0 B12R1.56 C#Cc1cc(C(=O)O)ccc1C Amb25798921 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.56 C#Cc1cc(C(=O)O)ccc1F Amb24493572 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.56 C#Cc1cc(C(=O)O)ccc1N Amb28457177 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.56 C#Cc1cc(C(=O)O)cnc1C Amb27961228 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.56 C#Cc1cc(C(=O)O)cnc1N Amb25219932 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.56 C#Cc1cc(C(=O)O)cnc1O Amb26513074 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.56 C#Cc1cc(C(=O)O)ncc1C Amb28042314 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.56 C#Cc1cc(C(C)=O)ccc1F Amb19944470 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.56 C#Cc1cc([N+](=O)[O-])ccc1O Amb2695143 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.56 C#Cc1nc(C(=O)O)ccc1C Amb25315379 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.56 C#Cc1nc(C(=O)O)ccc1O Amb28072757 [0,0,0,0,0,0|2,0,1]=3 11 B12R1.56 C=Cc1cc(C(=O)O)cnc1C Amb25682330 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.56 C=Cc1cc(C(=O)O)cnc1N Amb26080722 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.56 C=Cc1cc(C(=O)O)cnc1O Amb24395190 [0,0,0,0,0,0|2,0,1]=3 14 B12R1.56 C=Cc1cc(C(=O)O)ncc1C Amb27166675 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.56 C=Cc1cc([N+](=O)[O-])ccc1O Amb33080401 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.56 C=Cc1nc(C(=O)O)ccc1C Amb28279979 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.56 C=Cc1nc(C(=O)O)ccc1O Amb25978505 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.56 CC(=O)c1ccc(Br)c(C#N)c1 Amb22232827 [0,0,0,0,0,0|4,0,0]=4 19 B12R1.56 CC(=O)c1ccc(C)c(C#N)c1 Amb17138482 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.56 CC(=O)c1ccc(Cl)c(C#N)c1 Amb17138939 [0,0,0,0,0,0|4,0,0]=4 21 B12R1.56 CC(=O)c1ccc(Cl)c(C=O)c1 Amb28370008 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.56 CC(=O)c1ccc(Cl)c(CN)c1 Amb27851458 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.56 CC(=O)c1ccc(F)c(C#N)c1 Amb17138549 [0,0,0,0,0,0|4,0,0]=4 24 B12R1.56 CC(=O)c1ccc(N)c(C#N)c1 Amb17607409 [0,0,0,0,0,0|4,0,0]=4 25 B12R1.56 CC(=O)c1ccc(O)c(C=O)c1 Amb18645957 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.56 CC(=O)c1ccc(O)c(CCl)c1 Amb1103706 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.56 CC(=O)c1ccc(O)c(CN)c1 Amb27947395 [0,0,0,0,0,0|3,0,0]=3 28 B12R1.56 CC(=O)c1ccc(O)c(CO)c1 Amb1109886 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.56 CC(=O)c1ccc(O)c(N=O)c1 Amb25917951 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.56 CCN1C=C(C(=O)Cl)C=CC1=O Amb25097038 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.56 CCN1C=C(C(=O)O)C=CC1=O Amb18281013 [0,0,0,0,0,0|2,0,1]=3 32 B12R1.56 CCN1C=C(C(N)=O)C=CC1=O Amb25299167 [0,0,0,0,0,0|3,0,1]=4 33 B12R1.56 CCN1N=C(C(=O)O)C=CC1=O Amb18952897 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.56 CCc1cc(B(O)O)ccc1Br Amb25298553 [0,0,0,0,0,0|3,0,1]=4 35 B12R1.56 CCc1cc(B(O)O)ccc1C Amb25085910 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.56 CCc1cc(B(O)O)ccc1Cl Amb20171164 [0,0,0,0,0,0|3,0,1]=4 37 B12R1.56 CCc1cc(B(O)O)ccc1F Amb27223392 [0,0,0,0,0,0|3,0,1]=4 38 B12R1.56 CCc1cc(B(O)O)ccc1I Amb27883581 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.56 CCc1cc(B(O)O)ccc1O Amb25959059 [0,0,0,0,0,0|2,0,1]=3 40 B12R1.56 CCc1cc(C(=O)Cl)ccc1Cl Amb26608893 [0,0,0,0,0,0|3,0,0]=3 41 B12R1.56 CCc1cc(C(=O)Cl)ccc1F Amb27874713 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.56 CCc1cc(C(=O)O)ccc1Br Amb33549090 [0,0,0,0,0,0|2,0,0]=2 43 B12R1.56 CCc1cc(C(=O)O)ccc1C Amb26611442 [0,0,0,0,0,0|2,0,0]=2 44 B12R1.56 CCc1cc(C(=O)O)ccc1Cl Amb19892756 [0,0,0,0,0,0|2,0,0]=2 45 B12R1.56 CCc1cc(C(=O)O)ccc1F Amb16233181 [0,0,0,0,0,0|2,0,0]=2 46 B12R1.56 CCc1cc(C(=O)O)ccc1I Amb25351541 [0,0,0,0,0,0|2,0,0]=2 47 B12R1.56 CCc1cc(C(=O)O)ccc1N Amb2697546 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.56 CCc1cc(C(=O)O)ccc1O Amb9828624 [0,0,0,0,0,0|1,0,0]=1 49 B12R1.56 CCc1cc(C(=O)O)ccc1S Amb24367707 [0,0,0,0,0,0|1,1,0]=2 50 B12R1.56 CCc1cc(C(=O)O)ncc1Cl Amb18822253 [0,0,0,0,0,0|3,0,0]=3 51 B12R1.56 CCc1cc(C(=O)O)nnc1C Amb24396303 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.56 CCc1cc(C(=O)O)nnc1Cl Amb26392287 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.56 CCc1cc(C(=O)O)nnc1N Amb28125656 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.56 CCc1cc(C(=O)O)nnc1O Amb26883745 [0,0,0,0,0,0|3,0,0]=3 55 B12R1.56 CCc1cc(C(C)=O)ccc1C Amb26992472 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.56 CCc1cc(C(C)=O)ccc1Cl Amb24573695 [0,0,0,0,0,0|3,0,0]=3 57 B12R1.56 CCc1cc(C(C)=O)ccc1F Amb27762492 [0,0,0,0,0,0|3,0,0]=3 58 B12R1.56 CCc1cc(C(C)O)ccc1Cl Amb25867151 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.56 CCc1cc(C(N)=O)ccc1Cl Amb28399114 [0,0,0,0,0,0|3,0,0]=3 60 B12R1.56 CCc1cc(C(N)=O)ccc1I Amb32685340 [0,0,0,0,0,0|3,0,0]=3 61 B12R1.56 CCc1cc([N+](=O)[O-])ccc1Br Amb23577601 [0,0,0,0,0,0|3,0,1]=4 62 B12R1.56 CCc1cc([N+](=O)[O-])ccc1C Amb26604726 [0,0,0,0,0,0|3,0,1]=4 63 B12R1.56 CCc1cc([N+](=O)[O-])ccc1Cl Amb23577595 [0,0,0,0,0,0|3,0,1]=4 64 B12R1.56 CCc1cc([N+](=O)[O-])ccc1F Amb22284847 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.56 CCc1cc([N+](=O)[O-])ccc1I Amb26318838 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.56 CCc1cc([N+](=O)[O-])ccc1N Amb27439354 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.56 CCc1cc([N+](=O)[O-])ccc1S Amb25699015 [0,0,0,0,0,0|2,1,1]=4 68 B12R1.56 CCc1nc(C(=O)O)ccc1F Amb27175581 [0,0,0,0,0,0|3,0,0]=3 69 B12R1.56 CNc1cc(B(O)O)ccc1C Amb24431843 [0,0,0,0,0,0|3,0,1]=4 70 B12R1.56 CNc1cc(C(=O)O)ccc1Br Amb27255324 [0,0,0,0,0,0|2,0,0]=2 71 B12R1.56 CNc1cc(C(=O)O)ccc1F Amb18288737 [0,0,0,0,0,0|2,0,0]=2 72 B12R1.56 CNc1cc(C(=O)O)ccc1N Amb22498830 [0,0,0,0,0,0|2,0,0]=2 73 B12R1.56 CNc1cc(C(=O)O)ccc1O Amb16229666 [0,0,0,0,0,0|1,0,0]=1 74 B12R1.56 CNc1cc(C(C)=O)ccc1Cl Amb18267388 [0,0,0,0,0,0|3,0,0]=3 75 B12R1.56 CNc1cc(C(C)=O)ccc1F Amb18267393 [0,0,0,0,0,0|3,0,0]=3 76 B12R1.56 CNc1cc(C(C)=O)ccc1O Amb26994873 [0,0,0,0,0,0|2,0,0]=2 77 B12R1.56 CNc1cc(C(N)=O)ccc1N Amb22500933 [0,0,0,0,0,0|3,0,0]=3 78 B12R1.56 CNc1cc(N(C)C)ccc1O Amb27591612 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.56 CNc1cc([N+](=O)[O-])ccc1Br Amb17306893 [0,0,0,0,0,0|3,0,1]=4 80 B12R1.56 CNc1cc([N+](=O)[O-])ccc1C Amb17306472 [0,0,0,0,0,0|3,0,1]=4 81 B12R1.56 CNc1cc([N+](=O)[O-])ccc1Cl Amb10559444 [0,0,0,0,0,0|3,0,1]=4 82 B12R1.56 CNc1cc([N+](=O)[O-])ccc1F Amb18967602 [0,0,0,0,0,0|3,0,1]=4 83 B12R1.56 CNc1cc([N+](=O)[O-])ccc1N Amb22055782 [0,0,0,0,0,0|3,0,1]=4 84 B12R1.56 CNc1cc([N+](=O)[O-])ccc1O Amb28366230 [0,0,0,0,0,0|2,0,1]=3 85 B12R1.56 COC1=CC(B(O)O)=CNC1=O Amb25705860 [0,0,0,0,0,0|2,0,2]=4 86 B12R1.56 COC1=CC(C(C)=O)=CCC1=S Amb27416356 [0,0,0,0,0,0|1,1,1]=3 87 B12R1.56 CON1C=C(C(=O)O)C=CC1=O Amb28343136 [0,0,0,0,0,0|1,0,1]=2 88 B12R1.56 COc1cc(B(O)O)ccc1Br Amb22169332 [0,0,0,0,0,0|2,0,1]=3 89 B12R1.56 COc1cc(B(O)O)ccc1C Amb20242697 [0,0,0,0,0,0|2,0,1]=3 90 B12R1.56 COc1cc(B(O)O)ccc1Cl Amb6893820 [0,0,0,0,0,0|2,0,1]=3 91 B12R1.56 COc1cc(B(O)O)ccc1F Amb16234331 [0,0,0,0,0,0|2,0,1]=3 92 B12R1.56 COc1cc(B(O)O)ccc1I Amb27240954 [0,0,0,0,0,0|2,0,1]=3 93 B12R1.56 COc1cc(B(O)O)ccc1N Amb27407088 [0,0,0,0,0,0|2,0,1]=3 94 B12R1.56 COc1cc(B(O)O)ccc1O Amb20171349 [0,0,0,0,0,0|1,0,1]=2 95 B12R1.56 COc1cc(B(O)O)cnc1Br Amb27405904 [0,0,0,0,0,0|3,0,1]=4 96 B12R1.56 COc1cc(B(O)O)cnc1C Amb26585175 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.56 COc1cc(B(O)O)cnc1Cl Amb28070116 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.56 COc1cc(B(O)O)cnc1F Amb22490110 [0,0,0,0,0,0|3,0,1]=4 99 B12R1.56 COc1cc(B(O)O)ncc1C Amb27200446 [0,0,0,0,0,0|3,0,1]=4 100 B12R1.56 COc1cc(C(=N)N)ccc1Br Amb33337622 [0,0,0,0,0,0|3,0,0]=3 101 B12R1.56 COc1cc(C(=N)N)ccc1C Amb21984595 [0,0,0,0,0,0|3,0,0]=3 102 B12R1.56 COc1cc(C(=N)N)ccc1C Amb26374214 [0,0,0,0,0,0|3,0,0]=3 103 B12R1.56 COc1cc(C(=N)N)ccc1Cl Amb33407745 [0,0,0,0,0,0|3,0,0]=3 104 B12R1.56 COc1cc(C(=N)N)ccc1F Amb25808757 [0,0,0,0,0,0|3,0,0]=3 105 B12R1.56 COc1cc(C(=N)N)ccc1O Amb13883010 [0,0,0,0,0,0|2,0,0]=2 106 B12R1.56 COc1cc(C(=N)N)ccc1O Amb2696250 [0,0,0,0,0,0|2,0,0]=2 107 B12R1.56 COc1cc(C(=O)Cl)ccc1Br Amb26056298 [0,0,0,0,0,0|2,0,0]=2 108 B12R1.56 COc1cc(C(=O)Cl)ccc1Cl Amb26043134 [0,0,0,0,0,0|2,0,0]=2 109 B12R1.56 COc1cc(C(=O)Cl)ccc1F Amb10841633 [0,0,0,0,0,0|2,0,0]=2 110 B12R1.56 COc1cc(C(=O)Cl)ccc1I Amb28286699 [0,0,0,0,0,0|2,0,0]=2 111 B12R1.56 COc1cc(C(=O)Cl)ccc1N Amb26590907 [0,0,0,0,0,0|2,0,0]=2 112 B12R1.56 COc1cc(C(=O)Cl)ccc1O Amb25230620 [0,0,0,0,0,0|1,0,0]=1 113 B12R1.56 COc1cc(C(=O)Cl)cnc1Cl Amb27229123 [0,0,0,0,0,0|3,0,0]=3 114 B12R1.56 COc1cc(C(=O)O)ccc1Br Amb10072104 [0,0,0,0,0,0|1,0,0]=1 115 B12R1.56 COc1cc(C(=O)O)ccc1C Amb1229907 [0,0,0,0,0,0|1,0,0]=1 116 B12R1.56 COc1cc(C(=O)O)ccc1Cl Amb6335836 [0,0,0,0,0,0|1,0,0]=1 117 B12R1.56 COc1cc(C(=O)O)ccc1F Amb2688151 [0,0,0,0,0,0|1,0,0]=1 118 B12R1.56 COc1cc(C(=O)O)ccc1I Amb10975711 [0,0,0,0,0,0|1,0,0]=1 119 B12R1.56 COc1cc(C(=O)O)ccc1N Amb2721337 [0,0,0,0,0,0|1,0,0]=1 120 B12R1.56 COc1cc(C(=O)O)ccc1O Amb2613984 [0,0,0,0,0,0|0,0,0]=0 121 B12R1.56 COc1cc(C(=O)O)ccc1S Amb25946250 [0,0,0,0,0,0|0,1,0]=1 122 B12R1.56 COc1cc(C(=O)O)cnc1Br Amb25148780 [0,0,0,0,0,0|2,0,0]=2 123 B12R1.56 COc1cc(C(=O)O)cnc1Cl Amb19895310 [0,0,0,0,0,0|2,0,0]=2 124 B12R1.56 COc1cc(C(=O)O)cnc1F Amb26966945 [0,0,0,0,0,0|2,0,0]=2 125 B12R1.56 COc1cc(C(=O)O)cnc1N Amb27460181 [0,0,0,0,0,0|2,0,0]=2 126 B12R1.56 COc1cc(C(=O)O)cnc1O Amb13889895 [0,0,0,0,0,0|1,0,0]=1 127 B12R1.56 COc1cc(C(=O)O)ncc1Br Amb25317914 [0,0,0,0,0,0|2,0,0]=2 128 B12R1.56 COc1cc(C(=O)O)ncc1C Amb20248032 [0,0,0,0,0,0|2,0,0]=2 129 B12R1.56 COc1cc(C(=O)O)ncc1C Amb20622842 [0,0,0,0,0,0|2,0,0]=2 130 B12R1.56 COc1cc(C(=O)O)ncc1F Amb27471840 [0,0,0,0,0,0|2,0,0]=2 131 B12R1.56 COc1cc(C(=O)[O-])ccc1Cl Amb33513200 [0,0,0,0,0,0|1,0,1]=2 132 B12R1.56 COc1cc(C(C)=O)ccc1Br Amb22500454 [0,0,0,0,0,0|2,0,0]=2 133 B12R1.56 COc1cc(C(C)=O)ccc1C Amb26582917 [0,0,0,0,0,0|2,0,0]=2 134 B12R1.56 COc1cc(C(C)=O)ccc1Cl Amb17335724 [0,0,0,0,0,0|2,0,0]=2 135 B12R1.56 COc1cc(C(C)=O)ccc1F Amb2688142 [0,0,0,0,0,0|2,0,0]=2 136 B12R1.56 COc1cc(C(C)=O)ccc1I Amb23437509 [0,0,0,0,0,0|2,0,0]=2 137 B12R1.56 COc1cc(C(C)=O)ccc1N Amb2608648 [0,0,0,0,0,0|2,0,0]=2 138 B12R1.56 COc1cc(C(C)=O)ccc1O Amb2608866 [0,0,0,0,0,0|1,0,0]=1 139 B12R1.56 COc1cc(C(C)=O)ccc1S Amb26939468 [0,0,0,0,0,0|1,1,0]=2 140 B12R1.56 COc1cc(C(C)=O)cnc1Br Amb25933741 [0,0,0,0,0,0|3,0,0]=3 141 B12R1.56 COc1cc(C(C)=O)ncc1Br Amb28119179 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.56 COc1cc(C(C)=O)ncc1F Amb24514191 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.56 COc1cc(C(C)Br)ccc1C Amb27780591 [0,0,0,0,0,0|3,0,1]=4 144 B12R1.56 COc1cc(C(C)Br)ccc1O Amb28288471 [0,0,0,0,0,0|2,0,1]=3 145 B12R1.56 COc1cc(C(C)C)ccc1Br Amb18246171 [0,0,0,0,0,0|3,0,1]=4 146 B12R1.56 COc1cc(C(C)C)ccc1C Amb20624327 [0,0,0,0,0,0|3,0,1]=4 147 B12R1.56 COc1cc(C(C)C)ccc1N Amb18563706 [0,0,0,0,0,0|3,0,1]=4 148 B12R1.56 COc1cc(C(C)C)ccc1O Amb18893522 [0,0,0,0,0,0|2,0,1]=3 149 B12R1.56 COc1cc(C(C)C)ccc1S Amb26081090 [0,0,0,0,0,0|2,1,1]=4 150 B12R1.56 COc1cc(C(C)Cl)ccc1C Amb27865463 [0,0,0,0,0,0|3,0,1]=4 151 B12R1.56 COc1cc(C(C)Cl)ccc1I Amb27260361 [0,0,0,0,0,0|3,0,1]=4 152 B12R1.56 COc1cc(C(C)N)ccc1Br Amb25159272 [0,0,0,0,0,0|3,0,1]=4 153 B12R1.56 COc1cc(C(C)N)ccc1C Amb27267397 [0,0,0,0,0,0|3,0,1]=4 154 B12R1.56 COc1cc(C(C)N)ccc1Cl Amb27450806 [0,0,0,0,0,0|3,0,1]=4 155 B12R1.56 COc1cc(C(C)N)ccc1F Amb22059456 [0,0,0,0,0,0|3,0,1]=4 156 B12R1.56 COc1cc(C(C)O)ccc1Cl Amb27219591 [0,0,0,0,0,0|2,0,1]=3 157 B12R1.56 COc1cc(C(C)O)ccc1N Amb15695156 [0,0,0,0,0,0|2,0,1]=3 158 B12R1.56 COc1cc(C(C)O)ccc1O Amb1110981 [0,0,0,0,0,0|1,0,1]=2 159 B12R1.56 COc1cc(C(C)S)ccc1F Amb32788350 [0,0,0,0,0,0|2,1,1]=4 160 B12R1.56 COc1cc(C(C)S)ccc1O Amb7784718 [0,0,0,0,0,0|1,1,1]=3 161 B12R1.56 COc1cc(C(F)F)ccc1Br Amb26850220 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.56 COc1cc(C(F)F)ccc1C Amb25045239 [0,0,0,0,0,0|3,0,1]=4 163 B12R1.56 COc1cc(C(F)F)ccc1Cl Amb24432330 [0,0,0,0,0,0|3,0,1]=4 164 B12R1.56 COc1cc(C(F)F)ccc1F Amb25335336 [0,0,0,0,0,0|3,0,1]=4 165 B12R1.56 COc1cc(C(F)F)ccc1N Amb25288450 [0,0,0,0,0,0|3,0,1]=4 166 B12R1.56 COc1cc(C(F)F)ccc1O Amb26315417 [0,0,0,0,0,0|2,0,1]=3 167 B12R1.56 COc1cc(C(F)F)cnc1O Amb27448410 [0,0,0,0,0,0|3,0,1]=4 168 B12R1.56 COc1cc(C(N)=O)ccc1Br Amb10068105 [0,0,0,0,0,0|2,0,0]=2 169 B12R1.56 COc1cc(C(N)=O)ccc1C Amb6297122 [0,0,0,0,0,0|2,0,0]=2 170 B12R1.56 COc1cc(C(N)=O)ccc1Cl Amb22501141 [0,0,0,0,0,0|2,0,0]=2 171 B12R1.56 COc1cc(C(N)=O)ccc1F Amb22738942 [0,0,0,0,0,0|2,0,0]=2 172 B12R1.56 COc1cc(C(N)=O)ccc1I Amb23437518 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.56 COc1cc(C(N)=O)ccc1N Amb21926663 [0,0,0,0,0,0|2,0,0]=2 174 B12R1.56 COc1cc(C(N)=O)ccc1O Amb17594165 [0,0,0,0,0,0|1,0,0]=1 175 B12R1.56 COc1cc(C(N)=O)ccc1S Amb28141901 [0,0,0,0,0,0|1,1,0]=2 176 B12R1.56 COc1cc(C(N)=O)cnc1Cl Amb26893953 [0,0,0,0,0,0|3,0,0]=3 177 B12R1.56 COc1cc(C(N)=O)ncc1Br Amb25095456 [0,0,0,0,0,0|3,0,0]=3 178 B12R1.56 COc1cc(C(N)=S)ccc1Br Amb33337621 [0,0,0,0,0,0|2,1,0]=3 179 B12R1.56 COc1cc(C(N)=S)ccc1C Amb25069476 [0,0,0,0,0,0|2,1,0]=3 180 B12R1.56 COc1cc(C(N)=S)ccc1Cl Amb22901095 [0,0,0,0,0,0|2,1,0]=3 181 B12R1.56 COc1cc(C(N)=S)ccc1F Amb27770222 [0,0,0,0,0,0|2,1,0]=3 182 B12R1.56 COc1cc(C(N)=S)ccc1N Amb27264831 [0,0,0,0,0,0|2,1,0]=3 183 B12R1.56 COc1cc(C(N)=S)ccc1O Amb1121242 [0,0,0,0,0,0|1,1,0]=2 184 B12R1.56 COc1cc(N(=O)=O)ccc1Br Amb6365680 [0,0,0,0,0,0|2,0,1]=3 185 B12R1.56 COc1cc(N(=O)=O)ccc1Cl Amb20620771 [0,0,0,0,0,0|2,0,1]=3 186 B12R1.56 COc1cc(N(=O)=O)ccc1F Amb20621290 [0,0,0,0,0,0|2,0,1]=3 187 B12R1.56 COc1cc(N(=O)=O)ccc1I Amb20621470 [0,0,0,0,0,0|2,0,1]=3 188 B12R1.56 COc1cc(N(=O)=O)ccc1N Amb6357360 [0,0,0,0,0,0|2,0,1]=3 189 B12R1.56 COc1cc(N(=O)=O)ccc1O Amb6357122 [0,0,0,0,0,0|1,0,1]=2 190 B12R1.56 COc1cc(N(C)C)ccc1N Amb27875730 [0,0,0,0,0,0|4,0,0]=4 191 B12R1.56 COc1cc(N(C)C)ccc1O Amb24648652 [0,0,0,0,0,0|3,0,0]=3 192 B12R1.56 COc1cc(S(=O)[O-])ccc1Br Amb27608706 [0,0,0,0,0,0|2,0,1]=3 193 B12R1.56 COc1cc(S(=O)[O-])ccc1Cl Amb32755519 [0,0,0,0,0,0|2,0,1]=3 194 B12R1.56 COc1cc(S(=O)[O-])ccc1F Amb32754713 [0,0,0,0,0,0|2,0,1]=3 195 B12R1.56 COc1cc(S(=O)[O-])cnc1Cl Amb32754679 [0,0,0,0,0,0|3,0,1]=4 196 B12R1.56 COc1cc(S(C)=O)ccc1N Amb27654140 [0,0,0,0,0,0|3,0,0]=3 197 B12R1.56 COc1cc(S(C)=O)ccc1O Amb27240741 [0,0,0,0,0,0|2,0,0]=2 198 B12R1.56 COc1cc(S(C)=O)cnc1N Amb27476362 [0,0,0,0,0,0|4,0,0]=4 199 B12R1.56 COc1cc([C@@H](C)N)ccc1Br Amb24465354 [0,0,0,0,0,0|3,0,1]=4 200 B12R1.56 COc1cc([C@@H](C)N)ccc1C Amb24753254 [0,0,0,0,0,0|3,0,1]=4 201 B12R1.56 COc1cc([C@@H](C)N)ccc1Cl Amb24707764 [0,0,0,0,0,0|3,0,1]=4 202 B12R1.56 COc1cc([C@@H](C)N)ccc1F Amb22298532 [0,0,0,0,0,0|3,0,1]=4 203 B12R1.56 COc1cc([C@@H](C)N)ccc1F Amb22744979 [0,0,0,0,0,0|3,0,1]=4 204 B12R1.56 COc1cc([C@@H](C)N)ccc1O Amb24076217 [0,0,0,0,0,0|2,0,1]=3 205 B12R1.56 COc1cc([C@@H](C)O)ccc1Br Amb33337072 [0,0,0,0,0,0|2,0,1]=3 206 B12R1.56 COc1cc([C@@H](C)O)ccc1C Amb33420899 [0,0,0,0,0,0|2,0,1]=3 207 B12R1.56 COc1cc([C@@H](C)O)ccc1Cl Amb27600929 [0,0,0,0,0,0|2,0,1]=3 208 B12R1.56 COc1cc([C@@H](C)O)ccc1F Amb25694090 [0,0,0,0,0,0|2,0,1]=3 209 B12R1.56 COc1cc([C@@H](C)O)ccc1O Amb28385288 [0,0,0,0,0,0|1,0,1]=2 210 B12R1.56 COc1cc([C@H](C)N)ccc1Br Amb25775240 [0,0,0,0,0,0|3,0,1]=4 211 B12R1.56 COc1cc([C@H](C)N)ccc1C Amb26359783 [0,0,0,0,0,0|3,0,1]=4 212 B12R1.56 COc1cc([C@H](C)N)ccc1Cl Amb25374114 [0,0,0,0,0,0|3,0,1]=4 213 B12R1.56 COc1cc([C@H](C)N)ccc1F Amb16233850 [0,0,0,0,0,0|3,0,1]=4 214 B12R1.56 COc1cc([C@H](C)N)ccc1F Amb22406332 [0,0,0,0,0,0|3,0,1]=4 215 B12R1.56 COc1cc([C@H](C)N)ccc1O Amb26034834 [0,0,0,0,0,0|2,0,1]=3 216 B12R1.56 COc1cc([C@H](C)O)ccc1Br Amb33337075 [0,0,0,0,0,0|2,0,1]=3 217 B12R1.56 COc1cc([C@H](C)O)ccc1C Amb33224674 [0,0,0,0,0,0|2,0,1]=3 218 B12R1.56 COc1cc([C@H](C)O)ccc1Cl Amb27219128 [0,0,0,0,0,0|2,0,1]=3 219 B12R1.56 COc1cc([C@H](C)O)ccc1F Amb26343323 [0,0,0,0,0,0|2,0,1]=3 220 B12R1.56 COc1cc([C@H](C)O)ccc1O Amb27218675 [0,0,0,0,0,0|1,0,1]=2 221 B12R1.56 COc1cc([N+](=O)[O-])ccc1Br Amb6298858 [0,0,0,0,0,0|2,0,1]=3 222 B12R1.56 COc1cc([N+](=O)[O-])ccc1C Amb2582782 [0,0,0,0,0,0|2,0,1]=3 223 B12R1.56 COc1cc([N+](=O)[O-])ccc1Cl Amb2686278 [0,0,0,0,0,0|2,0,1]=3 224 B12R1.56 COc1cc([N+](=O)[O-])ccc1F Amb6296551 [0,0,0,0,0,0|2,0,1]=3 225 B12R1.56 COc1cc([N+](=O)[O-])ccc1I Amb2688862 [0,0,0,0,0,0|2,0,1]=3 226 B12R1.56 COc1cc([N+](=O)[O-])ccc1N Amb2613527 [0,0,0,0,0,0|2,0,1]=3 227 B12R1.56 COc1cc([N+](=O)[O-])ccc1O Amb6335799 [0,0,0,0,0,0|1,0,1]=2 228 B12R1.56 COc1cc([N+](=O)[O-])ccc1S Amb24084554 [0,0,0,0,0,0|1,1,1]=3 229 B12R1.56 COc1cc([N+](=O)[O-])cnc1Br Amb22496323 [0,0,0,0,0,0|3,0,1]=4 230 B12R1.56 COc1cc([N+](=O)[O-])cnc1C Amb25795501 [0,0,0,0,0,0|3,0,1]=4 231 B12R1.56 COc1cc([N+](=O)[O-])cnc1Cl Amb10066915 [0,0,0,0,0,0|3,0,1]=4 232 B12R1.56 COc1cc([N+](=O)[O-])cnc1N Amb23437249 [0,0,0,0,0,0|3,0,1]=4 233 B12R1.56 COc1cc([N+](=O)[O-])cnc1O Amb19958892 [0,0,0,0,0,0|2,0,1]=3 234 B12R1.56 COc1cc([N+](=O)[O-])ncc1C Amb27616166 [0,0,0,0,0,0|3,0,1]=4 235 B12R1.56 COc1nc(B(O)O)ccc1Cl Amb27220320 [0,0,0,0,0,0|3,0,1]=4 236 B12R1.56 COc1nc(B(O)O)ccc1F Amb27616213 [0,0,0,0,0,0|3,0,1]=4 237 B12R1.56 COc1nc(C(=O)O)ccc1Br Amb21857409 [0,0,0,0,0,0|2,0,0]=2 238 B12R1.56 COc1nc(C(=O)O)ccc1C Amb26517449 [0,0,0,0,0,0|2,0,0]=2 239 B12R1.56 COc1nc(C(=O)O)ccc1Cl Amb19958651 [0,0,0,0,0,0|2,0,0]=2 240 B12R1.56 COc1nc(C(=O)O)ccc1F Amb27840417 [0,0,0,0,0,0|2,0,0]=2 241 B12R1.56 COc1nc(C(=O)O)ccc1I Amb22751238 [0,0,0,0,0,0|2,0,0]=2 242 B12R1.56 COc1nc(C(=O)O)ccc1N Amb22751240 [0,0,0,0,0,0|2,0,0]=2 243 B12R1.56 COc1nc(C(=O)O)ccc1O Amb28254865 [0,0,0,0,0,0|1,0,0]=1 244 B12R1.56 COc1nc(C(=O)O)ncc1F Amb28052838 [0,0,0,0,0,0|3,0,0]=3 245 B12R1.56 COc1nc(C(C)=O)ccc1Br Amb26911312 [0,0,0,0,0,0|3,0,0]=3 246 B12R1.56 COc1nc(C(C)=O)ccc1Cl Amb24725575 [0,0,0,0,0,0|3,0,0]=3 247 B12R1.56 COc1nc(C(C)=O)ccc1F Amb27777437 [0,0,0,0,0,0|3,0,0]=3 248 B12R1.56 COc1nc(C(C)=O)ccc1O Amb27847548 [0,0,0,0,0,0|2,0,0]=2 249 B12R1.56 COc1nc(C(C)=O)ncc1F Amb25036236 [0,0,0,0,0,0|4,0,0]=4 250 B12R1.56 COc1nc(C(N)=O)ccc1C Amb27586410 [0,0,0,0,0,0|3,0,0]=3 251 B12R1.56 COc1nc(C(N)=O)ccc1N Amb26359409 [0,0,0,0,0,0|3,0,0]=3 252 B12R1.56 COc1nc([N+](=O)[O-])ccc1Cl Amb27491839 [0,0,0,0,0,0|3,0,1]=4 253 B12R1.56 CS(=O)c1ccc(O)c(CO)c1 Amb27974051 [0,0,0,0,0,0|4,0,0]=4 254 B12R1.56 CSc1cc(B(O)O)ccc1F Amb26611462 [0,0,0,0,0,0|2,1,1]=4 255 B12R1.56 CSc1cc(C(=O)O)cc[n+]1C Amb2612028 [0,0,0,0,0,0|2,1,0]=3 256 B12R1.56 CSc1cc(C(=O)O)ccc1Br Amb25260798 [0,0,0,0,0,0|1,1,0]=2 257 B12R1.56 CSc1cc(C(=O)O)ccc1C Amb18636742 [0,0,0,0,0,0|1,1,0]=2 258 B12R1.56 CSc1cc(C(=O)O)ccc1Cl Amb10808713 [0,0,0,0,0,0|1,1,0]=2 259 B12R1.56 CSc1cc(C(=O)O)ccc1F Amb22059712 [0,0,0,0,0,0|1,1,0]=2 260 B12R1.56 CSc1cc(C(=O)O)ccc1I Amb26630396 [0,0,0,0,0,0|1,1,0]=2 261 B12R1.56 CSc1cc(C(=O)O)ccc1N Amb110778 [0,0,0,0,0,0|1,1,0]=2 262 B12R1.56 CSc1cc(C(=O)O)ccc1N Amb2371588 [0,0,0,0,0,0|1,1,0]=2 263 B12R1.56 CSc1cc(C(=O)O)ccc1O Amb27624208 [0,0,0,0,0,0|0,1,0]=1 264 B12R1.56 CSc1cc(C(N)=O)ccc1F Amb28054108 [0,0,0,0,0,0|2,1,0]=3 265 B12R1.56 CSc1cc([N+](=O)[O-])ccc1Cl Amb24493182 [0,0,0,0,0,0|2,1,1]=4 266 B12R1.56 CSc1cc([N+](=O)[O-])ccc1F Amb26392588 [0,0,0,0,0,0|2,1,1]=4 267 B12R1.56 CSc1cc([N+](=O)[O-])ccc1I Amb28348386 [0,0,0,0,0,0|2,1,1]=4 268 B12R1.56 CSc1cc([N+](=O)[O-])ccc1O Amb24558362 [0,0,0,0,0,0|1,1,1]=3 269 B12R1.56 Cc1ccc(C(=O)O)cc1C#N Amb33547021 [0,0,0,0,0,0|3,0,0]=3 270 B12R1.56 Cc1ccc(C(=O)O)cc1C=O Amb27661270 [0,0,0,0,0,0|3,0,0]=3 271 B12R1.56 Cc1ccc(C(=O)O)cc1CBr Amb32679498 [0,0,0,0,0,0|3,0,0]=3 272 B12R1.56 Cc1ccc(C(=O)O)cc1CCl Amb28436922 [0,0,0,0,0,0|3,0,0]=3 273 B12R1.56 Cc1ccc(C(=O)O)cc1CN Amb24713723 [0,0,0,0,0,0|3,0,0]=3 274 B12R1.56 Cc1ccc(C(=O)O)cc1CN Amb33172765 [0,0,0,0,0,0|3,0,0]=3 275 B12R1.56 Cc1ccc(C(=O)O)cc1CO Amb23437467 [0,0,0,0,0,0|3,0,0]=3 276 B12R1.56 Cc1ccc(C(=O)O)cc1N=N Amb27804026 [0,0,0,0,0,0|3,0,0]=3 277 B12R1.56 Cc1ccc(C(=O)O)cc1NN Amb21955731 [0,0,0,0,0,0|3,0,0]=3 278 B12R1.56 Cc1ccc(C(=O)O)cc1NN Amb2234968 [0,0,0,0,0,0|3,0,0]=3 279 B12R1.56 Cc1ccc(C(=O)O)nc1C#N Amb28396590 [0,0,0,0,0,0|4,0,0]=4 280 B12R1.56 Cc1ccc(C(=O)O)nc1C=O Amb33072942 [0,0,0,0,0,0|4,0,0]=4 281 B12R1.56 Cc1ccc(C(N)=O)cc1C#N Amb24532772 [0,0,0,0,0,0|4,0,0]=4 282 B12R1.56 Cc1cnc(C(=O)O)cc1C#N Amb26995204 [0,0,0,0,0,0|4,0,0]=4 283 B12R1.56 Cc1ncc(C(=O)O)cc1C#N Amb16230651 [0,0,0,0,0,0|4,0,0]=4 284 B12R1.56 N#Cc1cc(B(O)O)ccc1O Amb27975754 [0,0,0,0,0,0|3,0,1]=4 285 B12R1.56 N#Cc1cc(C(=O)Cl)ccc1F Amb10840725 [0,0,0,0,0,0|4,0,0]=4 286 B12R1.56 N#Cc1cc(C(=O)O)ccc1Br Amb22001589 [0,0,0,0,0,0|3,0,0]=3 287 B12R1.56 N#Cc1cc(C(=O)O)ccc1Cl Amb22170211 [0,0,0,0,0,0|3,0,0]=3 288 B12R1.56 N#Cc1cc(C(=O)O)ccc1F Amb10840726 [0,0,0,0,0,0|3,0,0]=3 289 B12R1.56 N#Cc1cc(C(=O)O)ccc1I Amb27173833 [0,0,0,0,0,0|3,0,0]=3 290 B12R1.56 N#Cc1cc(C(=O)O)ccc1N Amb22495496 [0,0,0,0,0,0|3,0,0]=3 291 B12R1.56 N#Cc1cc(C(=O)O)ccc1O Amb10068292 [0,0,0,0,0,0|2,0,0]=2 292 B12R1.56 N#Cc1cc(C(=O)O)ccc1S Amb24713653 [0,0,0,0,0,0|2,1,0]=3 293 B12R1.56 N#Cc1cc(C(=O)O)cnc1Br Amb22751533 [0,0,0,0,0,0|4,0,0]=4 294 B12R1.56 N#Cc1cc(C(=O)O)cnc1Cl Amb22432442 [0,0,0,0,0,0|4,0,0]=4 295 B12R1.56 N#Cc1cc(C(=O)O)cnc1F Amb28384606 [0,0,0,0,0,0|4,0,0]=4 296 B12R1.56 N#Cc1cc(C(=O)O)cnc1N Amb25178696 [0,0,0,0,0,0|4,0,0]=4 297 B12R1.56 N#Cc1cc(C(=O)O)cnc1O Amb26005177 [0,0,0,0,0,0|3,0,0]=3 298 B12R1.56 N#Cc1cc(C(=O)O)cnc1S Amb24528406 [0,0,0,0,0,0|3,1,0]=4 299 B12R1.56 N#Cc1cc(C(=O)O)ncc1Br Amb25258914 [0,0,0,0,0,0|4,0,0]=4 300 B12R1.56 N#Cc1cc(C(=O)O)ncc1Cl Amb27470824 [0,0,0,0,0,0|4,0,0]=4 301 B12R1.56 N#Cc1cc(C(=O)O)ncc1F Amb24409090 [0,0,0,0,0,0|4,0,0]=4 302 B12R1.56 N#Cc1cc(C(=O)O)ncc1N Amb25255674 [0,0,0,0,0,0|4,0,0]=4 303 B12R1.56 N#Cc1cc(C(=O)O)ncc1S Amb24528410 [0,0,0,0,0,0|3,1,0]=4 304 B12R1.56 N#Cc1cc(C(N)=O)ccc1Br Amb23399999 [0,0,0,0,0,0|4,0,0]=4 305 B12R1.56 N#Cc1cc(C(N)=O)ccc1F Amb26495024 [0,0,0,0,0,0|4,0,0]=4 306 B12R1.56 N#Cc1cc(C(N)=O)ccc1O Amb27954715 [0,0,0,0,0,0|3,0,0]=3 307 B12R1.56 N#Cc1cc(S(=O)O)ccc1F Amb28246484 [0,0,0,0,0,0|4,0,0]=4 308 B12R1.56 N#Cc1cc([N+](=O)[O-])ccc1O Amb6889303 [0,0,0,0,0,0|3,0,1]=4 309 B12R1.56 N#Cc1nc(C(=O)Cl)ccc1O Amb28284345 [0,0,0,0,0,0|4,0,0]=4 310 B12R1.56 N#Cc1nc(C(=O)O)ccc1Cl Amb27212800 [0,0,0,0,0,0|4,0,0]=4 311 B12R1.56 N#Cc1nc(C(=O)O)ccc1F Amb26517597 [0,0,0,0,0,0|4,0,0]=4 312 B12R1.56 N#Cc1nc(C(=O)O)ccc1N Amb28434917 [0,0,0,0,0,0|4,0,0]=4 313 B12R1.56 N#Cc1nc(C(=O)O)ccc1O Amb28077315 [0,0,0,0,0,0|3,0,0]=3 314 B12R1.56 N#Cc1nc(C(=O)O)ccc1S Amb27491841 [0,0,0,0,0,0|3,1,0]=4 315 B12R1.56 NC(=O)c1ccc(Br)c(CBr)c1 Amb26934748 [0,0,0,0,0,0|4,0,0]=4 316 B12R1.56 NC(=O)c1ccc(F)c(C=O)c1 Amb16233263 [0,0,0,0,0,0|4,0,0]=4 317 B12R1.56 NC(=O)c1ccc(F)c(CBr)c1 Amb27817492 [0,0,0,0,0,0|4,0,0]=4 318 B12R1.56 NCc1cc(C(=O)O)ccc1Cl Amb17594794 [0,0,0,0,0,0|3,0,0]=3 319 B12R1.56 NCc1cc(C(=O)O)ccc1F Amb25149912 [0,0,0,0,0,0|3,0,0]=3 320 B12R1.56 NCc1cc(C(=O)O)ccc1F Amb28872398 [0,0,0,0,0,0|3,0,0]=3 321 B12R1.56 NCc1cc(C(=O)O)ccc1O Amb6369524 [0,0,0,0,0,0|2,0,0]=2 322 B12R1.56 NCc1cc(C(=O)O)ccc1O Amb6872193 [0,0,0,0,0,0|2,0,0]=2 323 B12R1.56 NCc1cc([N+](=O)[O-])ccc1O Amb2370822 [0,0,0,0,0,0|3,0,1]=4 324 B12R1.56 NCc1cc([N+](=O)[O-])ccc1O Amb404772 [0,0,0,0,0,0|3,0,1]=4 325 B12R1.56 NNc1cc(C(=O)Cl)ccc1Br Amb26397799 [0,0,0,0,0,0|4,0,0]=4 326 B12R1.56 NNc1cc(C(=O)Cl)ccc1N Amb28323622 [0,0,0,0,0,0|4,0,0]=4 327 B12R1.56 NNc1cc(C(=O)O)ccc1Cl Amb1105105 [0,0,0,0,0,0|3,0,0]=3 328 B12R1.56 NNc1cc(C(=O)O)ccc1Cl Amb1209487 [0,0,0,0,0,0|3,0,0]=3 329 B12R1.56 NNc1cc(C(=O)O)ccc1I Amb27665719 [0,0,0,0,0,0|3,0,0]=3 330 B12R1.56 NNc1cc(C(N)=O)ccc1Cl Amb27234601 [0,0,0,0,0,0|4,0,0]=4 331 B12R1.56 NNc1cc([N+](=O)[O-])ccc1O Amb18826208 [0,0,0,0,0,0|3,0,1]=4 332 B12R1.56 Nc1ccc(C(=O)O)cc1CO Amb23437483 [0,0,0,0,0,0|3,0,0]=3 333 B12R1.56 Nc1ccc(C(=O)O)cc1CS Amb27481772 [0,0,0,0,0,0|3,0,0]=3 334 B12R1.56 Nc1ccc(C(=O)O)nc1C=O Amb28410166 [0,0,0,0,0,0|4,0,0]=4 335 B12R1.56 Nc1ncc(C(=O)O)cc1C=O Amb27619083 [0,0,0,0,0,0|4,0,0]=4 336 B12R1.56 Nc1ncc(C(=O)O)cc1C=O Amb33309598 [0,0,0,0,0,0|4,0,0]=4 337 B12R1.56 Nc1ncc(C(=O)O)cc1CO Amb33309543 [0,0,0,0,0,0|4,0,0]=4 338 B12R1.56 O=C(Cl)c1ccc(Br)c(CBr)c1 Amb27244095 [0,0,0,0,0,0|4,0,0]=4 339 B12R1.56 O=C(Cl)c1ccc(Cl)c(CI)c1 Amb27416529 [0,0,0,0,0,0|4,0,0]=4 