\C=C\c1csc(Br)c1 Amb27777824 [0,1,0,0,1,0|1,0,0]=3 2669 B12R1.26 COC(=O)\C=C\c1csc(Br)n1 Amb33469150 [0,1,0,0,1,0|2,0,0]=4 2670 B12R1.26 COC(=O)\C=C\c1csc(C)c1 Amb27881423 [0,1,0,0,1,0|1,0,0]=3 2671 B12R1.26 COC(=O)\C=C\c1csc(C)n1 Amb25034820 [0,1,0,0,1,0|2,0,0]=4 2672 B12R1.26 COC(=O)\C=C\c1ncc(Cl)s1 Amb28207676 [0,1,0,0,1,0|2,0,0]=4 2673 B12R1.51 CCNC(=O)\C=C\c1cccs1 Amb17786755 [0,1,0,0,1,0|2,0,0]=4 2674 B12R1.51 CCOC(=O)\C=C\c1ccco1 Amb1033025 [0,1,0,0,1,0|1,0,0]=3 2675 B12R1.51 CCOC(=O)\C=C\c1cccs1 Amb21858181 [0,1,0,0,1,0|1,0,0]=3 2676 B12R1.51 CCOC(=O)\C=C\c1ccsc1 Amb33990712 [0,1,0,0,1,0|1,0,0]=3 2677 B12R1.51 CCOC(=O)\C=C\c1cncs1 Amb33469175 [0,1,0,0,1,0|2,0,0]=4 2678 B12R1.51 CCOC(=O)\C=C\c1cscn1 Amb30594535 [0,1,0,0,1,0|2,0,0]=4 2679 B12R1.51 CCOC(=O)\C=C\c1nccs1 Amb33469170 [0,1,0,0,1,0|2,0,0]=4 2680 B12R1.51 CONC(=O)\C=C\c1cccs1 Amb28063549 [0,1,0,0,1,0|1,0,0]=3 2681 B12R1.108 COC(=O)C(=O)Cc1ccco1 Amb17138626 [0,1,0,0,1,0|1,0,1]=4 2682 B12R1.108 COC(=O)C(=O)Nc1ccsc1 Amb27416715 [0,1,0,0,1,0|2,0,0]=4 2683 B12R1.108 COC(=O)\C(O)=C\c1cccs1 Amb18010728 [0,1,0,0,1,0|1,0,0]=3 2684 B12R1.264 C=C(C)C(=O)\C=C\c1ccco1 Amb25252220 [0,1,0,0,1,0|2,0,0]=4 2685 B12R1.264 CC(O)C(=O)\C=C\c1ccco1 Amb28202271 [0,1,0,0,1,0|2,0,0]=4 2686 B12R1.264 CN(C)C(=O)\C=C\c1cccs1 Amb6813597 [0,1,0,0,1,0|2,0,0]=4 2687 B12R1.264 C[C@H](O)C(=O)\C=C\c1ccco1 Amb27177681 [0,1,0,0,1,0|2,0,0]=4 2688 B12R1.353 CNC(=O)\C=C\c1cccn1C Amb27982662 [0,1,0,0,1,0|2,0,0]=4 2689 B12R1.353 COC(=O)\C=C\c1cccn1C Amb24726149 [0,1,0,0,1,0|1,0,0]=3 2690 B12R1.353 COC(=O)\C=C\c1ccnn1C Amb27230597 [0,1,0,0,1,0|2,0,0]=4 2691 B12R1.353 COC(=O)\C=C\c1ccoc1C Amb26951802 [0,1,0,0,1,0|1,0,0]=3 2692 B12R1.353 COC(=O)\C=C\c1ccsc1C Amb28048438 [0,1,0,0,1,0|1,0,0]=3 2693 B12R1.353 COC(=O)\C=C\c1cncn1C Amb30585013 [0,1,0,0,1,0|2,0,0]=4 2694 B12R1.353 COC(=O)\C=C\c1cscc1Br Amb28323700 [0,1,0,0,1,0|1,0,0]=3 2695 B12R1.353 COC(=O)\C=C\c1ocnc1C Amb27643685 [0,1,0,0,1,0|2,0,0]=4 2696 B12R1.353 COC(=O)\C=C\c1sccc1Br Amb28046177 [0,1,0,0,1,0|1,0,0]=3 2697 B12R1.353 COC(=O)\C=C\c1sccc1C Amb2780356 [0,1,0,0,1,0|1,0,0]=3 2698 B12R1.353 COC(=O)\C=C\c1sccc1Cl Amb28146353 [0,1,0,0,1,0|1,0,0]=3 2699 B12R1.353 COC(=O)\C=C\c1scnc1C Amb26512216 [0,1,0,0,1,0|2,0,0]=4 2700 B12R1.34 C=C(C(=O)CC)c1ccccc1 Amb27177863 [0,1,0,0,1,0|1,0,0]=3 2701 B12R1.34 C=C(C(=O)CO)c1ccccc1 Amb27175970 [0,1,0,0,1,0|2,0,0]=4 2702 B12R1.34 C=C(C(=O)OC)c1ccccc1 Amb8392364 [0,1,0,0,1,0|0,0,0]=2 2703 B12R1.34 C=C(OC)C(=O)c1ccccc1 Amb17594034 [0,1,0,0,1,0|1,0,0]=3 2704 B12R1.34 C=C(OC)C(O)c1ccccc1 Amb27652842 [0,1,0,0,1,0|1,0,1]=4 2705 B12R1.34 CCC(=N)C(=O)c1ccccc1 Amb27590280 [0,1,0,0,1,0|2,0,0]=4 2706 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,1,0,0,1,0|1,0,0]=3 2707 B12R1.34 CCC(=O)C(=O)c1ccccn1 Amb25762144 [0,1,0,0,1,0|2,0,0]=4 2708 B12R1.34 CCC(=O)C(=O)c1cccnc1 Amb27436887 [0,1,0,0,1,0|2,0,0]=4 2709 B12R1.34 CCC(=O)C(=O)c1ccncc1 Amb25245097 [0,1,0,0,1,0|2,0,0]=4 2710 B12R1.34 CCC(=O)C(Br)c1ccccc1 Amb17596238 [0,1,0,0,1,0|1,0,1]=4 2711 B12R1.34 CCC(=O)C(C)c1ccccc1 Amb3940841 [0,1,0,0,1,0|1,0,1]=4 2712 B12R1.34 CCC(=O)C(Cl)c1ccccc1 Amb27477956 [0,1,0,0,1,0|1,0,1]=4 2713 B12R1.34 CCC(=O)C(F)c1ccccc1 Amb27668940 [0,1,0,0,1,0|1,0,1]=4 2714 B12R1.34 CCC(=O)C(N)c1ccccc1 Amb27244834 [0,1,0,0,1,0|1,0,1]=4 2715 B12R1.34 CCC(=O)C(O)c1ccccc1 Amb28201072 [0,1,0,0,1,0|1,0,1]=4 2716 B12R1.34 CCC(=O)N(C)c1ccccc1 Amb2611725 [0,1,0,0,1,0|2,0,0]=4 2717 B12R1.34 CCC(=O)N(N)c1ccccc1 Amb33191340 [0,1,0,0,1,0|2,0,0]=4 2718 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,1,0|1,0,0]=3 2719 B12R1.34 CNC(=O)C(Br)c1ccccc1 Amb8631535 [0,1,0,0,1,0|1,0,1]=4 2720 B12R1.34 CNC(=O)C(C)c1ccccc1 Amb28325026 [0,1,0,0,1,0|1,0,1]=4 2721 B12R1.34 CNC(=O)C(Cl)c1ccccc1 Amb9209230 [0,1,0,0,1,0|1,0,1]=4 2722 B12R1.34 CNC(=O)C(F)c1ccccc1 Amb27660594 [0,1,0,0,1,0|1,0,1]=4 2723 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb33549035 [0,1,0,0,1,0|1,0,1]=4 2724 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb9726565 [0,1,0,0,1,0|1,0,1]=4 2725 B12R1.34 CNC(=O)C(O)c1ccccc1 Amb17400179 [0,1,0,0,1,0|1,0,1]=4 2726 B12R1.34 CNC(=O)N(O)c1ccccc1 Amb4136448 [0,1,0,0,1,0|2,0,0]=4 2727 B12R1.34 CNC(=O)[C@@H](N)c1ccccc1 Amb17232478 [0,1,0,0,1,0|1,0,1]=4 2728 B12R1.34 CNC(=O)[C@@H](O)c1ccccc1 Amb28398484 [0,1,0,0,1,0|1,0,1]=4 2729 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,1,0,0,1,0|1,0,1]=4 2730 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb32686954 [0,1,0,0,1,0|1,0,1]=4 2731 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,1,0,0,1,0|1,0,1]=4 2732 B12R1.34 COC(=N)C(O)c1ccccc1 Amb27953078 [0,1,0,0,1,0|1,0,1]=4 2733 B12R1.34 COC(=O)C(=O)c1ccccc1 Amb6296065 [0,1,0,0,1,0|0,0,0]=2 2734 B12R1.34 COC(=O)C(=O)c1cnccn1 Amb27644359 [0,1,0,0,1,0|2,0,0]=4 2735 B12R1.34 COC(=O)C(Br)c1ccccc1 Amb3939722 [0,1,0,0,1,0|0,0,1]=3 2736 B12R1.34 COC(=O)C(Br)c1ccccn1 Amb25381199 [0,1,0,0,1,0|1,0,1]=4 2737 B12R1.34 COC(=O)C(Br)c1cccnc1 Amb31193090 [0,1,0,0,1,0|1,0,1]=4 2738 B12R1.34 COC(=O)C(Br)c1ccncc1 Amb31193091 [0,1,0,0,1,0|1,0,1]=4 2739 B12R1.34 COC(=O)C(C)c1ccccc1 Amb16185437 [0,1,0,0,1,0|0,0,1]=3 2740 B12R1.34 COC(=O)C(C)c1ccccn1 Amb19375013 [0,1,0,0,1,0|1,0,1]=4 2741 B12R1.34 COC(=O)C(C)c1cccnc1 Amb18798400 [0,1,0,0,1,0|1,0,1]=4 2742 B12R1.34 COC(=O)C(C)c1ccncc1 Amb19374810 [0,1,0,0,1,0|1,0,1]=4 2743 B12R1.34 COC(=O)C(Cl)c1ccccc1 Amb1212399 [0,1,0,0,1,0|0,0,1]=3 2744 B12R1.34 COC(=O)C(Cl)c1ccccn1 Amb27755409 [0,1,0,0,1,0|1,0,1]=4 2745 B12R1.34 COC(=O)C(Cl)c1cccnc1 Amb20668455 [0,1,0,0,1,0|1,0,1]=4 2746 B12R1.34 COC(=O)C(Cl)c1ccncc1 Amb24497439 [0,1,0,0,1,0|1,0,1]=4 2747 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,1,0,0,1,0|0,0,1]=3 2748 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1196141 [0,1,0,0,1,0|0,0,1]=3 2749 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1911591 [0,1,0,0,1,0|0,0,1]=3 2750 B12R1.34 COC(=O)C(N)c1ccccn1 Amb13883488 [0,1,0,0,1,0|1,0,1]=4 2751 B12R1.34 COC(=O)C(N)c1ccccn1 Amb19148994 [0,1,0,0,1,0|1,0,1]=4 2752 B12R1.34 COC(=O)C(N)c1ccccn1 Amb22640969 [0,1,0,0,1,0|1,0,1]=4 2753 B12R1.34 COC(=O)C(N)c1cccnc1 Amb13951620 [0,1,0,0,1,0|1,0,1]=4 2754 B12R1.34 COC(=O)C(N)c1cccnc1 Amb33534611 [0,1,0,0,1,0|1,0,1]=4 2755 B12R1.34 COC(=O)C(N)c1ccncc1 Amb23400053 [0,1,0,0,1,0|1,0,1]=4 2756 B12R1.34 COC(=O)C(N)c1ccncc1 Amb23401700 [0,1,0,0,1,0|1,0,1]=4 2757 B12R1.34 COC(=O)C(O)c1ccccc1 Amb3939682 [0,1,0,0,1,0|0,0,1]=3 2758 B12R1.34 COC(=O)C(O)c1ccccn1 Amb28289655 [0,1,0,0,1,0|1,0,1]=4 2759 B12R1.34 COC(=O)C(O)c1cccnc1 Amb18805578 [0,1,0,0,1,0|1,0,1]=4 2760 B12R1.34 COC(=O)C(O)c1cccnc1 Amb19351687 [0,1,0,0,1,0|1,0,1]=4 2761 B12R1.34 COC(=O)C(O)c1ccncc1 Amb23580591 [0,1,0,0,1,0|1,0,1]=4 2762 B12R1.34 COC(=O)C([NH-])c1ccccc1 Amb8439013 [0,1,0,0,1,0|0,0,1]=3 2763 B12R1.34 COC(=O)C([NH3+])c1ccccc1 Amb4006043 [0,1,0,0,1,0|0,0,1]=3 2764 B12R1.34 COC(=O)N(C)c1ccccn1 Amb27267967 [0,1,0,0,1,0|2,0,0]=4 2765 B12R1.34 COC(=O)N(N)c1ccccc1 Amb24688001 [0,1,0,0,1,0|1,0,0]=3 2766 B12R1.34 COC(=O)N(N)c1ccccn1 Amb26601045 [0,1,0,0,1,0|2,0,0]=4 2767 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,1,0,0,1,0|0,0,1]=3 2768 B12R1.34 COC(=O)[C@@H](Cl)c1ccccc1 Amb27984727 [0,1,0,0,1,0|0,0,1]=3 2769 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb3941407 [0,1,0,0,1,0|0,0,1]=3 2770 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb8627870 [0,1,0,0,1,0|0,0,1]=3 2771 B12R1.34 COC(=O)[C@@H](O)c1ccccc1 Amb3939704 [0,1,0,0,1,0|0,0,1]=3 2772 B12R1.34 COC(=O)[C@H](C)c1ccccc1 Amb28244200 [0,1,0,0,1,0|0,0,1]=3 2773 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,1,0,0,1,0|0,0,1]=3 2774 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb3940044 [0,1,0,0,1,0|0,0,1]=3 2775 B12R1.34 COC(=O)[C@H](N)c1ccccn1 Amb27449320 [0,1,0,0,1,0|1,0,1]=4 2776 B12R1.34 COC(=O)[C@H](O)c1ccccc1 Amb3939671 [0,1,0,0,1,0|0,0,1]=3 2777 B12R1.34 CON(C)C(=O)c1ccccc1 Amb4037088 [0,1,0,0,1,0|2,0,0]=4 2778 B12R1.34 C\C=C(/F)C(=O)c1ccccc1 Amb27176127 [0,1,0,0,1,0|2,0,0]=4 2779 B12R1.34 C\C=C(\Br)C(=O)c1ccccc1 Amb27776890 [0,1,0,0,1,0|2,0,0]=4 2780 B12R1.34 C\C=C(\C)C(=O)c1ccccc1 Amb25730208 [0,1,0,0,1,0|2,0,0]=4 2781 B12R1.34 N#CC(=O)C(=O)c1ccccc1 Amb27433531 [0,1,0,0,1,0|2,0,0]=4 2782 B12R1.34 O=C(CBr)C(=O)c1ccccc1 Amb17406921 [0,1,0,0,1,0|2,0,0]=4 2783 B12R1.34 O=C(CO)C(=O)c1ccccc1 Amb27178026 [0,1,0,0,1,0|2,0,0]=4 2784 B12R1.34 O=C(OS)C(O)c1ccccc1 Amb27593918 [0,1,0,0,1,0|1,0,1]=4 2785 B12R1.49 CCC(=O)Cc1ccc(Br)cc1 Amb17477612 [0,1,0,0,1,0|1,0,1]=4 2786 B12R1.49 CCC(=O)Cc1ccc(C)cc1 Amb33534983 [0,1,0,0,1,0|1,0,1]=4 2787 B12R1.49 CCC(=O)Cc1ccc(Cl)cc1 Amb17139038 [0,1,0,0,1,0|1,0,1]=4 2788 B12R1.49 CCC(=O)Cc1ccc(F)cc1 Amb17138600 [0,1,0,0,1,0|1,0,1]=4 2789 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [0,1,0,0,1,0|1,0,1]=4 2790 B12R1.49 CCC(=O)Nc1ccc(Br)cc1 Amb3097301 [0,1,0,0,1,0|2,0,0]=4 2791 B12R1.49 CCC(=O)Nc1ccc(C)cc1 Amb2786241 [0,1,0,0,1,0|2,0,0]=4 2792 B12R1.49 CCC(=O)Nc1ccc(F)cc1 Amb3098070 [0,1,0,0,1,0|2,0,0]=4 2793 B12R1.49 CCC(=O)Nc1ccc(N)cc1 Amb10187476 [0,1,0,0,1,0|2,0,0]=4 2794 B12R1.49 CCC(=O)Nc1ccc(N)cc1 Amb1116465 [0,1,0,0,1,0|2,0,0]=4 2795 B12R1.49 CCC(=O)Nc1ccc(O)cc1 Amb2041133 [0,1,0,0,1,0|2,0,0]=4 2796 B12R1.49 CCC(=O)Nc1ccc(S)cc1 Amb27154268 [0,1,0,0,1,0|2,0,0]=4 2797 B12R1.49 CCC(=O)Oc1ccc(Br)cc1 Amb3124761 [0,1,0,0,1,0|2,0,0]=4 2798 B12R1.49 CCC(=O)Oc1ccc(C)cc1 Amb26984286 [0,1,0,0,1,0|2,0,0]=4 2799 B12R1.49 CCC(=O)Oc1ccc(N)cc1 Amb18646257 [0,1,0,0,1,0|2,0,0]=4 2800 B12R1.49 CCC(=O)Oc1ccc(O)cc1 Amb18646456 [0,1,0,0,1,0|2,0,0]=4 2801 B12R1.49 CCC(=O)Sc1ccc(C)cc1 Amb2447238 [0,1,0,0,1,0|2,0,0]=4 2802 B12R1.49 CNC(=O)Cc1ccc(Br)cc1 Amb2631901 [0,1,0,0,1,0|1,0,1]=4 2803 B12R1.49 CNC(=O)Cc1ccc(C)cc1 Amb1795465 [0,1,0,0,1,0|1,0,1]=4 2804 B12R1.49 CNC(=O)Cc1ccc(Cl)cc1 Amb3886814 [0,1,0,0,1,0|1,0,1]=4 2805 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb1117771 [0,1,0,0,1,0|1,0,1]=4 2806 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb15740907 [0,1,0,0,1,0|1,0,1]=4 2807 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [0,1,0,0,1,0|1,0,1]=4 2808 B12R1.49 CNC(=O)Nc1ccc(C)cc1 Amb3100985 [0,1,0,0,1,0|2,0,0]=4 2809 B12R1.49 CNC(=O)Nc1ccc(I)cc1 Amb27656299 [0,1,0,0,1,0|2,0,0]=4 2810 B12R1.49 CNC(=O)Nc1ccc(N)cc1 Amb7969385 [0,1,0,0,1,0|2,0,0]=4 2811 B12R1.49 CNC(=O)Oc1ccc(Br)cc1 Amb4035803 [0,1,0,0,1,0|2,0,0]=4 2812 B12R1.49 CNC(=O)Oc1ccc(F)cc1 Amb4034483 [0,1,0,0,1,0|2,0,0]=4 2813 B12R1.49 CNC(=O)Oc1ccc(N)cc1 Amb28138056 [0,1,0,0,1,0|2,0,0]=4 2814 B12R1.49 CNC(=O)Oc1ccc(O)cc1 Amb35609765 [0,1,0,0,1,0|2,0,0]=4 2815 B12R1.49 CNC(=O)Oc1ccc(S)cc1 Amb28243833 [0,1,0,0,1,0|2,0,0]=4 2816 B12R1.49 CNC(=O)Sc1ccc(Cl)cc1 Amb4035562 [0,1,0,0,1,0|2,0,0]=4 2817 B12R1.49 CNC(=O)Sc1ccc(F)cc1 Amb27607772 [0,1,0,0,1,0|2,0,0]=4 2818 B12R1.49 CNC(=O)Sc1ccc(O)cc1 Amb27815118 [0,1,0,0,1,0|2,0,0]=4 2819 B12R1.49 COC(=N)Cc1ccc(C)cc1 Amb18798199 [0,1,0,0,1,0|1,0,1]=4 2820 B12R1.49 COC(=N)Cc1ccc(N)cc1 Amb27233001 [0,1,0,0,1,0|1,0,1]=4 2821 B12R1.49 COC(=N)Cc1ccc(O)cc1 Amb18792627 [0,1,0,0,1,0|1,0,1]=4 2822 B12R1.49 COC(=O)CC1=CNC(=O)C=C1 Amb27974109 [0,1,0,0,1,0|1,0,1]=4 2823 B12R1.49 COC(=O)CN1C=CC(=O)C=C1 Amb18788533 [0,1,0,0,1,0|1,0,1]=4 2824 B12R1.49 COC(=O)Cc1ccc(Br)cc1 Amb843215 [0,1,0,0,1,0|0,0,1]=3 2825 B12R1.49 COC(=O)Cc1ccc(Br)cn1 Amb22388580 [0,1,0,0,1,0|1,0,1]=4 2826 B12R1.49 COC(=O)Cc1ccc(Br)nc1 Amb26057348 [0,1,0,0,1,0|1,0,1]=4 2827 B12R1.49 COC(=O)Cc1ccc(C)cc1 Amb843206 [0,1,0,0,1,0|0,0,1]=3 2828 B12R1.49 COC(=O)Cc1ccc(C)cn1 Amb22750281 [0,1,0,0,1,0|1,0,1]=4 2829 B12R1.49 COC(=O)Cc1ccc(C)nc1 Amb24179228 [0,1,0,0,1,0|1,0,1]=4 2830 B12R1.49 COC(=O)Cc1ccc(Cl)cc1 Amb843209 [0,1,0,0,1,0|0,0,1]=3 2831 B12R1.49 COC(=O)Cc1ccc(Cl)cn1 Amb23437494 [0,1,0,0,1,0|1,0,1]=4 2832 B12R1.49 COC(=O)Cc1ccc(Cl)nc1 Amb22494153 [0,1,0,0,1,0|1,0,1]=4 2833 B12R1.49 COC(=O)Cc1ccc(F)cc1 Amb6336634 [0,1,0,0,1,0|0,0,1]=3 2834 B12R1.49 COC(=O)Cc1ccc(F)cn1 Amb27951022 [0,1,0,0,1,0|1,0,1]=4 2835 B12R1.49 COC(=O)Cc1ccc(I)cc1 Amb10601390 [0,1,0,0,1,0|0,0,1]=3 2836 B12R1.49 COC(=O)Cc1ccc(I)nc1 Amb25223569 [0,1,0,0,1,0|1,0,1]=4 2837 B12R1.49 COC(=O)Cc1ccc(N)cc1 Amb2691375 [0,1,0,0,1,0|0,0,1]=3 2838 B12R1.49 COC(=O)Cc1ccc(N)cc1 Amb318183 [0,1,0,0,1,0|0,0,1]=3 2839 B12R1.49 COC(=O)Cc1ccc(N)cn1 Amb20248326 [0,1,0,0,1,0|1,0,1]=4 2840 B12R1.49 COC(=O)Cc1ccc(N)nc1 Amb25993882 [0,1,0,0,1,0|1,0,1]=4 2841 B12R1.49 COC(=O)Cc1ccc(O)cc1 Amb6357411 [0,1,0,0,1,0|0,0,1]=3 2842 B12R1.49 COC(=O)Nc1ccc(Br)cc1 Amb33532984 [0,1,0,0,1,0|1,0,0]=3 2843 B12R1.49 COC(=O)Nc1ccc(Br)cn1 Amb6317293 [0,1,0,0,1,0|2,0,0]=4 2844 B12R1.49 COC(=O)Nc1ccc(Br)nc1 Amb16982206 [0,1,0,0,1,0|2,0,0]=4 2845 B12R1.49 COC(=O)Nc1ccc(C)cc1 Amb17787412 [0,1,0,0,1,0|1,0,0]=3 2846 B12R1.49 COC(=O)Nc1ccc(Cl)cc1 Amb3361017 [0,1,0,0,1,0|1,0,0]=3 2847 B12R1.49 COC(=O)Nc1ccc(Cl)cn1 Amb6316360 [0,1,0,0,1,0|2,0,0]=4 2848 B12R1.49 COC(=O)Nc1ccc(I)cc1 Amb17861293 [0,1,0,0,1,0|1,0,0]=3 2849 B12R1.49 COC(=O)Nc1ccc(N)cc1 Amb6668684 [0,1,0,0,1,0|1,0,0]=3 2850 B12R1.49 COC(=O)Nc1ccc(N)cn1 Amb27757226 [0,1,0,0,1,0|2,0,0]=4 2851 B12R1.49 COC(=O)Nc1ccc(O)cc1 Amb6738850 [0,1,0,0,1,0|1,0,0]=3 2852 B12R1.49 COC(=O)Nc1ccc(S)nc1 Amb28243831 [0,1,0,0,1,0|2,0,0]=4 2853 B12R1.49 COC(=O)Oc1ccc(Br)cc1 Amb25307376 [0,1,0,0,1,0|1,0,0]=3 2854 B12R1.49 COC(=O)Oc1ccc(Cl)cc1 Amb27255120 [0,1,0,0,1,0|1,0,0]=3 2855 B12R1.49 COC(=O)Oc1ccc(F)cc1 Amb25821230 [0,1,0,0,1,0|1,0,0]=3 2856 B12R1.49 COC(=O)Oc1ccc(N)cc1 Amb27834323 [0,1,0,0,1,0|1,0,0]=3 2857 B12R1.49 COC(=S)Cc1ccc(F)cc1 Amb27666149 [0,1,0,0,1,0|0,1,1]=4 2858 B12R1.49 CSC(=O)Nc1ccc(F)cc1 Amb27752021 [0,1,0,0,1,0|1,1,0]=4 2859 B12R1.49 NOC(=O)Nc1ccc(Cl)cc1 Amb27446553 [0,1,0,0,1,0|2,0,0]=4 2860 B12R1.50 CCC(=O)Cc1cccc(Br)c1 Amb17477613 [0,1,0,0,1,0|1,0,1]=4 2861 B12R1.50 CCC(=O)Cc1cccc(C)c1 Amb17138543 [0,1,0,0,1,0|1,0,1]=4 2862 B12R1.50 CCC(=O)Cc1cccc(Cl)c1 Amb17139042 [0,1,0,0,1,0|1,0,1]=4 2863 B12R1.50 CCC(=O)Cc1cccc(F)c1 Amb17138604 [0,1,0,0,1,0|1,0,1]=4 2864 B12R1.50 CCC(=O)Cc1cccc(N)c1 Amb27625936 [0,1,0,0,1,0|1,0,1]=4 2865 B12R1.50 CCC(=O)Nc1cccc(Br)c1 Amb1885365 [0,1,0,0,1,0|2,0,0]=4 2866 B12R1.50 CCC(=O)Nc1cccc(Cl)c1 Amb3097299 [0,1,0,0,1,0|2,0,0]=4 2867 B12R1.50 CCC(=O)Nc1cccc(N)c1 Amb1118353 [0,1,0,0,1,0|2,0,0]=4 2868 B12R1.50 CCC(=O)Nc1cccc(O)c1 Amb2025988 [0,1,0,0,1,0|2,0,0]=4 2869 B12R1.50 CCC(=O)Oc1cccc(C)c1 Amb25198730 [0,1,0,0,1,0|2,0,0]=4 2870 B12R1.50 CCC(=O)Oc1cccc(Cl)c1 Amb25800916 [0,1,0,0,1,0|2,0,0]=4 2871 B12R1.50 CCC(=O)Oc1cccc(F)c1 Amb25153440 [0,1,0,0,1,0|2,0,0]=4 2872 B12R1.50 CCC(=O)Oc1cccc(O)c1 Amb22167292 [0,1,0,0,1,0|2,0,0]=4 2873 B12R1.50 CNC(=O)Cc1cccc(N)c1 Amb8426826 [0,1,0,0,1,0|1,0,1]=4 2874 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [0,1,0,0,1,0|1,0,1]=4 2875 B12R1.50 CNC(=O)Nc1cccc(Br)c1 Amb4016617 [0,1,0,0,1,0|2,0,0]=4 2876 B12R1.50 CNC(=O)Nc1cccc(C)c1 Amb4020805 [0,1,0,0,1,0|2,0,0]=4 2877 B12R1.50 CNC(=O)Nc1cccc(Cl)c1 Amb3099668 [0,1,0,0,1,0|2,0,0]=4 2878 B12R1.50 CNC(=O)Nc1cccc(F)c1 Amb22435126 [0,1,0,0,1,0|2,0,0]=4 2879 B12R1.50 CNC(=O)Nc1cccc(I)c1 Amb11258974 [0,1,0,0,1,0|2,0,0]=4 2880 B12R1.50 CNC(=O)Nc1cccc(N)c1 Amb33545775 [0,1,0,0,1,0|2,0,0]=4 2881 B12R1.50 CNC(=O)Oc1cccc(C)c1 Amb2732296 [0,1,0,0,1,0|2,0,0]=4 2882 B12R1.50 CNC(=O)Oc1cccc(Cl)c1 Amb24309165 [0,1,0,0,1,0|2,0,0]=4 2883 B12R1.50 CNC(=O)Oc1cccc(F)c1 Amb25674242 [0,1,0,0,1,0|2,0,0]=4 2884 B12R1.50 CNC(=O)Oc1cccc(N)c1 Amb27454823 [0,1,0,0,1,0|2,0,0]=4 2885 B12R1.50 CNC(=O)Oc1cccc(O)c1 Amb24063537 [0,1,0,0,1,0|2,0,0]=4 2886 B12R1.50 COC(=O)C[n+]1cccc(C)c1 Amb28370536 [0,1,0,0,1,0|1,0,1]=4 2887 B12R1.50 COC(=O)Cc1cc(Br)ccn1 Amb25969455 [0,1,0,0,1,0|1,0,1]=4 2888 B12R1.50 COC(=O)Cc1cc(C)ccn1 Amb22750287 [0,1,0,0,1,0|1,0,1]=4 2889 B12R1.50 COC(=O)Cc1cc(Cl)ccn1 Amb22752816 [0,1,0,0,1,0|1,0,1]=4 2890 B12R1.50 COC(=O)Cc1cc(Cl)ccn1 Amb22899188 [0,1,0,0,1,0|1,0,1]=4 2891 B12R1.50 COC(=O)Cc1cc(N)ccn1 Amb27239107 [0,1,0,0,1,0|1,0,1]=4 2892 B12R1.50 COC(=O)Cc1ccc[n+]([O-])c1 Amb32409825 [0,1,0,0,1,0|1,0,1]=4 2893 B12R1.50 COC(=O)Cc1cccc(Br)c1 Amb2696963 [0,1,0,0,1,0|0,0,1]=3 2894 B12R1.50 COC(=O)Cc1cccc(Br)n1 Amb22232089 [0,1,0,0,1,0|1,0,1]=4 2895 B12R1.50 COC(=O)Cc1cccc(C)c1 Amb8517236 [0,1,0,0,1,0|0,0,1]=3 2896 B12R1.50 COC(=O)Cc1cccc(C)n1 Amb21857032 [0,1,0,0,1,0|1,0,1]=4 2897 B12R1.50 COC(=O)Cc1cccc(Cl)c1 Amb6365713 [0,1,0,0,1,0|0,0,1]=3 2898 B12R1.50 COC(=O)Cc1cccc(Cl)n1 Amb10976128 [0,1,0,0,1,0|1,0,1]=4 2899 B12R1.50 COC(=O)Cc1cccc(F)c1 Amb6357324 [0,1,0,0,1,0|0,0,1]=3 2900 B12R1.50 COC(=O)Cc1cccc(F)n1 Amb24422962 [0,1,0,0,1,0|1,0,1]=4 2901 B12R1.50 COC(=O)Cc1cccc(I)c1 Amb26016370 [0,1,0,0,1,0|0,0,1]=3 2902 B12R1.50 COC(=O)Cc1cccc(N)c1 Amb10071208 [0,1,0,0,1,0|0,0,1]=3 2903 B12R1.50 COC(=O)Cc1cccc(N)c1 Amb6296533 [0,1,0,0,1,0|0,0,1]=3 2904 B12R1.50 COC(=O)Cc1cccc(N)n1 Amb25336485 [0,1,0,0,1,0|1,0,1]=4 2905 B12R1.50 COC(=O)Cc1cccc(O)c1 Amb3941018 [0,1,0,0,1,0|0,0,1]=3 2906 B12R1.50 COC(=O)Cc1ccnc(Br)c1 Amb24483854 [0,1,0,0,1,0|1,0,1]=4 2907 B12R1.50 COC(=O)Cc1ccnc(C)c1 Amb23441228 [0,1,0,0,1,0|1,0,1]=4 2908 B12R1.50 COC(=O)Cc1ccnc(Cl)c1 Amb6308554 [0,1,0,0,1,0|1,0,1]=4 2909 B12R1.50 COC(=O)Cc1ccnc(F)c1 Amb25106259 [0,1,0,0,1,0|1,0,1]=4 2910 B12R1.50 COC(=O)Cc1ccnc(N)c1 Amb25299195 [0,1,0,0,1,0|1,0,1]=4 2911 B12R1.50 COC(=O)Cc1cncc(Br)c1 Amb21857140 [0,1,0,0,1,0|1,0,1]=4 2912 B12R1.50 COC(=O)Cc1cncc(C)c1 Amb26398782 [0,1,0,0,1,0|1,0,1]=4 2913 B12R1.50 COC(=O)Cc1cncc(Cl)c1 Amb27613117 [0,1,0,0,1,0|1,0,1]=4 2914 B12R1.50 COC(=O)Nc1cc(Br)ccn1 Amb27403721 [0,1,0,0,1,0|2,0,0]=4 2915 B12R1.50 COC(=O)Nc1cc(C)ccn1 Amb3366377 [0,1,0,0,1,0|2,0,0]=4 2916 B12R1.50 COC(=O)Nc1cc(Cl)ccn1 Amb10070699 [0,1,0,0,1,0|2,0,0]=4 2917 B12R1.50 COC(=O)Nc1cc(N)ccn1 Amb27770703 [0,1,0,0,1,0|2,0,0]=4 2918 B12R1.50 COC(=O)Nc1cccc(Br)c1 Amb6514663 [0,1,0,0,1,0|1,0,0]=3 2919 B12R1.50 COC(=O)Nc1cccc(F)c1 Amb3361467 [0,1,0,0,1,0|1,0,0]=3 2920 B12R1.50 COC(=O)Nc1cccc(N)c1 Amb17622185 [0,1,0,0,1,0|1,0,0]=3 2921 B12R1.50 COC(=O)Nc1cccc(N)c1 Amb6668690 [0,1,0,0,1,0|1,0,0]=3 2922 B12R1.50 COC(=O)Nc1cccc(O)c1 Amb6738862 [0,1,0,0,1,0|1,0,0]=3 2923 B12R1.50 COC(=O)Nc1ccnc(N)c1 Amb35678016 [0,1,0,0,1,0|2,0,0]=4 2924 B12R1.50 COC(=O)Nc1cncc(Cl)c1 Amb35671565 [0,1,0,0,1,0|2,0,0]=4 2925 B12R1.50 COC(=O)Nc1cncc(F)c1 Amb27761941 [0,1,0,0,1,0|2,0,0]=4 2926 B12R1.50 COC(=O)Nc1cncc(I)c1 Amb24331628 [0,1,0,0,1,0|2,0,0]=4 2927 B12R1.50 COC(=O)Oc1cccc(C)c1 Amb27190644 [0,1,0,0,1,0|1,0,0]=3 2928 B12R1.50 COC(=O)Oc1cccc(Cl)c1 Amb27256013 [0,1,0,0,1,0|1,0,0]=3 2929 B12R1.50 COC(=O)Oc1cccc(F)c1 Amb27973636 [0,1,0,0,1,0|1,0,0]=3 2930 B12R1.50 COC(=O)Oc1cccc(I)c1 Amb28129224 [0,1,0,0,1,0|1,0,0]=3 2931 B12R1.50 COC(=S)Nc1cccc(F)c1 Amb27827828 [0,1,0,0,1,0|1,1,0]=4 2932 B12R1.50 CSC(=O)Nc1cccc(Cl)c1 Amb27754086 [0,1,0,0,1,0|1,1,0]=4 2933 B12R1.118 CCC(=Cc1ccccc1)CC Amb27807779 [0,1,0,0,1,0|2,0,0]=4 2934 B12R1.118 CC\C(=C\c1ccccc1)CO Amb27860945 [0,1,0,0,1,0|1,0,1]=4 2935 B12R1.118 CC\C(C=O)=C/c1ccccc1 Amb615951 [0,1,0,0,1,0|1,0,0]=3 2936 B12R1.118 CC\C(C=O)=C/c1ccccn1 Amb17334523 [0,1,0,0,1,0|2,0,0]=4 2937 B12R1.118 CC\C(C=O)=C/c1cccnc1 Amb17334524 [0,1,0,0,1,0|2,0,0]=4 2938 B12R1.118 CC\C(C=O)=C/c1ccncc1 Amb17334525 [0,1,0,0,1,0|2,0,0]=4 2939 B12R1.118 CC\C(C=O)=C\c1cccnc1 Amb28321082 [0,1,0,0,1,0|2,0,0]=4 2940 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [0,1,0,0,1,0|0,0,2]=4 2941 B12R1.118 CO\C(=C\c1ccccc1)CO Amb27457627 [0,1,0,0,1,0|0,0,1]=3 2942 B12R1.118 CO\C(C=O)=C\c1ccccc1 Amb17594035 [0,1,0,0,1,0|0,0,0]=2 2943 B12R1.118 CS\C(C#N)=C\c1ccccc1 Amb17594452 [0,1,0,0,1,0|1,1,0]=4 2944 B12R1.118 CS\C(C=O)=C/c1ccccc1 Amb27614686 [0,1,0,0,1,0|0,1,0]=3 2945 B12R1.118 C\C=C(/C=O)Cc1ccccc1 Amb25743406 [0,1,0,0,1,0|1,0,1]=4 2946 B12R1.118 O=CC(C=O)=Cc1ccccc1 Amb18645276 [0,1,0,0,1,0|2,0,0]=4 2947 B12R1.118 O=C\C(=C/c1ccccc1)CCl Amb27640646 [0,1,0,0,1,0|2,0,0]=4 2948 B12R1.118 O=C\C(=C\c1ccccc1)CO Amb27769967 [0,1,0,0,1,0|2,0,0]=4 2949 B12R1.194 COP(=O)(Cl)Oc1ccccc1 Amb27603392 [0,1,0,0,1,0|2,0,0]=4 2950 B12R1.194 COS(=O)(=O)Cc1ccccc1 Amb28244702 [0,1,0,0,1,0|1,0,1]=4 2951 B12R1.371 CCC(=O)Cc1ccccc1Br Amb33534982 [0,1,0,0,1,0|1,0,1]=4 2952 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,1,0,0,1,0|1,0,1]=4 2953 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,1,0,0,1,0|1,0,1]=4 2954 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,1,0,0,1,0|1,0,1]=4 2955 B12R1.371 CCC(=O)Nc1ccccc1Br Amb2222500 [0,1,0,0,1,0|2,0,0]=4 2956 B12R1.371 CCC(=O)Nc1ccccc1F Amb3098071 [0,1,0,0,1,0|2,0,0]=4 2957 B12R1.371 CCC(=O)Nc1ccccc1I Amb1788758 [0,1,0,0,1,0|2,0,0]=4 2958 B12R1.371 CCC(=O)Nc1ccccc1N Amb1114296 [0,1,0,0,1,0|2,0,0]=4 2959 B12R1.371 CCC(=O)Nc1ccccc1O Amb6540573 [0,1,0,0,1,0|2,0,0]=4 2960 B12R1.371 CCC(=O)Oc1ccccc1Br Amb26609039 [0,1,0,0,1,0|2,0,0]=4 2961 B12R1.371 CCC(=O)Oc1ccccc1Cl Amb3123529 [0,1,0,0,1,0|2,0,0]=4 2962 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,1,0,0,1,0|2,0,0]=4 2963 B12R1.371 CCC(=O)Oc1ccccc1I Amb27752759 [0,1,0,0,1,0|2,0,0]=4 2964 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,1,0,0,1,0|2,0,0]=4 2965 B12R1.371 CC\C(C)=C/c1ccccc1O Amb28253700 [0,1,0,0,1,0|2,0,0]=4 2966 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,1,0,0,1,0|1,0,1]=4 2967 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,1,0,0,1,0|1,0,1]=4 2968 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,1,0,0,1,0|1,0,1]=4 2969 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,1,0,0,1,0|1,0,1]=4 2970 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,1,0,0,1,0|1,0,1]=4 2971 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [0,1,0,0,1,0|2,0,0]=4 2972 B12R1.371 CNC(=O)Nc1ccccc1Cl Amb4010921 [0,1,0,0,1,0|2,0,0]=4 2973 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [0,1,0,0,1,0|2,0,0]=4 2974 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [0,1,0,0,1,0|2,0,0]=4 2975 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,1,0,0,1,0|2,0,0]=4 2976 B12R1.371 COC(=O)CC1=CC=CNC1=O Amb28385509 [0,1,0,0,1,0|1,0,1]=4 2977 B12R1.371 COC(=O)CC1=COC=CC1=O Amb27861351 [0,1,0,0,1,0|1,0,1]=4 2978 B12R1.371 COC(=O)CN1C=CC=CC1=O Amb18805575 [0,1,0,0,1,0|1,0,1]=4 2979 B12R1.371 COC(=O)C[n+]1ccccc1F Amb28204745 [0,1,0,0,1,0|1,0,1]=4 2980 B12R1.371 COC(=O)C[n+]1ccccc1N Amb26640179 [0,1,0,0,1,0|1,0,1]=4 2981 B12R1.371 COC(=O)Cc1ccccc1Br Amb8471030 [0,1,0,0,1,0|0,0,1]=3 2982 B12R1.371 COC(=O)Cc1ccccc1C Amb6357785 [0,1,0,0,1,0|0,0,1]=3 2983 B12R1.371 COC(=O)Cc1ccccc1Cl Amb6365742 [0,1,0,0,1,0|0,0,1]=3 2984 B12R1.371 COC(=O)Cc1ccccc1F Amb6336633 [0,1,0,0,1,0|0,0,1]=3 2985 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [0,1,0,0,1,0|0,0,1]=3 2986 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [0,1,0,0,1,0|0,0,1]=3 2987 B12R1.371 COC(=O)Cc1ccccc1N Amb8427007 [0,1,0,0,1,0|0,0,1]=3 2988 B12R1.371 COC(=O)Cc1ccccc1O Amb2699823 [0,1,0,0,1,0|0,0,1]=3 2989 B12R1.371 COC(=O)Cc1cccnc1Cl Amb22396231 [0,1,0,0,1,0|1,0,1]=4 2990 B12R1.371 COC(=O)Cc1cccnc1N Amb27258967 [0,1,0,0,1,0|1,0,1]=4 2991 B12R1.371 COC(=O)Cc1ccncc1Br Amb22586456 [0,1,0,0,1,0|1,0,1]=4 2992 B12R1.371 COC(=O)Cc1ccncc1Cl Amb28251565 [0,1,0,0,1,0|1,0,1]=4 2993 B12R1.371 COC(=O)Cc1ccncc1N Amb22371407 [0,1,0,0,1,0|1,0,1]=4 2994 B12R1.371 COC(=O)Cc1cnccc1N Amb24524861 [0,1,0,0,1,0|1,0,1]=4 2995 B12R1.371 COC(=O)Cc1ncccc1Br Amb22263925 [0,1,0,0,1,0|1,0,1]=4 2996 B12R1.371 COC(=O)Cc1ncccc1C Amb22750241 [0,1,0,0,1,0|1,0,1]=4 2997 B12R1.371 COC(=O)Cc1ncccc1Cl Amb22750289 [0,1,0,0,1,0|1,0,1]=4 2998 B12R1.371 COC(=O)Cc1ncccc1N Amb27225718 [0,1,0,0,1,0|1,0,1]=4 2999 B12R1.371 COC(=O)Nc1ccccc1Br Amb6498257 [0,1,0,0,1,0|1,0,0]=3 3000 B12R1.371 COC(=O)Nc1ccccc1C Amb17846660 [0,1,0,0,1,0|1,0,0]=3 3001 B12R1.371 COC(=O)Nc1ccccc1Cl Amb6514664 [0,1,0,0,1,0|1,0,0]=3 3002 B12R1.371 COC(=O)Nc1ccccc1F Amb6514672 [0,1,0,0,1,0|1,0,0]=3 3003 B12R1.371 COC(=O)Nc1ccccc1O Amb2611880 [0,1,0,0,1,0|1,0,0]=3 3004 B12R1.371 COC(=O)Nc1cccnc1C Amb27840459 [0,1,0,0,1,0|2,0,0]=4 3005 B12R1.371 COC(=O)Nc1ccncc1C Amb27260103 [0,1,0,0,1,0|2,0,0]=4 3006 B12R1.371 COC(=O)Nc1ccncc1F Amb27841855 [0,1,0,0,1,0|2,0,0]=4 3007 B12R1.371 COC(=O)Nc1ccncc1N Amb18967350 [0,1,0,0,1,0|2,0,0]=4 3008 B12R1.371 COC(=O)Nc1cnccc1C Amb28555762 [0,1,0,0,1,0|2,0,0]=4 3009 B12R1.371 COC(=O)Nc1cnccc1C Amb8388558 [0,1,0,0,1,0|2,0,0]=4 3010 B12R1.371 COC(=O)Nc1ncccc1I Amb27443838 [0,1,0,0,1,0|2,0,0]=4 3011 B12R1.371 COC(=S)Nc1ccccc1Cl Amb2768178 [0,1,0,0,1,0|1,1,0]=4 3012 B14R1.13 CNC(=O)N\N=C\c1ccc(Cl)cc1 Amb25917297 [0,1,0,0,0,1|2,0,0]=4 3013 B14R1.13 COC(=O)C#CCc1ccc(Br)cc1 Amb27837275 [0,1,0,0,0,1|0,0,2]=4 3014 B14R1.13 COC(=O)C#CCc1ccc(C)cc1 Amb27448192 [0,1,0,0,0,1|0,0,2]=4 3015 B14R1.13 COC(=O)CCCc1ccc(Br)cc1 Amb18629275 [0,1,0,0,0,1|0,0,2]=4 3016 B14R1.13 COC(=O)CCCc1ccc(C)cc1 Amb18110189 [0,1,0,0,0,1|0,0,2]=4 3017 B14R1.13 COC(=O)CCCc1ccc(Cl)cc1 Amb18629276 [0,1,0,0,0,1|0,0,2]=4 3018 B14R1.13 COC(=O)CCCc1ccc(F)cc1 Amb18110191 [0,1,0,0,0,1|0,0,2]=4 3019 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb22728278 [0,1,0,0,0,1|0,0,2]=4 3020 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb8391153 [0,1,0,0,0,1|0,0,2]=4 3021 B14R1.13 COC(=O)CCNc1ccc(Br)cc1 Amb1981435 [0,1,0,0,0,1|0,0,2]=4 3022 B14R1.13 COC(=O)CCNc1ccc(C)cc1 Amb9024004 [0,1,0,0,0,1|0,0,2]=4 3023 B14R1.13 COC(=O)CCNc1ccc(Cl)cc1 Amb2737282 [0,1,0,0,0,1|0,0,2]=4 3024 B14R1.13 COC(=O)CCNc1ccc(F)cc1 Amb9026328 [0,1,0,0,0,1|0,0,2]=4 3025 B14R1.13 COC(=O)CCNc1ccc(O)cc1 Amb30588582 [0,1,0,0,0,1|0,0,2]=4 3026 B14R1.13 COC(=O)CCOc1ccc(Br)cc1 Amb7773736 [0,1,0,0,0,1|0,0,2]=4 3027 B14R1.13 COC(=O)CCOc1ccc(F)cc1 Amb9204521 [0,1,0,0,0,1|0,0,2]=4 3028 B14R1.13 COC(=O)CCOc1ccc(N)cc1 Amb13951735 [0,1,0,0,0,1|0,0,2]=4 3029 B14R1.13 COC(=O)CNCc1ccc(C)cc1 Amb6686949 [0,1,0,0,0,1|0,0,2]=4 3030 B14R1.13 COC(=O)CNCc1ccc(Cl)cc1 Amb10609077 [0,1,0,0,0,1|0,0,2]=4 3031 B14R1.13 COC(=O)CNCc1ccc(Cl)cc1 Amb6686925 [0,1,0,0,0,1|0,0,2]=4 3032 B14R1.13 COC(=O)CNCc1ccc(F)cc1 Amb6686928 [0,1,0,0,0,1|0,0,2]=4 3033 B14R1.13 COC(=O)CSCc1ccc(Cl)cc1 Amb6383265 [0,1,0,0,0,1|0,0,2]=4 3034 B14R1.13 COC(=O)CSCc1ccc(N)cc1 Amb9482336 [0,1,0,0,0,1|0,0,2]=4 3035 B14R1.13 COC(=O)NCCc1ccc(C)cc1 Amb28482985 [0,1,0,0,0,1|0,0,2]=4 3036 B14R1.13 COC(=O)NCCc1ccc(N)cc1 Amb8390016 [0,1,0,0,0,1|0,0,2]=4 3037 B14R1.13 COC(=O)N\N=C\c1ccc(C)cc1 Amb3363191 [0,1,0,0,0,1|1,0,0]=3 3038 B14R1.13 COC(=O)N\N=C\c1ccc(N)nc1 Amb28045641 [0,1,0,0,0,1|2,0,0]=4 3039 B14R1.13 COC(=O)\C=C\Nc1ccc(C)cc1 Amb27951188 [0,1,0,0,0,1|0,0,0]=2 3040 B14R1.13 Cc1ccc(N\C=C\C(=O)CCl)cc1 Amb27252966 [0,1,0,0,0,1|2,0,0]=4 3041 B14R1.163 CCC(=O)NCC(=O)c1ccccc1 Amb17336295 [0,1,0,0,0,1|1,0,1]=4 3042 B14R1.163 CCC(=O)NNC(=O)c1ccccc1 Amb3097318 [0,1,0,0,0,1|2,0,0]=4 3043 B14R1.163 CC\C(C)=C/NC(=O)c1ccccc1 Amb27653322 [0,1,0,0,0,1|2,0,0]=4 3044 B14R1.163 CC\C(C)=C\NC(=O)c1ccccc1 Amb27980466 [0,1,0,0,0,1|2,0,0]=4 3045 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,1,0,0,0,1|1,0,1]=4 3046 B14R1.163 CNC(=O)NNC(=O)c1ccccc1 Amb2748084 [0,1,0,0,0,1|2,0,0]=4 3047 B14R1.163 CNC(=O)O\N=C(\C)c1ccccc1 Amb27830169 [0,1,0,0,0,1|2,0,0]=4 3048 B14R1.163 CNC(=O)O\N=C(\N)c1ccccc1 Amb27860246 [0,1,0,0,0,1|2,0,0]=4 3049 B14R1.163 COC(=O)C#C[C@@H](O)c1ccccc1 Amb27664199 [0,1,0,0,0,1|0,0,2]=4 3050 B14R1.163 COC(=O)CCC(=O)c1ccccc1 Amb2720969 [0,1,0,0,0,1|0,0,1]=3 3051 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb10610596 [0,1,0,0,0,1|0,0,2]=4 3052 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb19373309 [0,1,0,0,0,1|0,0,2]=4 3053 B14R1.163 COC(=O)CNC(=O)c1ccccc1 Amb1006962 [0,1,0,0,0,1|0,0,1]=3 3054 B14R1.163 COC(=O)CNC(=S)c1ccccc1 Amb22495668 [0,1,0,0,0,1|0,0,1]=3 3055 B14R1.163 COC(=O)CNC(C)c1ccccc1 Amb4035922 [0,1,0,0,0,1|0,0,2]=4 3056 B14R1.163 COC(=O)CN[C@@H](C)c1ccccc1 Amb34158023 [0,1,0,0,0,1|0,0,2]=4 3057 B14R1.163 COC(=O)NNC(=O)c1ccccc1 Amb3724158 [0,1,0,0,0,1|1,0,0]=3 3058 B14R1.163 COC(=O)N\N=C(/C)c1ccncc1 Amb2409833 [0,1,0,0,0,1|2,0,0]=4 3059 B14R1.163 COC(=O)\C=C\C(=O)c1ccccc1 Amb2435415 [0,1,0,0,0,1|0,0,0]=2 3060 B14R1.520 CCCC(=O)N\C=C/c1ccccc1 Amb27816219 [0,1,0,0,0,1|1,0,0]=3 3061 B14R1.520 CCCC(=O)\C=C\Nc1ccccc1 Amb28040792 [0,1,0,0,0,1|1,0,0]=3 3062 B14R1.520 CCNC(=O)\C=N\Nc1ccccc1 Amb27238604 [0,1,0,0,0,1|2,0,0]=4 3063 B14R1.520 CCOC(=O)C#CCc1ccccc1 Amb26505964 [0,1,0,0,0,1|0,0,2]=4 3064 B14R1.520 CCOC(=O)C#CSc1ccccc1 Amb28124566 [0,1,0,0,0,1|0,0,2]=4 3065 B14R1.520 CCOC(=O)CCCc1ccccc1 Amb3939013 [0,1,0,0,0,1|0,0,2]=4 3066 B14R1.520 CCOC(=O)CCNc1ccccc1 Amb9026190 [0,1,0,0,0,1|0,0,2]=4 3067 B14R1.520 CCOC(=O)CCOc1ccccc1 Amb6357771 [0,1,0,0,0,1|0,0,2]=4 3068 B14R1.520 CCOC(=O)CCSc1ccccc1 Amb8867120 [0,1,0,0,0,1|0,0,2]=4 3069 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb2720025 [0,1,0,0,0,1|0,0,2]=4 3070 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb6335212 [0,1,0,0,0,1|0,0,2]=4 3071 B14R1.520 CCOC(=O)COCc1ccccc1 Amb7764605 [0,1,0,0,0,1|0,0,2]=4 3072 B14R1.520 CCOC(=O)C\C=C\c1ccccc1 Amb34916573 [0,1,0,0,0,1|0,0,0]=2 3073 B14R1.520 CCOC(=O)C\N=C\c1ccccc1 Amb8394336 [0,1,0,0,0,1|0,0,1]=3 3074 B14R1.520 CCOC(=O)NCCc1ccccc1 Amb6358963 [0,1,0,0,0,1|0,0,2]=4 3075 B14R1.520 CCOC(=O)NOCc1ccccc1 Amb27611822 [0,1,0,0,0,1|1,0,1]=4 3076 B14R1.520 CCOC(=O)N\C=N\c1ccccc1 Amb27957763 [0,1,0,0,0,1|1,0,0]=3 3077 B14R1.520 CCOC(=O)\C=C/Cc1ccccc1 Amb6295788 [0,1,0,0,0,1|0,0,0]=2 3078 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,1,0,0,0,1|0,0,0]=2 3079 B14R1.520 COCC(=O)CCCc1ccccc1 Amb19073932 [0,1,0,0,0,1|0,0,2]=4 3080 B14R1.520 COCC(=O)CNCc1ccccc1 Amb33130886 [0,1,0,0,0,1|0,0,2]=4 3081 B14R1.520 COCC(=O)CSCc1ccccc1 Amb32683203 [0,1,0,0,0,1|0,0,2]=4 3082 B14R1.520 COCC(=O)NOCc1ccccc1 Amb10682506 [0,1,0,0,0,1|1,0,1]=4 3083 B14R1.520 CONC(=O)CNCc1ccccc1 Amb27973952 [0,1,0,0,0,1|0,0,2]=4 3084 B14R1.520 CONC(=O)COCc1ccccc1 Amb27483753 [0,1,0,0,0,1|0,0,2]=4 3085 B14R1.520 C\C=C\C(=O)\C=C\Nc1ccccc1 Amb27863604 [0,1,0,0,0,1|1,0,0]=3 3086 B14R1.743 CCC(=O)CC(=O)Nc1ccccc1 Amb27453598 [0,1,0,0,0,1|1,0,1]=4 3087 B14R1.743 CCC(=O)NC(=O)Nc1ccccc1 Amb4010076 [0,1,0,0,0,1|2,0,0]=4 3088 B14R1.743 CCC(=O)NC(=S)Nc1ccccc1 Amb6346289 [0,1,0,0,0,1|2,0,0]=4 3089 B14R1.743 CNC(=O)NC(=O)Cc1ccccc1 Amb27387925 [0,1,0,0,0,1|1,0,1]=4 3090 B14R1.743 CNC(=O)NC(=S)Nc1ccccc1 Amb27957491 [0,1,0,0,0,1|2,0,0]=4 3091 B14R1.743 CNC(=O)\C=C(\C)Nc1ccccc1 Amb28240397 [0,1,0,0,0,1|1,0,0]=3 3092 B14R1.743 CNC(=O)\C=C(\C)Sc1ccccc1 Amb27215373 [0,1,0,0,0,1|1,0,0]=3 3093 B14R1.743 CN\C(C)=C/C(=O)Oc1ccccc1 Amb2386641 [0,1,0,0,0,1|2,0,0]=4 3094 B14R1.743 CN\C(C)=C\C(=O)Nc1ccccc1 Amb27758693 [0,1,0,0,0,1|2,0,0]=4 3095 B14R1.743 COC(=O)CC(=O)Cc1ccccc1 Amb2689984 [0,1,0,0,0,1|0,0,1]=3 3096 B14R1.743 COC(=O)CC(=O)Nc1ccccc1 Amb6811741 [0,1,0,0,0,1|0,0,1]=3 3097 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,1|0,0,2]=4 3098 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,1|0,0,2]=4 3099 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,1|0,0,2]=4 3100 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,1|0,0,2]=4 3101 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719255 [0,1,0,0,0,1|0,0,2]=4 3102 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719261 [0,1,0,0,0,1|0,0,2]=4 3103 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719262 [0,1,0,0,0,1|0,0,2]=4 3104 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719263 [0,1,0,0,0,1|0,0,2]=4 3105 B14R1.743 COC(=O)NC(=N)Sc1ccccn1 Amb26589849 [0,1,0,0,0,1|2,0,0]=4 3106 B14R1.743 COC(=O)NC(=O)Nc1cccnc1 Amb28198910 [0,1,0,0,0,1|2,0,0]=4 3107 B14R1.743 COC(=O)NC(=S)Nc1ccccc1 Amb25906654 [0,1,0,0,0,1|1,0,0]=3 3108 B14R1.743 COC(=O)NC(C)Cc1ccccc1 Amb33552136 [0,1,0,0,0,1|0,0,2]=4 3109 B14R1.743 COC(=O)\C=C(/C)Nc1ccccc1 Amb6808898 [0,1,0,0,0,1|0,0,0]=2 3110 B14R1.743 COC(=O)\C=C(/C)Nc1ccccn1 Amb27958001 [0,1,0,0,0,1|1,0,0]=3 3111 B14R1.743 COC(=O)\C=C(\C)Nc1ccccc1 Amb2386652 [0,1,0,0,0,1|0,0,0]=2 3112 B14R1.743 COC(=O)\C=C(\C)Nc1ccccn1 Amb27970952 [0,1,0,0,0,1|1,0,0]=3 3113 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 Amb2422863 [0,1,0,0,0,1|1,0,1]=4 3114 B14R1.756 CNC(=O)C(O)\C=C\c1ccccc1 Amb25243537 [0,1,0,0,0,1|1,0,0]=3 3115 B14R1.756 CNC(=O)\C(C)=C\Sc1ccccc1 Amb25113975 [0,1,0,0,0,1|1,0,0]=3 3116 B14R1.756 COC(=O)C(=O)\C=C\c1ccccc1 Amb31029020 [0,1,0,0,0,1|0,0,0]=2 3117 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,1|0,0,2]=4 3118 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,1|0,0,2]=4 3119 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,1|0,0,2]=4 3120 B14R1.756 COC(=O)C(C)OCc1ccccc1 Amb2699315 [0,1,0,0,0,1|0,0,2]=4 3121 B14R1.756 COC(=O)C(C)\N=C\c1ccccc1 Amb2426902 [0,1,0,0,0,1|0,0,1]=3 3122 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb19042065 [0,1,0,0,0,1|0,0,2]=4 3123 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,1|0,0,2]=4 3124 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb22642641 [0,1,0,0,0,1|0,0,2]=4 3125 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb32662448 [0,1,0,0,0,1|0,0,2]=4 3126 B14R1.756 COC(=O)C(N)\C=C\c1ccccc1 Amb33081314 [0,1,0,0,0,1|0,0,0]=2 3127 B14R1.756 COC(=O)C(O)C#Cc1ccccc1 Amb27478725 [0,1,0,0,0,1|0,0,2]=4 3128 B14R1.756 COC(=O)C(O)OCc1ccccc1 Amb28065943 [0,1,0,0,0,1|0,0,2]=4 3129 B14R1.756 COC(=O)C(O)\C=C\c1ccccc1 Amb32952079 [0,1,0,0,0,1|0,0,0]=2 3130 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb16183003 [0,1,0,0,0,1|0,0,2]=4 3131 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,1|0,0,2]=4 3132 B14R1.756 COC(=O)[C@@H](C)OCc1ccccc1 Amb17617220 [0,1,0,0,0,1|0,0,2]=4 3133 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb33738062 [0,1,0,0,0,1|0,0,2]=4 3134 B14R1.756 COC(=O)[C@@H](N)\C=C\c1ccccc1 Amb30647374 [0,1,0,0,0,1|0,0,0]=2 3135 B14R1.756 COC(=O)[C@@H](O)C#Cc1ccccc1 Amb28455648 [0,1,0,0,0,1|0,0,2]=4 3136 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb33757896 [0,1,0,0,0,1|0,0,2]=4 3137 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb9228619 [0,1,0,0,0,1|0,0,2]=4 3138 B14R1.756 COC(=O)[C@H](N)CCc1ccccc1 Amb33737035 [0,1,0,0,0,1|0,0,2]=4 3139 B14R1.756 COC(=O)\C(C)=N\Nc1ccccc1 Amb4019441 [0,1,0,0,0,1|1,0,0]=3 3140 B14R1.756 COC(=O)\C(Cl)=N\Nc1ccccc1 Amb24277024 [0,1,0,0,0,1|1,0,0]=3 3141 B14R1.756 COC(=O)\C(N)=C\Nc1ccccc1 Amb28384498 [0,1,0,0,0,1|0,0,0]=2 3142 B14R1.756 CON(C)C(=O)\C=C\c1ccccc1 Amb10569707 [0,1,0,0,0,1|2,0,0]=4 3143 B14R1.837 COC(=O)C#CCc1ccccc1Br Amb29860819 [0,1,0,0,0,1|0,0,2]=4 3144 B14R1.837 COC(=O)C#CCc1ccccc1Cl Amb27464193 [0,1,0,0,0,1|0,0,2]=4 3145 B14R1.837 COC(=O)CCCc1ccccc1N Amb17595065 [0,1,0,0,0,1|0,0,2]=4 3146 B14R1.837 COC(=O)CCCc1ccccc1O Amb30982170 [0,1,0,0,0,1|0,0,2]=4 3147 B14R1.837 COC(=O)CCNc1ccccc1C Amb9026356 [0,1,0,0,0,1|0,0,2]=4 3148 B14R1.837 COC(=O)CCOc1ccccc1N Amb19080574 [0,1,0,0,0,1|0,0,2]=4 3149 B14R1.837 COC(=O)CCOc1ccccc1N Amb19148869 [0,1,0,0,0,1|0,0,2]=4 3150 B14R1.837 COC(=O)CNCc1ccccc1Br Amb6687151 [0,1,0,0,0,1|0,0,2]=4 3151 B14R1.837 COC(=O)CNCc1ccccc1C Amb10610000 [0,1,0,0,0,1|0,0,2]=4 3152 B14R1.837 COC(=O)CNCc1ccccc1C Amb6686948 [0,1,0,0,0,1|0,0,2]=4 3153 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb33550194 [0,1,0,0,0,1|0,0,2]=4 3154 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb6686921 [0,1,0,0,0,1|0,0,2]=4 3155 B14R1.837 COC(=O)NCCc1ccccc1N Amb17777450 [0,1,0,0,0,1|0,0,2]=4 3156 B14R1.837 COC(=O)N\C=C\c1ccccc1Cl Amb26078541 [0,1,0,0,0,1|0,0,0]=2 3157 B14R1.837 COC(=O)N\N=C\c1ccccc1Cl Amb2411285 [0,1,0,0,0,1|1,0,0]=3 3158 B14R1.837 COC(=O)N\N=C\c1ccccc1O Amb3355123 [0,1,0,0,0,1|1,0,0]=3 3159 B14R1.837 COC(=O)\C=C\Nc1ccccc1Cl Amb27465041 [0,1,0,0,0,1|0,0,0]=2 3160 B14R1.837 CSC(=O)N\N=C\c1ccccc1O Amb25729210 [0,1,0,0,0,1|1,1,0]=4 3161 B14R1.1025 COC(=O)C#CCc1cccc(Cl)c1 Amb27749372 [0,1,0,0,0,1|0,0,2]=4 3162 B14R1.1025 COC(=O)CCCc1cccc(N)c1 Amb33726854 [0,1,0,0,0,1|0,0,2]=4 3163 B14R1.1025 COC(=O)CCNc1cccc(Br)c1 Amb9026327 [0,1,0,0,0,1|0,0,2]=4 3164 B14R1.1025 COC(=O)CCNc1cccc(C)c1 Amb9026184 [0,1,0,0,0,1|0,0,2]=4 3165 B14R1.1025 COC(=O)CCNc1cccc(Cl)c1 Amb9026318 [0,1,0,0,0,1|0,0,2]=4 3166 B14R1.1025 COC(=O)CCNc1cccc(F)c1 Amb33548149 [0,1,0,0,0,1|0,0,2]=4 3167 B14R1.1025 COC(=O)CCSc1cccc(N)c1 Amb22058830 [0,1,0,0,0,1|0,0,2]=4 3168 B14R1.1025 COC(=O)CNCc1cccc(Br)c1 Amb28600446 [0,1,0,0,0,1|0,0,2]=4 3169 B14R1.1025 COC(=O)CNCc1cccc(C)c1 Amb6686952 [0,1,0,0,0,1|0,0,2]=4 3170 B14R1.1025 COC(=O)CNCc1cccc(F)c1 Amb10609869 [0,1,0,0,0,1|0,0,2]=4 3171 B14R1.1025 COC(=O)CNCc1cccc(F)c1 Amb6686943 [0,1,0,0,0,1|0,0,2]=4 3172 B14R1.1025 COC(=O)CSCc1cccc(N)c1 Amb9482322 [0,1,0,0,0,1|0,0,2]=4 3173 B14R1.1025 COC(=O)\C=C\Nc1cccc(F)c1 Amb27495123 [0,1,0,0,0,1|0,0,0]=2 3174 B14R1.1025 COC(=O)\C=C\Nc1cncc(Cl)c1 Amb29865006 [0,1,0,0,0,1|1,0,0]=3 3175 B14R1.6449 CC(=O)C(=O)\C=C/Nc1ccccc1 Amb28187044 [0,1,0,0,0,1|1,0,0]=3 3176 B14R1.6449 CC(=O)\C(C)=C\C=C\c1ccccc1 Amb28401501 [0,1,0,0,0,1|2,0,0]=4 3177 B14R1.6449 CC(O)C(=O)N\N=C\c1ccccc1 Amb3599689 [0,1,0,0,0,1|2,0,0]=4 3178 B14R1.6449 CN(C)C(=O)C\C=C\c1ccccc1 Amb24110298 [0,1,0,0,0,1|1,0,0]=3 3179 B14R1.6449 CN(C)C(=O)N\C=C/c1ccccc1 Amb28123104 [0,1,0,0,0,1|1,0,0]=3 3180 B14R1.6449 C\C(=C/C=C/c1ccccc1)C(C)Br Amb27662889 [0,1,0,0,0,1|2,0,0]=4 3181 B14R1.6449 C\C(=C/C=C/c1ccccc1)C(C)Cl Amb27389033 [0,1,0,0,0,1|2,0,0]=4 3182 B14R1.6449 O=C(O)C(=O)C\C=C\c1ccccc1 Amb33081312 [0,1,0,0,0,1|2,0,0]=4 3183 B14R1.10 CCC(=O)CC(=O)c1ccc(Br)cc1 Amb7766300 [0,2,0,0,0,0|1,0,1]=4 3184 B14R1.10 CCC(=O)CC(=O)c1ccc(C)cc1 Amb7766298 [0,2,0,0,0,0|1,0,1]=4 3185 B14R1.10 CCC(=O)CC(=O)c1ccc(Cl)cc1 Amb7766310 [0,2,0,0,0,0|1,0,1]=4 3186 B14R1.10 CCC(=O)CC(=O)c1ccc(F)cc1 Amb7766204 [0,2,0,0,0,0|1,0,1]=4 3187 B14R1.10 CCC(=O)CC(=O)c1ccc(I)cc1 Amb33130169 [0,2,0,0,0,0|1,0,1]=4 3188 B14R1.10 CCC(=O)NC(=O)c1ccc(Cl)cc1 Amb27814260 [0,2,0,0,0,0|2,0,0]=4 3189 B14R1.10 CCC(=O)\C=C(\I)c1ccc(Br)cc1 Amb28430779 [0,2,0,0,0,0|1,0,0]=3 3190 B14R1.10 CC\C(O)=C\C(=O)c1ccc(Br)cc1 Amb33553411 [0,2,0,0,0,0|1,0,1]=4 3191 B14R1.10 CNC(=O)CC(=O)c1ccc(C)cc1 Amb28408933 [0,2,0,0,0,0|1,0,1]=4 3192 B14R1.10 CNC(=O)CC(=O)c1ccc(Cl)cc1 Amb27957679 [0,2,0,0,0,0|1,0,1]=4 3193 B14R1.10 CNC(=O)CC(=O)c1ccc(F)cc1 Amb27413660 [0,2,0,0,0,0|1,0,1]=4 3194 B14R1.10 CN\C(C)=C\C(=O)c1ccc(C)cc1 Amb27463271 [0,2,0,0,0,0|2,0,0]=4 3195 B14R1.10 COC(=N)NC(=O)c1ccc(C)cc1 Amb28076805 [0,2,0,0,0,0|2,0,0]=4 3196 B14R1.10 COC(=O)CC(=O)c1ccc(Br)cc1 Amb2685448 [0,2,0,0,0,0|0,0,1]=3 3197 B14R1.10 COC(=O)CC(=O)c1ccc(Br)cn1 Amb33129834 [0,2,0,0,0,0|1,0,1]=4 3198 B14R1.10 COC(=O)CC(=O)c1ccc(Br)nc1 Amb33388039 [0,2,0,0,0,0|1,0,1]=4 3199 B14R1.10 COC(=O)CC(=O)c1ccc(C)cc1 Amb2689998 [0,2,0,0,0,0|0,0,1]=3 3200 B14R1.10 COC(=O)CC(=O)c1ccc(C)cn1 Amb33198847 [0,2,0,0,0,0|1,0,1]=4 3201 B14R1.10 COC(=O)CC(=O)c1ccc(C)nc1 Amb17617563 [0,2,0,0,0,0|1,0,1]=4 3202 B14R1.10 COC(=O)CC(=O)c1ccc(Cl)cc1 Amb2686393 [0,2,0,0,0,0|0,0,1]=3 3203 B14R1.10 COC(=O)CC(=O)c1ccc(Cl)cn1 Amb33129813 [0,2,0,0,0,0|1,0,1]=4 3204 B14R1.10 COC(=O)CC(=O)c1ccc(Cl)nc1 Amb33261948 [0,2,0,0,0,0|1,0,1]=4 3205 B14R1.10 COC(=O)CC(=O)c1ccc(F)cc1 Amb2688377 [0,2,0,0,0,0|0,0,1]=3 3206 B14R1.10 COC(=O)CC(=O)c1ccc(F)cn1 Amb33355467 [0,2,0,0,0,0|1,0,1]=4 3207 B14R1.10 COC(=O)CC(=O)c1ccc(I)cc1 Amb23400644 [0,2,0,0,0,0|0,0,1]=3 3208 B14R1.10 COC(=O)CC(=O)c1ccc(N)nc1 Amb18815365 [0,2,0,0,0,0|1,0,1]=4 3209 B14R1.10 COC(=O)CC(=O)c1ccc(O)cc1 Amb22731193 [0,2,0,0,0,0|0,0,1]=3 3210 B14R1.10 COC(=O)CC(C)c1ccc(Br)cc1 Amb17265526 [0,2,0,0,0,0|0,0,2]=4 3211 B14R1.10 COC(=O)CC(C)c1ccc(C)cc1 Amb17235400 [0,2,0,0,0,0|0,0,2]=4 3212 B14R1.10 COC(=O)CC(C)c1ccc(Cl)cc1 Amb17241254 [0,2,0,0,0,0|0,0,2]=4 3213 B14R1.10 COC(=O)CC(C)c1ccc(F)cc1 Amb17236380 [0,2,0,0,0,0|0,0,2]=4 3214 B14R1.10 COC(=O)CC(C)c1ccc(N)cc1 Amb26304332 [0,2,0,0,0,0|0,0,2]=4 3215 B14R1.10 COC(=O)CC(N)c1ccc(Br)cc1 Amb10619468 [0,2,0,0,0,0|0,0,2]=4 3216 B14R1.10 COC(=O)CC(N)c1ccc(Br)cc1 Amb2371490 [0,2,0,0,0,0|0,0,2]=4 3217 B14R1.10 COC(=O)CC(N)c1ccc(C)cc1 Amb309272 [0,2,0,0,0,0|0,0,2]=4 3218 B14R1.10 COC(=O)CC(N)c1ccc(C)cc1 Amb7761633 [0,2,0,0,0,0|0,0,2]=4 3219 B14R1.10 COC(=O)CC(N)c1ccc(Cl)cc1 Amb1104817 [0,2,0,0,0,0|0,0,2]=4 3220 B14R1.10 COC(=O)CC(N)c1ccc(Cl)cc1 Amb2260568 [0,2,0,0,0,0|0,0,2]=4 3221 B14R1.10 COC(=O)CC(N)c1ccc(Cl)cc1 Amb2693371 [0,2,0,0,0,0|0,0,2]=4 3222 B14R1.10 COC(=O)CC(N)c1ccc(F)cc1 Amb10610265 [0,2,0,0,0,0|0,0,2]=4 3223 B14R1.10 COC(=O)CC(N)c1ccc(F)cc1 Amb7800517 [0,2,0,0,0,0|0,0,2]=4 3224 B14R1.10 COC(=O)CC(N)c1ccc(O)cc1 Amb28989402 [0,2,0,0,0,0|0,0,2]=4 3225 B14R1.10 COC(=O)CC(N)c1ccc(O)cc1 Amb30640066 [0,2,0,0,0,0|0,0,2]=4 3226 B14R1.10 COC(=O)CC(O)c1ccc(Br)cc1 Amb33451492 [0,2,0,0,0,0|0,0,2]=4 3227 B14R1.10 COC(=O)CC(O)c1ccc(C)cc1 Amb33474559 [0,2,0,0,0,0|0,0,2]=4 3228 B14R1.10 COC(=O)CC(O)c1ccc(Cl)cc1 Amb33053174 [0,2,0,0,0,0|0,0,2]=4 3229 B14R1.10 COC(=O)CC(O)c1ccc(F)cc1 Amb33079867 [0,2,0,0,0,0|0,0,2]=4 3230 B14R1.10 COC(=O)CC(O)c1ccc(O)cc1 Amb15770418 [0,2,0,0,0,0|0,0,2]=4 3231 B14R1.10 COC(=O)CS(=O)c1ccc(Br)cc1 Amb19375540 [0,2,0,0,0,0|1,0,1]=4 3232 B14R1.10 COC(=O)C[C@@H](N)c1ccc(Br)cc1 Amb23440353 [0,2,0,0,0,0|0,0,2]=4 3233 B14R1.10 COC(=O)C[C@@H](N)c1ccc(Cl)cc1 Amb22747570 [0,2,0,0,0,0|0,0,2]=4 3234 B14R1.10 COC(=O)C[C@@H](N)c1ccc(F)cc1 Amb33801464 [0,2,0,0,0,0|0,0,2]=4 3235 B14R1.10 COC(=O)C[C@@H](O)c1ccc(Br)cc1 Amb33451487 [0,2,0,0,0,0|0,0,2]=4 3236 B14R1.10 COC(=O)C[C@@H](O)c1ccc(C)cc1 Amb33448664 [0,2,0,0,0,0|0,0,2]=4 3237 B14R1.10 COC(=O)C[C@@H](O)c1ccc(Cl)cc1 Amb33052825 [0,2,0,0,0,0|0,0,2]=4 3238 B14R1.10 COC(=O)C[C@@H](O)c1ccc(F)cc1 Amb33359366 [0,2,0,0,0,0|0,0,2]=4 3239 B14R1.10 COC(=O)C[C@@H](O)c1ccc(O)cc1 Amb33269074 [0,2,0,0,0,0|0,0,2]=4 3240 B14R1.10 COC(=O)C[C@H](N)c1ccc(Br)cc1 Amb32645738 [0,2,0,0,0,0|0,0,2]=4 3241 B14R1.10 COC(=O)C[C@H](N)c1ccc(Br)cc1 Amb33801988 [0,2,0,0,0,0|0,0,2]=4 3242 B14R1.10 COC(=O)C[C@H](N)c1ccc(C)cc1 Amb19051012 [0,2,0,0,0,0|0,0,2]=4 3243 B14R1.10 COC(=O)C[C@H](N)c1ccc(Cl)cc1 Amb24271443 [0,2,0,0,0,0|0,0,2]=4 3244 B14R1.10 COC(=O)C[C@H](N)c1ccc(Cl)cc1 Amb2699046 [0,2,0,0,0,0|0,0,2]=4 3245 B14R1.10 COC(=O)C[C@H](N)c1ccc(F)cc1 Amb32792221 [0,2,0,0,0,0|0,0,2]=4 3246 B14R1.10 COC(=O)C[C@H](O)c1ccc(Br)cc1 Amb33451489 [0,2,0,0,0,0|0,0,2]=4 3247 B14R1.10 COC(=O)C[C@H](O)c1ccc(C)cc1 Amb33473936 [0,2,0,0,0,0|0,0,2]=4 3248 B14R1.10 COC(=O)C[C@H](O)c1ccc(Cl)cc1 Amb33052793 [0,2,0,0,0,0|0,0,2]=4 3249 B14R1.10 COC(=O)C[C@H](O)c1ccc(F)cc1 Amb32953568 [0,2,0,0,0,0|0,0,2]=4 3250 B14R1.10 COC(=O)C[C@H](O)c1ccc(O)cc1 Amb33448550 [0,2,0,0,0,0|0,0,2]=4 3251 B14R1.10 COC(=O)NC(=O)c1ccc(C)cc1 Amb25709680 [0,2,0,0,0,0|1,0,0]=3 3252 B14R1.10 COC(=O)NC(=O)c1ccc(Cl)cc1 Amb3440553 [0,2,0,0,0,0|1,0,0]=3 3253 B14R1.10 COC(=O)NC(=O)c1ccc(F)cc1 Amb27653332 [0,2,0,0,0,0|1,0,0]=3 3254 B14R1.10 COC(=O)NC(=O)c1ccc(N)cc1 Amb25955083 [0,2,0,0,0,0|1,0,0]=3 3255 B14R1.10 COC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb27755358 [0,2,0,0,0,0|1,0,1]=4 3256 B14R1.10 COC(=O)\C=C(/C)c1ccc(F)cc1 Amb33249601 [0,2,0,0,0,0|0,0,0]=2 3257 B14R1.10 COC(=O)\C=C(/C)c1ccc(N)cc1 Amb27199738 [0,2,0,0,0,0|0,0,0]=2 3258 B14R1.10 COC(=O)\C=C(\C)c1ccc(Br)cc1 Amb25717231 [0,2,0,0,0,0|0,0,0]=2 3259 B14R1.10 COC(=O)\C=C(\C)c1ccc(Br)cn1 Amb35669509 [0,2,0,0,0,0|1,0,0]=3 3260 B14R1.10 COC(=O)\C=C(\C)c1ccc(C)cc1 Amb24635465 [0,2,0,0,0,0|0,0,0]=2 3261 B14R1.10 COC(=O)\C=C(\C)c1ccc(Cl)cc1 Amb26535762 [0,2,0,0,0,0|0,0,0]=2 3262 B14R1.10 COC(=O)\C=C(\C)c1ccc(Cl)cn1 Amb35702332 [0,2,0,0,0,0|1,0,0]=3 3263 B14R1.10 COC(=O)\C=C(\C)c1ccc(F)cc1 Amb27478776 [0,2,0,0,0,0|0,0,0]=2 3264 B14R1.10 COC(=O)\C=C(\C)c1ccc(F)cn1 Amb27453312 [0,2,0,0,0,0|1,0,0]=3 3265 B14R1.10 COC(=O)\C=C(\C)c1ccc(N)cc1 Amb27440008 [0,2,0,0,0,0|0,0,0]=2 3266 B14R1.10 COC(=O)\C=C(\N)c1ccc(Cl)cc1 Amb27882741 [0,2,0,0,0,0|0,0,0]=2 3267 B14R1.10 CO\C(N)=C\C(=O)c1ccc(Cl)cc1 Amb27827439 [0,2,0,0,0,0|1,0,0]=3 3268 B14R1.11 CCC(=O)CC(=O)c1cccc(Br)c1 Amb7766273 [0,2,0,0,0,0|1,0,1]=4 3269 B14R1.11 CCC(=O)CC(=O)c1cccc(C)c1 Amb19040897 [0,2,0,0,0,0|1,0,1]=4 3270 B14R1.11 CCC(=O)CC(=O)c1cccc(Cl)c1 Amb7766341 [0,2,0,0,0,0|1,0,1]=4 3271 B14R1.11 CCC(=O)CC(=O)c1cccc(F)c1 Amb7766224 [0,2,0,0,0,0|1,0,1]=4 3272 B14R1.11 CCC(=O)OC(=O)c1cccc(C)c1 Amb34912760 [0,2,0,0,0,0|2,0,0]=4 3273 B14R1.11 COC(=N)NC(=O)c1cccc(C)c1 Amb28040929 [0,2,0,0,0,0|2,0,0]=4 3274 B14R1.11 COC(=O)CC(=O)c1cc(C)ccn1 Amb33318131 [0,2,0,0,0,0|1,0,1]=4 3275 B14R1.11 COC(=O)CC(=O)c1cc(F)ccn1 Amb33414554 [0,2,0,0,0,0|1,0,1]=4 3276 B14R1.11 COC(=O)CC(=O)c1cccc(Br)c1 Amb2685447 [0,2,0,0,0,0|0,0,1]=3 3277 B14R1.11 COC(=O)CC(=O)c1cccc(Br)n1 Amb33433103 [0,2,0,0,0,0|1,0,1]=4 3278 B14R1.11 COC(=O)CC(=O)c1cccc(C)c1 Amb2689997 [0,2,0,0,0,0|0,0,1]=3 3279 B14R1.11 COC(=O)CC(=O)c1cccc(C)n1 Amb33199951 [0,2,0,0,0,0|1,0,1]=4 3280 B14R1.11 COC(=O)CC(=O)c1cccc(Cl)c1 Amb2686392 [0,2,0,0,0,0|0,0,1]=3 3281 B14R1.11 COC(=O)CC(=O)c1cccc(Cl)n1 Amb33222349 [0,2,0,0,0,0|1,0,1]=4 3282 B14R1.11 COC(=O)CC(=O)c1cccc(F)c1 Amb2688376 [0,2,0,0,0,0|0,0,1]=3 3283 B14R1.11 COC(=O)CC(=O)c1cccc(I)c1 Amb2688877 [0,2,0,0,0,0|0,0,1]=3 3284 B14R1.11 COC(=O)CC(=O)c1cccc(O)c1 Amb33223779 [0,2,0,0,0,0|0,0,1]=3 3285 B14R1.11 COC(=O)CC(=O)c1ccnc(C)c1 Amb33340419 [0,2,0,0,0,0|1,0,1]=4 3286 B14R1.11 COC(=O)CC(=O)c1ccnc(Cl)c1 Amb22296180 [0,2,0,0,0,0|1,0,1]=4 3287 B14R1.11 COC(=O)CC(=O)c1cncc(Br)c1 Amb5627409 [0,2,0,0,0,0|1,0,1]=4 3288 B14R1.11 COC(=O)CC(=O)c1cncc(C)c1 Amb33318024 [0,2,0,0,0,0|1,0,1]=4 3289 B14R1.11 COC(=O)CC(=O)c1cncc(F)c1 Amb33355466 [0,2,0,0,0,0|1,0,1]=4 3290 B14R1.11 COC(=O)CC(C)c1cccc(O)c1 Amb30588562 [0,2,0,0,0,0|0,0,2]=4 3291 B14R1.11 COC(=O)CC(N)c1cccc(Br)c1 Amb10610090 [0,2,0,0,0,0|0,0,2]=4 3292 B14R1.11 COC(=O)CC(N)c1cccc(Br)c1 Amb33537137 [0,2,0,0,0,0|0,0,2]=4 3293 B14R1.11 COC(=O)CC(N)c1cccc(C)c1 Amb32674757 [0,2,0,0,0,0|0,0,2]=4 3294 B14R1.11 COC(=O)CC(N)c1cccc(C)c1 Amb7800544 [0,2,0,0,0,0|0,0,2]=4 3295 B14R1.11 COC(=O)CC(N)c1cccc(Cl)c1 Amb2693368 [0,2,0,0,0,0|0,0,2]=4 3296 B14R1.11 COC(=O)CC(N)c1cccc(Cl)c1 Amb7800523 [0,2,0,0,0,0|0,0,2]=4 3297 B14R1.11 COC(=O)CC(N)c1cccc(F)c1 Amb1884736 [0,2,0,0,0,0|0,0,2]=4 3298 B14R1.11 COC(=O)CC(N)c1cccc(F)c1 Amb33527609 [0,2,0,0,0,0|0,0,2]=4 3299 B14R1.11 COC(=O)CC(N)c1cccc(I)c1 Amb32753183 [0,2,0,0,0,0|0,0,2]=4 3300 B14R1.11 COC(=O)CC(N)c1cccc(O)c1 Amb2693370 [0,2,0,0,0,0|0,0,2]=4 3301 B14R1.11 COC(=O)CC(O)c1cccc(Br)c1 Amb33452137 [0,2,0,0,0,0|0,0,2]=4 3302 B14R1.11 COC(=O)CC(O)c1cccc(C)c1 Amb32954638 [0,2,0,0,0,0|0,0,2]=4 3303 B14R1.11 COC(=O)CC(O)c1cccc(F)c1 Amb33358432 [0,2,0,0,0,0|0,0,2]=4 3304 B14R1.11 COC(=O)CC(O)c1cccc(O)c1 Amb28989401 [0,2,0,0,0,0|0,0,2]=4 3305 B14R1.11 COC(=O)CN(C)c1cccc(Cl)c1 Amb18269092 [0,2,0,0,0,0|1,0,1]=4 3306 B14R1.11 COC(=O)C[C@@H](N)c1cccc(Br)c1 Amb31289576 [0,2,0,0,0,0|0,0,2]=4 3307 B14R1.11 COC(=O)C[C@@H](N)c1cccc(Br)c1 Amb33276182 [0,2,0,0,0,0|0,0,2]=4 3308 B14R1.11 COC(=O)C[C@@H](N)c1cccc(Cl)c1 Amb33803856 [0,2,0,0,0,0|0,0,2]=4 3309 B14R1.11 COC(=O)C[C@@H](N)c1cccc(Cl)c1 Amb33804286 [0,2,0,0,0,0|0,0,2]=4 3310 B14R1.11 COC(=O)C[C@@H](N)c1cccc(I)c1 Amb32671236 [0,2,0,0,0,0|0,0,2]=4 3311 B14R1.11 COC(=O)C[C@@H](N)c1cccc(O)c1 Amb30869492 [0,2,0,0,0,0|0,0,2]=4 3312 B14R1.11 COC(=O)C[C@@H](O)c1cccc(Br)c1 Amb33451917 [0,2,0,0,0,0|0,0,2]=4 3313 B14R1.11 COC(=O)C[C@@H](O)c1cccc(C)c1 Amb33380880 [0,2,0,0,0,0|0,0,2]=4 3314 B14R1.11 COC(=O)C[C@@H](O)c1cccc(Cl)c1 Amb33261799 [0,2,0,0,0,0|0,0,2]=4 3315 B14R1.11 COC(=O)C[C@@H](O)c1cccc(F)c1 Amb33358395 [0,2,0,0,0,0|0,0,2]=4 3316 B14R1.11 COC(=O)C[C@@H](O)c1cccc(O)c1 Amb24181934 [0,2,0,0,0,0|0,0,2]=4 3317 B14R1.11 COC(=O)C[C@H](N)c1cccc(Br)c1 Amb30586496 [0,2,0,0,0,0|0,0,2]=4 3318 B14R1.11 COC(=O)C[C@H](N)c1cccc(Br)c1 Amb33276170 [0,2,0,0,0,0|0,0,2]=4 3319 B14R1.11 COC(=O)C[C@H](N)c1cccc(C)c1 Amb19051010 [0,2,0,0,0,0|0,0,2]=4 3320 B14R1.11 COC(=O)C[C@H](N)c1cccc(Cl)c1 Amb32792233 [0,2,0,0,0,0|0,0,2]=4 3321 B14R1.11 COC(=O)C[C@H](N)c1cccc(Cl)c1 Amb33803305 [0,2,0,0,0,0|0,0,2]=4 3322 B14R1.11 COC(=O)C[C@H](N)c1cccc(F)c1 Amb32792238 [0,2,0,0,0,0|0,0,2]=4 3323 B14R1.11 COC(=O)C[C@H](N)c1cccc(I)c1 Amb32645686 [0,2,0,0,0,0|0,0,2]=4 3324 B14R1.11 COC(=O)C[C@H](N)c1cccc(I)c1 Amb33456830 [0,2,0,0,0,0|0,0,2]=4 3325 B14R1.11 COC(=O)C[C@H](O)c1cccc(Br)c1 Amb33451916 [0,2,0,0,0,0|0,0,2]=4 3326 B14R1.11 COC(=O)C[C@H](O)c1cccc(C)c1 Amb32953347 [0,2,0,0,0,0|0,0,2]=4 3327 B14R1.11 COC(=O)C[C@H](O)c1cccc(Cl)c1 Amb33406483 [0,2,0,0,0,0|0,0,2]=4 3328 B14R1.11 COC(=O)C[C@H](O)c1cccc(F)c1 Amb33359272 [0,2,0,0,0,0|0,0,2]=4 3329 B14R1.11 COC(=O)C[C@H](O)c1cccc(O)c1 Amb33172537 [0,2,0,0,0,0|0,0,2]=4 3330 B14R1.11 COC(=O)NC(=O)c1cccc(Cl)c1 Amb24547065 [0,2,0,0,0,0|1,0,0]=3 3331 B14R1.11 COC(=O)\C=C(\C)c1cccc(Br)c1 Amb25871790 [0,2,0,0,0,0|0,0,0]=2 3332 B14R1.11 COC(=O)\C=C(\C)c1cccc(C)c1 Amb28352254 [0,2,0,0,0,0|0,0,0]=2 3333 B14R1.11 COC(=O)\C=C(\C)c1cccc(Cl)c1 Amb25850659 [0,2,0,0,0,0|0,0,0]=2 3334 B14R1.11 COC(=O)\C=C(\C)c1cccc(F)c1 Amb26640967 [0,2,0,0,0,0|0,0,0]=2 3335 B14R1.11 COC(=O)\C=C(\C)c1cccc(N)c1 Amb33472130 [0,2,0,0,0,0|0,0,0]=2 3336 B14R1.11 COC(=O)\C=C(\C)c1ccnc(F)c1 Amb33492943 [0,2,0,0,0,0|1,0,0]=3 3337 B14R1.11 COC(=O)\C=C(\C)c1cncc(Br)c1 Amb33472198 [0,2,0,0,0,0|1,0,0]=3 3338 B14R1.29 C=C(NC(=O)CCC)c1ccccc1 Amb28251178 [0,2,0,0,0,0|2,0,0]=4 3339 B14R1.29 C=C(NC(=O)OCC)c1ccccc1 Amb27230566 [0,2,0,0,0,0|1,0,0]=3 3340 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 Amb17940804 [0,2,0,0,0,0|1,0,1]=4 3341 B14R1.29 CCNC(=O)\C=C(\C)c1ccccc1 Amb27792973 [0,2,0,0,0,0|1,0,0]=3 3342 B14R1.29 CCNC(=O)\C=C(\Cl)c1ccccc1 Amb27875186 [0,2,0,0,0,0|1,0,0]=3 3343 B14R1.29 CCNC(=O)\C=C(\S)c1ccccc1 Amb27162822 [0,2,0,0,0,0|1,0,0]=3 3344 B14R1.29 CCOC(=O)CC(=O)c1ccccc1 Amb1212681 [0,2,0,0,0,0|0,0,1]=3 3345 B14R1.29 CCOC(=O)CC(=O)c1ccccn1 Amb13951245 [0,2,0,0,0,0|1,0,1]=4 3346 B14R1.29 CCOC(=O)CC(=O)c1ccccn1 Amb33528912 [0,2,0,0,0,0|1,0,1]=4 3347 B14R1.29 CCOC(=O)CC(=O)c1cccnc1 Amb1647670 [0,2,0,0,0,0|1,0,1]=4 3348 B14R1.29 CCOC(=O)CC(=O)c1cccnc1 Amb6891797 [0,2,0,0,0,0|1,0,1]=4 3349 B14R1.29 CCOC(=O)CC(=O)c1ccncc1 Amb33528914 [0,2,0,0,0,0|1,0,1]=4 3350 B14R1.29 CCOC(=O)CC(N)c1ccccc1 Amb4246797 [0,2,0,0,0,0|0,0,2]=4 3351 B14R1.29 CCOC(=O)CC(N)c1ccccc1 Amb595536 [0,2,0,0,0,0|0,0,2]=4 3352 B14R1.29 CCOC(=O)CC(O)c1ccccc1 Amb4017744 [0,2,0,0,0,0|0,0,2]=4 3353 B14R1.29 CCOC(=O)CC([NH3+])c1ccccc1 Amb5722513 [0,2,0,0,0,0|0,0,2]=4 3354 B14R1.29 CCOC(=O)C[C@@H](N)c1ccccc1 Amb19051013 [0,2,0,0,0,0|0,0,2]=4 3355 B14R1.29 CCOC(=O)C[C@@H](N)c1ccccc1 Amb8516393 [0,2,0,0,0,0|0,0,2]=4 3356 B14R1.29 CCOC(=O)C[C@@H](O)c1ccccc1 Amb10070415 [0,2,0,0,0,0|0,0,2]=4 3357 B14R1.29 CCOC(=O)C[C@H](N)c1ccccc1 Amb6365658 [0,2,0,0,0,0|0,0,2]=4 3358 B14R1.29 CCOC(=O)C[C@H](O)c1ccccc1 Amb6356330 [0,2,0,0,0,0|0,0,2]=4 3359 B14R1.29 CCOC(=O)NC(=N)c1ccccc1 Amb4057355 [0,2,0,0,0,0|1,0,0]=3 3360 B14R1.29 CCOC(=O)NC(=O)c1ccccc1 Amb2682787 [0,2,0,0,0,0|1,0,0]=3 3361 B14R1.29 CCOC(=O)NC(=S)c1cccnc1 Amb10559604 [0,2,0,0,0,0|2,0,0]=4 3362 B14R1.29 CCOC(=O)\C=C(/C)c1ccccc1 Amb8391067 [0,2,0,0,0,0|0,0,0]=2 3363 B14R1.29 CCOC(=O)\C=C(/N)c1ccccn1 Amb34912764 [0,2,0,0,0,0|1,0,0]=3 3364 B14R1.29 CCOC(=O)\C=C(\C)c1ccccc1 Amb10566527 [0,2,0,0,0,0|0,0,0]=2 3365 B14R1.29 CCOC(=O)\C=C(\C)c1ccccn1 Amb33493051 [0,2,0,0,0,0|1,0,0]=3 3366 B14R1.29 CCOC(=O)\C=C(\C)c1cccnc1 Amb33493054 [0,2,0,0,0,0|1,0,0]=3 3367 B14R1.29 CCOC(=O)\C=C(\C)c1ccncc1 Amb33493053 [0,2,0,0,0,0|1,0,0]=3 3368 B14R1.29 CCOC(=O)\C=C(\C)c1cnccn1 Amb33493147 [0,2,0,0,0,0|2,0,0]=4 3369 B14R1.29 CCOC(=S)NC(=O)c1ccccc1 Amb1641309 [0,2,0,0,0,0|1,1,0]=4 3370 B14R1.29 COCC(=O)CC(=O)c1ccccc1 Amb33291406 [0,2,0,0,0,0|0,0,1]=3 3371 B14R1.29 COCC(=O)CC(=O)c1ccccn1 Amb33291409 [0,2,0,0,0,0|1,0,1]=4 3372 B14R1.29 COCC(=O)CC(=O)c1cccnc1 Amb33291408 [0,2,0,0,0,0|1,0,1]=4 3373 B14R1.29 COCC(=O)CC(=O)c1ccncc1 Amb33291407 [0,2,0,0,0,0|1,0,1]=4 3374 B14R1.29 COCC(=O)N[C@@H](C)c1ccccc1 Amb23166824 [0,2,0,0,0,0|1,0,1]=4 3375 B14R1.29 C\C(=C/C(=O)N=[N+]=[N-])c1ccccc1 Amb27864054 [0,2,0,0,0,0|2,0,0]=4 3376 B14R1.29 C\C=C\C(=O)NC(=O)c1ccccc1 Amb25964354 [0,2,0,0,0,0|2,0,0]=4 3377 B14R1.29 N\C(=C/C(=O)NC=O)c1ccccc1 Amb28145844 [0,2,0,0,0,0|1,0,1]=4 3378 B14R1.29 [N-]=[N+]=NC(=O)\C=C(/Cl)c1ccccc1 Amb28285564 [0,2,0,0,0,0|2,0,0]=4 3379 B14R1.58 CC\C(=C\C(=O)c1ccccc1)NC Amb25664183 [0,2,0,0,0,0|2,0,0]=4 3380 B14R1.58 CN\C(C#N)=C\C(=O)c1ccccc1 Amb27984994 [0,2,0,0,0,0|2,0,0]=4 3381 B14R1.58 CO\C(=N\Cl)NC(=O)c1ccccc1 Amb27588071 [0,2,0,0,0,0|2,0,0]=4 3382 B14R1.58 CSC(=CC(=O)c1ccccc1)SC Amb2409773 [0,2,0,0,0,0|0,2,0]=4 3383 B14R1.85 C=C(C(=O)OC)C(O)c1ccccc1 Amb6671058 [0,2,0,0,0,0|0,0,1]=3 3384 B14R1.85 C=C(C(=O)OC)C(O)c1ccccn1 Amb33533017 [0,2,0,0,0,0|1,0,1]=4 3385 B14R1.85 C=C(C(=O)OC)C(O)c1cccnc1 Amb6467189 [0,2,0,0,0,0|1,0,1]=4 3386 B14R1.85 CCC(=O)\C(C)=C(\N)c1ccccc1 Amb27863440 [0,2,0,0,0,0|1,0,0]=3 3387 B14R1.85 CNC(=O)N(C)C(=O)c1ccccc1 Amb24551879 [0,2,0,0,0,0|2,0,0]=4 3388 B14R1.85 CNC(=O)\C(C)=C(\C)c1ccccc1 Amb26443927 [0,2,0,0,0,0|1,0,0]=3 3389 B14R1.85 COC(=O)C(=O)C(C)c1ccccc1 Amb17139343 [0,2,0,0,0,0|0,0,1]=3 3390 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccc1 Amb18866388 [0,2,0,0,0,0|0,0,1]=3 3391 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccn1 Amb18866484 [0,2,0,0,0,0|1,0,1]=4 3392 B14R1.85 COC(=O)C(=O)C(Cl)c1cccnc1 Amb18866485 [0,2,0,0,0,0|1,0,1]=4 3393 B14R1.85 COC(=O)C(=O)C(Cl)c1ccncc1 Amb18225175 [0,2,0,0,0,0|1,0,1]=4 3394 B14R1.85 COC(=O)C(C)C(=O)c1ccccc1 Amb10553472 [0,2,0,0,0,0|0,0,1]=3 3395 B14R1.85 COC(=O)C(C)C(N)c1ccccc1 Amb20623659 [0,2,0,0,0,0|0,0,2]=4 3396 B14R1.85 COC(=O)C(C)C(N)c1ccccc1 Amb32644838 [0,2,0,0,0,0|0,0,2]=4 3397 B14R1.85 COC(=O)C(Cl)C(=O)c1ccccc1 Amb18866389 [0,2,0,0,0,0|0,0,1]=3 3398 B14R1.85 COC(=O)C(Cl)C(C)c1ccccc1 Amb22059076 [0,2,0,0,0,0|0,0,2]=4 3399 B14R1.85 COC(=O)C(F)C(=O)c1ccncc1 Amb33470588 [0,2,0,0,0,0|1,0,1]=4 3400 B14R1.85 COC(=O)C(N)C(=O)c1ccccc1 Amb22325263 [0,2,0,0,0,0|0,0,1]=3 3401 B14R1.85 COC(=O)C(N)C(C)c1ccccc1 Amb19013065 [0,2,0,0,0,0|0,0,2]=4 3402 B14R1.85 COC(=O)C(N)C(C)c1ccccc1 Amb33534536 [0,2,0,0,0,0|0,0,2]=4 3403 B14R1.85 COC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb23439859 [0,2,0,0,0,0|0,0,2]=4 3404 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb17844463 [0,2,0,0,0,0|0,0,2]=4 3405 B14R1.85 COC(=O)[C@@H](O)[C@H](N)c1ccccc1 Amb22744727 [0,2,0,0,0,0|0,0,2]=4 3406 B14R1.85 COC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb10603125 [0,2,0,0,0,0|0,0,2]=4 3407 B14R1.85 COC(=O)[C@H](O)[C@H](N)c1ccccc1 Amb32409396 [0,2,0,0,0,0|0,0,2]=4 3408 B14R1.85 COC(=O)\C(N)=C(\C)c1ccccc1 Amb27629677 [0,2,0,0,0,0|0,0,0]=2 3409 B14R1.290 CCS(=O)(=O)\C=C(\I)c1ccccc1 Amb4034752 [0,2,0,0,0,0|2,0,0]=4 3410 B14R1.415 CC(=O)C(=O)CC(=O)c1ccccc1 Amb33355536 [0,2,0,0,0,0|1,0,1]=4 3411 B14R1.415 CC(C)C(=O)CC(=O)c1ccccc1 Amb5399070 [0,2,0,0,0,0|1,0,1]=4 3412 B14R1.415 C\C(=C/C(=O)c1ccccc1)N(C)C Amb6384170 [0,2,0,0,0,0|2,0,0]=4 3413 B14R1.415 N\C(=C/C(=O)C(F)F)c1ccccc1 Amb28368360 [0,2,0,0,0,0|2,0,0]=4 3414 B14R1.587 CCC(=O)CC(=O)c1ccccc1Br Amb7766264 [0,2,0,0,0,0|1,0,1]=4 3415 B14R1.587 CCC(=O)CC(=O)c1ccccc1C Amb7766348 [0,2,0,0,0,0|1,0,1]=4 3416 B14R1.587 CCC(=O)CC(=O)c1ccccc1Cl Amb7766338 [0,2,0,0,0,0|1,0,1]=4 3417 B14R1.587 CCC(=O)CC(=O)c1ccccc1F Amb7766228 [0,2,0,0,0,0|1,0,1]=4 3418 B14R1.587 CNC(=O)NC(=O)c1ccccc1Cl Amb27876465 [0,2,0,0,0,0|2,0,0]=4 3419 B14R1.587 COC(=O)CC(=O)c1ccccc1Br Amb2685446 [0,2,0,0,0,0|0,0,1]=3 3420 B14R1.587 COC(=O)CC(=O)c1ccccc1C Amb2689996 [0,2,0,0,0,0|0,0,1]=3 3421 B14R1.587 COC(=O)CC(=O)c1ccccc1Cl Amb5627410 [0,2,0,0,0,0|0,0,1]=3 3422 B14R1.587 COC(=O)CC(=O)c1ccccc1F Amb2688375 [0,2,0,0,0,0|0,0,1]=3 3423 B14R1.587 COC(=O)CC(=O)c1ccccc1I Amb2688876 [0,2,0,0,0,0|0,0,1]=3 3424 B14R1.587 COC(=O)CC(=O)c1ccccc1O Amb18130065 [0,2,0,0,0,0|0,0,1]=3 3425 B14R1.587 COC(=O)CC(=O)c1cccnc1Br Amb33387466 [0,2,0,0,0,0|1,0,1]=4 3426 B14R1.587 COC(=O)CC(=O)c1cccnc1C Amb32879570 [0,2,0,0,0,0|1,0,1]=4 3427 B14R1.587 COC(=O)CC(=O)c1cccnc1Cl Amb22296183 [0,2,0,0,0,0|1,0,1]=4 3428 B14R1.587 COC(=O)CC(=O)c1cccnc1F Amb33377689 [0,2,0,0,0,0|1,0,1]=4 3429 B14R1.587 COC(=O)CC(=O)c1ccncc1Br Amb33388261 [0,2,0,0,0,0|1,0,1]=4 3430 B14R1.587 COC(=O)CC(=O)c1ccncc1C Amb33414190 [0,2,0,0,0,0|1,0,1]=4 3431 B14R1.587 COC(=O)CC(=O)c1ccncc1Cl Amb33413779 [0,2,0,0,0,0|1,0,1]=4 3432 B14R1.587 COC(=O)CC(=O)c1ccncc1F Amb33317199 [0,2,0,0,0,0|1,0,1]=4 3433 B14R1.587 COC(=O)CC(=O)c1cnccc1C Amb33377017 [0,2,0,0,0,0|1,0,1]=4 3434 B14R1.587 COC(=O)CC(=O)c1ncccc1Br Amb23402730 [0,2,0,0,0,0|1,0,1]=4 3435 B14R1.587 COC(=O)CC(=O)c1ncccc1C Amb33428802 [0,2,0,0,0,0|1,0,1]=4 3436 B14R1.587 COC(=O)CC(=O)c1ncccc1F Amb23402727 [0,2,0,0,0,0|1,0,1]=4 3437 B14R1.587 COC(=O)CC(N)c1ccccc1Br Amb34913734 [0,2,0,0,0,0|0,0,2]=4 3438 B14R1.587 COC(=O)CC(N)c1ccccc1C Amb2693374 [0,2,0,0,0,0|0,0,2]=4 3439 B14R1.587 