340 B12R1.56 O=C(O)c1ccc(Br)c(CBr)c1 Amb22735820 [0,0,0,0,0,0|3,0,0]=3 341 B12R1.56 O=C(O)c1ccc(Br)c(CO)c1 Amb22233767 [0,0,0,0,0,0|3,0,0]=3 342 B12R1.56 O=C(O)c1ccc(Cl)c(CBr)c1 Amb22735956 [0,0,0,0,0,0|3,0,0]=3 343 B12R1.56 O=C(O)c1ccc(Cl)c(CO)c1 Amb23437474 [0,0,0,0,0,0|3,0,0]=3 344 B12R1.56 O=C(O)c1ccc(F)c(CBr)c1 Amb22735642 [0,0,0,0,0,0|3,0,0]=3 345 B12R1.56 O=C(O)c1ccc(F)c(CCl)c1 Amb26478511 [0,0,0,0,0,0|3,0,0]=3 346 B12R1.56 O=C(O)c1ccc(F)c(CO)c1 Amb18967401 [0,0,0,0,0,0|3,0,0]=3 347 B12R1.56 O=C(O)c1ccc(F)c(CS)c1 Amb18967403 [0,0,0,0,0,0|3,0,0]=3 348 B12R1.56 O=C(O)c1ccc(I)c(CCl)c1 Amb27856385 [0,0,0,0,0,0|3,0,0]=3 349 B12R1.56 O=C(O)c1ccc(I)c(CO)c1 Amb23437472 [0,0,0,0,0,0|3,0,0]=3 350 B12R1.56 O=C(O)c1ccc(O)c(CO)c1 Amb18646841 [0,0,0,0,0,0|2,0,0]=2 351 B12R1.56 O=C(O)c1cnc(Cl)c(CBr)c1 Amb27221387 [0,0,0,0,0,0|4,0,0]=4 352 B12R1.56 O=Cc1cc(B(O)O)ccc1O Amb22432235 [0,0,0,0,0,0|3,0,1]=4 353 B12R1.56 O=Cc1cc(C(=O)O)ccc1Br Amb33551798 [0,0,0,0,0,0|3,0,0]=3 354 B12R1.56 O=Cc1cc(C(=O)O)ccc1Cl Amb24374869 [0,0,0,0,0,0|3,0,0]=3 355 B12R1.56 O=Cc1cc(C(=O)O)ccc1F Amb2724974 [0,0,0,0,0,0|3,0,0]=3 356 B12R1.56 O=Cc1cc(C(=O)O)ccc1O Amb6296672 [0,0,0,0,0,0|2,0,0]=2 357 B12R1.56 O=Cc1cc(C(=O)O)cnc1Cl Amb26023979 [0,0,0,0,0,0|4,0,0]=4 358 B12R1.56 O=Cc1cc(C(=O)O)cnc1F Amb33745836 [0,0,0,0,0,0|4,0,0]=4 359 B12R1.56 O=Cc1cc(C(=O)O)ncc1F Amb32755980 [0,0,0,0,0,0|4,0,0]=4 360 B12R1.56 O=Cc1cc(N(=O)=O)ccc1O Amb2720236 [0,0,0,0,0,0|3,0,1]=4 361 B12R1.56 O=Cc1cc([N+](=O)[O-])ccc1O Amb2611301 [0,0,0,0,0,0|3,0,1]=4 362 B12R1.56 O=Cc1nc(C(=O)O)ccc1F Amb33072979 [0,0,0,0,0,0|4,0,0]=4 363 B12R1.56 O=N(=O)c1ccc(O)c(CBr)c1 Amb20620520 [0,0,0,0,0,0|3,0,1]=4 364 B12R1.56 O=[N+]([O-])c1ccc(O)c(CBr)c1 Amb3939719 [0,0,0,0,0,0|3,0,1]=4 365 B12R1.56 O=[N+]([O-])c1ccc(O)c(CCl)c1 Amb375606 [0,0,0,0,0,0|3,0,1]=4 366 B12R1.56 O=[N+]([O-])c1ccc(O)c(CO)c1 Amb837526 [0,0,0,0,0,0|3,0,1]=4 367 B12R1.56 O=[N+]([O-])c1ccc(O)c(CS)c1 Amb33429831 [0,0,0,0,0,0|3,0,1]=4 368 B11R1.21 C=C(C)c1ccc(N)c(C)c1 Amb17107086 [1,0,0,0,0,0|3,0,0]=4 369 B11R1.21 C=C(C)c1ccc(O)c(C)c1 Amb18124921 [1,0,0,0,0,0|2,0,0]=3 370 B11R1.21 C=C1C=CC(C(=O)O)=CC1=C Amb25982898 [1,0,0,0,0,0|1,0,1]=3 371 B11R1.21 CC(=O)C1=CC(=O)C(O)=CO1 Amb28428652 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.21 CC(=O)C1=CN(C)C(=O)C=C1 Amb26449705 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.21 CC(=O)c1cc(Br)c(O)cn1 Amb27242797 [1,0,0,0,0,0|3,0,0]=4 374 B11R1.21 CC(=O)c1cc(C)c(Br)cn1 Amb22756185 [1,0,0,0,0,0|3,0,0]=4 375 B11R1.21 CC(=O)c1cc(C)c(C)cn1 Amb27842058 [1,0,0,0,0,0|3,0,0]=4 376 B11R1.21 CC(=O)c1cc(C)c(Cl)cn1 Amb25839234 [1,0,0,0,0,0|3,0,0]=4 377 B11R1.21 CC(=O)c1cc(C)c(N)cn1 Amb24436705 [1,0,0,0,0,0|3,0,0]=4 378 B11R1.21 CC(=O)c1ccc(Br)c(Br)c1 Amb8427144 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.21 CC(=O)c1ccc(Br)c(C)c1 Amb3941604 [1,0,0,0,0,0|2,0,0]=3 380 B11R1.21 CC(=O)c1ccc(Br)c(C)n1 Amb25265646 [1,0,0,0,0,0|3,0,0]=4 381 B11R1.21 CC(=O)c1ccc(Br)c(Cl)c1 Amb21922906 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.21 CC(=O)c1ccc(Br)c(F)c1 Amb8393313 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.21 CC(=O)c1ccc(Br)c(I)c1 Amb26915226 [1,0,0,0,0,0|3,0,0]=4 384 B11R1.21 CC(=O)c1ccc(Br)c(N)c1 Amb9678321 [1,0,0,0,0,0|3,0,0]=4 385 B11R1.21 CC(=O)c1ccc(Br)c(O)c1 Amb20407392 [1,0,0,0,0,0|2,0,0]=3 386 B11R1.21 CC(=O)c1ccc(C)c(Br)c1 Amb6296407 [1,0,0,0,0,0|3,0,0]=4 387 B11R1.21 CC(=O)c1ccc(C)c(C)c1 Amb844093 [1,0,0,0,0,0|2,0,0]=3 388 B11R1.21 CC(=O)c1ccc(C)c(Cl)c1 Amb10607161 [1,0,0,0,0,0|3,0,0]=4 389 B11R1.21 CC(=O)c1ccc(C)c(F)c1 Amb2688167 [1,0,0,0,0,0|3,0,0]=4 390 B11R1.21 CC(=O)c1ccc(C)c(N)c1 Amb22587627 [1,0,0,0,0,0|3,0,0]=4 391 B11R1.21 CC(=O)c1ccc(C)c(N)c1 Amb9859639 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.21 CC(=O)c1ccc(C)c(O)c1 Amb17334297 [1,0,0,0,0,0|2,0,0]=3 393 B11R1.21 CC(=O)c1ccc(Cl)c(Br)c1 Amb8383437 [1,0,0,0,0,0|3,0,0]=4 394 B11R1.21 CC(=O)c1ccc(Cl)c(C)c1 Amb2722589 [1,0,0,0,0,0|2,0,0]=3 395 B11R1.21 CC(=O)c1ccc(Cl)c(C)n1 Amb25891534 [1,0,0,0,0,0|3,0,0]=4 396 B11R1.21 CC(=O)c1ccc(Cl)c(Cl)c1 Amb2722619 [1,0,0,0,0,0|3,0,0]=4 397 B11R1.21 CC(=O)c1ccc(Cl)c(F)c1 Amb2684189 [1,0,0,0,0,0|3,0,0]=4 398 B11R1.21 CC(=O)c1ccc(Cl)c(N)c1 Amb3429014 [1,0,0,0,0,0|3,0,0]=4 399 B11R1.21 CC(=O)c1ccc(Cl)c(O)c1 Amb18126734 [1,0,0,0,0,0|2,0,0]=3 400 B11R1.21 CC(=O)c1ccc(Cl)c(O)n1 Amb27764086 [1,0,0,0,0,0|3,0,0]=4 401 B11R1.21 CC(=O)c1ccc(F)c(Br)c1 Amb1233295 [1,0,0,0,0,0|3,0,0]=4 402 B11R1.21 CC(=O)c1ccc(F)c(C)c1 Amb5740247 [1,0,0,0,0,0|2,0,0]=3 403 B11R1.21 CC(=O)c1ccc(F)c(Cl)c1 Amb2726182 [1,0,0,0,0,0|3,0,0]=4 404 B11R1.21 CC(=O)c1ccc(F)c(F)c1 Amb1397747 [1,0,0,0,0,0|3,0,0]=4 405 B11R1.21 CC(=O)c1ccc(F)c(I)c1 Amb27592920 [1,0,0,0,0,0|3,0,0]=4 406 B11R1.21 CC(=O)c1ccc(F)c(N)c1 Amb8387154 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.21 CC(=O)c1ccc(F)c(O)c1 Amb19944608 [1,0,0,0,0,0|2,0,0]=3 408 B11R1.21 CC(=O)c1ccc(I)c(Br)c1 Amb24057226 [1,0,0,0,0,0|3,0,0]=4 409 B11R1.21 CC(=O)c1ccc(I)c(N)c1 Amb27969064 [1,0,0,0,0,0|3,0,0]=4 410 B11R1.21 CC(=O)c1ccc(I)c(O)c1 Amb23437508 [1,0,0,0,0,0|2,0,0]=3 411 B11R1.21 CC(=O)c1ccc(N)c(Br)c1 Amb2695799 [1,0,0,0,0,0|3,0,0]=4 412 B11R1.21 CC(=O)c1ccc(N)c(C)c1 Amb17138423 [1,0,0,0,0,0|2,0,0]=3 413 B11R1.21 CC(=O)c1ccc(N)c(Cl)c1 Amb2695803 [1,0,0,0,0,0|3,0,0]=4 414 B11R1.21 CC(=O)c1ccc(N)c(F)c1 Amb33109780 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.21 CC(=O)c1ccc(N)c(F)c1 Amb6760385 [1,0,0,0,0,0|3,0,0]=4 416 B11R1.21 CC(=O)c1ccc(N)c(I)c1 Amb22169738 [1,0,0,0,0,0|3,0,0]=4 417 B11R1.21 CC(=O)c1ccc(N)c(N)c1 Amb17202026 [1,0,0,0,0,0|3,0,0]=4 418 B11R1.21 CC(=O)c1ccc(N)c(O)c1 Amb8630247 [1,0,0,0,0,0|2,0,0]=3 419 B11R1.21 CC(=O)c1ccc(O)c(Br)c1 Amb20620486 [1,0,0,0,0,0|2,0,0]=3 420 B11R1.21 CC(=O)c1ccc(O)c(C)c1 Amb2464915 [1,0,0,0,0,0|1,0,0]=2 421 B11R1.21 CC(=O)c1ccc(O)c(Cl)c1 Amb2209368 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.21 CC(=O)c1ccc(O)c(Cl)n1 Amb27244818 [1,0,0,0,0,0|3,0,0]=4 423 B11R1.21 CC(=O)c1ccc(O)c(F)c1 Amb6384001 [1,0,0,0,0,0|2,0,0]=3 424 B11R1.21 CC(=O)c1ccc(O)c(I)c1 Amb28129824 [1,0,0,0,0,0|2,0,0]=3 425 B11R1.21 CC(=O)c1ccc(O)c(N)c1 Amb16186924 [1,0,0,0,0,0|2,0,0]=3 426 B11R1.21 CC(=O)c1ccc(O)c(N)c1 Amb28719624 [1,0,0,0,0,0|2,0,0]=3 427 B11R1.21 CC(=O)c1ccc(O)c(O)c1 Amb1240533 [1,0,0,0,0,0|1,0,0]=2 428 B11R1.21 CC(=O)c1cnc(Br)c(C)c1 Amb25147869 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.21 CC(=O)c1cnc(Br)c(O)c1 Amb27652361 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.21 CC(=O)c1cnc(Cl)c(C)c1 Amb22410823 [1,0,0,0,0,0|3,0,0]=4 431 B11R1.21 CC(=O)c1cnc(Cl)c(O)c1 Amb27482947 [1,0,0,0,0,0|3,0,0]=4 432 B11R1.21 CC(=O)c1cnc(F)c(C)c1 Amb25073920 [1,0,0,0,0,0|3,0,0]=4 433 B11R1.21 CC(=O)c1cnc(N)c(C)c1 Amb20247772 [1,0,0,0,0,0|3,0,0]=4 434 B11R1.21 CC(C)c1ccc(O)c(O)c1 Amb6298799 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.21 CC(N)c1ccc(O)c(O)c1 Amb28423415 [1,0,0,0,0,0|2,0,1]=4 436 B11R1.21 CC(O)c1ccc(O)c(Cl)c1 Amb21984354 [1,0,0,0,0,0|2,0,1]=4 437 B11R1.21 CC(O)c1ccc(O)c(F)c1 Amb27252906 [1,0,0,0,0,0|2,0,1]=4 438 B11R1.21 CC(O)c1ccc(O)c(N)c1 Amb29845092 [1,0,0,0,0,0|2,0,1]=4 439 B11R1.21 CC(O)c1ccc(O)c(O)c1 Amb22229046 [1,0,0,0,0,0|1,0,1]=3 440 B11R1.21 CC1=CC(C(=O)O)=CNC1=O Amb21963584 [1,0,0,0,0,0|1,0,1]=3 441 B11R1.21 CC1=CC=C(C(=O)O)NC1=O Amb18125523 [1,0,0,0,0,0|2,0,1]=4 442 B11R1.21 CC1=CC=C(C(=O)O)OC1=O Amb18644609 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.21 CC1=NC(C(=O)O)=CNC1=O Amb18125649 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.21 CN1C=C(C(=O)O)C=CC1=O Amb18280724 [1,0,0,0,0,0|1,0,1]=3 445 B11R1.21 CN1C=C(C(=O)O)C=NC1=O Amb18125650 [1,0,0,0,0,0|2,0,1]=4 446 B11R1.21 CN1C=C(C(=O)O)N=CC1=O Amb27865859 [1,0,0,0,0,0|2,0,1]=4 447 B11R1.21 CN1C=C(C(=O)O)N=CC1=O Amb30584797 [1,0,0,0,0,0|2,0,1]=4 448 B11R1.21 CN1C=C(C(N)=O)C=CC1=O Amb19133490 [1,0,0,0,0,0|2,0,1]=4 449 B11R1.21 CN1C=CC(C(=O)O)=CC1=O Amb18949290 [1,0,0,0,0,0|2,0,1]=4 450 B11R1.21 CN1N=C(C(=O)O)C=CC1=O Amb18372544 [1,0,0,0,0,0|2,0,1]=4 451 B11R1.21 C[C@@H](N)c1ccc(O)c(O)c1 Amb24074554 [1,0,0,0,0,0|2,0,1]=4 452 B11R1.21 C[C@@H](O)c1ccc(O)c(Br)c1 Amb27450421 [1,0,0,0,0,0|2,0,1]=4 453 B11R1.21 C[C@@H](O)c1ccc(O)c(Cl)c1 Amb26480544 [1,0,0,0,0,0|2,0,1]=4 454 B11R1.21 C[C@@H](O)c1ccc(O)c(F)c1 Amb26611410 [1,0,0,0,0,0|2,0,1]=4 455 B11R1.21 C[C@@H](O)c1ccc(O)c(O)c1 Amb25692329 [1,0,0,0,0,0|1,0,1]=3 456 B11R1.21 C[C@H](N)c1ccc(O)c(O)c1 Amb25698263 [1,0,0,0,0,0|2,0,1]=4 457 B11R1.21 C[C@H](O)c1ccc(O)c(Br)c1 Amb26856292 [1,0,0,0,0,0|2,0,1]=4 458 B11R1.21 C[C@H](O)c1ccc(O)c(Cl)c1 Amb26501886 [1,0,0,0,0,0|2,0,1]=4 459 B11R1.21 C[C@H](O)c1ccc(O)c(F)c1 Amb26631290 [1,0,0,0,0,0|2,0,1]=4 460 B11R1.21 C[C@H](O)c1ccc(O)c(O)c1 Amb25841624 [1,0,0,0,0,0|1,0,1]=3 461 B11R1.21 C[n+]1cc(C(=O)[O-])ccc1S Amb2612032 [1,0,0,0,0,0|1,1,1]=4 462 B11R1.21 Cc1cc(B(O)O)ccc1Br Amb21963482 [1,0,0,0,0,0|2,0,1]=4 463 B11R1.21 Cc1cc(B(O)O)ccc1Cl Amb6365896 [1,0,0,0,0,0|2,0,1]=4 464 B11R1.21 Cc1cc(B(O)O)ccc1F Amb2455998 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.21 Cc1cc(B(O)O)ccc1I Amb24407397 [1,0,0,0,0,0|2,0,1]=4 466 B11R1.21 Cc1cc(B(O)O)ccc1N Amb25106888 [1,0,0,0,0,0|2,0,1]=4 467 B11R1.21 Cc1cc(B(O)O)ccc1O Amb21856167 [1,0,0,0,0,0|1,0,1]=3 468 B11R1.21 Cc1cc(B(O)O)cnc1O Amb20669520 [1,0,0,0,0,0|2,0,1]=4 469 B11R1.21 Cc1cc(B(O)O)ncc1O Amb27488849 [1,0,0,0,0,0|2,0,1]=4 470 B11R1.21 Cc1cc(C(=N)N)ccc1Br Amb22755971 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.21 Cc1cc(C(=N)N)ccc1Br Amb28994395 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.21 Cc1cc(C(=N)N)ccc1Cl Amb25097178 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.21 Cc1cc(C(=N)N)ccc1F Amb18796670 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.21 Cc1cc(C(=N)N)cnc1O Amb29864833 [1,0,0,0,0,0|3,0,0]=4 475 B11R1.21 Cc1cc(C(=O)Cl)ccc1Br Amb3939572 [1,0,0,0,0,0|2,0,0]=3 476 B11R1.21 Cc1cc(C(=O)Cl)ccc1Cl Amb19891030 [1,0,0,0,0,0|2,0,0]=3 477 B11R1.21 Cc1cc(C(=O)Cl)ccc1F Amb2688194 [1,0,0,0,0,0|2,0,0]=3 478 B11R1.21 Cc1cc(C(=O)Cl)ccc1I Amb24126325 [1,0,0,0,0,0|2,0,0]=3 479 B11R1.21 Cc1cc(C(=O)Cl)ccc1N Amb24626036 [1,0,0,0,0,0|2,0,0]=3 480 B11R1.21 Cc1cc(C(=O)Cl)ncc1Br Amb24077444 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.21 Cc1cc(C(=O)F)ccc1N Amb28250724 [1,0,0,0,0,0|2,0,0]=3 482 B11R1.21 Cc1cc(C(=O)O)ccc1Br Amb2685318 [1,0,0,0,0,0|1,0,0]=2 483 B11R1.21 Cc1cc(C(=O)O)ccc1Cl Amb2686196 [1,0,0,0,0,0|1,0,0]=2 484 B11R1.21 Cc1cc(C(=O)O)ccc1F Amb2688190 [1,0,0,0,0,0|1,0,0]=2 485 B11R1.21 Cc1cc(C(=O)O)ccc1I Amb1060318 [1,0,0,0,0,0|1,0,0]=2 486 B11R1.21 Cc1cc(C(=O)O)ccc1N Amb2371743 [1,0,0,0,0,0|1,0,0]=2 487 B11R1.21 Cc1cc(C(=O)O)ccc1O Amb2688764 [1,0,0,0,0,0|0,0,0]=1 488 B11R1.21 Cc1cc(C(=O)O)ccc1S Amb18948117 [1,0,0,0,0,0|0,1,0]=2 489 B11R1.21 Cc1cc(C(=O)O)cnc1Br Amb20248203 [1,0,0,0,0,0|2,0,0]=3 490 B11R1.21 Cc1cc(C(=O)O)cnc1C Amb19516857 [1,0,0,0,0,0|2,0,0]=3 491 B11R1.21 Cc1cc(C(=O)O)cnc1C Amb22587378 [1,0,0,0,0,0|2,0,0]=3 492 B11R1.21 Cc1cc(C(=O)O)cnc1Cl Amb18126851 [1,0,0,0,0,0|2,0,0]=3 493 B11R1.21 Cc1cc(C(=O)O)cnc1F Amb2447519 [1,0,0,0,0,0|2,0,0]=3 494 B11R1.21 Cc1cc(C(=O)O)cnc1I Amb23446996 [1,0,0,0,0,0|2,0,0]=3 495 B11R1.21 Cc1cc(C(=O)O)cnc1S Amb18126607 [1,0,0,0,0,0|1,1,0]=3 496 B11R1.21 Cc1cc(C(=O)O)ncc1Br Amb10603820 [1,0,0,0,0,0|2,0,0]=3 497 B11R1.21 Cc1cc(C(=O)O)ncc1Cl Amb18198381 [1,0,0,0,0,0|2,0,0]=3 498 B11R1.21 Cc1cc(C(=O)O)ncc1F Amb26880387 [1,0,0,0,0,0|2,0,0]=3 499 B11R1.21 Cc1cc(C(=O)O)ncc1N Amb24601802 [1,0,0,0,0,0|2,0,0]=3 500 B11R1.21 Cc1cc(C(=O)O)ncc1N Amb33620557 [1,0,0,0,0,0|2,0,0]=3 501 B11R1.21 Cc1cc(C(=O)O)ncc1O Amb24417626 [1,0,0,0,0,0|1,0,0]=2 502 B11R1.21 Cc1cc(C(=O)O)nnc1C Amb27972213 [1,0,0,0,0,0|3,0,0]=4 503 B11R1.21 Cc1cc(C(=O)O)nnc1Cl Amb26427367 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.21 Cc1cc(C(=O)O)nnc1N Amb24414031 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.21 Cc1cc(C(=O)O)nnc1O Amb24739987 [1,0,0,0,0,0|2,0,0]=3 506 B11R1.21 Cc1cc(C(=O)S)ccc1O Amb28202373 [1,0,0,0,0,0|0,1,0]=2 507 B11R1.21 Cc1cc(C(=O)[O-])cnc1F Amb32663179 [1,0,0,0,0,0|2,0,1]=4 508 B11R1.21 Cc1cc(C(C)C)ccc1O Amb24083057 [1,0,0,0,0,0|2,0,1]=4 509 B11R1.21 Cc1cc(C(C)N)ccc1O Amb28397726 [1,0,0,0,0,0|2,0,1]=4 510 B11R1.21 Cc1cc(C(C)O)ccc1Br Amb17595841 [1,0,0,0,0,0|2,0,1]=4 511 B11R1.21 Cc1cc(C(C)O)ccc1Cl Amb17594279 [1,0,0,0,0,0|2,0,1]=4 512 B11R1.21 Cc1cc(C(C)O)ccc1F Amb17138449 [1,0,0,0,0,0|2,0,1]=4 513 B11R1.21 Cc1cc(C(C)O)ccc1N Amb30024369 [1,0,0,0,0,0|2,0,1]=4 514 B11R1.21 Cc1cc(C(F)F)ccc1O Amb26880372 [1,0,0,0,0,0|2,0,1]=4 515 B11R1.21 Cc1cc(C(N)=O)cc[n+]1[O-] Amb26530378 [1,0,0,0,0,0|2,0,1]=4 516 B11R1.21 Cc1cc(C(N)=O)ccc1Br Amb6366142 [1,0,0,0,0,0|2,0,0]=3 517 B11R1.21 Cc1cc(C(N)=O)ccc1Cl Amb18054429 [1,0,0,0,0,0|2,0,0]=3 518 B11R1.21 Cc1cc(C(N)=O)ccc1F Amb2688182 [1,0,0,0,0,0|2,0,0]=3 519 B11R1.21 Cc1cc(C(N)=O)ccc1I Amb20642439 [1,0,0,0,0,0|2,0,0]=3 520 B11R1.21 Cc1cc(C(N)=O)ccc1N Amb1112542 [1,0,0,0,0,0|2,0,0]=3 521 B11R1.21 Cc1cc(C(N)=O)ccc1N Amb7969565 [1,0,0,0,0,0|2,0,0]=3 522 B11R1.21 Cc1cc(C(N)=O)ccc1O Amb24487721 [1,0,0,0,0,0|1,0,0]=2 523 B11R1.21 Cc1cc(C(N)=O)ccc1S Amb27790189 [1,0,0,0,0,0|1,1,0]=3 524 B11R1.21 Cc1cc(C(N)=O)cnc1Cl Amb22410821 [1,0,0,0,0,0|3,0,0]=4 525 B11R1.21 Cc1cc(C(N)=O)cnc1F Amb25727261 [1,0,0,0,0,0|3,0,0]=4 526 B11R1.21 Cc1cc(C(N)=O)cnc1O Amb18125359 [1,0,0,0,0,0|2,0,0]=3 527 B11R1.21 Cc1cc(C(N)=O)ncc1Br Amb24077448 [1,0,0,0,0,0|3,0,0]=4 528 B11R1.21 Cc1cc(C(N)=S)ccc1Br Amb25727620 [1,0,0,0,0,0|2,1,0]=4 529 B11R1.21 Cc1cc(C(N)=S)ccc1Cl Amb22043764 [1,0,0,0,0,0|2,1,0]=4 530 B11R1.21 Cc1cc(C(N)=S)ccc1F Amb6263103 [1,0,0,0,0,0|2,1,0]=4 531 B11R1.21 Cc1cc(C(N)=S)cnc1O Amb35706715 [1,0,0,0,0,0|2,1,0]=4 532 B11R1.21 Cc1cc(N(=O)=O)ccc1Br Amb2720564 [1,0,0,0,0,0|2,0,1]=4 533 B11R1.21 Cc1cc(N(=O)=O)ccc1Cl Amb20620835 [1,0,0,0,0,0|2,0,1]=4 534 B11R1.21 Cc1cc(N(=O)=O)ccc1F Amb8386183 [1,0,0,0,0,0|2,0,1]=4 535 B11R1.21 Cc1cc(N(=O)=O)ccc1N Amb20621647 [1,0,0,0,0,0|2,0,1]=4 536 B11R1.21 Cc1cc(N(=O)=O)ccc1O Amb20621679 [1,0,0,0,0,0|1,0,1]=3 537 B11R1.21 Cc1cc(N(=O)=O)cnc1O Amb20621419 [1,0,0,0,0,0|2,0,1]=4 538 B11R1.21 Cc1cc(S(=O)Cl)ccc1Cl Amb18568615 [1,0,0,0,0,0|3,0,0]=4 539 B11R1.21 Cc1cc(S(=O)Cl)ccc1F Amb18565181 [1,0,0,0,0,0|3,0,0]=4 540 B11R1.21 Cc1cc(S(=O)O)ccc1Cl Amb18066253 [1,0,0,0,0,0|2,0,0]=3 541 B11R1.21 Cc1cc(S(=O)O)ccc1F Amb18564006 [1,0,0,0,0,0|2,0,0]=3 542 B11R1.21 Cc1cc(S(=O)O)cnc1F Amb32992468 [1,0,0,0,0,0|3,0,0]=4 543 B11R1.21 Cc1cc(S(=O)O)ncc1Cl Amb32992482 [1,0,0,0,0,0|3,0,0]=4 544 B11R1.21 Cc1cc(S(=O)[O-])ccc1Br Amb27882425 [1,0,0,0,0,0|2,0,1]=4 545 B11R1.21 Cc1cc(S(=O)[O-])ccc1Cl Amb32754678 [1,0,0,0,0,0|2,0,1]=4 546 B11R1.21 Cc1cc(S(=O)[O-])ccc1F Amb26968517 [1,0,0,0,0,0|2,0,1]=4 547 B11R1.21 Cc1cc([C@@H](C)O)ccc1Br Amb33330982 [1,0,0,0,0,0|2,0,1]=4 548 B11R1.21 Cc1cc([C@@H](C)O)ccc1Cl Amb26489374 [1,0,0,0,0,0|2,0,1]=4 549 B11R1.21 Cc1cc([C@@H](C)O)ccc1F Amb24509262 [1,0,0,0,0,0|2,0,1]=4 550 B11R1.21 Cc1cc([C@H](C)N)ccc1O Amb27950221 [1,0,0,0,0,0|2,0,1]=4 551 B11R1.21 Cc1cc([C@H](C)O)ccc1Br Amb33330984 [1,0,0,0,0,0|2,0,1]=4 552 B11R1.21 Cc1cc([C@H](C)O)ccc1Cl Amb24704425 [1,0,0,0,0,0|2,0,1]=4 553 B11R1.21 Cc1cc([C@H](C)O)ccc1F Amb26576099 [1,0,0,0,0,0|2,0,1]=4 554 B11R1.21 Cc1cc([N+](=O)[O-])ccc1Br Amb2685368 [1,0,0,0,0,0|2,0,1]=4 555 B11R1.21 Cc1cc([N+](=O)[O-])ccc1Cl Amb4036059 [1,0,0,0,0,0|2,0,1]=4 556 B11R1.21 Cc1cc([N+](=O)[O-])ccc1F Amb2688273 [1,0,0,0,0,0|2,0,1]=4 557 B11R1.21 Cc1cc([N+](=O)[O-])ccc1I Amb2180400 [1,0,0,0,0,0|2,0,1]=4 558 B11R1.21 Cc1cc([N+](=O)[O-])ccc1N Amb1935047 [1,0,0,0,0,0|2,0,1]=4 559 B11R1.21 Cc1cc([N+](=O)[O-])ccc1O Amb6298550 [1,0,0,0,0,0|1,0,1]=3 560 B11R1.21 Cc1cc([N+](=O)[O-])ccc1S Amb27648904 [1,0,0,0,0,0|1,1,1]=4 561 B11R1.21 Cc1cc([N+](=O)[O-])cnc1O Amb8393038 [1,0,0,0,0,0|2,0,1]=4 562 B11R1.21 Cc1ccc(B(O)O)cc1C Amb2455985 [1,0,0,0,0,0|2,0,1]=4 563 B11R1.21 Cc1ccc(B(O)O)cc1O Amb16185701 [1,0,0,0,0,0|2,0,1]=4 564 B11R1.21 Cc1ccc(C(=N)N)cc1C Amb22229053 [1,0,0,0,0,0|3,0,0]=4 565 B11R1.21 Cc1ccc(C(=N)N)cc1C Amb2695868 [1,0,0,0,0,0|3,0,0]=4 566 B11R1.21 Cc1ccc(C(=N)N)cc1O Amb26345223 [1,0,0,0,0,0|3,0,0]=4 567 B11R1.21 Cc1ccc(C(=O)Cl)cc1Br Amb2685324 [1,0,0,0,0,0|3,0,0]=4 568 B11R1.21 Cc1ccc(C(=O)Cl)cc1C Amb2687483 [1,0,0,0,0,0|2,0,0]=3 569 B11R1.21 Cc1ccc(C(=O)Cl)cc1F Amb2688193 [1,0,0,0,0,0|3,0,0]=4 570 B11R1.21 Cc1ccc(C(=O)Cl)cc1I Amb24093128 [1,0,0,0,0,0|3,0,0]=4 571 B11R1.21 Cc1ccc(C(=O)Cl)cc1O Amb6743372 [1,0,0,0,0,0|2,0,0]=3 572 B11R1.21 Cc1ccc(C(=O)Cl)nc1C Amb27868846 [1,0,0,0,0,0|3,0,0]=4 573 B11R1.21 Cc1ccc(C(=O)F)cc1F Amb26983710 [1,0,0,0,0,0|3,0,0]=4 574 B11R1.21 Cc1ccc(C(=O)O)c[n+]1[O-] Amb19959235 [1,0,0,0,0,0|2,0,1]=4 575 B11R1.21 Cc1ccc(C(=O)O)cc1Br Amb6349350 [1,0,0,0,0,0|2,0,0]=3 576 B11R1.21 Cc1ccc(C(=O)O)cc1C Amb2558202 [1,0,0,0,0,0|1,0,0]=2 577 B11R1.21 Cc1ccc(C(=O)O)cc1Cl Amb2686198 [1,0,0,0,0,0|2,0,0]=3 578 B11R1.21 Cc1ccc(C(=O)O)cc1F Amb1229910 [1,0,0,0,0,0|2,0,0]=3 579 B11R1.21 Cc1ccc(C(=O)O)cc1I Amb1125694 [1,0,0,0,0,0|2,0,0]=3 580 B11R1.21 Cc1ccc(C(=O)O)cc1N Amb2781997 [1,0,0,0,0,0|2,0,0]=3 581 B11R1.21 Cc1ccc(C(=O)O)cc1O Amb1229982 [1,0,0,0,0,0|1,0,0]=2 582 B11R1.21 Cc1ccc(C(=O)O)cc1S Amb24054265 [1,0,0,0,0,0|1,1,0]=3 583 B11R1.21 Cc1ccc(C(=O)O)nc1Br Amb20248966 [1,0,0,0,0,0|3,0,0]=4 584 B11R1.21 Cc1ccc(C(=O)O)nc1C Amb18125242 [1,0,0,0,0,0|2,0,0]=3 585 B11R1.21 Cc1ccc(C(=O)O)nc1Cl Amb19958043 [1,0,0,0,0,0|3,0,0]=4 586 B11R1.21 Cc1ccc(C(=O)O)nc1F Amb22235354 [1,0,0,0,0,0|3,0,0]=4 587 B11R1.21 Cc1ccc(C(=O)O)nc1N Amb25802260 [1,0,0,0,0,0|3,0,0]=4 588 B11R1.21 Cc1ccc(C(=O)[O-])cc1C Amb33512946 [1,0,0,0,0,0|1,0,1]=3 589 B11R1.21 Cc1ccc(C(=O)[O-])cc1Cl Amb22489468 [1,0,0,0,0,0|2,0,1]=4 590 B11R1.21 Cc1ccc(C(C)O)cc1C Amb1109785 [1,0,0,0,0,0|2,0,1]=4 591 B11R1.21 Cc1ccc(C(N)=O)cc1Br Amb6344044 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.21 Cc1ccc(C(N)=O)cc1C Amb2726179 [1,0,0,0,0,0|2,0,0]=3 593 B11R1.21 Cc1ccc(C(N)=O)cc1Cl Amb3429858 [1,0,0,0,0,0|3,0,0]=4 594 B11R1.21 Cc1ccc(C(N)=O)cc1F Amb2688181 [1,0,0,0,0,0|3,0,0]=4 595 B11R1.21 Cc1ccc(C(N)=O)cc1I Amb6397437 [1,0,0,0,0,0|3,0,0]=4 596 B11R1.21 Cc1ccc(C(N)=O)cc1N Amb1113095 [1,0,0,0,0,0|3,0,0]=4 597 B11R1.21 Cc1ccc(C(N)=O)cc1O Amb6671841 [1,0,0,0,0,0|2,0,0]=3 598 B11R1.21 Cc1ccc(C(N)=O)nc1C Amb28342630 [1,0,0,0,0,0|3,0,0]=4 599 B11R1.21 Cc1ccc(C(N)=S)cc1C Amb9618634 [1,0,0,0,0,0|2,1,0]=4 600 B11R1.21 Cc1ccc(C(N)=S)cc1O Amb25719896 [1,0,0,0,0,0|2,1,0]=4 601 B11R1.21 Cc1ccc(N(=O)=O)cc1C Amb20621948 [1,0,0,0,0,0|2,0,1]=4 602 B11R1.21 Cc1ccc(N(=O)=O)cc1O Amb21837681 [1,0,0,0,0,0|2,0,1]=4 603 B11R1.21 Cc1ccc(S(=O)Cl)cc1C Amb18564364 [1,0,0,0,0,0|3,0,0]=4 604 B11R1.21 Cc1ccc(S(=O)O)cc1C Amb18065475 [1,0,0,0,0,0|2,0,0]=3 605 B11R1.21 Cc1ccc(S(=O)[O-])cc1C Amb24427010 [1,0,0,0,0,0|2,0,1]=4 606 B11R1.21 Cc1ccc(S(C)=O)cc1C Amb19892211 [1,0,0,0,0,0|3,0,0]=4 607 B11R1.21 Cc1ccc([C@@H](C)O)cc1C Amb6893500 [1,0,0,0,0,0|2,0,1]=4 608 B11R1.21 Cc1ccc([C@@H](C)O)cc1O Amb33372650 [1,0,0,0,0,0|2,0,1]=4 609 B11R1.21 Cc1ccc([C@H](C)O)cc1C Amb6893501 [1,0,0,0,0,0|2,0,1]=4 610 B11R1.21 Cc1ccc([C@H](C)O)cc1O Amb33372649 [1,0,0,0,0,0|2,0,1]=4 611 B11R1.21 Cc1ccc([N+](=O)[O-])cc1O Amb2582781 [1,0,0,0,0,0|2,0,1]=4 612 B11R1.21 Cc1cnc(C(=O)O)cc1Br Amb22497693 [1,0,0,0,0,0|3,0,0]=4 613 B11R1.21 Cc1cnc(C(=O)O)cc1C Amb25892501 [1,0,0,0,0,0|2,0,0]=3 614 B11R1.21 Cc1cnc(C(=O)O)cc1C Amb30584727 [1,0,0,0,0,0|2,0,0]=3 615 B11R1.21 Cc1cnc(C(=O)O)cc1Cl Amb20670542 [1,0,0,0,0,0|3,0,0]=4 616 B11R1.21 Cc1cnc(C(=O)O)cc1F Amb27823093 [1,0,0,0,0,0|3,0,0]=4 617 B11R1.21 Cc1cnc(C(=O)O)cc1I Amb26557372 [1,0,0,0,0,0|3,0,0]=4 618 B11R1.21 Cc1cnc(C(=O)O)cc1O Amb20667840 [1,0,0,0,0,0|2,0,0]=3 619 B11R1.21 Cc1cnc(C(N)=O)cc1O Amb27590294 [1,0,0,0,0,0|3,0,0]=4 620 B11R1.21 Cc1nc(C(=O)Cl)ccc1Br Amb25149004 [1,0,0,0,0,0|3,0,0]=4 621 B11R1.21 Cc1nc(C(=O)F)ccc1N Amb28346789 [1,0,0,0,0,0|3,0,0]=4 622 B11R1.21 Cc1nc(C(=O)F)ccc1O Amb27390623 [1,0,0,0,0,0|2,0,0]=3 623 B11R1.21 Cc1nc(C(=O)O)ccc1Br Amb33549131 [1,0,0,0,0,0|2,0,0]=3 624 B11R1.21 Cc1nc(C(=O)O)ccc1F Amb21864546 [1,0,0,0,0,0|2,0,0]=3 625 B11R1.21 Cc1nc(C(=O)O)ccc1I Amb28186464 [1,0,0,0,0,0|2,0,0]=3 626 B11R1.21 Cc1nc(C(=O)O)ccc1O Amb26507572 [1,0,0,0,0,0|1,0,0]=2 627 B11R1.21 Cc1nc(C(=O)O)cnc1Cl Amb27431587 [1,0,0,0,0,0|3,0,0]=4 628 B11R1.21 Cc1nc(C(=O)O)cnc1N Amb25071590 [1,0,0,0,0,0|3,0,0]=4 629 B11R1.21 Cc1nc(C(=O)O)ncc1Br Amb26868064 [1,0,0,0,0,0|3,0,0]=4 630 B11R1.21 Cc1nc(C(N)=O)ccc1Br Amb22494648 [1,0,0,0,0,0|3,0,0]=4 631 B11R1.21 Cc1nc(C(N)=O)ccc1N Amb27639857 [1,0,0,0,0,0|3,0,0]=4 632 B11R1.21 Cc1nc([N+](=O)[O-])ccc1O Amb25335514 [1,0,0,0,0,0|2,0,1]=4 633 B11R1.21 Cc1ncc(C(=O)O)cc1Br Amb22234840 [1,0,0,0,0,0|3,0,0]=4 634 B11R1.21 Cc1ncc(C(=O)O)cc1Cl Amb27433483 [1,0,0,0,0,0|3,0,0]=4 635 B11R1.21 Cc1ncc(C(=O)O)cc1F Amb18830928 [1,0,0,0,0,0|3,0,0]=4 636 B11R1.21 Cc1ncc(C(=O)O)cc1N Amb23440034 [1,0,0,0,0,0|3,0,0]=4 637 B11R1.21 Cc1ncc(C(=O)O)cc1N Amb33742486 [1,0,0,0,0,0|3,0,0]=4 638 B11R1.21 Cc1ncc(C(=O)O)cc1O Amb13881250 [1,0,0,0,0,0|2,0,0]=3 639 B11R1.21 Cc1ncc(C(=O)O)nc1C Amb8009388 [1,0,0,0,0,0|3,0,0]=4 640 B11R1.21 Cn1cc(C(=O)Cl)ccc1=O Amb22227994 [1,0,0,0,0,0|2,0,1]=4 641 B11R1.21 Cn1cc(C(=O)O)ccc1=O Amb2783928 [1,0,0,0,0,0|1,0,1]=3 642 B11R1.21 Cn1ccc(C(=O)O)cc1=O Amb2612439 [1,0,0,0,0,0|2,0,1]=4 643 B11R1.21 Cn1ccc(C(=O)O)cc1=S Amb8439457 [1,0,0,0,0,0|2,1,0]=4 644 B11R1.21 N=C(N)c1ccc(O)c(Br)c1 Amb24097525 [1,0,0,0,0,0|3,0,0]=4 645 B11R1.21 N=C(N)c1ccc(O)c(Cl)c1 Amb18177961 [1,0,0,0,0,0|3,0,0]=4 646 B11R1.21 N=C(N)c1ccc(O)c(F)c1 Amb9523583 [1,0,0,0,0,0|3,0,0]=4 647 B11R1.21 N=C(N)c1ccc(O)c(O)c1 Amb28255581 [1,0,0,0,0,0|2,0,0]=3 648 B11R1.21 NC(=O)C1=CC(=O)C(O)=CN1 Amb26319350 [1,0,0,0,0,0|2,0,1]=4 649 B11R1.21 NC(=O)C1=CC=C(O)C(=O)N1 Amb27597580 [1,0,0,0,0,0|2,0,1]=4 650 B11R1.21 NC(=O)c1ccc(Br)c(Cl)c1 Amb21856620 [1,0,0,0,0,0|3,0,0]=4 651 B11R1.21 NC(=O)c1ccc(Br)c(F)c1 Amb11570824 [1,0,0,0,0,0|3,0,0]=4 652 B11R1.21 NC(=O)c1ccc(Br)c(I)c1 Amb19889875 [1,0,0,0,0,0|3,0,0]=4 653 B11R1.21 NC(=O)c1ccc(Br)c(N)c1 Amb18944459 [1,0,0,0,0,0|3,0,0]=4 654 B11R1.21 NC(=O)c1ccc(Br)c(O)c1 Amb20248961 [1,0,0,0,0,0|2,0,0]=3 655 B11R1.21 NC(=O)c1ccc(Cl)c(Br)c1 Amb21856659 [1,0,0,0,0,0|3,0,0]=4 656 B11R1.21 NC(=O)c1ccc(Cl)c(Cl)c1 Amb2726190 [1,0,0,0,0,0|3,0,0]=4 657 B11R1.21 NC(=O)c1ccc(Cl)c(F)c1 Amb21964736 [1,0,0,0,0,0|3,0,0]=4 658 B11R1.21 NC(=O)c1ccc(Cl)c(I)c1 Amb11480319 [1,0,0,0,0,0|3,0,0]=4 659 B11R1.21 NC(=O)c1ccc(Cl)c(N)c1 Amb1114429 [1,0,0,0,0,0|3,0,0]=4 660 B11R1.21 NC(=O)c1ccc(Cl)c(O)c1 Amb22501137 [1,0,0,0,0,0|2,0,0]=3 661 B11R1.21 NC(=O)c1ccc(F)c(Br)c1 Amb10841333 [1,0,0,0,0,0|3,0,0]=4 662 B11R1.21 NC(=O)c1ccc(F)c(Cl)c1 Amb2685935 [1,0,0,0,0,0|3,0,0]=4 663 B11R1.21 NC(=O)c1ccc(F)c(F)c1 Amb1224651 [1,0,0,0,0,0|3,0,0]=4 664 B11R1.21 NC(=O)c1ccc(F)c(I)c1 Amb19889876 [1,0,0,0,0,0|3,0,0]=4 665 B11R1.21 NC(=O)c1ccc(F)c(N)c1 Amb1125551 [1,0,0,0,0,0|3,0,0]=4 666 B11R1.21 NC(=O)c1ccc(F)c(N)c1 Amb21897111 [1,0,0,0,0,0|3,0,0]=4 667 B11R1.21 NC(=O)c1ccc(F)c(O)c1 Amb23437519 [1,0,0,0,0,0|2,0,0]=3 668 B11R1.21 NC(=O)c1ccc(I)c(Br)c1 Amb11329100 [1,0,0,0,0,0|3,0,0]=4 669 B11R1.21 NC(=O)c1ccc(I)c(Cl)c1 Amb21981742 [1,0,0,0,0,0|3,0,0]=4 670 B11R1.21 NC(=O)c1ccc(I)c(F)c1 Amb20642582 [1,0,0,0,0,0|3,0,0]=4 671 B11R1.21 NC(=O)c1ccc(I)c(I)c1 Amb26347309 [1,0,0,0,0,0|3,0,0]=4 672 B11R1.21 NC(=O)c1ccc(I)c(N)c1 Amb24533133 [1,0,0,0,0,0|3,0,0]=4 673 B11R1.21 NC(=O)c1ccc(I)c(O)c1 Amb10604518 [1,0,0,0,0,0|2,0,0]=3 674 B11R1.21 NC(=O)c1ccc(N)c(Br)c1 Amb33532728 [1,0,0,0,0,0|3,0,0]=4 675 B11R1.21 NC(=O)c1ccc(N)c(F)c1 Amb18280403 [1,0,0,0,0,0|3,0,0]=4 676 B11R1.21 NC(=O)c1ccc(N)c(I)c1 Amb23402156 [1,0,0,0,0,0|3,0,0]=4 677 B11R1.21 NC(=O)c1ccc(N)c(N)c1 Amb33529191 [1,0,0,0,0,0|3,0,0]=4 678 B11R1.21 NC(=O)c1ccc(N)c(O)c1 Amb23437514 [1,0,0,0,0,0|2,0,0]=3 679 B11R1.21 NC(=O)c1ccc(O)c(Br)c1 Amb26057216 [1,0,0,0,0,0|2,0,0]=3 680 B11R1.21 NC(=O)c1ccc(O)c(Cl)c1 Amb6671842 [1,0,0,0,0,0|2,0,0]=3 681 B11R1.21 NC(=O)c1ccc(O)c(F)c1 Amb27808175 [1,0,0,0,0,0|2,0,0]=3 682 B11R1.21 NC(=O)c1ccc(O)c(I)c1 Amb28398648 [1,0,0,0,0,0|2,0,0]=3 683 B11R1.21 NC(=O)c1ccc(O)c(N)c1 Amb9307840 [1,0,0,0,0,0|2,0,0]=3 684 B11R1.21 NC(=O)c1ccc(O)c(O)c1 Amb5492730 [1,0,0,0,0,0|1,0,0]=2 685 B11R1.21 NC(=O)c1cnc(Br)c(O)c1 Amb24519114 [1,0,0,0,0,0|3,0,0]=4 686 B11R1.21 NC(=S)c1ccc(O)c(Br)c1 Amb5762882 [1,0,0,0,0,0|2,1,0]=4 687 B11R1.21 NC(=S)c1ccc(O)c(Cl)c1 Amb19046880 [1,0,0,0,0,0|2,1,0]=4 688 B11R1.21 NC(=S)c1ccc(O)c(F)c1 Amb9523127 [1,0,0,0,0,0|2,1,0]=4 689 B11R1.21 NC(=S)c1ccc(O)c(O)c1 Amb1117602 [1,0,0,0,0,0|1,1,0]=3 690 B11R1.21 NC1=CC(C(=O)O)=CNC1=O Amb18200855 [1,0,0,0,0,0|2,0,1]=4 691 B11R1.21 Nc1cc(B(O)O)ccc1O Amb27617447 [1,0,0,0,0,0|2,0,1]=4 692 B11R1.21 Nc1cc(C(=O)Cl)ccc1Br Amb27945495 [1,0,0,0,0,0|3,0,0]=4 693 B11R1.21 Nc1cc(C(=O)Cl)ccc1F Amb27173682 [1,0,0,0,0,0|3,0,0]=4 694 B11R1.21 Nc1cc(C(=O)O)ccc1Br Amb6876192 [1,0,0,0,0,0|2,0,0]=3 695 B11R1.21 Nc1cc(C(=O)O)ccc1Cl Amb2720216 [1,0,0,0,0,0|2,0,0]=3 696 B11R1.21 Nc1cc(C(=O)O)ccc1F Amb10838541 [1,0,0,0,0,0|2,0,0]=3 697 B11R1.21 Nc1cc(C(=O)O)ccc1F Amb1980792 [1,0,0,0,0,0|2,0,0]=3 698 B11R1.21 Nc1cc(C(=O)O)ccc1I Amb20620266 [1,0,0,0,0,0|2,0,0]=3 699 B11R1.21 Nc1cc(C(=O)O)ccc1O Amb6335559 [1,0,0,0,0,0|1,0,0]=2 700 B11R1.21 Nc1cc(C(=O)O)ccc1O Amb8396074 [1,0,0,0,0,0|1,0,0]=2 701 B11R1.21 Nc1cc(C(=O)O)ccc1S Amb18647177 [1,0,0,0,0,0|1,1,0]=3 702 B11R1.21 Nc1cc(C(=O)O)cnc1Br Amb26989037 [1,0,0,0,0,0|3,0,0]=4 703 B11R1.21 Nc1cc(C(=O)O)cnc1Cl Amb22755350 [1,0,0,0,0,0|3,0,0]=4 704 B11R1.21 Nc1cc(C(=O)O)cnc1F Amb24673405 [1,0,0,0,0,0|3,0,0]=4 705 B11R1.21 Nc1cc(C(=O)O)cnc1N Amb17933345 [1,0,0,0,0,0|3,0,0]=4 706 B11R1.21 Nc1cc(C(=O)O)cnc1S Amb18198929 [1,0,0,0,0,0|2,1,0]=4 707 B11R1.21 Nc1cc(C(=O)O)ncc1Br Amb24061858 [1,0,0,0,0,0|3,0,0]=4 708 B11R1.21 Nc1cc(C(=O)O)ncc1Cl Amb27983517 [1,0,0,0,0,0|3,0,0]=4 709 B11R1.21 Nc1cc(C(=O)O)ncc1F Amb26064815 [1,0,0,0,0,0|3,0,0]=4 710 B11R1.21 Nc1cc(C(=O)O)ncc1F Amb33743411 [1,0,0,0,0,0|3,0,0]=4 711 B11R1.21 Nc1cc(N(=O)=O)ccc1O Amb5277344 [1,0,0,0,0,0|2,0,1]=4 712 B11R1.21 Nc1cc(S(=O)O)ccc1Cl Amb27252231 [1,0,0,0,0,0|3,0,0]=4 713 B11R1.21 Nc1cc([N+](=O)[O-])ccc1O Amb416198 [1,0,0,0,0,0|2,0,1]=4 714 B11R1.21 Nc1ccc(B(O)O)cc1O Amb24450871 [1,0,0,0,0,0|2,0,1]=4 715 B11R1.21 Nc1ccc(C(=O)Cl)cc1Br Amb25068003 [1,0,0,0,0,0|3,0,0]=4 716 B11R1.21 Nc1ccc(C(=O)Cl)cc1F Amb10839974 [1,0,0,0,0,0|3,0,0]=4 717 B11R1.21 Nc1ccc(C(=O)Cl)cc1I Amb28185868 [1,0,0,0,0,0|3,0,0]=4 718 B11R1.21 Nc1ccc(C(=O)O)cc1Br Amb2610450 [1,0,0,0,0,0|2,0,0]=3 719 B11R1.21 Nc1ccc(C(=O)O)cc1Cl Amb2684370 [1,0,0,0,0,0|2,0,0]=3 720 B11R1.21 Nc1ccc(C(=O)O)cc1F Amb3427807 [1,0,0,0,0,0|2,0,0]=3 721 B11R1.21 Nc1ccc(C(=O)O)cc1I Amb10070341 [1,0,0,0,0,0|2,0,0]=3 722 B11R1.21 Nc1ccc(C(=O)O)cc1N Amb28991357 [1,0,0,0,0,0|2,0,0]=3 723 B11R1.21 Nc1ccc(C(=O)O)cc1N Amb534799 [1,0,0,0,0,0|2,0,0]=3 724 B11R1.21 Nc1ccc(C(=O)O)cc1O Amb3940565 [1,0,0,0,0,0|1,0,0]=2 725 B11R1.21 Nc1ccc(C(=O)O)cc1S Amb20668181 [1,0,0,0,0,0|1,1,0]=3 726 B11R1.21 Nc1ccc(C(=O)O)cc1S Amb535967 [1,0,0,0,0,0|1,1,0]=3 727 B11R1.21 Nc1ccc(C(=O)O)nc1Br Amb24462272 [1,0,0,0,0,0|3,0,0]=4 728 B11R1.21 Nc1ccc(C(=O)O)nc1Cl Amb26633001 [1,0,0,0,0,0|3,0,0]=4 729 B11R1.21 Nc1ccc(C(=O)O)nc1F Amb28435295 [1,0,0,0,0,0|3,0,0]=4 730 B11R1.21 Nc1ccc(C(=O)O)nc1N Amb17097725 [1,0,0,0,0,0|3,0,0]=4 731 B11R1.21 Nc1ccc(C(=O)[O-])cc1N Amb33512957 [1,0,0,0,0,0|2,0,1]=4 732 B11R1.21 Nc1ccc(N(=O)=O)cc1O Amb8396410 [1,0,0,0,0,0|2,0,1]=4 733 B11R1.21 Nc1ccc([N+](=O)[O-])cc1O Amb4303739 [1,0,0,0,0,0|2,0,1]=4 734 B11R1.21 Nc1cnc(C(=O)O)cc1Br Amb25871181 [1,0,0,0,0,0|3,0,0]=4 735 B11R1.21 Nc1cnc(C(=O)O)cc1Cl Amb24709351 [1,0,0,0,0,0|3,0,0]=4 736 B11R1.21 Nc1nc(C(=O)O)ccc1Br Amb22498158 [1,0,0,0,0,0|3,0,0]=4 737 B11R1.21 Nc1nc(C(=O)O)ccc1Cl Amb23589339 [1,0,0,0,0,0|3,0,0]=4 738 B11R1.21 Nc1nc(C(=O)O)ccc1F Amb26386524 [1,0,0,0,0,0|3,0,0]=4 739 B11R1.21 Nc1nc(C(=O)O)ccc1O Amb22235554 [1,0,0,0,0,0|2,0,0]=3 740 B11R1.21 Nc1nc(C(=O)O)ccc1O Amb33172753 [1,0,0,0,0,0|2,0,0]=3 741 B11R1.21 Nc1ncc(C(=O)O)cc1Br Amb19889772 [1,0,0,0,0,0|3,0,0]=4 742 B11R1.21 Nc1ncc(C(=O)O)cc1Cl Amb6675664 [1,0,0,0,0,0|3,0,0]=4 743 B11R1.21 Nc1ncc(C(=O)O)cc1I Amb16230644 [1,0,0,0,0,0|3,0,0]=4 744 B11R1.21 Nc1ncc(C(=O)O)cc1O Amb19879002 [1,0,0,0,0,0|2,0,0]=3 745 B11R1.21 Nc1ncc(C(=O)O)cc1O Amb33483903 [1,0,0,0,0,0|2,0,0]=3 746 B11R1.21 O=C(Cl)c1ccc(Br)c(Cl)c1 Amb19888027 [1,0,0,0,0,0|3,0,0]=4 747 B11R1.21 O=C(Cl)c1ccc(Br)c(F)c1 Amb10841631 [1,0,0,0,0,0|3,0,0]=4 748 B11R1.21 O=C(Cl)c1ccc(Br)c(I)c1 Amb26579337 [1,0,0,0,0,0|3,0,0]=4 749 B11R1.21 O=C(Cl)c1ccc(Cl)c(Br)c1 Amb19888081 [1,0,0,0,0,0|3,0,0]=4 750 B11R1.21 O=C(Cl)c1ccc(Cl)c(Cl)c1 Amb1935253 [1,0,0,0,0,0|3,0,0]=4 751 B11R1.21 O=C(Cl)c1ccc(Cl)c(F)c1 Amb10841240 [1,0,0,0,0,0|3,0,0]=4 752 B11R1.21 O=C(Cl)c1ccc(Cl)c(I)c1 Amb25147886 [1,0,0,0,0,0|3,0,0]=4 753 B11R1.21 O=C(Cl)c1ccc(Cl)c(O)c1 Amb22736494 [1,0,0,0,0,0|2,0,0]=3 754 B11R1.21 O=C(Cl)c1ccc(F)c(Br)c1 Amb8387741 [1,0,0,0,0,0|3,0,0]=4 755 B11R1.21 O=C(Cl)c1ccc(F)c(Cl)c1 Amb2685967 [1,0,0,0,0,0|3,0,0]=4 756 B11R1.21 O=C(Cl)c1ccc(F)c(F)c1 Amb2687087 [1,0,0,0,0,0|3,0,0]=4 757 B11R1.21 O=C(Cl)c1ccc(F)c(I)c1 Amb25680988 [1,0,0,0,0,0|3,0,0]=4 758 B11R1.21 O=C(Cl)c1ccc(F)c(O)c1 Amb27668825 [1,0,0,0,0,0|2,0,0]=3 759 B11R1.21 O=C(Cl)c1ccc(I)c(Br)c1 Amb25983860 [1,0,0,0,0,0|3,0,0]=4 760 B11R1.21 O=C(Cl)c1ccc(I)c(Cl)c1 Amb21981741 [1,0,0,0,0,0|3,0,0]=4 761 B11R1.21 O=C(Cl)c1ccc(I)c(F)c1 Amb25147938 [1,0,0,0,0,0|3,0,0]=4 762 B11R1.21 O=C(Cl)c1ccc(I)c(I)c1 Amb20179402 [1,0,0,0,0,0|3,0,0]=4 763 B11R1.21 O=C(Cl)c1ccc(O)c(Cl)c1 Amb6743380 [1,0,0,0,0,0|2,0,0]=3 764 B11R1.21 O=C(Cl)c1ccc(O)c(F)c1 Amb26023050 [1,0,0,0,0,0|2,0,0]=3 765 B11R1.21 O=C(F)c1cc(F)c(O)cn1 Amb27654052 [1,0,0,0,0,0|3,0,0]=4 766 B11R1.21 O=C(F)c1ccc(F)c(Br)c1 Amb10839204 [1,0,0,0,0,0|3,0,0]=4 767 B11R1.21 O=C(F)c1ccc(F)c(Cl)c1 Amb10839929 [1,0,0,0,0,0|3,0,0]=4 768 B11R1.21 O=C(F)c1ccc(F)c(F)c1 Amb24552335 [1,0,0,0,0,0|3,0,0]=4 769 B11R1.21 O=C(I)c1ccc(O)c(O)c1 Amb27398217 [1,0,0,0,0,0|1,0,0]=2 770 B11R1.21 O=C(O)C1=CC(=O)C(Br)=CN1 Amb24483950 [1,0,0,0,0,0|2,0,1]=4 771 B11R1.21 O=C(O)C1=CC(=O)C(Br)=CO1 Amb18658338 [1,0,0,0,0,0|2,0,1]=4 772 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 Amb21962527 [1,0,0,0,0,0|1,0,1]=3 773 B11R1.21 O=C(O)C1=CC(=O)C(O)=CO1 Amb18125912 [1,0,0,0,0,0|1,0,1]=3 774 B11R1.21 O=C(O)C1=CC(=O)N(O)C=C1 Amb26455639 [1,0,0,0,0,0|1,0,1]=3 775 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 Amb21857410 [1,0,0,0,0,0|2,0,1]=4 776 B11R1.21 O=C(O)C1=CC=C(F)C(=O)N1 Amb22899461 [1,0,0,0,0,0|2,0,1]=4 777 B11R1.21 O=C(O)C1=CC=C(O)C(=O)N1 Amb24179163 [1,0,0,0,0,0|1,0,1]=3 778 B11R1.21 O=C(O)C1=CC=C(O)C(=O)O1 Amb27401871 [1,0,0,0,0,0|1,0,1]=3 779 B11R1.21 O=C(O)C1=CN(O)C(=O)C=C1 Amb33547583 [1,0,0,0,0,0|1,0,1]=3 780 B11R1.21 O=C(O)C1=CNC(=O)C(Br)=C1 Amb18769462 [1,0,0,0,0,0|2,0,1]=4 781 B11R1.21 O=C(O)C1=CNC(=O)C(Cl)=C1 Amb19406107 [1,0,0,0,0,0|2,0,1]=4 782 B11R1.21 O=C(O)C1=CNC(=O)C(O)=C1 Amb22498961 [1,0,0,0,0,0|1,0,1]=3 783 B11R1.21 O=C(O)C1=C[C@@H](O)[C@H](O)C=C1 Amb24088872 [1,0,0,0,0,0|0,0,2]=3 784 B11R1.21 O=C(O)c1cc(Br)c(Cl)cn1 Amb26989588 [1,0,0,0,0,0|3,0,0]=4 785 B11R1.21 O=C(O)c1cc(Br)c(F)cn1 Amb25698067 [1,0,0,0,0,0|3,0,0]=4 786 B11R1.21 O=C(O)c1cc(Br)c(O)cn1 Amb26012787 [1,0,0,0,0,0|2,0,0]=3 787 B11R1.21 O=C(O)c1cc(Cl)c(Br)cn1 Amb21963425 [1,0,0,0,0,0|3,0,0]=4 788 B11R1.21 O=C(O)c1cc(Cl)c(Cl)cn1 Amb20247870 [1,0,0,0,0,0|3,0,0]=4 789 B11R1.21 O=C(O)c1cc(Cl)c(F)cn1 Amb25151422 [1,0,0,0,0,0|3,0,0]=4 790 B11R1.21 O=C(O)c1cc(Cl)c(I)cn1 Amb27865224 [1,0,0,0,0,0|3,0,0]=4 791 B11R1.21 O=C(O)c1cc(Cl)c(O)cn1 Amb26494945 [1,0,0,0,0,0|2,0,0]=3 792 B11R1.21 O=C(O)c1cc(F)c(Br)cn1 Amb26395939 [1,0,0,0,0,0|3,0,0]=4 793 B11R1.21 O=C(O)c1cc(F)c(Cl)cn1 Amb24487683 [1,0,0,0,0,0|3,0,0]=4 794 B11R1.21 O=C(O)c1cc(F)c(I)cn1 Amb26421882 [1,0,0,0,0,0|3,0,0]=4 795 B11R1.21 O=C(O)c1cc(F)c(O)cn1 Amb27598032 [1,0,0,0,0,0|2,0,0]=3 796 B11R1.21 O=C(O)c1cc(I)c(F)cn1 Amb24595921 [1,0,0,0,0,0|3,0,0]=4 797 B11R1.21 O=C(O)c1cc(O)c(Cl)cn1 Amb25891410 [1,0,0,0,0,0|2,0,0]=3 798 B11R1.21 O=C(O)c1cc(O)c(F)cn1 Amb24594934 [1,0,0,0,0,0|2,0,0]=3 799 B11R1.21 O=C(O)c1cc(O)c(O)cn1 Amb30526971 [1,0,0,0,0,0|1,0,0]=2 800 B11R1.21 O=C(O)c1cc[n+]([O-])c(Br)c1 Amb26547254 [1,0,0,0,0,0|2,0,1]=4 801 B11R1.21 O=C(O)c1ccc(Br)[n+]([O-])c1 Amb27617454 [1,0,0,0,0,0|2,0,1]=4 802 B11R1.21 O=C(O)c1ccc(Br)c(Br)c1 Amb4009385 [1,0,0,0,0,0|2,0,0]=3 803 B11R1.21 O=C(O)c1ccc(Br)c(Cl)c1 Amb10071603 [1,0,0,0,0,0|2,0,0]=3 804 B11R1.21 O=C(O)c1ccc(Br)c(Cl)n1 Amb21856995 [1,0,0,0,0,0|3,0,0]=4 805 B11R1.21 O=C(O)c1ccc(Br)c(F)c1 Amb2685191 [1,0,0,0,0,0|2,0,0]=3 806 B11R1.21 O=C(O)c1ccc(Br)c(F)n1 Amb25958444 [1,0,0,0,0,0|3,0,0]=4 807 B11R1.21 O=C(O)c1ccc(Br)c(I)c1 Amb21963501 [1,0,0,0,0,0|2,0,0]=3 808 B11R1.21 O=C(O)c1ccc(Br)c(I)n1 Amb22751236 [1,0,0,0,0,0|3,0,0]=4 809 B11R1.21 O=C(O)c1ccc(Br)c(O)c1 Amb10072072 [1,0,0,0,0,0|1,0,0]=2 810 B11R1.21 O=C(O)c1ccc(Br)c(O)n1 Amb20075768 [1,0,0,0,0,0|2,0,0]=3 811 B11R1.21 O=C(O)c1ccc(Br)c(S)c1 Amb23557914 [1,0,0,0,0,0|1,1,0]=3 812 B11R1.21 O=C(O)c1ccc(Cl)[n+]([O-])c1 Amb27248689 [1,0,0,0,0,0|2,0,1]=4 813 B11R1.21 O=C(O)c1ccc(Cl)c(Br)c1 Amb845611 [1,0,0,0,0,0|2,0,0]=3 814 B11R1.21 O=C(O)c1ccc(Cl)c(Br)n1 Amb21961456 [1,0,0,0,0,0|3,0,0]=4 815 B11R1.21 O=C(O)c1ccc(Cl)c(Cl)c1 Amb3940030 [1,0,0,0,0,0|2,0,0]=3 816 B11R1.21 O=C(O)c1ccc(Cl)c(Cl)n1 Amb18129913 [1,0,0,0,0,0|3,0,0]=4 817 B11R1.21 O=C(O)c1ccc(Cl)c(F)c1 Amb2685952 [1,0,0,0,0,0|2,0,0]=3 818 B11R1.21 O=C(O)c1ccc(Cl)c(F)n1 Amb8390111 [1,0,0,0,0,0|3,0,0]=4 819 B11R1.21 O=C(O)c1ccc(Cl)c(I)c1 Amb1135958 [1,0,0,0,0,0|2,0,0]=3 820 B11R1.21 O=C(O)c1ccc(Cl)c(O)c1 Amb33544451 [1,0,0,0,0,0|1,0,0]=2 821 B11R1.21 O=C(O)c1ccc(Cl)c(S)c1 Amb18650042 [1,0,0,0,0,0|1,1,0]=3 822 B11R1.21 O=C(O)c1ccc(F)c(Br)c1 Amb535157 [1,0,0,0,0,0|2,0,0]=3 823 B11R1.21 O=C(O)c1ccc(F)c(Br)n1 Amb21856154 [1,0,0,0,0,0|3,0,0]=4 824 B11R1.21 O=C(O)c1ccc(F)c(Cl)c1 Amb535152 [1,0,0,0,0,0|2,0,0]=3 825 B11R1.21 O=C(O)c1ccc(F)c(Cl)n1 Amb20670131 [1,0,0,0,0,0|3,0,0]=4 826 B11R1.21 O=C(O)c1ccc(F)c(F)c1 Amb1218139 [1,0,0,0,0,0|2,0,0]=3 827 B11R1.21 O=C(O)c1ccc(F)c(F)n1 Amb8390116 [1,0,0,0,0,0|3,0,0]=4 828 B11R1.21 O=C(O)c1ccc(F)c(I)c1 Amb10841793 [1,0,0,0,0,0|2,0,0]=3 829 B11R1.21 O=C(O)c1ccc(F)c(O)c1 Amb535709 [1,0,0,0,0,0|1,0,0]=2 830 B11R1.21 O=C(O)c1ccc(F)c(S)c1 Amb19374986 [1,0,0,0,0,0|1,1,0]=3 831 B11R1.21 O=C(O)c1ccc(I)c(Br)c1 Amb5722021 [1,0,0,0,0,0|2,0,0]=3 832 B11R1.21 O=C(O)c1ccc(I)c(Cl)c1 Amb19888183 [1,0,0,0,0,0|2,0,0]=3 833 B11R1.21 O=C(O)c1ccc(I)c(F)c1 Amb8628766 [1,0,0,0,0,0|2,0,0]=3 834 B11R1.21 O=C(O)c1ccc(I)c(F)n1 Amb27848254 [1,0,0,0,0,0|3,0,0]=4 835 B11R1.21 O=C(O)c1ccc(I)c(I)c1 Amb15690596 [1,0,0,0,0,0|2,0,0]=3 836 B11R1.21 O=C(O)c1ccc(I)c(O)c1 Amb2616716 [1,0,0,0,0,0|1,0,0]=2 837 B11R1.21 O=C(O)c1ccc(I)c(S)c1 Amb27775191 [1,0,0,0,0,0|1,1,0]=3 838 B11R1.21 O=C(O)c1ccc(O)c(Br)c1 Amb24061924 [1,0,0,0,0,0|1,0,0]=2 839 B11R1.21 O=C(O)c1ccc(O)c(Br)c1 Amb34242 [1,0,0,0,0,0|1,0,0]=2 840 B11R1.21 O=C(O)c1ccc(O)c(Br)n1 Amb8439768 [1,0,0,0,0,0|2,0,0]=3 841 B11R1.21 O=C(O)c1ccc(O)c(Cl)c1 Amb2721201 [1,0,0,0,0,0|1,0,0]=2 842 B11R1.21 O=C(O)c1ccc(O)c(Cl)n1 Amb18127134 [1,0,0,0,0,0|2,0,0]=3 843 B11R1.21 O=C(O)c1ccc(O)c(F)c1 Amb1810752 [1,0,0,0,0,0|1,0,0]=2 844 B11R1.21 O=C(O)c1ccc(O)c(I)c1 Amb6296256 [1,0,0,0,0,0|1,0,0]=2 845 B11R1.21 O=C(O)c1ccc(O)c(I)n1 Amb26850461 [1,0,0,0,0,0|2,0,0]=3 846 B11R1.21 O=C(O)c1ccc(O)c(O)c1 Amb1960218 [1,0,0,0,0,0|0,0,0]=1 847 B11R1.21 O=C(O)c1ccc(O)c(S)c1 Amb18647318 [1,0,0,0,0,0|0,1,0]=2 848 B11R1.21 O=C(O)c1ccc(S)c(Br)c1 Amb28323215 [1,0,0,0,0,0|1,1,0]=3 849 B11R1.21 O=C(O)c1ccc(S)c(Cl)c1 Amb13952299 [1,0,0,0,0,0|1,1,0]=3 850 B11R1.21 O=C(O)c1ccc(S)c(F)c1 Amb18280497 [1,0,0,0,0,0|1,1,0]=3 851 B11R1.21 O=C(O)c1ccc(S)c(I)c1 Amb27398203 [1,0,0,0,0,0|1,1,0]=3 852 B11R1.21 O=C(O)c1ccc(S)c(O)c1 Amb24686672 [1,0,0,0,0,0|0,1,0]=2 853 B11R1.21 O=C(O)c1cnc(Br)c(Br)c1 Amb2642737 [1,0,0,0,0,0|3,0,0]=4 854 B11R1.21 O=C(O)c1cnc(Br)c(Cl)c1 Amb18662913 [1,0,0,0,0,0|3,0,0]=4 855 B11R1.21 O=C(O)c1cnc(Br)c(F)c1 Amb10605789 [1,0,0,0,0,0|3,0,0]=4 856 B11R1.21 O=C(O)c1cnc(Br)c(O)c1 Amb13881195 [1,0,0,0,0,0|2,0,0]=3 857 B11R1.21 O=C(O)c1cnc(Cl)c(Br)c1 Amb3427859 [1,0,0,0,0,0|3,0,0]=4 858 B11R1.21 O=C(O)c1cnc(Cl)c(Cl)c1 Amb1227710 [1,0,0,0,0,0|3,0,0]=4 859 B11R1.21 O=C(O)c1cnc(Cl)c(F)c1 Amb18127542 [1,0,0,0,0,0|3,0,0]=4 860 B11R1.21 O=C(O)c1cnc(Cl)c(I)c1 Amb9677760 [1,0,0,0,0,0|3,0,0]=4 861 B11R1.21 O=C(O)c1cnc(Cl)c(O)c1 Amb18197853 [1,0,0,0,0,0|2,0,0]=3 862 B11R1.21 O=C(O)c1cnc(F)c(Br)c1 Amb20241456 [1,0,0,0,0,0|3,0,0]=4 863 B11R1.21 O=C(O)c1cnc(F)c(Cl)c1 Amb8439421 [1,0,0,0,0,0|3,0,0]=4 864 B11R1.21 O=C(O)c1cnc(F)c(F)c1 Amb8390112 [1,0,0,0,0,0|3,0,0]=4 865 B11R1.21 O=C(O)c1cnc(I)c(O)c1 Amb10880793 [1,0,0,0,0,0|2,0,0]=3 866 B11R1.21 O=C(O)c1cnc(O)c(Cl)c1 Amb2720205 [1,0,0,0,0,0|2,0,0]=3 867 B11R1.21 O=C(O)c1cnc(O)c(I)c1 Amb22504600 [1,0,0,0,0,0|2,0,0]=3 868 B11R1.21 O=C(O)c1cnc(O)c(O)n1 Amb18125913 [1,0,0,0,0,0|2,0,0]=3 869 B11R1.21 O=C([O-])c1ccc(F)c(Cl)c1 Amb33513118 [1,0,0,0,0,0|2,0,1]=4 870 B11R1.21 O=C([O-])c1ccc(F)c(F)c1 Amb8397067 [1,0,0,0,0,0|2,0,1]=4 871 B11R1.21 O=C([O-])c1ccc(F)c(O)c1 Amb33512989 [1,0,0,0,0,0|1,0,1]=3 872 B11R1.21 O=C([O-])c1ccc(O)c(F)c1 Amb33512990 [1,0,0,0,0,0|1,0,1]=3 873 B11R1.21 O=C([O-])c1ccc(O)c(O)c1 Amb15690937 [1,0,0,0,0,0|0,0,1]=2 874 B11R1.21 O=N(=O)c1ccc(F)c(O)c1 Amb20621348 [1,0,0,0,0,0|2,0,1]=4 875 B11R1.21 O=N(=O)c1ccc(O)c(Br)c1 Amb20620564 [1,0,0,0,0,0|2,0,1]=4 876 B11R1.21 O=N(=O)c1ccc(O)c(Cl)c1 Amb20620811 [1,0,0,0,0,0|2,0,1]=4 877 B11R1.21 O=N(=O)c1ccc(O)c(F)c1 Amb20621351 [1,0,0,0,0,0|2,0,1]=4 878 B11R1.21 O=S(O)c1ccc(Cl)c(Cl)c1 Amb18066327 [1,0,0,0,0,0|3,0,0]=4 879 B11R1.21 O=S(O)c1ccc(F)c(Cl)c1 Amb18224864 [1,0,0,0,0,0|3,0,0]=4 880 B11R1.21 O=S(O)c1ccc(F)c(F)c1 Amb18862926 [1,0,0,0,0,0|3,0,0]=4 881 B11R1.21 O=S([O-])c1ccc(Br)c(O)c1 Amb32755455 [1,0,0,0,0,0|2,0,1]=4 882 B11R1.21 O=S([O-])c1ccc(Cl)c(O)c1 Amb32754946 [1,0,0,0,0,0|2,0,1]=4 883 B11R1.21 O=S([O-])c1ccc(O)c(F)c1 Amb32755003 [1,0,0,0,0,0|2,0,1]=4 884 B11R1.21 O=[N+]([O-])c1ccc(Br)c(O)c1 Amb8439239 [1,0,0,0,0,0|2,0,1]=4 885 B11R1.21 O=[N+]([O-])c1ccc(Cl)c(O)c1 Amb1033005 [1,0,0,0,0,0|2,0,1]=4 886 B11R1.21 O=[N+]([O-])c1ccc(F)c(O)c1 Amb6751882 [1,0,0,0,0,0|2,0,1]=4 887 B11R1.21 O=[N+]([O-])c1ccc(I)c(O)c1 Amb19515148 [1,0,0,0,0,0|2,0,1]=4 888 B11R1.21 O=[N+]([O-])c1ccc(O)c(Br)c1 Amb9489517 [1,0,0,0,0,0|2,0,1]=4 889 B11R1.21 O=[N+]([O-])c1ccc(O)c(Cl)c1 Amb444015 [1,0,0,0,0,0|2,0,1]=4 890 B11R1.21 O=[N+]([O-])c1ccc(O)c(F)c1 Amb2688264 [1,0,0,0,0,0|2,0,1]=4 891 B11R1.21 O=[N+]([O-])c1ccc(O)c(I)c1 Amb3318556 [1,0,0,0,0,0|2,0,1]=4 892 B11R1.21 O=[N+]([O-])c1ccc(O)c(O)c1 Amb33546836 [1,0,0,0,0,0|1,0,1]=3 893 B11R1.21 O=[N+]([O-])c1ccc(O)c(S)c1 Amb33475123 [1,0,0,0,0,0|1,1,1]=4 894 B11R1.21 O=[N+]([O-])c1ccc(S)c(O)c1 Amb27855569 [1,0,0,0,0,0|1,1,1]=4 895 B11R1.21 O=[N+]([O-])c1cnc(O)c(O)c1 Amb27405987 [1,0,0,0,0,0|2,0,1]=4 896 B11R1.21 OB(O)c1ccc(Br)c(O)c1 Amb26513949 [1,0,0,0,0,0|2,0,1]=4 897 B11R1.21 OB(O)c1ccc(Cl)c(O)c1 Amb20171110 [1,0,0,0,0,0|2,0,1]=4 898 B11R1.21 OB(O)c1ccc(F)c(O)c1 Amb10839667 [1,0,0,0,0,0|2,0,1]=4 899 B11R1.21 OB(O)c1ccc(I)c(O)c1 Amb24659310 [1,0,0,0,0,0|2,0,1]=4 900 B11R1.21 OB(O)c1ccc(O)c(Br)c1 Amb25682437 [1,0,0,0,0,0|2,0,1]=4 901 B11R1.21 OB(O)c1ccc(O)c(Cl)c1 Amb10071948 [1,0,0,0,0,0|2,0,1]=4 902 B11R1.21 OB(O)c1ccc(O)c(F)c1 Amb9766226 [1,0,0,0,0,0|2,0,1]=4 903 B11R1.21 OB(O)c1ccc(O)c(I)c1 Amb25922801 [1,0,0,0,0,0|2,0,1]=4 904 B11R1.21 OB(O)c1ccc(O)c(O)c1 Amb27647952 [1,0,0,0,0,0|1,0,1]=3 905 B11R1.21 OB(O)c1cnc(O)c(O)c1 Amb26640680 [1,0,0,0,0,0|2,0,1]=4 906 B11R1.266 C#Cc1cc(C(=O)O)ccn1 Amb22499967 [1,0,0,0,0,0|2,0,1]=4 907 B11R1.266 C#Cc1cccc(C(=O)O)c1 Amb10603689 [1,0,0,0,0,0|1,0,1]=3 908 B11R1.266 C#Cc1cccc(C(C)=O)c1 Amb2721511 [1,0,0,0,0,0|2,0,1]=4 909 B11R1.266 C#Cc1cccc(C(N)=O)c1 Amb22235121 [1,0,0,0,0,0|2,0,1]=4 910 B11R1.266 C#Cc1ccnc(C(=O)O)c1 Amb27766487 [1,0,0,0,0,0|2,0,1]=4 911 B11R1.266 C#Cc1cncc(C(=O)O)c1 Amb23598945 [1,0,0,0,0,0|2,0,1]=4 912 B11R1.266 C=C(C)c1cncc(OC)c1 Amb32721878 [1,0,0,0,0,0|3,0,0]=4 913 B11R1.266 C=C(F)c1cccc(OC)c1 Amb33329290 [1,0,0,0,0,0|2,0,0]=3 914 B11R1.266 C=Cc1cc(C(=O)O)ccn1 Amb25368401 [1,0,0,0,0,0|2,0,1]=4 915 B11R1.266 C=Cc1cccc(C(=O)O)c1 Amb9825008 [1,0,0,0,0,0|1,0,1]=3 916 B11R1.266 C=Cc1cccc(C(=O)O)n1 Amb25790049 [1,0,0,0,0,0|2,0,1]=4 917 B11R1.266 C=Cc1cccc(C(C)=O)c1 Amb24627220 [1,0,0,0,0,0|2,0,1]=4 918 B11R1.266 C=Cc1ccnc(C(=O)O)c1 Amb27975433 [1,0,0,0,0,0|2,0,1]=4 919 B11R1.266 CC(=O)c1cccc(C#N)c1 Amb2684215 [1,0,0,0,0,0|3,0,0]=4 920 B11R1.266 CC(=O)c1cccc(C=O)c1 Amb10607476 [1,0,0,0,0,0|3,0,0]=4 921 B11R1.266 CC(=O)c1cccc(CBr)c1 Amb22886702 [1,0,0,0,0,0|3,0,0]=4 922 B11R1.266 CC(=O)c1cccc(CCl)c1 Amb17621753 [1,0,0,0,0,0|3,0,0]=4 923 B11R1.266 CC(=O)c1cccc(CF)c1 Amb28194579 [1,0,0,0,0,0|3,0,0]=4 924 B11R1.266 CC(=O)c1cccc(CN)c1 Amb6297696 [1,0,0,0,0,0|3,0,0]=4 925 B11R1.266 CC(=O)c1cccc(CO)c1 Amb10608833 [1,0,0,0,0,0|3,0,0]=4 926 B11R1.266 CC(=O)c1cccc(N=O)c1 Amb25087142 [1,0,0,0,0,0|3,0,0]=4 927 B11R1.266 CC(=O)c1cccc(NN)c1 Amb3942547 [1,0,0,0,0,0|3,0,0]=4 928 B11R1.266 CC[n+]1cccc(C(=O)O)c1 Amb27848054 [1,0,0,0,0,0|2,0,0]=3 929 B11R1.266 CC[n+]1cccc(C(C)=O)c1 Amb32455994 [1,0,0,0,0,0|3,0,0]=4 930 B11R1.266 CC[n+]1cccc(C(N)=O)c1 Amb24677630 [1,0,0,0,0,0|3,0,0]=4 931 B11R1.266 CCc1cc(C(=O)Cl)ccn1 Amb24379461 [1,0,0,0,0,0|3,0,0]=4 932 B11R1.266 CCc1cc(C(=O)O)ccn1 Amb8630987 [1,0,0,0,0,0|2,0,0]=3 933 B11R1.266 CCc1cc(C(=O)O)ncn1 Amb24410715 [1,0,0,0,0,0|3,0,0]=4 934 B11R1.266 CCc1cc(C(N)=O)ccn1 Amb10606527 [1,0,0,0,0,0|3,0,0]=4 935 B11R1.266 CCc1cccc(B(O)O)c1 Amb33528872 [1,0,0,0,0,0|2,0,1]=4 936 B11R1.266 CCc1cccc(C(=N)N)c1 Amb25074481 [1,0,0,0,0,0|3,0,0]=4 937 B11R1.266 CCc1cccc(C(=O)Cl)c1 Amb22269011 [1,0,0,0,0,0|2,0,0]=3 938 B11R1.266 CCc1cccc(C(=O)O)c1 Amb8439094 [1,0,0,0,0,0|1,0,0]=2 939 B11R1.266 CCc1cccc(C(=O)O)n1 Amb21857614 [1,0,0,0,0,0|2,0,0]=3 940 B11R1.266 CCc1cccc(C(=O)O)n1 Amb8630986 [1,0,0,0,0,0|2,0,0]=3 941 B11R1.266 CCc1cccc(C(C)=O)c1 Amb2726208 [1,0,0,0,0,0|2,0,0]=3 942 B11R1.266 CCc1cccc(C(C)=O)n1 Amb25887119 [1,0,0,0,0,0|3,0,0]=4 943 B11R1.266 CCc1cccc(C(C)O)c1 Amb17593741 [1,0,0,0,0,0|2,0,1]=4 944 B11R1.266 CCc1cccc(C(N)=S)c1 Amb22229304 [1,0,0,0,0,0|2,1,0]=4 945 B11R1.266 CCc1cccc(S(=O)O)n1 Amb32992463 [1,0,0,0,0,0|3,0,0]=4 946 B11R1.266 CCc1cccc(S(=O)[O-])c1 Amb24410659 [1,0,0,0,0,0|2,0,1]=4 947 B11R1.266 CCc1cccc([C@@H](C)O)c1 Amb32876479 [1,0,0,0,0,0|2,0,1]=4 948 B11R1.266 CCc1cccc([C@H](C)O)c1 Amb32876471 [1,0,0,0,0,0|2,0,1]=4 949 B11R1.266 CCc1cccc([N+](=O)[O-])c1 Amb16233214 [1,0,0,0,0,0|2,0,1]=4 950 B11R1.266 CCc1ccnc(C(=O)Cl)c1 Amb27212794 [1,0,0,0,0,0|3,0,0]=4 951 B11R1.266 CCc1ccnc(C(=O)O)c1 Amb17614160 [1,0,0,0,0,0|2,0,0]=3 952 B11R1.266 CCc1ccnc(C(=O)O)c1 Amb8009565 [1,0,0,0,0,0|2,0,0]=3 953 B11R1.266 CCc1ccnc(C(C)=O)c1 Amb27955005 [1,0,0,0,0,0|3,0,0]=4 954 B11R1.266 CCc1ccnc(C(N)=O)c1 Amb28397906 [1,0,0,0,0,0|3,0,0]=4 955 B11R1.266 CCc1cncc(C(=O)O)c1 Amb33544097 [1,0,0,0,0,0|2,0,0]=3 956 B11R1.266 CCc1nccc(C(=O)O)n1 Amb18964009 [1,0,0,0,0,0|3,0,0]=4 957 B11R1.266 CNc1cc(C(=O)O)ccn1 Amb13949124 [1,0,0,0,0,0|2,0,0]=3 958 B11R1.266 CNc1cc(C(=O)O)ccn1 Amb33533113 [1,0,0,0,0,0|2,0,0]=3 959 B11R1.266 CNc1cc(C(=O)O)ncn1 Amb18065388 [1,0,0,0,0,0|3,0,0]=4 960 B11R1.266 CNc1cccc(B(O)O)c1 Amb26849120 [1,0,0,0,0,0|2,0,1]=4 961 B11R1.266 CNc1cccc(C(=O)O)c1 Amb17306309 [1,0,0,0,0,0|1,0,0]=2 962 B11R1.266 CNc1cccc(C(=O)O)c1 Amb22899076 [1,0,0,0,0,0|1,0,0]=2 963 B11R1.266 CNc1cccc(C(=O)O)n1 Amb18959747 [1,0,0,0,0,0|2,0,0]=3 964 B11R1.266 CNc1cccc(C(C)=O)c1 Amb17306672 [1,0,0,0,0,0|2,0,0]=3 965 B11R1.266 CNc1cccc(C(C)O)c1 Amb27823357 [1,0,0,0,0,0|2,0,1]=4 966 B11R1.266 CNc1cccc(C(N)=S)c1 Amb28382255 [1,0,0,0,0,0|2,1,0]=4 967 B11R1.266 CNc1cccc([N+](=O)[O-])c1 Amb9321198 [1,0,0,0,0,0|2,0,1]=4 968 B11R1.266 CNc1ccnc(C(=O)O)c1 Amb3319005 [1,0,0,0,0,0|2,0,0]=3 969 B11R1.266 CNc1ccnc(C(N)=O)c1 Amb9378642 [1,0,0,0,0,0|3,0,0]=4 970 B11R1.266 CNc1cncc(C(=O)O)c1 Amb3319002 [1,0,0,0,0,0|2,0,0]=3 971 B11R1.266 CNc1cncc(C(=O)O)n1 Amb2610824 [1,0,0,0,0,0|3,0,0]=4 972 B11R1.266 CNc1nccc(C(=O)O)n1 Amb24099648 [1,0,0,0,0,0|3,0,0]=4 973 B11R1.266 COc1cc(B(O)O)ccn1 Amb22886944 [1,0,0,0,0,0|2,0,1]=4 974 B11R1.266 COc1cc(B(O)O)ccn1 Amb8396837 [1,0,0,0,0,0|2,0,1]=4 975 B11R1.266 COc1cc(C(=N)N)ccn1 Amb6260705 [1,0,0,0,0,0|3,0,0]=4 976 B11R1.266 COc1cc(C(=O)Cl)ccn1 Amb24378926 [1,0,0,0,0,0|2,0,0]=3 977 B11R1.266 COc1cc(C(=O)O)ccn1 Amb1102567 [1,0,0,0,0,0|1,0,0]=2 978 B11R1.266 COc1cc(C(=O)O)cnn1 Amb23401892 [1,0,0,0,0,0|2,0,0]=3 979 B11R1.266 COc1cc(C(=O)O)ncn1 Amb33542851 [1,0,0,0,0,0|2,0,0]=3 980 B11R1.266 COc1cc(C(=O)[O-])ccn1 Amb33512968 [1,0,0,0,0,0|1,0,1]=3 981 B11R1.266 COc1cc(C(C)=O)ccn1 Amb22494173 [1,0,0,0,0,0|2,0,0]=3 982 B11R1.266 COc1cc(C(N)=O)ccn1 Amb2726062 [1,0,0,0,0,0|2,0,0]=3 983 B11R1.266 COc1cc(C(N)=S)ccn1 Amb2372599 [1,0,0,0,0,0|2,1,0]=4 984 B11R1.266 COc1cc(S(=O)O)ccn1 Amb32992442 [1,0,0,0,0,0|2,0,0]=3 985 B11R1.266 COc1cc(S(=O)[O-])ccn1 Amb32992522 [1,0,0,0,0,0|2,0,1]=4 986 B11R1.266 COc1cc([C@@H](C)O)ccn1 Amb32953821 [1,0,0,0,0,0|2,0,1]=4 987 B11R1.266 COc1cc([C@H](C)O)ccn1 Amb33474147 [1,0,0,0,0,0|2,0,1]=4 988 B11R1.266 COc1cccc(B(O)O)c1 Amb2383495 [1,0,0,0,0,0|1,0,1]=3 989 B11R1.266 COc1cccc(B(O)O)n1 Amb10597528 [1,0,0,0,0,0|2,0,1]=4 990 B11R1.266 COc1cccc(C(=N)N)c1 Amb2696292 [1,0,0,0,0,0|2,0,0]=3 991 B11R1.266 COc1cccc(C(=N)N)c1 Amb33551414 [1,0,0,0,0,0|2,0,0]=3 992 B11R1.266 COc1cccc(C(=N)N)n1 Amb22235905 [1,0,0,0,0,0|3,0,0]=4 993 B11R1.266 COc1cccc(C(=N)N)n1 Amb27952075 [1,0,0,0,0,0|3,0,0]=4 994 B11R1.266 COc1cccc(C(=O)Cl)c1 Amb2689093 [1,0,0,0,0,0|1,0,0]=2 995 B11R1.266 COc1cccc(C(=O)F)c1 Amb26980375 [1,0,0,0,0,0|1,0,0]=2 996 B11R1.266 COc1cccc(C(=O)O)c1 Amb1227738 [1,0,0,0,0,0|0,0,0]=1 997 B11R1.266 COc1cccc(C(=O)O)n1 Amb6565076 [1,0,0,0,0,0|1,0,0]=2 998 B11R1.266 COc1cccc(C(Br)Br)c1 Amb27823520 [1,0,0,0,0,0|2,0,1]=4 999 B11R1.266 COc1cccc(C(C)=O)c1 Amb2689085 [1,0,0,0,0,0|1,0,0]=2 1000 B11R1.266 COc1cccc(C(C)=O)n1 Amb10601920 [1,0,0,0,0,0|2,0,0]=3 1001 B11R1.266 COc1cccc(C(C)Br)c1 Amb8835387 [1,0,0,0,0,0|2,0,1]=4 1002 B11R1.266 COc1cccc(C(C)C)c1 Amb24105022 [1,0,0,0,0,0|2,0,1]=4 1003 B11R1.266 COc1cccc(C(C)Cl)c1 Amb7766799 [1,0,0,0,0,0|2,0,1]=4 1004 B11R1.266 COc1cccc(C(C)N)c1 Amb17935767 [1,0,0,0,0,0|2,0,1]=4 1005 B11R1.266 COc1cccc(C(C)N)c1 Amb9703882 [1,0,0,0,0,0|2,0,1]=4 1006 B11R1.266 COc1cccc(C(C)O)c1 Amb9703330 [1,0,0,0,0,0|1,0,1]=3 1007 B11R1.266 COc1cccc(C(C)O)n1 Amb25063594 [1,0,0,0,0,0|2,0,1]=4 1008 B11R1.266 COc1cccc(C(C)S)c1 Amb9208020 [1,0,0,0,0,0|1,1,1]=4 1009 B11R1.266 COc1cccc(C(F)F)c1 Amb23412232 [1,0,0,0,0,0|2,0,1]=4 1010 B11R1.266 COc1cccc(C(N)=O)c1 Amb3886598 [1,0,0,0,0,0|1,0,0]=2 1011 B11R1.266 COc1cccc(C(N)=O)n1 Amb6565090 [1,0,0,0,0,0|2,0,0]=3 1012 B11R1.266 COc1cccc(C(N)=S)c1 Amb1209474 [1,0,0,0,0,0|1,1,0]=3 1013 B11R1.266 COc1cccc(C(N)=S)n1 Amb25874468 [1,0,0,0,0,0|2,1,0]=4 1014 B11R1.266 COc1cccc(N(=O)=O)c1 Amb20621755 [1,0,0,0,0,0|1,0,1]=3 1015 B11R1.266 COc1cccc(N(C)C)c1 Amb2782333 [1,0,0,0,0,0|3,0,0]=4 1016 B11R1.266 COc1cccc(N(C)N)c1 Amb17232109 [1,0,0,0,0,0|3,0,0]=4 1017 B11R1.266 COc1cccc(S(=O)O)c1 Amb18862872 [1,0,0,0,0,0|1,0,0]=2 1018 B11R1.266 COc1cccc(S(=O)O)n1 Amb26497831 [1,0,0,0,0,0|2,0,0]=3 1019 B11R1.266 COc1cccc(S(=O)[O-])c1 Amb19944451 [1,0,0,0,0,0|1,0,1]=3 1020 B11R1.266 COc1cccc(S(=O)[O-])n1 Amb32992551 [1,0,0,0,0,0|2,0,1]=4 1021 B11R1.266 COc1cccc(S(C)=O)c1 Amb19892063 [1,0,0,0,0,0|2,0,0]=3 1022 B11R1.266 COc1cccc([C@@H](C)N)c1 Amb3941455 [1,0,0,0,0,0|2,0,1]=4 1023 B11R1.266 COc1cccc([C@@H](C)O)c1 Amb6893490 [1,0,0,0,0,0|1,0,1]=3 1024 B11R1.266 COc1cccc([C@@H](C)O)n1 Amb33202189 [1,0,0,0,0,0|2,0,1]=4 1025 B11R1.266 COc1cccc([C@H](C)N)c1 Amb22406370 [1,0,0,0,0,0|2,0,1]=4 1026 B11R1.266 COc1cccc([C@H](C)N)c1 Amb3939829 [1,0,0,0,0,0|2,0,1]=4 1027 B11R1.266 COc1cccc([C@H](C)O)c1 Amb6893491 [1,0,0,0,0,0|1,0,1]=3 1028 B11R1.266 COc1cccc([C@H](C)O)n1 Amb33202155 [1,0,0,0,0,0|2,0,1]=4 1029 B11R1.266 COc1ccnc(C(=N)N)c1 Amb18177177 [1,0,0,0,0,0|3,0,0]=4 1030 B11R1.266 COc1ccnc(C(=N)N)c1 Amb22235903 [1,0,0,0,0,0|3,0,0]=4 1031 B11R1.266 COc1ccnc(C(=O)Cl)c1 Amb26480031 [1,0,0,0,0,0|2,0,0]=3 1032 B11R1.266 COc1ccnc(C(=O)O)c1 Amb2795315 [1,0,0,0,0,0|1,0,0]=2 1033 B11R1.266 COc1ccnc(C(=O)O)c1 Amb6565045 [1,0,0,0,0,0|1,0,0]=2 1034 B11R1.266 COc1ccnc(C(=O)[O-])c1 Amb33512966 [1,0,0,0,0,0|1,0,1]=3 1035 B11R1.266 COc1ccnc(C(C)=O)c1 Amb17621642 [1,0,0,0,0,0|2,0,0]=3 1036 B11R1.266 COc1ccnc(C(C)=O)n1 Amb26961358 [1,0,0,0,0,0|3,0,0]=4 1037 B11R1.266 COc1ccnc(C(C)O)c1 Amb27602354 [1,0,0,0,0,0|2,0,1]=4 1038 B11R1.266 COc1ccnc(C(N)=O)c1 Amb5492739 [1,0,0,0,0,0|2,0,0]=3 1039 B11R1.266 COc1ccnc(C(N)=O)n1 Amb24551258 [1,0,0,0,0,0|3,0,0]=4 1040 B11R1.266 COc1ccnc(C(N)=S)c1 Amb18177875 [1,0,0,0,0,0|2,1,0]=4 1041 B11R1.266 COc1ccnc(S(=O)O)c1 Amb33747284 [1,0,0,0,0,0|2,0,0]=3 1042 B11R1.266 