COC(=O)CC(N)c1ccccc1C Amb7800519 [0,2,0,0,0,0|0,0,2]=4 3440 B14R1.587 COC(=O)CC(N)c1ccccc1Cl Amb1106205 [0,2,0,0,0,0|0,0,2]=4 3441 B14R1.587 COC(=O)CC(N)c1ccccc1Cl Amb6892517 [0,2,0,0,0,0|0,0,2]=4 3442 B14R1.587 COC(=O)CC(N)c1ccccc1F Amb1080280 [0,2,0,0,0,0|0,0,2]=4 3443 B14R1.587 COC(=O)CC(N)c1ccccc1F Amb2693373 [0,2,0,0,0,0|0,0,2]=4 3444 B14R1.587 COC(=O)CC(O)c1ccccc1Br Amb33388004 [0,2,0,0,0,0|0,0,2]=4 3445 B14R1.587 COC(=O)CC(O)c1ccccc1C Amb32665955 [0,2,0,0,0,0|0,0,2]=4 3446 B14R1.587 COC(=O)CC(O)c1ccccc1C Amb33429937 [0,2,0,0,0,0|0,0,2]=4 3447 B14R1.587 COC(=O)CC(O)c1ccccc1Cl Amb33052571 [0,2,0,0,0,0|0,0,2]=4 3448 B14R1.587 COC(=O)CC(O)c1ccccc1F Amb33450000 [0,2,0,0,0,0|0,0,2]=4 3449 B14R1.587 COC(=O)CC(O)c1ccccc1O Amb33080112 [0,2,0,0,0,0|0,0,2]=4 3450 B14R1.587 COC(=O)C[C@@H](O)c1ccccc1Br Amb33387998 [0,2,0,0,0,0|0,0,2]=4 3451 B14R1.587 COC(=O)C[C@@H](O)c1ccccc1Cl Amb33052564 [0,2,0,0,0,0|0,0,2]=4 3452 B14R1.587 COC(=O)C[C@@H](O)c1ccccc1F Amb33172592 [0,2,0,0,0,0|0,0,2]=4 3453 B14R1.587 COC(=O)C[C@@H](O)c1ccccc1O Amb33197206 [0,2,0,0,0,0|0,0,2]=4 3454 B14R1.587 COC(=O)C[C@H](N)c1ccccc1Br Amb32792251 [0,2,0,0,0,0|0,0,2]=4 3455 B14R1.587 COC(=O)C[C@H](N)c1ccccc1C Amb19051011 [0,2,0,0,0,0|0,0,2]=4 3456 B14R1.587 COC(=O)C[C@H](N)c1ccccc1C Amb34913505 [0,2,0,0,0,0|0,0,2]=4 3457 B14R1.587 COC(=O)C[C@H](N)c1ccccc1Cl Amb2699048 [0,2,0,0,0,0|0,0,2]=4 3458 B14R1.587 COC(=O)C[C@H](N)c1ccccc1F Amb32792057 [0,2,0,0,0,0|0,0,2]=4 3459 B14R1.587 COC(=O)C[C@H](O)c1ccccc1Br Amb33388002 [0,2,0,0,0,0|0,0,2]=4 3460 B14R1.587 COC(=O)C[C@H](O)c1ccccc1C Amb33359611 [0,2,0,0,0,0|0,0,2]=4 3461 B14R1.587 COC(=O)C[C@H](O)c1ccccc1Cl Amb33052567 [0,2,0,0,0,0|0,0,2]=4 3462 B14R1.587 COC(=O)C[C@H](O)c1ccccc1F Amb33171885 [0,2,0,0,0,0|0,0,2]=4 3463 B14R1.587 COC(=O)C[C@H](O)c1ccccc1O Amb33197205 [0,2,0,0,0,0|0,0,2]=4 3464 B14R1.587 COC(=O)NC(C)c1ccccc1C Amb28364374 [0,2,0,0,0,0|1,0,1]=4 3465 B14R1.587 COC(=O)NC(C)c1ccccc1Cl Amb27762066 [0,2,0,0,0,0|1,0,1]=4 3466 B14R1.587 COC(=O)\C=C(/C)c1ccccc1Cl Amb25776873 [0,2,0,0,0,0|0,0,0]=2 3467 B14R1.587 COC(=O)\C=C(\C)c1ccccc1Br Amb24687209 [0,2,0,0,0,0|0,0,0]=2 3468 B14R1.587 COC(=O)\C=C(\C)c1ccccc1C Amb24701693 [0,2,0,0,0,0|0,0,0]=2 3469 B14R1.587 COC(=O)\C=C(\C)c1ccccc1Cl Amb24463095 [0,2,0,0,0,0|0,0,0]=2 3470 B14R1.587 COC(=O)\C=C(\C)c1ccccc1F Amb25856433 [0,2,0,0,0,0|0,0,0]=2 3471 B14R1.587 COC(=O)\C=C(\C)c1cncnc1C Amb33492975 [0,2,0,0,0,0|2,0,0]=4 3472 B14R1.587 COC(=O)\C=C(\C)c1nccnc1C Amb25831473 [0,2,0,0,0,0|2,0,0]=4 3473 B14R1.587 C\C=C(C)/C=C(\C)c1ccccc1N Amb27440521 [0,2,0,0,0,0|2,0,0]=4 3474 B14R1.587 C\N=C(C)/C=C(\O)c1ccccc1O Amb27210540 [0,2,0,0,0,0|2,0,0]=4 3475 B14R1.741 COC(=O)CC(C)(N)c1ccccc1 Amb33249700 [0,2,0,0,0,0|0,0,2]=4 3476 B14R1.741 COC(=O)CS(=O)(=O)c1ccccc1 Amb2689632 [0,2,0,0,0,0|1,0,1]=4 3477 B14R1.741 COC(=O)NS(=O)(=O)c1ccccc1 Amb3987930 [0,2,0,0,0,0|2,0,0]=4 3478 B14R1.3297 C#CC(NC(=O)OC)c1ccccc1 Amb28071030 [0,2,0,0,0,0|1,0,1]=4 3479 B14R1.3297 CCC(=O)\C=C(/NC)c1ccccc1 Amb27747015 [0,2,0,0,0,0|1,0,0]=3 3480 B14R1.3297 CCC(=O)\C=C(\NC)c1ccccc1 Amb28246440 [0,2,0,0,0,0|1,0,0]=3 3481 B14R1.3297 CC\C(=C\C(=O)OC)c1ccccc1 Amb33472110 [0,2,0,0,0,0|0,0,0]=2 3482 B14R1.3297 CNC(=O)\C=C(/NC)c1ccccc1 Amb8492591 [0,2,0,0,0,0|1,0,0]=3 3483 B14R1.3297 CN\C(=C/C(=O)OC)c1ccccc1 Amb28119210 [0,2,0,0,0,0|0,0,0]=2 3484 B14R1.3297 CN\C(=C\C(=O)OC)c1ccccc1 Amb27268330 [0,2,0,0,0,0|0,0,0]=2 3485 B14R1.3297 COC(=O)CC(C#N)c1ccccc1 Amb4390416 [0,2,0,0,0,0|0,0,2]=4 3486 B14R1.3297 COC(=O)CC(CN)c1ccccc1 Amb17401739 [0,2,0,0,0,0|0,0,2]=4 3487 B14R1.3297 COC(=O)NC(C#N)c1ccccc1 Amb19060872 [0,2,0,0,0,0|1,0,1]=4 3488 B14R1.3297 COC(=O)N\C(=N\Cl)c1ccccc1 Amb28128509 [0,2,0,0,0,0|1,0,0]=3 3489 B14R1.3297 C\C=C(\NC(=O)CC)c1ccccc1 Amb27957706 [0,2,0,0,0,0|2,0,0]=4 3490 B14R1.3297 C\C=C(\NC(=O)OC)c1ccccc1 Amb26023678 [0,2,0,0,0,0|1,0,0]=3 3491 B14R1.3297 C\N=C(\NC(=O)NC)c1ccccc1 Amb27957912 [0,2,0,0,0,0|2,0,0]=4 3492 B14R1.3297 [C-]#[N+]C(CC(=O)OC)c1ccccc1 Amb2689498 [0,2,0,0,0,0|0,0,2]=4 3493 B14R1.5 C#Cc1ccc(CCC(=O)OC)cc1 Amb32413858 [0,2,0,0,0,0|0,0,2]=4 3494 B14R1.5 C#Cc1ccc(OCC(=O)OC)cc1 Amb32411302 [0,2,0,0,0,0|1,0,1]=4 3495 B14R1.5 C=CC(=O)\C=C\c1ccc(CC)cc1 Amb33503249 [0,2,0,0,0,0|1,0,1]=4 3496 B14R1.5 C=CC(=O)\C=C\c1ccc(OC)cc1 Amb33503241 [0,2,0,0,0,0|1,0,1]=4 3497 B14R1.5 CCC(=O)\C=C\c1ccc(OC)cc1 Amb6297854 [0,2,0,0,0,0|1,0,0]=3 3498 B14R1.5 CCc1ccc(C#CC(=O)OC)cc1 Amb27953373 [0,2,0,0,0,0|0,0,2]=4 3499 B14R1.5 CCc1ccc(CCC(=O)OC)cc1 Amb17401643 [0,2,0,0,0,0|0,0,2]=4 3500 B14R1.5 CCc1ccc(NCC(=O)OC)cc1 Amb6713159 [0,2,0,0,0,0|1,0,1]=4 3501 B14R1.5 CCc1ccc(\C=C\C(=O)NN)cc1 Amb8858539 [0,2,0,0,0,0|2,0,0]=4 3502 B14R1.5 CCc1ccc(\C=C\C(=O)OC)cc1 Amb2407737 [0,2,0,0,0,0|0,0,0]=2 3503 B14R1.5 CNC(=O)\C=N\c1ccc(OC)cc1 Amb27588234 [0,2,0,0,0,0|2,0,0]=4 3504 B14R1.5 CNc1ccc(CCC(=O)OC)cc1 Amb26304338 [0,2,0,0,0,0|0,0,2]=4 3505 B14R1.5 CNc1ccc(OCC(=O)OC)cc1 Amb19052197 [0,2,0,0,0,0|1,0,1]=4 3506 B14R1.5 CNc1ccc(OCC(=O)OC)cc1 Amb24271451 [0,2,0,0,0,0|1,0,1]=4 3507 B14R1.5 COC(=O)C#Cc1ccc(C#N)cc1 Amb27419388 [0,2,0,0,0,0|0,0,2]=4 3508 B14R1.5 COC(=O)C#Cc1ccc(OC)cc1 Amb22001786 [0,2,0,0,0,0|0,0,2]=4 3509 B14R1.5 COC(=O)CCc1ccc(CBr)cc1 Amb35751890 [0,2,0,0,0,0|0,0,2]=4 3510 B14R1.5 COC(=O)CCc1ccc(CN)cc1 Amb21618941 [0,2,0,0,0,0|0,0,2]=4 3511 B14R1.5 COC(=O)CCc1ccc(CN)cc1 Amb6357652 [0,2,0,0,0,0|0,0,2]=4 3512 B14R1.5 COC(=O)CCc1ccc(OC)cc1 Amb6492820 [0,2,0,0,0,0|0,0,2]=4 3513 B14R1.5 COC(=O)CCc1ccc(SC)cc1 Amb18942909 [0,2,0,0,0,0|0,0,2]=4 3514 B14R1.5 COC(=O)CNc1ccc(C#N)cc1 Amb6679417 [0,2,0,0,0,0|1,0,1]=4 3515 B14R1.5 COC(=O)CNc1ccc(OC)cc1 Amb6714234 [0,2,0,0,0,0|1,0,1]=4 3516 B14R1.5 COC(=O)COc1ccc(C#N)cc1 Amb1071792 [0,2,0,0,0,0|1,0,1]=4 3517 B14R1.5 COC(=O)COc1ccc(C=O)cc1 Amb1005677 [0,2,0,0,0,0|1,0,1]=4 3518 B14R1.5 COC(=O)COc1ccc(CO)cc1 Amb1010441 [0,2,0,0,0,0|1,0,1]=4 3519 B14R1.5 COC(=O)COc1ccc(OC)cc1 Amb2551843 [0,2,0,0,0,0|1,0,1]=4 3520 B14R1.5 COC(=O)\C=C\c1ccc(C=O)cc1 Amb6298406 [0,2,0,0,0,0|0,0,0]=2 3521 B14R1.5 COC(=O)\C=C\c1ccc(CBr)cc1 Amb34003887 [0,2,0,0,0,0|0,0,0]=2 3522 B14R1.5 COC(=O)\C=C\c1ccc(OC)cc1 Amb33513258 [0,2,0,0,0,0|0,0,0]=2 3523 B14R1.5 COc1ccc(\C=C\C(=O)NO)cc1 Amb27185827 [0,2,0,0,0,0|2,0,0]=4 3524 B14R1.134 CCC(=O)\C(C)=C\c1ccc(F)cc1 Amb22738967 [0,2,0,0,0,0|1,0,0]=3 3525 B14R1.134 CNC(=O)C(=O)Nc1ccc(Cl)cc1 Amb1856171 [0,2,0,0,0,0|2,0,0]=4 3526 B14R1.134 CNC(=O)C(=O)Nc1ccc(F)cc1 Amb1931362 [0,2,0,0,0,0|2,0,0]=4 3527 B14R1.134 COC(=O)C(=O)Cc1ccc(Br)cc1 Amb17162561 [0,2,0,0,0,0|0,0,1]=3 3528 B14R1.134 COC(=O)C(=O)Cc1ccc(C)cc1 Amb17139342 [0,2,0,0,0,0|0,0,1]=3 3529 B14R1.134 COC(=O)C(=O)Cc1ccc(Cl)cc1 Amb17140710 [0,2,0,0,0,0|0,0,1]=3 3530 B14R1.134 COC(=O)C(=O)Cc1ccc(F)cc1 Amb17139585 [0,2,0,0,0,0|0,0,1]=3 3531 B14R1.134 COC(=O)C(=O)Nc1ccc(C)cc1 Amb9175547 [0,2,0,0,0,0|1,0,0]=3 3532 B14R1.134 COC(=O)C(=O)Nc1ccc(C)nc1 Amb28079293 [0,2,0,0,0,0|2,0,0]=4 3533 B14R1.134 COC(=O)C(=O)Nc1ccc(Cl)cc1 Amb2710444 [0,2,0,0,0,0|1,0,0]=3 3534 B14R1.134 COC(=O)C(=O)Nc1ccc(F)cc1 Amb27754117 [0,2,0,0,0,0|1,0,0]=3 3535 B14R1.134 COC(=O)C(=O)Nc1ccc(N)cc1 Amb27803790 [0,2,0,0,0,0|1,0,0]=3 3536 B14R1.134 COC(=O)C(=O)Nc1ccc(O)cc1 Amb28342344 [0,2,0,0,0,0|1,0,0]=3 3537 B14R1.134 COC(=O)C(Br)Cc1ccc(Br)cc1 Amb7092620 [0,2,0,0,0,0|0,0,2]=4 3538 B14R1.134 COC(=O)C(Br)Cc1ccc(C)cc1 Amb7092616 [0,2,0,0,0,0|0,0,2]=4 3539 B14R1.134 COC(=O)C(Br)Cc1ccc(Cl)cc1 Amb7092619 [0,2,0,0,0,0|0,0,2]=4 3540 B14R1.134 COC(=O)C(Br)Cc1ccc(F)cc1 Amb7092618 [0,2,0,0,0,0|0,0,2]=4 3541 B14R1.134 COC(=O)C(C)Cc1ccc(C)cc1 Amb17844107 [0,2,0,0,0,0|0,0,2]=4 3542 B14R1.134 COC(=O)C(C)Cc1ccc(N)cc1 Amb32990220 [0,2,0,0,0,0|0,0,2]=4 3543 B14R1.134 COC(=O)C(C)Nc1ccc(C)cc1 Amb4137937 [0,2,0,0,0,0|1,0,1]=4 3544 B14R1.134 COC(=O)C(C)Nc1ccc(Cl)cc1 Amb19018827 [0,2,0,0,0,0|1,0,1]=4 3545 B14R1.134 COC(=O)C(C)Nc1ccc(F)cc1 Amb18307969 [0,2,0,0,0,0|1,0,1]=4 3546 B14R1.134 COC(=O)C(C)Nc1ccc(N)cc1 Amb19017407 [0,2,0,0,0,0|1,0,1]=4 3547 B14R1.134 COC(=O)C(C)Oc1ccc(Br)cc1 Amb6547342 [0,2,0,0,0,0|1,0,1]=4 3548 B14R1.134 COC(=O)C(C)Oc1ccc(F)cc1 Amb6550314 [0,2,0,0,0,0|1,0,1]=4 3549 B14R1.134 COC(=O)C(C)Oc1ccc(N)cc1 Amb17109999 [0,2,0,0,0,0|1,0,1]=4 3550 B14R1.134 COC(=O)C(C)Oc1ccc(O)cc1 Amb2423203 [0,2,0,0,0,0|1,0,1]=4 3551 B14R1.134 COC(=O)C(C)Sc1ccc(N)cc1 Amb33747225 [0,2,0,0,0,0|1,0,1]=4 3552 B14R1.134 COC(=O)C(Cl)Cc1ccc(Br)cc1 Amb17204951 [0,2,0,0,0,0|0,0,2]=4 3553 B14R1.134 COC(=O)C(Cl)Cc1ccc(C)cc1 Amb17204448 [0,2,0,0,0,0|0,0,2]=4 3554 B14R1.134 COC(=O)C(Cl)Cc1ccc(Cl)cc1 Amb17204593 [0,2,0,0,0,0|0,0,2]=4 3555 B14R1.134 COC(=O)C(Cl)Cc1ccc(F)cc1 Amb17204463 [0,2,0,0,0,0|0,0,2]=4 3556 B14R1.134 COC(=O)C(N)Cc1ccc(Br)cc1 Amb17415249 [0,2,0,0,0,0|0,0,2]=4 3557 B14R1.134 COC(=O)C(N)Cc1ccc(C)cc1 Amb17401774 [0,2,0,0,0,0|0,0,2]=4 3558 B14R1.134 COC(=O)C(N)Cc1ccc(Cl)cc1 Amb2228449 [0,2,0,0,0,0|0,0,2]=4 3559 B14R1.134 COC(=O)C(N)Cc1ccc(F)cc1 Amb17402183 [0,2,0,0,0,0|0,0,2]=4 3560 B14R1.134 COC(=O)C(N)Cc1ccc(F)cc1 Amb28468150 [0,2,0,0,0,0|0,0,2]=4 3561 B14R1.134 COC(=O)C(N)Cc1ccc(O)cc1 Amb1210958 [0,2,0,0,0,0|0,0,2]=4 3562 B14R1.134 COC(=O)C(N)Cc1ccc(O)cc1 Amb2722655 [0,2,0,0,0,0|0,0,2]=4 3563 B14R1.134 COC(=O)C(O)Cc1ccc(Br)cc1 Amb17163100 [0,2,0,0,0,0|0,0,2]=4 3564 B14R1.134 COC(=O)C(O)Cc1ccc(C)cc1 Amb17139450 [0,2,0,0,0,0|0,0,2]=4 3565 B14R1.134 COC(=O)C(O)Cc1ccc(Cl)cc1 Amb17140888 [0,2,0,0,0,0|0,0,2]=4 3566 B14R1.134 COC(=O)C(O)Cc1ccc(F)cc1 Amb17139694 [0,2,0,0,0,0|0,0,2]=4 3567 B14R1.134 COC(=O)C(O)Cc1ccc(O)cc1 Amb18652328 [0,2,0,0,0,0|0,0,2]=4 3568 B14R1.134 COC(=O)C(S)Cc1ccc(C)cc1 Amb33204510 [0,2,0,0,0,0|0,0,2]=4 3569 B14R1.134 COC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb22492774 [0,2,0,0,0,0|0,0,2]=4 3570 B14R1.134 COC(=O)N(C)Cc1ccc(N)cc1 Amb9317713 [0,2,0,0,0,0|1,0,1]=4 3571 B14R1.134 COC(=O)[C@@H](C)Nc1ccc(Cl)cc1 Amb27401161 [0,2,0,0,0,0|1,0,1]=4 3572 B14R1.134 COC(=O)[C@@H](C)Oc1ccc(O)cc1 Amb3939257 [0,2,0,0,0,0|1,0,1]=4 3573 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Br)cc1 Amb33623634 [0,2,0,0,0,0|0,0,2]=4 3574 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Br)cc1 Amb6295882 [0,2,0,0,0,0|0,0,2]=4 3575 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb33804277 [0,2,0,0,0,0|0,0,2]=4 3576 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb6295875 [0,2,0,0,0,0|0,0,2]=4 3577 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb22745758 [0,2,0,0,0,0|0,0,2]=4 3578 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb32684473 [0,2,0,0,0,0|0,0,2]=4 3579 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(I)cc1 Amb22226738 [0,2,0,0,0,0|0,0,2]=4 3580 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb2719689 [0,2,0,0,0,0|0,0,2]=4 3581 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb6364885 [0,2,0,0,0,0|0,0,2]=4 3582 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(F)cc1 Amb22747622 [0,2,0,0,0,0|0,0,2]=4 3583 B14R1.134 COC(=O)[C@H](C)Nc1ccc(C)cc1 Amb28400008 [0,2,0,0,0,0|1,0,1]=4 3584 B14R1.134 COC(=O)[C@H](C)Nc1ccc(Cl)cc1 Amb27873427 [0,2,0,0,0,0|1,0,1]=4 3585 B14R1.134 COC(=O)[C@H](C)Oc1ccc(O)cc1 Amb9826049 [0,2,0,0,0,0|1,0,1]=4 3586 B14R1.134 COC(=O)[C@H](N)Cc1ccc(Br)cc1 Amb33748949 [0,2,0,0,0,0|0,0,2]=4 3587 B14R1.134 COC(=O)[C@H](N)Cc1ccc(Cl)cc1 Amb6295877 [0,2,0,0,0,0|0,0,2]=4 3588 B14R1.134 COC(=O)[C@H](N)Cc1ccc(F)cc1 Amb2698796 [0,2,0,0,0,0|0,0,2]=4 3589 B14R1.134 COC(=O)[C@H](N)Cc1ccc(F)cc1 Amb4478178 [0,2,0,0,0,0|0,0,2]=4 3590 B14R1.134 COC(=O)[C@H](N)Cc1ccc(N)cc1 Amb8385957 [0,2,0,0,0,0|0,0,2]=4 3591 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb19944299 [0,2,0,0,0,0|0,0,2]=4 3592 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb33804816 [0,2,0,0,0,0|0,0,2]=4 3593 B14R1.134 COC(=O)[C@H](O)Cc1ccc(F)cc1 Amb17935903 [0,2,0,0,0,0|0,0,2]=4 3594 B14R1.134 COC(=O)\C(C)=C\c1ccc(N)nc1 Amb25844013 [0,2,0,0,0,0|1,0,0]=3 3595 B14R1.134 COC(=O)\C(Cl)=C\c1ccc(N)cc1 Amb28118449 [0,2,0,0,0,0|0,0,0]=2 3596 B14R1.134 COC(=O)\C(S)=C\c1ccc(O)cc1 Amb25366564 [0,2,0,0,0,0|0,0,0]=2 3597 B14R1.293 CCS(=O)(=O)\C=C\c1ccc(Cl)cc1 Amb23449963 [0,2,0,0,0,0|2,0,0]=4 3598 B14R1.293 Cc1ccc(\C=C\S(=O)(=O)O[K])cc1 Amb20248386 [0,2,0,0,0,0|2,0,0]=4 3599 B14R1.502 C=C(\C=C\c1ccc(F)cc1)CCN Amb33201730 [0,2,0,0,0,0|2,0,0]=4 3600 B14R1.502 CCNC(=O)\C=C\c1ccc(Br)cc1 Amb6881338 [0,2,0,0,0,0|1,0,0]=3 3601 B14R1.502 CCNC(=O)\C=C\c1ccc(Cl)cc1 Amb17775297 [0,2,0,0,0,0|1,0,0]=3 3602 B14R1.502 CCNC(=O)\C=C\c1ccc(F)cc1 Amb17859931 [0,2,0,0,0,0|1,0,0]=3 3603 B14R1.502 CCNC(=O)\C=C\c1ccc(N)cc1 Amb27588212 [0,2,0,0,0,0|1,0,0]=3 3604 B14R1.502 CCOC(=O)C#Cc1ccc(Br)cc1 Amb24643932 [0,2,0,0,0,0|0,0,2]=4 3605 B14R1.502 CCOC(=O)C#Cc1ccc(C)cc1 Amb25205982 [0,2,0,0,0,0|0,0,2]=4 3606 B14R1.502 CCOC(=O)C#Cc1ccc(Cl)cc1 Amb19515859 [0,2,0,0,0,0|0,0,2]=4 3607 B14R1.502 CCOC(=O)C#Cc1ccc(F)cc1 Amb25814599 [0,2,0,0,0,0|0,0,2]=4 3608 B14R1.502 CCOC(=O)C#Cc1ccc(N)cc1 Amb27265922 [0,2,0,0,0,0|0,0,2]=4 3609 B14R1.502 CCOC(=O)C#Cc1ccc(O)cc1 Amb25042066 [0,2,0,0,0,0|0,0,2]=4 3610 B14R1.502 CCOC(=O)CCc1ccc(Br)cc1 Amb15692691 [0,2,0,0,0,0|0,0,2]=4 3611 B14R1.502 CCOC(=O)CCc1ccc(C)cc1 Amb19073887 [0,2,0,0,0,0|0,0,2]=4 3612 B14R1.502 CCOC(=O)CCc1ccc(Cl)cc1 Amb21962138 [0,2,0,0,0,0|0,0,2]=4 3613 B14R1.502 CCOC(=O)CCc1ccc(F)cc1 Amb21962143 [0,2,0,0,0,0|0,0,2]=4 3614 B14R1.502 CCOC(=O)CCc1ccc(N)cc1 Amb19042046 [0,2,0,0,0,0|0,0,2]=4 3615 B14R1.502 CCOC(=O)CCc1ccc(N)cc1 Amb33548435 [0,2,0,0,0,0|0,0,2]=4 3616 B14R1.502 CCOC(=O)CCc1ccc(O)cc1 Amb2722568 [0,2,0,0,0,0|0,0,2]=4 3617 B14R1.502 CCOC(=O)CNc1ccc(Br)cc1 Amb1798245 [0,2,0,0,0,0|1,0,1]=4 3618 B14R1.502 CCOC(=O)CNc1ccc(C)cc1 Amb33527069 [0,2,0,0,0,0|1,0,1]=4 3619 B14R1.502 CCOC(=O)CNc1ccc(Cl)cc1 Amb6711991 [0,2,0,0,0,0|1,0,1]=4 3620 B14R1.502 CCOC(=O)CNc1ccc(F)cc1 Amb1649074 [0,2,0,0,0,0|1,0,1]=4 3621 B14R1.502 CCOC(=O)CNc1ccc(I)cc1 Amb1003062 [0,2,0,0,0,0|1,0,1]=4 3622 B14R1.502 CCOC(=O)CNc1ccc(N)cc1 Amb19051516 [0,2,0,0,0,0|1,0,1]=4 3623 B14R1.502 CCOC(=O)COc1ccc(C)cc1 Amb6555666 [0,2,0,0,0,0|1,0,1]=4 3624 B14R1.502 CCOC(=O)COc1ccc(Cl)cc1 Amb6367962 [0,2,0,0,0,0|1,0,1]=4 3625 B14R1.502 CCOC(=O)COc1ccc(F)cc1 Amb6545563 [0,2,0,0,0,0|1,0,1]=4 3626 B14R1.502 CCOC(=O)COc1ccc(I)cc1 Amb9203437 [0,2,0,0,0,0|1,0,1]=4 3627 B14R1.502 CCOC(=O)COc1ccc(N)cc1 Amb1121477 [0,2,0,0,0,0|1,0,1]=4 3628 B14R1.502 CCOC(=O)COc1ccc(O)cc1 Amb18652309 [0,2,0,0,0,0|1,0,1]=4 3629 B14R1.502 CCOC(=O)CSc1ccc(N)cc1 Amb8930381 [0,2,0,0,0,0|1,0,1]=4 3630 B14R1.502 CCOC(=O)NNc1ccc(F)cc1 Amb26524896 [0,2,0,0,0,0|2,0,0]=4 3631 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33716486 [0,2,0,0,0,0|0,0,0]=2 3632 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33870372 [0,2,0,0,0,0|0,0,0]=2 3633 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cn1 Amb28653453 [0,2,0,0,0,0|1,0,0]=3 3634 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)nc1 Amb28989668 [0,2,0,0,0,0|1,0,0]=3 3635 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cc1 Amb30526854 [0,2,0,0,0,0|0,0,0]=2 3636 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cn1 Amb30594534 [0,2,0,0,0,0|1,0,0]=3 3637 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb24078556 [0,2,0,0,0,0|0,0,0]=2 3638 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb33715893 [0,2,0,0,0,0|0,0,0]=2 3639 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cn1 Amb33469201 [0,2,0,0,0,0|1,0,0]=3 3640 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)nc1 Amb24097721 [0,2,0,0,0,0|1,0,0]=3 3641 B14R1.502 CCOC(=O)\C=C\c1ccc(F)cc1 Amb24089413 [0,2,0,0,0,0|0,0,0]=2 3642 B14R1.502 CCOC(=O)\C=C\c1ccc(F)nc1 Amb33469198 [0,2,0,0,0,0|1,0,0]=3 3643 B14R1.502 CCOC(=O)\C=C\c1ccc(N)cc1 Amb1197562 [0,2,0,0,0,0|0,0,0]=2 3644 B14R1.502 CCOC(=O)\C=C\c1ccc(N)nc1 Amb2697295 [0,2,0,0,0,0|1,0,0]=3 3645 B14R1.502 CCOC(=O)\C=C\c1ccc(O)cc1 Amb2445150 [0,2,0,0,0,0|0,0,0]=2 3646 B14R1.502 CCOC(=O)\C=N\c1ccc(Br)cc1 Amb20241622 [0,2,0,0,0,0|1,0,0]=3 3647 B14R1.502 CCOC(=O)\N=C\c1ccc(Cl)cc1 Amb29599218 [0,2,0,0,0,0|1,0,0]=3 3648 B14R1.502 CCOC(=O)\N=C\c1ccc(F)cc1 Amb33513280 [0,2,0,0,0,0|1,0,0]=3 3649 B14R1.502 CNCC(=O)\C=C\c1ccc(F)cc1 Amb33326727 [0,2,0,0,0,0|1,0,0]=3 3650 B14R1.502 COCC(=O)CSc1ccc(Br)cc1 Amb32683211 [0,2,0,0,0,0|1,0,1]=4 3651 B14R1.502 COCC(=O)CSc1ccc(C)cc1 Amb32683201 [0,2,0,0,0,0|1,0,1]=4 3652 B14R1.502 COCC(=O)CSc1ccc(Cl)cc1 Amb32683190 [0,2,0,0,0,0|1,0,1]=4 3653 B14R1.502 COCC(=O)CSc1ccc(F)cc1 Amb32683196 [0,2,0,0,0,0|1,0,1]=4 3654 B14R1.502 CONC(=O)CNc1ccc(Br)cc1 Amb27432810 [0,2,0,0,0,0|1,0,1]=4 3655 B14R1.502 Cc1ccc(\C=C\C(=O)N=[N+]=[N-])cc1 Amb22055753 [0,2,0,0,0,0|2,0,0]=4 3656 B14R1.502 Cc1ccc(\C=C\C(=O)NC#N)cc1 Amb27794069 [0,2,0,0,0,0|1,0,1]=4 3657 B14R1.502 N#CNC(=O)\C=C\c1ccc(Br)cc1 Amb27478207 [0,2,0,0,0,0|1,0,1]=4 3658 B14R1.502 NCCC(=O)\C=C\c1ccc(F)cc1 Amb33326731 [0,2,0,0,0,0|1,0,0]=3 3659 B14R1.502 [N-]=[N+]=NC(=O)\C=C\c1ccc(F)cc1 Amb27607758 [0,2,0,0,0,0|2,0,0]=4 3660 B14R1.529 CC\C(C=O)=C/Nc1ccc(C)cc1 Amb18650253 [0,2,0,0,0,0|2,0,0]=4 3661 B14R1.529 CC\C(C=O)=C\Nc1ccc(Cl)cc1 Amb28052664 [0,2,0,0,0,0|2,0,0]=4 3662 B14R1.679 C=C(C)C(=O)\C=C\c1ccc(N)cc1 Amb27593738 [0,2,0,0,0,0|1,0,0]=3 3663 B14R1.679 CC(C)C(=O)\C=C\c1ccc(Cl)cc1 Amb27649298 [0,2,0,0,0,0|1,0,0]=3 3664 B14R1.679 CC(C)C(=O)\C=C\c1ccc(F)cc1 Amb27241244 [0,2,0,0,0,0|1,0,0]=3 3665 B14R1.679 CC(C)C(=O)\C=C\c1ccc(N)cc1 Amb27655324 [0,2,0,0,0,0|1,0,0]=3 3666 B14R1.679 CC(N)C(=O)\C=C\c1ccc(F)cc1 Amb33326911 [0,2,0,0,0,0|1,0,0]=3 3667 B14R1.679 CN(C)C(=O)\C=C\c1ccc(Br)cc1 Amb26455569 [0,2,0,0,0,0|1,0,0]=3 3668 B14R1.679 CN(C)C(=O)\C=C\c1ccc(Cl)cc1 Amb2343408 [0,2,0,0,0,0|1,0,0]=3 3669 B14R1.679 CN(C)C(=O)\C=C\c1ccc(F)cc1 Amb24059350 [0,2,0,0,0,0|1,0,0]=3 3670 B14R1.679 CN(C)C(=O)\C=C\c1ccc(N)cc1 Amb27748024 [0,2,0,0,0,0|1,0,0]=3 3671 B14R1.679 Cc1ccc(\C=C\C(=O)C(=O)O)cc1 Amb17470740 [0,2,0,0,0,0|2,0,0]=4 3672 B14R1.679 O=C(O)C(=O)\C=C\c1ccc(Br)cc1 Amb17473509 [0,2,0,0,0,0|2,0,0]=4 3673 B14R1.679 O=C(O)C(=O)\C=C\c1ccc(Cl)cc1 Amb2444591 [0,2,0,0,0,0|2,0,0]=4 3674 B14R1.679 O=C(O)C(=O)\C=C\c1ccc(F)cc1 Amb17470867 [0,2,0,0,0,0|2,0,0]=4 3675 B14R1.679 O=C([O-])C(=O)\C=C\c1ccc(F)cc1 Amb33473145 [0,2,0,0,0,0|2,0,0]=4 3676 B14R1.679 O=C(\C=C\c1ccc(F)cc1)C(F)F Amb32809707 [0,2,0,0,0,0|2,0,0]=4 3677 B14R1.727 C=CC(=O)\C=C\c1ccc(C)cc1Br Amb33503237 [0,2,0,0,0,0|1,0,1]=4 3678 B14R1.727 CNC(=O)\C=C\c1ccc(Cl)cc1N Amb28292818 [0,2,0,0,0,0|1,0,0]=3 3679 B14R1.727 COC(=O)C#Cc1ccc(Br)cc1C Amb27749373 [0,2,0,0,0,0|0,0,2]=4 3680 B14R1.727 COC(=O)C#Cc1ccc(Br)cc1F Amb25905801 [0,2,0,0,0,0|0,0,2]=4 3681 B14R1.727 COC(=O)C#Cc1ccc(Br)cc1N Amb32990005 [0,2,0,0,0,0|0,0,2]=4 3682 B14R1.727 COC(=O)C#Cc1ccc(C)cc1C Amb27772252 [0,2,0,0,0,0|0,0,2]=4 3683 B14R1.727 COC(=O)C#Cc1ccc(Cl)cc1Cl Amb28079518 [0,2,0,0,0,0|0,0,2]=4 3684 B14R1.727 COC(=O)C#Cc1ccc(Cl)cc1F Amb27649527 [0,2,0,0,0,0|0,0,2]=4 3685 B14R1.727 COC(=O)C#Cc1ccc(Cl)cc1N Amb32990000 [0,2,0,0,0,0|0,0,2]=4 3686 B14R1.727 COC(=O)C#Cc1ccc(F)cc1C Amb27629017 [0,2,0,0,0,0|0,0,2]=4 3687 B14R1.727 COC(=O)C#Cc1ccc(F)cc1F Amb26632046 [0,2,0,0,0,0|0,0,2]=4 3688 B14R1.727 COC(=O)C#Cc1ccc(N)cc1Cl Amb32989972 [0,2,0,0,0,0|0,0,2]=4 3689 B14R1.727 COC(=O)C#Cc1ccc(O)cc1C Amb32990048 [0,2,0,0,0,0|0,0,2]=4 3690 B14R1.727 COC(=O)CCc1ccc(C)cc1C Amb17401645 [0,2,0,0,0,0|0,0,2]=4 3691 B14R1.727 COC(=O)CCc1ccc(Cl)cc1Cl Amb17408129 [0,2,0,0,0,0|0,0,2]=4 3692 B14R1.727 COC(=O)CCc1ccc(O)cc1C Amb18651801 [0,2,0,0,0,0|0,0,2]=4 3693 B14R1.727 COC(=O)CCc1ccc(O)cc1O Amb18940295 [0,2,0,0,0,0|0,0,2]=4 3694 B14R1.727 COC(=O)CNc1ccc(Br)cc1C Amb6709138 [0,2,0,0,0,0|1,0,1]=4 3695 B14R1.727 COC(=O)CNc1ccc(C)cc1Br Amb6708182 [0,2,0,0,0,0|1,0,1]=4 3696 B14R1.727 COC(=O)CNc1ccc(C)cc1C Amb6706816 [0,2,0,0,0,0|1,0,1]=4 3697 B14R1.727 COC(=O)CNc1ccc(F)cc1Br Amb7773348 [0,2,0,0,0,0|1,0,1]=4 3698 B14R1.727 COC(=O)CNc1ccc(I)cc1Br Amb27755181 [0,2,0,0,0,0|1,0,1]=4 3699 B14R1.727 COC(=O)CNc1ccc(I)cc1C Amb27660588 [0,2,0,0,0,0|1,0,1]=4 3700 B14R1.727 COC(=O)CNc1ccc(I)cc1F Amb35736208 [0,2,0,0,0,0|1,0,1]=4 3701 B14R1.727 COC(=O)CNc1ccc(N)cc1Cl Amb7767917 [0,2,0,0,0,0|1,0,1]=4 3702 B14R1.727 COC(=O)CNc1ccc(N)cc1F Amb7783371 [0,2,0,0,0,0|1,0,1]=4 3703 B14R1.727 COC(=O)COc1ccc(Br)cc1Br Amb8857322 [0,2,0,0,0,0|1,0,1]=4 3704 B14R1.727 COC(=O)COc1ccc(Br)cc1Cl Amb7753031 [0,2,0,0,0,0|1,0,1]=4 3705 B14R1.727 COC(=O)COc1ccc(Cl)cc1Br Amb9202573 [0,2,0,0,0,0|1,0,1]=4 3706 B14R1.727 COC(=O)COc1ccc(Cl)cc1Cl Amb4020670 [0,2,0,0,0,0|1,0,1]=4 3707 B14R1.727 COC(=O)COc1ccc(F)cc1F Amb9204471 [0,2,0,0,0,0|1,0,1]=4 3708 B14R1.727 COC(=O)COc1ccc(N)cc1Cl Amb6268311 [0,2,0,0,0,0|1,0,1]=4 3709 B14R1.727 COC(=O)COc1ccc(O)cc1C Amb22497406 [0,2,0,0,0,0|1,0,1]=4 3710 B14R1.727 COC(=O)NNc1ccc(Cl)cc1Cl Amb27239953 [0,2,0,0,0,0|2,0,0]=4 3711 B14R1.727 COC(=O)\C=C/c1ccc(F)cc1F Amb27222868 [0,2,0,0,0,0|0,0,0]=2 3712 B14R1.727 COC(=O)\C=C\C1=CNC(=O)NC1=O Amb26387887 [0,2,0,0,0,0|2,0,0]=4 3713 B14R1.727 COC(=O)\C=C\c1ccc(Br)cc1C Amb25210619 [0,2,0,0,0,0|0,0,0]=2 3714 B14R1.727 COC(=O)\C=C\c1ccc(Br)cc1F Amb33997728 [0,2,0,0,0,0|0,0,0]=2 3715 B14R1.727 COC(=O)\C=C\c1ccc(Br)nc1Cl Amb13889854 [0,2,0,0,0,0|1,0,0]=3 3716 B14R1.727 COC(=O)\C=C\c1ccc(C)cc1Br Amb25752789 [0,2,0,0,0,0|0,0,0]=2 3717 B14R1.727 COC(=O)\C=C\c1ccc(C)cc1C Amb26890985 [0,2,0,0,0,0|0,0,0]=2 3718 B14R1.727 COC(=O)\C=C\c1ccc(C)cc1Cl Amb35593404 [0,2,0,0,0,0|0,0,0]=2 3719 B14R1.727 COC(=O)\C=C\c1ccc(C)cc1F Amb25313400 [0,2,0,0,0,0|0,0,0]=2 3720 B14R1.727 COC(=O)\C=C\c1ccc(Cl)cc1Cl Amb20527695 [0,2,0,0,0,0|0,0,0]=2 3721 B14R1.727 COC(=O)\C=C\c1ccc(Cl)cc1F Amb25906325 [0,2,0,0,0,0|0,0,0]=2 3722 B14R1.727 COC(=O)\C=C\c1ccc(F)cc1Br Amb26346782 [0,2,0,0,0,0|0,0,0]=2 3723 B14R1.727 COC(=O)\C=C\c1ccc(F)cc1C Amb26607286 [0,2,0,0,0,0|0,0,0]=2 3724 B14R1.727 COC(=O)\C=C\c1ccc(F)cc1F Amb33718937 [0,2,0,0,0,0|0,0,0]=2 3725 B14R1.727 COC(=O)\C=C\c1ccc(N)cc1C Amb18650802 [0,2,0,0,0,0|0,0,0]=2 3726 B14R1.727 COC(=O)\C=C\c1ccc(N)cc1F Amb27747046 [0,2,0,0,0,0|0,0,0]=2 3727 B14R1.727 COC(=O)\C=C\c1ccc(N)nc1C Amb33733449 [0,2,0,0,0,0|1,0,0]=3 3728 B14R1.727 COC(=O)\C=C\c1ccc(O)cc1C Amb26655150 [0,2,0,0,0,0|0,0,0]=2 3729 B14R1.727 COC(=O)\C=C\c1ccc(O)cc1F Amb35696529 [0,2,0,0,0,0|0,0,0]=2 3730 B14R1.727 NNC(=O)\C=C\c1ccc(Cl)cc1Cl Amb2422939 [0,2,0,0,0,0|2,0,0]=4 3731 B14R1.727 O=C(\C=C\c1ccc(Br)cc1Cl)NO Amb27189866 [0,2,0,0,0,0|2,0,0]=4 3732 B14R1.833 C=CC(=O)\C=C\c1ccc(C)c(Cl)c1 Amb33503253 [0,2,0,0,0,0|1,0,1]=4 3733 B14R1.833 C=CC(=O)\C=C\c1ccc(F)c(F)c1 Amb33503244 [0,2,0,0,0,0|1,0,1]=4 3734 B14R1.833 CNC(=O)\C=C\c1ccc(C)c(N)c1 Amb17139256 [0,2,0,0,0,0|1,0,0]=3 3735 B14R1.833 CNC(=O)\C=C\c1ccc(Cl)c(N)c1 Amb17140548 [0,2,0,0,0,0|1,0,0]=3 3736 B14R1.833 CNC(=O)\C=C\c1ccc(F)c(N)c1 Amb17139444 [0,2,0,0,0,0|1,0,0]=3 3737 B14R1.833 CNC(=O)\C=C\c1ccc(O)c(O)c1 Amb24512838 [0,2,0,0,0,0|1,0,0]=3 3738 B14R1.833 COC(=O)C#Cc1ccc(Br)c(C)c1 Amb27646291 [0,2,0,0,0,0|0,0,2]=4 3739 B14R1.833 COC(=O)C#Cc1ccc(Br)c(Cl)c1 Amb27478199 [0,2,0,0,0,0|0,0,2]=4 3740 B14R1.833 COC(=O)C#Cc1ccc(Br)c(F)c1 Amb28255999 [0,2,0,0,0,0|0,0,2]=4 3741 B14R1.833 COC(=O)C#Cc1ccc(C)c(Br)c1 Amb27873655 [0,2,0,0,0,0|0,0,2]=4 3742 B14R1.833 COC(=O)C#Cc1ccc(C)c(Cl)c1 Amb27624320 [0,2,0,0,0,0|0,0,2]=4 3743 B14R1.833 COC(=O)C#Cc1ccc(C)c(F)c1 Amb27799667 [0,2,0,0,0,0|0,0,2]=4 3744 B14R1.833 COC(=O)C#Cc1ccc(C)c(N)c1 Amb32989996 [0,2,0,0,0,0|0,0,2]=4 3745 B14R1.833 COC(=O)C#Cc1ccc(Cl)c(C)c1 Amb28252951 [0,2,0,0,0,0|0,0,2]=4 3746 B14R1.833 COC(=O)C#Cc1ccc(Cl)c(Cl)c1 Amb28184146 [0,2,0,0,0,0|0,0,2]=4 3747 B14R1.833 COC(=O)C#Cc1ccc(Cl)c(N)c1 Amb32990011 [0,2,0,0,0,0|0,0,2]=4 3748 B14R1.833 COC(=O)C#Cc1ccc(F)c(Br)c1 Amb26506825 [0,2,0,0,0,0|0,0,2]=4 3749 B14R1.833 COC(=O)C#Cc1ccc(F)c(C)c1 Amb27772253 [0,2,0,0,0,0|0,0,2]=4 3750 B14R1.833 COC(=O)C#Cc1ccc(F)c(F)c1 Amb25905805 [0,2,0,0,0,0|0,0,2]=4 3751 B14R1.833 COC(=O)C#Cc1ccc(N)c(C)c1 Amb32989917 [0,2,0,0,0,0|0,0,2]=4 3752 B14R1.833 COC(=O)C#Cc1ccc(N)c(Cl)c1 Amb32989988 [0,2,0,0,0,0|0,0,2]=4 3753 B14R1.833 COC(=O)C#Cc1ccc(N)c(F)c1 Amb32989961 [0,2,0,0,0,0|0,0,2]=4 3754 B14R1.833 COC(=O)CCc1ccc(Br)c(C)c1 Amb18277188 [0,2,0,0,0,0|0,0,2]=4 3755 B14R1.833 COC(=O)CCc1ccc(C)c(C)c1 Amb18941462 [0,2,0,0,0,0|0,0,2]=4 3756 B14R1.833 COC(=O)CCc1ccc(Cl)c(C)c1 Amb18942764 [0,2,0,0,0,0|0,0,2]=4 3757 B14R1.833 COC(=O)CCc1ccc(Cl)c(Cl)c1 Amb17408130 [0,2,0,0,0,0|0,0,2]=4 3758 B14R1.833 COC(=O)CCc1ccc(F)c(C)c1 Amb18940747 [0,2,0,0,0,0|0,0,2]=4 3759 B14R1.833 COC(=O)CCc1ccc(F)c(F)c1 Amb18942896 [0,2,0,0,0,0|0,0,2]=4 3760 B14R1.833 COC(=O)CCc1ccc(O)c(C)c1 Amb20621633 [0,2,0,0,0,0|0,0,2]=4 3761 B14R1.833 COC(=O)CCc1ccc(O)c(Cl)c1 Amb17509215 [0,2,0,0,0,0|0,0,2]=4 3762 B14R1.833 COC(=O)CCc1ccc(O)c(N)c1 Amb32674863 [0,2,0,0,0,0|0,0,2]=4 3763 B14R1.833 COC(=O)CNc1ccc(Br)c(C)c1 Amb6709986 [0,2,0,0,0,0|1,0,1]=4 3764 B14R1.833 COC(=O)CNc1ccc(Br)c(F)c1 Amb27747222 [0,2,0,0,0,0|1,0,1]=4 3765 B14R1.833 COC(=O)CNc1ccc(Cl)c(Br)c1 Amb27182383 [0,2,0,0,0,0|1,0,1]=4 3766 B14R1.833 COC(=O)CNc1ccc(Cl)c(C)c1 Amb20671653 [0,2,0,0,0,0|1,0,1]=4 3767 B14R1.833 COC(=O)CNc1ccc(Cl)c(Cl)c1 Amb6710965 [0,2,0,0,0,0|1,0,1]=4 3768 B14R1.833 COC(=O)CNc1ccc(O)c(O)c1 Amb28066732 [0,2,0,0,0,0|1,0,1]=4 3769 B14R1.833 COC(=O)COc1ccc(N)c(C)c1 Amb1113989 [0,2,0,0,0,0|1,0,1]=4 3770 B14R1.833 COC(=O)NCc1ccc(Cl)c(Cl)c1 Amb6558471 [0,2,0,0,0,0|1,0,1]=4 3771 B14R1.833 COC(=O)NNc1ccc(Br)c(C)c1 Amb24528272 [0,2,0,0,0,0|2,0,0]=4 3772 B14R1.833 COC(=O)\C=C/c1ccc(F)c(F)c1 Amb31291650 [0,2,0,0,0,0|0,0,0]=2 3773 B14R1.833 COC(=O)\C=C\c1ccc(Br)c(F)c1 Amb25134561 [0,2,0,0,0,0|0,0,0]=2 3774 B14R1.833 COC(=O)\C=C\c1ccc(Br)c(N)c1 Amb33358057 [0,2,0,0,0,0|0,0,0]=2 3775 B14R1.833 COC(=O)\C=C\c1ccc(C)c(Br)c1 Amb27856767 [0,2,0,0,0,0|0,0,0]=2 3776 B14R1.833 COC(=O)\C=C\c1ccc(C)c(C)c1 Amb26501847 [0,2,0,0,0,0|0,0,0]=2 3777 B14R1.833 COC(=O)\C=C\c1ccc(C)c(Cl)c1 Amb25281369 [0,2,0,0,0,0|0,0,0]=2 3778 B14R1.833 COC(=O)\C=C\c1ccc(C)c(F)c1 Amb26534197 [0,2,0,0,0,0|0,0,0]=2 3779 B14R1.833 COC(=O)\C=C\c1ccc(Cl)c(Br)c1 Amb24389000 [0,2,0,0,0,0|0,0,0]=2 3780 B14R1.833 COC(=O)\C=C\c1ccc(Cl)c(C)c1 Amb33358066 [0,2,0,0,0,0|0,0,0]=2 3781 B14R1.833 COC(=O)\C=C\c1ccc(Cl)c(Cl)c1 Amb3113658 [0,2,0,0,0,0|0,0,0]=2 3782 B14R1.833 COC(=O)\C=C\c1ccc(Cl)c(N)c1 Amb28363884 [0,2,0,0,0,0|0,0,0]=2 3783 B14R1.833 COC(=O)\C=C\c1ccc(F)c(Br)c1 Amb25940163 [0,2,0,0,0,0|0,0,0]=2 3784 B14R1.833 COC(=O)\C=C\c1ccc(F)c(C)c1 Amb27447971 [0,2,0,0,0,0|0,0,0]=2 3785 B14R1.833 COC(=O)\C=C\c1ccc(F)c(F)c1 Amb25906322 [0,2,0,0,0,0|0,0,0]=2 3786 B14R1.833 COC(=O)\C=C\c1ccc(N)c(O)c1 Amb26483709 [0,2,0,0,0,0|0,0,0]=2 3787 B14R1.833 COC(=O)\C=C\c1ccc(O)c(Cl)c1 Amb18657375 [0,2,0,0,0,0|0,0,0]=2 3788 B14R1.833 COC(=O)\C=C\c1ccc(O)c(F)c1 Amb27170564 [0,2,0,0,0,0|0,0,0]=2 3789 B14R1.833 COC(=O)\C=C\c1ccc(O)c(O)c1 Amb1094602 [0,2,0,0,0,0|0,0,0]=2 3790 B14R1.833 COC(=O)\C=C\c1cnc(C)c(C)c1 Amb32423935 [0,2,0,0,0,0|1,0,0]=3 3791 B14R1.833 COC(=O)\C=C\c1cnc(N)c(C)c1 Amb33733446 [0,2,0,0,0,0|1,0,0]=3 3792 B14R1.833 NNC(=O)\C=C\c1ccc(Cl)c(Cl)c1 Amb8998066 [0,2,0,0,0,0|2,0,0]=4 3793 B14R1.833 O=C(\C=C\c1ccc(F)c(F)c1)CCl Amb27458400 [0,2,0,0,0,0|2,0,0]=4 3794 B14R1.15 C=CC(=O)\C=C\c1cccc(Cl)c1Cl Amb33503319 [0,2,0,0,0,0|1,0,1]=4 3795 B14R1.15 COC(=O)C#Cc1cccc(Br)c1C Amb28077517 [0,2,0,0,0,0|0,0,2]=4 3796 B14R1.15 COC(=O)C#Cc1cccc(Br)c1F Amb25126519 [0,2,0,0,0,0|0,0,2]=4 3797 B14R1.15 COC(=O)C#Cc1cccc(Cl)c1C Amb25665516 [0,2,0,0,0,0|0,0,2]=4 3798 B14R1.15 COC(=O)C#Cc1cccc(Cl)c1Cl Amb27465656 [0,2,0,0,0,0|0,0,2]=4 3799 B14R1.15 COC(=O)CCc1cccc(Cl)c1O Amb32661164 [0,2,0,0,0,0|0,0,2]=4 3800 B14R1.15 COC(=O)CNc1cccc(Br)c1F Amb35592897 [0,2,0,0,0,0|1,0,1]=4 3801 B14R1.15 COC(=O)CNc1cccc(Br)c1N Amb27948886 [0,2,0,0,0,0|1,0,1]=4 3802 B14R1.15 COC(=O)CNc1cccc(C)c1Cl Amb28207804 [0,2,0,0,0,0|1,0,1]=4 3803 B14R1.15 COC(=O)CNc1cccc(F)c1I Amb27234204 [0,2,0,0,0,0|1,0,1]=4 3804 B14R1.15 COC(=O)COc1cccc(C)c1C Amb7753167 [0,2,0,0,0,0|1,0,1]=4 3805 B14R1.15 COC(=O)COc1cccc(C)c1I Amb33512390 [0,2,0,0,0,0|1,0,1]=4 3806 B14R1.15 COC(=O)COc1cccc(C)c1N Amb9296684 [0,2,0,0,0,0|1,0,1]=4 3807 B14R1.15 COC(=O)COc1cccc(Cl)c1Cl Amb9202866 [0,2,0,0,0,0|1,0,1]=4 3808 B14R1.15 COC(=O)COc1cccc(O)c1O Amb23483122 [0,2,0,0,0,0|1,0,1]=4 3809 B14R1.15 COC(=O)NCc1cccc(Cl)c1Cl Amb29868924 [0,2,0,0,0,0|1,0,1]=4 3810 B14R1.15 COC(=O)\C=C\c1cccc(Br)c1Cl Amb26946422 [0,2,0,0,0,0|0,0,0]=2 3811 B14R1.15 COC(=O)\C=C\c1cccc(Br)c1F Amb24639755 [0,2,0,0,0,0|0,0,0]=2 3812 B14R1.15 COC(=O)\C=C\c1cccc(C)c1C Amb25133283 [0,2,0,0,0,0|0,0,0]=2 3813 B14R1.15 COC(=O)\C=C\c1cccc(C)c1F Amb28144910 [0,2,0,0,0,0|0,0,0]=2 3814 B14R1.15 COC(=O)\C=C\c1cccc(Cl)c1Cl Amb32661279 [0,2,0,0,0,0|0,0,0]=2 3815 B14R1.15 COC(=O)\C=C\c1cccc(Cl)c1N Amb27430262 [0,2,0,0,0,0|0,0,0]=2 3816 B14R1.15 COC(=O)\C=C\c1cccc(F)c1F Amb24635466 [0,2,0,0,0,0|0,0,0]=2 3817 B14R1.15 COC(=O)\C=C\c1cncc(C)c1C Amb32423926 [0,2,0,0,0,0|1,0,0]=3 3818 B14R1.15 NNC(=O)\C=C\c1cccc(Cl)c1Cl Amb8998091 [0,2,0,0,0,0|2,0,0]=4 3819 B14R1.32 CCNC(=O)\C=C\c1cccc(Br)c1 Amb9786534 [0,2,0,0,0,0|1,0,0]=3 3820 B14R1.32 CCNC(=O)\C=C\c1cccc(C)c1 Amb28364222 [0,2,0,0,0,0|1,0,0]=3 3821 B14R1.32 CCNC(=O)\C=C\c1cccc(N)c1 Amb17139254 [0,2,0,0,0,0|1,0,0]=3 3822 B14R1.32 CCOC(=O)C#Cc1cccc(Br)c1 Amb27603325 [0,2,0,0,0,0|0,0,2]=4 3823 B14R1.32 CCOC(=O)C#Cc1cccc(C)c1 Amb24450274 [0,2,0,0,0,0|0,0,2]=4 3824 B14R1.32 CCOC(=O)C#Cc1cccc(Cl)c1 Amb24093911 [0,2,0,0,0,0|0,0,2]=4 3825 B14R1.32 CCOC(=O)C#Cc1cccc(F)c1 Amb24063534 [0,2,0,0,0,0|0,0,2]=4 3826 B14R1.32 CCOC(=O)C#Cc1cccc(N)c1 Amb25088348 [0,2,0,0,0,0|0,0,2]=4 3827 B14R1.32 CCOC(=O)C#Cc1cccc(O)c1 Amb25814600 [0,2,0,0,0,0|0,0,2]=4 3828 B14R1.32 CCOC(=O)CCc1cccc(Br)c1 Amb22232484 [0,2,0,0,0,0|0,0,2]=4 3829 B14R1.32 CCOC(=O)CCc1cccc(C)c1 Amb19073886 [0,2,0,0,0,0|0,0,2]=4 3830 B14R1.32 CCOC(=O)CCc1cccc(Cl)c1 Amb34130702 [0,2,0,0,0,0|0,0,2]=4 3831 B14R1.32 CCOC(=O)CCc1cccc(N)c1 Amb22396481 [0,2,0,0,0,0|0,0,2]=4 3832 B14R1.32 CCOC(=O)CCc1cccc(N)c1 Amb33623730 [0,2,0,0,0,0|0,0,2]=4 3833 B14R1.32 CCOC(=O)CCc1cccc(O)c1 Amb19515925 [0,2,0,0,0,0|0,0,2]=4 3834 B14R1.32 CCOC(=O)CNc1cccc(Br)c1 Amb6712281 [0,2,0,0,0,0|1,0,1]=4 3835 B14R1.32 CCOC(=O)CNc1cccc(C)c1 Amb6706759 [0,2,0,0,0,0|1,0,1]=4 3836 B14R1.32 CCOC(=O)CNc1cccc(Cl)c1 Amb4086541 [0,2,0,0,0,0|1,0,1]=4 3837 B14R1.32 CCOC(=O)CNc1cccc(F)c1 Amb6711936 [0,2,0,0,0,0|1,0,1]=4 3838 B14R1.32 CCOC(=O)COc1cccc(Br)c1 Amb6548212 [0,2,0,0,0,0|1,0,1]=4 3839 B14R1.32 CCOC(=O)COc1cccc(Cl)c1 Amb2574396 [0,2,0,0,0,0|1,0,1]=4 3840 B14R1.32 CCOC(=O)COc1cccc(F)c1 Amb7755237 [0,2,0,0,0,0|1,0,1]=4 3841 B14R1.32 CCOC(=O)COc1cccc(I)c1 Amb8830746 [0,2,0,0,0,0|1,0,1]=4 3842 B14R1.32 CCOC(=O)COc1cccc(N)c1 Amb1119292 [0,2,0,0,0,0|1,0,1]=4 3843 B14R1.32 CCOC(=O)CSc1cccc(Br)c1 Amb30588432 [0,2,0,0,0,0|1,0,1]=4 3844 B14R1.32 CCOC(=O)CSc1cccc(N)c1 Amb30622814 [0,2,0,0,0,0|1,0,1]=4 3845 B14R1.32 CCOC(=O)\C=C\c1cc(Cl)ccn1 Amb33469204 [0,2,0,0,0,0|1,0,0]=3 3846 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)c1 Amb23504994 [0,2,0,0,0,0|0,0,0]=2 3847 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)n1 Amb33469169 [0,2,0,0,0,0|1,0,0]=3 3848 B14R1.32 CCOC(=O)\C=C\c1cccc(C)c1 Amb10566723 [0,2,0,0,0,0|0,0,0]=2 3849 B14R1.32 CCOC(=O)\C=C\c1cccc(Cl)c1 Amb23504715 [0,2,0,0,0,0|0,0,0]=2 3850 B14R1.32 CCOC(=O)\C=C\c1cccc(F)c1 Amb2699676 [0,2,0,0,0,0|0,0,0]=2 3851 B14R1.32 CCOC(=O)\C=C\c1cccc(N)c1 Amb24061861 [0,2,0,0,0,0|0,0,0]=2 3852 B14R1.32 CCOC(=O)\C=C\c1cccc(O)c1 Amb18651075 [0,2,0,0,0,0|0,0,0]=2 3853 B14R1.32 CCOC(=O)\C=C\c1ccnc(Cl)c1 Amb6565042 [0,2,0,0,0,0|1,0,0]=3 3854 B14R1.32 CCOC(=O)\C=C\c1cncc(Br)c1 Amb33469185 [0,2,0,0,0,0|1,0,0]=3 3855 B14R1.32 COCC(=O)CSc1cccc(Br)c1 Amb32683210 [0,2,0,0,0,0|1,0,1]=4 3856 B14R1.32 COCC(=O)CSc1cccc(C)c1 Amb32683205 [0,2,0,0,0,0|1,0,1]=4 3857 B14R1.32 COCC(=O)CSc1cccc(Cl)c1 Amb32683214 [0,2,0,0,0,0|1,0,1]=4 3858 B14R1.32 COCC(=O)CSc1cccc(F)c1 Amb32683198 [0,2,0,0,0,0|1,0,1]=4 3859 B14R1.32 CONC(=O)\C=C\c1cccc(C)c1 Amb27772238 [0,2,0,0,0,0|0,0,0]=2 3860 B14R1.32 CONC(=O)\C=C\c1cccc(F)c1 Amb27611726 [0,2,0,0,0,0|0,0,0]=2 3861 B14R1.32 Cc1cccc(\C=C\C(=O)N=[N+]=[N-])c1 Amb25288232 [0,2,0,0,0,0|2,0,0]=4 3862 B14R1.32 N#CNC(=O)\C=C\c1cccc(Cl)c1 Amb27425470 [0,2,0,0,0,0|1,0,1]=4 3863 B14R1.32 N#CNC(=O)\C=C\c1cccc(F)c1 Amb27586816 [0,2,0,0,0,0|1,0,1]=4 3864 B14R1.32 [N-]=[N+]=NC(=O)\C=C\c1cccc(Cl)c1 Amb24366106 [0,2,0,0,0,0|2,0,0]=4 3865 B14R1.32 [N-]=[N+]=NC(=O)\C=C\c1cccc(F)c1 Amb22551093 [0,2,0,0,0,0|2,0,0]=4 3866 B14R1.77 C=CC(=O)\C=C\c1cccc(OC)c1 Amb33503228 [0,2,0,0,0,0|1,0,1]=4 3867 B14R1.77 CNC(=O)\C=C\c1cccc(C#N)c1 Amb27255586 [0,2,0,0,0,0|1,0,0]=3 3868 B14R1.77 CNC(=O)\C=C\c1cccc(OC)c1 Amb24335833 [0,2,0,0,0,0|1,0,0]=3 3869 B14R1.77 CNc1cccc(CCC(=O)OC)c1 Amb33737256 [0,2,0,0,0,0|0,0,2]=4 3870 B14R1.77 COC(=O)C#Cc1cccc(OC)c1 Amb26499134 [0,2,0,0,0,0|0,0,2]=4 3871 B14R1.77 COC(=O)CCc1cccc(CN)c1 Amb10808054 [0,2,0,0,0,0|0,0,2]=4 3872 B14R1.77 COC(=O)CCc1cccc(CN)c1 Amb22047768 [0,2,0,0,0,0|0,0,2]=4 3873 B14R1.77 COC(=O)CNc1cccc(C#N)c1 Amb6712114 [0,2,0,0,0,0|1,0,1]=4 3874 B14R1.77 COC(=O)CNc1cccc(OC)c1 Amb6713991 [0,2,0,0,0,0|1,0,1]=4 3875 B14R1.77 COC(=O)COc1cccc(C=O)c1 Amb837249 [0,2,0,0,0,0|1,0,1]=4 3876 B14R1.77 COC(=O)COc1cccc(CBr)c1 Amb24095913 [0,2,0,0,0,0|1,0,1]=4 3877 B14R1.77 COC(=O)COc1cccc(CN)c1 Amb1116214 [0,2,0,0,0,0|1,0,1]=4 3878 B14R1.77 COC(=O)COc1cccc(CN)c1 Amb19515170 [0,2,0,0,0,0|1,0,1]=4 3879 B14R1.77 COC(=O)COc1cccc(CO)c1 Amb6705993 [0,2,0,0,0,0|1,0,1]=4 3880 B14R1.77 COC(=O)COc1cccc(OC)c1 Amb844180 [0,2,0,0,0,0|1,0,1]=4 3881 B14R1.77 COC(=O)NCc1cccc(C#N)c1 Amb19040833 [0,2,0,0,0,0|1,0,1]=4 3882 B14R1.77 COC(=O)\C=C\c1cccc(C#N)c1 Amb33870362 [0,2,0,0,0,0|0,0,0]=2 3883 B14R1.77 COC(=O)\C=C\c1cccc(OC)c1 Amb22584287 [0,2,0,0,0,0|0,0,0]=2 3884 B14R1.77 COC(=O)\C=C\c1cccc(OC)n1 Amb33469148 [0,2,0,0,0,0|1,0,0]=3 3885 B14R1.77 COC(=O)\C=C\c1cncc(OC)c1 Amb13889782 [0,2,0,0,0,0|1,0,0]=3 3886 B14R1.135 CNC(=O)C(=O)Nc1cccc(Cl)c1 Amb1772795 [0,2,0,0,0,0|2,0,0]=4 3887 B14R1.135 COC(=O)C(=O)Cc1cccc(Br)c1 Amb17162560 [0,2,0,0,0,0|0,0,1]=3 3888 B14R1.135 COC(=O)C(=O)Cc1cccc(C)c1 Amb17139341 [0,2,0,0,0,0|0,0,1]=3 3889 B14R1.135 COC(=O)C(=O)Cc1cccc(Cl)c1 Amb17140709 [0,2,0,0,0,0|0,0,1]=3 3890 B14R1.135 COC(=O)C(=O)Nc1cccc(C)c1 Amb27968555 [0,2,0,0,0,0|1,0,0]=3 3891 B14R1.135 COC(=O)C(=O)Nc1cccc(F)c1 Amb27808855 [0,2,0,0,0,0|1,0,0]=3 3892 B14R1.135 COC(=O)C(=O)Nc1cccc(O)c1 Amb28046275 [0,2,0,0,0,0|1,0,0]=3 3893 B14R1.135 COC(=O)C(=O)Nc1cncc(Cl)c1 Amb29864906 [0,2,0,0,0,0|2,0,0]=4 3894 B14R1.135 COC(=O)C(Br)Cc1cccc(Br)c1 Amb7092621 [0,2,0,0,0,0|0,0,2]=4 3895 B14R1.135 COC(=O)C(Br)Cc1cccc(C)c1 Amb4074140 [0,2,0,0,0,0|0,0,2]=4 3896 B14R1.135 COC(=O)C(Br)Cc1cccc(Cl)c1 Amb4074142 [0,2,0,0,0,0|0,0,2]=4 3897 B14R1.135 COC(=O)C(Br)Cc1cccc(F)c1 Amb17357773 [0,2,0,0,0,0|0,0,2]=4 3898 B14R1.135 COC(=O)C(C)Nc1cccc(Br)c1 Amb4137938 [0,2,0,0,0,0|1,0,1]=4 3899 B14R1.135 COC(=O)C(C)Nc1cccc(C)c1 Amb4314704 [0,2,0,0,0,0|1,0,1]=4 3900 B14R1.135 COC(=O)C(C)Nc1cccc(I)c1 Amb27590577 [0,2,0,0,0,0|1,0,1]=4 3901 B14R1.135 COC(=O)C(C)Nc1cccc(N)c1 Amb19017409 [0,2,0,0,0,0|1,0,1]=4 3902 B14R1.135 COC(=O)C(C)Oc1cccc(C)c1 Amb19079942 [0,2,0,0,0,0|1,0,1]=4 3903 B14R1.135 COC(=O)C(C)Oc1cccc(Cl)c1 Amb6551115 [0,2,0,0,0,0|1,0,1]=4 3904 B14R1.135 COC(=O)C(C)Oc1cccc(N)c1 Amb17110000 [0,2,0,0,0,0|1,0,1]=4 3905 B14R1.135 COC(=O)C(Cl)Cc1cccc(Br)c1 Amb17204953 [0,2,0,0,0,0|0,0,2]=4 3906 B14R1.135 COC(=O)C(Cl)Cc1cccc(C)c1 Amb17204447 [0,2,0,0,0,0|0,0,2]=4 3907 B14R1.135 COC(=O)C(Cl)Cc1cccc(Cl)c1 Amb17204592 [0,2,0,0,0,0|0,0,2]=4 3908 B14R1.135 COC(=O)C(Cl)Cc1cccc(F)c1 Amb17204464 [0,2,0,0,0,0|0,0,2]=4 3909 B14R1.135 COC(=O)C(N)Cc1cccc(Br)c1 Amb17415246 [0,2,0,0,0,0|0,0,2]=4 3910 B14R1.135 COC(=O)C(N)Cc1cccc(Br)c1 Amb33484187 [0,2,0,0,0,0|0,0,2]=4 3911 B14R1.135 COC(=O)C(N)Cc1cccc(C)c1 Amb17401771 [0,2,0,0,0,0|0,0,2]=4 3912 B14R1.135 COC(=O)C(N)Cc1cccc(Cl)c1 Amb17404295 [0,2,0,0,0,0|0,0,2]=4 3913 B14R1.135 COC(=O)C(N)Cc1cccc(F)c1 Amb28468152 [0,2,0,0,0,0|0,0,2]=4 3914 B14R1.135 COC(=O)C(N)Cc1cccc(F)c1 Amb32695421 [0,2,0,0,0,0|0,0,2]=4 3915 B14R1.135 COC(=O)C(N)Cc1cccc(O)c1 Amb33804284 [0,2,0,0,0,0|0,0,2]=4 3916 B14R1.135 COC(=O)C(O)Cc1cccc(Br)c1 Amb17163099 [0,2,0,0,0,0|0,0,2]=4 3917 B14R1.135 COC(=O)C(O)Cc1cccc(C)c1 Amb17139449 [0,2,0,0,0,0|0,0,2]=4 3918 B14R1.135 COC(=O)C(O)Cc1cccc(Cl)c1 Amb17140887 [0,2,0,0,0,0|0,0,2]=4 3919 B14R1.135 COC(=O)C(O)Cc1cccc(F)c1 Amb33359442 [0,2,0,0,0,0|0,0,2]=4 3920 B14R1.135 COC(=O)C(O)Cc1cccc(O)c1 Amb30588577 [0,2,0,0,0,0|0,0,2]=4 3921 B14R1.135 COC(=O)[C@@H](N)Cc1cccc(O)c1 Amb22746779 [0,2,0,0,0,0|0,0,2]=4 3922 B14R1.135 COC(=O)[C@H](N)Cc1cccc(C)c1 Amb29848699 [0,2,0,0,0,0|0,0,2]=4 3923 B14R1.135 COC(=O)[C@H](N)Cc1cccc(F)c1 Amb2698797 [0,2,0,0,0,0|0,0,2]=4 3924 B14R1.135 COC(=O)\C(C)=C\c1cccc(Br)c1 Amb35751718 [0,2,0,0,0,0|0,0,0]=2 3925 B14R1.294 CCS(=O)(=O)\C=C\c1cccc(C)c1 Amb23449916 [0,2,0,0,0,0|2,0,0]=4 3926 B14R1.294 CCS(=O)(=O)\C=C\c1cccc(N)c1 Amb23449967 [0,2,0,0,0,0|2,0,0]=4 3927 B14R1.820 C=CC(=O)\C=C\c1cc(Br)ccc1F Amb33503247 [0,2,0,0,0,0|1,0,1]=4 3928 B14R1.820 C=CC(=O)\C=C\c1cc(Cl)ccc1Cl Amb33503235 [0,2,0,0,0,0|1,0,1]=4 3929 B14R1.820 COC(=O)C#Cc1cc(Br)ccc1Br Amb25096110 [0,2,0,0,0,0|0,0,2]=4 3930 B14R1.820 COC(=O)C#Cc1cc(Br)ccc1C Amb27869005 [0,2,0,0,0,0|0,0,2]=4 3931 B14R1.820 COC(=O)C#Cc1cc(Br)ccc1Cl Amb27799668 [0,2,0,0,0,0|0,0,2]=4 3932 B14R1.820 COC(=O)C#Cc1cc(C)ccc1O Amb26498037 [0,2,0,0,0,0|0,0,2]=4 3933 B14R1.820 COC(=O)C#Cc1cc(Cl)ccc1Br Amb27869263 [0,2,0,0,0,0|0,0,2]=4 3934 B14R1.820 COC(=O)C#Cc1cc(Cl)ccc1C Amb27232391 [0,2,0,0,0,0|0,0,2]=4 3935 B14R1.820 COC(=O)C#Cc1cc(Cl)ccc1Cl Amb26953969 [0,2,0,0,0,0|0,0,2]=4 3936 B14R1.820 COC(=O)C#Cc1cc(Cl)ccc1N Amb32989963 [0,2,0,0,0,0|0,0,2]=4 3937 B14R1.820 COC(=O)C#Cc1cc(F)ccc1Br Amb27812581 [0,2,0,0,0,0|0,0,2]=4 3938 B14R1.820 COC(=O)C#Cc1cc(F)ccc1N Amb32989983 [0,2,0,0,0,0|0,0,2]=4 3939 B14R1.820 COC(=O)C#Cc1cc(N)ccc1Br Amb32990016 [0,2,0,0,0,0|0,0,2]=4 3940 B14R1.820 COC(=O)C#Cc1cc(N)ccc1C Amb32989947 [0,2,0,0,0,0|0,0,2]=4 3941 B14R1.820 COC(=O)CCc1cc(Br)ccc1F Amb18275119 [0,2,0,0,0,0|0,0,2]=4 3942 B14R1.820 COC(=O)CCc1cc(C)ccc1C Amb17401644 [0,2,0,0,0,0|0,0,2]=4 3943 B14R1.820 COC(=O)CCc1cc(C)ccc1O Amb18275180 [0,2,0,0,0,0|0,0,2]=4 3944 B14R1.820 COC(=O)CCc1cc(Cl)ccc1Cl Amb18940742 [0,2,0,0,0,0|0,0,2]=4 3945 B14R1.820 COC(=O)CCc1cc(Cl)ccc1O Amb18940881 [0,2,0,0,0,0|0,0,2]=4 3946 B14R1.820 COC(=O)CCc1cc(F)ccc1Br Amb22276083 [0,2,0,0,0,0|0,0,2]=4 3947 B14R1.820 COC(=O)CCc1cc(F)ccc1F Amb18942901 [0,2,0,0,0,0|0,0,2]=4 3948 B14R1.820 COC(=O)CCc1cc(F)ccc1O Amb18941516 [0,2,0,0,0,0|0,0,2]=4 3949 B14R1.820 COC(=O)CNc1cc(Br)ccc1I Amb28285465 [0,2,0,0,0,0|1,0,1]=4 3950 B14R1.820 COC(=O)CNc1cc(Br)ccc1N Amb27855868 [0,2,0,0,0,0|1,0,1]=4 3951 B14R1.820 COC(=O)CNc1cc(C)ccc1Br Amb27418422 [0,2,0,0,0,0|1,0,1]=4 3952 B14R1.820 COC(=O)CNc1cc(Cl)ccc1C Amb6706403 [0,2,0,0,0,0|1,0,1]=4 3953 B14R1.820 COC(=O)CNc1cc(Cl)ccc1I Amb35706242 [0,2,0,0,0,0|1,0,1]=4 3954 B14R1.820 COC(=O)CNc1cc(F)ccc1Br Amb27810556 [0,2,0,0,0,0|1,0,1]=4 3955 B14R1.820 COC(=O)CNc1cc(N)ccc1C Amb18312814 [0,2,0,0,0,0|1,0,1]=4 3956 B14R1.820 COC(=O)COc1cc(Cl)ccc1C Amb10783759 [0,2,0,0,0,0|1,0,1]=4 3957 B14R1.820 COC(=O)NCc1cc(I)ccc1C Amb32414234 [0,2,0,0,0,0|1,0,1]=4 3958 B14R1.820 COC(=O)\C=C\c1cc(Br)ccc1F Amb26332894 [0,2,0,0,0,0|0,0,0]=2 3959 B14R1.820 COC(=O)\C=C\c1cc(Br)cnc1F Amb33469149 [0,2,0,0,0,0|1,0,0]=3 3960 B14R1.820 COC(=O)\C=C\c1cc(Br)cnc1N Amb4560884 [0,2,0,0,0,0|1,0,0]=3 3961 B14R1.820 COC(=O)\C=C\c1cc(C)ccc1C Amb2438243 [0,2,0,0,0,0|0,0,0]=2 3962 B14R1.820 COC(=O)\C=C\c1cc(C)ccc1F Amb26942306 [0,2,0,0,0,0|0,0,0]=2 3963 B14R1.820 COC(=O)\C=C\c1cc(C)ccc1N Amb27204928 [0,2,0,0,0,0|0,0,0]=2 3964 B14R1.820 COC(=O)\C=C\c1cc(C)cnc1Cl Amb13889988 [0,2,0,0,0,0|1,0,0]=3 3965 B14R1.820 COC(=O)\C=C\c1cc(C)cnc1N Amb13889715 [0,2,0,0,0,0|1,0,0]=3 3966 B14R1.820 COC(=O)\C=C\c1cc(Cl)ccc1F Amb24667820 [0,2,0,0,0,0|0,0,0]=2 3967 B14R1.820 COC(=O)\C=C\c1cc(Cl)ccc1O Amb18657374 [0,2,0,0,0,0|0,0,0]=2 3968 B14R1.820 COC(=O)\C=C\c1cc(F)ccc1C Amb26872015 [0,2,0,0,0,0|0,0,0]=2 3969 B14R1.820 COC(=O)\C=C\c1cc(F)ccc1F Amb24425803 [0,2,0,0,0,0|0,0,0]=2 3970 B14R1.820 COC(=O)\C=C\c1cc(F)ccc1O Amb27640132 [0,2,0,0,0,0|0,0,0]=2 3971 B14R1.820 COC(=O)\C=C\c1cc(F)cnc1N Amb13889716 [0,2,0,0,0,0|1,0,0]=3 3972 B14R1.820 COC(=O)\C=C\c1cc(O)ccc1O Amb33510260 [0,2,0,0,0,0|0,0,0]=2 3973 B14R1.820 NNC(=O)\C=C\c1cc(Br)ccc1F Amb8998092 [0,2,0,0,0,0|2,0,0]=4 3974 B14R1.820 O=C(\C=C\c1cc(F)ccc1F)CCl Amb27973319 [0,2,0,0,0,0|2,0,0]=4 3975 B14R1.825 C=CC(=O)\C=C\c1cc(C)cc(C)c1 Amb33503250 [0,2,0,0,0,0|1,0,1]=4 3976 B14R1.825 C=CC(=O)\C=C\c1cc(Cl)cc(Cl)c1 Amb33503239 [0,2,0,0,0,0|1,0,1]=4 3977 B14R1.825 COC(=O)C#Cc1cc(Cl)cc(Cl)c1 Amb25341760 [0,2,0,0,0,0|0,0,2]=4 3978 B14R1.825 COC(=O)CCc1cc(C)cc(C)c1 Amb22234547 [0,2,0,0,0,0|0,0,2]=4 3979 B14R1.825 COC(=O)CNc1cc(Br)cc(Br)c1 Amb35725762 [0,2,0,0,0,0|1,0,1]=4 3980 B14R1.825 COC(=O)CNc1cc(Cl)cc(Cl)c1 Amb6710436 [0,2,0,0,0,0|1,0,1]=4 3981 B14R1.825 COC(=O)CNc1cc(F)cc(Br)c1 Amb27756178 [0,2,0,0,0,0|1,0,1]=4 3982 B14R1.825 COC(=O)COc1cc(C)cc(Br)c1 Amb35788746 [0,2,0,0,0,0|1,0,1]=4 3983 B14R1.825 COC(=O)COc1cc(C)cc(C)c1 Amb844178 [0,2,0,0,0,0|1,0,1]=4 3984 B14R1.825 COC(=O)COc1cc(N)cc(O)c1 Amb24095937 [0,2,0,0,0,0|1,0,1]=4 3985 B14R1.825 COC(=O)NCc1cc(C)cc(C)c1 Amb35708997 [0,2,0,0,0,0|1,0,1]=4 3986 B14R1.825 COC(=O)\C=C\c1cc(Br)cc(Br)c1 Amb26974149 [0,2,0,0,0,0|0,0,0]=2 3987 B14R1.825 COC(=O)\C=C\c1cc(C)cc(Br)c1 Amb33358065 [0,2,0,0,0,0|0,0,0]=2 3988 B14R1.825 COC(=O)\C=C\c1cc(C)cc(C)c1 Amb25056143 [0,2,0,0,0,0|0,0,0]=2 3989 B14R1.825 COC(=O)\C=C\c1cc(C)cc(F)c1 Amb24713479 [0,2,0,0,0,0|0,0,0]=2 3990 B14R1.825 COC(=O)\C=C\c1cc(Cl)cc(Br)c1 Amb25275482 [0,2,0,0,0,0|0,0,0]=2 3991 B14R1.825 COC(=O)\C=C\c1cc(F)cc(Br)c1 Amb24403387 [0,2,0,0,0,0|0,0,0]=2 3992 B14R1.825 COC(=O)\C=C\c1cc(F)cc(F)c1 Amb34002788 [0,2,0,0,0,0|0,0,0]=2 3993 B14R1.825 COC(=O)\C=C\c1cc(N)cc(F)c1 Amb27419876 [0,2,0,0,0,0|0,0,0]=2 3994 B14R1.5956 CN(C)C(=N)\C=C\c1cccc(O)c1 Amb26603051 [0,2,0,0,0,0|2,0,0]=4 3995 B14R1.5956 CN(C)C(=O)\C=C\c1cccc(Cl)c1 Amb24689652 [0,2,0,0,0,0|1,0,0]=3 3996 B14R1.5956 CN(C)C(=O)\C=C\c1cccc(N)c1 Amb17139255 [0,2,0,0,0,0|1,0,0]=3 3997 B14R1.5956 Cc1cccc(\C=C\C(=O)C(=O)O)c1 Amb17470739 [0,2,0,0,0,0|2,0,0]=4 3998 B14R1.5956 Cc1cccc(\C=C\C(=O)N(C)C)c1 Amb24510743 [0,2,0,0,0,0|1,0,0]=3 3999 B14R1.5956 O=C(O)C(=O)\C=C\c1cccc(Br)c1 Amb17473508 [0,2,0,0,0,0|2,0,0]=4 4000 B14R1.5956 O=C(O)C(=O)\C=C\c1cccc(Cl)c1 Amb17471418 [0,2,0,0,0,0|2,0,0]=4 4001 B14R1.5956 O=C(O)C(=O)\C=C\c1cccc(F)c1 Amb17470868 [0,2,0,0,0,0|2,0,0]=4 4002 B14R1.60 C=C(CCN)\C(C)=C\c1ccccc1 Amb33381243 [0,2,0,0,0,0|2,0,0]=4 4003 B14R1.60 C=C(COC)C(=O)Nc1ccccc1 Amb27210784 [0,2,0,0,0,0|2,0,0]=4 4004 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 Amb17401495 [0,2,0,0,0,0|1,0,1]=4 4005 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 Amb1814008 [0,2,0,0,0,0|2,0,0]=4 4006 B14R1.60 CCOC(=N)C(=S)Nc1ccccc1 Amb28185834 [0,2,0,0,0,0|2,0,0]=4 4007 B14R1.60 CCOC(=O)C(=O)C[n+]1ccccc1 Amb32456074 [0,2,0,0,0,0|1,0,1]=4 4008 B14R1.60 CCOC(=O)C(=O)Cc1ccccc1 Amb28989403 [0,2,0,0,0,0|0,0,1]=3 4009 B14R1.60 CCOC(=O)C(=O)Cc1ccncc1 Amb9201724 [0,2,0,0,0,0|1,0,1]=4 4010 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 Amb1196006 [0,2,0,0,0,0|1,0,0]=3 4011 B14R1.60 CCOC(=O)C(=O)Nc1ccccn1 Amb3886949 [0,2,0,0,0,0|2,0,0]=4 4012 B14R1.60 CCOC(=O)C(=O)Nc1cccnc1 Amb3886946 [0,2,0,0,0,0|2,0,0]=4 4013 B14R1.60 CCOC(=O)C(=O)Nc1ccncc1 Amb5794362 [0,2,0,0,0,0|2,0,0]=4 4014 B14R1.60 CCOC(=O)C(=O)Oc1ccccn1 Amb24103622 [0,2,0,0,0,0|2,0,0]=4 4015 B14R1.60 CCOC(=O)C(Br)Cc1ccccc1 Amb2794053 [0,2,0,0,0,0|0,0,2]=4 4016 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 Amb17940943 [0,2,0,0,0,0|1,0,1]=4 4017 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb6334959 [0,2,0,0,0,0|0,0,2]=4 4018 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb7762211 [0,2,0,0,0,0|0,0,2]=4 4019 B14R1.60 CCOC(=O)C(O)Cc1ccccc1 Amb19079971 [0,2,0,0,0,0|0,0,2]=4 4020 B14R1.60 CCOC(=O)N(C)Cc1ccccc1 Amb3095224 [0,2,0,0,0,0|1,0,1]=4 4021 B14R1.60 CCOC(=O)N(O)Cc1ccccc1 Amb28248736 [0,2,0,0,0,0|1,0,1]=4 4022 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb10844617 [0,2,0,0,0,0|0,0,2]=4 4023 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb2725501 [0,2,0,0,0,0|0,0,2]=4 4024 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb19889827 [0,2,0,0,0,0|0,0,2]=4 4025 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb3940062 [0,2,0,0,0,0|0,0,2]=4 4026 B14R1.60 CCOC(=O)\C(C)=C\c1ccccn1 Amb32664894 [0,2,0,0,0,0|1,0,0]=3 4027 B14R1.60 CCOC(=O)\C(C)=C\c1cccnc1 Amb32664895 [0,2,0,0,0,0|1,0,0]=3 4028 B14R1.60 CCOC(=O)\C(Cl)=C\c1ccccc1 Amb32425173 [0,2,0,0,0,0|0,0,0]=2 4029 B14R1.60 CCOC(=O)\C([O-])=C\c1ccncc1 Amb19506687 [0,2,0,0,0,0|1,0,0]=3 4030 B14R1.60 CNCC(=O)\C(C)=C\c1ccccc1 Amb33476419 [0,2,0,0,0,0|1,0,0]=3 4031 B14R1.60 COCC(=O)N(C)Cc1ccccc1 Amb3115734 [0,2,0,0,0,0|1,0,1]=4 4032 B14R1.60 CO\C=C(/F)C(=O)Nc1ccccc1 Amb22547243 [0,2,0,0,0,0|2,0,0]=4 4033 B14R1.60 CO\C=C(/F)C(=O)Sc1ccccc1 Amb22641707 [0,2,0,0,0,0|2,0,0]=4 4034 B14R1.60 C\C(=C/c1ccccc1)C(=O)CCN Amb33476404 [0,2,0,0,0,0|1,0,0]=3 4035 B14R1.60 C\C(=C/c1ccccc1)C(=O)N=[N+]=[N-] Amb27876099 [0,2,0,0,0,0|2,0,0]=4 4036 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/N Amb27858691 [0,2,0,0,0,0|1,0,1]=4 4037 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/[O-] Amb22728792 [0,2,0,0,0,0|1,0,1]=4 4038 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C\[O-] Amb24090361 [0,2,0,0,0,0|1,0,1]=4 4039 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\N Amb28137904 [0,2,0,0,0,0|1,0,1]=4 4040 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\O Amb27197219 [0,2,0,0,0,0|1,0,1]=4 4041 B14R1.60 C\C=C\C(=O)C(=O)Nc1ccccc1 Amb26904574 [0,2,0,0,0,0|2,0,0]=4 4042 B14R1.156 C#CCOC(=O)NCc1ccccc1 Amb8388819 [0,2,0,0,0,0|1,0,1]=4 4043 B14R1.156 C=CCOC(=O)NCc1ccccc1 Amb26382880 [0,2,0,0,0,0|1,0,1]=4 4044 B14R1.156 C=CCOC(=O)OCc1ccccc1 Amb27145426 [0,2,0,0,0,0|1,0,1]=4 4045 B14R1.156 C=CCOC(=O)\C=C\c1ccccc1 Amb6358001 [0,2,0,0,0,0|0,0,0]=2 4046 B14R1.156 CCCOC(=O)NCc1ccccc1 Amb3101958 [0,2,0,0,0,0|1,0,1]=4 4047 B14R1.156 CCCOC(=O)OCc1ccccc1 Amb27976572 [0,2,0,0,0,0|1,0,1]=4 4048 B14R1.156 CCOCC(=O)C#Cc1ccccc1 Amb27829374 [0,2,0,0,0,0|0,0,2]=4 4049 B14R1.156 CCONC(=O)NCc1ccccc1 Amb27590818 [0,2,0,0,0,0|1,0,1]=4 4050 B14R1.156 COCCC(=O)NCc1ccccc1 Amb28384929 [0,2,0,0,0,0|1,0,1]=4 4051 B14R1.156 COCNC(=O)OCc1ccccc1 Amb26316850 [0,2,0,0,0,0|1,0,1]=4 4052 B14R1.156 CONCC(=O)NCc1ccccc1 Amb27419363 [0,2,0,0,0,0|1,0,1]=4 4053 B14R1.156 N#CCOC(=O)NCc1ccccc1 Amb27876466 [0,2,0,0,0,0|1,0,1]=4 4054 B14R1.156 NCCOC(=O)NCc1ccccc1 Amb27870655 [0,2,0,0,0,0|1,0,1]=4 4055 B14R1.156 O=C(COc1ccccc1)OCCBr Amb24065427 [0,2,0,0,0,0|1,0,1]=4 4056 B14R1.156 O=C(NCc1ccccc1)OCCO Amb24335977 [0,2,0,0,0,0|1,0,1]=4 4057 B14R1.156 O=C(\C=C\c1ccccc1)NCCO Amb5799194 [0,2,0,0,0,0|1,0,0]=3 4058 B14R1.156 O=CCOC(=O)NCc1ccccc1 Amb28251211 [0,2,0,0,0,0|1,0,1]=4 4059 B14R1.156 O=CCOC(=O)OCc1ccccc1 Amb27481625 [0,2,0,0,0,0|1,0,1]=4 4060 B14R1.598 CCOC(=O)C#Cc1ccccc1C Amb24369087 [0,2,0,0,0,0|0,0,2]=4 4061 B14R1.598 CCOC(=O)C#Cc1ccccc1Cl Amb24079963 [0,2,0,0,0,0|0,0,2]=4 4062 B14R1.598 CCOC(=O)C#Cc1ccccc1F Amb24079971 [0,2,0,0,0,0|0,0,2]=4 4063 B14R1.598 CCOC(=O)C#Cc1ccccc1N Amb26490907 [0,2,0,0,0,0|0,0,2]=4 4064 B14R1.598 CCOC(=O)C#Cc1ccccc1O Amb24613197 [0,2,0,0,0,0|0,0,2]=4 4065 B14R1.598 CCOC(=O)CCc1ccccc1Br Amb15692688 [0,2,0,0,0,0|0,0,2]=4 4066 B14R1.598 CCOC(=O)CCc1ccccc1C Amb19073901 [0,2,0,0,0,0|0,0,2]=4 4067 B14R1.598 CCOC(=O)CCc1ccccc1Cl Amb21962867 [0,2,0,0,0,0|0,0,2]=4 4068 B14R1.598 CCOC(=O)CCc1ccccc1F Amb21962868 [0,2,0,0,0,0|0,0,2]=4 4069 B14R1.598 CCOC(=O)CCc1ccccc1N Amb33803544 [0,2,0,0,0,0|0,0,2]=4 4070 B14R1.598 CCOC(=O)CCc1ccccc1O Amb18651832 [0,2,0,0,0,0|0,0,2]=4 4071 B14R1.598 CCOC(=O)CNc1ccccc1C Amb6714296 [0,2,0,0,0,0|1,0,1]=4 4072 B14R1.598 CCOC(=O)CNc1ccccc1Cl Amb6712399 [0,2,0,0,0,0|1,0,1]=4 4073 B14R1.598 CCOC(=O)CNc1ccccc1F Amb6712589 [0,2,0,0,0,0|1,0,1]=4 4074 B14R1.598 CCOC(=O)CNc1ccccc1N Amb19051515 [0,2,0,0,0,0|1,0,1]=4 4075 B14R1.598 CCOC(=O)COc1ccccc1Br Amb6550418 [0,2,0,0,0,0|1,0,1]=4 4076 B14R1.598 CCOC(=O)COc1ccccc1C Amb6357570 [0,2,0,0,0,0|1,0,1]=4 4077 B14R1.598 CCOC(=O)COc1ccccc1Cl Amb6856205 [0,2,0,0,0,0|1,0,1]=4 4078 B14R1.598 CCOC(=O)COc1ccccc1F Amb7755238 [0,2,0,0,0,0|1,0,1]=4 4079 B14R1.598 CCOC(=O)COc1ccccc1I Amb9285952 [0,2,0,0,0,0|1,0,1]=4 4080 B14R1.598 CCOC(=O)COc1ccccc1O Amb1199351 [0,2,0,0,0,0|1,0,1]=4 4081 B14R1.598 CCOC(=O)\C=C\c1ccccc1Br Amb33997762 [0,2,0,0,0,0|0,0,0]=2 4082 B14R1.598 CCOC(=O)\C=C\c1ccccc1C Amb33358074 [0,2,0,0,0,0|0,0,0]=2 4083 B14R1.598 CCOC(=O)\C=C\c1ccccc1Cl Amb34103701 [0,2,0,0,0,0|0,0,0]=2 4084 B14R1.598 CCOC(=O)\C=C\c1ccccc1F Amb2699675 [0,2,0,0,0,0|0,0,0]=2 4085 B14R1.598 CCOC(=O)\C=C\c1ccccc1N Amb17777074 [0,2,0,0,0,0|0,0,0]=2 4086 B14R1.598 CCOC(=O)\C=C\c1ccccc1O Amb18651061 [0,2,0,0,0,0|0,0,0]=2 4087 B14R1.598 CCOC(=O)\C=C\c1cccnc1Br Amb33972638 [0,2,0,0,0,0|1,0,0]=3 4088 B14R1.598 CCOC(=O)\C=C\c1cccnc1Cl Amb24090584 [0,2,0,0,0,0|1,0,0]=3 4089 B14R1.598 CCOC(=O)\C=C\c1cccnc1F Amb33972618 [0,2,0,0,0,0|1,0,0]=3 4090 B14R1.598 CCOC(=O)\C=C\c1ccncc1F Amb33469196 [0,2,0,0,0,0|1,0,0]=3 4091 B14R1.598 CCOC(=O)\C=C\c1cnccc1C Amb32423788 [0,2,0,0,0,0|1,0,0]=3 4092 B14R1.598 CCOC(=O)\C=C\c1cnccc1N Amb10844701 [0,2,0,0,0,0|1,0,0]=3 4093 B14R1.598 CCOC(=O)\C=C\c1ncccc1F Amb33972617 [0,2,0,0,0,0|1,0,0]=3 4094 B14R1.598 COCC(=O)CSc1ccccc1Br Amb32683212 [0,2,0,0,0,0|1,0,1]=4 4095 B14R1.598 COCC(=O)CSc1ccccc1C Amb32683200 [0,2,0,0,0,0|1,0,1]=4 4096 B14R1.598 COCC(=O)CSc1ccccc1Cl Amb32683213 [0,2,0,0,0,0|1,0,1]=4 4097 B14R1.598 COCC(=O)CSc1ccccc1F Amb32683192 [0,2,0,0,0,0|1,0,1]=4 4098 B14R1.598 CONC(=O)\C=C\c1ccccc1Br Amb27857184 [0,2,0,0,0,0|0,0,0]=2 4099 B14R1.598 CONC(=O)\C=C\c1ccccc1F Amb28201232 [0,2,0,0,0,0|0,0,0]=2 4100 B14R1.598 [N-]=[N+]=NC(=O)\C=C\c1ccccc1Br Amb28280191 [0,2,0,0,0,0|2,0,0]=4 4101 B14R1.818 C=C(\C=C\c1ccccc1)NC(C)=O Amb27210869 [0,2,0,0,0,0|2,0,0]=4 4102 B14R1.818 CC(=C\C(C)O)\C=C\c1ccccc1 Amb27472779 [0,2,0,0,0,0|2,0,0]=4 4103 B14R1.818 CC(=O)CC(=O)\C=C\c1ccccc1 Amb17594879 [0,2,0,0,0,0|1,0,0]=3 4104 B14R1.818 CC(=O)NC(=O)\C=C/c1ccccn1 Amb27464445 [0,2,0,0,0,0|2,0,0]=4 4105 B14R1.818 CC(=O)NC(=O)\C=C\c1ccccn1 Amb27879510 [0,2,0,0,0,0|2,0,0]=4 4106 B14R1.818 CC(C)NC(=O)\C=C\c1ccccc1 Amb3096736 [0,2,0,0,0,0|1,0,0]=3 4107 B14R1.818 CC(C)OC(=O)C#Cc1ccccc1 Amb27662961 [0,2,0,0,0,0|0,0,2]=4 4108 B14R1.818 CC(Cl)OC(=O)OCc1ccccc1 Amb25202460 [0,2,0,0,0,0|1,0,1]=4 4109 B14R1.818 CN(C)NC(=O)\C=C\c1ccccc1 Amb2620529 [0,2,0,0,0,0|1,0,0]=3 4110 B14R1.818 CN(C)\N=C(N)/C=C/c1ccccc1 Amb27626897 [0,2,0,0,0,0|2,0,0]=4 4111 B14R1.818 N=C(N)NC(=O)\C=C\c1ccccc1 Amb28291434 [0,2,0,0,0,0|1,0,1]=4 4112 B14R1.818 NC(=O)NC(=O)\C=C\c1ccccc1 Amb25291849 [0,2,0,0,0,0|1,0,1]=4 4113 B14R1.818 NC(=S)NC(=O)\C=C\c1ccccc1 Amb4148846 [0,2,0,0,0,0|1,0,1]=4 4114 B14R1.979 CNC(\C=C\c1ccccc1)=N\C#N Amb27753765 [0,2,0,0,0,0|2,0,0]=4 4115 B14R1.425 C=C(C)C(=O)C(=O)Nc1ccccc1 Amb27868426 [0,2,0,0,0,0|2,0,0]=4 4116 B14R1.425 CN(C)C(=O)C(=O)Cc1ccccc1 Amb17401496 [0,2,0,0,0,0|1,0,1]=4 4117 B14R1.425 CN(C)C(=O)C(=O)Nc1ccccc1 Amb27407891 [0,2,0,0,0,0|2,0,0]=4 4118 B14R1.425 CN(C)C(=O)C(=S)Nc1ccccc1 Amb28290461 [0,2,0,0,0,0|2,0,0]=4 4119 B14R1.425 C\C(=C/c1ccccc1)C(=O)C(=O)O Amb27865568 [0,2,0,0,0,0|2,0,0]=4 4120 B14R1.425 C\C(=C/c1ccccc1)C(=O)C(C)N Amb33506725 [0,2,0,0,0,0|1,0,0]=3 4121 B14R1.425 C\C(=C/c1ccccc1)C(=O)C(F)F Amb33381506 [0,2,0,0,0,0|2,0,0]=4 4122 B14R1.425 C\C(=C\c1ccccc1)C(=O)C(=O)O Amb28193728 [0,2,0,0,0,0|2,0,0]=4 4123 B14R1.532 CO\C(=N\O)C(=O)Nc1ccccc1 Amb27166514 [0,2,0,0,0,0|1,0,1]=4 4124 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Cl Amb3600467 [0,2,0,0,0,0|2,0,0]=4 4125 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1F Amb3607831 [0,2,0,0,0,0|2,0,0]=4 4126 B14R1.1007 COC(=O)C(=O)Cc1ccccc1C Amb17139340 [0,2,0,0,0,0|0,0,1]=3 4127 B14R1.1007 COC(=O)C(=O)Cc1ccccc1Cl Amb17140708 [0,2,0,0,0,0|0,0,1]=3 4128 B14R1.1007 COC(=O)C(=O)Cc1ccccc1F Amb17139584 [0,2,0,0,0,0|0,0,1]=3 4129 B14R1.1007 COC(=O)C(=O)Nc1ccccc1I Amb27972049 [0,2,0,0,0,0|1,0,0]=3 4130 B14R1.1007 COC(=O)C(=O)Nc1ccccc1O Amb24678810 [0,2,0,0,0,0|1,0,0]=3 4131 B14R1.1007 COC(=O)C(=O)Nc1ccncc1F Amb27225593 [0,2,0,0,0,0|2,0,0]=4 4132 B14R1.1007 COC(=O)C(Br)Cc1ccccc1C Amb17355935 [0,2,0,0,0,0|0,0,2]=4 4133 B14R1.1007 COC(=O)C(Br)Cc1ccccc1Cl Amb4074141 [0,2,0,0,0,0|0,0,2]=4 4134 B14R1.1007 COC(=O)C(Br)Cc1ccccc1F Amb17357772 [0,2,0,0,0,0|0,0,2]=4 4135 B14R1.1007 COC(=O)C(C)Nc1ccccc1Cl Amb19018595 [0,2,0,0,0,0|1,0,1]=4 4136 B14R1.1007 COC(=O)C(C)Oc1ccccc1C Amb4292034 [0,2,0,0,0,0|1,0,1]=4 4137 B14R1.1007 COC(=O)C(C)Oc1ccccc1N Amb17110001 [0,2,0,0,0,0|1,0,1]=4 4138 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1Br Amb17204952 [0,2,0,0,0,0|0,0,2]=4 4139 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1C Amb17204446 [0,2,0,0,0,0|0,0,2]=4 4140 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1Cl Amb17204591 [0,2,0,0,0,0|0,0,2]=4 4141 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1F Amb17204462 [0,2,0,0,0,0|0,0,2]=4 4142 B14R1.1007 COC(=O)C(N)Cc1ccccc1Br Amb32753638 [0,2,0,0,0,0|0,0,2]=4 4143 B14R1.1007 COC(=O)C(N)Cc1ccccc1Br Amb32839096 [0,2,0,0,0,0|0,0,2]=4 4144 B14R1.1007 COC(=O)C(N)Cc1ccccc1C Amb17401769 [0,2,0,0,0,0|0,0,2]=4 4145 B14R1.1007 COC(=O)C(N)Cc1ccccc1Cl Amb17404292 [0,2,0,0,0,0|0,0,2]=4 4146 B14R1.1007 COC(=O)C(N)Cc1ccccc1F Amb17402181 [0,2,0,0,0,0|0,0,2]=4 4147 B14R1.1007 COC(=O)C(N)Cc1ccccc1O Amb28653208 [0,2,0,0,0,0|0,0,2]=4 4148 B14R1.1007 COC(=O)C(O)Cc1ccccc1Br Amb33430066 [0,2,0,0,0,0|0,0,2]=4 4149 B14R1.1007 COC(=O)C(O)Cc1ccccc1C Amb17139448 [0,2,0,0,0,0|0,0,2]=4 4150 B14R1.1007 COC(=O)C(O)Cc1ccccc1Cl Amb17140886 [0,2,0,0,0,0|0,0,2]=4 4151 B14R1.1007 COC(=O)C(O)Cc1ccccc1F Amb17139693 [0,2,0,0,0,0|0,0,2]=4 4152 B14R1.1007 COC(=O)C(O)Cc1ccccc1O Amb33079607 [0,2,0,0,0,0|0,0,2]=4 4153 B14R1.1007 COC(=O)[C@@H](N)Cc1ccccc1C Amb34162481 [0,2,0,0,0,0|0,0,2]=4 4154 B14R1.1007 COC(=O)[C@@H](N)Cc1ccccc1Cl Amb30633893 [0,2,0,0,0,0|0,0,2]=4 4155 B14R1.1007 COC(=O)[C@H](N)Cc1ccccc1C Amb35825274 [0,2,0,0,0,0|0,0,2]=4 4156 B14R1.1007 COC(=O)[C@H](N)Cc1ccccc1Cl Amb34162293 [0,2,0,0,0,0|0,0,2]=4 4157 B14R1.1007 COC(=O)\C(C)=C\c1ccccc1N Amb28185898 [0,2,0,0,0,0|0,0,0]=2 4158 B14R1.1007 COC(=O)\C(C)=C\c1ccccc1O Amb25347509 [0,2,0,0,0,0|0,0,0]=2 4159 B14R1.1031 CCC(Nc1ccccc1)C(=O)OC Amb19050998 [0,2,0,0,0,0|1,0,1]=4 4160 B14R1.1031 CNC(=O)\C(C#N)=C\c1ccccc1 Amb18649320 [0,2,0,0,0,0|1,0,0]=3 4161 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb19079328 [0,2,0,0,0,0|0,0,2]=4 4162 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb30633473 [0,2,0,0,0,0|0,0,2]=4 4163 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb16183825 [0,2,0,0,0,0|0,0,2]=4 4164 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb22745351 [0,2,0,0,0,0|0,0,2]=4 4165 B14R1.1031 CN[C@H](Cc1ccccc1)C(=O)OC Amb33483084 [0,2,0,0,0,0|0,0,2]=4 4166 B14R1.1031 CN[C@H](Cc1ccccc1)C(=O)OC Amb33483812 [0,2,0,0,0,0|0,0,2]=4 4167 B14R1.1031 COC(=O)C(C#N)Cc1ccccc1 Amb17336069 [0,2,0,0,0,0|0,0,2]=4 4168 B14R1.1031 COC(=O)C(CN)Cc1ccccc1 Amb2694062 [0,2,0,0,0,0|0,0,2]=4 4169 B14R1.1031 COC(=O)C(CN)Cc1ccccc1 Amb7800908 [0,2,0,0,0,0|0,0,2]=4 4170 B14R1.1031 COC(=O)C(CN)Oc1ccccc1 Amb32651896 [0,2,0,0,0,0|1,0,1]=4 4171 B14R1.1031 COC(=O)C(CN)Oc1ccccc1 Amb32651920 [0,2,0,0,0,0|1,0,1]=4 4172 B14R1.1031 COC(=O)C(CO)Cc1ccccc1 Amb10608962 [0,2,0,0,0,0|0,0,2]=4 4173 B14R1.1031 COC(=O)C(Cc1ccccc1)ON Amb33339253 [0,2,0,0,0,0|0,0,2]=4 4174 B14R1.1031 COC(=O)[C@@H](CN)Cc1ccccc1 Amb33329063 [0,2,0,0,0,0|0,0,2]=4 4175 B14R1.1031 COC(=O)[C@@H](CN)Cc1ccccc1 Amb33329082 [0,2,0,0,0,0|0,0,2]=4 4176 B14R1.1031 COC(=O)[C@@H](CN)Oc1ccccc1 Amb32680272 [0,2,0,0,0,0|1,0,1]=4 4177 B14R1.1031 COC(=O)[C@@H](CN)Oc1ccccc1 Amb32680273 [0,2,0,0,0,0|1,0,1]=4 4178 B14R1.1031 COC(=O)[C@H](CN)Cc1ccccc1 Amb33328927 [0,2,0,0,0,0|0,0,2]=4 4179 B14R1.1031 COC(=O)[C@H](CN)Cc1ccccc1 Amb33457754 [0,2,0,0,0,0|0,0,2]=4 4180 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb18650860 [0,2,0,0,0,0|0,0,0]=2 4181 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb32413923 [0,2,0,0,0,0|0,0,0]=2 4182 B14R1.1031 COC(=O)\C(C#N)=C/c1ccccc1 Amb2701553 [0,2,0,0,0,0|0,0,0]=2 4183 B14R1.1031 COC(=O)\C(C#N)=C\c1ccccc1 Amb10844663 [0,2,0,0,0,0|0,0,0]=2 4184 B14R1.1031 COC(=O)\C(C#N)=C\c1ccccn1 Amb3369894 [0,2,0,0,0,0|1,0,0]=3 4185 B14R1.1031 COC(=O)\C(C#N)=C\c1cccnc1 Amb6883274 [0,2,0,0,0,0|1,0,0]=3 4186 B14R1.1031 COC(=O)\C(C#N)=C\c1ccncc1 Amb17335958 [0,2,0,0,0,0|1,0,0]=3 4187 B14R1.1031 COC(=O)\C(C#N)=C\c1ccncn1 Amb28143571 [0,2,0,0,0,0|2,0,0]=4 4188 B14R1.1031 COC(=O)\C(C#N)=C\c1cnccn1 Amb35639876 [0,2,0,0,0,0|2,0,0]=4 4189 B14R1.1031 COC(=O)\C(C#N)=C\c1cncnc1 Amb28455981 [0,2,0,0,0,0|2,0,0]=4 4190 B14R1.1107 COC(=O)C(C)(C)Cc1ccccc1 Amb17844108 [0,2,0,0,0,0|0,0,2]=4 4191 B14R1.1107 COC(=O)C(C)(C)Nc1ccccc1 Amb18304726 [0,2,0,0,0,0|1,0,1]=4 4192 B14R1.1107 COC(=O)C(C)(C)Oc1ccccc1 Amb17401865 [0,2,0,0,0,0|1,0,1]=4 4193 B14R1.1107 COC(=O)C(C)(Cl)Cc1ccccc1 Amb32729440 [0,2,0,0,0,0|0,0,2]=4 4194 B14R1.1107 COC(=O)C(C)(N)Cc1ccccc1 Amb17401738 [0,2,0,0,0,0|0,0,2]=4 4195 B14R1.1107 COC(=O)C(C)(N)Cc1ccccc1 Amb6365465 [0,2,0,0,0,0|0,0,2]=4 4196 B14R1.298 COC(C)(C)\C=C\c1ccccc1O Amb26432949 [0,2,0,0,0,0|1,0,1]=4 4197 B14R1.2928 COC(C)(\C=C\c1ccccc1)CN Amb33080819 [0,2,0,0,0,0|1,0,1]=4 4198 B14R1.161 CC(C)C(=O)\C=C\c1ccccc1O Amb25252165 [0,2,0,0,0,0|1,0,0]=3 4199 B14R1.161 CN(C)C(=O)\C=C\c1ccccc1Cl Amb3701968 [0,2,0,0,0,0|1,0,0]=3 4200 B14R1.161 CN(C)C(=O)\C=C\c1ccccc1O Amb18650814 [0,2,0,0,0,0|1,0,0]=3 4201 B14R1.161 Cc1ccccc1\C=C\C(=O)C(=O)O Amb17470738 [0,2,0,0,0,0|2,0,0]=4 4202 B14R1.161 Cc1ccccc1\C=C\C(=O)N(C)C Amb28194394 [0,2,0,0,0,0|1,0,0]=3 4203 B14R1.161 O=C(O)C(=O)\C=C/c1ccccc1O Amb25068429 [0,2,0,0,0,0|2,0,0]=4 4204 B14R1.161 O=C(O)C(=O)\C=C\c1ccccc1Br Amb17473510 [0,2,0,0,0,0|2,0,0]=4 4205 B14R1.161 O=C(O)C(=O)\C=C\c1ccccc1Cl Amb17471417 [0,2,0,0,0,0|2,0,0]=4 4206 B14R1.161 O=C(O)C(=O)\C=C\c1ccccc1F Amb17470866 [0,2,0,0,0,0|2,0,0]=4 4207 B14R1.3099 CC(C)(C)C(=O)\C=C/c1ccncc1 Amb22342921 [0,2,0,0,0,0|2,0,0]=4 4208 B14R1.3099 CC(C)(C)C(=O)\C=C\c1ccccc1 Amb2627026 [0,2,0,0,0,0|1,0,0]=3 4209 B14R1.3099 O=C(\C=C\c1ccccc1)C(F)(F)F Amb2236433 [0,2,0,0,0,0|2,0,0]=4 4210 B14R1.4194 CCC(\C=C\c1ccccc1)C(=O)O Amb32954843 [0,2,0,0,0,0|1,0,1]=4 4211 B14R1.863 C#Cc1ccccc1\C=C\C(=O)OC Amb28436256 [0,2,0,0,0,0|0,0,0]=2 4212 B14R1.863 C=CC(=O)\C=C\c1ccccc1OC Amb33503245 [0,2,0,0,0,0|1,0,1]=4 4213 B14R1.863 CCc1ccccc1C#CC(=O)OC Amb27393368 [0,2,0,0,0,0|0,0,2]=4 4214 B14R1.863 CCc1ccccc1OCC(=O)OC Amb9004689 [0,2,0,0,0,0|1,0,1]=4 4215 B14R1.863 CCc1ccccc1\C=C\C(=O)OC Amb33358061 [0,2,0,0,0,0|0,0,0]=2 4216 B14R1.863 COC(=O)CCc1ccccc1CN Amb32965562 [0,2,0,0,0,0|0,0,2]=4 4217 B14R1.863 COC(=O)CCc1ccccc1CN Amb33482758 [0,2,0,0,0,0|0,0,2]=4 4218 B14R1.863 COC(=O)CNc1ccccc1OC Amb1043473 [0,2,0,0,0,0|1,0,1]=4 4219 B14R1.863 COC(=O)COc1ccccc1C#N Amb2420034 [0,2,0,0,0,0|1,0,1]=4 4220 B14R1.863 COC(=O)COc1ccccc1C=O Amb3599278 [0,2,0,0,0,0|1,0,1]=4 4221 B14R1.863 COC(=O)COc1ccccc1CN Amb1112350 [0,2,0,0,0,0|1,0,1]=4 4222 B14R1.863 COC(=O)COc1ccccc1CN Amb19341302 [0,2,0,0,0,0|1,0,1]=4 4223 B14R1.863 COC(=O)COc1ccccc1OC Amb6540785 [0,2,0,0,0,0|1,0,1]=4 4224 B14R1.863 COC(=O)CSc1ccccc1CO Amb33607467 [0,2,0,0,0,0|1,0,1]=4 4225 B14R1.863 COC(=O)\C=C\c1ccccc1C#N Amb18649516 [0,2,0,0,0,0|0,0,0]=2 4226 B14R1.863 COC(=O)\C=C\c1ccccc1CBr Amb24120383 [0,2,0,0,0,0|0,0,0]=2 4227 B14R1.863 COC(=O)\C=C\c1ccccc1OC Amb34005315 [0,2,0,0,0,0|0,0,0]=2 4228 B14R1.19598 C=CC(=O)\C=C\c1c(Cl)cccc1Cl Amb33503121 [0,2,0,0,0,0|1,0,1]=4 4229 B14R1.19598 C=CC(=O)\C=C\c1c(F)cccc1F Amb33503231 [0,2,0,0,0,0|1,0,1]=4 4230 B14R1.19598 COC(=O)C#Cc1c(C)cccc1Br Amb27654604 [0,2,0,0,0,0|0,0,2]=4 4231 B14R1.19598 COC(=O)C#Cc1c(Cl)cccc1Br Amb27263581 [0,2,0,0,0,0|0,0,2]=4 4232 B14R1.19598 COC(=O)C#Cc1c(F)cccc1Cl Amb28184147 [0,2,0,0,0,0|0,0,2]=4 4233 B14R1.19598 COC(=O)C#Cc1c(F)cccc1F Amb25905765 [0,2,0,0,0,0|0,0,2]=4 4234 B14R1.19598 COC(=O)C#Cc1c(O)cccc1F Amb32990043 [0,2,0,0,0,0|0,0,2]=4 4235 B14R1.19598 COC(=O)CCc1c(Cl)cccc1Cl Amb28653276 [0,2,0,0,0,0|0,0,2]=4 4236 B14R1.19598 COC(=O)CCc1c(F)cccc1Cl Amb17404666 [0,2,0,0,0,0|0,0,2]=4 4237 B14R1.19598 COC(=O)CNc1c(C)cccc1Br Amb35706947 [0,2,0,0,0,0|1,0,1]=4 4238 B14R1.19598 COC(=O)CNc1c(C)cccc1C Amb19079332 [0,2,0,0,0,0|1,0,1]=4 4239 B14R1.19598 COC(=O)CNc1c(C)cccc1Cl Amb28314804 [0,2,0,0,0,0|1,0,1]=4 4240 B14R1.19598 COC(=O)CNc1c(F)cccc1Cl Amb28040655 [0,2,0,0,0,0|1,0,1]=4 4241 B14R1.19598 COC(=O)CNc1c(N)cccc1Br Amb35645927 [0,2,0,0,0,0|1,0,1]=4 4242 B14R1.19598 COC(=O)CNc1c(N)cccc1F Amb27662748 [0,2,0,0,0,0|1,0,1]=4 4243 B14R1.19598 COC(=O)COc1c(Br)cccc1Br Amb9206349 [0,2,0,0,0,0|1,0,1]=4 4244 B14R1.19598 COC(=O)NCc1c(Cl)cccc1Cl Amb29868925 [0,2,0,0,0,0|1,0,1]=4 4245 B14R1.19598 COC(=O)\C=C\c1c(Br)cncc1Br Amb27491312 [0,2,0,0,0,0|1,0,0]=3 4246 B14R1.19598 COC(=O)\C=C\c1c(C)cccc1C Amb25304892 [0,2,0,0,0,0|0,0,0]=2 4247 B14R1.19598 COC(=O)\C=C\c1c(Cl)cccc1Cl Amb3114735 [0,2,0,0,0,0|0,0,0]=2 4248 B14R1.19598 COC(=O)\C=C\c1c(F)cccc1Br Amb28245037 [0,2,0,0,0,0|0,0,0]=2 4249 B14R1.19598 COC(=O)\C=C\c1c(F)cccc1Cl Amb27431132 [0,2,0,0,0,0|0,0,0]=2 4250 B14R1.19598 COC(=O)\C=C\c1c(F)cccc1F Amb24309474 [0,2,0,0,0,0|0,0,0]=2 4251 B14R1.19598 COC(=O)\C=C\c1c(I)ccnc1Cl Amb13889816 [0,2,0,0,0,0|1,0,0]=3 4252 B14R1.19598 NNC(=O)\C=C\c1c(Cl)cccc1Cl Amb8998122 [0,2,0,0,0,0|2,0,0]=4 4253 B14R1.19598 NNC(=O)\C=C\c1c(F)cccc1Cl Amb8998243 [0,2,0,0,0,0|2,0,0]=4 4254 B12R1.77 C#Cc1ccccc1C(=O)OC Amb20621612 [0,0,1,1,0,0|0,0,2]=4 4255 B12R1.77 C=C(OC)c1ccccc1C=O Amb28381213 [0,0,1,1,0,0|2,0,0]=4 4256 B12R1.77 C=Cc1ccccc1C(=O)OC Amb16185426 [0,0,1,1,0,0|0,0,0]=2 4257 B12R1.77 C=Cc1cccnc1C(=O)OC Amb26451003 [0,0,1,1,0,0|1,0,0]=3 4258 B12R1.77 C=Cc1ccncc1C(=O)OC Amb25343188 [0,0,1,1,0,0|1,0,0]=3 4259 B12R1.77 C=Cc1cnccc1C(=O)OC Amb33456835 [0,0,1,1,0,0|1,0,0]=3 4260 B12R1.77 C=Cc1ncccc1C(=O)CC Amb25693281 [0,0,1,1,0,0|2,0,0]=4 4261 B12R1.77 CNC(=O)c1ccccc1C=O Amb18645820 [0,0,1,1,0,0|2,0,0]=4 4262 B12R1.77 CNc1ccccc1C(=O)OC Amb841657 [0,0,1,1,0,0|1,0,1]=4 4263 B12R1.77 COC(=O)c1ccccc1C#N Amb2689405 [0,0,1,1,0,0|1,0,1]=4 4264 B12R1.77 COC(=O)c1ccccc1C=O Amb1215595 [0,0,1,1,0,0|1,0,0]=3 4265 B12R1.77 COC(=O)c1ccccc1CBr Amb5721955 [0,0,1,1,0,0|1,0,1]=4 4266 B12R1.77 COC(=O)c1ccccc1CCl Amb6297671 [0,0,1,1,0,0|1,0,1]=4 4267 B12R1.77 COC(=O)c1ccccc1CN Amb2691282 [0,0,1,1,0,0|1,0,1]=4 4268 B12R1.77 COC(=O)c1ccccc1CN Amb9283588 [0,0,1,1,0,0|1,0,1]=4 4269 B12R1.77 COC(=O)c1ccccc1CO Amb1110579 [0,0,1,1,0,0|1,0,1]=4 4270 B12R1.77 COC(=O)c1ccccc1CS Amb27153582 [0,0,1,1,0,0|1,0,1]=4 4271 B12R1.77 COC(=O)c1ccccc1NN Amb24578734 [0,0,1,1,0,0|2,0,0]=4 4272 B12R1.77 COC(=O)c1ccccc1N[NH3+] Amb22489304 [0,0,1,1,0,0|2,0,0]=4 4273 B12R1.77 COC(=O)c1ccccc1OC Amb4380371 [0,0,1,1,0,0|1,0,1]=4 4274 B12R1.77 COC(=O)c1ccccc1SC Amb1398892 [0,0,1,1,0,0|1,0,1]=4 4275 B12R1.77 COC(=O)c1cccnc1C=O Amb8467930 [0,0,1,1,0,0|2,0,0]=4 4276 B12R1.77 COC(=O)c1ccncc1C=O Amb23538928 [0,0,1,1,0,0|2,0,0]=4 4277 B12R1.77 COC(=O)c1cnccc1C=O Amb22500676 [0,0,1,1,0,0|2,0,0]=4 4278 B12R1.77 COC(=O)c1ncccc1C=O Amb17933834 [0,0,1,1,0,0|2,0,0]=4 4279 B12R1.77 [C-]#[N+]c1ccccc1C(=O)OC Amb19928642 [0,0,1,1,0,0|1,0,1]=4 4280 B12R1.291 COC(=O)c1ccoc1\C=C\Br Amb33135553 [0,0,1,1,0,0|2,0,0]=4 4281 B12R1.291 COC(=O)c1ccsc1\C=C\Br Amb33135631 [0,0,1,1,0,0|2,0,0]=4 4282 B12R1.291 COC(=O)c1sccc1\C=C\Br Amb33135299 [0,0,1,1,0,0|2,0,0]=4 4283 B12R1.365 COC(=O)C1=CC=CC=CC1=O Amb27262900 [0,0,1,1,0,0|1,0,0]=3 4284 B12R1.382 COc1cccc(\C=C\C=O)c1 Amb17232402 [0,0,1,1,0,0|2,0,0]=4 4285 B12R1.382 COc1cccc(\C=C\C=O)n1 Amb33358721 [0,0,1,1,0,0|2,0,0]=4 4286 B12R1.1659 COC(=O)C1=CC=CC=CC=C1 Amb24534302 [0,0,1,1,0,0|0,0,0]=2 4287 B12R1.1748 COC(=O)NC1C=CC=CC=C1 Amb27445072 [0,0,1,1,0,0|1,0,1]=4 4288 B12R1.71 C=C\C=C\c1ccc(OC)cc1 Amb22546592 [0,0,1,1,0,0|1,0,0]=3 4289 B12R1.71 COc1ccc(\C=C\C=O)cc1 Amb6296108 [0,0,1,1,0,0|2,0,0]=4 4290 B12R1.71 COc1ccc(\C=C\C=O)cn1 Amb32953972 [0,0,1,1,0,0|2,0,0]=4 4291 B12R1.354 COC(=O)C1=CC(=O)C=CC1=O Amb17594120 [0,0,1,1,0,0|2,0,0]=4 4292 B12R1.354 COC(=O)c1cc(Br)ccc1Br Amb6365473 [0,0,1,1,0,0|2,0,0]=4 4293 B12R1.354 COC(=O)c1cc(Br)ccc1C Amb8395927 [0,0,1,1,0,0|1,0,1]=4 4294 B12R1.354 COC(=O)c1cc(Br)ccc1Cl Amb6508703 [0,0,1,1,0,0|2,0,0]=4 4295 B12R1.354 COC(=O)c1cc(Br)ccc1F Amb9241997 [0,0,1,1,0,0|2,0,0]=4 4296 B12R1.354 COC(=O)c1cc(Br)ccc1I Amb6297364 [0,0,1,1,0,0|2,0,0]=4 4297 B12R1.354 COC(=O)c1cc(Br)ccc1N Amb841656 [0,0,1,1,0,0|2,0,0]=4 4298 B12R1.354 COC(=O)c1cc(Br)ccc1O Amb6335134 [0,0,1,1,0,0|2,0,0]=4 4299 B12R1.354 COC(=O)c1cc(Br)ccc1S Amb28430391 [0,0,1,1,0,0|2,0,0]=4 4300 B12R1.354 COC(=O)c1cc(C)ccc1Br Amb21857016 [0,0,1,1,0,0|1,0,1]=4 4301 B12R1.354 COC(=O)c1cc(C)ccc1C Amb9241815 [0,0,1,1,0,0|0,0,2]=4 4302 B12R1.354 COC(=O)c1cc(C)ccc1Cl Amb24066646 [0,0,1,1,0,0|1,0,1]=4 4303 B12R1.354 COC(=O)c1cc(C)ccc1F Amb18805790 [0,0,1,1,0,0|1,0,1]=4 4304 B12R1.354 COC(=O)c1cc(C)ccc1I Amb10982586 [0,0,1,1,0,0|1,0,1]=4 4305 B12R1.354 COC(=O)c1cc(C)ccc1N Amb19514943 [0,0,1,1,0,0|1,0,1]=4 4306 B12R1.354 COC(=O)c1cc(C)ccc1N Amb841654 [0,0,1,1,0,0|1,0,1]=4 4307 B12R1.354 COC(=O)c1cc(C)ccc1O Amb2689444 [0,0,1,1,0,0|1,0,1]=4 4308 B12R1.354 COC(=O)c1cc(C)ccc1S Amb28145997 [0,0,1,1,0,0|1,0,1]=4 4309 B12R1.354 COC(=O)c1cc(Cl)ccc1Br Amb6366120 [0,0,1,1,0,0|2,0,0]=4 4310 B12R1.354 COC(=O)c1cc(Cl)ccc1C Amb20248840 [0,0,1,1,0,0|1,0,1]=4 4311 B12R1.354 COC(=O)c1cc(Cl)ccc1Cl Amb6365414 [0,0,1,1,0,0|2,0,0]=4 4312 B12R1.354 COC(=O)c1cc(Cl)ccc1F Amb9246801 [0,0,1,1,0,0|2,0,0]=4 4313 B12R1.354 COC(=O)c1cc(Cl)ccc1I Amb16185427 [0,0,1,1,0,0|2,0,0]=4 4314 B12R1.354 COC(=O)c1cc(Cl)ccc1N Amb841655 [0,0,1,1,0,0|2,0,0]=4 4315 B12R1.354 COC(=O)c1cc(Cl)ccc1O Amb2725152 [0,0,1,1,0,0|2,0,0]=4 4316 B12R1.354 COC(=O)c1cc(Cl)ccc1S Amb26932207 [0,0,1,1,0,0|2,0,0]=4 4317 B12R1.354 COC(=O)c1cc(F)ccc1Br Amb9246343 [0,0,1,1,0,0|2,0,0]=4 4318 B12R1.354 COC(=O)c1cc(F)ccc1C Amb4477454 [0,0,1,1,0,0|1,0,1]=4 4319 B12R1.354 COC(=O)c1cc(F)ccc1Cl Amb21856757 [0,0,1,1,0,0|2,0,0]=4 4320 B12R1.354 COC(=O)c1cc(F)ccc1F Amb2689414 [0,0,1,1,0,0|2,0,0]=4 4321 B12R1.354 COC(=O)c1cc(F)ccc1I Amb21962102 [0,0,1,1,0,0|2,0,0]=4 4322 B12R1.354 COC(=O)c1cc(F)ccc1N Amb6357909 [0,0,1,1,0,0|2,0,0]=4 4323 B12R1.354 COC(=O)c1cc(F)ccc1O Amb10603999 [0,0,1,1,0,0|2,0,0]=4 4324 B12R1.354 COC(=O)c1cc(F)ccc1S Amb26462187 [0,0,1,1,0,0|2,0,0]=4 4325 B12R1.354 COC(=O)c1cc(I)ccc1Br Amb19888248 [0,0,1,1,0,0|2,0,0]=4 4326 B12R1.354 COC(=O)c1cc(I)ccc1C Amb16232814 [0,0,1,1,0,0|1,0,1]=4 4327 B12R1.354 COC(=O)c1cc(I)ccc1Cl Amb16231584 [0,0,1,1,0,0|2,0,0]=4 4328 B12R1.354 COC(=O)c1cc(I)ccc1F Amb16185940 [0,0,1,1,0,0|2,0,0]=4 4329 B12R1.354 COC(=O)c1cc(I)ccc1I Amb24553261 [0,0,1,1,0,0|2,0,0]=4 4330 B12R1.354 COC(=O)c1cc(I)ccc1N Amb6371300 [0,0,1,1,0,0|2,0,0]=4 4331 B12R1.354 COC(=O)c1cc(I)ccc1O Amb6335133 [0,0,1,1,0,0|2,0,0]=4 4332 B12R1.354 COC(=O)c1cc(I)ccc1S Amb25768584 [0,0,1,1,0,0|2,0,0]=4 4333 B12R1.354 COC(=O)c1cc(N)ccc1Br Amb31378888 [0,0,1,1,0,0|2,0,0]=4 4334 B12R1.354 COC(=O)c1cc(N)ccc1Br Amb4010785 [0,0,1,1,0,0|2,0,0]=4 4335 B12R1.354 COC(=O)c1cc(N)ccc1C Amb6298304 [0,0,1,1,0,0|1,0,1]=4 4336 B12R1.354 COC(=O)c1cc(N)ccc1Cl Amb1090914 [0,0,1,1,0,0|2,0,0]=4 4337 B12R1.354 COC(=O)c1cc(N)ccc1Cl Amb8622737 [0,0,1,1,0,0|2,0,0]=4 4338 B12R1.354 COC(=O)c1cc(N)ccc1F Amb1106409 [0,0,1,1,0,0|2,0,0]=4 4339 B12R1.354 COC(=O)c1cc(N)ccc1F Amb32679405 [0,0,1,1,0,0|2,0,0]=4 4340 B12R1.354 COC(=O)c1cc(N)ccc1I Amb26860148 [0,0,1,1,0,0|2,0,0]=4 4341 B12R1.354 COC(=O)c1cc(N)ccc1N Amb18953028 [0,0,1,1,0,0|2,0,0]=4 4342 B12R1.354 COC(=O)c1cc(N)ccc1O Amb22051657 [0,0,1,1,0,0|2,0,0]=4 4343 B12R1.354 COC(=O)c1cc(N)ccc1O Amb2609072 [0,0,1,1,0,0|2,0,0]=4 4344 B12R1.354 COC(=O)c1cc(N)ccc1S Amb27764267 [0,0,1,1,0,0|2,0,0]=4 4345 B12R1.354 COC(=O)c1cc(O)ccc1Br Amb22493091 [0,0,1,1,0,0|2,0,0]=4 4346 B12R1.354 COC(=O)c1cc(O)ccc1C Amb13883583 [0,0,1,1,0,0|1,0,1]=4 4347 B12R1.354 COC(=O)c1cc(O)ccc1Cl Amb21963331 [0,0,1,1,0,0|2,0,0]=4 4348 B12R1.354 COC(=O)c1cc(O)ccc1F Amb21864823 [0,0,1,1,0,0|2,0,0]=4 4349 B12R1.354 COC(=O)c1cc(O)ccc1I Amb22737591 [0,0,1,1,0,0|2,0,0]=4 4350 B12R1.354 COC(=O)c1cc(O)ccc1N Amb2612465 [0,0,1,1,0,0|2,0,0]=4 4351 B12R1.354 COC(=O)c1cc(O)ccc1O Amb6335777 [0,0,1,1,0,0|2,0,0]=4 4352 B12R1.354 COC(=O)c1cc(O)ccc1S Amb27626541 [0,0,1,1,0,0|2,0,0]=4 4353 B12R1.354 COC(=O)c1cc(S)ccc1Cl Amb20623815 [0,0,1,1,0,0|2,0,0]=4 4354 B12R1.354 COC(=O)c1cc(S)ccc1F Amb27795561 [0,0,1,1,0,0|2,0,0]=4 4355 B12R1.354 COC(=O)c1cc(S)ccc1I Amb27190803 [0,0,1,1,0,0|2,0,0]=4 4356 B12R1.354 COC(=O)c1cc(S)ccc1O Amb27802687 [0,0,1,1,0,0|2,0,0]=4 4357 B12R1.78 C=Cc1cc(OC)ccc1C=O Amb25117921 [0,0,1,1,0,0|2,0,0]=4 4358 B12R1.78 C=Cc1ccc(OC)cc1C=O Amb18645651 [0,0,1,1,0,0|2,0,0]=4 4359 B12R1.78 C=Cc1ccc(OC)nc1C=O Amb27416661 [0,0,1,1,0,0|2,0,0]=4 4360 B12R1.78 C=Cc1nc(OC)ccc1C=O Amb25677511 [0,0,1,1,0,0|2,0,0]=4 4361 B12R1.179 COC(=O)c1csc(\C=C\Br)c1 Amb33135186 [0,0,1,1,0,0|2,0,0]=4 4362 B12R1.435 C#Cc1cccc(C(=O)OC)c1 Amb19895030 [0,0,1,1,0,0|0,0,2]=4 4363 B12R1.435 C=Cc1cc(C(=O)OC)ncn1 Amb28196394 [0,0,1,1,0,0|2,0,0]=4 4364 B12R1.435 C=Cc1cccc(C(=O)CC)c1 Amb27175868 [0,0,1,1,0,0|1,0,0]=3 4365 B12R1.435 C=Cc1cccc(C(=O)OC)c1 Amb16185423 [0,0,1,1,0,0|0,0,0]=2 4366 B12R1.435 C=Cc1cccc(C(=O)OC)n1 Amb28145004 [0,0,1,1,0,0|1,0,0]=3 4367 B12R1.435 C=Cc1ccnc(C(=O)OC)c1 Amb25774439 [0,0,1,1,0,0|1,0,0]=3 4368 B12R1.435 C=Cc1cncc(C(=O)NC)c1 Amb25308250 [0,0,1,1,0,0|2,0,0]=4 4369 B12R1.435 CCC(=O)c1cccc(C=O)c1 Amb17334555 [0,0,1,1,0,0|2,0,0]=4 4370 B12R1.435 CCc1cccc(C(=O)OC)c1 Amb26017255 [0,0,1,1,0,0|0,0,2]=4 4371 B12R1.435 CNC(=O)c1cccc(C=O)c1 Amb19943944 [0,0,1,1,0,0|2,0,0]=4 4372 B12R1.435 CNc1cccc(C(=O)OC)c1 Amb17307207 [0,0,1,1,0,0|1,0,1]=4 4373 B12R1.435 COC(=N)c1cccc(C=O)c1 Amb24669051 [0,0,1,1,0,0|2,0,0]=4 4374 B12R1.435 COC(=O)c1cc(C=O)ccn1 Amb22002131 [0,0,1,1,0,0|2,0,0]=4 4375 B12R1.435 COC(=O)c1cccc(C#N)c1 Amb2725334 [0,0,1,1,0,0|1,0,1]=4 4376 B12R1.435 COC(=O)c1cccc(C=O)c1 Amb3941035 [0,0,1,1,0,0|1,0,0]=3 4377 B12R1.435 COC(=O)c1cccc(C=O)n1 Amb8386292 [0,0,1,1,0,0|2,0,0]=4 4378 B12R1.435 COC(=O)c1cccc(CBr)c1 Amb1210760 [0,0,1,1,0,0|1,0,1]=4 4379 B12R1.435 COC(=O)c1cccc(CCl)c1 Amb6296206 [0,0,1,1,0,0|1,0,1]=4 4380 B12R1.435 COC(=O)c1cccc(CN)c1 Amb10976909 [0,0,1,1,0,0|1,0,1]=4 4381 B12R1.435 COC(=O)c1cccc(CN)c1 Amb2691285 [0,0,1,1,0,0|1,0,1]=4 4382 B12R1.435 COC(=O)c1cccc(CO)c1 Amb2698038 [0,0,1,1,0,0|1,0,1]=4 4383 B12R1.435 COC(=O)c1cccc(CS)c1 Amb27759098 [0,0,1,1,0,0|1,0,1]=4 4384 B12R1.435 COC(=O)c1cccc(C[NH3+])c1 Amb5722517 [0,0,1,1,0,0|1,0,1]=4 4385 B12R1.435 COC(=O)c1cccc(NN)c1 Amb22170359 [0,0,1,1,0,0|2,0,0]=4 4386 B12R1.435 COC(=O)c1cccc(NN)c1 Amb32409816 [0,0,1,1,0,0|2,0,0]=4 4387 B12R1.435 COC(=O)c1cccc(OC)c1 Amb534978 [0,0,1,1,0,0|1,0,1]=4 4388 B12R1.435 COC(=O)c1cccc(ON)c1 Amb27615432 [0,0,1,1,0,0|2,0,0]=4 4389 B12R1.435 COC(=O)c1cccc(SC)c1 Amb22261603 [0,0,1,1,0,0|1,0,1]=4 4390 B12R1.435 COC(=O)c1cccc(SCl)c1 Amb24702477 [0,0,1,1,0,0|2,0,0]=4 4391 B12R1.435 COC(=O)c1ccnc(C=O)c1 Amb21857368 [0,0,1,1,0,0|2,0,0]=4 4392 B12R1.435 COC(=O)c1cncc(C=O)c1 Amb17614600 [0,0,1,1,0,0|2,0,0]=4 4393 B12R1.435 [C-]#[N+]c1cccc(C(=O)OC)c1 Amb2689478 [0,0,1,1,0,0|1,0,1]=4 4394 B12R1.608 C=Cc1cc(C(=O)OC)c(C)o1 Amb27202167 [0,0,1,1,0,0|1,0,1]=4 4395 B12R1.608 C=Cc1cc(C(=O)OC)n(C)c1 Amb26864869 [0,0,1,1,0,0|1,0,1]=4 4396 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [1,0,0,1,0,0|1,0,1]=4 4397 B12R2.1 CCc1ccn2ccccc12 Amb27977884 [1,0,0,1,0,0|2,0,0]=4 4398 B12R2.1 CCc1coc2ccccc12 Amb27792683 [1,0,0,1,0,0|2,0,0]=4 4399 B12R2.1 CCn1ccc2ccccc21 Amb3708000 [1,0,0,1,0,0|2,0,0]=4 4400 B12R2.1 CNc1coc2ccccc12 Amb26039834 [1,0,0,1,0,0|2,0,0]=4 4401 B12R2.1 CNc1csc2ccccc12 Amb23403655 [1,0,0,1,0,0|2,0,0]=4 4402 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [1,0,0,1,0,0|0,0,1]=3 4403 B12R2.1 COc1ccn2ccccc12 Amb28282776 [1,0,0,1,0,0|1,0,0]=3 4404 B12R2.1 COc1csc2ccccc12 Amb28320302 [1,0,0,1,0,0|1,0,0]=3 4405 B12R2.1 COc1noc2ccccc12 Amb23571257 [1,0,0,1,0,0|2,0,0]=4 4406 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [1,0,0,1,0,0|1,0,0]=3 4407 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [1,0,0,1,0,0|1,0,1]=4 4408 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [1,0,0,1,0,0|1,0,1]=4 4409 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [1,0,0,1,0,0|1,0,1]=4 4410 B12R2.2 C1=CCC(c2ccccc2)=C1 Amb27484884 [1,0,0,1,0,0|1,0,0]=3 4411 B12R2.2 c1cc(-c2ccoc2)ccn1 Amb25151842 [1,0,0,1,0,0|1,0,1]=4 4412 B12R2.2 c1ccc(-c2ccco2)cc1 Amb8390025 [1,0,0,1,0,0|2,0,0]=4 4413 B12R2.2 c1ccc(-c2cccs2)cc1 Amb1215646 [1,0,0,1,0,0|2,0,0]=4 4414 B12R2.2 c1ccc(-c2ccno2)cc1 Amb2191136 [1,0,0,1,0,0|2,0,0]=4 4415 B12R2.2 c1ccc(-c2ccoc2)cc1 Amb27155517 [1,0,0,1,0,0|0,0,1]=3 4416 B12R2.2 c1ccc(-c2ccoc2)nc1 Amb27632684 [1,0,0,1,0,0|1,0,1]=4 4417 B12R2.2 c1ccc(-c2ccsc2)cc1 Amb2611643 [1,0,0,1,0,0|0,1,1]=4 4418 B12R2.2 c1ccc(-c2ccsn2)cc1 Amb24376714 [1,0,0,1,0,0|1,1,0]=4 4419 B12R2.2 c1ccc(-c2cnoc2)cc1 Amb33542838 [1,0,0,1,0,0|1,0,1]=4 4420 B12R2.2 c1ccc(-c2cnon2)cc1 Amb9791661 [1,0,0,1,0,0|2,0,0]=4 4421 B12R2.2 c1ccc(-c2cocn2)cc1 Amb17399894 [1,0,0,1,0,0|1,0,1]=4 4422 B12R2.2 c1ccc(-c2ncon2)cc1 Amb28457268 [1,0,0,1,0,0|2,0,0]=4 4423 B12R2.41 C1=CCc2ccccc2C=C1 Amb28288749 [1,0,0,1,0,0|1,0,0]=3 4424 B12R2.41 C1=CNc2ccccc2C=C1 Amb25340361 [1,0,0,1,0,0|2,0,0]=4 4425 B12R2.41 C1=Cc2ccccc2CCC1 Amb2383779 [1,0,0,1,0,0|1,0,1]=4 4426 B12R2.41 C1=Cc2ccccc2CCN1 Amb28140661 [1,0,0,1,0,0|2,0,0]=4 4427 B12R2.41 C1=Cc2ccccc2CNC1 Amb27595801 [1,0,0,1,0,0|1,0,1]=4 4428 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [1,0,0,1,0,0|2,0,0]=4 4429 B12R2.1081 CC1NC=Cc2ccccc21 Amb28424328 [1,0,0,1,0,0|2,0,0]=4 4430 B12R2.1081 CN1CC=Cc2ccccc21 Amb26960927 [1,0,0,1,0,0|1,0,1]=4 4431 B12R2.1081 C[n+]1cccc2ccccc21 Amb2602430 [1,0,0,1,0,0|1,0,0]=3 4432 B12R2.1081 C[n+]1cccc2ncccc21 Amb2610098 [1,0,0,1,0,0|2,0,0]=4 4433 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [1,0,0,1,0,0|1,0,0]=3 4434 B12R2.1081 Cc1cccc2cccnc12 Amb1229978 [1,0,0,1,0,0|2,0,0]=4 4435 B12R2.1081 Cc1cccc2ccncc12 Amb10070397 [1,0,0,1,0,0|2,0,0]=4 4436 B12R2.1081 Cc1cccc2cnccc12 Amb2447327 [1,0,0,1,0,0|2,0,0]=4 4437 B12R2.1081 Cc1cccc2ncccc12 Amb2447286 [1,0,0,1,0,0|2,0,0]=4 4438 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [1,0,0,1,0,0|2,0,0]=4 4439 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [1,0,0,1,0,0|2,0,0]=4 4440 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [1,0,0,1,0,0|2,0,0]=4 4441 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [1,0,0,1,0,0|2,0,0]=4 4442 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [1,0,0,1,0,0|2,0,0]=4 4443 B12R2.1081 N[n+]1cccc2ccccc21 Amb2613573 [1,0,0,1,0,0|2,0,0]=4 4444 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [1,0,0,1,0,0|2,0,0]=4 4445 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [1,0,0,1,0,0|2,0,0]=4 4446 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [1,0,0,1,0,0|2,0,0]=4 4447 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [1,0,0,1,0,0|2,0,0]=4 4448 B12R2.1081 [O-][n+]1cccc2ccccc21 Amb2609905 [1,0,0,1,0,0|2,0,0]=4 4449 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [1,0,0,1,0,0|2,0,0]=4 4450 B12R2.2057 C(=C\C1CO1)/c2ccccc2 Amb32954418 [1,0,0,1,0,0|0,0,1]=3 4451 B12R2.2057 C(=C\C1CO1)/c2ccncc2 Amb27818057 [1,0,0,1,0,0|1,0,1]=4 4452 B12R2.2057 C(=C\[C@@H]1CO1)/c2ccccc2 Amb33081122 [1,0,0,1,0,0|0,0,1]=3 4453 B12R2.2057 C(=C\[C@H]1CO1)/c2ccccc2 Amb33081121 [1,0,0,1,0,0|0,0,1]=3 4454 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [1,0,0,1,0,0|0,0,2]=4 4455 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [1,0,0,1,0,0|1,0,1]=4 4456 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [1,0,0,1,0,0|1,0,1]=4 4457 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [1,0,0,1,0,0|2,0,0]=4 4458 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [1,0,0,1,0,0|1,0,1]=4 4459 B12R2.24 C[n+]1ccc2ccccc2c1 Amb1147460 [1,0,0,1,0,0|2,0,0]=4 4460 B12R2.24 C[n+]1ccc2ccccc2c1 Amb2609709 [1,0,0,1,0,0|2,0,0]=4 4461 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [1,0,0,1,0,0|2,0,0]=4 4462 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [1,0,0,1,0,0|1,0,0]=3 4463 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [1,0,0,1,0,0|1,0,0]=3 4464 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [1,0,0,1,0,0|1,0,0]=3 4465 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [1,0,0,1,0,0|2,0,0]=4 4466 B12R2.24 Cc1ccc2cccnc2n1 Amb2793429 [1,0,0,1,0,0|2,0,0]=4 4467 B12R2.24 Cc1ccc2ccncc2c1 Amb33544176 [1,0,0,1,0,0|2,0,0]=4 4468 B12R2.24 Cc1ccc2ccncc2n1 Amb25305156 [1,0,0,1,0,0|2,0,0]=4 4469 B12R2.24 Cc1ccc2cnccc2c1 Amb10071945 [1,0,0,1,0,0|2,0,0]=4 4470 B12R2.24 Cc1ccc2cnccc2n1 Amb23441223 [1,0,0,1,0,0|2,0,0]=4 4471 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [1,0,0,1,0,0|2,0,0]=4 4472 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [1,0,0,1,0,0|2,0,0]=4 4473 B12R2.24 Cc1ccc2ncccc2n1 Amb15692772 [1,0,0,1,0,0|2,0,0]=4 4474 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [1,0,0,1,0,0|2,0,0]=4 4475 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [1,0,0,1,0,0|2,0,0]=4 4476 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [1,0,0,1,0,0|1,0,1]=4 4477 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [1,0,0,1,0,0|2,0,0]=4 4478 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [1,0,0,1,0,0|1,0,1]=4 4479 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [1,0,0,1,0,0|2,0,0]=4 4480 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [1,0,0,1,0,0|1,0,1]=4 4481 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [1,0,0,1,0,0|2,0,0]=4 4482 B12R2.24 NC1C=Cc2ccccc2C1 Amb17470378 [1,0,0,1,0,0|1,0,1]=4 4483 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [1,0,0,1,0,0|1,0,1]=4 4484 B12R2.24 N[C@H]1C=Cc2ccccc2C1 Amb27779859 [1,0,0,1,0,0|1,0,1]=4 4485 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [1,0,0,1,0,0|1,0,1]=4 4486 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [1,0,0,1,0,0|1,0,1]=4 4487 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [1,0,0,1,0,0|2,0,0]=4 4488 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [1,0,0,1,0,0|1,0,1]=4 4489 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [1,0,0,1,0,0|1,0,0]=3 4490 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [1,0,0,1,0,0|0,0,0]=2 4491 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [1,0,0,1,0,0|1,0,0]=3 4492 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [1,0,0,1,0,0|1,0,0]=3 4493 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [1,0,0,1,0,0|2,0,0]=4 4494 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [1,0,0,1,0,0|2,0,0]=4 4495 B12R2.24 O=C1C=Cc2ccncc2O1 Amb24395883 [1,0,0,1,0,0|1,0,0]=3 4496 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [1,0,0,1,0,0|2,0,0]=4 4497 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [1,0,0,1,0,0|2,0,0]=4 4498 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [1,0,0,1,0,0|2,0,0]=4 4499 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [1,0,0,1,0,0|0,0,2]=4 4500 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [1,0,0,1,0,0|0,0,2]=4 4501 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [1,0,0,1,0,0|1,0,1]=4 4502 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [1,0,0,1,0,0|1,0,1]=4 4503 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [1,0,0,1,0,0|1,0,1]=4 4504 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [1,0,0,1,0,0|1,0,1]=4 4505 B12R2.24 O=C1CSc2ccccc2C1 Amb22231635 [1,0,0,1,0,0|1,0,1]=4 4506 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [1,0,0,1,0,0|1,0,1]=4 4507 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [1,0,0,1,0,0|1,0,1]=4 4508 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [1,0,0,1,0,0|2,0,0]=4 4509 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [1,0,0,1,0,0|1,0,0]=3 4510 B12R2.24 O=C1NCc2ccccc2O1 Amb27468708 [1,0,0,1,0,0|1,0,1]=4 4511 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [1,0,0,1,0,0|1,0,1]=4 4512 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [1,0,0,1,0,0|1,0,1]=4 4513 B12R2.24 OC1=CC=C2C=CC=CN2C1 Amb17835334 [1,0,0,1,0,0|1,0,1]=4 4514 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [1,0,0,1,0,0|0,1,1]=4 4515 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [1,0,0,1,0,0|2,0,0]=4 4516 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [1,0,0,1,0,0|2,0,0]=4 4517 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [1,0,0,1,0,0|1,0,0]=3 4518 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [1,0,0,1,0,0|2,0,0]=4 4519 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [1,0,0,1,0,0|2,0,0]=4 4520 B12R2.24 Oc1ccc2cccnc2n1 Amb9806398 [1,0,0,1,0,0|2,0,0]=4 4521 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [1,0,0,1,0,0|2,0,0]=4 4522 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [1,0,0,1,0,0|2,0,0]=4 4523 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [1,0,0,1,0,0|2,0,0]=4 4524 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [1,0,0,1,0,0|2,0,0]=4 4525 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [1,0,0,1,0,0|2,0,0]=4 4526 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [1,0,0,1,0,0|2,0,0]=4 4527 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [1,0,0,1,0,0|2,0,0]=4 4528 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [1,0,0,1,0,0|1,1,0]=4 4529 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [1,0,0,1,0,0|0,1,1]=4 4530 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [1,0,0,1,0,0|1,1,0]=4 4531 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [1,0,0,1,0,0|1,0,1]=4 4532 B12R2.2403 CC1(C)C=Cc2ccccc21 Amb17844051 [1,0,0,1,0,0|1,0,1]=4 4533 B12R2.2403 O=S1(=O)C=Cc2ccccc21 Amb6356379 [1,0,0,1,0,0|1,0,1]=4 4534 B12R2.3190 CC(=O)C1Cc2ccccc21 Amb28066759 [1,0,0,1,0,0|0,0,2]=4 4535 B12R2.3190 CC(=O)N1Cc2ccccc21 Amb25148191 [1,0,0,1,0,0|1,0,1]=4 4536 B12R2.3190 O=C(Cl)C1=C2C=CC=CC2=C1 Amb25779648 [1,0,0,1,0,0|1,0,0]=3 4537 B12R2.3190 O=C(O)C1=Cc2ccccc21 Amb17593654 [1,0,0,1,0,0|0,0,0]=2 4538 B12R2.3190 O=C(O)C1Cc2ccccc21 Amb4017188 [1,0,0,1,0,0|0,0,2]=4 4539 B12R2.6 O=C1C=C(c2ccco2)CC1 Amb17138420 [0,0,0,1,1,0|2,0,0]=4 4540 B12R2.6 O=C1C=C(c2ccco2)CO1 Amb27879956 [0,0,0,1,1,0|1,0,0]=3 4541 B12R2.6 O=C1C=C(c2cccs2)CC1 Amb17138573 [0,0,0,1,1,0|2,0,0]=4 4542 B12R2.6 O=C1C=C(c2ccoc2)CC1 Amb27394356 [0,0,0,1,1,0|2,0,0]=4 4543 B12R2.6 O=C1C=C(c2ccsc2)CN1 Amb28204093 [0,0,0,1,1,0|2,0,0]=4 4544 B12R2.44 COc1ccc2c(c1)C=CC2 Amb2383764 [0,0,0,1,1,0|1,0,1]=4 4545 B12R2.44 COc1ccc2c(c1)CC=C2 Amb21857137 [0,0,0,1,1,0|1,0,1]=4 4546 B12R2.44 COc1ccc2ccoc2c1 Amb21962786 [0,0,0,1,1,0|2,0,0]=4 4547 B12R2.44 COc1ccc2ccsc2c1 Amb22001743 [0,0,0,1,1,0|2,0,0]=4 4548 B12R2.44 COc1ccc2ccsc2n1 Amb25335420 [0,0,0,1,1,0|2,0,0]=4 4549 B12R2.44 COc1ccc2occc2c1 Amb2689090 [0,0,0,1,1,0|2,0,0]=4 4550 B12R2.44 COc1ccc2sccc2c1 Amb8439416 [0,0,0,1,1,0|2,0,0]=4 4551 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,0,0,1,1,0|1,0,1]=4 4552 B12R2.18 CC1C(=O)Nc2ccccc21 Amb2612193 [0,0,0,1,1,0|2,0,0]=4 4553 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,0,0,1,1,0|2,0,0]=4 4554 B12R2.18 CN1C(=O)Cc2ccccc21 Amb1398903 [0,0,0,1,1,0|1,0,1]=4 4555 B12R2.18 CN1C(=O)Nc2ccccc21 Amb18537193 [0,0,0,1,1,0|2,0,0]=4 4556 B12R2.18 CN1C(=O)Oc2ccccc21 Amb18043105 [0,0,0,1,1,0|2,0,0]=4 4557 B12R2.18 CN1C(=O)Sc2ccccc21 Amb19654015 [0,0,0,1,1,0|2,0,0]=4 4558 B12R2.18 Cc1cc2ccccc2n1C Amb1934988 [0,0,0,1,1,0|2,0,0]=4 4559 B12R2.18 Cn1c(Br)cc2ccccc21 Amb22232574 [0,0,0,1,1,0|2,0,0]=4 4560 B12R2.18 Cn1c(Cl)cc2ccccc21 Amb26587274 [0,0,0,1,1,0|2,0,0]=4 4561 B12R2.18 Cn1c(F)cc2ccccc21 Amb27882722 [0,0,0,1,1,0|2,0,0]=4 4562 B12R2.18 Cn1c(I)cc2ccccc21 Amb24067548 [0,0,0,1,1,0|2,0,0]=4 4563 B12R2.18 Cn1c(N)cc2ccccc21 Amb18644284 [0,0,0,1,1,0|2,0,0]=4 4564 B12R2.18 Cn1c(N)cc2ccccc21 Amb19944548 [0,0,0,1,1,0|2,0,0]=4 4565 B12R2.18 Cn1c(O)cc2ccccc21 Amb3427957 [0,0,0,1,1,0|1,0,1]=4 4566 B12R2.18 Cn1c(S)cc2ccccc21 Amb26845572 [0,0,0,1,1,0|1,1,0]=4 4567 B12R2.32 CCC1=Cc2ccccc2C1 Amb6357923 [0,0,0,1,1,0|2,0,0]=4 4568 B12R2.32 CCc1cc2ccccc2o1 Amb6608886 [0,0,0,1,1,0|1,0,1]=4 4569 B12R2.32 CNc1cc2ccccc2s1 Amb27428924 [0,0,0,1,1,0|1,1,0]=4 4570 B12R2.32 COc1cc2ccccc2o1 Amb27962930 [0,0,0,1,1,0|0,0,1]=3 4571 B12R2.37 CC1=C(c2ccccc2)N1C Amb27602376 [0,0,0,1,1,0|2,0,0]=4 4572 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [0,0,0,1,1,0|1,0,1]=4 4573 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,0,0,1,1,0|1,0,0]=3 4574 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,0,0,1,1,0|2,0,0]=4 4575 B14R2.8 