COc1ccnc(S(=O)O)n1 Amb32992445 [1,0,0,0,0,0|3,0,0]=4 1043 B11R1.266 COc1ccnc(S(=O)[O-])c1 Amb33621264 [1,0,0,0,0,0|2,0,1]=4 1044 B11R1.266 COc1ccnc([C@@H](C)O)c1 Amb33319053 [1,0,0,0,0,0|2,0,1]=4 1045 B11R1.266 COc1ccnc([C@H](C)O)c1 Amb33319052 [1,0,0,0,0,0|2,0,1]=4 1046 B11R1.266 COc1ccnc([N+](=O)[O-])c1 Amb20247847 [1,0,0,0,0,0|2,0,1]=4 1047 B11R1.266 COc1cncc(B(O)O)c1 Amb10069929 [1,0,0,0,0,0|2,0,1]=4 1048 B11R1.266 COc1cncc(C(=N)N)c1 Amb27823095 [1,0,0,0,0,0|3,0,0]=4 1049 B11R1.266 COc1cncc(C(=O)Cl)n1 Amb26345127 [1,0,0,0,0,0|3,0,0]=4 1050 B11R1.266 COc1cncc(C(=O)O)c1 Amb2795316 [1,0,0,0,0,0|1,0,0]=2 1051 B11R1.266 COc1cncc(C(=O)O)n1 Amb8009484 [1,0,0,0,0,0|2,0,0]=3 1052 B11R1.266 COc1cncc(C(C)=O)c1 Amb33735055 [1,0,0,0,0,0|2,0,0]=3 1053 B11R1.266 COc1cncc(C(C)=O)c1 Amb8426292 [1,0,0,0,0,0|2,0,0]=3 1054 B11R1.266 COc1cncc(C(C)O)c1 Amb27591600 [1,0,0,0,0,0|2,0,1]=4 1055 B11R1.266 COc1cncc(C(N)=O)n1 Amb27404505 [1,0,0,0,0,0|3,0,0]=4 1056 B11R1.266 COc1cncc(C(N)=S)c1 Amb25760189 [1,0,0,0,0,0|2,1,0]=4 1057 B11R1.266 COc1cncc(S(=O)[O-])c1 Amb32755029 [1,0,0,0,0,0|2,0,1]=4 1058 B11R1.266 COc1cncc([C@@H](C)O)c1 Amb32874153 [1,0,0,0,0,0|2,0,1]=4 1059 B11R1.266 COc1cncc([C@H](C)O)c1 Amb32874359 [1,0,0,0,0,0|2,0,1]=4 1060 B11R1.266 COc1cnnc(C(=O)O)c1 Amb27622845 [1,0,0,0,0,0|2,0,0]=3 1061 B11R1.266 COc1nccc(C(=O)O)n1 Amb18125652 [1,0,0,0,0,0|2,0,0]=3 1062 B11R1.266 COc1nccc(C(C)=O)n1 Amb22498197 [1,0,0,0,0,0|3,0,0]=4 1063 B11R1.266 CSc1cc(C(=O)O)ccn1 Amb10610037 [1,0,0,0,0,0|1,1,0]=3 1064 B11R1.266 CSc1cc(C(=O)O)cnn1 Amb27620134 [1,0,0,0,0,0|2,1,0]=4 1065 B11R1.266 CSc1cc(C(C)=O)ccn1 Amb28201251 [1,0,0,0,0,0|2,1,0]=4 1066 B11R1.266 CSc1cccc(B(O)O)c1 Amb2456035 [1,0,0,0,0,0|1,1,1]=4 1067 B11R1.266 CSc1cccc(C(=N)N)c1 Amb26873940 [1,0,0,0,0,0|2,1,0]=4 1068 B11R1.266 CSc1cccc(C(=O)O)c1 Amb8387513 [1,0,0,0,0,0|0,1,0]=2 1069 B11R1.266 CSc1cccc(C(=O)O)n1 Amb18284988 [1,0,0,0,0,0|1,1,0]=3 1070 B11R1.266 CSc1cccc(C(C)=O)c1 Amb25228464 [1,0,0,0,0,0|1,1,0]=3 1071 B11R1.266 CSc1cccc(C(C)=O)n1 Amb23590739 [1,0,0,0,0,0|2,1,0]=4 1072 B11R1.266 CSc1cccc(C(C)O)c1 Amb24615637 [1,0,0,0,0,0|1,1,1]=4 1073 B11R1.266 CSc1cccc(C(N)=O)c1 Amb24415513 [1,0,0,0,0,0|1,1,0]=3 1074 B11R1.266 CSc1cccc(C(N)=S)c1 Amb33148749 [1,0,0,0,0,0|1,2,0]=4 1075 B11R1.266 CSc1cccc(N(=O)=O)c1 Amb20621881 [1,0,0,0,0,0|1,1,1]=4 1076 B11R1.266 CSc1cccc(S(=O)[O-])c1 Amb32755011 [1,0,0,0,0,0|1,1,1]=4 1077 B11R1.266 CSc1cccc([C@@H](C)O)c1 Amb33143794 [1,0,0,0,0,0|1,1,1]=4 1078 B11R1.266 CSc1cccc([C@H](C)O)c1 Amb24407454 [1,0,0,0,0,0|1,1,1]=4 1079 B11R1.266 CSc1ccnc(C(=O)O)c1 Amb18281638 [1,0,0,0,0,0|1,1,0]=3 1080 B11R1.266 CSc1ccnc(C(=O)O)n1 Amb26501726 [1,0,0,0,0,0|2,1,0]=4 1081 B11R1.266 CSc1ccnc(C(C)=O)c1 Amb25976176 [1,0,0,0,0,0|2,1,0]=4 1082 B11R1.266 CSc1ccnc(C(N)=O)c1 Amb28365668 [1,0,0,0,0,0|2,1,0]=4 1083 B11R1.266 CSc1cncc(C(=O)O)c1 Amb2795671 [1,0,0,0,0,0|1,1,0]=3 1084 B11R1.266 CSc1cncc(C(=O)O)n1 Amb25107712 [1,0,0,0,0,0|2,1,0]=4 1085 B11R1.266 CSc1nccc(C(=O)O)n1 Amb8630074 [1,0,0,0,0,0|2,1,0]=4 1086 B11R1.266 N#Cc1cc(C(=O)O)ccn1 Amb8386265 [1,0,0,0,0,0|3,0,0]=4 1087 B11R1.266 N#Cc1cccc(C(=O)Cl)c1 Amb3939161 [1,0,0,0,0,0|3,0,0]=4 1088 B11R1.266 N#Cc1cccc(C(=O)F)c1 Amb25923078 [1,0,0,0,0,0|3,0,0]=4 1089 B11R1.266 N#Cc1cccc(C(=O)O)c1 Amb1208364 [1,0,0,0,0,0|2,0,0]=3 1090 B11R1.266 N#Cc1cccc(C(=O)O)n1 Amb16192027 [1,0,0,0,0,0|3,0,0]=4 1091 B11R1.266 N#Cc1cccc(C(N)=O)c1 Amb6276180 [1,0,0,0,0,0|3,0,0]=4 1092 B11R1.266 N#Cc1ccnc(C(=O)O)c1 Amb6384306 [1,0,0,0,0,0|3,0,0]=4 1093 B11R1.266 N#Cc1cncc(C(=O)O)c1 Amb8386273 [1,0,0,0,0,0|3,0,0]=4 1094 B11R1.266 NC(=O)c1cccc(C=O)c1 Amb19514706 [1,0,0,0,0,0|3,0,0]=4 1095 B11R1.266 NC(=O)c1cccc(CBr)c1 Amb21857552 [1,0,0,0,0,0|3,0,0]=4 1096 B11R1.266 NC(=O)c1cccc(CCl)c1 Amb2609964 [1,0,0,0,0,0|3,0,0]=4 1097 B11R1.266 NC(=O)c1cccc(CO)c1 Amb9421378 [1,0,0,0,0,0|3,0,0]=4 1098 B11R1.266 NC(=O)c1cccc(CS)c1 Amb32788427 [1,0,0,0,0,0|3,0,0]=4 1099 B11R1.266 NCc1cc(C(=O)O)ccn1 Amb18201422 [1,0,0,0,0,0|3,0,0]=4 1100 B11R1.266 NCc1cc(C(=O)O)ccn1 Amb22035332 [1,0,0,0,0,0|3,0,0]=4 1101 B11R1.266 NCc1cc(C(=O)O)ccn1 Amb31147375 [1,0,0,0,0,0|3,0,0]=4 1102 B11R1.266 NCc1cccc(C(=O)O)c1 Amb535343 [1,0,0,0,0,0|2,0,0]=3 1103 B11R1.266 NCc1cccc(C(=O)O)c1 Amb8630062 [1,0,0,0,0,0|2,0,0]=3 1104 B11R1.266 NCc1cccc(C(=O)O)n1 Amb16231963 [1,0,0,0,0,0|3,0,0]=4 1105 B11R1.266 NCc1cccc(C(=O)O)n1 Amb22727985 [1,0,0,0,0,0|3,0,0]=4 1106 B11R1.266 NCc1cccc(C(N)=O)c1 Amb10601529 [1,0,0,0,0,0|3,0,0]=4 1107 B11R1.266 NCc1cccc(C(N)=O)c1 Amb1114445 [1,0,0,0,0,0|3,0,0]=4 1108 B11R1.266 NCc1ccnc(C(=O)O)c1 Amb25870440 [1,0,0,0,0,0|3,0,0]=4 1109 B11R1.266 NCc1ccnc(C(=O)O)c1 Amb32721634 [1,0,0,0,0,0|3,0,0]=4 1110 B11R1.266 NCc1cncc(C(=O)O)c1 Amb26037233 [1,0,0,0,0,0|3,0,0]=4 1111 B11R1.266 NNc1cc(C(=O)O)ccn1 Amb10071583 [1,0,0,0,0,0|3,0,0]=4 1112 B11R1.266 NNc1cccc(C(=O)O)c1 Amb10664885 [1,0,0,0,0,0|2,0,0]=3 1113 B11R1.266 NNc1cccc(C(=O)O)c1 Amb2234498 [1,0,0,0,0,0|2,0,0]=3 1114 B11R1.266 NNc1cccc(C(=O)O)n1 Amb16230599 [1,0,0,0,0,0|3,0,0]=4 1115 B11R1.266 NNc1cccc(C(N)=O)c1 Amb24102219 [1,0,0,0,0,0|3,0,0]=4 1116 B11R1.266 NNc1cccc(C(N)=O)c1 Amb33457238 [1,0,0,0,0,0|3,0,0]=4 1117 B11R1.266 NNc1ccnc(C(=O)O)c1 Amb23592137 [1,0,0,0,0,0|3,0,0]=4 1118 B11R1.266 NOc1cccc(C(=O)O)c1 Amb8388259 [1,0,0,0,0,0|1,0,0]=2 1119 B11R1.266 NOc1cccc([N+](=O)[O-])c1 Amb26866234 [1,0,0,0,0,0|2,0,1]=4 1120 B11R1.266 O=Bc1cccc(C(=O)Cl)c1 Amb17938054 [1,0,0,0,0,0|3,0,0]=4 1121 B11R1.266 O=C(Cl)c1cccc(CBr)c1 Amb24113090 [1,0,0,0,0,0|3,0,0]=4 1122 B11R1.266 O=C(Cl)c1cccc(CCl)c1 Amb8396075 [1,0,0,0,0,0|3,0,0]=4 1123 B11R1.266 O=C(O)c1cc(CO)ccn1 Amb3319274 [1,0,0,0,0,0|3,0,0]=4 1124 B11R1.266 O=C(O)c1cccc(CBr)c1 Amb1213401 [1,0,0,0,0,0|2,0,0]=3 1125 B11R1.266 O=C(O)c1cccc(CBr)n1 Amb2694907 [1,0,0,0,0,0|3,0,0]=4 1126 B11R1.266 O=C(O)c1cccc(CCl)c1 Amb2609963 [1,0,0,0,0,0|2,0,0]=3 1127 B11R1.266 O=C(O)c1cccc(CCl)n1 Amb27617286 [1,0,0,0,0,0|3,0,0]=4 1128 B11R1.266 O=C(O)c1cccc(CF)c1 Amb27791782 [1,0,0,0,0,0|2,0,0]=3 1129 B11R1.266 O=C(O)c1cccc(CF)n1 Amb27210941 [1,0,0,0,0,0|3,0,0]=4 1130 B11R1.266 O=C(O)c1cccc(CO)c1 Amb6296522 [1,0,0,0,0,0|2,0,0]=3 1131 B11R1.266 O=C(O)c1cccc(CO)n1 Amb32409793 [1,0,0,0,0,0|3,0,0]=4 1132 B11R1.266 O=C(O)c1cccc(CO)n1 Amb8010246 [1,0,0,0,0,0|3,0,0]=4 1133 B11R1.266 O=C(O)c1cccc(CS)c1 Amb6892057 [1,0,0,0,0,0|2,0,0]=3 1134 B11R1.266 O=C(O)c1ccnc(CBr)c1 Amb22011863 [1,0,0,0,0,0|3,0,0]=4 1135 B11R1.266 O=C(O)c1ccnc(CCl)c1 Amb26952189 [1,0,0,0,0,0|3,0,0]=4 1136 B11R1.266 O=C(O)c1ccnc(CF)c1 Amb27428939 [1,0,0,0,0,0|3,0,0]=4 1137 B11R1.266 O=C(O)c1ccnc(CO)c1 Amb21857371 [1,0,0,0,0,0|3,0,0]=4 1138 B11R1.266 O=C(O)c1ccnc(CO)c1 Amb30584723 [1,0,0,0,0,0|3,0,0]=4 1139 B11R1.266 O=C(O)c1ccnc(NO)c1 Amb28042628 [1,0,0,0,0,0|3,0,0]=4 1140 B11R1.266 O=C(O)c1cncc(CO)c1 Amb28291288 [1,0,0,0,0,0|3,0,0]=4 1141 B11R1.266 O=Cc1cc(C(=O)O)ccn1 Amb21857065 [1,0,0,0,0,0|3,0,0]=4 1142 B11R1.266 O=Cc1cccc(C(=O)Cl)c1 Amb22893506 [1,0,0,0,0,0|3,0,0]=4 1143 B11R1.266 O=Cc1cccc(C(=O)O)c1 Amb2721214 [1,0,0,0,0,0|2,0,0]=3 1144 B11R1.266 O=Cc1cccc(C(=O)O)n1 Amb18201819 [1,0,0,0,0,0|3,0,0]=4 1145 B11R1.266 O=Cc1cccc(C(=O)O)n1 Amb32655951 [1,0,0,0,0,0|3,0,0]=4 1146 B11R1.266 O=Cc1ccnc(C(=O)O)c1 Amb22500483 [1,0,0,0,0,0|3,0,0]=4 1147 B11R1.266 O=Cc1cncc(C(=O)O)c1 Amb2795633 [1,0,0,0,0,0|3,0,0]=4 1148 B11R1.266 O=Cc1cncc(C(=O)O)c1 Amb32753667 [1,0,0,0,0,0|3,0,0]=4 1149 B11R1.266 [C-]#[N+]c1cccc(C(C)=O)c1 Amb1981041 [1,0,0,0,0,0|2,0,1]=4 1150 B11R1.280 C#Cc1ccc(Br)c(OC)c1 Amb33331478 [1,0,0,0,0,0|2,0,1]=4 1151 B11R1.280 C#Cc1ccc(C)c(OC)c1 Amb30015948 [1,0,0,0,0,0|2,0,1]=4 1152 B11R1.280 C#Cc1ccc(Cl)c(OC)c1 Amb26371137 [1,0,0,0,0,0|2,0,1]=4 1153 B11R1.280 C#Cc1ccc(F)c(OC)c1 Amb26430203 [1,0,0,0,0,0|2,0,1]=4 1154 B11R1.280 C#Cc1ccc(N)c(OC)c1 Amb25836406 [1,0,0,0,0,0|2,0,1]=4 1155 B11R1.280 C#Cc1ccc(O)c(OC)c1 Amb27167659 [1,0,0,0,0,0|1,0,1]=3 1156 B11R1.280 C=Cc1cc(C=O)ccc1F Amb28073772 [1,0,0,0,0,0|2,0,1]=4 1157 B11R1.280 C=Cc1cc(OC)c(F)cn1 Amb24487045 [1,0,0,0,0,0|3,0,0]=4 1158 B11R1.280 C=Cc1ccc(Br)c(OC)c1 Amb33331784 [1,0,0,0,0,0|2,0,0]=3 1159 B11R1.280 C=Cc1ccc(C)c(OC)c1 Amb33420865 [1,0,0,0,0,0|2,0,0]=3 1160 B11R1.280 C=Cc1ccc(C)c(OC)n1 Amb24487091 [1,0,0,0,0,0|3,0,0]=4 1161 B11R1.280 C=Cc1ccc(Cl)c(OC)c1 Amb33390305 [1,0,0,0,0,0|2,0,0]=3 1162 B11R1.280 C=Cc1ccc(F)c(OC)c1 Amb22749045 [1,0,0,0,0,0|2,0,0]=3 1163 B11R1.280 C=Cc1ccc(F)c(OC)n1 Amb27776476 [1,0,0,0,0,0|3,0,0]=4 1164 B11R1.280 C=Cc1ccc(N)c(CC)c1 Amb27596764 [1,0,0,0,0,0|3,0,0]=4 1165 B11R1.280 C=Cc1ccc(N)c(OC)n1 Amb26978668 [1,0,0,0,0,0|3,0,0]=4 1166 B11R1.280 C=Cc1ccc(O)c(C=C)c1 Amb28287065 [1,0,0,0,0,0|2,0,1]=4 1167 B11R1.280 C=Cc1ccc(O)c(OC)c1 Amb6296659 [1,0,0,0,0,0|1,0,0]=2 1168 B11R1.280 C=Cc1cnc(Cl)c(OC)c1 Amb25922890 [1,0,0,0,0,0|3,0,0]=4 1169 B11R1.280 C=Cc1cnc(N)c(OC)c1 Amb25849926 [1,0,0,0,0,0|3,0,0]=4 1170 B11R1.280 CCC1=C\C(=N\O)C=CC1=O Amb28130608 [1,0,0,0,0,0|2,0,1]=4 1171 B11R1.280 CCN1C=C(C=O)C=CC1=O Amb27965000 [1,0,0,0,0,0|2,0,1]=4 1172 B11R1.280 CCc1cc(C#N)ccc1O Amb27834281 [1,0,0,0,0,0|2,0,1]=4 1173 B11R1.280 CCc1cc(C=O)ccc1Br Amb33744343 [1,0,0,0,0,0|2,0,0]=3 1174 B11R1.280 CCc1cc(C=O)ccc1Cl Amb19892755 [1,0,0,0,0,0|2,0,0]=3 1175 B11R1.280 CCc1cc(C=O)ccc1O Amb25891446 [1,0,0,0,0,0|1,0,0]=2 1176 B11R1.280 CCc1cc(C=O)cnc1Cl Amb27861431 [1,0,0,0,0,0|3,0,0]=4 1177 B11R1.280 CCc1cc(CO)ccc1C Amb27169239 [1,0,0,0,0,0|2,0,1]=4 1178 B11R1.280 CCc1cc(CO)ccc1Cl Amb26959420 [1,0,0,0,0,0|2,0,1]=4 1179 B11R1.280 CCc1cc(N=O)ccc1O Amb27227025 [1,0,0,0,0,0|2,0,0]=3 1180 B11R1.280 CCc1cc(NN)ccc1O Amb25223493 [1,0,0,0,0,0|3,0,0]=4 1181 B11R1.280 CCc1cc(OC)ccc1O Amb18057238 [1,0,0,0,0,0|3,0,0]=4 1182 B11R1.280 CCc1ccc(Br)c(OC)c1 Amb22752637 [1,0,0,0,0,0|2,0,1]=4 1183 B11R1.280 CCc1ccc(N)c(OC)c1 Amb4303790 [1,0,0,0,0,0|2,0,1]=4 1184 B11R1.280 CCc1ccc(O)c(OC)c1 Amb2720982 [1,0,0,0,0,0|1,0,1]=3 1185 B11R1.280 CCc1ccc(O)c(SC)c1 Amb27453450 [1,0,0,0,0,0|1,1,1]=4 1186 B11R1.280 CCc1ccc(S)c(OC)c1 Amb26475481 [1,0,0,0,0,0|1,1,1]=4 1187 B11R1.280 CNc1cc(C#N)ccc1O Amb27860165 [1,0,0,0,0,0|2,0,1]=4 1188 B11R1.280 CNc1cc(C=O)ccc1O Amb27464014 [1,0,0,0,0,0|1,0,0]=2 1189 B11R1.280 CNc1cc(CN)ccc1O Amb28200193 [1,0,0,0,0,0|2,0,1]=4 1190 B11R1.280 CNc1cc(OC)ccc1O Amb18553545 [1,0,0,0,0,0|3,0,0]=4 1191 B11R1.280 CNc1cc(SC)ccc1O Amb27244760 [1,0,0,0,0,0|3,0,0]=4 1192 B11R1.280 CNc1ccc(Br)c(OC)c1 Amb26622174 [1,0,0,0,0,0|3,0,0]=4 1193 B11R1.280 CNc1ccc(C)c(OC)c1 Amb25942974 [1,0,0,0,0,0|3,0,0]=4 1194 B11R1.280 CNc1ccc(Cl)c(OC)c1 Amb28069919 [1,0,0,0,0,0|3,0,0]=4 1195 B11R1.280 CNc1ccc(F)c(OC)c1 Amb25718501 [1,0,0,0,0,0|3,0,0]=4 1196 B11R1.280 CNc1ccc(N)c(OC)c1 Amb26888208 [1,0,0,0,0,0|3,0,0]=4 1197 B11R1.280 COC1=C\C(=N\O)C=CC1=O Amb28140640 [1,0,0,0,0,0|1,0,1]=3 1198 B11R1.280 COc1cc(C#N)ccc1Br Amb17772373 [1,0,0,0,0,0|2,0,1]=4 1199 B11R1.280 COc1cc(C#N)ccc1C Amb10068739 [1,0,0,0,0,0|2,0,1]=4 1200 B11R1.280 COc1cc(C#N)ccc1Cl Amb17912110 [1,0,0,0,0,0|2,0,1]=4 1201 B11R1.280 COc1cc(C#N)ccc1F Amb6296365 [1,0,0,0,0,0|2,0,1]=4 1202 B11R1.280 COc1cc(C#N)ccc1I Amb23437516 [1,0,0,0,0,0|2,0,1]=4 1203 B11R1.280 COc1cc(C#N)ccc1N Amb13882837 [1,0,0,0,0,0|2,0,1]=4 1204 B11R1.280 COc1cc(C#N)ccc1O Amb1209844 [1,0,0,0,0,0|1,0,1]=3 1205 B11R1.280 COc1cc(C#N)ccc1S Amb25204900 [1,0,0,0,0,0|1,1,1]=4 1206 B11R1.280 COc1cc(C#N)ncc1O Amb25074057 [1,0,0,0,0,0|2,0,1]=4 1207 B11R1.280 COc1cc(C=O)ccc1Br Amb18771155 [1,0,0,0,0,0|1,0,0]=2 1208 B11R1.280 COc1cc(C=O)ccc1C Amb2592690 [1,0,0,0,0,0|1,0,0]=2 1209 B11R1.280 COc1cc(C=O)ccc1Cl Amb9871394 [1,0,0,0,0,0|1,0,0]=2 1210 B11R1.280 COc1cc(C=O)ccc1F Amb2688144 [1,0,0,0,0,0|1,0,0]=2 1211 B11R1.280 COc1cc(C=O)ccc1I Amb22500722 [1,0,0,0,0,0|1,0,0]=2 1212 B11R1.280 COc1cc(C=O)ccc1N Amb10603960 [1,0,0,0,0,0|1,0,0]=2 1213 B11R1.280 COc1cc(C=O)ccc1O Amb1880873 [1,0,0,0,0,0|0,0,0]=1 1214 B11R1.280 COc1cc(C=O)ccc1S Amb10610424 [1,0,0,0,0,0|0,1,0]=2 1215 B11R1.280 COc1cc(C=O)cnc1Br Amb27866439 [1,0,0,0,0,0|2,0,0]=3 1216 B11R1.280 COc1cc(C=O)cnc1Cl Amb26870411 [1,0,0,0,0,0|2,0,0]=3 1217 B11R1.280 COc1cc(C=O)cnc1F Amb25892515 [1,0,0,0,0,0|2,0,0]=3 1218 B11R1.280 COc1cc(C=O)cnc1I Amb27823469 [1,0,0,0,0,0|2,0,0]=3 1219 B11R1.280 COc1cc(C=O)cnc1N Amb25825796 [1,0,0,0,0,0|2,0,0]=3 1220 B11R1.280 COc1cc(C=O)ncc1Br Amb27667572 [1,0,0,0,0,0|2,0,0]=3 1221 B11R1.280 COc1cc(C=O)ncc1Cl Amb26490625 [1,0,0,0,0,0|2,0,0]=3 1222 B11R1.280 COc1cc(C=O)ncc1F Amb25982677 [1,0,0,0,0,0|2,0,0]=3 1223 B11R1.280 COc1cc(C=O)ncc1I Amb27666443 [1,0,0,0,0,0|2,0,0]=3 1224 B11R1.280 COc1cc(CBr)ccc1Br Amb22501129 [1,0,0,0,0,0|2,0,1]=4 1225 B11R1.280 COc1cc(CBr)ccc1C Amb25075362 [1,0,0,0,0,0|2,0,1]=4 1226 B11R1.280 COc1cc(CBr)ccc1Cl Amb22002709 [1,0,0,0,0,0|2,0,1]=4 1227 B11R1.280 COc1cc(CBr)ccc1F Amb10605881 [1,0,0,0,0,0|2,0,1]=4 1228 B11R1.280 COc1cc(CBr)ccc1I Amb23437522 [1,0,0,0,0,0|2,0,1]=4 1229 B11R1.280 COc1cc(CBr)ccc1O Amb24079588 [1,0,0,0,0,0|1,0,1]=3 1230 B11R1.280 COc1cc(CCl)ccc1Br Amb22501124 [1,0,0,0,0,0|2,0,1]=4 1231 B11R1.280 COc1cc(CCl)ccc1C Amb9004321 [1,0,0,0,0,0|2,0,1]=4 1232 B11R1.280 COc1cc(CCl)ccc1Cl Amb22501136 [1,0,0,0,0,0|2,0,1]=4 1233 B11R1.280 COc1cc(CCl)ccc1F Amb19958737 [1,0,0,0,0,0|2,0,1]=4 1234 B11R1.280 COc1cc(CCl)ccc1N Amb27858233 [1,0,0,0,0,0|2,0,1]=4 1235 B11R1.280 COc1cc(CCl)ccc1O Amb17477803 [1,0,0,0,0,0|1,0,1]=3 1236 B11R1.280 COc1cc(CF)ccc1O Amb27617639 [1,0,0,0,0,0|1,0,1]=3 1237 B11R1.280 COc1cc(CN)ccc1Br Amb22500718 [1,0,0,0,0,0|2,0,1]=4 1238 B11R1.280 COc1cc(CN)ccc1C Amb10610104 [1,0,0,0,0,0|2,0,1]=4 1239 B11R1.280 COc1cc(CN)ccc1C Amb6255452 [1,0,0,0,0,0|2,0,1]=4 1240 B11R1.280 COc1cc(CN)ccc1Cl Amb18908883 [1,0,0,0,0,0|2,0,1]=4 1241 B11R1.280 COc1cc(CN)ccc1Cl Amb22501133 [1,0,0,0,0,0|2,0,1]=4 1242 B11R1.280 COc1cc(CN)ccc1F Amb19884033 [1,0,0,0,0,0|2,0,1]=4 1243 B11R1.280 COc1cc(CN)ccc1F Amb22498732 [1,0,0,0,0,0|2,0,1]=4 1244 B11R1.280 COc1cc(CN)ccc1I Amb23437523 [1,0,0,0,0,0|2,0,1]=4 1245 B11R1.280 COc1cc(CN)ccc1N Amb18201291 [1,0,0,0,0,0|2,0,1]=4 1246 B11R1.280 COc1cc(CN)ccc1N Amb33465391 [1,0,0,0,0,0|2,0,1]=4 1247 B11R1.280 COc1cc(CN)ccc1O Amb1111183 [1,0,0,0,0,0|1,0,1]=3 1248 B11R1.280 COc1cc(CN)ccc1O Amb33513228 [1,0,0,0,0,0|1,0,1]=3 1249 B11R1.280 COc1cc(CN)ccc1O Amb33531126 [1,0,0,0,0,0|1,0,1]=3 1250 B11R1.280 COc1cc(CN)ncc1O Amb28401495 [1,0,0,0,0,0|2,0,1]=4 1251 B11R1.280 COc1cc(CO)ccc1Br Amb10602018 [1,0,0,0,0,0|1,0,1]=3 1252 B11R1.280 COc1cc(CO)ccc1C Amb9004303 [1,0,0,0,0,0|1,0,1]=3 1253 B11R1.280 COc1cc(CO)ccc1Cl Amb22170282 [1,0,0,0,0,0|1,0,1]=3 1254 B11R1.280 COc1cc(CO)ccc1F Amb10605579 [1,0,0,0,0,0|1,0,1]=3 1255 B11R1.280 COc1cc(CO)ccc1I Amb23437520 [1,0,0,0,0,0|1,0,1]=3 1256 B11R1.280 COc1cc(CO)ccc1N Amb22001532 [1,0,0,0,0,0|1,0,1]=3 1257 B11R1.280 COc1cc(CO)ccc1O Amb534863 [1,0,0,0,0,0|0,0,1]=2 1258 B11R1.280 COc1cc(CO)cnc1Br Amb25951152 [1,0,0,0,0,0|2,0,1]=4 1259 B11R1.280 COc1cc(CO)cnc1C Amb24467499 [1,0,0,0,0,0|2,0,1]=4 1260 B11R1.280 COc1cc(CO)cnc1Cl Amb27827491 [1,0,0,0,0,0|2,0,1]=4 1261 B11R1.280 COc1cc(CO)cnc1F Amb27225049 [1,0,0,0,0,0|2,0,1]=4 1262 B11R1.280 COc1cc(CO)cnc1N Amb27444047 [1,0,0,0,0,0|2,0,1]=4 1263 B11R1.280 COc1cc(CO)ncc1Br Amb25714481 [1,0,0,0,0,0|2,0,1]=4 1264 B11R1.280 COc1cc(CO)ncc1Cl Amb26892881 [1,0,0,0,0,0|2,0,1]=4 1265 B11R1.280 COc1cc(CO)ncc1F Amb27221681 [1,0,0,0,0,0|2,0,1]=4 1266 B11R1.280 COc1cc(CS)ccc1Br Amb24682300 [1,0,0,0,0,0|1,1,1]=4 1267 B11R1.280 COc1cc(CS)ccc1C Amb33420864 [1,0,0,0,0,0|1,1,1]=4 1268 B11R1.280 COc1cc(CS)ccc1Cl Amb32788120 [1,0,0,0,0,0|1,1,1]=4 1269 B11R1.280 COc1cc(CS)ccc1F Amb33312429 [1,0,0,0,0,0|1,1,1]=4 1270 B11R1.280 COc1cc(CS)ccc1O Amb25803294 [1,0,0,0,0,0|0,1,1]=3 1271 B11R1.280 COc1cc(N=N)ccc1N Amb27632262 [1,0,0,0,0,0|3,0,0]=4 1272 B11R1.280 COc1cc(NN)ccc1Br Amb27482694 [1,0,0,0,0,0|3,0,0]=4 1273 B11R1.280 COc1cc(NN)ccc1C Amb22011759 [1,0,0,0,0,0|3,0,0]=4 1274 B11R1.280 COc1cc(NN)ccc1Cl Amb25339439 [1,0,0,0,0,0|3,0,0]=4 1275 B11R1.280 COc1cc(NN)ccc1Cl Amb33446991 [1,0,0,0,0,0|3,0,0]=4 1276 B11R1.280 COc1cc(NN)ccc1F Amb22831896 [1,0,0,0,0,0|3,0,0]=4 1277 B11R1.280 COc1cc(NN)ccc1F Amb27786188 [1,0,0,0,0,0|3,0,0]=4 1278 B11R1.280 COc1cc(NN)ccc1I Amb25265675 [1,0,0,0,0,0|3,0,0]=4 1279 B11R1.280 COc1cc(NN)ccc1N Amb27665702 [1,0,0,0,0,0|3,0,0]=4 1280 B11R1.280 COc1cc(NN)ccc1O Amb24712582 [1,0,0,0,0,0|2,0,0]=3 1281 B11R1.280 COc1cc(NN)ccc1S Amb28434921 [1,0,0,0,0,0|2,1,0]=4 1282 B11R1.280 COc1cc(OC)c(O)cn1 Amb27638946 [1,0,0,0,0,0|3,0,0]=4 1283 B11R1.280 COc1cc(SC)ccc1F Amb28182540 [1,0,0,0,0,0|3,0,0]=4 1284 B11R1.280 COc1cc(SC)ccc1I Amb24368771 [1,0,0,0,0,0|3,0,0]=4 1285 B11R1.280 COc1cc(SC)ccc1N Amb20623878 [1,0,0,0,0,0|3,0,0]=4 1286 B11R1.280 COc1cc(SC)ccc1N Amb33321473 [1,0,0,0,0,0|3,0,0]=4 1287 B11R1.280 COc1cc(SC)ccc1O Amb18126705 [1,0,0,0,0,0|2,0,0]=3 1288 B11R1.280 COc1cc([N+]#N)ccc1Br Amb27883636 [1,0,0,0,0,0|3,0,0]=4 1289 B11R1.280 COc1cc([N+]#N)ccc1C Amb29859461 [1,0,0,0,0,0|3,0,0]=4 1290 B11R1.280 COc1ccc(Br)c(OC)c1 Amb2685124 [1,0,0,0,0,0|3,0,0]=4 1291 B11R1.280 COc1ccc(C)c(OC)c1 Amb4037064 [1,0,0,0,0,0|3,0,0]=4 1292 B11R1.280 COc1ccc(Cl)c(OC)c1 Amb2685872 [1,0,0,0,0,0|3,0,0]=4 1293 B11R1.280 COc1ccc(F)c(OC)c1 Amb2687362 [1,0,0,0,0,0|3,0,0]=4 1294 B11R1.280 COc1ccc(I)c(OC)c1 Amb2687371 [1,0,0,0,0,0|3,0,0]=4 1295 B11R1.280 COc1ccc(N)c(OC)c1 Amb2725495 [1,0,0,0,0,0|3,0,0]=4 1296 B11R1.280 COc1ccc(O)c(OC)c1 Amb17199437 [1,0,0,0,0,0|2,0,0]=3 1297 B11R1.280 COc1ccc(O)c(OC)n1 Amb2696838 [1,0,0,0,0,0|3,0,0]=4 1298 B11R1.280 COc1ccc(S)c(OC)c1 Amb2687435 [1,0,0,0,0,0|2,1,0]=4 1299 B11R1.280 COc1ccc([Mg+])c(OC)c1 Amb22489729 [1,0,0,0,0,0|3,0,0]=4 1300 B11R1.280 COc1nc(C=O)ccc1Br Amb24724915 [1,0,0,0,0,0|2,0,0]=3 1301 B11R1.280 COc1nc(C=O)ccc1C Amb28423438 [1,0,0,0,0,0|2,0,0]=3 1302 B11R1.280 COc1nc(C=O)ccc1Cl Amb25104651 [1,0,0,0,0,0|2,0,0]=3 1303 B11R1.280 COc1nc(C=O)ccc1F Amb25151176 [1,0,0,0,0,0|2,0,0]=3 1304 B11R1.280 COc1nc(C=O)ccc1I Amb27615892 [1,0,0,0,0,0|2,0,0]=3 1305 B11R1.280 COc1nc(C=O)ncc1Br Amb33749371 [1,0,0,0,0,0|3,0,0]=4 1306 B11R1.280 COc1nc(CN)ccc1O Amb27832857 [1,0,0,0,0,0|2,0,1]=4 1307 B11R1.280 COc1nc(CO)ccc1Br Amb26049393 [1,0,0,0,0,0|2,0,1]=4 1308 B11R1.280 COc1nc(CO)ccc1Cl Amb25696908 [1,0,0,0,0,0|2,0,1]=4 1309 B11R1.280 COc1nc(CO)ccc1F Amb26476272 [1,0,0,0,0,0|2,0,1]=4 1310 B11R1.280 CSC1=C\C(=N\O)C=CC1=O Amb27435106 [1,0,0,0,0,0|1,1,1]=4 1311 B11R1.280 CSc1cc(C#N)ccc1O Amb27483107 [1,0,0,0,0,0|1,1,1]=4 1312 B11R1.280 CSc1cc(C=O)ccc1C Amb27439060 [1,0,0,0,0,0|1,1,0]=3 1313 B11R1.280 CSc1cc(C=O)ccc1F Amb25891721 [1,0,0,0,0,0|1,1,0]=3 1314 B11R1.280 CSc1cc(C=O)ccc1O Amb24648702 [1,0,0,0,0,0|0,1,0]=2 1315 B11R1.280 CSc1cc(CO)ccc1F Amb28182582 [1,0,0,0,0,0|1,1,1]=4 1316 B11R1.280 CSc1cc(CO)ccc1O Amb27974050 [1,0,0,0,0,0|0,1,1]=3 1317 B11R1.280 CSc1cc(N=O)ccc1O Amb28074718 [1,0,0,0,0,0|1,1,0]=3 1318 B11R1.280 CSc1ccc(O)c(SC)c1 Amb18129646 [1,0,0,0,0,0|2,1,0]=4 1319 B11R1.280 C\C=C1/C=CC(=O)C(OC)=C1 Amb28429538 [1,0,0,0,0,0|1,0,1]=3 1320 B11R1.280 Cc1ccc(C=O)cc1C#N Amb16230003 [1,0,0,0,0,0|3,0,0]=4 1321 B11R1.280 Cc1ccc(C=O)cc1CCl Amb28197535 [1,0,0,0,0,0|3,0,0]=4 1322 B11R1.280 Cc1ccc(C=O)cc1CO Amb28128396 [1,0,0,0,0,0|3,0,0]=4 1323 B11R1.280 Cc1ccc(C=O)cc1NN Amb26989903 [1,0,0,0,0,0|3,0,0]=4 1324 B11R1.280 N#Cc1cc(C=O)ccc1Br Amb22011727 [1,0,0,0,0,0|3,0,0]=4 1325 B11R1.280 N#Cc1cc(C=O)ccc1Cl Amb22170248 [1,0,0,0,0,0|3,0,0]=4 1326 B11R1.280 N#Cc1cc(C=O)ccc1F Amb3939299 [1,0,0,0,0,0|3,0,0]=4 1327 B11R1.280 N#Cc1cc(C=O)ccc1N Amb21926780 [1,0,0,0,0,0|3,0,0]=4 1328 B11R1.280 N#Cc1cc(C=O)ccc1O Amb22396045 [1,0,0,0,0,0|2,0,0]=3 1329 B11R1.280 N#Cc1cc(CO)ccc1O Amb26959300 [1,0,0,0,0,0|2,0,1]=4 1330 B11R1.280 NCc1cc(C=O)ccc1O Amb23559308 [1,0,0,0,0,0|2,0,0]=3 1331 B11R1.280 NNc1cc(C=O)ccc1Br Amb27965688 [1,0,0,0,0,0|3,0,0]=4 1332 B11R1.280 NNc1cc(C=O)ccc1Cl Amb26608271 [1,0,0,0,0,0|3,0,0]=4 1333 B11R1.280 NNc1cc(C=O)ccc1F Amb28135579 [1,0,0,0,0,0|3,0,0]=4 1334 B11R1.280 NNc1cc(C=O)ccc1I Amb27439336 [1,0,0,0,0,0|3,0,0]=4 1335 B11R1.280 NNc1cc(C=O)ccc1O Amb25964241 [1,0,0,0,0,0|2,0,0]=3 1336 B11R1.280 NNc1cc(C=O)ccc1S Amb26582559 [1,0,0,0,0,0|2,1,0]=4 1337 B11R1.280 O=Cc1cc(C=O)c(O)cn1 Amb27451309 [1,0,0,0,0,0|3,0,0]=4 1338 B11R1.280 O=Cc1cc(CO)ccc1O Amb16186821 [1,0,0,0,0,0|2,0,1]=4 1339 B11R1.280 O=Cc1cc(N=O)ccc1O Amb27176374 [1,0,0,0,0,0|3,0,0]=4 1340 B11R1.280 O=Cc1ccc(Br)c(C=O)c1 Amb22754824 [1,0,0,0,0,0|3,0,0]=4 1341 B11R1.280 O=Cc1ccc(Br)c(CCl)c1 Amb27237291 [1,0,0,0,0,0|3,0,0]=4 1342 B11R1.280 O=Cc1ccc(Br)c(CO)c1 Amb23437486 [1,0,0,0,0,0|3,0,0]=4 1343 B11R1.280 O=Cc1ccc(Cl)c(C=O)c1 Amb27176469 [1,0,0,0,0,0|3,0,0]=4 1344 B11R1.280 O=Cc1ccc(Cl)c(CBr)c1 Amb28241466 [1,0,0,0,0,0|3,0,0]=4 1345 B11R1.280 O=Cc1ccc(F)c(CBr)c1 Amb22735655 [1,0,0,0,0,0|3,0,0]=4 1346 B11R1.280 O=Cc1ccc(I)c(CBr)c1 Amb28284711 [1,0,0,0,0,0|3,0,0]=4 1347 B11R1.280 O=Cc1ccc(O)c(C=O)c1 Amb2720284 [1,0,0,0,0,0|2,0,0]=3 1348 B11R1.280 O=Cc1ccc(O)c(CCl)c1 Amb2796313 [1,0,0,0,0,0|2,0,0]=3 1349 B11R1.280 O=Cc1ccc(O)c(CO)c1 Amb3778843 [1,0,0,0,0,0|2,0,0]=3 1350 B11R1.280 O=Cc1cnc(O)c(C=O)c1 Amb28124823 [1,0,0,0,0,0|3,0,0]=4 1351 B11R1.280 OCc1ccc(O)c(CO)c1 Amb18125663 [1,0,0,0,0,0|2,0,1]=4 1352 B11R1.280 [C-]#[N+]c1ccc(Br)c(OC)c1 Amb32797423 [1,0,0,0,0,0|3,0,0]=4 1353 B11R1.280 [C-]#[N+]c1ccc(C)c(OC)c1 Amb32797378 [1,0,0,0,0,0|3,0,0]=4 1354 B11R1.280 [C-]#[N+]c1ccc(Cl)c(OC)c1 Amb32797366 [1,0,0,0,0,0|3,0,0]=4 1355 B11R1.280 [C-]#[N+]c1ccc(F)c(OC)c1 Amb32797401 [1,0,0,0,0,0|3,0,0]=4 1356 B13R1.13 C=C(C)c1ccc(O)c(C(C)C)c1 Amb28351628 [0,1,0,0,0,0|3,0,0]=4 1357 B13R1.13 CC(=O)C1=CC(C(=O)O)=CNC1=O Amb18193419 [0,1,0,0,0,0|2,0,1]=4 1358 B13R1.13 CC(=O)c1cc(C(=O)O)ccc1C Amb17201601 [0,1,0,0,0,0|2,0,0]=3 1359 B13R1.13 CC(=O)c1cc(C(=O)O)ccc1Cl Amb25244510 [0,1,0,0,0,0|2,0,0]=3 1360 B13R1.13 CC(=O)c1cc(C(=O)O)ccc1F Amb26345774 [0,1,0,0,0,0|2,0,0]=3 1361 B13R1.13 CC(=O)c1cc(C(=O)O)ccc1N Amb25775930 [0,1,0,0,0,0|2,0,0]=3 1362 B13R1.13 CC(=O)c1cc(C(=O)O)ccc1O Amb1139217 [0,1,0,0,0,0|1,0,0]=2 1363 B13R1.13 CC(=O)c1cc(C(=O)O)cnc1N Amb27641100 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.13 CC(=O)c1cc(C(N)=O)ccc1C Amb28065593 [0,1,0,0,0,0|3,0,0]=4 1365 B13R1.13 CC(=O)c1cc([N+](=O)[O-])ccc1O Amb5492706 [0,1,0,0,0,0|2,0,1]=4 1366 B13R1.13 CC(=O)c1ccc(C)c(N(C)C)c1 Amb25042666 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.13 CC(=O)c1ccc(Cl)c(N(C)C)c1 Amb18267416 [0,1,0,0,0,0|3,0,0]=4 1368 B13R1.13 CC(=O)c1ccc(F)c(N(C)C)c1 Amb18930559 [0,1,0,0,0,0|3,0,0]=4 1369 B13R1.13 CC(=O)c1ccc(O)c(C(=O)O)c1 Amb2781439 [0,1,0,0,0,0|3,0,0]=4 1370 B13R1.13 CC(=O)c1ccc(O)c(C(=O)[O-])c1 Amb33513156 [0,1,0,0,0,0|3,0,0]=4 1371 B13R1.13 CC(=O)c1ccc(O)c(C(C)C)c1 Amb18555071 [0,1,0,0,0,0|2,0,0]=3 1372 B13R1.13 CC(=O)c1ccc(O)c(C(N)=O)c1 Amb2725547 [0,1,0,0,0,0|3,0,0]=4 1373 B13R1.13 CC(=O)c1ccc(O)c([N+](=O)[O-])c1 Amb6357509 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.13 CC(C)N1C=C(C(=O)O)C=CC1=O Amb18956702 [0,1,0,0,0,0|2,0,1]=4 1375 B13R1.13 CC(C)c1cc(B(O)O)ccc1O Amb25192268 [0,1,0,0,0,0|2,0,1]=4 1376 B13R1.13 CC(C)c1cc(C(=O)Cl)ccc1O Amb28126614 [0,1,0,0,0,0|2,0,0]=3 1377 B13R1.13 CC(C)c1cc(C(=O)O)ccc1Cl Amb19892759 [0,1,0,0,0,0|2,0,0]=3 1378 B13R1.13 CC(C)c1cc(C(=O)O)ccc1O Amb18555010 [0,1,0,0,0,0|1,0,0]=2 1379 B13R1.13 CC(C)c1cc(C(=O)O)ncc1Cl Amb18187534 [0,1,0,0,0,0|3,0,0]=4 1380 B13R1.13 CC(C)c1cc(C(=O)O)nnc1O Amb24556076 [0,1,0,0,0,0|3,0,0]=4 1381 B13R1.13 CC(C)c1cc([N+](=O)[O-])ccc1O Amb6308446 [0,1,0,0,0,0|2,0,1]=4 1382 B13R1.13 CC(F)c1cc(C(=O)O)ccc1O Amb28245499 [0,1,0,0,0,0|1,0,0]=2 1383 B13R1.13 CC(N)c1cc(C(=O)O)ccc1Br Amb27176954 [0,1,0,0,0,0|2,0,0]=3 1384 B13R1.13 CC(N)c1cc([N+](=O)[O-])ccc1O Amb27654952 [0,1,0,0,0,0|2,0,1]=4 1385 B13R1.13 CC(O)c1ccc(O)c(C(C)F)c1 Amb27635432 [0,1,0,0,0,0|2,0,1]=4 1386 B13R1.13 CN(C)C1=CC(C(=O)O)=CNC1=O Amb28400152 [0,1,0,0,0,0|2,0,1]=4 1387 B13R1.13 CN(C)c1cc(C(=O)O)ccc1Br Amb28041795 [0,1,0,0,0,0|2,0,0]=3 1388 B13R1.13 CN(C)c1cc(C(=O)O)ccc1Cl Amb18269672 [0,1,0,0,0,0|2,0,0]=3 1389 B13R1.13 CN(C)c1cc(C(=O)O)ccc1F Amb18268965 [0,1,0,0,0,0|2,0,0]=3 1390 B13R1.13 CN(C)c1cc(C(=O)O)ccc1N Amb27977695 [0,1,0,0,0,0|2,0,0]=3 1391 B13R1.13 CN(C)c1nc(C(=O)O)ccc1Cl Amb32698488 [0,1,0,0,0,0|3,0,0]=4 1392 B13R1.13 CS(=O)c1cc(C(=O)O)ccc1F Amb27664676 [0,1,0,0,0,0|1,1,0]=3 1393 B13R1.13 C[C@@H](N)c1cc(C(=O)O)ccc1Br Amb27864157 [0,1,0,0,0,0|2,0,0]=3 1394 B13R1.13 C[C@@H](N)c1cc(C(N)=O)ccc1O Amb28067781 [0,1,0,0,0,0|2,0,0]=3 1395 B13R1.13 C[C@@H](N)c1cc([N+](=O)[O-])ccc1O Amb24346903 [0,1,0,0,0,0|2,0,1]=4 1396 B13R1.13 C[C@@H](O)c1cc([N+](=O)[O-])ccc1O Amb26951131 [0,1,0,0,0,0|2,0,1]=4 1397 B13R1.13 C[C@H](N)c1cc(C(=O)O)ccc1N Amb27224956 [0,1,0,0,0,0|2,0,0]=3 1398 B13R1.13 C[C@H](N)c1cc(C(=O)O)ccc1O Amb27596529 [0,1,0,0,0,0|1,0,0]=2 1399 B13R1.13 C[C@H](N)c1cc(C(N)=O)ccc1O Amb28316439 [0,1,0,0,0,0|2,0,0]=3 1400 B13R1.13 C[C@H](N)c1cc([N+](=O)[O-])ccc1O Amb24763665 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.13 C[C@H](O)c1cc([N+](=O)[O-])ccc1O Amb25257860 [0,1,0,0,0,0|2,0,1]=4 1402 B13R1.13 Cc1ccc(C(=O)O)cc1B(O)O Amb20241158 [0,1,0,0,0,0|3,0,0]=4 1403 B13R1.13 Cc1ccc(C(=O)O)cc1C(=O)O Amb17201548 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.13 Cc1ccc(C(=O)O)cc1C(C)C Amb27974182 [0,1,0,0,0,0|2,0,0]=3 1405 B13R1.13 Cc1ccc(C(=O)O)cc1C(C)N Amb27954463 [0,1,0,0,0,0|2,0,0]=3 1406 B13R1.13 Cc1ccc(C(=O)O)cc1C(F)F Amb25376065 [0,1,0,0,0,0|3,0,0]=4 1407 B13R1.13 Cc1ccc(C(=O)O)cc1C(N)=O Amb27607694 [0,1,0,0,0,0|3,0,0]=4 1408 B13R1.13 Cc1ccc(C(=O)O)cc1C(O)=S Amb25863452 [0,1,0,0,0,0|3,0,0]=4 1409 B13R1.13 Cc1ccc(C(=O)O)cc1N(C)C Amb23441481 [0,1,0,0,0,0|2,0,0]=3 1410 B13R1.13 Cc1ccc(C(=O)O)cc1[C@H](C)N Amb27196225 [0,1,0,0,0,0|2,0,0]=3 1411 B13R1.13 Cc1ccc(C(=O)O)cc1[N+](=O)[O-] Amb2554776 [0,1,0,0,0,0|3,0,0]=4 1412 B13R1.13 NC(=O)c1cc(C(=O)O)ccc1Cl Amb27829912 [0,1,0,0,0,0|3,0,0]=4 1413 B13R1.13 NC(=O)c1cc(C(=O)O)ccc1F Amb27775514 [0,1,0,0,0,0|3,0,0]=4 1414 B13R1.13 NC(=O)c1ccc(O)c(B(O)O)c1 Amb27862430 [0,1,0,0,0,0|3,0,0]=4 1415 B13R1.13 NC(=O)c1ccc(O)c(C(=O)O)c1 Amb24183844 [0,1,0,0,0,0|3,0,0]=4 1416 B13R1.13 NC(=O)c1ccc(O)c([N+](=O)[O-])c1 Amb25945772 [0,1,0,0,0,0|3,0,0]=4 1417 B13R1.13 Nc1ccc(C(=O)O)cc1C(=O)O Amb7092155 [0,1,0,0,0,0|3,0,0]=4 1418 B13R1.13 Nc1ccc(C(=O)O)cc1[N+](=O)[O-] Amb1033050 [0,1,0,0,0,0|3,0,0]=4 1419 B13R1.13 O=C(Cl)c1ccc(O)c(C(=O)Cl)c1 Amb28351591 [0,1,0,0,0,0|3,0,0]=4 1420 B13R1.13 O=C(O)c1cc(C(F)F)c(O)cn1 Amb25848368 [0,1,0,0,0,0|3,0,0]=4 1421 B13R1.13 O=C(O)c1cc(S(=O)O)ccc1O Amb25669376 [0,1,0,0,0,0|3,0,0]=4 1422 B13R1.13 O=C(O)c1cc([N+](=O)[O-])c(O)cn1 Amb26452601 [0,1,0,0,0,0|3,0,0]=4 1423 B13R1.13 O=C(O)c1ccc(Br)c(B(O)O)c1 Amb26051157 [0,1,0,0,0,0|3,0,0]=4 1424 B13R1.13 O=C(O)c1ccc(Br)c(C(=O)O)c1 Amb2685283 [0,1,0,0,0,0|3,0,0]=4 1425 B13R1.13 O=C(O)c1ccc(Br)c(N(=O)=O)c1 Amb20620549 [0,1,0,0,0,0|3,0,0]=4 1426 B13R1.13 O=C(O)c1ccc(Br)c([N+](=O)[O-])c1 Amb6364716 [0,1,0,0,0,0|3,0,0]=4 1427 B13R1.13 O=C(O)c1ccc(Cl)c(B(O)O)c1 Amb10070675 [0,1,0,0,0,0|3,0,0]=4 1428 B13R1.13 O=C(O)c1ccc(Cl)c(C(=O)O)c1 Amb9173993 [0,1,0,0,0,0|3,0,0]=4 1429 B13R1.13 O=C(O)c1ccc(Cl)c(C(F)F)c1 Amb33730985 [0,1,0,0,0,0|3,0,0]=4 1430 B13R1.13 O=C(O)c1ccc(Cl)c(S(=O)O)c1 Amb28253121 [0,1,0,0,0,0|2,1,0]=4 1431 B13R1.13 O=C(O)c1ccc(Cl)c([N+](=O)[O-])c1 Amb6334879 [0,1,0,0,0,0|3,0,0]=4 1432 B13R1.13 O=C(O)c1ccc(F)c(B(O)O)c1 Amb16232060 [0,1,0,0,0,0|3,0,0]=4 1433 B13R1.13 O=C(O)c1ccc(F)c(C(=O)O)c1 Amb22008323 [0,1,0,0,0,0|3,0,0]=4 1434 B13R1.13 O=C(O)c1ccc(F)c(C(F)F)c1 Amb26567524 [0,1,0,0,0,0|3,0,0]=4 1435 B13R1.13 O=C(O)c1ccc(F)c([N+](=O)[O-])c1 Amb1980791 [0,1,0,0,0,0|3,0,0]=4 1436 B13R1.13 O=C(O)c1ccc(I)c(C(=O)O)c1 Amb27830176 [0,1,0,0,0,0|3,0,0]=4 1437 B13R1.13 O=C(O)c1ccc(I)c(N(=O)=O)c1 Amb20621473 [0,1,0,0,0,0|3,0,0]=4 1438 B13R1.13 O=C(O)c1ccc(I)c([N+](=O)[O-])c1 Amb6296300 [0,1,0,0,0,0|3,0,0]=4 1439 B13R1.13 O=C(O)c1ccc(O)c(B(O)O)c1 Amb27162242 [0,1,0,0,0,0|2,0,0]=3 1440 B13R1.13 O=C(O)c1ccc(O)c(C(=O)O)c1 Amb6200999 [0,1,0,0,0,0|2,0,0]=3 1441 B13R1.13 O=C(O)c1ccc(O)c(C(=O)O)n1 Amb25320947 [0,1,0,0,0,0|3,0,0]=4 1442 B13R1.13 O=C(O)c1ccc(O)c(N(=O)=O)c1 Amb6357408 [0,1,0,0,0,0|2,0,0]=3 1443 B13R1.13 O=C(O)c1ccc(O)c([N+](=O)[O-])c1 Amb1980793 [0,1,0,0,0,0|2,0,0]=3 1444 B13R1.13 O=C(O)c1ccc(O)c([N+](=O)[O-])n1 Amb24373088 [0,1,0,0,0,0|3,0,0]=4 1445 B13R1.13 O=C(O)c1ccc(S)c(C(=O)O)c1 Amb28118925 [0,1,0,0,0,0|2,1,0]=4 1446 B13R1.13 O=C(O)c1ccc(S)c([N+](=O)[O-])c1 Amb18954046 [0,1,0,0,0,0|2,1,0]=4 1447 B13R1.13 O=C(O)c1cnc(O)c(C(F)F)c1 Amb26520828 [0,1,0,0,0,0|3,0,0]=4 1448 B13R1.13 O=C(O)c1cnc(O)c(N(=O)=O)c1 Amb20621433 [0,1,0,0,0,0|3,0,0]=4 1449 B13R1.13 O=C(O)c1cnc(O)c([N+](=O)[O-])c1 Amb3431630 [0,1,0,0,0,0|3,0,0]=4 1450 B13R1.13 O=C([O-])c1ccc(O)c(S(=O)[O-])c1 Amb32753941 [0,1,0,0,0,0|1,1,1]=4 1451 B13R1.49 C#CC(C)c1ccc(O)c(OC)c1 Amb33429355 [0,1,0,0,0,0|2,0,1]=4 1452 B13R1.49 C#Cc1cc(C(=O)OC)ccc1C Amb26881136 [0,1,0,0,0,0|2,0,1]=4 1453 B13R1.49 C#Cc1cc(C(=O)OC)ccc1O Amb27267047 [0,1,0,0,0,0|1,0,1]=3 1454 B13R1.49 C=C(CBr)c1ccc(C)c(OC)c1 Amb33335636 [0,1,0,0,0,0|3,0,0]=4 1455 B13R1.49 C=C(CBr)c1ccc(Cl)c(OC)c1 Amb33335586 [0,1,0,0,0,0|3,0,0]=4 1456 B13R1.49 C=C(CBr)c1ccc(F)c(OC)c1 Amb33332816 [0,1,0,0,0,0|3,0,0]=4 1457 B13R1.49 C=C(CBr)c1ccc(O)c(OC)c1 Amb33430017 [0,1,0,0,0,0|2,0,0]=3 1458 B13R1.49 C=C(CCl)c1ccc(Br)c(OC)c1 Amb33336362 [0,1,0,0,0,0|3,0,0]=4 1459 B13R1.49 C=C(CCl)c1ccc(Cl)c(OC)c1 Amb33256433 [0,1,0,0,0,0|3,0,0]=4 1460 B13R1.49 C=C(CCl)c1ccc(F)c(OC)c1 Amb33414057 [0,1,0,0,0,0|3,0,0]=4 1461 B13R1.49 C=C(CCl)c1ccc(O)c(OC)c1 Amb33052804 [0,1,0,0,0,0|2,0,0]=3 1462 B13R1.49 C=C(CN)c1ccc(Br)c(OC)c1 Amb33331783 [0,1,0,0,0,0|3,0,0]=4 1463 B13R1.49 C=C(CN)c1ccc(C)c(OC)c1 Amb33419527 [0,1,0,0,0,0|3,0,0]=4 1464 B13R1.49 C=C(CN)c1ccc(Cl)c(OC)c1 Amb33256443 [0,1,0,0,0,0|3,0,0]=4 1465 B13R1.49 C=C(CN)c1ccc(F)c(OC)c1 Amb33313151 [0,1,0,0,0,0|3,0,0]=4 1466 B13R1.49 C=C(CN)c1ccc(O)c(OC)c1 Amb33429333 [0,1,0,0,0,0|2,0,0]=3 1467 B13R1.49 C=CC(=O)c1ccc(Br)c(OC)c1 Amb25832749 [0,1,0,0,0,0|2,0,0]=3 1468 B13R1.49 C=CC(=O)c1ccc(C)c(OC)c1 Amb24730319 [0,1,0,0,0,0|2,0,0]=3 1469 B13R1.49 C=CC(=O)c1ccc(Cl)c(OC)c1 Amb24567009 [0,1,0,0,0,0|2,0,0]=3 1470 B13R1.49 C=CC(=O)c1ccc(F)c(OC)c1 Amb25926365 [0,1,0,0,0,0|2,0,0]=3 1471 B13R1.49 C=CC(=O)c1ccc(O)c(OC)c1 Amb18128068 [0,1,0,0,0,0|1,0,0]=2 1472 B13R1.49 C=CC(=O)c1cnc(Cl)c(OC)c1 Amb27950161 [0,1,0,0,0,0|3,0,0]=4 1473 B13R1.49 C=CC(O)c1ccc(Br)c(OC)c1 Amb33331425 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.49 C=CC(O)c1ccc(C)c(OC)c1 Amb25076079 [0,1,0,0,0,0|2,0,1]=4 1475 B13R1.49 C=CC(O)c1ccc(Cl)c(OC)c1 Amb33052764 [0,1,0,0,0,0|2,0,1]=4 1476 B13R1.49 C=CC(O)c1ccc(F)c(OC)c1 Amb27632083 [0,1,0,0,0,0|2,0,1]=4 1477 B13R1.49 C=CC(O)c1ccc(O)c(OC)c1 Amb25788963 [0,1,0,0,0,0|1,0,1]=3 1478 B13R1.49 CCC(=O)c1ccc(Br)c(CC)c1 Amb27209927 [0,1,0,0,0,0|3,0,0]=4 1479 B13R1.49 CCC(=O)c1ccc(Br)c(OC)c1 Amb26853687 [0,1,0,0,0,0|2,0,0]=3 1480 B13R1.49 CCC(=O)c1ccc(Br)c(SC)c1 Amb26576826 [0,1,0,0,0,0|2,1,0]=4 1481 B13R1.49 CCC(=O)c1ccc(C)c(CC)c1 Amb26965735 [0,1,0,0,0,0|3,0,0]=4 1482 B13R1.49 CCC(=O)c1ccc(Cl)c(OC)c1 Amb24496952 [0,1,0,0,0,0|2,0,0]=3 1483 B13R1.49 CCC(=O)c1ccc(Cl)c(SC)c1 Amb27844663 [0,1,0,0,0,0|2,1,0]=4 1484 B13R1.49 CCC(=O)c1ccc(F)c(OC)c1 Amb28243412 [0,1,0,0,0,0|2,0,0]=3 1485 B13R1.49 CCC(=O)c1ccc(I)c(OC)c1 Amb27948017 [0,1,0,0,0,0|2,0,0]=3 1486 B13R1.49 CCC(=O)c1ccc(I)c(SC)c1 Amb27423739 [0,1,0,0,0,0|2,1,0]=4 1487 B13R1.49 CCC(=O)c1ccc(N)c(OC)c1 Amb27596146 [0,1,0,0,0,0|2,0,0]=3 1488 B13R1.49 CCC(=O)c1ccc(O)c(C#N)c1 Amb27968195 [0,1,0,0,0,0|3,0,0]=4 1489 B13R1.49 CCC(=O)c1ccc(O)c(CCl)c1 Amb4005555 [0,1,0,0,0,0|3,0,0]=4 1490 B13R1.49 CCC(=O)c1ccc(O)c(CO)c1 Amb27209139 [0,1,0,0,0,0|3,0,0]=4 1491 B13R1.49 CCC(=O)c1ccc(O)c(OC)c1 Amb533168 [0,1,0,0,0,0|1,0,0]=2 1492 B13R1.49 CCC(=O)c1ccc(S)c(OC)c1 Amb27877028 [0,1,0,0,0,0|1,1,0]=3 1493 B13R1.49 CCC(C)c1ccc(O)c(OC)c1 Amb25894322 [0,1,0,0,0,0|2,0,1]=4 1494 B13R1.49 CCC(N)c1ccc(O)c(OC)c1 Amb18056265 [0,1,0,0,0,0|2,0,1]=4 1495 B13R1.49 CCC(O)c1ccc(F)c(OC)c1 Amb28322755 [0,1,0,0,0,0|2,0,1]=4 1496 B13R1.49 CCC(O)c1ccc(O)c(OC)c1 Amb1787750 [0,1,0,0,0,0|1,0,1]=3 1497 B13R1.49 CC[C@@H](O)c1ccc(F)c(OC)c1 Amb27187251 [0,1,0,0,0,0|2,0,1]=4 1498 B13R1.49 CC[C@H](O)c1ccc(O)c(OC)c1 Amb27609521 [0,1,0,0,0,0|1,0,1]=3 1499 B13R1.49 CCc1cc(C(=O)CBr)ccc1Br Amb24492197 [0,1,0,0,0,0|3,0,0]=4 1500 B13R1.49 CCc1cc(C(=O)CBr)ccc1Cl Amb27602646 [0,1,0,0,0,0|3,0,0]=4 1501 B13R1.49 CCc1cc(C(=O)CBr)ccc1I Amb28365048 [0,1,0,0,0,0|3,0,0]=4 1502 B13R1.49 CCc1cc(C(=O)CBr)ccc1N Amb27648753 [0,1,0,0,0,0|3,0,0]=4 1503 B13R1.49 CCc1cc(C(=O)NN)ccc1Cl Amb28243634 [0,1,0,0,0,0|3,0,0]=4 1504 B13R1.49 CCc1cc(C(=O)OC)cc[n+]1[O-] Amb28139600 [0,1,0,0,0,0|2,0,1]=4 1505 B13R1.49 CCc1cc(C(=O)OC)ccc1Br Amb27398146 [0,1,0,0,0,0|2,0,0]=3 1506 B13R1.49 CCc1cc(C(=O)OC)ccc1Cl Amb28243633 [0,1,0,0,0,0|2,0,0]=3 1507 B13R1.49 CCc1cc(C(=O)OC)ccc1F Amb28365874 [0,1,0,0,0,0|2,0,0]=3 1508 B13R1.49 CCc1cc(C(=O)OC)ccc1N Amb26316245 [0,1,0,0,0,0|2,0,0]=3 1509 B13R1.49 CNC(=N)c1ccc(F)c(OC)c1 Amb28317495 [0,1,0,0,0,0|3,0,0]=4 1510 B13R1.49 CNC(=O)c1cc(OC)c(O)cn1 Amb28255485 [0,1,0,0,0,0|2,0,0]=3 1511 B13R1.49 CNC(=O)c1ccc(Br)c(OC)c1 Amb22001296 [0,1,0,0,0,0|2,0,0]=3 1512 B13R1.49 CNC(=O)c1ccc(C)c(OC)c1 Amb8326930 [0,1,0,0,0,0|2,0,0]=3 1513 B13R1.49 CNC(=O)c1ccc(F)c(OC)c1 Amb27878474 [0,1,0,0,0,0|2,0,0]=3 1514 B13R1.49 CNC(=O)c1ccc(F)c(SC)c1 Amb26343596 [0,1,0,0,0,0|2,1,0]=4 1515 B13R1.49 CNC(=O)c1ccc(N)c(OC)c1 Amb17226390 [0,1,0,0,0,0|2,0,0]=3 1516 B13R1.49 CNC(=O)c1ccc(O)c(CN)c1 Amb28197749 [0,1,0,0,0,0|3,0,0]=4 1517 B13R1.49 CNC(=O)c1ccc(O)c(OC)c1 Amb24415298 [0,1,0,0,0,0|1,0,0]=2 1518 B13R1.49 CNC(=O)c1ccc(O)c(OC)n1 Amb27605830 [0,1,0,0,0,0|2,0,0]=3 1519 B13R1.49 CNC(C)c1ccc(O)c(OC)c1 Amb1119752 [0,1,0,0,0,0|2,0,1]=4 1520 B13R1.49 CN[C@H](C)c1ccc(O)c(OC)c1 Amb27859535 [0,1,0,0,0,0|2,0,1]=4 1521 B13R1.49 CNc1cc(C(=O)OC)ccc1Cl Amb19002834 [0,1,0,0,0,0|2,0,0]=3 1522 B13R1.49 CNc1cc(C(=O)OC)ccc1N Amb21858984 [0,1,0,0,0,0|2,0,0]=3 1523 B13R1.49 CNc1nc(C(=O)OC)ccc1Cl Amb27463131 [0,1,0,0,0,0|3,0,0]=4 1524 B13R1.49 CNc1nc(C(=O)OC)ccc1N Amb26591986 [0,1,0,0,0,0|3,0,0]=4 1525 B13R1.49 COC(=N)c1ccc(F)c(OC)c1 Amb28314704 [0,1,0,0,0,0|2,0,0]=3 1526 B13R1.49 COC(=N)c1ccc(O)c(OC)c1 Amb18181286 [0,1,0,0,0,0|1,0,0]=2 1527 B13R1.49 COC(=O)c1cc(OC)c(Br)cn1 Amb22495507 [0,1,0,0,0,0|2,0,0]=3 1528 B13R1.49 COC(=O)c1cc(OC)c(C)cn1 Amb24586367 [0,1,0,0,0,0|2,0,0]=3 1529 B13R1.49 COC(=O)c1cc(OC)c(Cl)cn1 Amb25995916 [0,1,0,0,0,0|2,0,0]=3 1530 B13R1.49 COC(=O)c1cc(OC)c(F)cn1 Amb26844356 [0,1,0,0,0,0|2,0,0]=3 1531 B13R1.49 COC(=O)c1cc(OC)c(O)cn1 Amb27471754 [0,1,0,0,0,0|1,0,0]=2 1532 B13R1.49 COC(=O)c1cc[n+](C)c(OC)c1 Amb22893466 [0,1,0,0,0,0|2,0,0]=3 1533 B13R1.49 COC(=O)c1cc[n+](C)c(SC)c1 Amb2612029 [0,1,0,0,0,0|2,1,0]=4 1534 B13R1.49 COC(=O)c1ccc(Br)c(C#N)c1 Amb22491792 [0,1,0,0,0,0|3,0,0]=4 1535 B13R1.49 COC(=O)c1ccc(Br)c(C=O)c1 Amb22898841 [0,1,0,0,0,0|3,0,0]=4 1536 B13R1.49 COC(=O)c1ccc(Br)c(CBr)c1 Amb22406489 [0,1,0,0,0,0|3,0,0]=4 1537 B13R1.49 COC(=O)c1ccc(Br)c(CCl)c1 Amb23437487 [0,1,0,0,0,0|3,0,0]=4 1538 B13R1.49 COC(=O)c1ccc(Br)c(CO)c1 Amb23437475 [0,1,0,0,0,0|3,0,0]=4 1539 B13R1.49 COC(=O)c1ccc(Br)c(NN)c1 Amb24730571 [0,1,0,0,0,0|3,0,0]=4 1540 B13R1.49 COC(=O)c1ccc(Br)c(NN)c1 Amb32661071 [0,1,0,0,0,0|3,0,0]=4 1541 B13R1.49 COC(=O)c1ccc(Br)c(NN)c1 Amb32664231 [0,1,0,0,0,0|3,0,0]=4 1542 B13R1.49 COC(=O)c1ccc(Br)c(OC)c1 Amb10072102 [0,1,0,0,0,0|1,0,0]=2 1543 B13R1.49 COC(=O)c1ccc(Br)c(OC)n1 Amb21857416 [0,1,0,0,0,0|2,0,0]=3 1544 B13R1.49 COC(=O)c1ccc(Br)c(SC)c1 Amb26425547 [0,1,0,0,0,0|1,1,0]=3 1545 B13R1.49 COC(=O)c1ccc(C)c(C#N)c1 Amb22493982 [0,1,0,0,0,0|3,0,0]=4 1546 B13R1.49 COC(=O)c1ccc(C)c(C=O)c1 Amb27390175 [0,1,0,0,0,0|3,0,0]=4 1547 B13R1.49 COC(=O)c1ccc(C)c(CBr)c1 Amb20621571 [0,1,0,0,0,0|3,0,0]=4 1548 B13R1.49 COC(=O)c1ccc(C)c(CCl)c1 Amb27865474 [0,1,0,0,0,0|3,0,0]=4 1549 B13R1.49 COC(=O)c1ccc(C)c(CN)c1 Amb28348596 [0,1,0,0,0,0|3,0,0]=4 1550 B13R1.49 COC(=O)c1ccc(C)c(CO)c1 Amb23437478 [0,1,0,0,0,0|3,0,0]=4 1551 B13R1.49 COC(=O)c1ccc(C)c(NN)c1 Amb28125343 [0,1,0,0,0,0|3,0,0]=4 1552 B13R1.49 COC(=O)c1ccc(C)c(OC)c1 Amb6357574 [0,1,0,0,0,0|1,0,0]=2 1553 B13R1.49 COC(=O)c1ccc(C)c(OC)n1 Amb8388509 [0,1,0,0,0,0|2,0,0]=3 1554 B13R1.49 COC(=O)c1ccc(C)c(SC)c1 Amb25759615 [0,1,0,0,0,0|1,1,0]=3 1555 B13R1.49 COC(=O)c1ccc(Cl)c(C#N)c1 Amb22751096 [0,1,0,0,0,0|3,0,0]=4 1556 B13R1.49 COC(=O)c1ccc(Cl)c(C=O)c1 Amb25837444 [0,1,0,0,0,0|3,0,0]=4 1557 B13R1.49 COC(=O)c1ccc(Cl)c(CBr)c1 Amb23437451 [0,1,0,0,0,0|3,0,0]=4 1558 B13R1.49 COC(=O)c1ccc(Cl)c(CCl)c1 Amb25155162 [0,1,0,0,0,0|3,0,0]=4 1559 B13R1.49 COC(=O)c1ccc(Cl)c(CN)c1 Amb26425821 [0,1,0,0,0,0|3,0,0]=4 1560 B13R1.49 COC(=O)c1ccc(Cl)c(CO)c1 Amb23437485 [0,1,0,0,0,0|3,0,0]=4 1561 B13R1.49 COC(=O)c1ccc(Cl)c(NN)c1 Amb22446888 [0,1,0,0,0,0|3,0,0]=4 1562 B13R1.49 COC(=O)c1ccc(Cl)c(OC)c1 Amb20621583 [0,1,0,0,0,0|1,0,0]=2 1563 B13R1.49 COC(=O)c1ccc(Cl)c(OC)n1 Amb22751234 [0,1,0,0,0,0|2,0,0]=3 1564 B13R1.49 COC(=O)c1ccc(Cl)c(SC)c1 Amb25875622 [0,1,0,0,0,0|1,1,0]=3 1565 B13R1.49 COC(=O)c1ccc(F)c(C#N)c1 Amb10604154 [0,1,0,0,0,0|3,0,0]=4 1566 B13R1.49 COC(=O)c1ccc(F)c(C=O)c1 Amb19958863 [0,1,0,0,0,0|3,0,0]=4 1567 B13R1.49 COC(=O)c1ccc(F)c(CBr)c1 Amb23437480 [0,1,0,0,0,0|3,0,0]=4 1568 B13R1.49 COC(=O)c1ccc(F)c(CCl)c1 Amb25670303 [0,1,0,0,0,0|3,0,0]=4 1569 B13R1.49 COC(=O)c1ccc(F)c(CN)c1 Amb26641839 [0,1,0,0,0,0|3,0,0]=4 1570 B13R1.49 COC(=O)c1ccc(F)c(CN)c1 Amb32751173 [0,1,0,0,0,0|3,0,0]=4 1571 B13R1.49 COC(=O)c1ccc(F)c(CO)c1 Amb23437473 [0,1,0,0,0,0|3,0,0]=4 1572 B13R1.49 COC(=O)c1ccc(F)c(NN)c1 Amb22432312 [0,1,0,0,0,0|3,0,0]=4 1573 B13R1.49 COC(=O)c1ccc(F)c(OC)c1 Amb21926916 [0,1,0,0,0,0|1,0,0]=2 1574 B13R1.49 COC(=O)c1ccc(F)c(SC)c1 Amb24737487 [0,1,0,0,0,0|1,1,0]=3 1575 B13R1.49 COC(=O)c1ccc(I)c(C#N)c1 Amb26461248 [0,1,0,0,0,0|3,0,0]=4 1576 B13R1.49 COC(=O)c1ccc(I)c(CBr)c1 Amb23437471 [0,1,0,0,0,0|3,0,0]=4 1577 B13R1.49 COC(=O)c1ccc(I)c(CO)c1 Amb23403375 [0,1,0,0,0,0|3,0,0]=4 1578 B13R1.49 COC(=O)c1ccc(I)c(OC)c1 Amb10604959 [0,1,0,0,0,0|1,0,0]=2 1579 B13R1.49 COC(=O)c1ccc(I)c(OC)n1 Amb22751239 [0,1,0,0,0,0|2,0,0]=3 1580 B13R1.49 COC(=O)c1ccc(I)c(SC)c1 Amb24647837 [0,1,0,0,0,0|1,1,0]=3 1581 B13R1.49 COC(=O)c1ccc(N)c(C#N)c1 Amb22750823 [0,1,0,0,0,0|3,0,0]=4 1582 B13R1.49 COC(=O)c1ccc(N)c(C=O)c1 Amb21964110 [0,1,0,0,0,0|3,0,0]=4 1583 B13R1.49 COC(=O)c1ccc(N)c(CO)c1 Amb23437484 [0,1,0,0,0,0|3,0,0]=4 1584 B13R1.49 COC(=O)c1ccc(N)c(NN)c1 Amb26608239 [0,1,0,0,0,0|3,0,0]=4 1585 B13R1.49 COC(=O)c1ccc(N)c(OC)c1 Amb2608797 [0,1,0,0,0,0|1,0,0]=2 1586 B13R1.49 COC(=O)c1ccc(N)c(OC)n1 Amb22751241 [0,1,0,0,0,0|2,0,0]=3 1587 B13R1.49 COC(=O)c1ccc(N)c(OC)n1 Amb33109802 [0,1,0,0,0,0|2,0,0]=3 1588 B13R1.49 COC(=O)c1ccc(N)c(SC)c1 Amb24096131 [0,1,0,0,0,0|1,1,0]=3 1589 B13R1.49 COC(=O)c1ccc(N)c(SC)n1 Amb27408809 [0,1,0,0,0,0|2,1,0]=4 1590 B13R1.49 COC(=O)c1ccc(O)c(C#N)c1 Amb20242049 [0,1,0,0,0,0|2,0,0]=3 1591 B13R1.49 COC(=O)c1ccc(O)c(C#N)n1 Amb24496789 [0,1,0,0,0,0|3,0,0]=4 1592 B13R1.49 COC(=O)c1ccc(O)c(C=O)c1 Amb10071572 [0,1,0,0,0,0|2,0,0]=3 1593 B13R1.49 COC(=O)c1ccc(O)c(CCl)c1 Amb25744513 [0,1,0,0,0,0|2,0,0]=3 1594 B13R1.49 COC(=O)c1ccc(O)c(CN)c1 Amb9885803 [0,1,0,0,0,0|2,0,0]=3 1595 B13R1.49 COC(=O)c1ccc(O)c(OC)c1 Amb1233206 [0,1,0,0,0,0|0,0,0]=1 1596 B13R1.49 COC(=O)c1ccc(O)c(OC)n1 Amb22494571 [0,1,0,0,0,0|1,0,0]=2 1597 B13R1.49 COC(=O)c1ccc(O)c(SC)c1 Amb25669220 [0,1,0,0,0,0|0,1,0]=2 1598 B13R1.49 COC(=O)c1ccc(S)c(C#N)c1 Amb28042905 [0,1,0,0,0,0|2,1,0]=4 1599 B13R1.49 COC(=O)c1ccc(S)c(NN)c1 Amb27208502 [0,1,0,0,0,0|2,1,0]=4 1600 B13R1.49 COC(=O)c1cnc(Br)c(OC)c1 Amb25970957 [0,1,0,0,0,0|2,0,0]=3 1601 B13R1.49 COC(=O)c1cnc(C)c(OC)c1 Amb25374933 [0,1,0,0,0,0|2,0,0]=3 1602 B13R1.49 COC(=O)c1cnc(Cl)c(OC)c1 Amb19895083 [0,1,0,0,0,0|2,0,0]=3 1603 B13R1.49 COC(=O)c1cnc(F)c(OC)c1 Amb24496788 [0,1,0,0,0,0|2,0,0]=3 1604 B13R1.49 COc1cc(C(=N)NO)ccc1O Amb8190998 [0,1,0,0,0,0|1,0,0]=2 1605 B13R1.49 COc1cc(C(=O)C#N)ccc1O Amb27802472 [0,1,0,0,0,0|1,0,0]=2 1606 B13R1.49 COc1cc(C(=O)CBr)ccc1Br Amb23437507 [0,1,0,0,0,0|2,0,0]=3 1607 B13R1.49 COc1cc(C(=O)CBr)ccc1Cl Amb23437506 [0,1,0,0,0,0|2,0,0]=3 1608 B13R1.49 COc1cc(C(=O)CBr)ccc1F Amb22493810 [0,1,0,0,0,0|2,0,0]=3 1609 B13R1.49 COc1cc(C(=O)CBr)ccc1I Amb24088417 [0,1,0,0,0,0|2,0,0]=3 1610 B13R1.49 COc1cc(C(=O)CBr)ccc1N Amb25126847 [0,1,0,0,0,0|2,0,0]=3 1611 B13R1.49 COc1cc(C(=O)CBr)ccc1O Amb13883652 [0,1,0,0,0,0|1,0,0]=2 1612 B13R1.49 COc1cc(C(=O)CCl)ccc1Br Amb24404818 [0,1,0,0,0,0|2,0,0]=3 1613 B13R1.49 COc1cc(C(=O)CCl)ccc1C Amb24558197 [0,1,0,0,0,0|2,0,0]=3 1614 B13R1.49 COc1cc(C(=O)CCl)ccc1Cl Amb24431921 [0,1,0,0,0,0|2,0,0]=3 1615 B13R1.49 COc1cc(C(=O)CCl)ccc1F Amb26537164 [0,1,0,0,0,0|2,0,0]=3 1616 B13R1.49 COc1cc(C(=O)CCl)ccc1O Amb18056261 [0,1,0,0,0,0|1,0,0]=2 1617 B13R1.49 COc1cc(C(=O)CN)ccc1Br Amb25820581 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.49 COc1cc(C(=O)CN)ccc1C Amb28367241 [0,1,0,0,0,0|2,0,0]=3 1619 B13R1.49 COc1cc(C(=O)CN)ccc1Cl Amb25791379 [0,1,0,0,0,0|2,0,0]=3 1620 B13R1.49 COc1cc(C(=O)CN)ccc1F Amb18823413 [0,1,0,0,0,0|2,0,0]=3 1621 B13R1.49 COc1cc(C(=O)CN)ccc1O Amb26424072 [0,1,0,0,0,0|1,0,0]=2 1622 B13R1.49 COc1cc(C(=O)CO)ccc1O Amb3994169 [0,1,0,0,0,0|0,0,0]=1 1623 B13R1.49 COc1cc(C(=O)NN)ccc1C Amb6248702 [0,1,0,0,0,0|2,0,0]=3 1624 B13R1.49 COc1cc(C(=O)NN)ccc1O Amb1635637 [0,1,0,0,0,0|1,0,0]=2 1625 B13R1.49 COc1cc(C(=O)SC)ccc1O Amb27970133 [0,1,0,0,0,0|0,1,0]=2 1626 B13R1.49 COc1cc(C(C)C#N)ccc1O Amb28242774 [0,1,0,0,0,0|2,0,1]=4 1627 B13R1.49 COc1cc(C(C)C=O)ccc1Br Amb33331782 [0,1,0,0,0,0|2,0,1]=4 1628 B13R1.49 COc1cc(C(C)C=O)ccc1C Amb26855994 [0,1,0,0,0,0|2,0,1]=4 1629 B13R1.49 COc1cc(C(C)C=O)ccc1Cl Amb33256424 [0,1,0,0,0,0|2,0,1]=4 1630 B13R1.49 COc1cc(C(C)C=O)ccc1F Amb27789092 [0,1,0,0,0,0|2,0,1]=4 1631 B13R1.49 COc1cc(C(C)C=O)ccc1O Amb27861207 [0,1,0,0,0,0|1,0,1]=3 1632 B13R1.49 COc1cc(C(C)CBr)ccc1O Amb33452250 [0,1,0,0,0,0|2,0,1]=4 1633 B13R1.49 COc1cc(C(C)CN)ccc1O Amb28291486 [0,1,0,0,0,0|2,0,1]=4 1634 B13R1.49 COc1cc(C(C)CO)ccc1C Amb25935315 [0,1,0,0,0,0|2,0,1]=4 1635 B13R1.49 COc1cc(C(C)CO)ccc1O Amb26457948 [0,1,0,0,0,0|1,0,1]=3 1636 B13R1.49 COc1cc(C(C)NO)ccc1O Amb27413729 [0,1,0,0,0,0|1,0,1]=3 1637 B13R1.49 COc1cc(C(C)ON)ccc1Br Amb33331796 [0,1,0,0,0,0|2,0,1]=4 1638 B13R1.49 COc1cc(C(C)ON)ccc1C Amb33419661 [0,1,0,0,0,0|2,0,1]=4 1639 B13R1.49 COc1cc(C(C)ON)ccc1Cl Amb33256400 [0,1,0,0,0,0|2,0,1]=4 1640 B13R1.49 COc1cc(C(C)ON)ccc1F Amb33313173 [0,1,0,0,0,0|2,0,1]=4 1641 B13R1.49 COc1cc(C(C)ON)ccc1O Amb33429364 [0,1,0,0,0,0|1,0,1]=3 1642 B13R1.49 COc1cc(C(F)CN)ccc1O Amb26575637 [0,1,0,0,0,0|2,0,1]=4 1643 B13R1.49 COc1cc(C(N)CF)ccc1O Amb24369497 [0,1,0,0,0,0|2,0,1]=4 1644 B13R1.49 COc1cc(C(N)CN)ccc1O Amb27754633 [0,1,0,0,0,0|2,0,1]=4 1645 B13R1.49 COc1cc(C(N)CO)ccc1Br Amb27856654 [0,1,0,0,0,0|2,0,1]=4 1646 B13R1.49 COc1cc(C(N)CO)ccc1C Amb26959398 [0,1,0,0,0,0|2,0,1]=4 1647 B13R1.49 COc1cc(C(N)CO)ccc1Cl Amb25080947 [0,1,0,0,0,0|2,0,1]=4 1648 B13R1.49 COc1cc(C(N)CO)ccc1F Amb24351623 [0,1,0,0,0,0|2,0,1]=4 1649 B13R1.49 COc1cc(C(N)CO)ccc1O Amb25843819 [0,1,0,0,0,0|1,0,1]=3 1650 B13R1.49 COc1cc(C(O)C#N)ccc1O Amb9237664 [0,1,0,0,0,0|1,0,1]=3 1651 B13R1.49 COc1cc(C(O)C=O)ccc1O Amb24489690 [0,1,0,0,0,0|0,0,1]=2 1652 B13R1.49 COc1cc(C(O)CBr)ccc1C Amb33335632 [0,1,0,0,0,0|2,0,1]=4 1653 B13R1.49 COc1cc(C(O)CBr)ccc1Cl Amb33335585 [0,1,0,0,0,0|2,0,1]=4 1654 B13R1.49 COc1cc(C(O)CBr)ccc1F Amb33332458 [0,1,0,0,0,0|2,0,1]=4 1655 B13R1.49 COc1cc(C(O)CBr)ccc1O Amb33429984 [0,1,0,0,0,0|1,0,1]=3 1656 B13R1.49 COc1cc(C(O)CCl)ccc1Br Amb33331793 [0,1,0,0,0,0|2,0,1]=4 1657 B13R1.49 COc1cc(C(O)CCl)ccc1Cl Amb33256427 [0,1,0,0,0,0|2,0,1]=4 1658 B13R1.49 COc1cc(C(O)CCl)ccc1F Amb33414051 [0,1,0,0,0,0|2,0,1]=4 1659 B13R1.49 COc1cc(C(O)CCl)ccc1O Amb28346672 [0,1,0,0,0,0|1,0,1]=3 1660 B13R1.49 COc1cc(C(O)CF)ccc1Br Amb33331797 [0,1,0,0,0,0|2,0,1]=4 1661 B13R1.49 COc1cc(C(O)CF)ccc1C Amb33419530 [0,1,0,0,0,0|2,0,1]=4 1662 B13R1.49 COc1cc(C(O)CF)ccc1Cl Amb33256431 [0,1,0,0,0,0|2,0,1]=4 1663 B13R1.49 COc1cc(C(O)CF)ccc1F Amb33313155 [0,1,0,0,0,0|2,0,1]=4 1664 B13R1.49 COc1cc(C(O)CF)ccc1O Amb33429336 [0,1,0,0,0,0|1,0,1]=3 1665 B13R1.49 COc1cc(C(O)CN)ccc1Br Amb27406160 [0,1,0,0,0,0|2,0,1]=4 1666 B13R1.49 COc1cc(C(O)CN)ccc1C Amb27149027 [0,1,0,0,0,0|2,0,1]=4 1667 B13R1.49 COc1cc(C(O)CN)ccc1Cl Amb24749097 [0,1,0,0,0,0|2,0,1]=4 1668 B13R1.49 COc1cc(C(O)CN)ccc1F Amb24106019 [0,1,0,0,0,0|2,0,1]=4 1669 B13R1.49 COc1cc(C(O)CN)ccc1O Amb1108645 [0,1,0,0,0,0|1,0,1]=3 1670 B13R1.49 COc1cc(C(O)CN)ccc1O Amb33527555 [0,1,0,0,0,0|1,0,1]=3 1671 B13R1.49 COc1cc(C(O)CO)ccc1Br Amb33331789 [0,1,0,0,0,0|1,0,2]=4 1672 B13R1.49 COc1cc(C(O)CO)ccc1C Amb33420878 [0,1,0,0,0,0|1,0,2]=4 1673 B13R1.49 COc1cc(C(O)CO)ccc1Cl Amb33406631 [0,1,0,0,0,0|1,0,2]=4 1674 B13R1.49 COc1cc(C(O)CO)ccc1F Amb33313156 [0,1,0,0,0,0|1,0,2]=4 1675 B13R1.49 COc1cc(C(O)CO)ccc1O Amb6600137 [0,1,0,0,0,0|0,0,2]=3 1676 B13R1.49 COc1cc(N(C)OC)ccc1N Amb28399023 [0,1,0,0,0,0|3,0,0]=4 1677 B13R1.49 COc1cc([C@@H](C)CO)ccc1C Amb24495356 [0,1,0,0,0,0|2,0,1]=4 1678 B13R1.49 COc1cc([C@@H](N)CF)ccc1O Amb27772427 [0,1,0,0,0,0|2,0,1]=4 1679 B13R1.49 COc1cc([C@@H](N)CN)ccc1O Amb28057768 [0,1,0,0,0,0|2,0,1]=4 1680 B13R1.49 COc1cc([C@@H](N)CO)ccc1Br Amb26537821 [0,1,0,0,0,0|2,0,1]=4 1681 B13R1.49 COc1cc([C@@H](N)CO)ccc1C Amb25131686 [0,1,0,0,0,0|2,0,1]=4 1682 B13R1.49 COc1cc([C@@H](N)CO)ccc1Cl Amb26935956 [0,1,0,0,0,0|2,0,1]=4 1683 B13R1.49 COc1cc([C@@H](N)CO)ccc1F Amb24346740 [0,1,0,0,0,0|2,0,1]=4 1684 B13R1.49 COc1cc([C@@H](N)CO)ccc1O Amb25843041 [0,1,0,0,0,0|1,0,1]=3 1685 B13R1.49 COc1cc([C@@H](O)CN)ccc1Br Amb33331448 [0,1,0,0,0,0|2,0,1]=4 1686 B13R1.49 COc1cc([C@@H](O)CN)ccc1C Amb33419921 [0,1,0,0,0,0|2,0,1]=4 1687 B13R1.49 COc1cc([C@@H](O)CN)ccc1Cl Amb33256246 [0,1,0,0,0,0|2,0,1]=4 1688 B13R1.49 COc1cc([C@@H](O)CN)ccc1F Amb33313185 [0,1,0,0,0,0|2,0,1]=4 1689 B13R1.49 COc1cc([C@@H](O)CN)ccc1O Amb27668665 [0,1,0,0,0,0|1,0,1]=3 1690 B13R1.49 COc1cc([C@H](C)CO)ccc1C Amb24526873 [0,1,0,0,0,0|2,0,1]=4 1691 B13R1.49 COc1cc([C@H](N)CO)ccc1Br Amb24492351 [0,1,0,0,0,0|2,0,1]=4 1692 B13R1.49 COc1cc([C@H](N)CO)ccc1C Amb26017288 [0,1,0,0,0,0|2,0,1]=4 1693 B13R1.49 COc1cc([C@H](N)CO)ccc1Cl Amb25369731 [0,1,0,0,0,0|2,0,1]=4 1694 B13R1.49 COc1cc([C@H](N)CO)ccc1F Amb26438014 [0,1,0,0,0,0|2,0,1]=4 1695 B13R1.49 COc1cc([C@H](N)CO)ccc1O Amb25817483 [0,1,0,0,0,0|1,0,1]=3 1696 B13R1.49 COc1cc([C@H](O)CN)ccc1Br Amb33331456 [0,1,0,0,0,0|2,0,1]=4 1697 B13R1.49 COc1cc([C@H](O)CN)ccc1C Amb33419920 [0,1,0,0,0,0|2,0,1]=4 1698 B13R1.49 COc1cc([C@H](O)CN)ccc1Cl Amb33413483 [0,1,0,0,0,0|2,0,1]=4 1699 B13R1.49 COc1cc([C@H](O)CN)ccc1F Amb33313182 [0,1,0,0,0,0|2,0,1]=4 1700 B13R1.49 COc1cc([C@H](O)CN)ccc1O Amb27251533 [0,1,0,0,0,0|1,0,1]=3 1701 B13R1.49 COc1cc(\C(N)=N\N)ccc1C Amb18791034 [0,1,0,0,0,0|3,0,0]=4 1702 B13R1.49 COc1cc(\C(N)=N\N)ccc1F Amb27449113 [0,1,0,0,0,0|3,0,0]=4 1703 B13R1.49 COc1cc(\C(N)=N\O)ccc1C Amb27860071 [0,1,0,0,0,0|2,0,0]=3 1704 B13R1.49 COc1cc(\C(N)=N\O)ccc1F Amb26537059 [0,1,0,0,0,0|2,0,0]=3 1705 B13R1.49 COc1cc(\C(N)=N\O)ccc1N Amb24460578 [0,1,0,0,0,0|2,0,0]=3 1706 B13R1.49 COc1cc(\C(N)=N\O)ccc1O Amb1114833 [0,1,0,0,0,0|1,0,0]=2 1707 B13R1.49 CSc1cc(C(O)CN)ccc1O Amb27983725 [0,1,0,0,0,0|1,1,1]=4 1708 B13R1.49 N#Cc1cc(C(=O)NO)ccc1Cl Amb28280730 [0,1,0,0,0,0|3,0,0]=4 1709 B13R1.49 O=C(CBr)c1ccc(O)c(CO)c1 Amb24065361 [0,1,0,0,0,0|3,0,0]=4 1710 B13R1.49 O=Cc1cc(C(=O)CBr)ccc1O Amb8394788 [0,1,0,0,0,0|3,0,0]=4 1711 B13R1.49 [C-]#[N+]c1cc(C(=O)OC)ccc1Br Amb27794926 [0,1,0,0,0,0|2,0,1]=4 1712 B13R1.49 [C-]#[N+]c1cc(C(=O)OC)ccc1C Amb2689493 [0,1,0,0,0,0|2,0,1]=4 1713 B13R1.50 COc1cc(B(F)(F)F)ccc1O Amb34913037 [0,1,0,0,0,0|3,0,0]=4 1714 B13R1.50 COc1cc(C(C)(C)C)ccc1O Amb18648396 [0,1,0,0,0,0|2,0,1]=4 1715 B13R1.50 COc1cc(C(C)(C)N)ccc1O Amb26858237 [0,1,0,0,0,0|2,0,1]=4 1716 B13R1.50 COc1cc(C(C)(C)O)ccc1Br Amb33331434 [0,1,0,0,0,0|2,0,1]=4 1717 B13R1.50 COc1cc(C(C)(C)O)ccc1C Amb25911051 [0,1,0,0,0,0|2,0,1]=4 1718 B13R1.50 COc1cc(C(C)(C)O)ccc1Cl Amb26442761 [0,1,0,0,0,0|2,0,1]=4 1719 B13R1.50 COc1cc(C(C)(C)O)ccc1F Amb27158011 [0,1,0,0,0,0|2,0,1]=4 1720 B13R1.50 COc1cc(C(C)(C)O)ccc1O Amb26634528 [0,1,0,0,0,0|1,0,1]=3 1721 B13R1.50 COc1cc(C(F)(F)F)ccc1O Amb18054281 [0,1,0,0,0,0|2,0,1]=4 1722 B13R1.50 COc1cc(P(C)(C)=O)ccc1N Amb28242903 [0,1,0,0,0,0|3,0,0]=4 1723 B13R1.50 COc1cc(S(=O)(=O)Cl)ccc1Br Amb15701599 [0,1,0,0,0,0|2,0,1]=4 1724 B13R1.50 COc1cc(S(=O)(=O)Cl)ccc1C Amb25815260 [0,1,0,0,0,0|2,0,1]=4 1725 B13R1.50 COc1cc(S(=O)(=O)Cl)ccc1Cl Amb15701593 [0,1,0,0,0,0|2,0,1]=4 1726 B13R1.50 COc1cc(S(=O)(=O)Cl)ccc1F Amb10838632 [0,1,0,0,0,0|2,0,1]=4 1727 B13R1.50 COc1cc(S(=O)(=O)Cl)ccc1O Amb19887842 [0,1,0,0,0,0|1,0,1]=3 1728 B13R1.50 COc1cc(S(=O)(=O)F)ccc1Br Amb32718303 [0,1,0,0,0,0|2,0,1]=4 1729 B13R1.50 COc1cc(S(=O)(=O)F)ccc1C Amb33076630 [0,1,0,0,0,0|2,0,1]=4 1730 B13R1.50 COc1cc(S(=O)(=O)F)ccc1Cl Amb32718454 [0,1,0,0,0,0|2,0,1]=4 1731 B13R1.50 COc1cc(S(=O)(=O)F)ccc1F Amb32717643 [0,1,0,0,0,0|2,0,1]=4 1732 B13R1.50 COc1cc(S(=O)(=O)F)ccc1N Amb33078435 [0,1,0,0,0,0|2,0,1]=4 1733 B13R1.50 COc1cc(S(=O)(=O)F)ccc1O Amb24380852 [0,1,0,0,0,0|1,0,1]=3 1734 B13R1.50 COc1cc(S(=O)(=O)O)ccc1N Amb26459744 [0,1,0,0,0,0|2,0,0]=3 1735 B13R1.50 COc1cc(S(=O)(=O)[O-])ccc1O Amb9871376 [0,1,0,0,0,0|1,0,1]=3 1736 B13R1.50 COc1cc(S(C)(=O)=O)ccc1Br Amb22504509 [0,1,0,0,0,0|2,0,1]=4 1737 B13R1.50 COc1cc(S(C)(=O)=O)ccc1N Amb22015354 [0,1,0,0,0,0|2,0,1]=4 1738 B13R1.50 COc1cc(S(C)(=O)=O)ccc1O Amb25061945 [0,1,0,0,0,0|1,0,1]=3 1739 B13R1.50 COc1cc(S(C)(=O)=O)cnc1O Amb28400115 [0,1,0,0,0,0|2,0,1]=4 1740 B13R1.50 COc1cc(S(N)(=O)=O)ccc1Br Amb13949592 [0,1,0,0,0,0|2,0,1]=4 1741 B13R1.50 COc1cc(S(N)(=O)=O)ccc1C Amb24470323 [0,1,0,0,0,0|2,0,1]=4 1742 B13R1.50 COc1cc(S(N)(=O)=O)ccc1Cl Amb13950129 [0,1,0,0,0,0|2,0,1]=4 1743 B13R1.50 COc1cc(S(N)(=O)=O)ccc1F Amb24452726 [0,1,0,0,0,0|2,0,1]=4 1744 B13R1.50 COc1cc(S(N)(=O)=O)ccc1N Amb20669468 [0,1,0,0,0,0|2,0,1]=4 1745 B13R1.50 COc1cc(S(N)(=O)=O)ccc1O Amb26919307 [0,1,0,0,0,0|1,0,1]=3 1746 B13R1.50 COc1cc([Si](C)(C)C)ccc1O Amb28074655 [0,1,0,0,0,0|2,1,0]=4 1747 B13R1.298 CC(=O)c1cc(C)c(O)c(CCl)c1 Amb27187222 [0,1,0,0,0,0|3,0,0]=4 1748 B13R1.298 CCC1=C(O)C(=O)C=C(C(=O)O)O1 Amb28076691 [0,1,0,0,0,0|2,0,0]=3 1749 B13R1.298 CCC1=CC(C(=O)O)=CN(C)C1=O Amb25065280 [0,1,0,0,0,0|2,0,1]=4 1750 B13R1.298 CCN1C=C(C(=O)O)C=C(F)C1=O Amb27407761 [0,1,0,0,0,0|2,0,1]=4 1751 B13R1.298 CCc1cc(C(=O)O)cc(C)c1O Amb27658967 [0,1,0,0,0,0|1,0,0]=2 1752 B13R1.298 CCc1cc(C(=O)O)cc(O)c1C Amb27659275 [0,1,0,0,0,0|2,0,0]=3 1753 B13R1.298 CCc1cc(C(C)=O)cc(N)c1O Amb17319971 [0,1,0,0,0,0|2,0,0]=3 1754 B13R1.298 CCc1cc([N+](=O)[O-])cc(Br)c1O Amb27179571 [0,1,0,0,0,0|2,0,1]=4 1755 B13R1.298 CCc1cc([N+](=O)[O-])cc(Cl)c1O Amb27843563 [0,1,0,0,0,0|2,0,1]=4 1756 B13R1.298 CCc1cc([N+](=O)[O-])cc(N)c1O Amb23528801 [0,1,0,0,0,0|2,0,1]=4 1757 B13R1.298 COc1cc(B(O)O)cc(C)c1F Amb27225897 [0,1,0,0,0,0|2,0,1]=4 1758 B13R1.298 COc1cc(B(O)O)cc(Cl)c1F Amb25024287 [0,1,0,0,0,0|2,0,1]=4 1759 B13R1.298 COc1cc(B(O)O)cc(Cl)c1O Amb20171175 [0,1,0,0,0,0|1,0,1]=3 1760 B13R1.298 COc1cc(B(O)O)cc(F)c1C Amb28124908 [0,1,0,0,0,0|2,0,1]=4 1761 B13R1.298 COc1cc(B(O)O)cc(F)c1Cl Amb25144472 [0,1,0,0,0,0|2,0,1]=4 1762 B13R1.298 COc1cc(B(O)O)cc(F)c1F Amb10838730 [0,1,0,0,0,0|2,0,1]=4 1763 B13R1.298 COc1cc(C(=N)N)cc(Br)c1O Amb8834116 [0,1,0,0,0,0|2,0,0]=3 1764 B13R1.298 COc1cc(C(=N)N)cc(O)c1O Amb33427866 [0,1,0,0,0,0|2,0,0]=3 1765 B13R1.298 COc1cc(C(=O)Cl)cc(C)c1C Amb26907684 [0,1,0,0,0,0|2,0,0]=3 1766 B13R1.298 COc1cc(C(=O)Cl)cc(F)c1F Amb27177291 [0,1,0,0,0,0|2,0,0]=3 1767 B13R1.298 COc1cc(C(=O)Cl)cc(I)c1I Amb27199552 [0,1,0,0,0,0|2,0,0]=3 1768 B13R1.298 COc1cc(C(=O)Cl)cc(O)c1O Amb27816732 [0,1,0,0,0,0|1,0,0]=2 1769 B13R1.298 COc1cc(C(=O)O)cc(Br)c1O Amb1104836 [0,1,0,0,0,0|0,0,0]=1 1770 B13R1.298 COc1cc(C(=O)O)cc(C)c1O Amb27984796 [0,1,0,0,0,0|0,0,0]=1 1771 B13R1.298 COc1cc(C(=O)O)cc(Cl)c1C Amb23556478 [0,1,0,0,0,0|1,0,0]=2 1772 B13R1.298 COc1cc(C(=O)O)cc(Cl)c1O Amb1218380 [0,1,0,0,0,0|0,0,0]=1 1773 B13R1.298 COc1cc(C(=O)O)cc(F)c1Br Amb27837062 [0,1,0,0,0,0|1,0,0]=2 1774 B13R1.298 COc1cc(C(=O)O)cc(F)c1F Amb8385500 [0,1,0,0,0,0|1,0,0]=2 1775 B13R1.298 COc1cc(C(=O)O)cc(F)c1O Amb26505380 [0,1,0,0,0,0|0,0,0]=1 1776 B13R1.298 COc1cc(C(=O)O)cc(F)c1S Amb27177150 [0,1,0,0,0,0|0,1,0]=2 1777 B13R1.298 COc1cc(C(=O)O)cc(I)c1O Amb6296860 [0,1,0,0,0,0|0,0,0]=1 1778 B13R1.298 COc1cc(C(=O)O)cc(N)c1Cl Amb32648097 [0,1,0,0,0,0|1,0,0]=2 1779 B13R1.298 COc1cc(C(=O)O)cc(N)c1Cl Amb32651682 [0,1,0,0,0,0|1,0,0]=2 1780 B13R1.298 COc1cc(C(=O)O)cc(N)c1N Amb31156409 [0,1,0,0,0,0|1,0,0]=2 1781 B13R1.298 COc1cc(C(=O)O)cc(N)c1O Amb20243470 [0,1,0,0,0,0|0,0,0]=1 1782 B13R1.298 COc1cc(C(=O)O)cc(N)c1O Amb24117558 [0,1,0,0,0,0|0,0,0]=1 1783 B13R1.298 COc1cc(C(=O)O)cc(O)c1C Amb22752244 [0,1,0,0,0,0|1,0,0]=2 1784 B13R1.298 COc1cc(C(=O)O)cc(O)c1O Amb6296118 [0,1,0,0,0,0|0,0,0]=1 1785 B13R1.298 COc1cc(C(=O)O)nc(C)c1Br Amb27638467 [0,1,0,0,0,0|2,0,0]=3 1786 B13R1.298 COc1cc(C(=O)O)nc(C)c1Cl Amb27795188 [0,1,0,0,0,0|2,0,0]=3 1787 B13R1.298 COc1cc(C(C)=O)cc(Br)c1O Amb26507623 [0,1,0,0,0,0|1,0,0]=2 1788 B13R1.298 COc1cc(C(C)=O)cc(C)c1C Amb24537105 [0,1,0,0,0,0|2,0,0]=3 1789 B13R1.298 COc1cc(C(C)=O)cc(C)c1N Amb27415641 [0,1,0,0,0,0|2,0,0]=3 1790 B13R1.298 COc1cc(C(C)=O)cc(Cl)c1O Amb23590097 [0,1,0,0,0,0|1,0,0]=2 1791 B13R1.298 COc1cc(C(C)=O)cc(F)c1C Amb27201500 [0,1,0,0,0,0|2,0,0]=3 1792 B13R1.298 COc1cc(C(C)=O)cc(F)c1Cl Amb28428643 [0,1,0,0,0,0|2,0,0]=3 1793 B13R1.298 COc1cc(C(C)=O)cc(I)c1O Amb23590104 [0,1,0,0,0,0|1,0,0]=2 1794 B13R1.298 COc1cc(C(C)=O)cc(N)c1O Amb17319975 [0,1,0,0,0,0|1,0,0]=2 1795 B13R1.298 COc1cc(C(C)=O)cc(O)c1O Amb25073320 [0,1,0,0,0,0|1,0,0]=2 1796 B13R1.298 COc1cc(C(C)N)cc(Br)c1O Amb25669165 [0,1,0,0,0,0|2,0,1]=4 1797 B13R1.298 COc1cc(C(C)N)cc(O)c1O Amb28434620 [0,1,0,0,0,0|2,0,1]=4 1798 B13R1.298 COc1cc(C(C)O)cc(Br)c1O Amb27811861 [0,1,0,0,0,0|1,0,1]=3 1799 B13R1.298 COc1cc(C(C)O)cc(Cl)c1F Amb27813534 [0,1,0,0,0,0|2,0,1]=4 1800 B13R1.298 COc1cc(C(C)O)cc(F)c1Cl Amb27429165 [0,1,0,0,0,0|2,0,1]=4 1801 B13R1.298 COc1cc(C(C)O)cc(F)c1F Amb27609574 [0,1,0,0,0,0|2,0,1]=4 1802 B13R1.298 COc1cc(C(F)F)cc(Cl)c1O Amb27199876 [0,1,0,0,0,0|2,0,1]=4 1803 B13R1.298 COc1cc(C(N)=O)cc(C)c1C Amb27259928 [0,1,0,0,0,0|2,0,0]=3 1804 B13R1.298 COc1cc(C(N)=O)cc(Cl)c1O Amb17509158 [0,1,0,0,0,0|1,0,0]=2 1805 B13R1.298 COc1cc(C(N)=O)cc(F)c1F Amb26905070 [0,1,0,0,0,0|2,0,0]=3 1806 B13R1.298 COc1cc(C(N)=O)cc(I)c1I Amb27438578 [0,1,0,0,0,0|2,0,0]=3 1807 B13R1.298 COc1cc(C(N)=S)cc(Br)c1O Amb1114688 [0,1,0,0,0,0|1,1,0]=3 1808 B13R1.298 COc1cc(C(N)=S)cc(Cl)c1O Amb27224712 [0,1,0,0,0,0|1,1,0]=3 1809 B13R1.298 COc1cc(C(N)=S)cc(O)c1O Amb33427867 [0,1,0,0,0,0|1,1,0]=3 1810 B13R1.298 COc1cc([C@@H](C)N)cc(Br)c1O Amb26654236 [0,1,0,0,0,0|2,0,1]=4 1811 B13R1.298 COc1cc([C@@H](C)N)cc(I)c1O Amb27948078 [0,1,0,0,0,0|2,0,1]=4 1812 B13R1.298 COc1cc([C@@H](C)N)cc(O)c1O Amb25824221 [0,1,0,0,0,0|2,0,1]=4 1813 B13R1.298 COc1cc([C@@H](C)O)cc(Br)c1O Amb25895967 [0,1,0,0,0,0|1,0,1]=3 1814 B13R1.298 COc1cc([C@@H](C)O)cc(O)c1O Amb33372700 [0,1,0,0,0,0|1,0,1]=3 1815 B13R1.298 COc1cc([C@H](C)N)cc(Br)c1O Amb25784686 [0,1,0,0,0,0|2,0,1]=4 1816 B13R1.298 COc1cc([C@H](C)N)cc(O)c1O Amb28456602 [0,1,0,0,0,0|2,0,1]=4 1817 B13R1.298 COc1cc([C@H](C)O)cc(Br)c1O Amb27780584 [0,1,0,0,0,0|1,0,1]=3 1818 B13R1.298 COc1cc([C@H](C)O)cc(O)c1O Amb33225526 [0,1,0,0,0,0|1,0,1]=3 1819 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1Br Amb19944201 [0,1,0,0,0,0|2,0,1]=4 1820 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1C Amb28246173 [0,1,0,0,0,0|2,0,1]=4 1821 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1Cl Amb19944199 [0,1,0,0,0,0|2,0,1]=4 1822 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1I Amb19944200 [0,1,0,0,0,0|2,0,1]=4 1823 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1N Amb2613549 [0,1,0,0,0,0|2,0,1]=4 1824 B13R1.298 COc1cc([N+](=O)[O-])cc(Br)c1O Amb24472474 [0,1,0,0,0,0|1,0,1]=3 1825 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1Br Amb26897150 [0,1,0,0,0,0|2,0,1]=4 1826 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1C Amb27442039 [0,1,0,0,0,0|2,0,1]=4 1827 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1Cl Amb27816653 [0,1,0,0,0,0|2,0,1]=4 1828 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1F Amb26424101 [0,1,0,0,0,0|2,0,1]=4 1829 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1N Amb24407569 [0,1,0,0,0,0|2,0,1]=4 1830 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1O Amb25068744 [0,1,0,0,0,0|1,0,1]=3 1831 B13R1.298 COc1cc([N+](=O)[O-])cc(C)c1S Amb26336700 [0,1,0,0,0,0|1,1,1]=4 1832 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1Br Amb23530593 [0,1,0,0,0,0|2,0,1]=4 1833 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1C Amb28198662 [0,1,0,0,0,0|2,0,1]=4 1834 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1Cl Amb23530594 [0,1,0,0,0,0|2,0,1]=4 1835 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1F Amb33521797 [0,1,0,0,0,0|2,0,1]=4 1836 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1I Amb23530530 [0,1,0,0,0,0|2,0,1]=4 1837 B13R1.298 COc1cc([N+](=O)[O-])cc(Cl)c1N Amb26609990 [0,1,0,0,0,0|2,0,1]=4 1838 B13R1.298 COc1cc([N+](=O)[O-])cc(F)c1Br Amb28323467 [0,1,0,0,0,0|2,0,1]=4 1839 B13R1.298 COc1cc([N+](=O)[O-])cc(F)c1C Amb27613721 [0,1,0,0,0,0|2,0,1]=4 1840 B13R1.298 COc1cc([N+](=O)[O-])cc(F)c1F Amb23412375 [0,1,0,0,0,0|2,0,1]=4 1841 B13R1.298 COc1cc([N+](=O)[O-])cc(I)c1N Amb23551789 [0,1,0,0,0,0|2,0,1]=4 1842 B13R1.298 COc1cc([N+](=O)[O-])cc(N)c1C Amb26504766 [0,1,0,0,0,0|2,0,1]=4 1843 B13R1.298 COc1cc([N+](=O)[O-])cc(N)c1N Amb26049031 [0,1,0,0,0,0|2,0,1]=4 1844 B13R1.298 COc1cc([N+](=O)[O-])cc(O)c1O Amb5718416 [0,1,0,0,0,0|1,0,1]=3 1845 B13R1.298 CSc1cc(C(=O)O)cc(Cl)c1C Amb25091707 [0,1,0,0,0,0|1,1,0]=3 1846 B13R1.298 Cc1c(Br)cc(C(=O)O)cc1C#N Amb26904336 [0,1,0,0,0,0|3,0,0]=4 1847 B13R1.298 Cc1c(Br)cc(C(=O)O)cc1C=O Amb33072934 [0,1,0,0,0,0|3,0,0]=4 1848 B13R1.298 Cc1c(I)cc(C(=O)O)cc1C#N Amb26559478 [0,1,0,0,0,0|3,0,0]=4 1849 B13R1.298 Cc1c(O)cc(C(=O)O)cc1C#N Amb27847007 [0,1,0,0,0,0|3,0,0]=4 1850 B13R1.298 Cc1c(S)cc(C(=O)O)cc1C#N Amb27846952 [0,1,0,0,0,0|3,0,0]=4 1851 B13R1.298 Cc1cc(C(=O)O)cc(C#N)c1Br Amb25804291 [0,1,0,0,0,0|3,0,0]=4 1852 B13R1.298 Cc1cc(C(=O)O)cc(C#N)c1C Amb27234023 [0,1,0,0,0,0|3,0,0]=4 1853 B13R1.298 Cc1cc(C(=O)O)cc(C#N)c1Cl Amb25194900 [0,1,0,0,0,0|3,0,0]=4 1854 B13R1.298 Cc1cc(C(=O)O)cc(C#N)c1F Amb27624818 [0,1,0,0,0,0|3,0,0]=4 1855 B13R1.298 Cc1cc(C(=O)O)cc(C#N)c1O Amb26896953 [0,1,0,0,0,0|2,0,0]=3 1856 B13R1.298 Cc1cc(C(=O)O)cc(C=O)c1O Amb25934073 [0,1,0,0,0,0|2,0,0]=3 1857 B13R1.298 Cc1cc(C(=O)O)cc(CBr)c1C Amb32679546 [0,1,0,0,0,0|3,0,0]=4 1858 B13R1.298 Cc1cc(C(=O)O)cc(CCl)c1C Amb32679534 [0,1,0,0,0,0|3,0,0]=4 1859 B13R1.298 Cc1cc(C(=O)O)cc(CN)c1C Amb32679526 [0,1,0,0,0,0|3,0,0]=4 1860 B13R1.298 Cc1cc(C(=O)O)cc(CO)c1C Amb32679553 [0,1,0,0,0,0|3,0,0]=4 1861 B13R1.298 N#Cc1cc(C(=O)O)cc(Br)c1Br Amb26897058 [0,1,0,0,0,0|3,0,0]=4 1862 B13R1.298 N#Cc1cc(C(=O)O)cc(Br)c1Cl Amb25804834 [0,1,0,0,0,0|3,0,0]=4 1863 B13R1.298 N#Cc1cc(C(=O)O)cc(Br)c1F Amb25981119 [0,1,0,0,0,0|3,0,0]=4 1864 B13R1.298 N#Cc1cc(C(=O)O)cc(Br)c1O Amb27403154 [0,1,0,0,0,0|2,0,0]=3 1865 B13R1.298 N#Cc1cc(C(=O)O)cc(Br)c1S Amb28434948 [0,1,0,0,0,0|2,1,0]=4 1866 B13R1.298 N#Cc1cc(C(=O)O)cc(Cl)c1Br Amb24367369 [0,1,0,0,0,0|3,0,0]=4 1867 B13R1.298 N#Cc1cc(C(=O)O)cc(Cl)c1I Amb27792394 [0,1,0,0,0,0|3,0,0]=4 1868 B13R1.298 N#Cc1cc(C(=O)O)cc(Cl)c1S Amb26917149 [0,1,0,0,0,0|2,1,0]=4 1869 B13R1.298 N#Cc1cc(C(=O)O)cc(F)c1Br Amb26914766 [0,1,0,0,0,0|3,0,0]=4 1870 B13R1.298 N#Cc1cc(C(=O)O)cc(F)c1Cl Amb27635441 [0,1,0,0,0,0|3,0,0]=4 1871 B13R1.298 N#Cc1cc(C(=O)O)cc(F)c1F Amb24708037 [0,1,0,0,0,0|3,0,0]=4 1872 B13R1.298 N#Cc1cc(C(=O)O)cc(F)c1I Amb28061012 [0,1,0,0,0,0|3,0,0]=4 1873 B13R1.298 N#Cc1cc(C(=O)O)cc(I)c1Br Amb24374926 [0,1,0,0,0,0|3,0,0]=4 1874 B13R1.298 N#Cc1cc(C(=O)O)cc(I)c1Cl Amb27481832 [0,1,0,0,0,0|3,0,0]=4 1875 B13R1.298 N#Cc1cc(C(=O)O)cc(O)c1F Amb27199800 [0,1,0,0,0,0|3,0,0]=4 1876 B13R1.298 N#Cc1cc(C(=O)O)cc(S)c1Cl Amb25247071 [0,1,0,0,0,0|3,0,0]=4 1877 B13R1.298 N#Cc1cc(C(=O)O)cc(S)c1O Amb27861012 [0,1,0,0,0,0|2,0,0]=3 1878 B13R1.298 NCc1cc(C(=O)O)cc(Br)c1O Amb24117607 [0,1,0,0,0,0|2,0,0]=3 1879 B13R1.298 NCc1cc(C(=O)O)cc(N)c1O Amb24117610 [0,1,0,0,0,0|2,0,0]=3 1880 B13R1.298 NCc1cc(C(=O)O)cc(O)c1O Amb24117606 [0,1,0,0,0,0|2,0,0]=3 1881 B13R1.298 O=Cc1cc(C(=O)O)cc(Br)c1O Amb33276650 [0,1,0,0,0,0|2,0,0]=3 1882 B13R1.298 O=Cc1cc(C(=O)O)cc(Cl)c1Cl Amb33072965 [0,1,0,0,0,0|3,0,0]=4 1883 B13R1.298 O=Cc1cc(C(=O)O)cc(I)c1O Amb25729791 [0,1,0,0,0,0|2,0,0]=3 1884 B13R1.298 O=Cc1cc(C(=O)O)cc(O)c1O Amb27650640 [0,1,0,0,0,0|2,0,0]=3 1885 B13R1.354 C=CCc1cc(C(=O)O)ccc1C Amb27179313 [0,1,0,0,0,0|2,0,1]=4 1886 B13R1.354 C=CCc1cc(C(=O)O)ccc1F Amb27634820 [0,1,0,0,0,0|2,0,1]=4 1887 B13R1.354 C=CCc1cc(C(=O)O)ccc1O Amb17157376 [0,1,0,0,0,0|1,0,1]=3 1888 B13R1.354 C=CCc1cc(C(C)=O)ccc1O Amb2612085 [0,1,0,0,0,0|2,0,1]=4 1889 B13R1.354 CC(=O)c1ccc(O)c(CCCl)c1 Amb19149243 [0,1,0,0,0,0|2,0,0]=3 1890 B13R1.354 CC(=O)c1ccc(O)c(CCO)c1 Amb6892146 [0,1,0,0,0,0|2,0,0]=3 1891 B13R1.354 CCCN1C=C(C(=O)O)C=CC1=O Amb18984957 [0,1,0,0,0,0|2,0,1]=4 1892 B13R1.354 CCCc1cc(B(O)O)ccc1O Amb28312832 [0,1,0,0,0,0|2,0,1]=4 1893 B13R1.354 CCCc1cc(C(=O)O)ccc1Cl Amb25129061 [0,1,0,0,0,0|2,0,0]=3 1894 B13R1.354 CCCc1cc(C(=O)O)ccc1F Amb19958807 [0,1,0,0,0,0|2,0,0]=3 1895 B13R1.354 CCCc1cc(C(=O)O)ccc1O Amb16229669 [0,1,0,0,0,0|1,0,0]=2 1896 B13R1.354 CCCc1cc(C(C)=O)ccc1C Amb28246583 [0,1,0,0,0,0|3,0,0]=4 1897 B13R1.354 CCNc1cc(C(=O)O)ccc1Cl Amb18270551 [0,1,0,0,0,0|2,0,0]=3 1898 B13R1.354 CCNc1cc(C(=O)O)ccc1N Amb25854288 [0,1,0,0,0,0|2,0,0]=3 1899 B13R1.354 CCNc1cc(C(C)=O)ccc1Cl Amb18930547 [0,1,0,0,0,0|3,0,0]=4 1900 B13R1.354 CCNc1cc(C(C)=O)ccc1F Amb18267249 [0,1,0,0,0,0|3,0,0]=4 1901 B13R1.354 CCNc1cc(C(N)=O)ccc1C Amb27188680 [0,1,0,0,0,0|3,0,0]=4 1902 B13R1.354 CCNc1cc(C(N)=O)ccc1N Amb28242073 [0,1,0,0,0,0|3,0,0]=4 1903 B13R1.354 CCNc1nc(C(=O)O)ccc1N Amb27392735 [0,1,0,0,0,0|3,0,0]=4 1904 B13R1.354 CCOc1cc(B(O)O)ccc1C Amb22490147 [0,1,0,0,0,0|2,0,1]=4 1905 B13R1.354 CCOc1cc(B(O)O)ccc1Cl Amb9766268 [0,1,0,0,0,0|2,0,1]=4 1906 B13R1.354 CCOc1cc(B(O)O)ccc1F Amb10841318 [0,1,0,0,0,0|2,0,1]=4 1907 B13R1.354 CCOc1cc(B(O)O)ccc1N Amb27259322 [0,1,0,0,0,0|2,0,1]=4 1908 B13R1.354 CCOc1cc(B(O)O)ccc1O Amb27657123 [0,1,0,0,0,0|1,0,1]=3 1909 B13R1.354 CCOc1cc(C(=N)N)ccc1O Amb8831699 [0,1,0,0,0,0|2,0,0]=3 1910 B13R1.354 CCOc1cc(C(=O)Cl)ccc1F Amb25870362 [0,1,0,0,0,0|2,0,0]=3 1911 B13R1.354 CCOc1cc(C(=O)O)ccc1Br Amb26047800 [0,1,0,0,0,0|1,0,0]=2 1912 B13R1.354 CCOc1cc(C(=O)O)ccc1C Amb17483556 [0,1,0,0,0,0|1,0,0]=2 1913 B13R1.354 CCOc1cc(C(=O)O)ccc1Cl Amb22001079 [0,1,0,0,0,0|1,0,0]=2 1914 B13R1.354 CCOc1cc(C(=O)O)ccc1F Amb26339329 [0,1,0,0,0,0|1,0,0]=2 1915 B13R1.354 CCOc1cc(C(=O)O)ccc1I Amb28344479 [0,1,0,0,0,0|1,0,0]=2 1916 B13R1.354 CCOc1cc(C(=O)O)ccc1N Amb8963108 [0,1,0,0,0,0|1,0,0]=2 1917 B13R1.354 CCOc1cc(C(=O)O)ccc1O Amb2697877 [0,1,0,0,0,0|0,0,0]=1 1918 B13R1.354 CCOc1cc(C(=O)O)ccc1S Amb27618508 [0,1,0,0,0,0|0,1,0]=2 1919 B13R1.354 CCOc1cc(C(=O)O)cnc1Cl Amb28255789 [0,1,0,0,0,0|2,0,0]=3 1920 B13R1.354 CCOc1cc(C(=O)O)ncc1Br Amb32418351 [0,1,0,0,0,0|2,0,0]=3 1921 B13R1.354 CCOc1cc(C(C)=O)ccc1Br Amb24078638 [0,1,0,0,0,0|2,0,0]=3 1922 B13R1.354 CCOc1cc(C(C)=O)ccc1C Amb27471837 [0,1,0,0,0,0|2,0,0]=3 1923 B13R1.354 CCOc1cc(C(C)=O)ccc1Cl Amb27618174 [0,1,0,0,0,0|2,0,0]=3 1924 B13R1.354 CCOc1cc(C(C)=O)ccc1F Amb28385515 [0,1,0,0,0,0|2,0,0]=3 1925 B13R1.354 CCOc1cc(C(C)=O)ccc1I Amb25079538 [0,1,0,0,0,0|2,0,0]=3 1926 B13R1.354 CCOc1cc(C(C)=O)ccc1O Amb18128637 [0,1,0,0,0,0|1,0,0]=2 1927 B13R1.354 CCOc1cc(C(C)=O)cnc1C Amb28320989 [0,1,0,0,0,0|3,0,0]=4 1928 B13R1.354 CCOc1cc(C(C)N)ccc1O Amb27233737 [0,1,0,0,0,0|2,0,1]=4 1929 B13R1.354 CCOc1cc(C(C)O)ccc1F Amb25726972 [0,1,0,0,0,0|2,0,1]=4 1930 B13R1.354 CCOc1cc(C(C)O)ccc1I Amb28455360 [0,1,0,0,0,0|2,0,1]=4 1931 B13R1.354 CCOc1cc(C(C)O)ccc1O Amb28252871 [0,1,0,0,0,0|1,0,1]=3 1932 B13R1.354 CCOc1cc(C(N)=O)ccc1Br Amb27150261 [0,1,0,0,0,0|2,0,0]=3 1933 B13R1.354 CCOc1cc(C(N)=O)ccc1Cl Amb27245451 [0,1,0,0,0,0|2,0,0]=3 1934 B13R1.354 CCOc1cc(C(N)=O)ccc1I Amb28047580 [0,1,0,0,0,0|2,0,0]=3 1935 B13R1.354 CCOc1cc(C(N)=O)ccc1N Amb22584105 [0,1,0,0,0,0|2,0,0]=3 1936 B13R1.354 CCOc1cc(C(N)=S)ccc1O Amb8834037 [0,1,0,0,0,0|1,1,0]=3 1937 B13R1.354 CCOc1cc(N(=O)=O)ccc1N Amb22396479 [0,1,0,0,0,0|2,0,1]=4 1938 B13R1.354 CCOc1cc([C@@H](C)N)ccc1O Amb27592403 [0,1,0,0,0,0|2,0,1]=4 1939 B13R1.354 CCOc1cc([C@@H](C)O)ccc1O Amb25342215 [0,1,0,0,0,0|1,0,1]=3 1940 B13R1.354 CCOc1cc([C@H](C)N)ccc1O Amb24655943 [0,1,0,0,0,0|2,0,1]=4 1941 B13R1.354 CCOc1cc([C@H](C)O)ccc1O Amb25669197 [0,1,0,0,0,0|1,0,1]=3 1942 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1Br Amb10808051 [0,1,0,0,0,0|2,0,1]=4 1943 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1C Amb26358756 [0,1,0,0,0,0|2,0,1]=4 1944 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1Cl Amb21856263 [0,1,0,0,0,0|2,0,1]=4 1945 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1F Amb21963797 [0,1,0,0,0,0|2,0,1]=4 1946 B13R1.354 CCOc1cc([N+](=O)[O-])ccc1S Amb28203575 [0,1,0,0,0,0|1,1,1]=4 1947 B13R1.354 CCOc1cc([N+](=O)[O-])cnc1O Amb27648943 [0,1,0,0,0,0|2,0,1]=4 1948 B13R1.354 CCOc1nc(C(N)=O)ccc1N Amb25300196 [0,1,0,0,0,0|3,0,0]=4 1949 B13R1.354 CCSc1cc(C(=O)O)ccc1Br Amb25786331 [0,1,0,0,0,0|1,1,0]=3 1950 B13R1.354 CCSc1cc(C(=O)O)ccc1C Amb18638225 [0,1,0,0,0,0|1,1,0]=3 1951 B13R1.354 CCSc1cc(C(=O)O)ccc1Cl Amb26471155 [0,1,0,0,0,0|1,1,0]=3 1952 B13R1.354 CCSc1cc(C(=O)O)ccc1F Amb26454627 [0,1,0,0,0,0|1,1,0]=3 1953 B13R1.354 CCSc1cc(C(=O)O)ccc1I Amb26345654 [0,1,0,0,0,0|1,1,0]=3 1954 B13R1.354 CCSc1cc(C(=O)O)ccc1N Amb27946858 [0,1,0,0,0,0|1,1,0]=3 1955 B13R1.354 CCSc1cc(C(=O)O)ccc1O Amb28241209 [0,1,0,0,0,0|0,1,0]=2 1956 B13R1.354 CCSc1cc([N+](=O)[O-])ccc1O Amb28348425 [0,1,0,0,0,0|1,1,1]=4 1957 B13R1.354 CNCc1cc([N+](=O)[O-])ccc1O Amb18294775 [0,1,0,0,0,0|2,0,1]=4 1958 B13R1.354 COCN1N=C(C(=O)O)C=CC1=O Amb27466762 [0,1,0,0,0,0|2,0,1]=4 1959 B13R1.354 COCc1cc(B(O)O)ccc1Br Amb24314121 [0,1,0,0,0,0|2,0,1]=4 1960 B13R1.354 COCc1cc(B(O)O)ccc1Cl Amb25132697 [0,1,0,0,0,0|2,0,1]=4 1961 B13R1.354 COCc1cc(B(O)O)ccc1F Amb22899906 [0,1,0,0,0,0|2,0,1]=4 1962 B13R1.354 COCc1cc(C(=O)O)ccc1F Amb18303063 [0,1,0,0,0,0|1,0,0]=2 1963 B13R1.354 COCc1cc(C(C)=O)ccc1O Amb1104394 [0,1,0,0,0,0|1,0,0]=2 1964 B13R1.354 COCc1cc(C(N)=O)ccc1F Amb27598261 [0,1,0,0,0,0|2,0,0]=3 1965 B13R1.354 COCc1cc([N+](=O)[O-])ccc1Cl Amb8860385 [0,1,0,0,0,0|2,0,1]=4 1966 B13R1.354 COCc1cc([N+](=O)[O-])ccc1N Amb18987104 [0,1,0,0,0,0|2,0,1]=4 1967 B13R1.354 COCc1cc([N+](=O)[O-])ccc1O Amb28347827 [0,1,0,0,0,0|1,0,1]=3 1968 B13R1.354 CSCc1cc(C(=O)O)ccc1F Amb19002588 [0,1,0,0,0,0|1,1,0]=3 1969 B13R1.354 CSCc1cc(C(C)=O)ccc1O Amb2728546 [0,1,0,0,0,0|1,1,0]=3 1970 B13R1.354 CSCc1cc(C(N)=O)ccc1F Amb27854448 [0,1,0,0,0,0|2,1,0]=4 1971 B13R1.354 CSSc1cc(C(=O)O)ccc1F Amb28289203 [0,1,0,0,0,0|1,1,0]=3 1972 B13R1.354 C\C=C\c1cc(C(=O)O)ccc1O Amb547735 [0,1,0,0,0,0|1,0,0]=2 1973 B13R1.354 Cc1ccc(C(=O)O)cc1CCN Amb17201640 [0,1,0,0,0,0|2,0,0]=3 1974 B13R1.354 Cc1ccc(C(=O)O)cc1NC#N Amb29870382 [0,1,0,0,0,0|2,0,1]=4 1975 B13R1.354 Cc1ccc(C(=O)O)cc1NC=O Amb18951577 [0,1,0,0,0,0|2,0,1]=4 1976 B13R1.354 Cc1ccc([N+](=O)[O-])cc1OCCl Amb24678722 [0,1,0,0,0,0|2,0,1]=4 1977 B13R1.354 N#CCc1cc(C(=O)O)ccc1Cl Amb27834315 [0,1,0,0,0,0|2,0,1]=4 1978 B13R1.354 N#CNc1cc(C(=O)O)ccc1Br Amb29870727 [0,1,0,0,0,0|2,0,1]=4 1979 B13R1.354 N#CNc1cc(C(=O)O)ccc1Cl Amb29870711 [0,1,0,0,0,0|2,0,1]=4 1980 B13R1.354 N#CNc1cc(C(=O)O)ccc1F Amb29870403 [0,1,0,0,0,0|2,0,1]=4 1981 B13R1.354 N#CNc1cc(C(=O)O)ccc1I Amb29870728 [0,1,0,0,0,0|2,0,1]=4 1982 B13R1.354 N#CNc1cc(C(=O)O)ccc1O Amb29870396 [0,1,0,0,0,0|1,0,1]=3 1983 B13R1.354 N#CSc1cc(C(=O)O)ccc1Cl Amb27830112 [0,1,0,0,0,0|1,1,1]=4 1984 B13R1.354 NCCc1cc(C(=O)O)ccc1Cl Amb27961258 [0,1,0,0,0,0|2,0,0]=3 1985 B13R1.354 NCCc1cc(C(=O)O)ccc1O Amb26519911 [0,1,0,0,0,0|1,0,0]=2 1986 B13R1.354 NCCc1cc([N+](=O)[O-])ccc1O Amb33079722 [0,1,0,0,0,0|2,0,1]=4 1987 B13R1.354 NOCc1cc(C(=O)O)ccc1F Amb27619007 [0,1,0,0,0,0|2,0,0]=3 1988 B13R1.354 NOCc1cc([N+](=O)[O-])ccc1O Amb33378863 [0,1,0,0,0,0|2,0,1]=4 1989 B13R1.354 O=C(O)C1=CN(CCO)C(=O)C=C1 Amb18972039 [0,1,0,0,0,0|2,0,1]=4 1990 B13R1.354 O=C(O)c1ccc(F)c(CNO)c1 Amb27475582 [0,1,0,0,0,0|3,0,0]=4 1991 B13R1.354 O=C(O)c1ccc(F)c(\C=C\Br)c1 Amb33135265 [0,1,0,0,0,0|2,0,1]=4 1992 B13R1.354 O=C(O)c1ccc(O)c(\C=C\Br)c1 Amb33135180 [0,1,0,0,0,0|1,0,1]=3 1993 B13R1.354 O=CNc1cc(C(=O)O)ccc1F Amb18951596 [0,1,0,0,0,0|2,0,1]=4 1994 B13R1.354 O=CNc1cc(C(=O)O)ccc1O Amb22047561 [0,1,0,0,0,0|1,0,1]=3 1995 B13R1.354 O=[N+]([O-])c1ccc(Br)c(OCCl)c1 Amb27610304 [0,1,0,0,0,0|2,0,1]=4 1996 B13R1.354 O=[N+]([O-])c1ccc(Cl)c(OCCl)c1 Amb25054392 [0,1,0,0,0,0|2,0,1]=4 1997 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCBr)c1 Amb33477217 [0,1,0,0,0,0|2,0,1]=4 1998 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCO)c1 Amb33448462 [0,1,0,0,0,0|2,0,1]=4 1999 B13R1.354 O=[N+]([O-])c1ccc(O)c(CCS)c1 Amb33379376 [0,1,0,0,0,0|2,0,1]=4 2000 B13R1.354 [N-]=[N+]=Nc1cc(C(=O)O)ccc1Cl Amb27828073 [0,1,0,0,0,0|3,0,0]=4 2001 B13R1.354 [N-]=[N+]=Nc1cc(C(=O)O)ccc1F Amb27777278 [0,1,0,0,0,0|3,0,0]=4 2002 B13R1.354 [N-]=[N+]=Nc1cc(C(=O)O)ccc1O Amb23454576 [0,1,0,0,0,0|2,0,0]=3 2003 B13R1.651 C#Cc1cc(C(=O)O)c(C)cc1C Amb27245996 [0,1,0,0,0,0|2,0,1]=4 2004 B13R1.651 CCC1=C(C)NC(=O)C(C(=O)O)=C1 Amb27233016 [0,1,0,0,0,0|3,0,0]=4 2005 B13R1.651 CCN1C=C(C(=O)O)C(=O)C=C1C Amb26044850 [0,1,0,0,0,0|3,0,0]=4 2006 B13R1.651 CCc1cc(C(=O)O)c(C)cc1C Amb29864674 [0,1,0,0,0,0|2,0,0]=3 2007 B13R1.651 CCc1cc(C(=O)O)c(N)cc1Cl Amb29864867 [0,1,0,0,0,0|2,0,0]=3 2008 B13R1.651 CCc1cc(C(=O)O)c(O)cc1N Amb28119919 [0,1,0,0,0,0|2,0,0]=3 2009 B13R1.651 CCc1cc(C(C)=N)c(O)cc1O Amb27435402 [0,1,0,0,0,0|3,0,0]=4 2010 B13R1.651 CCc1cc(C(C)=O)c(C)cc1C Amb27970165 [0,1,0,0,0,0|3,0,0]=4 2011 B13R1.651 CCc1cc(C(C)=O)c(O)cc1O Amb18128603 [0,1,0,0,0,0|2,0,0]=3 2012 B13R1.651 CNc1cc(C(=O)O)c(F)cc1F Amb18288703 [0,1,0,0,0,0|2,0,0]=3 2013 B13R1.651 CNc1cc(C(N)=O)c(Cl)cc1Cl Amb27665116 [0,1,0,0,0,0|3,0,0]=4 2014 B13R1.651 CNc1cc(C(N)=O)c(N)cc1Br Amb28388404 [0,1,0,0,0,0|3,0,0]=4 2015 B13R1.651 CNc1cc(C(N)=O)c(N)cc1F Amb18284221 [0,1,0,0,0,0|3,0,0]=4 2016 B13R1.651 COc1cc(B(O)O)c(Br)cc1Br Amb10067926 [0,1,0,0,0,0|2,0,1]=4 2017 B13R1.651 COc1cc(B(O)O)c(Br)cc1Cl Amb24314002 [0,1,0,0,0,0|2,0,1]=4 2018 B13R1.651 COc1cc(B(O)O)c(C)cc1Cl Amb24314003 [0,1,0,0,0,0|2,0,1]=4 2019 B13R1.651 COc1cc(B(O)O)c(Cl)cc1Br Amb10067918 [0,1,0,0,0,0|2,0,1]=4 2020 B13R1.651 COc1cc(B(O)O)c(Cl)cc1Cl Amb22169075 [0,1,0,0,0,0|2,0,1]=4 2021 B13R1.651 COc1cc(B(O)O)c(Cl)cc1F Amb22169386 [0,1,0,0,0,0|2,0,1]=4 2022 B13R1.651 COc1cc(B(O)O)c(F)cc1Br Amb27653418 [0,1,0,0,0,0|2,0,1]=4 2023 B13R1.651 COc1cc(B(O)O)c(F)cc1C Amb25765136 [0,1,0,0,0,0|2,0,1]=4 2024 B13R1.651 COc1cc(B(O)O)c(F)cc1Cl Amb21856461 [0,1,0,0,0,0|2,0,1]=4 2025 B13R1.651 COc1cc(B(O)O)c(F)cc1F Amb25024296 [0,1,0,0,0,0|2,0,1]=4 2026 B13R1.651 COc1cc(C(=N)N)c(Br)cc1O Amb33333283 [0,1,0,0,0,0|2,0,0]=3 2027 B13R1.651 COc1cc(C(=O)Cl)c(C)cc1C Amb26594441 [0,1,0,0,0,0|2,0,0]=3 2028 B13R1.651 COc1cc(C(=O)O)c(Br)cc1Br Amb26069380 [0,1,0,0,0,0|1,0,0]=2 2029 B13R1.651 COc1cc(C(=O)O)c(Br)cc1C Amb21926745 [0,1,0,0,0,0|1,0,0]=2 2030 B13R1.651 COc1cc(C(=O)O)c(Br)cc1Cl Amb26905350 [0,1,0,0,0,0|1,0,0]=2 2031 B13R1.651 COc1cc(C(=O)O)c(Br)cc1F Amb22274238 [0,1,0,0,0,0|1,0,0]=2 2032 B13R1.651 COc1cc(C(=O)O)c(Br)cc1O Amb23541425 [0,1,0,0,0,0|0,0,0]=1 2033 B13R1.651 COc1cc(C(=O)O)c(C)cc1C Amb27426542 [0,1,0,0,0,0|1,0,0]=2 2034 B13R1.651 COc1cc(C(=O)O)c(C)cc1F Amb27610127 [0,1,0,0,0,0|1,0,0]=2 2035 B13R1.651 COc1cc(C(=O)O)c(C)nc1Cl Amb25342210 [0,1,0,0,0,0|2,0,0]=3 2036 B13R1.651 COc1cc(C(=O)O)c(Cl)cc1N Amb24490281 [0,1,0,0,0,0|1,0,0]=2 2037 B13R1.651 COc1cc(C(=O)O)c(Cl)cc1O Amb25809059 [0,1,0,0,0,0|0,0,0]=1 2038 B13R1.651 COc1cc(C(=O)O)c(F)cc1Br Amb25037035 [0,1,0,0,0,0|1,0,0]=2 2039 B13R1.651 COc1cc(C(=O)O)c(F)cc1C Amb22232693 [0,1,0,0,0,0|1,0,0]=2 2040 B13R1.651 COc1cc(C(=O)O)c(F)cc1Cl Amb22751492 [0,1,0,0,0,0|1,0,0]=2 2041 B13R1.651 COc1cc(C(=O)O)c(F)cc1F Amb27633399 [0,1,0,0,0,0|1,0,0]=2 2042 B13R1.651 COc1cc(C(=O)O)c(F)cc1N Amb21864888 [0,1,0,0,0,0|1,0,0]=2 2043 B13R1.651 COc1cc(C(=O)O)c(N)cc1Br Amb26459936 [0,1,0,0,0,0|1,0,0]=2 2044 B13R1.651 COc1cc(C(=O)O)c(N)cc1C Amb27812406 [0,1,0,0,0,0|1,0,0]=2 2045 B13R1.651 COc1cc(C(=O)O)c(N)cc1Cl Amb26057402 [0,1,0,0,0,0|1,0,0]=2 2046 B13R1.651 COc1cc(C(=O)O)c(N)cc1F Amb18957865 [0,1,0,0,0,0|1,0,0]=2 2047 B13R1.651 COc1cc(C(=O)O)c(N)cc1O Amb28991388 [0,1,0,0,0,0|0,0,0]=1 2048 B13R1.651 COc1cc(C(=O)O)c(O)cc1C Amb22752245 [0,1,0,0,0,0|1,0,0]=2 2049 B13R1.651 COc1cc(C(=O)O)c(O)cc1O Amb24355300 [0,1,0,0,0,0|0,0,0]=1 2050 B13R1.651 COc1cc(C(C)=O)c(Br)cc1O Amb33333320 [0,1,0,0,0,0|1,0,0]=2 2051 B13R1.651 COc1cc(C(C)=O)c(C)cc1N Amb25371952 [0,1,0,0,0,0|2,0,0]=3 2052 B13R1.651 COc1cc(C(C)=O)c(C)cc1O Amb25713545 [0,1,0,0,0,0|1,0,0]=2 2053 B13R1.651 COc1cc(C(C)=O)c(C)cc1S Amb26882368 [0,1,0,0,0,0|1,1,0]=3 2054 B13R1.651 COc1cc(C(C)=O)c(F)cc1Cl Amb26915333 [0,1,0,0,0,0|2,0,0]=3 2055 B13R1.651 COc1cc(C(C)=O)c(F)cc1O Amb10839985 [0,1,0,0,0,0|1,0,0]=2 2056 B13R1.651 COc1cc(C(C)=O)c(I)cc1I Amb28287790 [0,1,0,0,0,0|2,0,0]=3 2057 B13R1.651 COc1cc(C(C)=O)c(N)cc1Br Amb32687601 [0,1,0,0,0,0|2,0,0]=3 2058 B13R1.651 COc1cc(C(C)=O)c(N)cc1Cl Amb24358057 [0,1,0,0,0,0|2,0,0]=3 2059 B13R1.651 COc1cc(C(C)=O)c(N)cc1F Amb22274590 [0,1,0,0,0,0|2,0,0]=3 2060 B13R1.651 COc1cc(C(C)=O)c(O)cc1C Amb2697941 [0,1,0,0,0,0|2,0,0]=3 2061 B13R1.651 COc1cc(C(C)=O)c(O)cc1O Amb22055148 [0,1,0,0,0,0|1,0,0]=2 2062 B13R1.651 COc1cc(C(C)=O)c(S)cc1C Amb25343878 [0,1,0,0,0,0|2,0,0]=3 2063 B13R1.651 COc1cc(C(C)C)c(Br)cc1O Amb27603324 [0,1,0,0,0,0|2,0,1]=4 2064 B13R1.651 COc1cc(C(C)Cl)c(F)cc1O Amb27793757 [0,1,0,0,0,0|2,0,1]=4 2065 B13R1.651 COc1cc(C(C)N)c(Br)cc1O Amb25897684 [0,1,0,0,0,0|2,0,1]=4 2066 B13R1.651 COc1cc(C(C)O)c(O)cc1F Amb27872721 [0,1,0,0,0,0|2,0,1]=4 2067 B13R1.651 COc1cc(C(N)=O)c(C)cc1C Amb25234270 [0,1,0,0,0,0|2,0,0]=3 2068 B13R1.651 COc1cc(C(N)=O)c(F)cc1O Amb27872734 [0,1,0,0,0,0|1,0,0]=2 2069 B13R1.651 COc1cc(C(N)=O)c(I)cc1I Amb27613646 [0,1,0,0,0,0|2,0,0]=3 2070 B13R1.651 COc1cc(C(N)=O)c(N)cc1Cl Amb28064131 [0,1,0,0,0,0|2,0,0]=3 2071 B13R1.651 COc1cc(C(N)=S)c(Br)cc1O Amb33333285 [0,1,0,0,0,0|1,1,0]=3 2072 B13R1.651 COc1cc([C@@H](C)N)c(Br)cc1O Amb25773230 [0,1,0,0,0,0|2,0,1]=4 2073 B13R1.651 COc1cc([C@@H](C)N)c(C)cc1O Amb27780754 [0,1,0,0,0,0|2,0,1]=4 2074 B13R1.651 COc1cc([C@@H](C)O)c(Br)cc1O Amb33333352 [0,1,0,0,0,0|1,0,1]=3 2075 B13R1.651 COc1cc([C@H](C)N)c(Br)cc1O Amb25866742 [0,1,0,0,0,0|2,0,1]=4 2076 B13R1.651 COc1cc([C@H](C)N)c(C)cc1O Amb27595582 [0,1,0,0,0,0|2,0,1]=4 2077 B13R1.651 COc1cc([C@H](C)N)c(Cl)cc1O Amb28119255 [0,1,0,0,0,0|2,0,1]=4 2078 B13R1.651 COc1cc([C@H](C)N)c(F)cc1O Amb27831945 [0,1,0,0,0,0|2,0,1]=4 2079 B13R1.651 COc1cc([C@H](C)O)c(Br)cc1O Amb33333354 [0,1,0,0,0,0|1,0,1]=3 2080 B13R1.651 COc1cc([N+](=O)[O-])c(Br)cc1Br Amb10604341 [0,1,0,0,0,0|2,0,1]=4 2081 B13R1.651 COc1cc([N+](=O)[O-])c(Br)cc1F Amb19958698 [0,1,0,0,0,0|2,0,1]=4 2082 B13R1.651 COc1cc([N+](=O)[O-])c(Br)cc1N Amb27868068 [0,1,0,0,0,0|2,0,1]=4 2083 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1Br Amb25037162 [0,1,0,0,0,0|2,0,1]=4 2084 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1C Amb28293039 [0,1,0,0,0,0|2,0,1]=4 2085 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1Cl Amb22234748 [0,1,0,0,0,0|2,0,1]=4 2086 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1F Amb22739269 [0,1,0,0,0,0|2,0,1]=4 2087 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1N Amb22641911 [0,1,0,0,0,0|2,0,1]=4 2088 B13R1.651 COc1cc([N+](=O)[O-])c(C)cc1S Amb28205989 [0,1,0,0,0,0|1,1,1]=4 2089 B13R1.651 COc1cc([N+](=O)[O-])c(Cl)cc1Br Amb27856340 [0,1,0,0,0,0|2,0,1]=4 2090 B13R1.651 COc1cc([N+](=O)[O-])c(Cl)cc1C Amb25204501 [0,1,0,0,0,0|2,0,1]=4 2091 B13R1.651 COc1cc([N+](=O)[O-])c(Cl)cc1Cl Amb22232687 [0,1,0,0,0,0|2,0,1]=4 2092 B13R1.651 COc1cc([N+](=O)[O-])c(Cl)cc1F Amb25265321 [0,1,0,0,0,0|2,0,1]=4 2093 B13R1.651 COc1cc([N+](=O)[O-])c(Cl)cc1N Amb14801 [0,1,0,0,0,0|2,0,1]=4 2094 B13R1.651 COc1cc([N+](=O)[O-])c(F)cc1Br Amb22739235 [0,1,0,0,0,0|2,0,1]=4 2095 B13R1.651 COc1cc([N+](=O)[O-])c(F)cc1C Amb22735464 [0,1,0,0,0,0|2,0,1]=4 2096 B13R1.651 COc1cc([N+](=O)[O-])c(F)cc1Cl Amb3428086 [0,1,0,0,0,0|2,0,1]=4 2097 B13R1.651 COc1cc([N+](=O)[O-])c(F)cc1F Amb2608743 [0,1,0,0,0,0|2,0,1]=4 2098 B13R1.651 COc1cc([N+](=O)[O-])c(F)cc1N Amb22898857 [0,1,0,0,0,0|2,0,1]=4 2099 B13R1.651 COc1cc([N+](=O)[O-])c(N)cc1Br Amb4010693 [0,1,0,0,0,0|2,0,1]=4 2100 B13R1.651 COc1cc([N+](=O)[O-])c(N)cc1C Amb20171489 [0,1,0,0,0,0|2,0,1]=4 2101 B13R1.651 COc1cc([N+](=O)[O-])c(N)cc1Cl Amb15695320 [0,1,0,0,0,0|2,0,1]=4 2102 B13R1.651 COc1cc([N+](=O)[O-])c(N)cc1F Amb22232688 [0,1,0,0,0,0|2,0,1]=4 2103 B13R1.651 COc1cc([N+](=O)[O-])c(O)cc1Br Amb22737625 [0,1,0,0,0,0|2,0,1]=4 2104 B13R1.651 COc1cc([N+](=O)[O-])c(O)cc1Cl Amb25983916 [0,1,0,0,0,0|2,0,1]=4 2105 B13R1.651 COc1cc([N+](=O)[O-])c(S)cc1F Amb25256065 [0,1,0,0,0,0|2,0,1]=4 2106 B13R1.651 COc1nc(C(=O)O)c(C)cc1Br Amb27967664 [0,1,0,0,0,0|2,0,0]=3 2107 B13R1.651 COc1nc(C(=O)O)c(Cl)cc1C Amb27647568 [0,1,0,0,0,0|2,0,0]=3 2108 B13R1.651 COc1nc(C(C)=O)c(Cl)cc1F Amb28135990 [0,1,0,0,0,0|3,0,0]=4 2109 B13R1.651 COc1nc(C(N)=O)c(F)cc1C Amb25378808 [0,1,0,0,0,0|3,0,0]=4 2110 B13R1.651 COc1nc(C(N)=O)c(N)cc1C Amb26505856 [0,1,0,0,0,0|3,0,0]=4 2111 B13R1.651 CSc1cc(C(=O)O)c(Cl)cc1C Amb27427076 [0,1,0,0,0,0|1,1,0]=3 2112 B13R1.651 CSc1cc(C(=O)O)c(Cl)cc1Cl Amb20668850 [0,1,0,0,0,0|1,1,0]=3 2113 B13R1.651 CSc1cc(C(=O)O)c(Cl)cc1N Amb27436206 [0,1,0,0,0,0|1,1,0]=3 2114 B13R1.651 CSc1cc(C(=O)O)c(Cl)cc1O Amb27146738 [0,1,0,0,0,0|0,1,0]=2 2115 B13R1.651 CSc1cc(C(=O)O)c(F)cc1F Amb24682187 [0,1,0,0,0,0|1,1,0]=3 2116 B13R1.651 CSc1cc(C(=O)O)c(F)cc1I Amb25342117 [0,1,0,0,0,0|1,1,0]=3 2117 B13R1.651 CSc1cc(C(=O)O)c(F)cc1O Amb26622442 [0,1,0,0,0,0|0,1,0]=2 2118 B13R1.651 CSc1cc(C(=O)O)c(N)cc1F Amb18957868 [0,1,0,0,0,0|1,1,0]=3 2119 B13R1.651 CSc1cc(C(=O)O)c(O)cc1C Amb27179321 [0,1,0,0,0,0|1,1,0]=3 2120 B13R1.651 CSc1cc(C(C)=O)c(N)cc1Cl Amb18657899 [0,1,0,0,0,0|2,1,0]=4 2121 B13R1.651 CSc1cc(C(N)=O)c(Cl)cc1Cl Amb27599208 [0,1,0,0,0,0|2,1,0]=4 2122 B13R1.651 CSc1cc(C(N)=O)c(N)cc1F Amb18957869 [0,1,0,0,0,0|2,1,0]=4 2123 B13R1.651 Cc1cc(Br)c(C#N)cc1C(=O)O Amb28186644 [0,1,0,0,0,0|3,0,0]=4 2124 B13R1.651 Cc1cc(Br)c(C(=O)O)cc1C#N Amb27486994 [0,1,0,0,0,0|3,0,0]=4 2125 B13R1.651 Cc1cc(Br)c(C(=O)O)cc1NN Amb28314729 [0,1,0,0,0,0|3,0,0]=4 2126 B13R1.651 Cc1cc(C)c(C(=O)O)cc1C#N Amb27637565 [0,1,0,0,0,0|3,0,0]=4 2127 B13R1.651 Cc1cc(C)c(C(=O)O)cc1C=O Amb26567272 [0,1,0,0,0,0|3,0,0]=4 2128 B13R1.651 Cc1cc(C)c(C(=O)O)cc1CN Amb28384617 [0,1,0,0,0,0|3,0,0]=4 2129 B13R1.651 Cc1cc(C)c(C(=O)O)cc1CO Amb28396563 [0,1,0,0,0,0|3,0,0]=4 2130 B13R1.651 Cc1cc(Cl)c(C#N)cc1C(=O)O Amb27429081 [0,1,0,0,0,0|3,0,0]=4 2131 B13R1.651 Cc1cc(Cl)c(C(=O)O)cc1C#N Amb28246008 [0,1,0,0,0,0|3,0,0]=4 2132 B13R1.651 Cc1cc(F)c(C(=O)O)cc1C#N Amb25920201 [0,1,0,0,0,0|3,0,0]=4 2133 B13R1.651 Cc1cc(I)c(C#N)cc1C(=O)O Amb28284439 [0,1,0,0,0,0|3,0,0]=4 2134 B13R1.651 Cc1cc(O)c(C#N)cc1C(=O)O Amb28196018 [0,1,0,0,0,0|2,0,0]=3 2135 B13R1.651 Cc1cc(O)c(C(=O)O)cc1C#N Amb4450532 [0,1,0,0,0,0|3,0,0]=4 2136 B13R1.651 Cc1cc(S)c(C#N)cc1C(=O)O Amb27202108 [0,1,0,0,0,0|2,1,0]=4 2137 B13R1.651 Cc1cc(S)c(C(=O)O)cc1C#N Amb25212740 [0,1,0,0,0,0|3,0,0]=4 2138 B13R1.651 N#Cc1cc(C(=O)O)c(Br)cc1Cl Amb26423879 [0,1,0,0,0,0|3,0,0]=4 2139 B13R1.651 N#Cc1cc(C(=O)O)c(Br)cc1F Amb28186565 [0,1,0,0,0,0|3,0,0]=4 2140 B13R1.651 N#Cc1cc(C(=O)O)c(Br)cc1I Amb24443946 [0,1,0,0,0,0|3,0,0]=4 2141 B13R1.651 N#Cc1cc(C(=O)O)c(Br)cc1O Amb28240541 [0,1,0,0,0,0|2,0,0]=3 2142 B13R1.651 N#Cc1cc(C(=O)O)c(Br)cc1S Amb28251505 [0,1,0,0,0,0|2,1,0]=4 2143 B13R1.651 N#Cc1cc(C(=O)O)c(Cl)cc1Br Amb27462270 [0,1,0,0,0,0|3,0,0]=4 2144 B13R1.651 N#Cc1cc(C(=O)O)c(Cl)cc1Cl Amb28132840 [0,1,0,0,0,0|3,0,0]=4 2145 B13R1.651 N#Cc1cc(C(=O)O)c(Cl)cc1I Amb28284247 [0,1,0,0,0,0|3,0,0]=4 2146 B13R1.651 N#Cc1cc(C(=O)O)c(Cl)cc1O Amb27441466 [0,1,0,0,0,0|2,0,0]=3 2147 B13R1.651 N#Cc1cc(C(=O)O)c(Cl)cc1S Amb25996736 [0,1,0,0,0,0|2,1,0]=4 2148 B13R1.651 N#Cc1cc(C(=O)O)c(F)cc1Br Amb28251680 [0,1,0,0,0,0|3,0,0]=4 2149 B13R1.651 N#Cc1cc(C(=O)O)c(F)cc1F Amb28243683 [0,1,0,0,0,0|3,0,0]=4 2150 B13R1.651 N#Cc1cc(C(=O)O)c(I)cc1Br Amb24375517 [0,1,0,0,0,0|3,0,0]=4 2151 B13R1.651 N#Cc1cc(C(=O)O)c(I)cc1Cl Amb28060926 [0,1,0,0,0,0|3,0,0]=4 2152 B13R1.651 N#Cc1cc(C(=O)O)c(N)cc1N Amb27237977 [0,1,0,0,0,0|3,0,0]=4 2153 B13R1.651 N#Cc1cc(C(=O)O)c(O)cc1Br Amb18135372 [0,1,0,0,0,0|3,0,0]=4 2154 B13R1.651 N#Cc1cc(C(=O)O)c(O)cc1F Amb28284684 [0,1,0,0,0,0|3,0,0]=4 2155 B13R1.651 N#Cc1cc(C(=O)O)c(O)cc1N Amb18128047 [0,1,0,0,0,0|3,0,0]=4 2156 B13R1.651 N#Cc1cc(C(=O)O)c(O)cc1O Amb27199439 [0,1,0,0,0,0|2,0,0]=3 2157 B13R1.651 N#Cc1cc(C(=O)O)c(S)cc1Cl Amb27623354 [0,1,0,0,0,0|3,0,0]=4 2158 B13R1.651 O=C(O)c1cc(CCl)c(F)cc1F Amb26855479 [0,1,0,0,0,0|3,0,0]=4 2159 B13R1.651 O=Cc1cc(C(=O)O)c(Br)cc1F Amb33072967 [0,1,0,0,0,0|3,0,0]=4 2160 B13R1.651 O=Cc1cc(C(=O)O)c(Cl)cc1Cl Amb25948465 [0,1,0,0,0,0|3,0,0]=4 2161 B13R1.651 O=Cc1cc(C(=O)O)c(Cl)cc1O Amb28245923 [0,1,0,0,0,0|2,0,0]=3 2162 B13R1.651 O=Cc1cc(C(=O)O)c(F)cc1F Amb20248099 [0,1,0,0,0,0|3,0,0]=4 2163 B13R1.3091 C#Cc1cc(C(=O)O)ccc1CC Amb30982099 [0,1,0,0,0,0|2,0,1]=4 2164 B13R1.3091 C#Cc1cc(C(=O)O)ccc1OC Amb28396632 [0,1,0,0,0,0|1,0,1]=3 2165 B13R1.3091 C#Cc1ccc(C(=O)O)cc1OC Amb25675764 [0,1,0,0,0,0|1,0,0]=2 2166 B13R1.3091 C#Cc1ccc([N+](=O)[O-])cc1OC Amb10975285 [0,1,0,0,0,0|2,0,1]=4 2167 B13R1.3091 C=C(C)c1ccc(OC)c(OC)c1 Amb22171578 [0,1,0,0,0,0|2,0,0]=3 2168 B13R1.3091 C=Cc1cc(C(C)=O)ccc1CO Amb27394852 [0,1,0,0,0,0|2,0,1]=4 2169 B13R1.3091 C=Cc1ccc([N+](=O)[O-])cc1OC Amb32879363 [0,1,0,0,0,0|2,0,1]=4 2170 B13R1.3091 CCc1cc(B(O)O)ccc1CO Amb34911644 [0,1,0,0,0,0|2,0,1]=4 2171 B13R1.3091 CCc1cc(B(O)O)ccc1OC Amb28324262 [0,1,0,0,0,0|2,0,1]=4 2172 B13R1.3091 CCc1cc(C(=N)N)ccc1OC Amb18243726 [0,1,0,0,0,0|3,0,0]=4 2173 B13R1.3091 CCc1cc(C(=O)O)ccc1C#N Amb25765792 [0,1,0,0,0,0|2,0,0]=3 2174 B13R1.3091 CCc1cc(C(=O)O)ccc1C=O Amb27985008 [0,1,0,0,0,0|1,0,1]=3 2175 B13R1.3091 CCc1cc(C(=O)O)ccc1CBr Amb27405765 [0,1,0,0,0,0|2,0,0]=3 2176 B13R1.3091 CCc1cc(C(=O)O)ccc1CCl Amb26572560 [0,1,0,0,0,0|2,0,0]=3 2177 B13R1.3091 CCc1cc(C(=O)O)ccc1CF Amb25682507 [0,1,0,0,0,0|2,0,0]=3 2178 B13R1.3091 CCc1cc(C(=O)O)ccc1CI Amb25307996 [0,1,0,0,0,0|2,0,0]=3 2179 B13R1.3091 CCc1cc(C(=O)O)ccc1CN Amb25827418 [0,1,0,0,0,0|2,0,0]=3 2180 B13R1.3091 CCc1cc(C(=O)O)ccc1CO Amb26520352 [0,1,0,0,0,0|1,0,0]=2 2181 B13R1.3091 CCc1cc(C(=O)O)ccc1OC Amb17203904 [0,1,0,0,0,0|1,0,0]=2 2182 B13R1.3091 CCc1cc(C(C)=O)ccc1CO Amb27658786 [0,1,0,0,0,0|2,0,0]=3 2183 B13R1.3091 CCc1cc(C(C)O)ccc1OC Amb25135175 [0,1,0,0,0,0|2,0,1]=4 2184 B13R1.3091 CCc1cc(C(N)=O)ccc1OC Amb18243755 [0,1,0,0,0,0|2,0,0]=3 2185 B13R1.3091 CCc1cc(C(N)=S)ccc1OC Amb18244071 [0,1,0,0,0,0|2,1,0]=4 2186 B13R1.3091 CCc1cc(S(=O)O)ccc1OC Amb18225035 [0,1,0,0,0,0|2,0,0]=3 2187 B13R1.3091 CCc1cc([N+](=O)[O-])ccc1OC Amb18243802 [0,1,0,0,0,0|2,0,1]=4 2188 B13R1.3091 CCc1ccc(B(O)O)cc1OC Amb26461067 [0,1,0,0,0,0|2,0,1]=4 2189 B13R1.3091 CCc1ccc(C(=O)Cl)cc1OC Amb27808176 [0,1,0,0,0,0|2,0,0]=3 2190 B13R1.3091 CCc1ccc(C(=O)O)cc1C#N Amb20668457 [0,1,0,0,0,0|3,0,0]=4 2191 B13R1.3091 CCc1ccc(C(=O)O)cc1C=O Amb28342300 [0,1,0,0,0,0|3,0,0]=4 2192 B13R1.3091 CCc1ccc(C(=O)O)cc1CC Amb22059708 [0,1,0,0,0,0|2,0,0]=3 2193 B13R1.3091 CCc1ccc(C(=O)O)cc1NN Amb27633728 [0,1,0,0,0,0|3,0,0]=4 2194 B13R1.3091 CCc1ccc(C(C)=O)cc1CC Amb25195757 [0,1,0,0,0,0|3,0,0]=4 2195 B13R1.3091 CCc1ccc([N+](=O)[O-])cc1OC Amb27391070 [0,1,0,0,0,0|2,0,1]=4 2196 B13R1.3091 CCc1ncc(C(=O)O)cc1OC Amb27847526 [0,1,0,0,0,0|2,0,0]=3 2197 B13R1.3091 CNc1cc(C(=O)O)ccc1C#N Amb27490039 [0,1,0,0,0,0|2,0,0]=3 2198 B13R1.3091 CNc1ccc(C(=O)O)cc1OC Amb27477785 [0,1,0,0,0,0|1,0,0]=2 2199 B13R1.3091 CNc1ccc([N+](=O)[O-])cc1OC Amb18303198 [0,1,0,0,0,0|2,0,1]=4 2200 B13R1.3091 COc1cc(B(O)O)ccc1C#N Amb21856905 [0,1,0,0,0,0|2,0,1]=4 2201 B13R1.3091 COc1cc(B(O)O)ccc1C=O Amb21856209 [0,1,0,0,0,0|1,0,2]=4 2202 B13R1.3091 COc1cc(B(O)O)ccc1NN Amb27423616 [0,1,0,0,0,0|2,0,1]=4 2203 B13R1.3091 COc1cc(B(O)O)cnc1OC Amb27974508 [0,1,0,0,0,0|2,0,1]=4 2204 B13R1.3091 COc1cc(C(=O)O)ccc1C#N Amb22898894 [0,1,0,0,0,0|1,0,0]=2 2205 B13R1.3091 COc1cc(C(=O)O)ccc1C=O Amb25684775 [0,1,0,0,0,0|0,0,1]=2 2206 B13R1.3091 COc1cc(C(=O)O)ccc1CBr Amb8628452 [0,1,0,0,0,0|1,0,0]=2 2207 B13R1.3091 COc1cc(C(=O)O)ccc1CCl Amb25085293 [0,1,0,0,0,0|1,0,0]=2 2208 B13R1.3091 COc1cc(C(=O)O)ccc1CF Amb27169221 [0,1,0,0,0,0|1,0,0]=2 2209 B13R1.3091 COc1cc(C(=O)O)ccc1CI Amb24598172 [0,1,0,0,0,0|1,0,0]=2 2210 B13R1.3091 COc1cc(C(=O)O)ccc1CN Amb21984597 [0,1,0,0,0,0|1,0,0]=2 2211 B13R1.3091 COc1cc(C(=O)O)ccc1CN Amb8385699 [0,1,0,0,0,0|1,0,0]=2 2212 B13R1.3091 COc1cc(C(=O)O)ccc1CO Amb21984596 [0,1,0,0,0,0|0,0,0]=1 2213 B13R1.3091 COc1cc(C(=O)O)ccc1NN Amb27247859 [0,1,0,0,0,0|1,0,0]=2 2214 B13R1.3091 COc1cc(C(=O)O)cnc1OC Amb13889888 [0,1,0,0,0,0|1,0,0]=2 2215 B13R1.3091 COc1cc(C(=O)O)ncc1C#N Amb25312299 [0,1,0,0,0,0|2,0,0]=3 2216 B13R1.3091 COc1cc(C(C)=O)ccc1C#N Amb25262714 [0,1,0,0,0,0|2,0,0]=3 2217 B13R1.3091 COc1cc(C(C)=O)ccc1SC Amb13951675 [0,1,0,0,0,0|1,1,0]=3 2218 B13R1.3091 COc1cc(C(C)C)ccc1CO Amb18224686 [0,1,0,0,0,0|2,0,1]=4 2219 B13R1.3091 COc1cc(C(C)N)ccc1CO Amb27171211 [0,1,0,0,0,0|2,0,1]=4 2220 B13R1.3091 COc1cc(C(N)=O)ccc1C#N Amb26425661 [0,1,0,0,0,0|2,0,0]=3 2221 B13R1.3091 COc1cc(N(=O)=O)ccc1C=O Amb20621513 [0,1,0,0,0,0|1,0,2]=4 2222 B13R1.3091 COc1cc(N(C)C)ccc1CO Amb27882633 [0,1,0,0,0,0|3,0,0]=4 2223 B13R1.3091 COc1cc([N+](=O)[O-])ccc1C#N Amb10808066 [0,1,0,0,0,0|2,0,1]=4 2224 B13R1.3091 COc1cc([N+](=O)[O-])ccc1C=O Amb10576466 [0,1,0,0,0,0|1,0,2]=4 2225 B13R1.3091 COc1cc([N+](=O)[O-])ccc1CBr Amb23399818 [0,1,0,0,0,0|2,0,1]=4 2226 B13R1.3091 COc1cc([N+](=O)[O-])ccc1CCl Amb23401144 [0,1,0,0,0,0|2,0,1]=4 2227 B13R1.3091 COc1cc([N+](=O)[O-])ccc1CN Amb26017293 [0,1,0,0,0,0|2,0,1]=4 2228 B13R1.3091 COc1cc([N+](=O)[O-])ccc1CO Amb22228868 [0,1,0,0,0,0|1,0,1]=3 2229 B13R1.3091 COc1cc([N+](=O)[O-])ccc1CS Amb32878746 [0,1,0,0,0,0|1,1,1]=4 2230 B13R1.3091 COc1cc([N+](=O)[O-])ccc1NN Amb33551549 [0,1,0,0,0,0|2,0,1]=4 2231 B13R1.3091 COc1cc([N+](=O)[O-])ccc1NN Amb8964354 [0,1,0,0,0,0|2,0,1]=4 2232 B13R1.3091 COc1cc([N+](=O)[O-])ccc1SC Amb23440832 [0,1,0,0,0,0|1,1,1]=4 2233 B13R1.3091 COc1cc([N+](=O)[O-])cnc1OC Amb10552791 [0,1,0,0,0,0|2,0,1]=4 2234 B13R1.3091 COc1ccc(B(O)O)cc1OC Amb2447136 [0,1,0,0,0,0|1,0,1]=3 2235 B13R1.3091 COc1ccc(B(O)O)cc1SC Amb24712394 [0,1,0,0,0,0|1,1,1]=4 2236 B13R1.3091 COc1ccc(C(=N)N)cc1OC Amb2695846 [0,1,0,0,0,0|2,0,0]=3 2237 B13R1.3091 COc1ccc(C(=N)N)cc1OC Amb2699598 [0,1,0,0,0,0|2,0,0]=3 2238 B13R1.3091 COc1ccc(C(=O)Cl)cc1OC Amb535053 [0,1,0,0,0,0|1,0,0]=2 2239 B13R1.3091 COc1ccc(C(=O)O)cc1C#N Amb17201731 [0,1,0,0,0,0|2,0,0]=3 2240 B13R1.3091 COc1ccc(C(=O)O)cc1C=O Amb24329414 [0,1,0,0,0,0|2,0,0]=3 2241 B13R1.3091 COc1ccc(C(=O)O)cc1CBr Amb25676434 [0,1,0,0,0,0|2,0,0]=3 2242 B13R1.3091 COc1ccc(C(=O)O)cc1CCl Amb25224908 [0,1,0,0,0,0|2,0,0]=3 2243 B13R1.3091 COc1ccc(C(=O)O)cc1CF Amb27481732 [0,1,0,0,0,0|2,0,0]=3 2244 B13R1.3091 COc1ccc(C(=O)O)cc1CN Amb23559373 [0,1,0,0,0,0|2,0,0]=3 2245 B13R1.3091 COc1ccc(C(=O)O)cc1CN Amb24117603 [0,1,0,0,0,0|2,0,0]=3 2246 B13R1.3091 COc1ccc(C(=O)O)cc1OC Amb530403 [0,1,0,0,0,0|0,0,0]=1 2247 B13R1.3091 COc1ccc(C(=O)O)cc1SC Amb26032208 [0,1,0,0,0,0|0,1,0]=2 2248 B13R1.3091 COc1ccc(C(=O)O)nc1C#N Amb27245828 [0,1,0,0,0,0|3,0,0]=4 2249 B13R1.3091 COc1ccc(C(C)=O)cc1C#N Amb17138755 [0,1,0,0,0,0|3,0,0]=4 2250 B13R1.3091 COc1ccc(C(C)=O)cc1C=O Amb17594530 [0,1,0,0,0,0|3,0,0]=4 2251 B13R1.3091 COc1ccc(C(C)=O)cc1CBr Amb27608823 [0,1,0,0,0,0|3,0,0]=4 2252 B13R1.3091 COc1ccc(C(C)=O)cc1CCl Amb1657374 [0,1,0,0,0,0|3,0,0]=4 2253 B13R1.3091 COc1ccc(C(C)=O)cc1CI Amb28203095 [0,1,0,0,0,0|3,0,0]=4 2254 B13R1.3091 COc1ccc(C(C)=O)cc1CO Amb33526715 [0,1,0,0,0,0|3,0,0]=4 2255 B13R1.3091 COc1ccc(C(C)=O)cc1OC Amb2613654 [0,1,0,0,0,0|1,0,0]=2 2256 B13R1.3091 COc1ccc(C(C)=O)nc1OC Amb13889982 [0,1,0,0,0,0|2,0,0]=3 2257 B13R1.3091 COc1ccc(C(C)=S)cc1OC Amb27250671 [0,1,0,0,0,0|1,1,0]=3 2258 B13R1.3091 COc1ccc(C(C)Br)cc1OC Amb8835377 [0,1,0,0,0,0|2,0,1]=4 2259 B13R1.3091 COc1ccc(C(C)Cl)cc1OC Amb9205026 [0,1,0,0,0,0|2,0,1]=4 2260 B13R1.3091 COc1ccc(C(C)N)cc1OC Amb33552290 [0,1,0,0,0,0|2,0,1]=4 2261 B13R1.3091 COc1ccc(C(C)N)cc1OC Amb9703815 [0,1,0,0,0,0|2,0,1]=4 2262 B13R1.3091 COc1ccc(C(C)O)cc1OC Amb1111053 [0,1,0,0,0,0|1,0,1]=3 2263 B13R1.3091 COc1ccc(C(C)S)cc1OC Amb7784681 [0,1,0,0,0,0|1,1,1]=4 2264 B13R1.3091 COc1ccc(C(N)=O)cc1C#N Amb25684148 [0,1,0,0,0,0|3,0,0]=4 2265 B13R1.3091 COc1ccc(C(N)=O)cc1C=O Amb27415715 [0,1,0,0,0,0|3,0,0]=4 2266 B13R1.3091 COc1ccc(C(N)=O)cc1OC Amb3886787 [0,1,0,0,0,0|1,0,0]=2 2267 B13R1.3091 COc1ccc(C(N)=S)cc1OC Amb1152770 [0,1,0,0,0,0|1,1,0]=3 2268 B13R1.3091 COc1ccc(N(C)C)cc1OC Amb18268723 [0,1,0,0,0,0|3,0,0]=4 2269 B13R1.3091 COc1ccc(N(C)O)cc1OC Amb27448458 [0,1,0,0,0,0|2,0,0]=3 2270 B13R1.3091 COc1ccc(S(=O)Cl)cc1OC Amb18570762 [0,1,0,0,0,0|2,0,0]=3 2271 B13R1.3091 COc1ccc(S(=O)O)cc1OC Amb18566482 [0,1,0,0,0,0|1,0,0]=2 2272 B13R1.3091 COc1ccc(S(=O)[O-])cc1OC Amb24112906 [0,1,0,0,0,0|1,0,1]=3 2273 B13R1.3091 COc1ccc(S(C)=O)cc1OC Amb19892217 [0,1,0,0,0,0|2,0,0]=3 2274 B13R1.3091 COc1ccc([C@@H](C)N)cc1OC Amb30633594 [0,1,0,0,0,0|2,0,1]=4 2275 B13R1.3091 COc1ccc([C@@H](C)N)cc1OC Amb6893518 [0,1,0,0,0,0|2,0,1]=4 2276 B13R1.3091 COc1ccc([C@@H](C)O)cc1OC Amb6893517 [0,1,0,0,0,0|1,0,1]=3 2277 B13R1.3091 COc1ccc([C@H](C)N)cc1OC Amb33473585 [0,1,0,0,0,0|2,0,1]=4 2278 B13R1.3091 COc1ccc([C@H](C)N)cc1OC Amb6893519 [0,1,0,0,0,0|2,0,1]=4 2279 B13R1.3091 COc1ccc([C@H](C)O)cc1OC Amb6893516 [0,1,0,0,0,0|1,0,1]=3 2280 B13R1.3091 COc1ccc([N+](=O)[O-])cc1OC Amb1352020 [0,1,0,0,0,0|1,0,1]=3 2281 B13R1.3091 COc1ccc([N+](=O)[O-])cc1SC Amb28068886 [0,1,0,0,0,0|1,1,1]=4 2282 B13R1.3091 COc1ccc([N+](=O)[O-])nc1OC Amb19959785 [0,1,0,0,0,0|2,0,1]=4 2283 B13R1.3091 COc1ccc([S-](=O)=O)cc1OC Amb13881374 [0,1,0,0,0,0|1,0,1]=3 2284 B13R1.3091 COc1ccc([S-](=O)=O)cc1OC Amb22042484 [0,1,0,0,0,0|1,0,1]=3 2285 B13R1.3091 COc1cnc(C(=O)O)cc1C#N Amb27265887 [0,1,0,0,0,0|3,0,0]=4 2286 B13R1.3091 COc1cnc(C(=O)O)cc1CN Amb27953723 [0,1,0,0,0,0|3,0,0]=4 2287 B13R1.3091 COc1cnc(C(=O)O)cc1OC Amb26512642 [0,1,0,0,0,0|1,0,0]=2 2288 B13R1.3091 COc1cnc([N+](=O)[O-])cc1OC Amb27795024 [0,1,0,0,0,0|2,0,1]=4 2289 B13R1.3091 COc1nc(C(=O)Cl)ccc1C#N Amb27791102 [0,1,0,0,0,0|3,0,0]=4 2290 B13R1.3091 COc1nc(C(=O)O)ccc1C#N Amb28239740 [0,1,0,0,0,0|2,0,0]=3 2291 B13R1.3091 COc1nc(C(=O)O)ccc1SC Amb27441583 [0,1,0,0,0,0|1,1,0]=3 2292 B13R1.3091 COc1ncc(C(=O)O)cc1C#N Amb23450276 [0,1,0,0,0,0|3,0,0]=4 2293 B13R1.3091 COc1ncc(C(=O)O)cc1C=O Amb33737880 [0,1,0,0,0,0|3,0,0]=4 2294 B13R1.3091 COc1ncc(C(=O)O)cc1CO Amb27813480 [0,1,0,0,0,0|3,0,0]=4 2295 B13R1.3091 CSc1cc(C(=O)O)ccc1C#N Amb24535346 [0,1,0,0,0,0|1,1,0]=3 2296 B13R1.3091 CSc1cc(C(=O)O)ccc1C=O Amb26334053 [0,1,0,0,0,0|0,1,1]=3 2297 B13R1.3091 CSc1cc(C(=O)O)ccc1NN Amb28134403 [0,1,0,0,0,0|1,1,0]=3 2298 B13R1.3091 CSc1nc(C(=O)O)ccc1C#N Amb27593848 [0,1,0,0,0,0|2,1,0]=4 2299 B13R1.3091 N#Cc1cc(C(=O)O)ccc1C=O Amb33072956 [0,1,0,0,0,0|2,0,1]=4 2300 B13R1.3091 N#Cc1cc(C(=O)O)ccc1CBr Amb26569095 [0,1,0,0,0,0|3,0,0]=4 2301 B13R1.3091 N#Cc1cc(C(=O)O)ccc1CCl Amb26932130 [0,1,0,0,0,0|3,0,0]=4 2302 B13R1.3091 N#Cc1cc(C(=O)O)ccc1CN Amb27217611 [0,1,0,0,0,0|3,0,0]=4 2303 B13R1.3091 N#Cc1ccc(C(=O)O)cc1C#N Amb18647583 [0,1,0,0,0,0|3,0,0]=4 2304 B13R1.3091 N#Cc1ccc(C(=O)O)cc1CBr Amb28119202 [0,1,0,0,0,0|3,0,0]=4 2305 B13R1.3091 NNc1cc(C(=O)O)ccc1C=O Amb27423542 [0,1,0,0,0,0|2,0,1]=4 2306 B13R1.3091 NNc1cc(C(=O)O)ccc1CBr Amb27200529 [0,1,0,0,0,0|3,0,0]=4 2307 B13R1.3091 NNc1cc(C(=O)O)ccc1CCl Amb27229510 [0,1,0,0,0,0|3,0,0]=4 2308 B13R1.3091 NNc1ccc(C(=O)O)cc1C=O Amb28323405 [0,1,0,0,0,0|3,0,0]=4 2309 B13R1.3091 [C-]#[N+]c1ccc([N+](=O)[O-])cc1OC Amb2235914 [0,1,0,0,0,0|2,0,1]=4 2310 B13R1.3230 CC(=O)c1ccc(O)c(C=O)c1O Amb28251193 [0,1,0,0,0,0|3,0,0]=4 2311 B13R1.3230 CCN1C(=O)C(C(=O)O)=CC=C1C Amb18540172 [0,1,0,0,0,0|3,0,0]=4 2312 B13R1.3230 CCc1c(Cl)ccc(C(=O)O)c1Cl Amb22547137 [0,1,0,0,0,0|2,0,0]=3 2313 B13R1.3230 CCc1c(F)ccc(C(=O)O)c1Cl Amb27798269 [0,1,0,0,0,0|2,0,0]=3 2314 B13R1.3230 COC1=C(C)NC=C(C(=O)O)C1=O Amb18823427 [0,1,0,0,0,0|2,0,0]=3 2315 B13R1.3230 COc1c(Br)ccc(B(O)O)c1Cl Amb28129758 [0,1,0,0,0,0|2,0,1]=4 2316 B13R1.3230 COc1c(Br)ccc(B(O)O)c1F Amb25661972 [0,1,0,0,0,0|2,0,1]=4 2317 B13R1.3230 COc1c(Br)ccc(C(=O)Cl)c1F Amb27792399 [0,1,0,0,0,0|2,0,0]=3 2318 B13R1.3230 COc1c(Br)ccc(C(=O)O)c1C Amb22584103 [0,1,0,0,0,0|1,0,0]=2 2319 B13R1.3230 COc1c(Br)ccc(C(=O)O)c1F Amb10839389 [0,1,0,0,0,0|1,0,0]=2 2320 B13R1.3230 COc1c(Br)ccc(C(=O)O)c1N Amb28242811 [0,1,0,0,0,0|1,0,0]=2 2321 B13R1.3230 COc1c(Br)ccc([N+](=O)[O-])c1F Amb26640476 [0,1,0,0,0,0|2,0,1]=4 2322 B13R1.3230 COc1c(Br)cnc(C(=O)O)c1F Amb27209629 [0,1,0,0,0,0|2,0,0]=3 2323 B13R1.3230 COc1c(C)ccc(B(O)O)c1C Amb10068975 [0,1,0,0,0,0|2,0,1]=4 2324 B13R1.3230 COc1c(C)ccc(C(=O)Cl)c1C Amb26419441 [0,1,0,0,0,0|2,0,0]=3 2325 B13R1.3230 COc1c(C)ccc(C(=O)O)c1C Amb27665865 [0,1,0,0,0,0|1,0,0]=2 2326 B13R1.3230 COc1c(C)ccc(C(=O)O)c1N Amb18128814 [0,1,0,0,0,0|1,0,0]=2 2327 B13R1.3230 COc1c(C)ccc(C(=O)O)c1O Amb18648581 [0,1,0,0,0,0|1,0,0]=2 2328 B13R1.3230 COc1c(C)ccc(C(C)=O)c1O Amb18128636 [0,1,0,0,0,0|2,0,0]=3 2329 B13R1.3230 COc1c(C)ccc(C(N)=O)c1C Amb27667255 [0,1,0,0,0,0|2,0,0]=3 2330 B13R1.3230 COc1c(C)ccc([N+](=O)[O-])c1Br Amb27238078 [0,1,0,0,0,0|2,0,1]=4 2331 B13R1.3230 COc1c(C)ccc([N+](=O)[O-])c1C Amb26519660 [0,1,0,0,0,0|2,0,1]=4 2332 B13R1.3230 COc1c(C)ccc([N+](=O)[O-])c1Cl Amb24330420 [0,1,0,0,0,0|2,0,1]=4 2333 B13R1.3230 COc1c(C)ccc([N+](=O)[O-])c1F Amb27877159 [0,1,0,0,0,0|2,0,1]=4 2334 B13R1.3230 COc1c(C)ccc([N+](=O)[O-])c1N Amb24626597 [0,1,0,0,0,0|2,0,1]=4 2335 B13R1.3230 COc1c(C)cnc(C(=O)O)c1C Amb26067056 [0,1,0,0,0,0|2,0,0]=3 2336 B13R1.3230 COc1c(Cl)ccc(B(O)O)c1Cl Amb20075704 [0,1,0,0,0,0|2,0,1]=4 2337 B13R1.3230 COc1c(Cl)ccc(B(O)O)c1F Amb20171169 [0,1,0,0,0,0|2,0,1]=4 2338 B13R1.3230 COc1c(Cl)ccc(C(=O)O)c1Cl Amb27953062 [0,1,0,0,0,0|1,0,0]=2 2339 B13R1.3230 COc1c(Cl)ccc(C(=O)O)c1N Amb18282853 [0,1,0,0,0,0|1,0,0]=2 2340 B13R1.3230 COc1c(Cl)ccc(C(=O)O)c1O Amb31308421 [0,1,0,0,0,0|1,0,0]=2 2341 B13R1.3230 COc1c(Cl)ccc([N+](=O)[O-])c1C Amb27587135 [0,1,0,0,0,0|2,0,1]=4 2342 B13R1.3230 COc1c(Cl)ccc([N+](=O)[O-])c1Cl Amb27259884 [0,1,0,0,0,0|2,0,1]=4 2343 B13R1.3230 COc1c(Cl)cnc(C(=O)O)c1C Amb27642721 [0,1,0,0,0,0|2,0,0]=3 2344 B13R1.3230 COc1c(F)ccc(B(O)O)c1F Amb20075726 [0,1,0,0,0,0|2,0,1]=4 2345 B13R1.3230 COc1c(F)ccc(C(=N)N)c1F Amb28205399 [0,1,0,0,0,0|3,0,0]=4 2346 B13R1.3230 COc1c(F)ccc(C(=O)Cl)c1F Amb22738231 [0,1,0,0,0,0|2,0,0]=3 2347 B13R1.3230 COc1c(F)ccc(C(=O)O)c1F Amb6298602 [0,1,0,0,0,0|1,0,0]=2 2348 B13R1.3230 COc1c(F)ccc(C(=O)O)c1N Amb19516112 [0,1,0,0,0,0|1,0,0]=2 2349 B13R1.3230 COc1c(F)ccc(C(=O)O)c1O Amb27438133 [0,1,0,0,0,0|1,0,0]=2 2350 B13R1.3230 COc1c(F)ccc(C(C)=O)c1F Amb8383578 [0,1,0,0,0,0|2,0,0]=3 2351 B13R1.3230 COc1c(F)ccc(C(C)=O)c1O Amb28076180 [0,1,0,0,0,0|2,0,0]=3 2352 B13R1.3230 COc1c(F)ccc(C(C)O)c1O Amb28132930 [0,1,0,0,0,0|2,0,1]=4 2353 B13R1.3230 COc1c(F)ccc(C(N)=O)c1F Amb22036340 [0,1,0,0,0,0|2,0,0]=3 2354 B13R1.3230 COc1c(F)ccc([N+](=O)[O-])c1Br Amb25919945 [0,1,0,0,0,0|2,0,1]=4 2355 B13R1.3230 COc1c(F)ccc([N+](=O)[O-])c1C Amb27796506 [0,1,0,0,0,0|2,0,1]=4 2356 B13R1.3230 COc1c(F)ccc([N+](=O)[O-])c1F Amb27634252 [0,1,0,0,0,0|2,0,1]=4 2357 B13R1.3230 COc1c(F)cnc(C(=O)O)c1Br Amb27795221 [0,1,0,0,0,0|2,0,0]=3 2358 B13R1.3230 COc1c(I)ccc(B(O)O)c1I Amb27193431 [0,1,0,0,0,0|2,0,1]=4 2359 B13R1.3230 COc1c(I)ccc(C(=O)O)c1I Amb27847042 [0,1,0,0,0,0|1,0,0]=2 2360 B13R1.3230 COc1c(I)ccc(C(N)=O)c1I Amb27463486 [0,1,0,0,0,0|2,0,0]=3 2361 B13R1.3230 COc1c(N)ccc(C(=O)O)c1Cl Amb27759119 [0,1,0,0,0,0|1,0,0]=2 2362 B13R1.3230 COc1c(N)ccc([N+](=O)[O-])c1C Amb26317043 [0,1,0,0,0,0|2,0,1]=4 2363 B13R1.3230 COc1c(O)ccc(C(=O)O)c1N Amb27179065 [0,1,0,0,0,0|0,0,0]=1 2364 B13R1.3230 COc1c(O)ccc(C(=O)O)c1O Amb25049742 [0,1,0,0,0,0|0,0,0]=1 2365 B13R1.3230 COc1c(O)ccc(C(C)=O)c1Cl Amb27263004 [0,1,0,0,0,0|1,0,0]=2 2366 B13R1.3230 COc1c(O)ccc(C(C)=O)c1N Amb20241558 [0,1,0,0,0,0|1,0,0]=2 2367 B13R1.3230 COc1c(O)ccc(C(C)=O)c1O Amb26985961 [0,1,0,0,0,0|1,0,0]=2 2368 B13R1.3230 Cc1c(C(=O)O)ccc(Br)c1C#N Amb26381495 [0,1,0,0,0,0|3,0,0]=4 2369 B13R1.3230 Cc1c(C(=O)O)ccc(Cl)c1C#N Amb25243260 [0,1,0,0,0,0|3,0,0]=4 2370 B13R1.3230 Cc1c(C(=O)O)ccc(F)c1C#N Amb25971139 [0,1,0,0,0,0|3,0,0]=4 2371 B13R1.3230 Cc1c(C(=O)O)ccc(S)c1C#N Amb26576186 [0,1,0,0,0,0|2,1,0]=4 2372 B13R1.3230 Cc1c(C(=O)O)cnc(O)c1C#N Amb19516925 [0,1,0,0,0,0|3,0,0]=4 2373 B13R1.3230 Cc1ccc(C(=O)O)c(Br)c1C#N Amb26397746 [0,1,0,0,0,0|3,0,0]=4 2374 B13R1.3230 Cc1ccc(C(=O)O)c(C)c1CBr Amb32679543 [0,1,0,0,0,0|3,0,0]=4 2375 B13R1.3230 Cc1ccc(C(=O)O)c(C)c1CCl Amb32679533 [0,1,0,0,0,0|3,0,0]=4 2376 B13R1.3230 Cc1ccc(C(=O)O)c(C)c1CN Amb32679524 [0,1,0,0,0,0|3,0,0]=4 2377 B13R1.3230 Cc1ccc(C(=O)O)c(C)c1CO Amb32679552 [0,1,0,0,0,0|3,0,0]=4 2378 B13R1.3230 Cc1ccc(C(=O)O)c(Cl)c1C#N Amb25276825 [0,1,0,0,0,0|3,0,0]=4 2379 B13R1.3230 Cc1ccc(C(=O)O)c(F)c1C=O Amb33495808 [0,1,0,0,0,0|3,0,0]=4 2380 B13R1.3230 Cc1ccc(C(=O)O)c(I)c1C#N Amb25349617 [0,1,0,0,0,0|3,0,0]=4 2381 B13R1.3230 Cc1ccc(C(=O)O)c(O)c1C#N Amb27438317 [0,1,0,0,0,0|3,0,0]=4 2382 B13R1.3230 Cc1ccc(C(=O)O)c(O)c1C=O Amb27411355 [0,1,0,0,0,0|3,0,0]=4 2383 B13R1.3230 Cc1ccc(C(=O)O)c(S)c1C#N Amb26419228 [0,1,0,0,0,0|3,0,0]=4 2384 B13R1.3230 N#Cc1c(Br)ccc(C(=O)O)c1Br Amb25217663 [0,1,0,0,0,0|3,0,0]=4 2385 B13R1.3230 N#Cc1c(Br)ccc(C(=O)O)c1Cl Amb27795063 [0,1,0,0,0,0|3,0,0]=4 