CCc1cnc(-c2ccccc2)s1 Amb24471037 [0,0,0,1,0,1|1,1,0]=4 4576 B14R2.8 CCc1nc(-c2ccccc2)cs1 Amb27879316 [0,0,0,1,0,1|2,0,0]=4 4577 B14R2.8 CNc1ccn(-c2ccccc2)n1 Amb28119015 [0,0,0,1,0,1|2,0,0]=4 4578 B14R2.8 CNc1nc(-c2ccccc2)co1 Amb22301262 [0,0,0,1,0,1|2,0,0]=4 4579 B14R2.8 CNc1nc(-c2ccccc2)cs1 Amb2444640 [0,0,0,1,0,1|2,0,0]=4 4580 B14R2.8 CNc1ncc(-c2ccccc2)o1 Amb23412493 [0,0,0,1,0,1|1,0,1]=4 4581 B14R2.8 CNc1ncc(-c2ccccc2)s1 Amb33540592 [0,0,0,1,0,1|1,1,0]=4 4582 B14R2.8 COc1cc(-c2ccccc2)no1 Amb10553853 [0,0,0,1,0,1|2,0,0]=4 4583 B14R2.8 COc1ccn(-c2cccnc2)n1 Amb32657031 [0,0,0,1,0,1|2,0,0]=4 4584 B14R2.8 COc1ccn(-c2ccncc2)n1 Amb32657028 [0,0,0,1,0,1|2,0,0]=4 4585 B14R2.19 CC1=CCC(Cc2ccccc2)=C1 Amb27398578 [0,0,0,1,0,1|2,0,0]=4 4586 B14R2.19 Nc1cc(Cc2ccccc2)no1 Amb17233004 [0,0,0,1,0,1|2,0,0]=4 4587 B14R2.19 O=C1C=C(Cc2ccccc2)CC1 Amb25900544 [0,0,0,1,0,1|1,0,0]=3 4588 B14R2.19 O=C1C=C(Cc2ccccc2)NN1 Amb25299854 [0,0,0,1,0,1|2,0,0]=4 4589 B14R2.19 O=C1C=C(Cc2ccccn2)CC1 Amb27791684 [0,0,0,1,0,1|2,0,0]=4 4590 B14R2.19 O=C1C=C(Nc2ccccc2)CC1 Amb3499135 [0,0,0,1,0,1|1,0,0]=3 4591 B14R2.19 O=C1C=C(Nc2ccccc2)CN1 Amb4314408 [0,0,0,1,0,1|1,0,0]=3 4592 B14R2.19 O=C1C=C(Nc2ccccc2)NN1 Amb22049648 [0,0,0,1,0,1|2,0,0]=4 4593 B14R2.19 O=C1C=C(Nc2ccccc2)OC1 Amb27876324 [0,0,0,1,0,1|2,0,0]=4 4594 B14R2.19 O=C1C=C(Sc2ccccc2)CO1 Amb21928058 [0,0,0,1,0,1|0,0,0]=2 4595 B14R2.19 O=C1C=C(Sc2ccccn2)CC1 Amb9833232 [0,0,0,1,0,1|2,0,0]=4 4596 B14R2.19 O=C1C=C\C(=C/c2ccccc2)N1 Amb27423284 [0,0,0,1,0,1|1,0,1]=4 4597 B14R2.19 O=C1C=C\C(=C/c2ccccc2)O1 Amb28242947 [0,0,0,1,0,1|1,0,1]=4 4598 B14R2.19 O=C1CC(Cc2ccccc2)=NO1 Amb1099037 [0,0,0,1,0,1|1,0,1]=4 4599 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,1,0,1|0,0,2]=4 4600 B14R2.19 O=C1CC(Nc2ccccc2)CO1 Amb27415556 [0,0,0,1,0,1|0,0,2]=4 4601 B14R2.19 O=C1CC\[N+](=C/c2ccccc2)[N-]1 Amb2423893 [0,0,0,1,0,1|2,0,0]=4 4602 B14R2.19 O=C1CN(Cc2ccccc2)CO1 Amb27861590 [0,0,0,1,0,1|0,0,2]=4 4603 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,1,0,1|0,0,2]=4 4604 B14R2.19 O=C1NC(Oc2ccccc2)=NO1 Amb27815250 [0,0,0,1,0,1|2,0,0]=4 4605 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,1,0,1|0,0,2]=4 4606 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,1,0,1|0,0,2]=4 4607 B14R2.19 O=C1N\C(=C/c2ccccc2)CO1 Amb27815226 [0,0,0,1,0,1|0,0,0]=2 4608 B14R2.19 O=C1N\C(=C\c2ccccc2)CO1 Amb27981988 [0,0,0,1,0,1|0,0,0]=2 4609 B14R2.19 O=C1N\C(=N/c2ccccc2)CS1 Amb2961402 [0,0,0,1,0,1|1,1,0]=4 4610 B14R2.19 OC1C\C(=C\c2ccccc2)CO1 Amb22522086 [0,0,0,1,0,1|0,0,2]=4 4611 B14R2.19 Oc1cc(Cc2ccccc2)no1 Amb20672899 [0,0,0,1,0,1|1,0,1]=4 4612 B14R2.19 S=C1C=C(Nc2ccccc2)CC1 Amb27771930 [0,0,0,1,0,1|1,1,0]=4 4613 B14R2.68 NC1=NC=C(c2ccccc2)CN1 Amb28385669 [0,0,0,1,0,1|2,0,0]=4 4614 B14R2.68 O=C1C=CC(c2ccccc2)=CO1 Amb28319529 [0,0,0,1,0,1|0,0,1]=3 4615 B14R2.68 O=C1C=CC(c2ccccc2)=NN1 Amb19514521 [0,0,0,1,0,1|2,0,0]=4 4616 B14R2.68 O=C1C=CC(c2ccccc2)CC1 Amb28131957 [0,0,0,1,0,1|1,0,0]=3 4617 B14R2.68 O=C1C=CC(c2ccccc2)OC1 Amb27587340 [0,0,0,1,0,1|2,0,0]=4 4618 B14R2.68 O=C1C=C[C@@H](c2ccccc2)CC1 Amb27772525 [0,0,0,1,0,1|1,0,0]=3 4619 B14R2.68 O=C1C=NC(c2ccccc2)=CN1 Amb20669858 [0,0,0,1,0,1|1,0,1]=4 4620 B14R2.68 O=C1C=NC(c2ccccc2)=NN1 Amb24183960 [0,0,0,1,0,1|2,0,0]=4 4621 B14R2.68 O=C1CC=C(c2ccccc2)CC1 Amb34104182 [0,0,0,1,0,1|1,0,0]=3 4622 B14R2.68 O=C1CC=C(c2ccccc2)OC1 Amb27599462 [0,0,0,1,0,1|2,0,0]=4 4623 B14R2.68 O=C1CCC(c2ccccc2)=NN1 Amb1017246 [0,0,0,1,0,1|2,0,0]=4 4624 B14R2.68 O=C1CCC(c2ccccc2)CO1 Amb28122923 [0,0,0,1,0,1|0,0,2]=4 4625 B14R2.68 O=C1CNC(c2ccccc2)=NO1 Amb28398006 [0,0,0,1,0,1|1,0,1]=4 4626 B14R2.68 O=C1CN[C@@H](c2ccccc2)CO1 Amb24052958 [0,0,0,1,0,1|0,0,2]=4 4627 B14R2.68 O=C1CN[C@@H](c2ccccc2)CO1 Amb8629097 [0,0,0,1,0,1|0,0,2]=4 4628 B14R2.68 O=C1CN[C@H](c2ccccc2)CO1 Amb22748846 [0,0,0,1,0,1|0,0,2]=4 4629 B14R2.68 O=C1CN[C@H](c2ccccc2)CO1 Amb8629096 [0,0,0,1,0,1|0,0,2]=4 4630 B14R2.68 O=C1CSC(c2ccccc2)CO1 Amb28289733 [0,0,0,1,0,1|0,0,2]=4 4631 B14R2.68 O=C1N=CC(c2ccccc2)=CN1 Amb18540687 [0,0,0,1,0,1|1,0,1]=4 4632 B14R2.68 O=C1N=CC(c2ccccc2)=C[NH2+]1 Amb17843327 [0,0,0,1,0,1|1,0,1]=4 4633 B14R2.68 O=C1N=CC(c2ccccc2)=NN1 Amb26637991 [0,0,0,1,0,1|2,0,0]=4 4634 B14R2.68 O=C1NCC(c2ccccc2)=NN1 Amb578338 [0,0,0,1,0,1|2,0,0]=4 4635 B14R2.68 O=C1NCC(c2ccccc2)CO1 Amb28208260 [0,0,0,1,0,1|0,0,2]=4 4636 B14R2.68 O=C1NN=C(c2ccccc2)CO1 Amb24715861 [0,0,0,1,0,1|1,0,0]=3 4637 B14R2.68 O=C1NN=C(c2ccccc2)CS1 Amb28129439 [0,0,0,1,0,1|1,1,0]=4 4638 B14R2.95 C#CC(=O)c1coc2ccccc12 Amb27471604 [0,0,0,1,0,1|1,0,1]=4 4639 B14R2.95 C#CC(=O)c1csc2ccccc12 Amb27447124 [0,0,0,1,0,1|1,0,1]=4 4640 B14R2.95 C=CC(=O)c1coc2ccccc12 Amb25842127 [0,0,0,1,0,1|1,0,1]=4 4641 B14R2.95 C=CC(=O)c1csc2ccccc12 Amb25825739 [0,0,0,1,0,1|1,0,1]=4 4642 B14R2.95 CCC(=O)c1coc2ccccc12 Amb25086526 [0,0,0,1,0,1|1,0,0]=3 4643 B14R2.95 CCC(=O)c1csc2ccccc12 Amb9212755 [0,0,0,1,0,1|1,0,0]=3 4644 B14R2.95 CCC(=O)c1ncc2ccccn12 Amb27448758 [0,0,0,1,0,1|2,0,0]=4 4645 B14R2.95 CCC(=O)c1ncn2ccccc12 Amb25079202 [0,0,0,1,0,1|2,0,0]=4 4646 B14R2.95 CCC(=O)n1cnc2ccccc21 Amb1205539 [0,0,0,1,0,1|2,0,0]=4 4647 B14R2.95 CNC(=O)c1csc2ccccc12 Amb8337784 [0,0,0,1,0,1|1,0,0]=3 4648 B14R2.95 CNC(=O)c1noc2ccccc12 Amb27614300 [0,0,0,1,0,1|2,0,0]=4 4649 B14R2.95 CNC(=O)c1nsc2ccccc12 Amb27446673 [0,0,0,1,0,1|2,0,0]=4 4650 B14R2.95 CNC(=O)c1snc2ccccc12 Amb27654260 [0,0,0,1,0,1|2,0,0]=4 4651 B14R2.95 CNC(=O)n1cnc2ccccc21 Amb24310272 [0,0,0,1,0,1|2,0,0]=4 4652 B14R2.95 COC(=N)c1csc2ccccc12 Amb19073373 [0,0,0,1,0,1|1,0,0]=3 4653 B14R2.95 COC(=N)c1ncn2ccccc12 Amb23560046 [0,0,0,1,0,1|2,0,0]=4 4654 B14R2.95 COC(=N)c1occ2ccccc12 Amb27490928 [0,0,0,1,0,1|1,0,0]=3 4655 B14R2.95 COC(=O)C1=CCc2ccccc21 Amb2691225 [0,0,0,1,0,1|0,0,0]=2 4656 B14R2.95 COC(=O)C1C=Cc2ccncc21 Amb27165289 [0,0,0,1,0,1|1,0,0]=3 4657 B14R2.95 COC(=O)C1CCc2ccccc21 Amb10563171 [0,0,0,1,0,1|0,0,2]=4 4658 B14R2.95 COC(=O)C1CNc2ccccc21 Amb19320764 [0,0,0,1,0,1|0,0,2]=4 4659 B14R2.95 COC(=O)C1CNc2ccccc21 Amb22234034 [0,0,0,1,0,1|0,0,2]=4 4660 B14R2.95 COC(=O)C1COc2ccccc21 Amb22059417 [0,0,0,1,0,1|0,0,2]=4 4661 B14R2.95 COC(=O)C1CSc2ccccc21 Amb24489808 [0,0,0,1,0,1|0,0,2]=4 4662 B14R2.95 COC(=O)N1CCc2ccccc21 Amb6317361 [0,0,0,1,0,1|0,0,2]=4 4663 B14R2.95 COC(=O)[C@H]1CNc2ccccc21 Amb28140145 [0,0,0,1,0,1|0,0,2]=4 4664 B14R2.95 COC(=O)c1ccn2ccccc12 Amb20241327 [0,0,0,1,0,1|1,0,0]=3 4665 B14R2.95 COC(=O)c1cnc2cnccn12 Amb23401669 [0,0,0,1,0,1|2,0,0]=4 4666 B14R2.95 COC(=O)c1cnn2ccccc12 Amb10067849 [0,0,0,1,0,1|1,0,0]=3 4667 B14R2.95 COC(=O)c1cnn2cccnc12 Amb1043860 [0,0,0,1,0,1|2,0,0]=4 4668 B14R2.95 COC(=O)c1cnn2ccncc12 Amb27151714 [0,0,0,1,0,1|2,0,0]=4 4669 B14R2.95 COC(=O)c1cnn2ncccc12 Amb24659222 [0,0,0,1,0,1|2,0,0]=4 4670 B14R2.95 COC(=O)c1coc2ccccc12 Amb22269388 [0,0,0,1,0,1|0,0,0]=2 4671 B14R2.95 COC(=O)c1coc2cccnc12 Amb25972263 [0,0,0,1,0,1|1,0,0]=3 4672 B14R2.95 COC(=O)c1coc2ccncc12 Amb26845446 [0,0,0,1,0,1|1,0,0]=3 4673 B14R2.95 COC(=O)c1coc2cnccc12 Amb25714999 [0,0,0,1,0,1|1,0,0]=3 4674 B14R2.95 COC(=O)c1coc2ncccc12 Amb28383191 [0,0,0,1,0,1|1,0,0]=3 4675 B14R2.95 COC(=O)c1csc2ccccc12 Amb18330285 [0,0,0,1,0,1|0,0,0]=2 4676 B14R2.95 COC(=O)c1csc2cccnc12 Amb8383327 [0,0,0,1,0,1|1,0,0]=3 4677 B14R2.95 COC(=O)c1csc2cnccc12 Amb24066969 [0,0,0,1,0,1|1,0,0]=3 4678 B14R2.95 COC(=O)c1ncc2ccccn12 Amb27172268 [0,0,0,1,0,1|1,0,0]=3 4679 B14R2.95 COC(=O)c1ncc2cnccn12 Amb25157008 [0,0,0,1,0,1|2,0,0]=4 4680 B14R2.95 COC(=O)c1ncn2ccccc12 Amb26647760 [0,0,0,1,0,1|1,0,0]=3 4681 B14R2.95 COC(=O)c1ncn2ncccc12 Amb25192712 [0,0,0,1,0,1|2,0,0]=4 4682 B14R2.95 COC(=O)c1nnc2ccccn12 Amb23449896 [0,0,0,1,0,1|2,0,0]=4 4683 B14R2.95 COC(=O)c1nnn2ccccc12 Amb25142185 [0,0,0,1,0,1|2,0,0]=4 4684 B14R2.95 COC(=O)c1noc2ccccc12 Amb23437527 [0,0,0,1,0,1|1,0,0]=3 4685 B14R2.95 COC(=O)c1nsc2ncccc12 Amb27944687 [0,0,0,1,0,1|2,0,0]=4 4686 B14R2.95 COC(=O)c1scc2nccnc12 Amb27252546 [0,0,0,1,0,1|2,0,0]=4 4687 B14R2.95 COC(=O)c1snc2ccccc12 Amb27851664 [0,0,0,1,0,1|1,0,0]=3 4688 B14R2.95 COS(=O)c1csc2ccccc12 Amb28198930 [0,0,0,1,0,1|1,0,0]=3 4689 B14R2.95 NCC(=O)c1coc2ccccc12 Amb18197463 [0,0,0,1,0,1|2,0,0]=4 4690 B14R2.95 NCC(=O)c1csc2ccccc12 Amb18910163 [0,0,0,1,0,1|2,0,0]=4 4691 B14R2.95 NCC(=O)n1ccc2ccccc21 Amb28385549 [0,0,0,1,0,1|2,0,0]=4 4692 B14R2.95 NNC(=O)C1=CCc2ccccc21 Amb27867874 [0,0,0,1,0,1|2,0,0]=4 4693 B14R2.95 NNC(=O)c1csc2ccccc12 Amb6497059 [0,0,0,1,0,1|2,0,0]=4 4694 B14R2.95 NNC(=O)c1occ2ccccc12 Amb27202749 [0,0,0,1,0,1|2,0,0]=4 4695 B14R2.95 O=C(CBr)c1coc2ccccc12 Amb2723422 [0,0,0,1,0,1|2,0,0]=4 4696 B14R2.95 O=C(CBr)c1csc2ccccc12 Amb2723181 [0,0,0,1,0,1|2,0,0]=4 4697 B14R2.95 O=C(CCl)c1coc2ccccc12 Amb25362239 [0,0,0,1,0,1|2,0,0]=4 4698 B14R2.95 O=C(CCl)c1csc2ccccc12 Amb33532135 [0,0,0,1,0,1|2,0,0]=4 4699 B14R2.95 O=C(CCl)n1ccc2ccccc21 Amb25257982 [0,0,0,1,0,1|2,0,0]=4 4700 B14R2.95 O=C(CO)c1coc2ccccc12 Amb18808835 [0,0,0,1,0,1|2,0,0]=4 4701 B14R2.95 O=C(CO)c1csc2ccccc12 Amb28139796 [0,0,0,1,0,1|2,0,0]=4 4702 B14R2.95 O=C(CO)c1occ2ccccc12 Amb27603862 [0,0,0,1,0,1|2,0,0]=4 4703 B14R2.95 O=CC(=O)C1C=Cc2ccccc21 Amb27842130 [0,0,0,1,0,1|2,0,0]=4 4704 B14R2.95 O=CC(=O)c1coc2ccccc12 Amb27445832 [0,0,0,1,0,1|2,0,0]=4 4705 B14R2.280 O=C1C=Cc2ccccc2C=CN1 Amb6359616 [0,0,0,1,0,1|1,0,1]=4 4706 B14R2.958 COC(=O)C1CC1c2ccccc2 Amb6740592 [0,0,0,1,0,1|0,0,2]=4 4707 B14R2.958 COC(=O)C1N=C1c2ccccc2 Amb22325239 [0,0,0,1,0,1|0,0,1]=3 4708 B14R2.958 COC(=O)C1NC1c2ccccc2 Amb33624814 [0,0,0,1,0,1|0,0,2]=4 4709 B14R2.958 COC(=O)C1OC1c2ccccc2 Amb3940627 [0,0,0,1,0,1|0,0,2]=4 4710 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,0,0,1,0,1|0,0,2]=4 4711 B14R2.958 COC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27626014 [0,0,0,1,0,1|0,0,2]=4 4712 B14R2.958 COC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25961866 [0,0,0,1,0,1|0,0,2]=4 4713 B14R2.958 COC(=O)[C@H]1O[C@H]1c2ccccc2 Amb26612812 [0,0,0,1,0,1|0,0,2]=4 4714 B14R2.4514 CC1=C(c2ccccc2)CNC1=O Amb27625681 [0,0,0,1,0,1|1,0,1]=4 4715 B14R2.4514 CC1C(=O)C=CN1c2ccccc2 Amb27972975 [0,0,0,1,0,1|1,0,0]=3 4716 B14R2.4514 CN1C(=N)SC=C1c2ccccc2 Amb19203330 [0,0,0,1,0,1|2,0,0]=4 4717 B14R2.4514 CN1C(=O)C=CN1c2ccccc2 Amb19767333 [0,0,0,1,0,1|1,0,0]=3 4718 B14R2.4514 CN1C(=O)NC=C1c2ccccc2 Amb26619647 [0,0,0,1,0,1|1,0,0]=3 4719 B14R2.4514 CN1C(=O)NN=C1c2ccccc2 Amb25898165 [0,0,0,1,0,1|2,0,0]=4 4720 B14R2.4514 CN1C(=O)ON=C1c2ccccc2 Amb27599244 [0,0,0,1,0,1|2,0,0]=4 4721 B14R2.4514 CN1C(=S)NC=C1c2ccccc2 Amb21937135 [0,0,0,1,0,1|1,1,0]=4 4722 B14R2.4514 CN1C(=S)SC=C1c2ccccc2 Amb22730579 [0,0,0,1,0,1|1,1,0]=4 4723 B14R2.4514 C[C@@H]1C(=O)C=C[C@H]1c2ccccc2 Amb28054304 [0,0,0,1,0,1|1,0,0]=3 4724 B14R2.4514 Cc1ccc(-c2ccccc2)n1C Amb17232815 [0,0,0,1,0,1|2,0,0]=4 4725 B14R2.4514 Cc1ncc(-c2ccccc2)n1C Amb27207079 [0,0,0,1,0,1|2,0,0]=4 4726 B14R2.4514 Cn1c(-c2ccccc2)cnc1Cl Amb32409751 [0,0,0,1,0,1|2,0,0]=4 4727 B14R2.4514 Cn1c(-c2ccccc2)cnc1N Amb2236688 [0,0,0,1,0,1|2,0,0]=4 4728 B14R2.4514 Cn1c(-c2ccccc2)cnc1S Amb6320325 [0,0,0,1,0,1|1,1,0]=4 4729 B14R2.4514 Cn1c(Br)ccc1-c2ccccc2 Amb27638886 [0,0,0,1,0,1|2,0,0]=4 4730 B14R2.4514 Cn1c(Br)cnc1-c2ccccc2 Amb22900007 [0,0,0,1,0,1|2,0,0]=4 4731 B14R2.4514 Cn1c(Cl)cnc1-c2ccccc2 Amb2422867 [0,0,0,1,0,1|2,0,0]=4 4732 B14R2.4514 Cn1c(F)cnc1-c2ccccc2 Amb28239981 [0,0,0,1,0,1|2,0,0]=4 4733 B14R2.4514 Cn1c(I)cnc1-c2ccccc2 Amb22900008 [0,0,0,1,0,1|2,0,0]=4 4734 B14R2.4514 O=C1C=CN(c2ccccc2)C1=O Amb28201128 [0,0,0,1,0,1|2,0,0]=4 4735 B14R2.5672 O=C1C=CC2=CC=CC=C(C=C1)C2 Amb28074679 [0,0,0,1,0,1|1,0,1]=4 4736 B14R2.5709 O=C1C=CC2=C(C=C1)OC=CC=C2 Amb28054448 [0,0,0,1,0,1|1,0,1]=4 4737 B14R2.21 NC1=CC(c2ccccc2)=CCN1 Amb28118874 [0,1,0,1,0,0|2,0,0]=4 4738 B14R2.21 O=C1C=C(c2ccccc2)C=CO1 Amb27480961 [0,1,0,1,0,0|0,0,1]=3 4739 B14R2.21 O=C1C=C(c2ccccc2)C=NN1 Amb25859226 [0,1,0,1,0,0|1,0,1]=4 4740 B14R2.21 O=C1C=C(c2ccccc2)CCC1 Amb2613651 [0,1,0,1,0,0|1,0,0]=3 4741 B14R2.21 O=C1C=C(c2ccccc2)N=CN1 Amb18001789 [0,1,0,1,0,0|1,0,1]=4 4742 B14R2.21 O=C1C=C(c2ccccc2)OCC1 Amb22750040 [0,1,0,1,0,0|1,0,0]=3 4743 B14R2.21 O=C1C=C(c2cccnc2)CCC1 Amb27837073 [0,1,0,1,0,0|2,0,0]=4 4744 B14R2.21 O=C1C=COC(c2ccccc2)=C1 Amb22750060 [0,1,0,1,0,0|1,0,1]=4 4745 B14R2.21 O=C1CC(c2ccccc2)CCO1 Amb22499444 [0,1,0,1,0,0|0,0,2]=4 4746 B14R2.21 O=C1COCC(c2ccccc2)C1 Amb28381209 [0,1,0,1,0,0|0,0,2]=4 4747 B14R2.21 O=C1COCC(c2ccccc2)N1 Amb21864800 [0,1,0,1,0,0|1,0,1]=4 4748 B14R2.21 O=C1COC[C@@H](c2ccccc2)N1 Amb24654701 [0,1,0,1,0,0|1,0,1]=4 4749 B14R2.21 O=C1COC[C@H](c2ccccc2)N1 Amb24181880 [0,1,0,1,0,0|1,0,1]=4 4750 B14R2.21 O=C1C[C@@H](c2ccccc2)CCO1 Amb27187321 [0,1,0,1,0,0|0,0,2]=4 4751 B14R2.21 O=C1NC(c2ccccc2)CCO1 Amb27481645 [0,1,0,1,0,0|1,0,1]=4 4752 B14R2.21 O=C1NN(c2ccccc2)CCO1 Amb27826339 [0,1,0,1,0,0|2,0,0]=4 4753 B14R2.52 CC1=CC(=O)c2ccccc2CC1 Amb27409481 [0,1,0,1,0,0|2,0,0]=4 4754 B14R2.52 O=C1CCc2ccccc2C(=O)N1 Amb17470514 [0,1,0,1,0,0|2,0,0]=4 4755 B14R2.52 O=C1CCc2ccccc2C(=O)O1 Amb17470546 [0,1,0,1,0,0|2,0,0]=4 4756 B14R2.52 O=C1NCc2ccccc2C(=O)O1 Amb28130439 [0,1,0,1,0,0|2,0,0]=4 4757 B14R2.260 CC1CC(c2ccccc2)=CC1=O Amb28240634 [0,1,0,1,0,0|1,0,0]=3 4758 B14R2.260 CC1N=C(c2ccccc2)OC1=O Amb2689618 [0,1,0,1,0,0|2,0,0]=4 4759 B14R2.260 CN1C=C(c2ccccc2)SC1=O Amb28183097 [0,1,0,1,0,0|2,0,0]=4 4760 B14R2.260 CN1N=C(c2ccccc2)CC1=O Amb17712376 [0,1,0,1,0,0|1,0,1]=4 4761 B14R2.260 CN1NC(c2ccccc2)=CC1=O Amb19769388 [0,1,0,1,0,0|1,0,0]=3 4762 B14R2.260 CN1OC(c2ccccc2)=NC1=O Amb28182733 [0,1,0,1,0,0|2,0,0]=4 4763 B14R2.260 Cc1cc(-c2ccccc2)cn1C Amb17666668 [0,1,0,1,0,0|2,0,0]=4 4764 B14R2.260 Cc1cc(-c2ccccc2)nn1C Amb26592408 [0,1,0,1,0,0|2,0,0]=4 4765 B14R2.260 Cc1sc(-c2ccccc2)cc1I Amb8447438 [0,1,0,1,0,0|2,0,0]=4 4766 B14R2.260 Cn1nc(-c2ccccc2)cc1Br Amb22301186 [0,1,0,1,0,0|2,0,0]=4 4767 B14R2.260 Cn1nc(-c2ccccc2)cc1Cl Amb22453272 [0,1,0,1,0,0|2,0,0]=4 4768 B14R2.260 Cn1nc(-c2ccccc2)cc1N Amb2684469 [0,1,0,1,0,0|2,0,0]=4 4769 B14R2.260 Cn1nc(-c2ccccc2)cc1O Amb2608456 [0,1,0,1,0,0|1,0,1]=4 4770 B14R2.260 Cn1nc(-c2ccccc2)cc1S Amb19073087 [0,1,0,1,0,0|1,1,0]=4 4771 B14R2.260 O=C1C=C(c2ccccc2)OC1=O Amb9685644 [0,1,0,1,0,0|2,0,0]=4 4772 B14R2.335 O=C1CCN1C(=O)c2ccccc2 Amb25855874 [0,1,0,1,0,0|2,0,0]=4 4773 B14R2.335 O=C1NCC1C(=O)c2ccccc2 Amb27206601 [0,1,0,1,0,0|1,0,1]=4 4774 B14R2.794 O=C(C=C1CCC1)c2ccccc2 Amb28351430 [0,1,0,1,0,0|2,0,0]=4 4775 B14R2.1019 CCC1=CC(=O)c2ccccc2O1 Amb18048528 [0,1,0,1,0,0|1,0,1]=4 4776 B14R2.1019 CCC1=CC(=S)c2ccccc2N1 Amb28041388 [0,1,0,1,0,0|2,0,0]=4 4777 B14R2.1019 CCc1cc(Br)c2ccccc2n1 Amb28051574 [0,1,0,1,0,0|2,0,0]=4 4778 B14R2.1019 CCc1cc(C)c2ccccc2n1 Amb27175355 [0,1,0,1,0,0|2,0,0]=4 4779 B14R2.1019 CCc1cc(Cl)c2ccccc2n1 Amb9533775 [0,1,0,1,0,0|2,0,0]=4 4780 B14R2.1019 CCc1cc(N)c2ccccc2c1 Amb18126820 [0,1,0,1,0,0|2,0,0]=4 4781 B14R2.1019 CCc1cc(N)c2ccccc2n1 Amb18946867 [0,1,0,1,0,0|2,0,0]=4 4782 B14R2.1019 CCc1cc(O)c2ccccc2n1 Amb22410671 [0,1,0,1,0,0|2,0,0]=4 4783 B14R2.1019 COC1=Nc2ccccc2C(=O)N1 Amb21964345 [0,1,0,1,0,0|2,0,0]=4 4784 B14R2.1019 COc1c[n+]([O-])c2ccccc2n1 Amb24371120 [0,1,0,1,0,0|2,0,0]=4 4785 B14R2.1019 COc1cc(Br)c2ccccc2c1 Amb27754022 [0,1,0,1,0,0|1,0,0]=3 4786 B14R2.1019 COc1cc(Br)c2ccccc2n1 Amb24490818 [0,1,0,1,0,0|1,0,0]=3 4787 B14R2.1019 COc1cc(Br)c2cccnc2c1 Amb24076016 [0,1,0,1,0,0|2,0,0]=4 4788 B14R2.1019 COc1cc(Br)c2ccncc2c1 Amb25895582 [0,1,0,1,0,0|2,0,0]=4 4789 B14R2.1019 COc1cc(Br)c2cnccc2c1 Amb26051135 [0,1,0,1,0,0|2,0,0]=4 4790 B14R2.1019 COc1cc(Br)c2ncccc2c1 Amb21963302 [0,1,0,1,0,0|2,0,0]=4 4791 B14R2.1019 COc1cc(C)c2ccccc2c1 Amb24652139 [0,1,0,1,0,0|1,0,0]=3 4792 B14R2.1019 COc1cc(C)c2ncccc2c1 Amb23437328 [0,1,0,1,0,0|2,0,0]=4 4793 B14R2.1019 COc1cc(Cl)c2ccccc2c1 Amb24417708 [0,1,0,1,0,0|1,0,0]=3 4794 B14R2.1019 COc1cc(Cl)c2cccnc2n1 Amb27242891 [0,1,0,1,0,0|2,0,0]=4 4795 B14R2.1019 COc1cc(Cl)c2ncccc2c1 Amb20670601 [0,1,0,1,0,0|2,0,0]=4 4796 B14R2.1019 COc1cc(F)c2ccccc2c1 Amb25060592 [0,1,0,1,0,0|1,0,0]=3 4797 B14R2.1019 COc1cc(F)c2ccccc2n1 Amb27179384 [0,1,0,1,0,0|1,0,0]=3 4798 B14R2.1019 COc1cc(F)c2ccncc2c1 Amb32670332 [0,1,0,1,0,0|2,0,0]=4 4799 B14R2.1019 COc1cc(F)c2ncccc2c1 Amb22495147 [0,1,0,1,0,0|2,0,0]=4 4800 B14R2.1019 COc1cc(I)c2ccccc2n1 Amb27633252 [0,1,0,1,0,0|1,0,0]=3 4801 B14R2.1019 COc1cc(I)c2ncccc2c1 Amb23437327 [0,1,0,1,0,0|2,0,0]=4 4802 B14R2.1019 COc1cc(N)c2ccccc2c1 Amb27233835 [0,1,0,1,0,0|1,0,0]=3 4803 B14R2.1019 COc1cc(N)c2ccccc2n1 Amb26636650 [0,1,0,1,0,0|1,0,0]=3 4804 B14R2.1019 COc1cc(N)c2ccccc2n1 Amb28600366 [0,1,0,1,0,0|1,0,0]=3 4805 B14R2.1019 COc1cc(N)c2ccncc2c1 Amb27459903 [0,1,0,1,0,0|2,0,0]=4 4806 B14R2.1019 COc1cc(N)c2ncccc2c1 Amb1094006 [0,1,0,1,0,0|2,0,0]=4 4807 B14R2.1019 COc1cc(O)c2ccccc2c1 Amb18127199 [0,1,0,1,0,0|1,0,0]=3 4808 B14R2.1019 COc1cc(O)c2cccnc2c1 Amb28243706 [0,1,0,1,0,0|2,0,0]=4 4809 B14R2.1019 COc1cc(O)c2ncccc2c1 Amb13883518 [0,1,0,1,0,0|2,0,0]=4 4810 B14R2.1019 COc1cc([NH3+])c2ncccc2c1 Amb4005869 [0,1,0,1,0,0|2,0,0]=4 4811 B14R2.1019 COc1cc2ccccc2c(N)n1 Amb24649975 [0,1,0,1,0,0|2,0,0]=4 4812 B14R2.1019 COc1nc(Cl)c2ccccc2n1 Amb27653988 [0,1,0,1,0,0|2,0,0]=4 4813 B14R2.1019 COc1nc(O)c2ccccc2n1 Amb8439076 [0,1,0,1,0,0|2,0,0]=4 4814 B14R2.1019 CSC1=CC(=O)c2ccccc2N1 Amb27224827 [0,1,0,1,0,0|1,1,0]=4 4815 B14R2.1019 CSC1=CC(=O)c2ccccc2S1 Amb19667918 [0,1,0,1,0,0|0,2,0]=4 4816 B14R2.1019 CSc1cc(C)c2ccccc2n1 Amb28066074 [0,1,0,1,0,0|1,1,0]=4 4817 B14R2.1019 CSc1cc(N)c2ccccc2n1 Amb27407722 [0,1,0,1,0,0|1,1,0]=4 4818 B14R2.2950 C[C@@]1(c2ccccc2)COC(=O)N1 Amb27390178 [0,1,0,1,0,0|1,0,1]=4 4819 B14R2.2950 O=C1CC(O)(c2ccccc2)CO1 Amb2613714 [0,1,0,1,0,0|0,0,2]=4 4820 B14R2.7724 CC1=C2C=CC=CC2=C(C)C(=O)N1 Amb27658771 [0,1,0,1,0,0|2,0,0]=4 4821 B14R2.7724 CC1=CC(=O)N(C)c2ccccc21 Amb19653965 [0,1,0,1,0,0|1,0,0]=3 4822 B14R2.7724 CC1=CC(=O)N(N)c2ccccc21 Amb18647836 [0,1,0,1,0,0|2,0,0]=4 4823 B14R2.7724 CC1C(=O)NC(=O)c2ccccc21 Amb22364372 [0,1,0,1,0,0|2,0,0]=4 4824 B14R2.7724 CN1C(=O)C=C(Cl)c2ccccc21 Amb17997066 [0,1,0,1,0,0|1,0,0]=3 4825 B14R2.7724 CN1C(=O)C=C(N)c2ccccc21 Amb18127278 [0,1,0,1,0,0|1,0,0]=3 4826 B14R2.7724 CN1C(=O)C=C(O)c2ccccc21 Amb18011109 [0,1,0,1,0,0|1,0,0]=3 4827 B14R2.7724 CN1C(=O)CC(=O)c2ccccc21 Amb1421567 [0,1,0,1,0,0|1,0,1]=4 4828 B14R2.7724 CN1C(=O)NC(=O)c2ccccc21 Amb19516832 [0,1,0,1,0,0|2,0,0]=4 4829 B14R2.7724 CN1C(=O)NC(=S)c2ccccc21 Amb27407873 [0,1,0,1,0,0|2,0,0]=4 4830 B14R2.7724 CN1C(=O)OC(=O)c2ccccc21 Amb17933878 [0,1,0,1,0,0|2,0,0]=4 4831 B14R2.7724 CN1C(N)=CC(=O)c2ccccc21 Amb27484098 [0,1,0,1,0,0|2,0,0]=4 4832 B14R2.7724 CN1C(O)=CC(=O)c2ccccc21 Amb22564234 [0,1,0,1,0,0|1,0,1]=4 4833 B14R2.7724 Cc1c(Cl)cc(N)c2ccccc12 Amb28250139 [0,1,0,1,0,0|2,0,0]=4 4834 B14R2.7724 Cc1c(N)cc(N)c2ccccc12 Amb28366076 [0,1,0,1,0,0|2,0,0]=4 4835 B14R2.7724 Cc1cc(C)c2ccccc2c1C Amb341458 [0,1,0,1,0,0|2,0,0]=4 4836 B14R2.7724 Cc1cc(Cl)c2ccccc2[n+]1C Amb22359536 [0,1,0,1,0,0|2,0,0]=4 4837 B14R2.7724 Cc1cc(N)c(C)c2ccccc12 Amb27983799 [0,1,0,1,0,0|2,0,0]=4 4838 B14R2.7724 Cc1cc(N)c2ccccc2c1C Amb18647537 [0,1,0,1,0,0|2,0,0]=4 4839 B14R2.7724 Cn1c(=O)cc(S)c2ccccc21 Amb2794682 [0,1,0,1,0,0|1,0,0]=3 4840 B14R2.7724 NC1=CC(=O)C(=O)c2ccccc21 Amb17594342 [0,1,0,1,0,0|2,0,0]=4 4841 B14R2.7724 NN1C(=O)C=C(O)c2ccccc21 Amb27165265 [0,1,0,1,0,0|2,0,0]=4 4842 B14R2.20 Cc1cc(-c2ccc(Br)cc2)no1 Amb26961131 [0,1,0,1,0,0|2,0,0]=4 4843 B14R2.20 Cc1cc(-c2ccc(F)cc2)no1 Amb22011901 [0,1,0,1,0,0|2,0,0]=4 4844 B14R2.20 Cc1cc(-c2ccc(N)cc2)no1 Amb17138721 [0,1,0,1,0,0|2,0,0]=4 4845 B14R2.20 Cc1ccc(-c2cc(Br)on2)cc1 Amb27797160 [0,1,0,1,0,0|2,0,0]=4 4846 B14R2.20 Cc1ccc(-c2cc(Cl)on2)cc1 Amb27974719 [0,1,0,1,0,0|2,0,0]=4 4847 B14R2.20 Cc1ccc(-c2cc(N)on2)cc1 Amb1153655 [0,1,0,1,0,0|2,0,0]=4 4848 B14R2.20 Cc1ccc(-c2cc(N)on2)cc1 Amb30622854 [0,1,0,1,0,0|2,0,0]=4 4849 B14R2.20 Cc1ccc(-c2cc(O)on2)cc1 Amb4411873 [0,1,0,1,0,0|1,0,1]=4 4850 B14R2.20 Cc1ccc(-c2coc(Br)c2)cc1 Amb10600679 [0,1,0,1,0,0|1,0,1]=4 4851 B14R2.20 Cc1ccc(C2=CC(=O)CC2)cc1 Amb17138689 [0,1,0,1,0,0|1,0,0]=3 4852 B14R2.20 Cc1ccc(C2=CC(=O)OC2)cc1 Amb26881729 [0,1,0,1,0,0|0,0,0]=2 4853 B14R2.20 Cc1ccc(C2COC(=O)C2)cc1 Amb33353522 [0,1,0,1,0,0|0,0,2]=4 4854 B14R2.20 Cc1ccc(C2COC(=O)N2)cc1 Amb25082390 [0,1,0,1,0,0|1,0,1]=4 4855 B14R2.20 Cc1ccc([C@H]2COC(=O)N2)cc1 Amb28205134 [0,1,0,1,0,0|1,0,1]=4 4856 B14R2.20 Fc1ccc(-c2coc(Br)c2)cc1 Amb10600681 [0,1,0,1,0,0|1,0,1]=4 4857 B14R2.20 Nc1cc(-c2ccc(Br)cc2)co1 Amb18732753 [0,1,0,1,0,0|1,0,1]=4 4858 B14R2.20 Nc1cc(-c2ccc(Br)cc2)no1 Amb1353201 [0,1,0,1,0,0|2,0,0]=4 4859 B14R2.20 Nc1cc(-c2ccc(Cl)cc2)no1 Amb1105291 [0,1,0,1,0,0|2,0,0]=4 4860 B14R2.20 Nc1cc(-c2ccc(F)cc2)no1 Amb1105726 [0,1,0,1,0,0|2,0,0]=4 4861 B14R2.20 Nc1cc(-c2ccc(I)cc2)no1 Amb33531461 [0,1,0,1,0,0|2,0,0]=4 4862 B14R2.20 Nc1cc(-c2ccc(O)cc2)no1 Amb15694903 [0,1,0,1,0,0|2,0,0]=4 4863 B14R2.20 Nc1ccc(C2=CC(=O)NN2)cc1 Amb19514381 [0,1,0,1,0,0|2,0,0]=4 4864 B14R2.20 Nc1ccc(C2=CC(=O)OC2)cc1 Amb27179354 [0,1,0,1,0,0|0,0,0]=2 4865 B14R2.20 Nc1ccc(C2=CC(=O)ON2)cc1 Amb28145958 [0,1,0,1,0,0|1,0,0]=3 4866 B14R2.20 Nc1ccc(C2=NOC(=O)N2)cc1 Amb19308491 [0,1,0,1,0,0|2,0,0]=4 4867 B14R2.20 Nc1ccc(C2=NOC(=O)N2)cc1 Amb22292039 [0,1,0,1,0,0|2,0,0]=4 4868 B14R2.20 O=C1C=C(c2ccc(Br)cc2)CC1 Amb17158297 [0,1,0,1,0,0|1,0,0]=3 4869 B14R2.20 O=C1C=C(c2ccc(Br)cc2)CN1 Amb27402148 [0,1,0,1,0,0|1,0,0]=3 4870 B14R2.20 O=C1C=C(c2ccc(Br)cc2)CO1 Amb33353508 [0,1,0,1,0,0|0,0,0]=2 4871 B14R2.20 O=C1C=C(c2ccc(Cl)cc2)CC1 Amb17139382 [0,1,0,1,0,0|1,0,0]=3 4872 B14R2.20 O=C1C=C(c2ccc(Cl)cc2)CN1 Amb26043758 [0,1,0,1,0,0|1,0,0]=3 4873 B14R2.20 O=C1C=C(c2ccc(Cl)cc2)CO1 Amb33353510 [0,1,0,1,0,0|0,0,0]=2 4874 B14R2.20 O=C1C=C(c2ccc(Cl)cc2)NN1 Amb19804642 [0,1,0,1,0,0|2,0,0]=4 4875 B14R2.20 O=C1C=C(c2ccc(F)cc2)CC1 Amb17138772 [0,1,0,1,0,0|1,0,0]=3 4876 B14R2.20 O=C1C=C(c2ccc(F)cc2)CO1 Amb25135231 [0,1,0,1,0,0|0,0,0]=2 4877 B14R2.20 O=C1C=C(c2ccc(F)cc2)NN1 Amb19804596 [0,1,0,1,0,0|2,0,0]=4 4878 B14R2.20 O=C1CC(c2ccc(Br)cc2)=NO1 Amb27606467 [0,1,0,1,0,0|1,0,1]=4 4879 B14R2.20 O=C1CC(c2ccc(Br)cc2)CO1 Amb33353520 [0,1,0,1,0,0|0,0,2]=4 4880 B14R2.20 O=C1CC(c2ccc(Cl)cc2)=NO1 Amb1011011 [0,1,0,1,0,0|1,0,1]=4 4881 B14R2.20 O=C1CC(c2ccc(Cl)cc2)CO1 Amb24097675 [0,1,0,1,0,0|0,0,2]=4 4882 B14R2.20 O=C1CC(c2ccc(F)cc2)=NO1 Amb24376264 [0,1,0,1,0,0|1,0,1]=4 4883 B14R2.20 O=C1CC(c2ccc(F)cc2)CO1 Amb32419031 [0,1,0,1,0,0|0,0,2]=4 4884 B14R2.20 O=C1CC(c2ccc(I)cc2)=NO1 Amb27223426 [0,1,0,1,0,0|1,0,1]=4 4885 B14R2.20 O=C1CC(c2ccc(O)cc2)=NO1 Amb27954186 [0,1,0,1,0,0|1,0,1]=4 4886 B14R2.20 O=C1NC(c2ccc(Br)cc2)=CO1 Amb26520410 [0,1,0,1,0,0|1,0,1]=4 4887 B14R2.20 O=C1NC(c2ccc(Br)cc2)=NO1 Amb22001449 [0,1,0,1,0,0|2,0,0]=4 4888 B14R2.20 O=C1NC(c2ccc(Br)cc2)CO1 Amb33532359 [0,1,0,1,0,0|1,0,1]=4 4889 B14R2.20 O=C1NC(c2ccc(Cl)cc2)=CO1 Amb26529298 [0,1,0,1,0,0|1,0,1]=4 4890 B14R2.20 O=C1NC(c2ccc(Cl)cc2)=NO1 Amb18321583 [0,1,0,1,0,0|2,0,0]=4 4891 B14R2.20 O=C1NC(c2ccc(Cl)cc2)CO1 Amb27585382 [0,1,0,1,0,0|1,0,1]=4 4892 B14R2.20 O=C1NC(c2ccc(F)cc2)=NO1 Amb18796208 [0,1,0,1,0,0|2,0,0]=4 4893 B14R2.20 O=C1NC(c2ccc(F)cc2)CO1 Amb26854637 [0,1,0,1,0,0|1,0,1]=4 4894 B14R2.20 O=C1NC(c2ccc(O)cc2)CO1 Amb24709902 [0,1,0,1,0,0|1,0,1]=4 4895 B14R2.20 O=C1N[C@H](c2ccc(Br)cc2)CO1 Amb27600878 [0,1,0,1,0,0|1,0,1]=4 4896 B14R2.20 O=C1N[C@H](c2ccc(Cl)cc2)CO1 Amb28397440 [0,1,0,1,0,0|1,0,1]=4 4897 B14R2.20 Oc1cc(-c2ccc(Br)cc2)no1 Amb20672938 [0,1,0,1,0,0|1,0,1]=4 4898 B14R2.20 Oc1cc(-c2ccc(Cl)cc2)no1 Amb20672905 [0,1,0,1,0,0|1,0,1]=4 4899 B14R2.20 Oc1cc(-c2ccc(F)cc2)no1 Amb20672918 [0,1,0,1,0,0|1,0,1]=4 4900 B14R2.20 Oc1cc(-c2ccc(I)cc2)no1 Amb28317243 [0,1,0,1,0,0|1,0,1]=4 4901 B14R2.20 Oc1ccc(-c2coc(Br)c2)cc1 Amb18157668 [0,1,0,1,0,0|1,0,1]=4 4902 B14R2.134 CCc1ccc2ccc(O)cc2c1 Amb26937947 [0,1,0,1,0,0|2,0,0]=4 4903 B14R2.134 CNc1ccc2ccc(F)cc2n1 Amb28318054 [0,1,0,1,0,0|2,0,0]=4 4904 B14R2.134 COC1=CC2=CC(=O)NC=C2C=C1 Amb21964171 [0,1,0,1,0,0|2,0,0]=4 4905 B14R2.134 COc1cc2cc(Br)ccc2cn1 Amb22498297 [0,1,0,1,0,0|2,0,0]=4 4906 B14R2.134 COc1ccc2c(c1)OC(=O)C=C2 Amb18511473 [0,1,0,1,0,0|2,0,0]=4 4907 B14R2.134 COc1ccc2c(c1)OC(=S)C=C2 Amb28385461 [0,1,0,1,0,0|2,0,0]=4 4908 B14R2.134 COc1ccc2c(n1)NC(=O)C=C2 Amb22753693 [0,1,0,1,0,0|2,0,0]=4 4909 B14R2.134 COc1ccc2cc[n+]([O-])cc2c1 Amb2613189 [0,1,0,1,0,0|2,0,0]=4 4910 B14R2.134 COc1ccc2ccc(Br)cc2c1 Amb27252105 [0,1,0,1,0,0|1,0,0]=3 4911 B14R2.134 COc1ccc2ccc(Br)cc2n1 Amb22234521 [0,1,0,1,0,0|1,0,0]=3 4912 B14R2.134 COc1ccc2ccc(Br)nc2c1 Amb25789005 [0,1,0,1,0,0|2,0,0]=4 4913 B14R2.134 COc1ccc2ccc(C)cc2c1 Amb25340236 [0,1,0,1,0,0|1,0,0]=3 4914 B14R2.134 COc1ccc2ccc(C)nc2c1 Amb1994820 [0,1,0,1,0,0|2,0,0]=4 4915 B14R2.134 COc1ccc2ccc(Cl)cc2c1 Amb25974096 [0,1,0,1,0,0|1,0,0]=3 4916 B14R2.134 COc1ccc2ccc(Cl)nc2c1 Amb21864672 [0,1,0,1,0,0|2,0,0]=4 4917 B14R2.134 COc1ccc2ccc(F)cc2c1 Amb24725253 [0,1,0,1,0,0|1,0,0]=3 4918 B14R2.134 COc1ccc2ccc(I)cc2c1 Amb27667893 [0,1,0,1,0,0|1,0,0]=3 4919 B14R2.134 COc1ccc2ccc(N)cc2c1 Amb25187874 [0,1,0,1,0,0|1,0,0]=3 4920 B14R2.134 COc1ccc2ccc(N)cc2n1 Amb23401128 [0,1,0,1,0,0|1,0,0]=3 4921 B14R2.134 COc1ccc2ccc(N)nc2c1 Amb18127232 [0,1,0,1,0,0|2,0,0]=4 4922 B14R2.134 COc1ccc2ccc(N)nc2n1 Amb25900489 [0,1,0,1,0,0|2,0,0]=4 4923 B14R2.134 COc1ccc2ccc(O)cc2c1 Amb3939561 [0,1,0,1,0,0|1,0,0]=3 4924 B14R2.134 COc1ccc2ccc(O)cc2n1 Amb26317850 [0,1,0,1,0,0|1,0,0]=3 4925 B14R2.134 COc1ccc2ccc(S)nc2c1 Amb28429749 [0,1,0,1,0,0|2,0,0]=4 4926 B14R2.134 COc1ccc2cnc(C)cc2c1 Amb17778822 [0,1,0,1,0,0|2,0,0]=4 4927 B14R2.134 COc1ccc2cnc(Cl)cc2c1 Amb22735858 [0,1,0,1,0,0|2,0,0]=4 4928 B14R2.134 COc1ccc2cnc(F)cc2c1 Amb26414113 [0,1,0,1,0,0|2,0,0]=4 4929 B14R2.134 COc1ccc2ncc(Br)cc2c1 Amb1994330 [0,1,0,1,0,0|2,0,0]=4 4930 B14R2.134 COc1ccc2ncc(C)cc2n1 Amb28120690 [0,1,0,1,0,0|2,0,0]=4 4931 B14R2.134 COc1ccc2ncc(F)cc2c1 Amb21926929 [0,1,0,1,0,0|2,0,0]=4 4932 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb10669512 [0,1,0,1,0,0|2,0,0]=4 4933 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb1994860 [0,1,0,1,0,0|2,0,0]=4 4934 B14R2.134 COc1ccc2ncc(N)cc2c1 Amb20239407 [0,1,0,1,0,0|2,0,0]=4 4935 B14R2.134 COc1ccc2ncc(O)cc2c1 Amb8506041 [0,1,0,1,0,0|2,0,0]=4 4936 B14R2.134 COc1cnc2ccc(Br)cc2c1 Amb22494759 [0,1,0,1,0,0|2,0,0]=4 4937 B14R2.134 COc1cnc2ccc(Br)cc2n1 Amb27609348 [0,1,0,1,0,0|2,0,0]=4 4938 B14R2.134 COc1cnc2ccc(Cl)cc2c1 Amb22495280 [0,1,0,1,0,0|2,0,0]=4 4939 B14R2.134 COc1cnc2ccc(F)cc2c1 Amb22495281 [0,1,0,1,0,0|2,0,0]=4 4940 B14R2.134 COc1cnc2ccc(I)cc2c1 Amb22495279 [0,1,0,1,0,0|2,0,0]=4 4941 B14R2.134 COc1cnc2ccc(N)cc2c1 Amb26880806 [0,1,0,1,0,0|2,0,0]=4 4942 B14R2.134 COc1cnc2ccc(O)cc2c1 Amb28066536 [0,1,0,1,0,0|2,0,0]=4 4943 B14R2.134 COc1ncc2ccc(Cl)cc2n1 Amb28242391 [0,1,0,1,0,0|2,0,0]=4 4944 B14R2.134 CSc1ccc2ccc(C)cc2n1 Amb28255821 [0,1,0,1,0,0|1,1,0]=4 4945 B14R2.948 CC1(\C=C\c2ccc(F)cc2)CO1 Amb33202418 [0,1,0,1,0,0|1,0,1]=4 4946 B14R2.4400 O=C1C=C(c2ccc(Br)cc2)C1=O Amb27627838 [0,1,0,1,0,0|2,0,0]=4 4947 B14R2.4513 CN1C(=O)C=Cc2ccc(Br)cc21 Amb22495249 [0,1,0,1,0,0|1,0,0]=3 4948 B14R2.4513 CN1C(=O)C=Cc2ccc(Cl)nc21 Amb27872447 [0,1,0,1,0,0|2,0,0]=4 4949 B14R2.4513 CN1C(=O)C=Cc2ccc(F)cc21 Amb26064690 [0,1,0,1,0,0|1,0,0]=3 4950 B14R2.4513 CN1C(=O)C=Cc2ccc(N)cc21 Amb27179353 [0,1,0,1,0,0|1,0,0]=3 4951 B14R2.4513 CN1C(=O)C=Cc2ccc(N)nc21 Amb27984856 [0,1,0,1,0,0|2,0,0]=4 4952 B14R2.4513 CN1C(=O)C=Cc2ncc(F)cc21 Amb27756420 [0,1,0,1,0,0|2,0,0]=4 4953 B14R2.4513 CN1C(=O)C=Nc2ccc(Br)cc21 Amb19957640 [0,1,0,1,0,0|2,0,0]=4 4954 B14R2.4513 CN1C(=O)C=Nc2ccc(Cl)cc21 Amb27475957 [0,1,0,1,0,0|2,0,0]=4 4955 B14R2.4513 Cc1ccc2c(c1)N(O)C(=O)C=C2 Amb25793546 [0,1,0,1,0,0|2,0,0]=4 4956 B14R2.4513 Cc1ccc2ccc(C)c(C)c2c1 Amb6296402 [0,1,0,1,0,0|2,0,0]=4 4957 B14R2.4513 Cc1ccc2ccc(O)cc2c1C Amb27750229 [0,1,0,1,0,0|2,0,0]=4 4958 B14R2.4513 O=C1C=Cc2ccc(Cl)cc2C1=O Amb27461312 [0,1,0,1,0,0|2,0,0]=4 4959 B14R2.4513 O=C1C=Cc2ccc(O)cc2C1=O Amb17594375 [0,1,0,1,0,0|2,0,0]=4 4960 B14R2.22 Brc1cccc(-c2cc(Br)on2)c1 Amb28240991 [0,1,0,1,0,0|2,0,0]=4 4961 B14R2.22 Cc1cc(-c2cccc(Br)c2)no1 Amb27828667 [0,1,0,1,0,0|2,0,0]=4 4962 B14R2.22 Cc1cc(-c2cccc(N)c2)co1 Amb28240870 [0,1,0,1,0,0|1,0,1]=4 4963 B14R2.22 Cc1cc(-c2cccc(N)c2)no1 Amb17138720 [0,1,0,1,0,0|2,0,0]=4 4964 B14R2.22 Cc1cccc(-c2cc(Cl)on2)c1 Amb22446523 [0,1,0,1,0,0|2,0,0]=4 4965 B14R2.22 Cc1cccc(-c2cc(N)on2)c1 Amb5328875 [0,1,0,1,0,0|2,0,0]=4 4966 B14R2.22 Cc1cccc(-c2cc(O)on2)c1 Amb20672944 [0,1,0,1,0,0|1,0,1]=4 4967 B14R2.22 Cc1cccc(-c2coc(Br)c2)c1 Amb10600678 [0,1,0,1,0,0|1,0,1]=4 4968 B14R2.22 Cc1cccc(C2=CC(=O)CC2)c1 Amb17138688 [0,1,0,1,0,0|1,0,0]=3 4969 B14R2.22 Cc1cccc(C2=CC(=O)OC2)c1 Amb33353517 [0,1,0,1,0,0|0,0,0]=2 4970 B14R2.22 Cc1cccc(C2=NOC(=O)N2)c1 Amb18180568 [0,1,0,1,0,0|2,0,0]=4 4971 B14R2.22 Cc1cccc(C2COC(=O)C2)c1 Amb33353528 [0,1,0,1,0,0|0,0,2]=4 4972 B14R2.22 Cc1cccc(C2COC(=O)N2)c1 Amb26025408 [0,1,0,1,0,0|1,0,1]=4 4973 B14R2.22 Cc1cccc([C@@H]2COC(=O)N2)c1 Amb27494700 [0,1,0,1,0,0|1,0,1]=4 4974 B14R2.22 Fc1cccc(-c2coc(Br)c2)c1 Amb10600680 [0,1,0,1,0,0|1,0,1]=4 4975 B14R2.22 Nc1cc(-c2cccc(Br)c2)co1 Amb18157695 [0,1,0,1,0,0|1,0,1]=4 4976 B14R2.22 Nc1cc(-c2cccc(Br)c2)no1 Amb33528087 [0,1,0,1,0,0|2,0,0]=4 4977 B14R2.22 Nc1cc(-c2cccc(Cl)c2)no1 Amb2608587 [0,1,0,1,0,0|2,0,0]=4 4978 B14R2.22 Nc1cc(-c2cccc(F)c2)no1 Amb33528108 [0,1,0,1,0,0|2,0,0]=4 4979 B14R2.22 Nc1cc(-c2cccc(O)c2)no1 Amb18197032 [0,1,0,1,0,0|2,0,0]=4 4980 B14R2.22 Nc1cccc(-c2cc(N)on2)c1 Amb28045043 [0,1,0,1,0,0|2,0,0]=4 4981 B14R2.22 Nc1cccc(-c2coc(Br)c2)c1 Amb18158180 [0,1,0,1,0,0|1,0,1]=4 4982 B14R2.22 Nc1cccc(C2=NOC(=O)N2)c1 Amb19373012 [0,1,0,1,0,0|2,0,0]=4 4983 B14R2.22 Nc1cccc(C2=NOC(=O)N2)c1 Amb19514650 [0,1,0,1,0,0|2,0,0]=4 4984 B14R2.22 O=C1C=C(c2cccc(Br)c2)CC1 Amb17158296 [0,1,0,1,0,0|1,0,0]=3 4985 B14R2.22 O=C1C=C(c2cccc(Br)c2)CO1 Amb33353509 [0,1,0,1,0,0|0,0,0]=2 4986 B14R2.22 O=C1C=C(c2cccc(Cl)c2)CC1 Amb17139381 [0,1,0,1,0,0|1,0,0]=3 4987 B14R2.22 O=C1C=C(c2cccc(Cl)c2)CO1 Amb33353516 [0,1,0,1,0,0|0,0,0]=2 4988 B14R2.22 O=C1C=C(c2cccc(F)c2)CC1 Amb18065607 [0,1,0,1,0,0|1,0,0]=3 4989 B14R2.22 O=C1C=C(c2cccc(F)c2)CO1 Amb33353512 [0,1,0,1,0,0|0,0,0]=2 4990 B14R2.22 O=C1C=C(c2cccc(O)c2)SS1 Amb27772513 [0,1,0,1,0,0|1,1,0]=4 4991 B14R2.22 O=C1CC(c2cccc(Br)c2)=NO1 Amb28186922 [0,1,0,1,0,0|1,0,1]=4 4992 B14R2.22 O=C1CC(c2cccc(Br)c2)CO1 Amb33353521 [0,1,0,1,0,0|0,0,2]=4 4993 B14R2.22 O=C1CC(c2cccc(Cl)c2)=NO1 Amb22469072 [0,1,0,1,0,0|1,0,1]=4 4994 B14R2.22 O=C1CC(c2cccc(Cl)c2)CO1 Amb33353527 [0,1,0,1,0,0|0,0,2]=4 4995 B14R2.22 O=C1CC(c2cccc(F)c2)CO1 Amb33353524 [0,1,0,1,0,0|0,0,2]=4 4996 B14R2.22 O=C1NC(c2cccc(Br)c2)=NO1 Amb19372948 [0,1,0,1,0,0|2,0,0]=4 4997 B14R2.22 O=C1NC(c2cccc(Br)c2)CO1 Amb27390854 [0,1,0,1,0,0|1,0,1]=4 4998 B14R2.22 O=C1NC(c2cccc(Cl)c2)=NO1 Amb18321584 [0,1,0,1,0,0|2,0,0]=4 4999 B14R2.22 O=C1NC(c2cccc(Cl)c2)CO1 Amb26859137 [0,1,0,1,0,0|1,0,1]=4 5000 B14R2.22 O=C1NC(c2cccc(F)c2)=CO1 Amb27659472 [0,1,0,1,0,0|1,0,1]=4 5001 B14R2.22 O=C1NC(c2cccc(F)c2)CO1 Amb25316630 [0,1,0,1,0,0|1,0,1]=4 5002 B14R2.22 O=C1N[C@@H](c2cccc(Cl)c2)CO1 Amb28077006 [0,1,0,1,0,0|1,0,1]=4 5003 B14R2.22 O=C1N[C@@H](c2cccc(I)c2)CO1 Amb27864565 [0,1,0,1,0,0|1,0,1]=4 5004 B14R2.22 O=C1N[C@H](c2cccc(I)c2)CO1 Amb27646977 [0,1,0,1,0,0|1,0,1]=4 5005 B14R2.22 Oc1cc(-c2cccc(Br)c2)no1 Amb20672933 [0,1,0,1,0,0|1,0,1]=4 5006 B14R2.22 Oc1cc(-c2cccc(Cl)c2)no1 Amb20672930 [0,1,0,1,0,0|1,0,1]=4 5007 B14R2.22 Oc1cc(-c2cccc(F)c2)no1 Amb20672928 [0,1,0,1,0,0|1,0,1]=4 5008 B14R2.142 CCc1ccc2cccc(Br)c2n1 Amb28429730 [0,1,0,1,0,0|2,0,0]=4 5009 B14R2.142 CCc1ccc2cccc(C)c2n1 Amb27975680 [0,1,0,1,0,0|2,0,0]=4 5010 B14R2.142 CCc1ccc2cccc(N)c2n1 Amb28455340 [0,1,0,1,0,0|2,0,0]=4 5011 B14R2.142 CCc1ccc2cccc(O)c2c1 Amb18559371 [0,1,0,1,0,0|2,0,0]=4 5012 B14R2.142 CNc1ccc2cccc(C)c2n1 Amb28193372 [0,1,0,1,0,0|2,0,0]=4 5013 B14R2.142 CNc1ccc2cccc(O)c2c1 Amb17594347 [0,1,0,1,0,0|2,0,0]=4 5014 B14R2.142 CNc1ccc2cccc(O)c2n1 Amb8506024 [0,1,0,1,0,0|2,0,0]=4 5015 B14R2.142 COc1cc2c(Br)cccc2cn1 Amb22735853 [0,1,0,1,0,0|2,0,0]=4 5016 B14R2.142 COc1cc2c(N)cccc2cn1 Amb22500899 [0,1,0,1,0,0|2,0,0]=4 5017 B14R2.142 COc1ccc2c(c1)C(=O)C=CN2 Amb18178164 [0,1,0,1,0,0|2,0,0]=4 5018 B14R2.142 COc1ccc2c(c1)C(=O)C=CN2 Amb33719339 [0,1,0,1,0,0|2,0,0]=4 5019 B14R2.142 COc1ccc2c(c1)C(=O)C=CO2 Amb19666847 [0,1,0,1,0,0|2,0,0]=4 5020 B14R2.142 COc1ccc2c(c1)C(=O)OC=C2 Amb27169698 [0,1,0,1,0,0|2,0,0]=4 5021 B14R2.142 COc1ccc2c(c1)C(=S)C=CN2 Amb22010850 [0,1,0,1,0,0|2,0,0]=4 5022 B14R2.142 COc1ccc2c(n1)C(=O)C=CN2 Amb22500169 [0,1,0,1,0,0|2,0,0]=4 5023 B14R2.142 COc1ccc2cccc(Br)c2c1 Amb25670283 [0,1,0,1,0,0|1,0,0]=3 5024 B14R2.142 COc1ccc2cccc(Br)c2n1 Amb22494690 [0,1,0,1,0,0|1,0,0]=3 5025 B14R2.142 COc1ccc2cccc(C)c2n1 Amb20171195 [0,1,0,1,0,0|1,0,0]=3 5026 B14R2.142 COc1ccc2cccc(Cl)c2c1 Amb26014314 [0,1,0,1,0,0|1,0,0]=3 5027 B14R2.142 COc1ccc2cccc(Cl)c2n1 Amb26521076 [0,1,0,1,0,0|1,0,0]=3 5028 B14R2.142 COc1ccc2cccc(N)c2c1 Amb18647727 [0,1,0,1,0,0|1,0,0]=3 5029 B14R2.142 COc1ccc2cccc(N)c2n1 Amb22713475 [0,1,0,1,0,0|1,0,0]=3 5030 B14R2.142 COc1ccc2cccc(O)c2c1 Amb3429497 [0,1,0,1,0,0|1,0,0]=3 5031 B14R2.142 COc1ccc2cccc(O)c2n1 Amb1779249 [0,1,0,1,0,0|1,0,0]=3 5032 B14R2.142 COc1ccc2ccnc(Br)c2c1 Amb18062826 [0,1,0,1,0,0|2,0,0]=4 5033 B14R2.142 COc1ccc2ccnc(Cl)c2c1 Amb18560354 [0,1,0,1,0,0|2,0,0]=4 5034 B14R2.142 COc1ccc2ccnc(F)c2c1 Amb35642416 [0,1,0,1,0,0|2,0,0]=4 5035 B14R2.142 COc1ccc2ccnc(I)c2c1 Amb8439711 [0,1,0,1,0,0|2,0,0]=4 5036 B14R2.142 COc1ccc2ccnc(N)c2c1 Amb18560418 [0,1,0,1,0,0|2,0,0]=4 5037 B14R2.142 COc1ccc2ccnc(O)c2c1 Amb18560323 [0,1,0,1,0,0|2,0,0]=4 5038 B14R2.142 COc1ccc2ccnc(S)c2c1 Amb27592542 [0,1,0,1,0,0|2,0,0]=4 5039 B14R2.142 COc1ccc2nccc(Br)c2c1 Amb1994865 [0,1,0,1,0,0|2,0,0]=4 5040 B14R2.142 COc1ccc2nccc(Br)c2n1 Amb21926825 [0,1,0,1,0,0|2,0,0]=4 5041 B14R2.142 COc1ccc2nccc(C)c2c1 Amb2689153 [0,1,0,1,0,0|2,0,0]=4 5042 B14R2.142 COc1ccc2nccc(C)c2c1 Amb6383241 [0,1,0,1,0,0|2,0,0]=4 5043 B14R2.142 COc1ccc2nccc(Cl)c2c1 Amb33531717 [0,1,0,1,0,0|2,0,0]=4 5044 B14R2.142 COc1ccc2nccc(Cl)c2n1 Amb19957914 [0,1,0,1,0,0|2,0,0]=4 5045 B14R2.142 COc1ccc2nccc(I)c2c1 Amb24073902 [0,1,0,1,0,0|2,0,0]=4 5046 B14R2.142 COc1ccc2nccc(N)c2c1 Amb1994316 [0,1,0,1,0,0|2,0,0]=4 5047 B14R2.142 COc1ccc2nccc(N)c2n1 Amb22899619 [0,1,0,1,0,0|2,0,0]=4 5048 B14R2.142 COc1ccc2nccc(O)c2c1 Amb1994274 [0,1,0,1,0,0|2,0,0]=4 5049 B14R2.142 COc1cnc2cccc(Br)c2c1 Amb22048262 [0,1,0,1,0,0|2,0,0]=4 5050 B14R2.142 COc1cnc2cccc(Cl)c2n1 Amb27869968 [0,1,0,1,0,0|2,0,0]=4 5051 B14R2.142 COc1cnc2cccc(O)c2c1 Amb25700788 [0,1,0,1,0,0|2,0,0]=4 5052 B14R2.2332 CCc1ccc2cc(C)ccc2c1 Amb26519635 [0,1,0,1,0,0|2,0,0]=4 5053 B14R2.2332 CCc1ccc2cc(F)ccc2n1 Amb27179995 [0,1,0,1,0,0|2,0,0]=4 5054 B14R2.2332 CCc1ccc2cc(N)ccc2n1 Amb24531670 [0,1,0,1,0,0|2,0,0]=4 5055 B14R2.2332 CCc1ccc2cc(O)ccc2c1 Amb8387657 [0,1,0,1,0,0|2,0,0]=4 5056 B14R2.2332 CNc1ccc2cc(Br)ccc2c1 Amb27851207 [0,1,0,1,0,0|2,0,0]=4 5057 B14R2.2332 CNc1ccc2cc(Br)ccc2n1 Amb26980680 [0,1,0,1,0,0|2,0,0]=4 5058 B14R2.2332 CNc1ccc2cc(C)ccc2n1 Amb28193373 [0,1,0,1,0,0|2,0,0]=4 5059 B14R2.2332 CNc1ccc2cc(N)ccc2n1 Amb9310169 [0,1,0,1,0,0|2,0,0]=4 5060 B14R2.2332 COC1=CC2=CNC(=O)C=C2C=C1 Amb26603414 [0,1,0,1,0,0|2,0,0]=4 5061 B14R2.2332 COc1cc2ccc(Br)cc2cn1 Amb22735852 [0,1,0,1,0,0|2,0,0]=4 5062 B14R2.2332 COc1cc2ccc(N)cc2cn1 Amb22500898 [0,1,0,1,0,0|2,0,0]=4 5063 B14R2.2332 COc1ccc2c(c1)C=CC(=O)N2 Amb18546025 [0,1,0,1,0,0|2,0,0]=4 5064 B14R2.2332 COc1ccc2c(c1)C=CC(=O)O2 Amb19892427 [0,1,0,1,0,0|2,0,0]=4 5065 B14R2.2332 COc1ccc2c(n1)C=CC(=O)N2 Amb28255716 [0,1,0,1,0,0|2,0,0]=4 5066 B14R2.2332 COc1ccc2c[n+]([O-])ccc2c1 Amb22500172 [0,1,0,1,0,0|2,0,0]=4 5067 B14R2.2332 COc1ccc2cc(Br)ccc2c1 Amb6365011 [0,1,0,1,0,0|1,0,0]=3 5068 B14R2.2332 COc1ccc2cc(Br)ccc2n1 Amb10608831 [0,1,0,1,0,0|1,0,0]=3 5069 B14R2.2332 COc1ccc2cc(Br)cnc2c1 Amb20241799 [0,1,0,1,0,0|2,0,0]=4 5070 B14R2.2332 COc1ccc2cc(Br)cnc2n1 Amb27461909 [0,1,0,1,0,0|2,0,0]=4 5071 B14R2.2332 COc1ccc2cc(Br)ncc2n1 Amb25696481 [0,1,0,1,0,0|2,0,0]=4 5072 B14R2.2332 COc1ccc2cc(C)ccc2c1 Amb22749231 [0,1,0,1,0,0|1,0,0]=3 5073 B14R2.2332 COc1ccc2cc(C)ccc2n1 Amb28341767 [0,1,0,1,0,0|1,0,0]=3 5074 B14R2.2332 COc1ccc2cc(C)cnc2c1 Amb27865816 [0,1,0,1,0,0|2,0,0]=4 5075 B14R2.2332 COc1ccc2cc(C)ncc2c1 Amb21857935 [0,1,0,1,0,0|2,0,0]=4 5076 B14R2.2332 COc1ccc2cc(Cl)cnc2c1 Amb20242057 [0,1,0,1,0,0|2,0,0]=4 5077 B14R2.2332 COc1ccc2cc(Cl)ncc2c1 Amb24099959 [0,1,0,1,0,0|2,0,0]=4 5078 B14R2.2332 COc1ccc2cc(F)ccc2n1 Amb19959135 [0,1,0,1,0,0|1,0,0]=3 5079 B14R2.2332 COc1ccc2cc(I)ccc2c1 Amb22749216 [0,1,0,1,0,0|1,0,0]=3 5080 B14R2.2332 COc1ccc2cc(I)cnc2c1 Amb22497629 [0,1,0,1,0,0|2,0,0]=4 5081 B14R2.2332 COc1ccc2cc(N)ccc2c1 Amb18279523 [0,1,0,1,0,0|1,0,0]=3 5082 B14R2.2332 COc1ccc2cc(N)ccc2c1 Amb32652033 [0,1,0,1,0,0|1,0,0]=3 5083 B14R2.2332 COc1ccc2cc(N)ccc2n1 Amb9310368 [0,1,0,1,0,0|1,0,0]=3 5084 B14R2.2332 COc1ccc2cc(N)cnc2c1 Amb15741138 [0,1,0,1,0,0|2,0,0]=4 5085 B14R2.2332 COc1ccc2cc(N)cnc2c1 Amb9830331 [0,1,0,1,0,0|2,0,0]=4 5086 B14R2.2332 COc1ccc2cc(O)ccc2c1 Amb17689147 [0,1,0,1,0,0|1,0,0]=3 5087 B14R2.2332 COc1ccc2cc(O)cnc2c1 Amb26501443 [0,1,0,1,0,0|2,0,0]=4 5088 B14R2.2332 COc1ccc2cc(S)ccc2c1 Amb19040993 [0,1,0,1,0,0|1,0,0]=3 5089 B14R2.2332 COc1ccc2nc(Br)ccc2c1 Amb22263104 [0,1,0,1,0,0|2,0,0]=4 5090 B14R2.2332 COc1ccc2nc(C)ccc2c1 Amb1774422 [0,1,0,1,0,0|2,0,0]=4 5091 B14R2.2332 COc1ccc2nc(C)ccc2n1 Amb25961137 [0,1,0,1,0,0|2,0,0]=4 5092 B14R2.2332 COc1ccc2nc(Cl)ccc2c1 Amb1773592 [0,1,0,1,0,0|2,0,0]=4 5093 B14R2.2332 COc1ccc2nc(Cl)ccc2n1 Amb27751724 [0,1,0,1,0,0|2,0,0]=4 5094 B14R2.2332 COc1ccc2nc(N)ccc2c1 Amb8386592 [0,1,0,1,0,0|2,0,0]=4 5095 B14R2.2332 COc1ccc2nc(S)ccc2c1 Amb25127710 [0,1,0,1,0,0|2,0,0]=4 5096 B14R2.2332 COc1cnc2cc(Br)ccc2c1 Amb22236117 [0,1,0,1,0,0|2,0,0]=4 5097 B14R2.2332 COc1cnc2cc(Cl)ccc2n1 Amb28051712 [0,1,0,1,0,0|2,0,0]=4 5098 B14R2.2332 CSc1ccc2cc(Br)ccc2n1 Amb27438712 [0,1,0,1,0,0|1,1,0]=4 5099 B14R2.2332 CSc1ccc2cc(C)ccc2n1 Amb10809159 [0,1,0,1,0,0|1,1,0]=4 5100 B14R2.2332 CSc1ccc2cc(O)ccc2c1 Amb28202173 [0,1,0,1,0,0|1,1,0]=4 5101 B14R2.2332 NOc1ccc2cc(Br)ccc2c1 Amb27188210 [0,1,0,1,0,0|2,0,0]=4 5102 B14R2.10634 COC(=O)C1Cc2cc(C)ccc21 Amb27481324 [0,1,0,1,0,0|0,0,2]=4 5103 B14R2.28523 CN1C(=O)C=Cc2cccc(N)c21 Amb25689714 [0,1,0,1,0,0|1,0,0]=3 5104 B14R2.28523 CN1C(=O)C=Cc2cccc(O)c21 Amb22751142 [0,1,0,1,0,0|1,0,0]=3 5105 B14R2.28523 CN1C(=O)C=Cc2nccc(O)c21 Amb27974128 [0,1,0,1,0,0|2,0,0]=4 5106 B14R2.28523 CN1C(=O)C=Nc2cccc(Cl)c21 Amb27451759 [0,1,0,1,0,0|2,0,0]=4 5107 B14R2.28523 Cc1ccc2cccc(C)c2c1C Amb6298592 [0,1,0,1,0,0|2,0,0]=4 5108 B14R2.28523 Cn1c(=O)ccc2cccc(Br)c21 Amb24092279 [0,1,0,1,0,0|1,0,0]=3 5109 B14R2.28523 N=C1C(=O)C=Cc2cccc(N)c21 Amb27415544 [0,1,0,1,0,0|2,0,0]=4 5110 B14R2.28523 O=C1C=Cc2cccc(Br)c2C1=O Amb28121485 [0,1,0,1,0,0|2,0,0]=4 5111 B14R2.29369 CN1C(=O)C=Cc2cc(Br)ccc21 Amb22522657 [0,1,0,1,0,0|1,0,0]=3 5112 B14R2.29369 CN1C(=O)C=Cc2cc(O)ccc21 Amb18127365 [0,1,0,1,0,0|1,0,0]=3 5113 B14R2.29369 CN1C(=O)C=Nc2cc(Br)ccc21 Amb27177111 [0,1,0,1,0,0|2,0,0]=4 5114 B14R2.29369 CN1C(=O)C=Nc2cc(Cl)ccc21 Amb27605467 [0,1,0,1,0,0|2,0,0]=4 5115 B14R2.29369 CN1C(=O)C=Nc2cc(F)ccc21 Amb24559947 [0,1,0,1,0,0|2,0,0]=4 5116 B14R2.29369 Cc1ccc2c(c1)C=CC(=O)N2C Amb21994767 [0,1,0,1,0,0|1,0,0]=3 5117 B14R2.29369 Cc1ccc2c(c1)C=CC(=O)N2O Amb27954617 [0,1,0,1,0,0|2,0,0]=4 5118 B14R2.29369 Cc1ccc2cc(F)ccc2[n+]1C Amb2728008 [0,1,0,1,0,0|2,0,0]=4 5119 B14R2.29369 O=C1C=Cc2cc(Br)ccc2C1=O Amb1783962 [0,1,0,1,0,0|2,0,0]=4 5120 B14R2.29369 O=C1C=Cc2cc(O)ccc2C1=O Amb17594374 [0,1,0,1,0,0|2,0,0]=4 5121 B14R2.15 O=C1C=C(c2ccccc2)\C1=N/O Amb27211894 [0,1,0,1,0,0|2,0,0]=4 5122 B14R2.30 C=C1COC\C1=C\c2ccccc2 Amb27640106 [0,1,0,1,0,0|1,0,0]=3 5123 B14R2.30 O=C1C=CC\C1=C/c2ccccc2 Amb27762533 [0,1,0,1,0,0|1,0,0]=3 5124 B14R2.30 O=C1CCC=C1Oc2ccccc2 Amb28053964 [0,1,0,1,0,0|2,0,0]=4 5125 B14R2.30 O=C1CCC\C1=C/c2ccccc2 Amb1198712 [0,1,0,1,0,0|1,0,0]=3 5126 B14R2.30 O=C1CCC\C1=C/c2cccnc2 Amb27857716 [0,1,0,1,0,0|2,0,0]=4 5127 B14R2.30 O=C1CCC\C1=C/c2ccncc2 Amb1486635 [0,1,0,1,0,0|2,0,0]=4 5128 B14R2.30 O=C1COCC1Cc2ccccc2 Amb27599380 [0,1,0,1,0,0|0,0,2]=4 5129 B14R2.30 O=C1NC=N\C1=C/c2ccccc2 Amb25837555 [0,1,0,1,0,0|1,0,1]=4 5130 B14R2.30 O=C1NCC\C1=C/c2ccccc2 Amb22643155 [0,1,0,1,0,0|1,0,0]=3 5131 B14R2.30 O=C1OCC=C1Sc2ccccc2 Amb21928057 [0,1,0,1,0,0|1,0,0]=3 5132 B14R2.30 O=C1OCCC1Cc2ccccc2 Amb28363627 [0,1,0,1,0,0|0,0,2]=4 5133 B14R2.30 O=C1OCCC1Nc2ccccc2 Amb25743171 [0,1,0,1,0,0|1,0,1]=4 5134 B14R2.30 O=C1OCCC1Oc2ccccc2 Amb28140570 [0,1,0,1,0,0|1,0,1]=4 5135 B14R2.30 O=C1OCCC1Sc2ccccc2 Amb3836146 [0,1,0,1,0,0|1,0,1]=4 5136 B14R2.30 O=C1OCC\C1=C/c2ccccc2 Amb593520 [0,1,0,1,0,0|0,0,0]=2 5137 B14R2.30 S=C1NCC\C1=C/c2ccccc2 Amb26445085 [0,1,0,1,0,0|1,1,0]=4 5138 B14R2.101 C(/Nc1ccccc1)=C2\CCCO2 Amb27453572 [0,1,0,1,0,0|2,0,0]=4 5139 B14R2.101 C(=C\C1CCCO1)/c2ccccc2 Amb4103388 [0,1,0,1,0,0|1,0,1]=4 5140 B14R2.101 C(=C\C1OCCO1)/c2ccccc2 Amb26483959 [0,1,0,1,0,0|0,0,2]=4 5141 B14R2.101 C(=C\c1ccccc1)/C2=NCCN2 Amb27474827 [0,1,0,1,0,0|2,0,0]=4 5142 B14R2.101 C(=C\c1ccccc1)/C2=NCCS2 Amb28139613 [0,1,0,1,0,0|1,1,0]=4 5143 B14R2.101 C(=C\c1ccco1)/c2ccccc2 Amb26498528 [0,1,0,1,0,0|1,0,1]=4 5144 B14R2.112 BrCCc1ccc2ccccc2c1 Amb8439759 [0,1,0,1,0,0|2,0,0]=4 5145 B14R2.112 BrCCc1ccc2ccccc2n1 Amb25113626 [0,1,0,1,0,0|2,0,0]=4 5146 B14R2.112 CC#Cc1ccc2ccccc2n1 Amb27208301 [0,1,0,1,0,0|2,0,0]=4 5147 B14R2.112 CCCc1ccc2ccccc2n1 Amb27265534 [0,1,0,1,0,0|2,0,0]=4 5148 B14R2.112 CCNc1ccc2ccccc2c1 Amb7759811 [0,1,0,1,0,0|2,0,0]=4 5149 B14R2.112 CCOc1cc2ccccc2cn1 Amb2610107 [0,1,0,1,0,0|2,0,0]=4 5150 B14R2.112 CCOc1ccc2ccccc2c1 Amb4017891 [0,1,0,1,0,0|1,0,0]=3 5151 B14R2.112 CCOc1ccc2cccnc2c1 Amb27772101 [0,1,0,1,0,0|2,0,0]=4 5152 B14R2.112 CCOc1ccc2ncccc2c1 Amb19106597 [0,1,0,1,0,0|2,0,0]=4 5153 B14R2.112 CCOc1ccc2ncccc2n1 Amb25900314 [0,1,0,1,0,0|2,0,0]=4 5154 B14R2.112 CCSc1ccc2ccccc2c1 Amb24359866 [0,1,0,1,0,0|1,1,0]=4 5155 B14R2.112 CCSc1ccc2ccccc2n1 Amb27972844 [0,1,0,1,0,0|1,1,0]=4 5156 B14R2.112 CNCc1ccc2ccccc2c1 Amb1106022 [0,1,0,1,0,0|2,0,0]=4 5157 B14R2.112 CNCc1ccc2ccccc2n1 Amb6742539 [0,1,0,1,0,0|2,0,0]=4 5158 B14R2.112 COCc1cnc2ccccc2c1 Amb28422626 [0,1,0,1,0,0|2,0,0]=4 5159 B14R2.112 CSCc1ccc2ccccc2c1 Amb4006802 [0,1,0,1,0,0|1,1,0]=4 5160 B14R2.112 CSCc1ccc2ccccc2n1 Amb27836677 [0,1,0,1,0,0|1,1,0]=4 5161 B14R2.112 C\N=C\c1ccc2ccccc2n1 Amb27642803 [0,1,0,1,0,0|2,0,0]=4 5162 B14R2.112 ClCOc1cnc2ccccc2c1 Amb28195835 [0,1,0,1,0,0|2,0,0]=4 5163 B14R2.112 N#COc1ccc2ccccc2c1 Amb27445591 [0,1,0,1,0,0|1,0,1]=4 5164 B14R2.112 NCCc1ccc2ccccc2c1 Amb6245305 [0,1,0,1,0,0|2,0,0]=4 5165 B14R2.112 NCCc1ccc2ccccc2c1 Amb7969583 [0,1,0,1,0,0|2,0,0]=4 5166 B14R2.112 NCCc1ccc2ccccc2n1 Amb6742401 [0,1,0,1,0,0|2,0,0]=4 5167 B14R2.112 NCCc1ccc2ccccc2n1 Amb9182400 [0,1,0,1,0,0|2,0,0]=4 5168 B14R2.112 NOCc1ccc2ccccc2c1 Amb33362172 [0,1,0,1,0,0|2,0,0]=4 5169 B14R2.112 NOCc1ccc2ccccc2n1 Amb24466527 [0,1,0,1,0,0|2,0,0]=4 5170 B14R2.112 OCCc1ccc2ccccc2c1 Amb3939094 [0,1,0,1,0,0|2,0,0]=4 5171 B14R2.112 OCCc1ccc2ccccc2n1 Amb4093502 [0,1,0,1,0,0|2,0,0]=4 5172 B14R2.112 SCCc1ccc2ccccc2c1 Amb28346891 [0,1,0,1,0,0|2,0,0]=4 5173 B14R2.112 SCCc1ccc2ccccc2n1 Amb26552663 [0,1,0,1,0,0|2,0,0]=4 5174 B14R2.203 BrCc1c(Br)ccc2ccccc12 Amb22040437 [0,1,0,1,0,0|2,0,0]=4 5175 B14R2.203 BrCc1c(I)ccc2ccccc12 Amb25351584 [0,1,0,1,0,0|2,0,0]=4 5176 B14R2.203 CCN1C(=O)C=Cc2ccccc21 Amb22360524 [0,1,0,1,0,0|1,0,0]=3 5177 B14R2.203 CCN1C(=O)C=Cc2cccnc21 Amb26376360 [0,1,0,1,0,0|2,0,0]=4 5178 B14R2.203 CCN1C(=O)C=Nc2ccccc21 Amb26053521 [0,1,0,1,0,0|2,0,0]=4 5179 B14R2.203 CCN1C(=S)C=Cc2ccccc21 Amb20247294 [0,1,0,1,0,0|1,1,0]=4 5180 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb1144527 [0,1,0,1,0,0|2,0,0]=4 5181 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb2609772 [0,1,0,1,0,0|2,0,0]=4 5182 B14R2.203 CCc1c(N)ccc2ccccc12 Amb28322316 [0,1,0,1,0,0|2,0,0]=4 5183 B14R2.203 CNc1c(C)ccc2ccccc12 Amb18553377 [0,1,0,1,0,0|2,0,0]=4 5184 B14R2.203 COC1c2ccccc2C=CC1O Amb28281797 [0,1,0,1,0,0|0,0,2]=4 5185 B14R2.203 COc1c(Br)ccc2ccccc12 Amb18559387 [0,1,0,1,0,0|1,0,0]=3 5186 B14R2.203 COc1c(Br)ccc2cccnc12 Amb23003265 [0,1,0,1,0,0|2,0,0]=4 5187 B14R2.203 COc1c(Br)ccc2ccncc12 Amb35788869 [0,1,0,1,0,0|2,0,0]=4 5188 B14R2.203 COc1c(Br)ccc2ncccc12 Amb25092126 [0,1,0,1,0,0|2,0,0]=4 5189 B14R2.203 COc1c(Br)cnc2ccccc12 Amb27225887 [0,1,0,1,0,0|2,0,0]=4 5190 B14R2.203 COc1c(Br)ncc2ccccc12 Amb27784001 [0,1,0,1,0,0|2,0,0]=4 5191 B14R2.203 COc1c(C)ccc2ccccc12 Amb25829445 [0,1,0,1,0,0|1,0,0]=3 5192 B14R2.203 COc1c(Cl)ccc2ccccc12 Amb26846125 [0,1,0,1,0,0|1,0,0]=3 5193 B14R2.203 COc1c(Cl)ccc2cccnc12 Amb23003247 [0,1,0,1,0,0|2,0,0]=4 5194 B14R2.203 COc1c(Cl)ccc2ncccc12 Amb27616510 [0,1,0,1,0,0|2,0,0]=4 5195 B14R2.203 COc1c(F)ccc2ccccc12 Amb26556586 [0,1,0,1,0,0|1,0,0]=3 5196 B14R2.203 COc1c(I)ccc2ccccc12 Amb25237394 [0,1,0,1,0,0|1,0,0]=3 5197 B14R2.203 COc1c(I)cnc2ccccc12 Amb27878879 [0,1,0,1,0,0|2,0,0]=4 5198 B14R2.203 COc1c(N)ccc2ccccc12 Amb18127046 [0,1,0,1,0,0|1,0,0]=3 5199 B14R2.203 COc1c(N)ccc2ncccc12 Amb28351725 [0,1,0,1,0,0|2,0,0]=4 5200 B14R2.203 COc1c(N)cnc2ccccc12 Amb23402468 [0,1,0,1,0,0|2,0,0]=4 5201 B14R2.203 COc1c(N)ncc2ccccc12 Amb27246768 [0,1,0,1,0,0|2,0,0]=4 5202 B14R2.203 COc1c(O)ccc2ccccc12 Amb18127193 [0,1,0,1,0,0|0,0,1]=3 5203 B14R2.203 COc1c(O)ccc2cccnc12 Amb28243277 [0,1,0,1,0,0|1,0,1]=4 5204 B14R2.203 COc1c(O)ccc2ncccc12 Amb28399306 [0,1,0,1,0,0|1,0,1]=4 5205 B14R2.203 COc1c(O)cnc2ccccc12 Amb24496940 [0,1,0,1,0,0|1,0,1]=4 5206 B14R2.203 CSc1c(N)ccc2ccccc12 Amb27860266 [0,1,0,1,0,0|1,1,0]=4 5207 B14R2.203 Cc1ccc2ccccc2c1CBr Amb24080215 [0,1,0,1,0,0|2,0,0]=4 5208 B14R2.203 Cc1ccc2ccccc2c1CCl Amb2609042 [0,1,0,1,0,0|2,0,0]=4 5209 B14R2.203 Cc1ccc2ccccc2c1CN Amb18051856 [0,1,0,1,0,0|2,0,0]=4 5210 B14R2.203 ClCc1c(Br)ccc2ccccc12 Amb25995195 [0,1,0,1,0,0|2,0,0]=4 5211 B14R2.203 ClCc1c(Cl)ccc2ccccc12 Amb27986203 [0,1,0,1,0,0|2,0,0]=4 5212 B14R2.203 ClCc1c(I)ccc2ccccc12 Amb26025835 [0,1,0,1,0,0|2,0,0]=4 5213 B14R2.203 Clc1ccc2ccccc2c1CBr Amb27753540 [0,1,0,1,0,0|2,0,0]=4 5214 B14R2.203 Fc1ccc2ccccc2c1CBr Amb26654237 [0,1,0,1,0,0|2,0,0]=4 5215 B14R2.203 Fc1ccc2ccccc2c1CCl Amb24055306 [0,1,0,1,0,0|2,0,0]=4 5216 B14R2.203 NCc1c(Cl)ccc2ccccc12 Amb27803653 [0,1,0,1,0,0|2,0,0]=4 5217 B14R2.203 NCc1c(F)ccc2ccccc12 Amb24054596 [0,1,0,1,0,0|2,0,0]=4 5218 B14R2.203 NCc1c(I)ccc2ccccc12 Amb25324000 [0,1,0,1,0,0|2,0,0]=4 5219 B14R2.203 NCc1c(N)ccc2ccccc12 Amb28243692 [0,1,0,1,0,0|2,0,0]=4 5220 B14R2.203 NCc1c(N)ccc2ccccc12 Amb32667593 [0,1,0,1,0,0|2,0,0]=4 5221 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1133018 [0,1,0,1,0,0|1,0,1]=4 5222 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1993926 [0,1,0,1,0,0|1,0,1]=4 5223 B14R2.203 N\C=C1\C(=O)C=Cc2ccccc21 Amb27446516 [0,1,0,1,0,0|1,0,1]=4 5224 B14R2.203 Nc1ccc2ccccc2c1CBr Amb27180644 [0,1,0,1,0,0|2,0,0]=4 5225 B14R2.203 Nc1ccc2ccccc2c1CO Amb27250669 [0,1,0,1,0,0|2,0,0]=4 5226 B14R2.203 O=C1C=Cc2ccccc2\C1=N/O Amb19748272 [0,1,0,1,0,0|2,0,0]=4 5227 B14R2.203 OCc1c(Cl)ccc2ccccc12 Amb25808641 [0,1,0,1,0,0|2,0,0]=4 5228 B14R2.203 OCc1c(F)ccc2ccccc12 Amb25945307 [0,1,0,1,0,0|2,0,0]=4 5229 B14R2.203 OCc1c(I)ccc2ccccc12 Amb27796250 [0,1,0,1,0,0|2,0,0]=4 5230 B14R2.203 OCc1c(O)ccc2ccccc12 Amb1111444 [0,1,0,1,0,0|1,0,1]=4 5231 B14R2.203 OCc1c(S)ccc2ccccc12 Amb27665549 [0,1,0,1,0,0|1,1,0]=4 5232 B14R2.203 Oc1ccc2ccccc2c1CBr Amb25211050 [0,1,0,1,0,0|1,0,1]=4 5233 B14R2.203 Oc1ccc2ccccc2c1CCl Amb17477547 [0,1,0,1,0,0|1,0,1]=4 5234 B14R2.203 Oc1ccc2ccccc2c1CS Amb32788722 [0,1,0,1,0,0|1,0,1]=4 5235 B14R2.598 C=C1NC(=O)C=C1c2ccccc2 Amb27236869 [0,1,0,1,0,0|1,0,1]=4 5236 B14R2.598 CC1=C(c2ccccc2)CC(=O)N1 Amb27401182 [0,1,0,1,0,0|1,0,1]=4 5237 B14R2.598 CC1=C(c2ccccc2)NC(=O)N1 Amb28186629 [0,1,0,1,0,0|2,0,0]=4 5238 B14R2.598 CC1=C(c2ccccc2)NC(=O)S1 Amb19078561 [0,1,0,1,0,0|1,1,0]=4 5239 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,1,0,1,0,0|1,0,1]=4 5240 B14R2.598 C[C@H]1OC(=O)N[C@H]1c2ccccc2 Amb4090301 [0,1,0,1,0,0|1,0,1]=4 5241 B14R2.598 Cc1cc(-c2ccccc2)c(N)o1 Amb27983008 [0,1,0,1,0,0|1,0,1]=4 5242 B14R2.598 Cc1cc(-c2ccccc2)n(C)n1 Amb25731051 [0,1,0,1,0,0|2,0,0]=4 5243 B14R2.598 Cc1nc(-c2ccccc2)c(C)o1 Amb26588240 [0,1,0,1,0,0|2,0,0]=4 5244 B14R2.598 Cc1oc(Cl)nc1-c2ccccc2 Amb27268201 [0,1,0,1,0,0|2,0,0]=4 5245 B14R2.598 Cc1oc(I)nc1-c2ccccc2 Amb27214111 [0,1,0,1,0,0|2,0,0]=4 5246 B14R2.598 Cc1sc(Br)cc1-c2ccccc2 Amb10600995 [0,1,0,1,0,0|1,1,0]=4 5247 B14R2.598 Cc1sc(N)cc1-c2ccccc2 Amb17096063 [0,1,0,1,0,0|1,1,0]=4 5248 B14R2.598 Cn1nc(Br)cc1-c2ccccc2 Amb27429069 [0,1,0,1,0,0|2,0,0]=4 5249 B14R2.598 Cn1nc(N)cc1-c2ccccc2 Amb18647737 [0,1,0,1,0,0|2,0,0]=4 5250 B14R2.598 O=C1C=C(c2ccccc2)C(=O)N1 Amb17334915 [0,1,0,1,0,0|1,0,1]=4 5251 B14R2.598 O=C1C=C(c2ccccc2)C(=O)O1 Amb2431774 [0,1,0,1,0,0|0,0,1]=3 5252 B14R2.598 O=C1C=C(c2ccccc2)C(O)O1 Amb28422312 [0,1,0,1,0,0|0,0,0]=2 5253 B14R2.598 Oc1oc(Br)cc1-c2ccccc2 Amb18732494 [0,1,0,1,0,0|1,0,1]=4 5254 B14R2.2899 O=C(OCc1ccccc1)C2CO2 Amb28240799 [0,1,0,1,0,0|1,0,1]=4 5255 B14R2.2899 O=C(\C=C/c1ccncc1)C2CC2 Amb27974604 [0,1,0,1,0,0|2,0,0]=4 5256 B14R2.2899 O=C(\C=C\c1ccccc1)C2CC2 Amb1796193 [0,1,0,1,0,0|1,0,0]=3 5257 B14R2.2899 O=C(\C=C\c1ccccn1)C2CC2 Amb28249412 [0,1,0,1,0,0|2,0,0]=4 5258 B14R2.2899 O=C(\C=C\c1ccncc1)C2CC2 Amb27878882 [0,1,0,1,0,0|2,0,0]=4 5259 B14R2.2899 O[C@@H](\C=C\c1ccccc1)[C@H]2CO2 Amb27432098 [0,1,0,1,0,0|0,0,2]=4 5260 B14R2.2899 O[C@H](\C=C\c1ccccc1)[C@@H]2CO2 Amb27805449 [0,1,0,1,0,0|0,0,2]=4 5261 B14R2.33858 CCOC(=O)C1Cc2ccccc21 Amb27872867 [0,1,0,1,0,0|0,0,2]=4 5262 B14R2.33858 COCC(=O)C1Cc2ccccc21 Amb27949917 [0,1,0,1,0,0|0,0,2]=4 5263 B14R2.447 CC1=C(c2ccccc2)C(Cl)C1=O Amb2612722 [0,1,0,1,0,0|1,0,1]=4 5264 B14R2.447 NC1=C(c2ccccc2)C(=O)C1=O Amb27984840 [0,1,0,1,0,0|2,0,0]=4 5265 B14R2.447 O=C1C(=O)C(c2ccccc2)=C1Cl Amb28121691 [0,1,0,1,0,0|2,0,0]=4 5266 B14R2.741 CC1=Cc2ccccc2C=CC1=O Amb21948167 [0,1,0,1,0,0|1,0,0]=3 5267 B14R2.741 CC1=Nc2ccccc2CNC1=O Amb27628340 [0,1,0,1,0,0|2,0,0]=4 5268 B14R2.972 C=CC(=O)c1cc2ccccc2s1 Amb25674040 [0,1,0,1,0,0|1,0,1]=4 5269 B14R2.972 CCC(=O)c1nc2ccccc2s1 Amb19649815 [0,1,0,1,0,0|2,0,0]=4 5270 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 Amb28249973 [0,1,0,1,0,0|1,0,0]=3 5271 B14R2.972 CNC(=O)c1cc2ccccc2o1 Amb1089716 [0,1,0,1,0,0|1,0,0]=3 5272 B14R2.972 CNC(=O)c1cc2ccccc2s1 Amb8330181 [0,1,0,1,0,0|1,0,0]=3 5273 B14R2.972 CNC(=O)c1cc2ccccn2n1 Amb33718817 [0,1,0,1,0,0|2,0,0]=4 5274 B14R2.972 CNC(=O)c1cn2ccccc2n1 Amb20668178 [0,1,0,1,0,0|2,0,0]=4 5275 B14R2.972 CNC(=O)c1nc2ccccc2o1 Amb27772628 [0,1,0,1,0,0|2,0,0]=4 5276 B14R2.972 CNC(=O)c1nc2ccccc2s1 Amb27604261 [0,1,0,1,0,0|2,0,0]=4 5277 B14R2.972 COC(=N)c1cc2ccccc2o1 Amb18180472 [0,1,0,1,0,0|1,0,0]=3 5278 B14R2.972 COC(=N)c1cn2ccccc2n1 Amb27594032 [0,1,0,1,0,0|2,0,0]=4 5279 B14R2.972 COC(=N)c1nc2ccccc2o1 Amb8428185 [0,1,0,1,0,0|2,0,0]=4 5280 B14R2.972 COC(=O)C1=CN2C=CC=CC2N1 Amb24058254 [0,1,0,1,0,0|1,0,1]=4 5281 B14R2.972 COC(=O)C1=Cc2ccccc2C1 Amb25776174 [0,1,0,1,0,0|0,0,0]=2 5282 B14R2.972 COC(=O)C1Cc2ccccc2C1 Amb21859222 [0,1,0,1,0,0|0,0,2]=4 5283 B14R2.972 COC(=O)C1Cc2ccccc2N1 Amb2724864 [0,1,0,1,0,0|0,0,2]=4 5284 B14R2.972 COC(=O)C1Cc2ccccc2N1 Amb33804592 [0,1,0,1,0,0|0,0,2]=4 5285 B14R2.972 COC(=O)C1Cc2ccccc2O1 Amb9246802 [0,1,0,1,0,0|0,0,2]=4 5286 B14R2.972 COC(=O)C1Oc2ccccc2O1 Amb9782874 [0,1,0,1,0,0|1,0,1]=4 5287 B14R2.972 COC(=O)N1Cc2ccccc2C1 Amb8439541 [0,1,0,1,0,0|1,0,1]=4 5288 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb18180641 [0,1,0,1,0,0|0,0,2]=4 5289 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb33716840 [0,1,0,1,0,0|0,0,2]=4 5290 B14R2.972 COC(=O)[C@H]1Cc2ccccc2N1 Amb25751911 [0,1,0,1,0,0|0,0,2]=4 5291 B14R2.972 COC(=O)c1cc2ccccc2o1 Amb2438530 [0,1,0,1,0,0|0,0,0]=2 5292 B14R2.972 COC(=O)c1cc2ccccc2s1 Amb1089421 [0,1,0,1,0,0|0,0,0]=2 5293 B14R2.972 COC(=O)c1cc2ccccn2c1 Amb19335913 [0,1,0,1,0,0|1,0,0]=3 5294 B14R2.972 COC(=O)c1cc2ccccn2n1 Amb10067445 [0,1,0,1,0,0|1,0,0]=3 5295 B14R2.972 COC(=O)c1cc2cccnc2s1 Amb10975342 [0,1,0,1,0,0|1,0,0]=3 5296 B14R2.972 COC(=O)c1cc2ccncc2s1 Amb20075908 [0,1,0,1,0,0|1,0,0]=3 5297 B14R2.972 COC(=O)c1cc2cnccc2s1 Amb25897258 [0,1,0,1,0,0|1,0,0]=3 5298 B14R2.972 COC(=O)c1cc2cnccn2c1 Amb28289810 [0,1,0,1,0,0|2,0,0]=4 5299 B14R2.972 COC(=O)c1cc2cncnc2s1 Amb26449250 [0,1,0,1,0,0|2,0,0]=4 5300 B14R2.972 COC(=O)c1cc2ncccc2s1 Amb9677683 [0,1,0,1,0,0|1,0,0]=3 5301 B14R2.972 COC(=O)c1cc2ncccn2n1 Amb33527274 [0,1,0,1,0,0|2,0,0]=4 5302 B14R2.972 COC(=O)c1cc2nccnc2s1 Amb24179185 [0,1,0,1,0,0|2,0,0]=4 5303 B14R2.972 COC(=O)c1cn2cccnc2n1 Amb9173752 [0,1,0,1,0,0|2,0,0]=4 5304 B14R2.972 COC(=O)c1cn2ccncc2n1 Amb22898996 [0,1,0,1,0,0|2,0,0]=4 5305 B14R2.972 COC(=O)c1nc2ccccc2o1 Amb19958887 [0,1,0,1,0,0|1,0,0]=3 5306 B14R2.972 COC(=O)c1nc2cccnc2s1 Amb24394990 [0,1,0,1,0,0|2,0,0]=4 5307 B14R2.972 COC(=O)c1nc2ccncc2s1 Amb27868791 [0,1,0,1,0,0|2,0,0]=4 5308 B14R2.972 COC(=O)c1nc2cnccc2s1 Amb25697585 [0,1,0,1,0,0|2,0,0]=4 5309 B14R2.972 COC(=O)c1nc2ncccc2o1 Amb28434849 [0,1,0,1,0,0|2,0,0]=4 5310 B14R2.972 COC(=S)c1cc2ccccc2o1 Amb27670058 [0,1,0,1,0,0|0,1,0]=3 5311 B14R2.972 CSC(=O)c1cc2ccccc2s1 Amb27966177 [0,1,0,1,0,0|0,1,0]=3 5312 B14R2.972 NCC(=O)c1cc2ccccc2o1 Amb7094329 [0,1,0,1,0,0|2,0,0]=4 5313 B14R2.972 NCC(=O)c1cc2ccccc2s1 Amb25900376 [0,1,0,1,0,0|2,0,0]=4 5314 B14R2.972 NCC(=O)c1cc2ccccc2s1 Amb32674584 [0,1,0,1,0,0|2,0,0]=4 5315 B14R2.972 NNC(=O)c1cc2ccccc2o1 Amb1830252 [0,1,0,1,0,0|2,0,0]=4 5316 B14R2.972 NNC(=O)c1cc2ccccc2s1 Amb2722617 [0,1,0,1,0,0|2,0,0]=4 5317 B14R2.972 O=C(CBr)c1cc2ccccc2o1 Amb1103621 [0,1,0,1,0,0|2,0,0]=4 5318 B14R2.972 O=C(CBr)c1cc2ccccc2s1 Amb2723177 [0,1,0,1,0,0|2,0,0]=4 5319 B14R2.972 O=C(CCl)c1cc2ccccc2o1 Amb5559104 [0,1,0,1,0,0|2,0,0]=4 5320 B14R2.972 O=C(CO)c1cc2ccccc2o1 Amb18808836 [0,1,0,1,0,0|2,0,0]=4 5321 B14R2.972 O=C(CO)c1cc2ccccc2s1 Amb27462459 [0,1,0,1,0,0|2,0,0]=4 5322 B14R2.972 O=C(NO)c1cc2ccccc2o1 Amb6279288 [0,1,0,1,0,0|2,0,0]=4 5323 B14R2.972 O=CC(=O)c1cc2ccccc2o1 Amb10067948 [0,1,0,1,0,0|2,0,0]=4 5324 B14R2.972 O=CC(=O)c1cc2ccccc2o1 Amb18825262 [0,1,0,1,0,0|2,0,0]=4 5325 B14R2.972 O=CC(=O)c1cc2ccccc2s1 Amb10067949 [0,1,0,1,0,0|2,0,0]=4 5326 B14R2.972 O=CC(=O)c1cc2ccccc2s1 Amb20671215 [0,1,0,1,0,0|2,0,0]=4 5327 B14R2.1128 CCc1cc2ccccc2cc1Br Amb32650448 [0,1,0,1,0,0|2,0,0]=4 5328 B14R2.1128 CCc1cc2ccccc2cc1Cl Amb32650447 [0,1,0,1,0,0|2,0,0]=4 5329 B14R2.1128 CCc1cc2ccccc2cc1O Amb25059607 [0,1,0,1,0,0|2,0,0]=4 5330 B14R2.1128 CCc1nc2ccccc2cc1Br Amb32695576 [0,1,0,1,0,0|2,0,0]=4 5331 B14R2.1128 CCc1nc2ccccc2cc1N Amb26336609 [0,1,0,1,0,0|2,0,0]=4 5332 B14R2.1128 CCc1nc2ccccc2cc1O Amb24749839 [0,1,0,1,0,0|2,0,0]=4 5333 B14R2.1128 CNc1nc2ccccc2cc1C Amb27205570 [0,1,0,1,0,0|2,0,0]=4 5334 B14R2.1128 CNc1nc2ccccc2cc1N Amb27415570 [0,1,0,1,0,0|2,0,0]=4 5335 B14R2.1128 COC1=Cc2ccccc2OC1=O Amb23512578 [0,1,0,1,0,0|2,0,0]=4 5336 B14R2.1128 COc1cc2ccccc2cc1Br Amb22445934 [0,1,0,1,0,0|1,0,0]=3 5337 B14R2.1128 COc1cc2ccccc2cc1C Amb24415328 [0,1,0,1,0,0|1,0,0]=3 5338 B14R2.1128 COc1cc2ccccc2cc1Cl Amb24735700 [0,1,0,1,0,0|1,0,0]=3 5339 B14R2.1128 COc1cc2ccccc2cc1I Amb26595184 [0,1,0,1,0,0|1,0,0]=3 5340 B14R2.1128 COc1cc2ccccc2cc1N Amb18127045 [0,1,0,1,0,0|1,0,0]=3 5341 B14R2.1128 COc1cc2ccccc2cc1O Amb6358072 [0,1,0,1,0,0|1,0,0]=3 5342 B14R2.1128 COc1cc2ccccc2nc1Br Amb25739600 [0,1,0,1,0,0|2,0,0]=4 5343 B14R2.1128 COc1cc2ccccc2nc1Cl Amb24534649 [0,1,0,1,0,0|2,0,0]=4 5344 B14R2.1128 COc1cc2ccccc2nc1O Amb2612889 [0,1,0,1,0,0|2,0,0]=4 5345 B14R2.1128 COc1cc2cccnc2cc1Br Amb23437339 [0,1,0,1,0,0|2,0,0]=4 5346 B14R2.1128 COc1cc2cccnc2cc1C Amb22886999 [0,1,0,1,0,0|2,0,0]=4 5347 B14R2.1128 COc1cc2cccnc2cc1Cl Amb23401102 [0,1,0,1,0,0|2,0,0]=4 5348 B14R2.1128 COc1cc2cccnc2cc1F Amb19957347 [0,1,0,1,0,0|2,0,0]=4 5349 B14R2.1128 COc1cc2cccnc2cc1I Amb23400929 [0,1,0,1,0,0|2,0,0]=4 5350 B14R2.1128 COc1cc2cccnc2cc1N Amb24565737 [0,1,0,1,0,0|2,0,0]=4 5351 B14R2.1128 COc1cc2ccncc2cc1Br Amb25999152 [0,1,0,1,0,0|2,0,0]=4 5352 B14R2.1128 COc1cc2ccncc2cc1O Amb33528714 [0,1,0,1,0,0|2,0,0]=4 5353 B14R2.1128 COc1cc2cnccc2cc1Br Amb25771927 [0,1,0,1,0,0|2,0,0]=4 5354 B14R2.1128 COc1cc2cnccc2cc1F Amb25697053 [0,1,0,1,0,0|2,0,0]=4 5355 B14R2.1128 COc1cc2cnccc2cc1I Amb24566749 [0,1,0,1,0,0|2,0,0]=4 5356 B14R2.1128 COc1cc2cnccc2cc1N Amb18197674 [0,1,0,1,0,0|2,0,0]=4 5357 B14R2.1128 COc1cc2ncccc2cc1Br Amb30594112 [0,1,0,1,0,0|2,0,0]=4 5358 B14R2.1128 COc1cc2ncccc2cc1C Amb25869889 [0,1,0,1,0,0|2,0,0]=4 5359 B14R2.1128 COc1cc2ncccc2cc1F Amb27593053 [0,1,0,1,0,0|2,0,0]=4 5360 B14R2.1128 COc1cc2ncccc2cc1N Amb24427333 [0,1,0,1,0,0|2,0,0]=4 5361 B14R2.1128 COc1nc2ccccc2cc1Br Amb10608360 [0,1,0,1,0,0|1,0,0]=3 5362 B14R2.1128 COc1nc2ccccc2cc1Cl Amb24533657 [0,1,0,1,0,0|1,0,0]=3 5363 B14R2.1128 COc1nc2ccccc2cc1N Amb27179996 [0,1,0,1,0,0|1,0,0]=3 5364 B14R2.1128 COc1nc2ccccc2cc1O Amb27476171 [0,1,0,1,0,0|1,0,0]=3 5365 B14R2.1128 COc1nc2ccccc2cc1S Amb32729752 [0,1,0,1,0,0|1,0,0]=3 5366 B14R2.1128 COc1nc2ccccc2nc1Cl Amb8386355 [0,1,0,1,0,0|2,0,0]=4 5367 B14R2.1128 COc1nc2ccccc2nc1F Amb35593850 [0,1,0,1,0,0|2,0,0]=4 5368 B14R2.1128 COc1nc2ccccc2nc1I Amb28051615 [0,1,0,1,0,0|2,0,0]=4 5369 B14R2.1128 COc1nc2ccccc2nc1N Amb18127415 [0,1,0,1,0,0|2,0,0]=4 5370 B14R2.1128 COc1nc2cccnc2cc1Br Amb34931281 [0,1,0,1,0,0|2,0,0]=4 5371 B14R2.1128 COc1nc2ncccc2cc1N Amb32424340 [0,1,0,1,0,0|2,0,0]=4 5372 B14R2.1128 CSc1nc2ccccc2cc1Br Amb27209717 [0,1,0,1,0,0|1,1,0]=4 5373 B14R2.8188 CC1=Cc2ccccc2N(C)C1=O Amb22904186 [0,1,0,1,0,0|1,0,0]=3 5374 B14R2.8188 CC1=Nc2ccccc2N(C)C1=O Amb19652902 [0,1,0,1,0,0|2,0,0]=4 5375 B14R2.8188 CN1C(=O)C(=O)Nc2ccccc21 Amb19516760 [0,1,0,1,0,0|2,0,0]=4 5376 B14R2.8188 CN1C(=O)C(Br)=Cc2ccccc21 Amb20246919 [0,1,0,1,0,0|1,0,0]=3 5377 B14R2.8188 CN1C(=O)C(F)=Cc2ccccc21 Amb22547226 [0,1,0,1,0,0|1,0,0]=3 5378 B14R2.8188 CN1C(=O)C(N)=Cc2ccccc21 Amb18065259 [0,1,0,1,0,0|1,0,0]=3 5379 B14R2.8188 Cc1c(O)cc2ccccc2c1C Amb24309351 [0,1,0,1,0,0|2,0,0]=4 5380 B14R2.8188 Cc1cc2ccccc2c(C)c1C Amb6296864 [0,1,0,1,0,0|2,0,0]=4 5381 B14R2.8188 Cn1c(=O)c(N)nc2ccccc21 Amb8439682 [0,1,0,1,0,0|2,0,0]=4 5382 B14R2.8188 NC1=Cc2ccccc2N(O)C1=O Amb27244820 [0,1,0,1,0,0|2,0,0]=4 5383 B14R2.8188 O=C1C(=O)c2ccccc2C=C1Cl Amb27404598 [0,1,0,1,0,0|2,0,0]=4 5384 B14R2.8188 O=C1C(=O)c2ccccc2C=C1O Amb17594373 [0,1,0,1,0,0|2,0,0]=4 5385 B14R2.9592 C\C(=C/c1ccccc1)C2(C)CO2 Amb33380914 [0,1,0,1,0,0|1,0,1]=4 5386 B14R2.10659 COC(=O)C1(C)Cc2ccccc21 Amb25341517 [0,1,0,1,0,0|0,0,2]=4 5387 B14R2.403 O=S1(=O)C=C(c2ccccc2)CC1 Amb2797391 [0,1,0,1,0,0|2,0,0]=4 5388 B14R2.3492 O=CC1(\C=C\c2ccccc2)CC1 Amb33081324 [0,1,0,1,0,0|1,0,1]=4 5389 B14R2.743 CC1(N)C(=O)C=Cc2ccccc21 Amb27400286 [0,1,0,1,0,0|1,0,0]=3 5390 B14R2.743 CC1(O)C(=O)C=Cc2ccccc21 Amb4006659 [0,1,0,1,0,0|1,0,0]=3 5391 B14R2.743 O=C1C=Cc2ccccc2C1(Cl)Cl Amb28370028 [0,1,0,1,0,0|2,0,0]=4 5392 B14R2.781 C=C(C)c1ccc2ccccc2c1 Amb6360067 [0,1,0,1,0,0|2,0,0]=4 5393 B14R2.781 C=C(C)c1ccc2ccccc2n1 Amb26451445 [0,1,0,1,0,0|2,0,0]=4 5394 B14R2.781 CC(=O)c1ccc2ccccc2c1 Amb752737 [0,1,0,1,0,0|2,0,0]=4 5395 B14R2.781 CC(=O)c1ccc2ccccc2n1 Amb5494070 [0,1,0,1,0,0|2,0,0]=4 5396 B14R2.781 CC(Br)c1ccc2ccccc2c1 Amb8835394 [0,1,0,1,0,0|2,0,0]=4 5397 B14R2.781 CC(C)c1ccc2ccccc2c1 Amb2720809 [0,1,0,1,0,0|2,0,0]=4 5398 B14R2.781 CC(C)c1ccc2ccccc2n1 Amb24715817 [0,1,0,1,0,0|2,0,0]=4 5399 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb1211899 [0,1,0,1,0,0|2,0,0]=4 5400 B14R2.781 CC(N)c1ccc2ccccc2c1 Amb6239355 [0,1,0,1,0,0|2,0,0]=4 5401 B14R2.781 CC(N)c1ccc2ccccc2n1 Amb24548779 [0,1,0,1,0,0|2,0,0]=4 5402 B14R2.781 CC(O)c1ccc2ccccc2c1 Amb9748274 [0,1,0,1,0,0|2,0,0]=4 5403 B14R2.781 CC(O)c1ccc2ccccc2n1 Amb25215245 [0,1,0,1,0,0|2,0,0]=4 5404 B14R2.781 CC(S)c1ccc2ccccc2c1 Amb7784705 [0,1,0,1,0,0|2,0,0]=4 5405 B14R2.781 CN(C)c1ccc2ccccc2c1 Amb22228802 [0,1,0,1,0,0|2,0,0]=4 5406 B14R2.781 CN(C)c1ccc2ccccc2n1 Amb4010061 [0,1,0,1,0,0|2,0,0]=4 5407 B14R2.781 CS(=O)c1ccc2ccccc2c1 Amb10553605 [0,1,0,1,0,0|1,1,0]=4 5408 B14R2.781 C[C@@H](Cl)c1ccc2ccccc2c1 Amb27858415 [0,1,0,1,0,0|2,0,0]=4 5409 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb13951472 [0,1,0,1,0,0|2,0,0]=4 5410 B14R2.781 C[C@@H](N)c1ccc2ccccc2c1 Amb3941411 [0,1,0,1,0,0|2,0,0]=4 5411 B14R2.781 C[C@@H](N)c1ccc2ccccc2n1 Amb27187332 [0,1,0,1,0,0|2,0,0]=4 5412 B14R2.781 C[C@@H](O)c1ccc2ccccc2c1 Amb10844722 [0,1,0,1,0,0|2,0,0]=4 5413 B14R2.781 C[C@@H](O)c1ccc2ccccc2n1 Amb25839820 [0,1,0,1,0,0|2,0,0]=4 5414 B14R2.781 C[C@H](N)c1ccc2ccccc2c1 Amb2611666 [0,1,0,1,0,0|2,0,0]=4 5415 B14R2.781 C[C@H](N)c1ccc2ccccc2n1 Amb24711720 [0,1,0,1,0,0|2,0,0]=4 5416 B14R2.781 C[C@H](O)c1ccc2ccccc2c1 Amb4605849 [0,1,0,1,0,0|2,0,0]=4 5417 B14R2.781 C[C@H](O)c1ccc2ccccc2n1 Amb26943845 [0,1,0,1,0,0|2,0,0]=4 5418 B14R2.92 CCC1=CNc2ccccc2C1=O Amb27180179 [0,1,0,1,0,0|2,0,0]=4 5419 B14R2.92 CNc1ccc2ccccc2c1N Amb17594325 [0,1,0,1,0,0|2,0,0]=4 5420 B14R2.92 COC1=CNc2ccccc2C1=O Amb25679917 [0,1,0,1,0,0|1,0,0]=3 5421 B14R2.92 CO[C@@H]1C=Cc2ccccc2[C@@H]1O Amb27197147 [0,1,0,1,0,0|0,0,2]=4 5422 B14R2.92 COc1ccc2ccccc2c1Br Amb2618563 [0,1,0,1,0,0|1,0,0]=3 5423 B14R2.92 COc1ccc2ccccc2c1C Amb17743960 [0,1,0,1,0,0|1,0,0]=3 5424 B14R2.92 COc1ccc2ccccc2c1F Amb28185351 [0,1,0,1,0,0|1,0,0]=3 5425 B14R2.92 COc1ccc2ccccc2c1I Amb2477152 [0,1,0,1,0,0|1,0,0]=3 5426 B14R2.92 COc1ccc2ccccc2c1N Amb17200200 [0,1,0,1,0,0|1,0,0]=3 5427 B14R2.92 COc1ccc2ccccc2c1S Amb32732685 [0,1,0,1,0,0|0,1,0]=3 5428 B14R2.92 COc1ccc2cccnc2c1Br Amb16226757 [0,1,0,1,0,0|2,0,0]=4 5429 B14R2.92 COc1ccc2cccnc2c1C Amb32651814 [0,1,0,1,0,0|2,0,0]=4 5430 B14R2.92 COc1ccc2cccnc2c1Cl Amb23437321 [0,1,0,1,0,0|2,0,0]=4 5431 B14R2.92 COc1ccc2cccnc2c1F Amb23403105 [0,1,0,1,0,0|2,0,0]=4 5432 B14R2.92 COc1ccc2cccnc2c1I Amb23400932 [0,1,0,1,0,0|2,0,0]=4 5433 B14R2.92 COc1ccc2cccnc2c1N Amb20621536 [0,1,0,1,0,0|2,0,0]=4 5434 B14R2.92 COc1ccc2cccnc2c1O Amb26880905 [0,1,0,1,0,0|1,0,1]=4 5435 B14R2.92 COc1ccc2ccncc2c1Br Amb19100699 [0,1,0,1,0,0|2,0,0]=4 5436 B14R2.92 COc1ccc2ccncc2c1I Amb2613187 [0,1,0,1,0,0|2,0,0]=4 5437 B14R2.92 COc1ccc2ccncc2c1N Amb8010681 [0,1,0,1,0,0|2,0,0]=4 5438 B14R2.92 COc1ccc2cnccc2c1Br Amb19100700 [0,1,0,1,0,0|2,0,0]=4 5439 B14R2.92 COc1ccc2cnccc2c1N Amb24062940 [0,1,0,1,0,0|2,0,0]=4 5440 B14R2.92 COc1ccc2cnccc2c1O Amb27954682 [0,1,0,1,0,0|1,0,1]=4 5441 B14R2.92 COc1ccc2ncccc2c1Br Amb18354242 [0,1,0,1,0,0|2,0,0]=4 5442 B14R2.92 COc1ccc2ncccc2c1C Amb35789585 [0,1,0,1,0,0|2,0,0]=4 5443 B14R2.92 COc1ccc2ncccc2c1Cl Amb23437324 [0,1,0,1,0,0|2,0,0]=4 5444 B14R2.92 COc1ccc2ncccc2c1I Amb23403115 [0,1,0,1,0,0|2,0,0]=4 5445 B14R2.92 COc1ccc2ncccc2c1N Amb9676517 [0,1,0,1,0,0|2,0,0]=4 5446 B14R2.92 COc1ccc2ncccc2c1O Amb18127369 [0,1,0,1,0,0|1,0,1]=4 5447 B14R2.92 COc1cnc2ccccc2[n+]1[O-] Amb27231680 [0,1,0,1,0,0|1,0,1]=4 5448 B14R2.92 COc1cnc2ccccc2c1Br Amb27405335 [0,1,0,1,0,0|2,0,0]=4 5449 B14R2.92 COc1cnc2ccccc2c1N Amb18127237 [0,1,0,1,0,0|2,0,0]=4 5450 B14R2.92 CSC1=COc2ccccc2C1=O Amb28242942 [0,1,0,1,0,0|1,1,0]=4 5451 B14R2.92 CSc1ccc2ccccc2c1N Amb27407738 [0,1,0,1,0,0|1,1,0]=4 5452 B14R2.92 C[n+]1c(NN)ccc2ccccc21 Amb27869603 [0,1,0,1,0,0|2,0,0]=4 5453 B14R2.92 Cc1c(C#N)ccc2ccccc12 Amb17594178 [0,1,0,1,0,0|2,0,0]=4 5454 B14R2.92 Cc1c(C=O)ccc2ccccc12 Amb17594259 [0,1,0,1,0,0|1,0,0]=3 5455 B14R2.92 Cc1c(CBr)ccc2ccccc12 Amb27180973 [0,1,0,1,0,0|2,0,0]=4 5456 B14R2.92 Cc1c(CCl)ccc2ccccc12 Amb25927087 [0,1,0,1,0,0|2,0,0]=4 5457 B14R2.92 Cc1c(CN)ccc2ccccc12 Amb25815347 [0,1,0,1,0,0|2,0,0]=4 5458 B14R2.92 Nc1c(C=O)ccc2ccccc12 Amb27389594 [0,1,0,1,0,0|2,0,0]=4 5459 B14R2.92 O=C1\C(=N\O)C=Cc2ccccc21 Amb22489656 [0,1,0,1,0,0|2,0,0]=4 5460 B14R2.92 O=Cc1ccc2ccccc2[n+]1[O-] Amb9776106 [0,1,0,1,0,0|2,0,0]=4 5461 B14R2.92 O=Cc1ccc2ccccc2c1Br Amb3939652 [0,1,0,1,0,0|2,0,0]=4 5462 B14R2.92 O=Cc1ccc2ccccc2c1Cl Amb8388177 [0,1,0,1,0,0|2,0,0]=4 5463 B14R2.92 O=Cc1ccc2ccccc2c1F Amb8388176 [0,1,0,1,0,0|2,0,0]=4 5464 B14R2.92 O=Cc1ccc2ccccc2c1I Amb27647571 [0,1,0,1,0,0|2,0,0]=4 5465 B14R2.92 O=Cc1ccc2ccccc2c1O Amb4007826 [0,1,0,1,0,0|2,0,0]=4 5466 B14R2.92 O=Nc1ccc2ccccc2c1O Amb6357361 [0,1,0,1,0,0|2,0,0]=4 5467 B14R2.92 [N-]=[N+]=C1C=Cc2ccccc2C1=O Amb25758125 [0,1,0,1,0,0|2,0,0]=4 5468 B14R2.16831 COC1(C=O)C=Nc2ccccc21 Amb8629084 [0,1,0,1,0,0|1,0,1]=4 5469 B14R2.256 Cc1cc(-c2ccccc2Br)no1 Amb24461615 [0,1,0,1,0,0|2,0,0]=4 5470 B14R2.256 Cc1cc(-c2ccccc2Cl)no1 Amb8629179 [0,1,0,1,0,0|2,0,0]=4 5471 B14R2.256 Cc1ccccc1-c2cc(Cl)on2 Amb27160743 [0,1,0,1,0,0|2,0,0]=4 5472 B14R2.256 Cc1ccccc1-c2cc(N)on2 Amb33528098 [0,1,0,1,0,0|2,0,0]=4 5473 B14R2.256 Cc1ccccc1-c2cc(O)on2 Amb20672902 [0,1,0,1,0,0|1,0,1]=4 5474 B14R2.256 Cc1ccccc1-c2coc(Br)c2 Amb10600645 [0,1,0,1,0,0|1,0,1]=4 5475 B14R2.256 Cc1ccccc1-c2coc(N)c2 Amb10600646 [0,1,0,1,0,0|1,0,1]=4 5476 B14R2.256 Cc1ccccc1C2=CC(=O)CC2 Amb17138687 [0,1,0,1,0,0|1,0,0]=3 5477 B14R2.256 Cc1ccccc1C2=NOC(=O)N2 Amb19372941 [0,1,0,1,0,0|2,0,0]=4 5478 B14R2.256 Cc1ccccc1C2COC(=O)C2 Amb33495540 [0,1,0,1,0,0|0,0,2]=4 5479 B14R2.256 Cc1ccccc1C2COC(=O)N2 Amb28140244 [0,1,0,1,0,0|1,0,1]=4 5480 B14R2.256 Clc1cc(-c2ccccc2Cl)no1 Amb27643507 [0,1,0,1,0,0|2,0,0]=4 5481 B14R2.256 Fc1ccccc1-c2cc(Br)on2 Amb27753707 [0,1,0,1,0,0|2,0,0]=4 5482 B14R2.256 Fc1ccccc1-c2cc(Cl)on2 Amb27759943 [0,1,0,1,0,0|2,0,0]=4 5483 B14R2.256 Fc1ccccc1-c2coc(Br)c2 Amb10600647 [0,1,0,1,0,0|1,0,1]=4 5484 B14R2.256 Nc1cc(-c2ccccc2Br)no1 Amb5328871 [0,1,0,1,0,0|2,0,0]=4 5485 B14R2.256 Nc1cc(-c2ccccc2Cl)no1 Amb33528102 [0,1,0,1,0,0|2,0,0]=4 5486 B14R2.256 Nc1cc(-c2ccccc2F)co1 Amb10600648 [0,1,0,1,0,0|1,0,1]=4 5487 B14R2.256 Nc1cc(-c2ccccc2F)no1 Amb5328872 [0,1,0,1,0,0|2,0,0]=4 5488 B14R2.256 Nc1cc(-c2ccccc2I)no1 Amb33528097 [0,1,0,1,0,0|2,0,0]=4 5489 B14R2.256 Nc1cc(-c2ccccc2O)no1 Amb18647949 [0,1,0,1,0,0|2,0,0]=4 5490 B14R2.256 Nc1ccccc1C2=CC(=O)ON2 Amb27441291 [0,1,0,1,0,0|1,0,0]=3 5491 B14R2.256 O=C1C=C(c2ccccc2Br)CC1 Amb18071045 [0,1,0,1,0,0|1,0,0]=3 5492 B14R2.256 O=C1C=C(c2ccccc2Cl)CC1 Amb17139380 [0,1,0,1,0,0|1,0,0]=3 5493 B14R2.256 O=C1C=C(c2ccccc2F)CC1 Amb17138771 [0,1,0,1,0,0|1,0,0]=3 5494 B14R2.256 O=C1C=C(c2ccccc2O)NO1 Amb27211094 [0,1,0,1,0,0|1,0,0]=3 5495 B14R2.256 O=C1C=C(c2ccccc2O)ON1 Amb27641862 [0,1,0,1,0,0|2,0,0]=4 5496 B14R2.256 O=C1CC(c2ccccc2Br)CO1 Amb33495543 [0,1,0,1,0,0|0,0,2]=4 5497 B14R2.256 O=C1CC(c2ccccc2Cl)=NO1 Amb25817486 [0,1,0,1,0,0|1,0,1]=4 5498 B14R2.256 O=C1CC(c2ccccc2Cl)CO1 Amb33495542 [0,1,0,1,0,0|0,0,2]=4 5499 B14R2.256 O=C1CC(c2ccccc2F)CO1 Amb33495541 [0,1,0,1,0,0|0,0,2]=4 5500 B14R2.256 O=C1CC(c2ccccc2O)CO1 Amb28054441 [0,1,0,1,0,0|0,0,2]=4 5501 B14R2.256 O=C1NC(c2ccccc2Br)CO1 Amb25061795 [0,1,0,1,0,0|1,0,1]=4 5502 B14R2.256 O=C1NC(c2ccccc2Cl)=NO1 Amb18321585 [0,1,0,1,0,0|2,0,0]=4 5503 B14R2.256 O=C1NC(c2ccccc2Cl)CO1 Amb24714277 [0,1,0,1,0,0|1,0,1]=4 5504 B14R2.256 O=C1NC(c2ccccc2F)CO1 Amb24642133 [0,1,0,1,0,0|1,0,1]=4 5505 B14R2.256 O=C1NC(c2ccccc2I)CO1 Amb27762387 [0,1,0,1,0,0|1,0,1]=4 5506 B14R2.256 O=C1NC(c2ccccc2O)CO1 Amb27970497 [0,1,0,1,0,0|1,0,1]=4 5507 B14R2.256 O=C1N[C@@H](c2ccccc2Cl)CO1 Amb27405997 [0,1,0,1,0,0|1,0,1]=4 5508 B14R2.256 O=C1N[C@H](c2ccccc2I)CO1 Amb28386512 [0,1,0,1,0,0|1,0,1]=4 5509 B14R2.256 O=C1N[C@H](c2ccccc2O)CO1 Amb27273373 [0,1,0,1,0,0|1,0,1]=4 5510 B14R2.256 Oc1cc(-c2ccccc2Br)no1 Amb20672940 [0,1,0,1,0,0|1,0,1]=4 5511 B14R2.256 Oc1cc(-c2ccccc2Cl)no1 Amb20672919 [0,1,0,1,0,0|1,0,1]=4 5512 B14R2.256 Oc1cc(-c2ccccc2F)no1 Amb20672910 [0,1,0,1,0,0|1,0,1]=4 5513 B14R2.256 Oc1cc(-c2ccccc2I)no1 Amb33624408 [0,1,0,1,0,0|1,0,1]=4 5514 B14R2.1801 CCc1ccc2c(N)cccc2n1 Amb25712154 [0,1,0,1,0,0|2,0,0]=4 5515 B14R2.1801 COc1cc2cccc(N)c2cn1 Amb25898312 [0,1,0,1,0,0|2,0,0]=4 5516 B14R2.1801 COc1ccc2c(Br)cccc2n1 Amb18157722 [0,1,0,1,0,0|1,0,0]=3 5517 B14R2.1801 COc1ccc2c(Br)ccnc2c1 Amb9134337 [0,1,0,1,0,0|2,0,0]=4 5518 B14R2.1801 COc1ccc2c(Br)nccc2c1 Amb18062821 [0,1,0,1,0,0|2,0,0]=4 5519 B14R2.1801 COc1ccc2c(C)cccc2c1 Amb23448322 [0,1,0,1,0,0|1,0,0]=3 5520 B14R2.1801 COc1ccc2c(C)ccnc2c1 Amb20240028 [0,1,0,1,0,0|2,0,0]=4 5521 B14R2.1801 COc1ccc2c(C)ccnc2c1 Amb8496543 [0,1,0,1,0,0|2,0,0]=4 5522 B14R2.1801 COc1ccc2c(C)nccc2c1 Amb24580619 [0,1,0,1,0,0|2,0,0]=4 5523 B14R2.1801 COc1ccc2c(C)nccc2n1 Amb27953781 [0,1,0,1,0,0|2,0,0]=4 5524 B14R2.1801 COc1ccc2c(Cl)cccc2c1 Amb24330978 [0,1,0,1,0,0|1,0,0]=3 5525 B14R2.1801 COc1ccc2c(Cl)ccnc2c1 Amb1994639 [0,1,0,1,0,0|2,0,0]=4 5526 B14R2.1801 COc1ccc2c(Cl)nccc2c1 Amb10603410 [0,1,0,1,0,0|2,0,0]=4 5527 B14R2.1801 COc1ccc2c(F)cccc2c1 Amb24330977 [0,1,0,1,0,0|1,0,0]=3 5528 B14R2.1801 COc1ccc2c(F)nccc2c1 Amb28202693 [0,1,0,1,0,0|2,0,0]=4 5529 B14R2.1801 COc1ccc2c(N)cccc2n1 Amb18127236 [0,1,0,1,0,0|1,0,0]=3 5530 B14R2.1801 COc1ccc2c(N)ccnc2c1 Amb1994611 [0,1,0,1,0,0|2,0,0]=4 5531 B14R2.1801 COc1ccc2c(N)nccc2c1 Amb17216965 [0,1,0,1,0,0|2,0,0]=4 5532 B14R2.1801 COc1ccc2c(N)nccc2n1 Amb27217962 [0,1,0,1,0,0|2,0,0]=4 5533 B14R2.1801 COc1ccc2c(O)cccc2c1 Amb10603866 [0,1,0,1,0,0|1,0,0]=3 5534 B14R2.1801 COc1ccc2c(O)cccc2n1 Amb25735678 [0,1,0,1,0,0|1,0,0]=3 5535 B14R2.1801 COc1ccc2c(O)ccnc2c1 Amb1994268 [0,1,0,1,0,0|2,0,0]=4 5536 B14R2.1801 COc1ccc2c(O)nccc2c1 Amb18560322 [0,1,0,1,0,0|2,0,0]=4 5537 B14R2.1801 COc1ccc2c(c1)C=CNC2=O Amb18034940 [0,1,0,1,0,0|2,0,0]=4 5538 B14R2.1801 COc1ccc2c(c1)CC=CC2=O Amb21952654 [0,1,0,1,0,0|1,0,1]=4 5539 B14R2.1801 COc1ccc2c(c1)NC=CC2=O Amb22234843 [0,1,0,1,0,0|2,0,0]=4 5540 B14R2.1801 COc1ccc2c(c1)NC=CC2=S Amb24109680 [0,1,0,1,0,0|2,0,0]=4 5541 B14R2.1801 COc1ccc2c(c1)OC=CC2=O Amb19894750 [0,1,0,1,0,0|2,0,0]=4 5542 B14R2.1801 COc1ccc2c(ccc[n+]2C)c1 Amb8503643 [0,1,0,1,0,0|2,0,0]=4 5543 B14R2.1801 COc1cnc2c(Br)cccc2c1 Amb27623928 [0,1,0,1,0,0|2,0,0]=4 5544 B14R2.1801 COc1cnc2c(Cl)cccc2n1 Amb27200750 [0,1,0,1,0,0|2,0,0]=4 5545 B14R2.1801 COc1cnc2c(N)cccc2c1 Amb24183789 [0,1,0,1,0,0|2,0,0]=4 5546 B14R2.1801 COc1cnc2c(N)cccc2n1 Amb25044226 [0,1,0,1,0,0|2,0,0]=4 5547 B14R2.1801 COc1cnc2c(O)cccc2c1 Amb25852325 [0,1,0,1,0,0|2,0,0]=4 5548 B14R2.1801 COc1ncc2c(Br)cccc2n1 Amb18157411 [0,1,0,1,0,0|2,0,0]=4 5549 B14R2.8038 CN1C(=O)C=CC2=C1C=CNC2=O Amb23592126 [0,1,0,1,0,0|2,0,0]=4 5550 B14R2.8038 CN1C(=O)C=Cc2c(Br)cccc21 Amb26331987 [0,1,0,1,0,0|1,0,0]=3 5551 B14R2.8038 CN1C(=O)C=Cc2c(F)cccc21 Amb23448941 [0,1,0,1,0,0|1,0,0]=3 5552 B14R2.8038 CN1C(=O)C=Cc2c(N)cccc21 Amb28243197 [0,1,0,1,0,0|1,0,0]=3 5553 B14R2.8038 CN1C(=O)C=Cc2c(N)cccc21 Amb32664671 [0,1,0,1,0,0|1,0,0]=3 5554 B14R2.8038 CN1C(=O)C=Cc2c(O)cccc21 Amb26476600 [0,1,0,1,0,0|1,0,0]=3 5555 B14R2.8038 CN1C(=O)C=Cc2c1ccnc2Cl Amb23592151 [0,1,0,1,0,0|2,0,0]=4 5556 B14R2.8038 CN1C(=O)C=Cc2c1ccnc2N Amb23592153 [0,1,0,1,0,0|2,0,0]=4 5557 B14R2.8038 CN1C(=O)C=Nc2c(Br)cccc21 Amb27394228 [0,1,0,1,0,0|2,0,0]=4 5558 B14R2.8038 CN1C(=O)C=Nc2c(F)cccc21 Amb27180485 [0,1,0,1,0,0|2,0,0]=4 5559 B14R2.8038 Cc1ccc2c(C)cccc2c1C Amb16192708 [0,1,0,1,0,0|2,0,0]=4 5560 B14R2.8038 Cc1ccnc2c1C=CC(=O)N2C Amb27946259 [0,1,0,1,0,0|2,0,0]=4 5561 B14R3.5352 O=C1C(=O)C2=C1c3ccccc32 Amb27948619 [0,0,0,2,0,0|2,0,0]=4 5562 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,0,0,0,1,0|2,0,0]=4 5563 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,0,0,0,1,0|2,0,0]=4 5564 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,0,0,0,1,0|1,0,1]=4 5565 B10R1.18 CC(=O)C[n+]1ccccc1 Amb4018023 [1,0,0,0,1,0|1,0,1]=4 5566 B10R1.18 CC(=O)C[n+]1ccccc1 Amb6366487 [1,0,0,0,1,0|1,0,1]=4 5567 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [1,0,0,0,1,0|0,0,1]=3 5568 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [1,0,0,0,1,0|1,0,1]=4 5569 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,0,0,0,1,0|1,0,1]=4 5570 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [1,0,0,0,1,0|1,0,1]=4 5571 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,0,0,0,1,0|1,0,1]=4 5572 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [1,0,0,0,1,0|1,0,1]=4 5573 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [1,0,0,0,1,0|1,0,0]=3 5574 B10R1.18 CC(=O)Nc1ccccn1 Amb6374183 [1,0,0,0,1,0|2,0,0]=4 5575 B10R1.18 CC(=O)Nc1cccnc1 Amb6608635 [1,0,0,0,1,0|2,0,0]=4 5576 B10R1.18 CC(=O)Nc1ccncc1 Amb6395765 [1,0,0,0,1,0|2,0,0]=4 5577 B10R1.18 CC(=O)Oc1cccnc1 Amb6297781 [1,0,0,0,1,0|2,0,0]=4 5578 B10R1.18 CC(=O)Oc1ccncc1 Amb22522585 [1,0,0,0,1,0|2,0,0]=4 5579 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,0,0,0,1,0|1,0,0]=3 5580 B10R1.18 CC(=O)Sc1cccnc1 Amb27429372 [1,0,0,0,1,0|2,0,0]=4 5581 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [1,0,0,0,1,0|1,1,0]=4 5582 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [1,0,0,0,1,0|1,0,0]=3 5583 B10R1.18 CC(C)=Cc1ccncc1 Amb27658833 [1,0,0,0,1,0|2,0,0]=4 5584 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,0,0,0,1,0|1,0,1]=4 5585 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [1,0,0,0,1,0|2,0,0]=4 5586 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [1,0,0,0,1,0|0,0,1]=3 5587 B10R1.18 C\[N+]([O-])=C/c1ccccc1 Amb3988092 [1,0,0,0,1,0|1,0,1]=4 5588 B10R1.18 C\[N+]([O-])=C\c1ccccc1 Amb2420785 [1,0,0,0,1,0|1,0,1]=4 5589 B10R1.18 ClC(Cl)=Cc1ccccc1 Amb26554175 [1,0,0,0,1,0|2,0,0]=4 5590 B10R1.18 F\C(Br)=C\c1ccccc1 Amb24053589 [1,0,0,0,1,0|2,0,0]=4 5591 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,0,0,0,1,0|2,0,0]=4 5592 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,0,0,0,1,0|1,0,1]=4 5593 B10R1.18 NC(=O)Nc1ccccc1 Amb3106756 [1,0,0,0,1,0|2,0,0]=4 5594 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [1,0,0,0,1,0|2,0,0]=4 5595 B10R1.18 NC(=O)Sc1ccccc1 Amb28182472 [1,0,0,0,1,0|2,0,0]=4 5596 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [1,0,0,0,1,0|1,0,1]=4 5597 B10R1.18 O=C(Br)Nc1ccccc1 Amb27229968 [1,0,0,0,1,0|2,0,0]=4 5598 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [1,0,0,0,1,0|1,0,1]=4 5599 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,0,0,0,1,0|2,0,0]=4 5600 B10R1.18 O=C(Cl)Oc1ccccc1 Amb6296594 [1,0,0,0,1,0|2,0,0]=4 5601 B10R1.18 O=C(Cl)Sc1ccccc1 Amb4006578 [1,0,0,0,1,0|2,0,0]=4 5602 B10R1.18 O=C(Cl)[NH2+]c1ccccc1 Amb9787354 [1,0,0,0,1,0|2,0,0]=4 5603 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,0,0,0,1,0|2,0,0]=4 5604 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [1,0,0,0,1,0|1,0,1]=4 5605 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [1,0,0,0,1,0|1,0,1]=4 5606 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [1,0,0,0,1,0|1,0,1]=4 5607 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [1,0,0,0,1,0|0,0,1]=3 5608 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [1,0,0,0,1,0|1,0,1]=4 5609 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [1,0,0,0,1,0|1,0,1]=4 5610 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [1,0,0,0,1,0|1,0,1]=4 5611 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [1,0,0,0,1,0|1,0,1]=4 5612 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [1,0,0,0,1,0|1,0,1]=4 5613 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [1,0,0,0,1,0|1,0,1]=4 5614 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [1,0,0,0,1,0|1,0,0]=3 5615 B10R1.18 O=C(O)Nc1cccnc1 Amb24102579 [1,0,0,0,1,0|2,0,0]=4 5616 B10R1.18 O=C(O)Nc1ccncc1 Amb24070647 [1,0,0,0,1,0|2,0,0]=4 5617 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [1,0,0,0,1,0|0,0,2]=4 5618 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [1,0,0,0,1,0|0,0,2]=4 5619 B10R1.18 O=C([O-])Oc1ccccc1 Amb5540415 [1,0,0,0,1,0|1,0,1]=4 5620 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [1,0,0,0,1,0|1,0,1]=4 5621 B10R1.18 O=S(O)Oc1ccccc1 Amb27964140 [1,0,0,0,1,0|2,0,0]=4 5622 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [1,0,0,0,1,0|1,0,1]=4 5623 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,0,0,0,1,0|0,1,1]=4 5624 B10R1.66 CC(=O)\C=C/c1ccco1 Amb25066388 [1,0,0,0,1,0|1,0,0]=3 5625 B10R1.66 CC(=O)\C=C\c1ccco1 Amb6608963 [1,0,0,0,1,0|1,0,0]=3 5626 B10R1.66 CC(=O)\C=C\c1cccs1 Amb33512960 [1,0,0,0,1,0|1,0,0]=3 5627 B10R1.66 CC(=O)\C=C\c1ccns1 Amb35720406 [1,0,0,0,1,0|2,0,0]=4 5628 B10R1.66 CC(=O)\C=C\c1ccoc1 Amb24479175 [1,0,0,0,1,0|1,0,0]=3 5629 B10R1.66 CC(=O)\C=C\c1ccon1 Amb33199366 [1,0,0,0,1,0|2,0,0]=4 5630 B10R1.66 CC(=O)\C=C\c1ccsc1 Amb22370887 [1,0,0,0,1,0|1,0,0]=3 5631 B10R1.66 CC(=O)\C=C\c1cnco1 Amb33319933 [1,0,0,0,1,0|2,0,0]=4 5632 B10R1.66 CC(=O)\C=C\c1cncs1 Amb33359799 [1,0,0,0,1,0|2,0,0]=4 5633 B10R1.66 CC(=O)\C=C\c1cnsc1 Amb26986340 [1,0,0,0,1,0|2,0,0]=4 5634 B10R1.66 CC(=O)\C=C\c1cscn1 Amb32954498 [1,0,0,0,1,0|2,0,0]=4 5635 B10R1.66 CC(=O)\C=C\c1nccs1 Amb33449103 [1,0,0,0,1,0|2,0,0]=4 5636 B10R1.66 NC(=O)\C=C/c1ccoc1 Amb27493171 [1,0,0,0,1,0|2,0,0]=4 5637 B10R1.66 NC(=O)\C=C\c1ccco1 Amb6387328 [1,0,0,0,1,0|2,0,0]=4 5638 B10R1.66 NC(=O)\C=C\c1cccs1 Amb3429140 [1,0,0,0,1,0|2,0,0]=4 5639 B10R1.66 O=C(Cl)\C=C/c1ccco1 Amb26581586 [1,0,0,0,1,0|2,0,0]=4 5640 B10R1.66 O=C(Cl)\C=C\c1ccco1 Amb16230244 [1,0,0,0,1,0|2,0,0]=4 5641 B10R1.66 O=C(Cl)\C=C\c1cccs1 Amb7173093 [1,0,0,0,1,0|2,0,0]=4 5642 B10R1.66 O=C(Cl)\C=C\c1ccsc1 Amb8385105 [1,0,0,0,1,0|2,0,0]=4 5643 B10R1.66 O=C(O)\C=C/c1ccco1 Amb26458726 [1,0,0,0,1,0|1,0,0]=3 5644 B10R1.66 O=C(O)\C=C/c1cccs1 Amb27658635 [1,0,0,0,1,0|1,0,0]=3 5645 B10R1.66 O=C(O)\C=C/c1ccsc1 Amb10071559 [1,0,0,0,1,0|1,0,0]=3 5646 B10R1.66 O=C(O)\C=C\c1ccco1 Amb6335256 [1,0,0,0,1,0|1,0,0]=3 5647 B10R1.66 O=C(O)\C=C\c1cccs1 Amb24076486 [1,0,0,0,1,0|1,0,0]=3 5648 B10R1.66 O=C(O)\C=C\c1cccs1 Amb33716246 [1,0,0,0,1,0|1,0,0]=3 5649 B10R1.66 O=C(O)\C=C\c1ccno1 Amb27851739 [1,0,0,0,1,0|2,0,0]=4 5650 B10R1.66 O=C(O)\C=C\c1ccns1 Amb27234709 [1,0,0,0,1,0|2,0,0]=4 5651 B10R1.66 O=C(O)\C=C\c1ccoc1 Amb33946022 [1,0,0,0,1,0|1,0,0]=3 5652 B10R1.66 O=C(O)\C=C\c1ccon1 Amb33198351 [1,0,0,0,1,0|2,0,0]=4 5653 B10R1.66 O=C(O)\C=C\c1ccsc1 Amb1154295 [1,0,0,0,1,0|1,0,0]=3 5654 B10R1.66 O=C(O)\C=C\c1ccsn1 Amb24624065 [1,0,0,0,1,0|2,0,0]=4 5655 B10R1.66 O=C(O)\C=C\c1cnco1 Amb32954265 [1,0,0,0,1,0|2,0,0]=4 5656 B10R1.66 O=C(O)\C=C\c1cncs1 Amb33473685 [1,0,0,0,1,0|2,0,0]=4 5657 B10R1.66 O=C(O)\C=C\c1cnsc1 Amb28239806 [1,0,0,0,1,0|2,0,0]=4 5658 B10R1.66 O=C(O)\C=C\c1cocn1 Amb24638306 [1,0,0,0,1,0|2,0,0]=4 5659 B10R1.66 O=C(O)\C=C\c1cscn1 Amb8836304 [1,0,0,0,1,0|2,0,0]=4 5660 B10R1.66 O=C(O)\C=C\c1ncco1 Amb26921286 [1,0,0,0,1,0|2,0,0]=4 5661 B10R1.66 O=C(O)\C=C\c1nccs1 Amb8836307 [1,0,0,0,1,0|2,0,0]=4 5662 B10R1.66 O=C(O)\C=C\n1ccnc1 Amb26919413 [1,0,0,0,1,0|2,0,0]=4 5663 B10R1.66 O=C([O-])\C=C\c1ccsc1 Amb33512980 [1,0,0,0,1,0|1,0,1]=4 5664 B10R1.27 COC(=O)CC1C=CC=C1 Amb27445266 [0,0,0,0,2,0|0,0,2]=4 5665 B10R1.27 COC(=O)Cc1cccs1 Amb8465809 [0,0,0,0,2,0|1,0,1]=4 5666 B10R1.27 COC(=O)Cc1ccoc1 Amb26320148 [0,0,0,0,2,0|1,0,1]=4 5667 B10R1.27 COC(=O)Cc1ccsc1 Amb2725958 [0,0,0,0,2,0|1,0,1]=4 5668 B10R1.27 COC(=O)Cn1cccc1 Amb8011835 [0,0,0,0,2,0|1,0,1]=4 5669 B10R1.27 COC(=O)Nc1ccco1 Amb28241377 [0,0,0,0,2,0|2,0,0]=4 5670 B10R1.27 COC(=O)Nc1ccoc1 Amb27614097 [0,0,0,0,2,0|2,0,0]=4 5671 B10R1.27 COC(=O)Nc1ccsc1 Amb2612883 [0,0,0,0,2,0|2,0,0]=4 5672 B10R1.27 COC(=O)Oc1ccco1 Amb27974836 [0,0,0,0,2,0|2,0,0]=4 5673 B10R1.27 COC(=O)Sc1cccs1 Amb28368652 [0,0,0,0,2,0|2,0,0]=4 5674 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,0,0,2,0|1,0,1]=4 5675 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,0,0,0,2,0|2,0,0]=4 5676 B10R1.15 C=C(OC)c1ccccn1 Amb28141881 [0,0,0,0,2,0|2,0,0]=4 5677 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [0,0,0,0,2,0|1,0,1]=4 5678 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,0,0,0,2,0|1,0,0]=3 5679 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [0,0,0,0,2,0|2,0,0]=4 5680 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [0,0,0,0,2,0|2,0,0]=4 5681 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [0,0,0,0,2,0|2,0,0]=4 5682 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,0,0,0,2,0|2,0,0]=4 5683 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,0,0,2,0|2,0,0]=4 5684 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,0,0,0,2,0|2,0,0]=4 5685 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,0,0,0,2,0|1,0,0]=3 5686 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [0,0,0,0,2,0|2,0,0]=4 5687 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [0,0,0,0,2,0|2,0,0]=4 5688 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [0,0,0,0,2,0|2,0,0]=4 5689 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,0,0,2,0|1,1,0]=4 5690 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,0,0,0,2,0|1,0,0]=3 5691 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,0,0,0,2,0|1,0,0]=3 5692 B10R1.15 COC(=O)C1=CC=CNC1 Amb28042598 [0,0,0,0,2,0|1,0,1]=4 5693 B10R1.15 COC(=O)N1C=CC=CC1 Amb2697197 [0,0,0,0,2,0|1,0,1]=4 5694 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,0,0,0,2,0|0,0,0]=2 5695 B10R1.15 COC(=O)c1ccccn1 Amb2721020 [0,0,0,0,2,0|1,0,0]=3 5696 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [0,0,0,0,2,0|1,0,0]=3 5697 B10R1.15 COC(=O)c1cccnc1 Amb22741138 [0,0,0,0,2,0|1,0,0]=3 5698 B10R1.15 COC(=O)c1cccnn1 Amb21960450 [0,0,0,0,2,0|2,0,0]=4 5699 B10R1.15 COC(=O)c1ccncc1 Amb6608958 [0,0,0,0,2,0|1,0,0]=3 5700 B10R1.15 COC(=O)c1ccncn1 Amb7101502 [0,0,0,0,2,0|2,0,0]=4 5701 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [0,0,0,0,2,0|2,0,0]=4 5702 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [0,0,0,0,2,0|2,0,0]=4 5703 B10R1.15 COC(=O)c1cnccn1 Amb33620824 [0,0,0,0,2,0|2,0,0]=4 5704 B10R1.15 COC(=O)c1cncnc1 Amb5492761 [0,0,0,0,2,0|2,0,0]=4 5705 B10R1.15 COC(=O)c1ncccn1 Amb7101492 [0,0,0,0,2,0|2,0,0]=4 5706 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,0,0,2,0|0,1,0]=3 5707 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,0,0,0,2,0|1,0,1]=4 5708 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [0,0,0,0,2,0|1,0,0]=3 5709 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,0,0,2,0|1,1,0]=4 5710 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [0,0,0,0,2,0|1,1,0]=4 5711 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,0,0,2,0|0,2,0]=4 5712 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,0,0,0,2,0|2,0,0]=4 5713 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,0,0,0,2,0|2,0,0]=4 5714 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,0,0,0,2,0|2,0,0]=4 5715 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,0,0,0,2,0|2,0,0]=4 5716 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [0,0,0,0,2,0|2,0,0]=4 5717 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [0,0,0,0,2,0|2,0,0]=4 5718 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,0,0,2,0|2,0,0]=4 5719 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,0,0,0,2,0|2,0,0]=4 5720 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,0,0,2,0|2,0,0]=4 5721 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,0,0,0,2,0|2,0,0]=4 5722 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,0,0,0,2,0|2,0,0]=4 5723 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,0,0,0,2,0|2,0,0]=4 5724 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,0,0,2,0|2,0,0]=4 5725 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,0,0,0,2,0|2,0,0]=4 5726 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,0,0,0,2,0|2,0,0]=4 5727 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [0,0,0,0,2,0|2,0,0]=4 5728 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,0,0,0,2,0|2,0,0]=4 5729 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [0,0,0,0,2,0|2,0,0]=4 5730 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [0,0,0,0,2,0|2,0,0]=4 5731 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [0,0,0,0,2,0|2,0,0]=4 5732 B10R1.15 O=C(OO)c1ccncc1 Amb24066209 [0,0,0,0,2,0|2,0,0]=4 5733 B10R1.15 O=C(O[K])c1cccnc1 Amb3150242 [0,0,0,0,2,0|2,0,0]=4 5734 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [0,0,0,0,2,0|2,0,0]=4 5735 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [0,0,0,0,2,0|2,0,0]=4 5736 B10R1.15 O=S(O[Na])c1ccccc1 Amb6365754 [0,0,0,0,2,0|2,0,0]=4 5737 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,0,0,0,2,0|2,0,0]=4 5738 B12R1.1414 O=C\C=C\C=C1C=CC=CC=C1 Amb26393515 [1,0,0,0,0,1|2,0,0]=4 5739 B14R1.716 CCC(=O)\C=C/NCc1ccccc1 Amb27965467 [0,0,0,0,0,2|1,0,0]=3 5740 B14R1.716 COC(=O)C#CCOc1ccccc1 Amb27755610 [0,0,0,0,0,2|0,0,2]=4 5741 B14R1.716 COC(=O)C#CCSc1ccccc1 Amb27795338 [0,0,0,0,0,2|0,0,2]=4 5742 B14R1.716 COC(=O)CCCCc1ccccc1 Amb8392132 [0,0,0,0,0,2|0,0,2]=4 5743 B14R1.716 COC(=O)CCCSc1ccccc1 Amb8950459 [0,0,0,0,0,2|0,0,2]=4 5744 B14R1.716 COC(=O)CCNCc1ccccc1 Amb288483 [0,0,0,0,0,2|0,0,2]=4 5745 B14R1.716 COC(=O)CCNCc1ccccc1 Amb996333 [0,0,0,0,0,2|0,0,2]=4 5746 B14R1.716 COC(=O)CCOCc1ccccc1 Amb7773811 [0,0,0,0,0,2|0,0,2]=4 5747 B14R1.716 COC(=O)CNCCc1ccccc1 Amb6686977 [0,0,0,0,0,2|0,0,2]=4 5748 B14R1.716 COC(=O)NCC#Cc1ccccc1 Amb24374036 [0,0,0,0,0,2|0,0,2]=4 5749 B14R1.716 COC(=O)N\C=C\Sc1ccccc1 Amb28052640 [0,0,0,0,0,2|0,0,0]=2 5750 B14R1.716 COC(=O)\C=C\C#Cc1ccccc1 Amb20001567 [0,0,0,0,0,2|0,0,0]=2 5751 B14R1.716 O=C(CCl)NC\C=C\c1ccccc1 Amb31158323 [0,0,0,0,0,2|2,0,0]=4