2386 B13R1.3230 N#Cc1c(Br)ccc(C(=O)O)c1F Amb24528101 [0,1,0,0,0,0|3,0,0]=4 2387 B13R1.3230 N#Cc1c(Br)ccc(C(=O)O)c1I Amb26973118 [0,1,0,0,0,0|3,0,0]=4 2388 B13R1.3230 N#Cc1c(Cl)ccc(C(=O)O)c1Br Amb25208128 [0,1,0,0,0,0|3,0,0]=4 2389 B13R1.3230 N#Cc1c(Cl)ccc(C(=O)O)c1Cl Amb25241898 [0,1,0,0,0,0|3,0,0]=4 2390 B13R1.3230 N#Cc1c(Cl)ccc(C(=O)O)c1I Amb28071430 [0,1,0,0,0,0|3,0,0]=4 2391 B13R1.3230 N#Cc1c(Cl)ccc(C(=O)O)c1S Amb25973040 [0,1,0,0,0,0|3,0,0]=4 2392 B13R1.3230 N#Cc1c(F)ccc(C(=O)O)c1F Amb27484201 [0,1,0,0,0,0|3,0,0]=4 2393 B13R1.3230 N#Cc1c(F)ccc(C(=O)O)c1S Amb27623380 [0,1,0,0,0,0|3,0,0]=4 2394 B13R1.3230 N#Cc1c(I)ccc(C(=O)O)c1Cl Amb27777512 [0,1,0,0,0,0|3,0,0]=4 2395 B13R1.3230 N#Cc1c(N)ccc(C(=O)O)c1N Amb28284607 [0,1,0,0,0,0|3,0,0]=4 2396 B13R1.3230 N#Cc1c(O)ccc(C(=O)O)c1I Amb27804283 [0,1,0,0,0,0|2,0,0]=3 2397 B13R1.3230 N#Cc1c(S)ccc(C(=O)O)c1Cl Amb27624702 [0,1,0,0,0,0|2,1,0]=4 2398 B13R1.3230 NCc1c(F)ccc(C(=O)O)c1F Amb26639911 [0,1,0,0,0,0|3,0,0]=4 2399 B13R1.3230 O=C(O)c1ccc(F)c(CBr)c1F Amb32679501 [0,1,0,0,0,0|3,0,0]=4 2400 B13R1.3230 O=C(O)c1ccc(F)c(CO)c1F Amb32679494 [0,1,0,0,0,0|3,0,0]=4 2401 B13R1.3230 O=Cc1c(Cl)ccc(C(=O)O)c1Cl Amb26618634 [0,1,0,0,0,0|3,0,0]=4 2402 B13R1.3230 O=Cc1c(F)ccc(C(=O)O)c1F Amb22449350 [0,1,0,0,0,0|3,0,0]=4 2403 B13R2.430 CC(=O)c1ccc2c(c1)CCC2 Amb1657672 [0,0,0,1,0,0|3,0,0]=4 2404 B13R2.430 CC(=O)c1ccc2c(c1)CCN2 Amb34912700 [0,0,0,1,0,0|3,0,0]=4 2405 B13R2.430 CC(=O)c1ccc2c(c1)CCN2 Amb841880 [0,0,0,1,0,0|3,0,0]=4 2406 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 Amb1680104 [0,0,0,1,0,0|2,0,0]=3 2407 B13R2.430 CC(=O)c1ccc2c(c1)CCS2 Amb18824832 [0,0,0,1,0,0|2,1,0]=4 2408 B13R2.430 CC(=O)c1ccc2c(c1)NCC2 Amb18829947 [0,0,0,1,0,0|3,0,0]=4 2409 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 Amb2720840 [0,0,0,1,0,0|1,0,0]=2 2410 B13R2.430 CC(=O)c1ccc2c(n1)OCC2 Amb25892272 [0,0,0,1,0,0|3,0,0]=4 2411 B13R2.430 CC(=O)c1ccc2ccoc2c1 Amb23401817 [0,0,0,1,0,0|2,0,1]=4 2412 B13R2.430 CC(=O)c1ccc2ncoc2c1 Amb18830116 [0,0,0,1,0,0|2,0,1]=4 2413 B13R2.430 CC(=O)c1ccc2occc2c1 Amb18830288 [0,0,0,1,0,0|2,0,1]=4 2414 B13R2.430 CC(=O)c1ccc2ocnc2c1 Amb17319977 [0,0,0,1,0,0|2,0,1]=4 2415 B13R2.430 CC(=S)c1ccc2c(c1)CCO2 Amb27175648 [0,0,0,1,0,0|2,1,0]=4 2416 B13R2.430 CC(Br)c1ccc2c(c1)OCO2 Amb8835386 [0,0,0,1,0,0|2,0,1]=4 2417 B13R2.430 CC(C)c1ccc2c(c1)OCO2 Amb27848190 [0,0,0,1,0,0|2,0,1]=4 2418 B13R2.430 CC(Cl)c1ccc2c(c1)OCO2 Amb9205029 [0,0,0,1,0,0|2,0,1]=4 2419 B13R2.430 CC(N)c1ccc2c(c1)OCO2 Amb1108031 [0,0,0,1,0,0|2,0,1]=4 2420 B13R2.430 CC(N)c1ccc2c(c1)OCO2 Amb7969594 [0,0,0,1,0,0|2,0,1]=4 2421 B13R2.430 CC(O)c1ccc2c(c1)CCO2 Amb9619583 [0,0,0,1,0,0|2,0,1]=4 2422 B13R2.430 CC(O)c1ccc2c(c1)OCC2 Amb28386120 [0,0,0,1,0,0|2,0,1]=4 2423 B13R2.430 CC(O)c1ccc2c(c1)OCO2 Amb6705774 [0,0,0,1,0,0|1,0,1]=3 2424 B13R2.430 CC(S)c1ccc2c(c1)OCO2 Amb7784696 [0,0,0,1,0,0|1,1,1]=4 2425 B13R2.430 CN(C)c1ccc2c(c1)OCO2 Amb15772457 [0,0,0,1,0,0|3,0,0]=4 2426 B13R2.430 C[C@@H](N)c1ccc2c(c1)OCO2 Amb6893514 [0,0,0,1,0,0|2,0,1]=4 2427 B13R2.430 C[C@@H](O)c1ccc2c(c1)CCO2 Amb26844310 [0,0,0,1,0,0|2,0,1]=4 2428 B13R2.430 C[C@@H](O)c1ccc2c(c1)OCO2 Amb6893512 [0,0,0,1,0,0|1,0,1]=3 2429 B13R2.430 C[C@H](N)c1ccc2c(c1)OCO2 Amb6893515 [0,0,0,1,0,0|2,0,1]=4 2430 B13R2.430 C[C@H](O)c1ccc2c(c1)CCO2 Amb26553967 [0,0,0,1,0,0|2,0,1]=4 2431 B13R2.430 C[C@H](O)c1ccc2c(c1)OCO2 Amb6893513 [0,0,0,1,0,0|1,0,1]=3 2432 B13R2.430 N=C(N)c1ccc2c(c1)CCO2 Amb9670464 [0,0,0,1,0,0|3,0,0]=4 2433 B13R2.430 N=C(N)c1ccc2c(c1)OCO2 Amb2695209 [0,0,0,1,0,0|2,0,0]=3 2434 B13R2.430 N=C(N)c1ccc2c(c1)OCO2 Amb2699428 [0,0,0,1,0,0|2,0,0]=3 2435 B13R2.430 NC(=O)c1ccc2c(c1)CCC2 Amb8340019 [0,0,0,1,0,0|3,0,0]=4 2436 B13R2.430 NC(=O)c1ccc2c(c1)CCN2 Amb20669540 [0,0,0,1,0,0|3,0,0]=4 2437 B13R2.430 NC(=O)c1ccc2c(c1)CCN2 Amb9210812 [0,0,0,1,0,0|3,0,0]=4 2438 B13R2.430 NC(=O)c1ccc2c(c1)CCO2 Amb8999091 [0,0,0,1,0,0|2,0,0]=3 2439 B13R2.430 NC(=O)c1ccc2c(c1)OCC2 Amb23399917 [0,0,0,1,0,0|2,0,0]=3 2440 B13R2.430 NC(=O)c1ccc2c(c1)OCO2 Amb33551132 [0,0,0,1,0,0|1,0,0]=2 2441 B13R2.430 NC(=O)c1ccc2ccoc2c1 Amb23401819 [0,0,0,1,0,0|2,0,1]=4 2442 B13R2.430 NC(=O)c1ccc2ncoc2c1 Amb27390946 [0,0,0,1,0,0|2,0,1]=4 2443 B13R2.430 NC(=O)c1ccc2occc2c1 Amb23401830 [0,0,0,1,0,0|2,0,1]=4 2444 B13R2.430 NC(=S)c1ccc2c(c1)CCO2 Amb2725872 [0,0,0,1,0,0|2,1,0]=4 2445 B13R2.430 NC(=S)c1ccc2c(c1)OCO2 Amb2722983 [0,0,0,1,0,0|1,1,0]=3 2446 B13R2.430 O=C(Cl)c1ccc2c(c1)CCO2 Amb2723017 [0,0,0,1,0,0|2,0,0]=3 2447 B13R2.430 O=C(Cl)c1ccc2c(c1)OCO2 Amb2720178 [0,0,0,1,0,0|1,0,0]=2 2448 B13R2.430 O=C(Cl)c1ccc2ccoc2c1 Amb26917355 [0,0,0,1,0,0|2,0,1]=4 2449 B13R2.430 O=C(Cl)c1ccc2ncoc2c1 Amb27638540 [0,0,0,1,0,0|2,0,1]=4 2450 B13R2.430 O=C(Cl)c1ccc2occc2c1 Amb2723108 [0,0,0,1,0,0|2,0,1]=4 2451 B13R2.430 O=C(O)C1=CN2CCN=C2C=C1 Amb27877618 [0,0,0,1,0,0|3,0,0]=4 2452 B13R2.430 O=C(O)c1cc2c(cn1)CCC2 Amb33742900 [0,0,0,1,0,0|3,0,0]=4 2453 B13R2.430 O=C(O)c1cc2c(cn1)CCC2 Amb33746295 [0,0,0,1,0,0|3,0,0]=4 2454 B13R2.430 O=C(O)c1cc2c(cn1)OCO2 Amb24060671 [0,0,0,1,0,0|1,0,0]=2 2455 B13R2.430 O=C(O)c1cc2ccoc2cn1 Amb19958264 [0,0,0,1,0,0|2,0,1]=4 2456 B13R2.430 O=C(O)c1cc2ccoc2cn1 Amb22235943 [0,0,0,1,0,0|2,0,1]=4 2457 B13R2.430 O=C(O)c1cc2occc2cn1 Amb18829553 [0,0,0,1,0,0|2,0,1]=4 2458 B13R2.430 O=C(O)c1cc2ocnc2cn1 Amb24066867 [0,0,0,1,0,0|2,0,1]=4 2459 B13R2.430 O=C(O)c1ccc2c(c1)C=CC2 Amb24078363 [0,0,0,1,0,0|2,0,1]=4 2460 B13R2.430 O=C(O)c1ccc2c(c1)C=N[NH2+]2 Amb2694905 [0,0,0,1,0,0|3,0,0]=4 2461 B13R2.430 O=C(O)c1ccc2c(c1)CCC2 Amb1091099 [0,0,0,1,0,0|2,0,0]=3 2462 B13R2.430 O=C(O)c1ccc2c(c1)CCN2 Amb1223232 [0,0,0,1,0,0|2,0,0]=3 2463 B13R2.430 O=C(O)c1ccc2c(c1)CCN2 Amb6892652 [0,0,0,1,0,0|2,0,0]=3 2464 B13R2.430 O=C(O)c1ccc2c(c1)CCO2 Amb540918 [0,0,0,1,0,0|1,0,0]=2 2465 B13R2.430 O=C(O)c1ccc2c(c1)CCS2 Amb27607728 [0,0,0,1,0,0|1,1,0]=3 2466 B13R2.430 O=C(O)c1ccc2c(c1)CNC2 Amb10067687 [0,0,0,1,0,0|3,0,0]=4 2467 B13R2.430 O=C(O)c1ccc2c(c1)CNC2 Amb19514871 [0,0,0,1,0,0|3,0,0]=4 2468 B13R2.430 O=C(O)c1ccc2c(c1)CNC2 Amb20241434 [0,0,0,1,0,0|3,0,0]=4 2469 B13R2.430 O=C(O)c1ccc2c(c1)COC2 Amb13951734 [0,0,0,1,0,0|3,0,0]=4 2470 B13R2.430 O=C(O)c1ccc2c(c1)CSC2 Amb27215617 [0,0,0,1,0,0|3,0,0]=4 2471 B13R2.430 O=C(O)c1ccc2c(c1)NCC2 Amb22756227 [0,0,0,1,0,0|2,0,0]=3 2472 B13R2.430 O=C(O)c1ccc2c(c1)NCC2 Amb8629693 [0,0,0,1,0,0|2,0,0]=3 2473 B13R2.430 O=C(O)c1ccc2c(c1)NCO2 Amb33133015 [0,0,0,1,0,0|1,0,0]=2 2474 B13R2.430 O=C(O)c1ccc2c(c1)OCC2 Amb10602522 [0,0,0,1,0,0|1,0,0]=2 2475 B13R2.430 O=C(O)c1ccc2c(c1)OCN2 Amb17621777 [0,0,0,1,0,0|1,0,0]=2 2476 B13R2.430 O=C(O)c1ccc2c(c1)OCO2 Amb2542764 [0,0,0,1,0,0|0,0,0]=1 2477 B13R2.430 O=C(O)c1ccc2c(c1)SCC2 Amb27451361 [0,0,0,1,0,0|1,1,0]=3 2478 B13R2.430 O=C(O)c1ccc2c(n1)CCC2 Amb25337591 [0,0,0,1,0,0|3,0,0]=4 2479 B13R2.430 O=C(O)c1ccc2c(n1)CCC2 Amb31217539 [0,0,0,1,0,0|3,0,0]=4 2480 B13R2.430 O=C(O)c1ccc2c(n1)OCO2 Amb18827396 [0,0,0,1,0,0|1,0,0]=2 2481 B13R2.430 O=C(O)c1ccc2ccoc2c1 Amb33542897 [0,0,0,1,0,0|1,0,1]=3 2482 B13R2.430 O=C(O)c1ccc2ccsc2c1 Amb9783319 [0,0,0,1,0,0|1,1,1]=4 2483 B13R2.430 O=C(O)c1ccc2cnoc2c1 Amb27982959 [0,0,0,1,0,0|2,0,0]=3 2484 B13R2.430 O=C(O)c1ccc2cnsc2c1 Amb22754833 [0,0,0,1,0,0|2,1,0]=4 2485 B13R2.430 O=C(O)c1ccc2ncoc2c1 Amb8629960 [0,0,0,1,0,0|1,0,1]=3 2486 B13R2.430 O=C(O)c1ccc2ncsc2c1 Amb1207386 [0,0,0,1,0,0|1,1,1]=4 2487 B13R2.430 O=C(O)c1ccc2nnoc2c1 Amb18829108 [0,0,0,1,0,0|2,0,0]=3 2488 B13R2.430 O=C(O)c1ccc2nnsc2c1 Amb8439690 [0,0,0,1,0,0|2,1,0]=4 2489 B13R2.430 O=C(O)c1ccc2nonc2c1 Amb1087899 [0,0,0,1,0,0|3,0,0]=4 2490 B13R2.430 O=C(O)c1ccc2nsnc2c1 Amb1042175 [0,0,0,1,0,0|3,0,0]=4 2491 B13R2.430 O=C(O)c1ccc2occc2c1 Amb2723107 [0,0,0,1,0,0|1,0,1]=3 2492 B13R2.430 O=C(O)c1ccc2occc2n1 Amb18645762 [0,0,0,1,0,0|2,0,1]=4 2493 B13R2.430 O=C(O)c1ccc2ocnc2c1 Amb5730401 [0,0,0,1,0,0|1,0,1]=3 2494 B13R2.430 O=C(O)c1ccc2ocnc2n1 Amb25677507 [0,0,0,1,0,0|2,0,1]=4 2495 B13R2.430 O=C(O)c1ccc2oncc2c1 Amb26477875 [0,0,0,1,0,0|2,0,0]=3 2496 B13R2.430 O=C(O)c1ccc2sccc2c1 Amb1995219 [0,0,0,1,0,0|1,1,1]=4 2497 B13R2.430 O=C(O)c1ccc2scnc2c1 Amb1994154 [0,0,0,1,0,0|1,1,1]=4 2498 B13R2.430 O=C(O)c1ccc2sncc2c1 Amb24330535 [0,0,0,1,0,0|2,1,0]=4 2499 B13R2.430 O=C(O)c1ccc2snnc2c1 Amb2723135 [0,0,0,1,0,0|2,1,0]=4 2500 B13R2.430 O=C(O)c1cnc2c(c1)CCC2 Amb33542542 [0,0,0,1,0,0|3,0,0]=4 2501 B13R2.430 O=C(O)c1cnc2c(c1)NCC2 Amb18829046 [0,0,0,1,0,0|3,0,0]=4 2502 B13R2.430 O=C(O)c1cnc2c(c1)NCC2 Amb33465416 [0,0,0,1,0,0|3,0,0]=4 2503 B13R2.430 O=C(O)c1cnc2c(c1)OCO2 Amb18827404 [0,0,0,1,0,0|1,0,0]=2 2504 B13R2.430 O=C(O)c1cnc2ccoc2c1 Amb13890160 [0,0,0,1,0,0|2,0,1]=4 2505 B13R2.430 O=C(O)c1cnc2ncoc2c1 Amb27186299 [0,0,0,1,0,0|2,0,1]=4 2506 B13R2.430 O=C(O)c1cnc2occc2c1 Amb18645764 [0,0,0,1,0,0|2,0,1]=4 2507 B13R2.430 O=C(O)c1cnc2oncc2c1 Amb18829107 [0,0,0,1,0,0|3,0,0]=4 2508 B13R2.430 O=C(O)c1ncc2c(n1)OCC2 Amb18827990 [0,0,0,1,0,0|3,0,0]=4 2509 B13R2.430 O=C([O-])c1ccc2c(c1)OCO2 Amb24309015 [0,0,0,1,0,0|0,0,1]=2 2510 B13R2.430 O=N(=O)c1ccc2c(c1)OCO2 Amb6357461 [0,0,0,1,0,0|1,0,1]=3 2511 B13R2.430 O=S(Cl)c1ccc2c(c1)OCO2 Amb18567170 [0,0,0,1,0,0|2,0,0]=3 2512 B13R2.430 O=S(O)c1ccc2c(c1)CCC2 Amb18224763 [0,0,0,1,0,0|3,0,0]=4 2513 B13R2.430 O=S(O)c1ccc2c(c1)CCO2 Amb27855119 [0,0,0,1,0,0|2,0,0]=3 2514 B13R2.430 O=S(O)c1ccc2c(c1)OCO2 Amb18066175 [0,0,0,1,0,0|1,0,0]=2 2515 B13R2.430 O=S([O-])c1ccc2c(c1)CCO2 Amb28320550 [0,0,0,1,0,0|2,0,1]=4 2516 B13R2.430 O=S([O-])c1ccc2c(c1)OCC2 Amb32755529 [0,0,0,1,0,0|2,0,1]=4 2517 B13R2.430 O=S([O-])c1ccc2c(c1)OCO2 Amb25677807 [0,0,0,1,0,0|1,0,1]=3 2518 B13R2.430 O=[N+]([O-])c1ccc2c(c1)CCO2 Amb22498102 [0,0,0,1,0,0|2,0,1]=4 2519 B13R2.430 O=[N+]([O-])c1ccc2c(c1)OCO2 Amb1950845 [0,0,0,1,0,0|1,0,1]=3 2520 B13R2.430 O=[N+]([O-])c1ccc2c(n1)OCO2 Amb27266252 [0,0,0,1,0,0|2,0,1]=4 2521 B13R2.430 OB(O)c1ccc2c(c1)CCO2 Amb2455957 [0,0,0,1,0,0|2,0,1]=4 2522 B13R2.430 OB(O)c1ccc2c(c1)OCC2 Amb22498248 [0,0,0,1,0,0|2,0,1]=4 2523 B13R2.430 OB(O)c1ccc2c(c1)OCO2 Amb842445 [0,0,0,1,0,0|1,0,1]=3 2524 B13R2.430 OB(O)c1cnc2c(c1)OCO2 Amb24485594 [0,0,0,1,0,0|2,0,1]=4 2525 B13R2.2461 COc1cc(C2CO2)ccc1Br Amb33389667 [0,0,0,1,0,0|2,0,1]=4 2526 B13R2.2461 COc1cc(C2CO2)ccc1C Amb33420849 [0,0,0,1,0,0|2,0,1]=4 2527 B13R2.2461 COc1cc(C2CO2)ccc1Cl Amb33051998 [0,0,0,1,0,0|2,0,1]=4 2528 B13R2.2461 COc1cc(C2CO2)ccc1F Amb26854236 [0,0,0,1,0,0|2,0,1]=4 2529 B13R2.2461 COc1cc(C2CO2)ccc1O Amb17090256 [0,0,0,1,0,0|1,0,1]=3 2530 B13R2.2461 COc1cc([C@@H]2CO2)ccc1Br Amb33337043 [0,0,0,1,0,0|2,0,1]=4 2531 B13R2.2461 COc1cc([C@@H]2CO2)ccc1C Amb33224649 [0,0,0,1,0,0|2,0,1]=4 2532 B13R2.2461 COc1cc([C@@H]2CO2)ccc1Cl Amb33256455 [0,0,0,1,0,0|2,0,1]=4 2533 B13R2.2461 COc1cc([C@@H]2CO2)ccc1F Amb33311992 [0,0,0,1,0,0|2,0,1]=4 2534 B13R2.2461 COc1cc([C@H]2CO2)ccc1Br Amb33337040 [0,0,0,1,0,0|2,0,1]=4 2535 B13R2.2461 COc1cc([C@H]2CO2)ccc1C Amb33418911 [0,0,0,1,0,0|2,0,1]=4 2536 B13R2.2461 COc1cc([C@H]2CO2)ccc1Cl Amb33256836 [0,0,0,1,0,0|2,0,1]=4 2537 B13R2.2461 COc1cc([C@H]2CO2)ccc1F Amb33311993 [0,0,0,1,0,0|2,0,1]=4 2538 B11R1.48 CCc1cc(C(=O)O)sc1C Amb1105368 [0,0,0,0,1,0|3,0,0]=4 2539 B11R1.48 CCc1oc(C(=O)O)cc1Br Amb29860659 [0,0,0,0,1,0|3,0,0]=4 2540 B11R1.48 CCc1oc(C(=O)O)cc1C Amb18685127 [0,0,0,0,1,0|3,0,0]=4 2541 B11R1.48 CCc1sc(C(=O)O)cc1Br Amb1946278 [0,0,0,0,1,0|3,0,0]=4 2542 B11R1.48 CCc1sc(C(=O)O)cc1C Amb434061 [0,0,0,0,1,0|3,0,0]=4 2543 B11R1.48 CCc1sc(C(=O)O)cc1Cl Amb22755085 [0,0,0,0,1,0|3,0,0]=4 2544 B11R1.48 CCn1nc(C(=O)O)cc1O Amb33549574 [0,0,0,0,1,0|3,0,0]=4 2545 B11R1.48 CNc1oc(C(=O)O)cc1Br Amb29860622 [0,0,0,0,1,0|3,0,0]=4 2546 B11R1.48 COc1cc(C(=O)O)nn1C Amb19957325 [0,0,0,0,1,0|3,0,0]=4 2547 B11R1.48 COc1cc(C(=O)O)oc1C Amb27397701 [0,0,0,0,1,0|2,0,0]=3 2548 B11R1.48 COc1cc(C(=O)O)sc1Br Amb27635171 [0,0,0,0,1,0|2,0,0]=3 2549 B11R1.48 COc1cc(C(N)=O)sc1Br Amb27594516 [0,0,0,0,1,0|3,0,0]=4 2550 B11R1.48 COc1oc(C(=O)O)cc1Br Amb23538047 [0,0,0,0,1,0|2,0,0]=3 2551 B11R1.48 COc1sc(C(=O)O)cc1Br Amb8439403 [0,0,0,0,1,0|2,0,0]=3 2552 B11R1.48 COc1sc(C(=O)O)cc1Cl Amb27221748 [0,0,0,0,1,0|2,0,0]=3 2553 B11R1.48 COc1sc(C(C)=O)cc1Br Amb2439255 [0,0,0,0,1,0|3,0,0]=4 2554 B11R1.48 CSc1cc(C(=O)O)oc1C Amb19334672 [0,0,0,0,1,0|2,1,0]=4 2555 B11R1.48 CSc1oc(C(=O)O)cc1Br Amb23538061 [0,0,0,0,1,0|2,1,0]=4 2556 B11R1.48 CSc1sc(C(=O)O)cc1Br Amb19515239 [0,0,0,0,1,0|2,1,0]=4 2557 B11R1.48 CSc1sc(C(=O)O)cc1N Amb18820000 [0,0,0,0,1,0|2,1,0]=4 2558 B11R1.64 CCc1c(C(=O)O)ccn1C Amb26014628 [0,0,0,0,1,0|3,0,0]=4 2559 B11R1.64 CCc1c(C(=O)O)csc1C Amb2154726 [0,0,0,0,1,0|3,0,0]=4 2560 B11R1.64 CCc1c(C)csc1C(=O)O Amb18198908 [0,0,0,0,1,0|3,0,0]=4 2561 B11R1.64 CCc1c(O)noc1C(=O)O Amb27229256 [0,0,0,0,1,0|3,0,0]=4 2562 B11R1.64 COc1c(Br)csc1C(=O)O Amb18134144 [0,0,0,0,1,0|2,0,0]=3 2563 B11R1.64 COc1c(C(=O)Cl)csc1Cl Amb2724392 [0,0,0,0,1,0|3,0,0]=4 2564 B11R1.64 COc1c(C(=O)O)cnn1C Amb23580132 [0,0,0,0,1,0|3,0,0]=4 2565 B11R1.64 COc1c(C(=O)O)csc1Br Amb2724393 [0,0,0,0,1,0|2,0,0]=3 2566 B11R1.64 COc1c(C(=O)O)csc1Cl Amb2724391 [0,0,0,0,1,0|2,0,0]=3 2567 B11R1.64 COc1c(C)csc1C(=O)O Amb9768652 [0,0,0,0,1,0|2,0,0]=3 2568 B11R1.64 COc1c(Cl)csc1C(=O)O Amb23509667 [0,0,0,0,1,0|2,0,0]=3 2569 B11R1.64 CSc1c(Br)csc1C(=O)O Amb2613280 [0,0,0,0,1,0|2,1,0]=4 2570 B11R1.64 O=Cc1c(O)csc1C(=O)O Amb33072988 [0,0,0,0,1,0|3,0,0]=4 2571 B13R1.52 C=C(C)Cc1ccc(F)c(OC)c1 Amb27461347 [0,0,0,0,0,1|3,0,0]=4 2572 B13R1.52 CC(=O)Cc1ccc(O)c(CO)c1 Amb27208790 [0,0,0,0,0,1|3,0,0]=4 2573 B13R1.52 CC(=O)Nc1ccc(O)c(C=O)c1 Amb18128333 [0,0,0,0,0,1|3,0,0]=4 2574 B13R1.52 CC(=O)Nc1ccc(O)c(OS)c1 Amb27879577 [0,0,0,0,0,1|2,0,0]=3 2575 B13R1.52 CCc1cc(CC(=O)O)ccc1Br Amb26931732 [0,0,0,0,0,1|2,0,0]=3 2576 B13R1.52 CCc1cc(CC(=O)O)ccc1C Amb27246807 [0,0,0,0,0,1|2,0,0]=3 2577 B13R1.52 CCc1cc(CC(=O)O)ccc1Cl Amb25117985 [0,0,0,0,0,1|2,0,0]=3 2578 B13R1.52 CCc1cc(CC(=O)O)ccc1F Amb27974667 [0,0,0,0,0,1|2,0,0]=3 2579 B13R1.52 CCc1cc(CC(=O)O)ccc1N Amb24445446 [0,0,0,0,0,1|2,0,0]=3 2580 B13R1.52 CCc1cc(CC(=O)O)ccc1S Amb24437662 [0,0,0,0,0,1|1,1,0]=3 2581 B13R1.52 CCc1cc(CC(C)=O)ccc1Br Amb26571758 [0,0,0,0,0,1|3,0,0]=4 2582 B13R1.52 CCc1cc(CC(C)=O)ccc1Cl Amb28246218 [0,0,0,0,0,1|3,0,0]=4 2583 B13R1.52 CCc1cc(CC(C)=O)ccc1F Amb27209859 [0,0,0,0,0,1|3,0,0]=4 2584 B13R1.52 CCc1cc(CC(C)=O)ccc1O Amb28323518 [0,0,0,0,0,1|2,0,0]=3 2585 B13R1.52 CCc1cc(NC(=O)Cl)ccc1C Amb35632983 [0,0,0,0,0,1|3,0,0]=4 2586 B13R1.52 CCc1cc(NC(=O)Cl)ccc1F Amb35633606 [0,0,0,0,0,1|3,0,0]=4 2587 B13R1.52 CCc1cc(NC(C)=O)ccc1Br Amb3989963 [0,0,0,0,0,1|3,0,0]=4 2588 B13R1.52 CCc1cc(NC(C)=O)ccc1C Amb24709376 [0,0,0,0,0,1|3,0,0]=4 2589 B13R1.52 CCc1cc(NC(C)=O)ccc1O Amb18128417 [0,0,0,0,0,1|2,0,0]=3 2590 B13R1.52 CCc1cc(OC(=O)Cl)ccc1Cl Amb24573783 [0,0,0,0,0,1|3,0,0]=4 2591 B13R1.52 CNc1cc(CC(N)=O)ccc1N Amb27179184 [0,0,0,0,0,1|3,0,0]=4 2592 B13R1.52 CNc1cc(NC(C)=O)ccc1C Amb18967618 [0,0,0,0,0,1|3,0,0]=4 2593 B13R1.52 COc1cc(C=C(Br)Br)ccc1O Amb18117891 [0,0,0,0,0,1|2,0,0]=3 2594 B13R1.52 COc1cc(CC(=N)N)ccc1Br Amb33337041 [0,0,0,0,0,1|3,0,0]=4 2595 B13R1.52 COc1cc(CC(=N)N)ccc1C Amb24545944 [0,0,0,0,0,1|3,0,0]=4 2596 B13R1.52 COc1cc(CC(=N)N)ccc1Cl Amb33256448 [0,0,0,0,0,1|3,0,0]=4 2597 B13R1.52 COc1cc(CC(=N)N)ccc1F Amb33312423 [0,0,0,0,0,1|3,0,0]=4 2598 B13R1.52 COc1cc(CC(=N)N)ccc1O Amb2696150 [0,0,0,0,0,1|2,0,0]=3 2599 B13R1.52 COc1cc(CC(=O)O)ccc1Br Amb27461990 [0,0,0,0,0,1|1,0,0]=2 2600 B13R1.52 COc1cc(CC(=O)O)ccc1C Amb461640 [0,0,0,0,0,1|1,0,0]=2 2601 B13R1.52 COc1cc(CC(=O)O)ccc1Cl Amb8056354 [0,0,0,0,0,1|1,0,0]=2 2602 B13R1.52 COc1cc(CC(=O)O)ccc1F Amb8011490 [0,0,0,0,0,1|1,0,0]=2 2603 B13R1.52 COc1cc(CC(=O)O)ccc1N Amb24680955 [0,0,0,0,0,1|1,0,0]=2 2604 B13R1.52 COc1cc(CC(=O)O)ccc1O Amb2688758 [0,0,0,0,0,1|0,0,0]=1 2605 B13R1.52 COc1cc(CC(=O)O)ccc1S Amb28280130 [0,0,0,0,0,1|0,1,0]=2 2606 B13R1.52 COc1cc(CC(=O)O)cnc1Br Amb27816674 [0,0,0,0,0,1|2,0,0]=3 2607 B13R1.52 COc1cc(CC(=O)O)cnc1C Amb25995770 [0,0,0,0,0,1|2,0,0]=3 2608 B13R1.52 COc1cc(CC(=O)O)cnc1F Amb26006132 [0,0,0,0,0,1|2,0,0]=3 2609 B13R1.52 COc1cc(CC(=O)O)ncc1Br Amb27201761 [0,0,0,0,0,1|2,0,0]=3 2610 B13R1.52 COc1cc(CC(=O)O)ncc1F Amb26055443 [0,0,0,0,0,1|2,0,0]=3 2611 B13R1.52 COc1cc(CC(=O)O)ncc1O Amb28052967 [0,0,0,0,0,1|1,0,0]=2 2612 B13R1.52 COc1cc(CC(=O)[O-])ccc1O Amb32661762 [0,0,0,0,0,1|0,0,1]=2 2613 B13R1.52 COc1cc(CC(C)=O)ccc1Br Amb26040193 [0,0,0,0,0,1|2,0,0]=3 2614 B13R1.52 COc1cc(CC(C)=O)ccc1C Amb6297098 [0,0,0,0,0,1|2,0,0]=3 2615 B13R1.52 COc1cc(CC(C)=O)ccc1Cl Amb24393362 [0,0,0,0,0,1|2,0,0]=3 2616 B13R1.52 COc1cc(CC(C)=O)ccc1F Amb6298574 [0,0,0,0,0,1|2,0,0]=3 2617 B13R1.52 COc1cc(CC(C)=O)ccc1N Amb27877155 [0,0,0,0,0,1|2,0,0]=3 2618 B13R1.52 COc1cc(CC(C)=O)ccc1O Amb2778809 [0,0,0,0,0,1|1,0,0]=2 2619 B13R1.52 COc1cc(CC(C)Br)ccc1O Amb17596769 [0,0,0,0,0,1|2,0,1]=4 2620 B13R1.52 COc1cc(CC(C)F)ccc1O Amb28122405 [0,0,0,0,0,1|2,0,1]=4 2621 B13R1.52 COc1cc(CC(C)N)ccc1O Amb4079284 [0,0,0,0,0,1|2,0,1]=4 2622 B13R1.52 COc1cc(CC(C)O)ccc1Br Amb33331426 [0,0,0,0,0,1|2,0,1]=4 2623 B13R1.52 COc1cc(CC(C)O)ccc1C Amb33419934 [0,0,0,0,0,1|2,0,1]=4 2624 B13R1.52 COc1cc(CC(C)O)ccc1Cl Amb33413488 [0,0,0,0,0,1|2,0,1]=4 2625 B13R1.52 COc1cc(CC(C)O)ccc1F Amb33313217 [0,0,0,0,0,1|2,0,1]=4 2626 B13R1.52 COc1cc(CC(C)O)ccc1O Amb28141298 [0,0,0,0,0,1|1,0,1]=3 2627 B13R1.52 COc1cc(CC(N)=S)ccc1Br Amb33337046 [0,0,0,0,0,1|2,1,0]=4 2628 B13R1.52 COc1cc(CC(N)=S)ccc1C Amb33419153 [0,0,0,0,0,1|2,1,0]=4 2629 B13R1.52 COc1cc(CC(N)=S)ccc1Cl Amb33262889 [0,0,0,0,0,1|2,1,0]=4 2630 B13R1.52 COc1cc(CC(N)=S)ccc1F Amb24667869 [0,0,0,0,0,1|2,1,0]=4 2631 B13R1.52 COc1cc(CC(N)=S)ccc1O Amb33429197 [0,0,0,0,0,1|1,1,0]=3 2632 B13R1.52 COc1cc(CN(C)C)ccc1O Amb18648505 [0,0,0,0,0,1|3,0,0]=4 2633 B13R1.52 COc1cc(CN(C)C)ccc1O Amb28556075 [0,0,0,0,0,1|3,0,0]=4 2634 B13R1.52 COc1cc(CN(C)O)ccc1Br Amb33331429 [0,0,0,0,0,1|3,0,0]=4 2635 B13R1.52 COc1cc(CN(C)O)ccc1C Amb33419996 [0,0,0,0,0,1|3,0,0]=4 2636 B13R1.52 COc1cc(CN(C)O)ccc1Cl Amb33413451 [0,0,0,0,0,1|3,0,0]=4 2637 B13R1.52 COc1cc(CN(C)O)ccc1F Amb33313670 [0,0,0,0,0,1|3,0,0]=4 2638 B13R1.52 COc1cc(CN(C)O)ccc1O Amb33429539 [0,0,0,0,0,1|2,0,0]=3 2639 B13R1.52 COc1cc(C[C@@H](C)N)ccc1O Amb27950710 [0,0,0,0,0,1|2,0,1]=4 2640 B13R1.52 COc1cc(C[C@@H](C)O)ccc1Br Amb33331475 [0,0,0,0,0,1|2,0,1]=4 2641 B13R1.52 COc1cc(C[C@@H](C)O)ccc1C Amb33419535 [0,0,0,0,0,1|2,0,1]=4 2642 B13R1.52 COc1cc(C[C@@H](C)O)ccc1Cl Amb33256405 [0,0,0,0,0,1|2,0,1]=4 2643 B13R1.52 COc1cc(C[C@@H](C)O)ccc1F Amb33313161 [0,0,0,0,0,1|2,0,1]=4 2644 B13R1.52 COc1cc(C[C@@H](C)O)ccc1O Amb33429517 [0,0,0,0,0,1|1,0,1]=3 2645 B13R1.52 COc1cc(C[C@H](C)N)ccc1O Amb25326282 [0,0,0,0,0,1|2,0,1]=4 2646 B13R1.52 COc1cc(C[C@H](C)O)ccc1Br Amb33331474 [0,0,0,0,0,1|2,0,1]=4 2647 B13R1.52 COc1cc(C[C@H](C)O)ccc1C Amb33419536 [0,0,0,0,0,1|2,0,1]=4 2648 B13R1.52 COc1cc(C[C@H](C)O)ccc1Cl Amb33256401 [0,0,0,0,0,1|2,0,1]=4 2649 B13R1.52 COc1cc(C[C@H](C)O)ccc1F Amb33313162 [0,0,0,0,0,1|2,0,1]=4 2650 B13R1.52 COc1cc(C[C@H](C)O)ccc1O Amb33429519 [0,0,0,0,0,1|1,0,1]=3 2651 B13R1.52 COc1cc(C[N+](=O)[O-])ccc1Br Amb33331798 [0,0,0,0,0,1|2,0,1]=4 2652 B13R1.52 COc1cc(C[N+](=O)[O-])ccc1C Amb33419525 [0,0,0,0,0,1|2,0,1]=4 2653 B13R1.52 COc1cc(C[N+](=O)[O-])ccc1Cl Amb33256450 [0,0,0,0,0,1|2,0,1]=4 2654 B13R1.52 COc1cc(C[N+](=O)[O-])ccc1F Amb33312791 [0,0,0,0,0,1|2,0,1]=4 2655 B13R1.52 COc1cc(C[N+](=O)[O-])ccc1O Amb33429332 [0,0,0,0,0,1|1,0,1]=3 2656 B13R1.52 COc1cc(NC(=N)N)ccc1C Amb29859463 [0,0,0,0,0,1|3,0,0]=4 2657 B13R1.52 COc1cc(NC(=O)Cl)ccc1Br Amb35625736 [0,0,0,0,0,1|2,0,0]=3 2658 B13R1.52 COc1cc(NC(=O)Cl)ccc1C Amb35625777 [0,0,0,0,0,1|2,0,0]=3 2659 B13R1.52 COc1cc(NC(=O)Cl)ccc1Cl Amb35625602 [0,0,0,0,0,1|2,0,0]=3 2660 B13R1.52 COc1cc(NC(=O)Cl)ccc1F Amb35625603 [0,0,0,0,0,1|2,0,0]=3 2661 B13R1.52 COc1cc(NC(C)=N)ccc1C Amb29859410 [0,0,0,0,0,1|3,0,0]=4 2662 B13R1.52 COc1cc(NC(C)=N)ccc1Cl Amb28240055 [0,0,0,0,0,1|3,0,0]=4 2663 B13R1.52 COc1cc(NC(C)=O)ccc1Cl Amb19959297 [0,0,0,0,0,1|2,0,0]=3 2664 B13R1.52 COc1cc(NC(C)=O)ccc1I Amb19373672 [0,0,0,0,0,1|2,0,0]=3 2665 B13R1.52 COc1cc(NC(C)=O)ccc1N Amb1135622 [0,0,0,0,0,1|2,0,0]=3 2666 B13R1.52 COc1cc(NC(C)=O)cnc1N Amb32679025 [0,0,0,0,0,1|3,0,0]=4 2667 B13R1.52 COc1cc(NC(C)=O)ncc1Br Amb28047789 [0,0,0,0,0,1|3,0,0]=4 2668 B13R1.52 COc1cc(NC(N)=O)ccc1C Amb35690394 [0,0,0,0,0,1|2,0,0]=3 2669 B13R1.52 COc1cc(NC(N)=O)ccc1F Amb24692422 [0,0,0,0,0,1|2,0,0]=3 2670 B13R1.52 COc1cc(NC(N)=O)ncc1Br Amb28283764 [0,0,0,0,0,1|3,0,0]=4 2671 B13R1.52 COc1cc(NC(N)=S)ccc1C Amb25927450 [0,0,0,0,0,1|2,1,0]=4 2672 B13R1.52 COc1cc(NC(N)=S)ccc1Cl Amb24490346 [0,0,0,0,0,1|2,1,0]=4 2673 B13R1.52 COc1cc(NC(N)=S)ccc1F Amb19891119 [0,0,0,0,0,1|2,1,0]=4 2674 B13R1.52 COc1cc(NC(N)=S)ccc1I Amb24455492 [0,0,0,0,0,1|2,1,0]=4 2675 B13R1.52 COc1cc(NC(N)=S)ccc1N Amb24437654 [0,0,0,0,0,1|2,1,0]=4 2676 B13R1.52 COc1cc(NC(N)=S)ccc1O Amb25311133 [0,0,0,0,0,1|1,1,0]=3 2677 B13R1.52 COc1cc(OC(C)=O)ccc1O Amb18648579 [0,0,0,0,0,1|1,0,0]=2 2678 B13R1.52 COc1cc(OC(C)C)ccc1O Amb28066607 [0,0,0,0,0,1|2,0,1]=4 2679 B13R1.52 COc1cc(OC(F)F)ccc1O Amb25143575 [0,0,0,0,0,1|2,0,1]=4 2680 B13R1.52 COc1cc(\C=C(\C)Cl)ccc1O Amb27629799 [0,0,0,0,0,1|2,0,0]=3 2681 B13R1.52 COc1cc(\C=C(\C)F)ccc1O Amb25987694 [0,0,0,0,0,1|2,0,0]=3 2682 B13R1.52 COc1nc(CC(=O)O)ccc1Br Amb27947548 [0,0,0,0,0,1|2,0,0]=3 2683 B13R1.52 COc1nc(CC(=O)O)ncc1F Amb27965750 [0,0,0,0,0,1|3,0,0]=4 2684 B13R1.52 COc1nc(CC(C)=O)ccc1F Amb28071488 [0,0,0,0,0,1|3,0,0]=4 2685 B13R1.52 CSc1cc(CC(=O)O)ccc1C Amb24445123 [0,0,0,0,0,1|1,1,0]=3 2686 B13R1.52 CSc1cc(CC(=O)O)ccc1Cl Amb25066420 [0,0,0,0,0,1|1,1,0]=3 2687 B13R1.52 CSc1cc(CC(=O)O)ccc1F Amb28321986 [0,0,0,0,0,1|1,1,0]=3 2688 B13R1.52 CSc1cc(CC(=O)O)ccc1I Amb25896346 [0,0,0,0,0,1|1,1,0]=3 2689 B13R1.52 CSc1cc(CC(=O)O)ccc1N Amb24367748 [0,0,0,0,0,1|1,1,0]=3 2690 B13R1.52 CSc1cc(CC(=O)O)ccc1O Amb24494748 [0,0,0,0,0,1|0,1,0]=2 2691 B13R1.52 CSc1cc(CC(C)=O)ccc1I Amb27258184 [0,0,0,0,0,1|2,1,0]=4 2692 B13R1.52 CSc1cc(CC(C)=O)ccc1O Amb28133054 [0,0,0,0,0,1|1,1,0]=3 2693 B13R1.52 CSc1cc(NC(C)=O)ccc1C Amb24490462 [0,0,0,0,0,1|2,1,0]=4 2694 B13R1.52 CSc1cc(NC(C)=O)ccc1Cl Amb24491992 [0,0,0,0,0,1|2,1,0]=4 2695 B13R1.52 CSc1cc(NC(C)=O)ccc1F Amb26079431 [0,0,0,0,0,1|2,1,0]=4 2696 B13R1.52 CSc1cc(NC(C)=O)ccc1I Amb27764296 [0,0,0,0,0,1|2,1,0]=4 2697 B13R1.52 CSc1cc(NC(C)=O)ccc1N Amb27173828 [0,0,0,0,0,1|2,1,0]=4 2698 B13R1.52 CSc1cc(NC(C)=O)ccc1O Amb17617825 [0,0,0,0,0,1|1,1,0]=3 2699 B13R1.52 Cc1ccc(CC(=O)O)cc1C#N Amb22235525 [0,0,0,0,0,1|3,0,0]=4 2700 B13R1.52 Cc1ccc(CC(=O)O)cc1NN Amb27210036 [0,0,0,0,0,1|3,0,0]=4 2701 B13R1.52 N#Cc1cc(CC(=O)O)ccc1Br Amb26574773 [0,0,0,0,0,1|3,0,0]=4 2702 B13R1.52 N#Cc1cc(CC(=O)O)ccc1Cl Amb26600999 [0,0,0,0,0,1|3,0,0]=4 2703 B13R1.52 N#Cc1cc(CC(=O)O)ccc1F Amb10840729 [0,0,0,0,0,1|3,0,0]=4 2704 B13R1.52 N#Cc1cc(CC(=O)O)ccc1I Amb24491995 [0,0,0,0,0,1|3,0,0]=4 2705 B13R1.52 N#Cc1cc(CC(=O)O)ccc1O Amb25188036 [0,0,0,0,0,1|2,0,0]=3 2706 B13R1.52 N#Cc1cc(CC(=O)O)ccc1S Amb25094440 [0,0,0,0,0,1|2,1,0]=4 2707 B13R1.52 NCc1cc(CC(=O)O)ccc1F Amb28345536 [0,0,0,0,0,1|3,0,0]=4 2708 B13R1.52 O=C(O)Cc1ccc(Cl)c(CBr)c1 Amb27484780 [0,0,0,0,0,1|3,0,0]=4 2709 B13R1.52 O=C(O)Cc1ccc(F)c(CBr)c1 Amb24057278 [0,0,0,0,0,1|3,0,0]=4 2710 B13R1.52 O=Cc1cc(CC(=O)O)ccc1F Amb27844610 [0,0,0,0,0,1|3,0,0]=4 2711 B13R1.52 O=Cc1cc(CC(=O)O)ccc1O Amb27217606 [0,0,0,0,0,1|2,0,0]=3 2712 B13R1.2260 COC1=CC(C(C)O)=CC=CC1=O Amb28064191 [0,0,0,0,0,1|1,0,2]=4 2713 B13R1.3094 CNC1=CC=C(C(=O)O)C=CC1=O Amb27984798 [0,0,0,0,0,1|1,0,1]=3 2714 B13R1.3094 COC1=CC=C(N(=O)=O)C=CC1=O Amb22554215 [0,0,0,0,0,1|1,0,2]=4 2715 B10R0.57 O=C(O)\C=C\C(=O)\C(O)=C\O Amb27757567 [1,0,1,0,0,0|1,0,1]=4 2716 B10R0.82 C\C(=C/C=C(\O)C=O)C(=O)O Amb27645488 [1,0,1,0,0,0|0,0,2]=4 2717 B10R0.55 COC(=O)\C=C/C=C\C(C)=O Amb27672212 [1,0,1,0,0,0|2,0,0]=4 2718 B10R0.55 COC(=O)\C=C\C=C/C(C)=O Amb27672213 [1,0,1,0,0,0|2,0,0]=4 2719 B10R0.55 COC(=O)\C=C\C=C\C(=O)O Amb17593891 [1,0,1,0,0,0|1,0,0]=3 2720 B10R0.55 COC(=O)\C=C\C=C\C(C)=O Amb27673586 [1,0,1,0,0,0|2,0,0]=4 2721 B10R0.83 COC(=O)\C(O)=C\C=C\C=O Amb17850706 [1,0,1,0,0,0|1,0,0]=3 2722 B10R0.98 CC(=O)\C(C)=C\C=C\C(=O)O Amb28122398 [1,0,1,0,0,0|2,0,0]=4 2723 B10R0.98 O=C(O)\C=C/C=C(/Cl)C(=O)O Amb27166062 [1,0,1,0,0,0|2,0,0]=4 2724 B10R0.98 O=C(O)\C=C\C=C(/O)C(=O)O Amb28325659 [1,0,1,0,0,0|1,0,0]=3 2725 B10R1.13 C=C(C)c1ccc(O)cc1 Amb13883631 [2,0,0,0,0,0|2,0,0]=4 2726 B10R1.13 C=C1C=CC(C(=O)O)C=C1 Amb28340914 [2,0,0,0,0,0|1,0,1]=4 2727 B10R1.13 CC(=O)c1ccc(Br)cc1 Amb1221363 [2,0,0,0,0,0|2,0,0]=4 2728 B10R1.13 CC(=O)c1ccc(C)cc1 Amb2447132 [2,0,0,0,0,0|2,0,0]=4 2729 B10R1.13 CC(=O)c1ccc(Cl)cc1 Amb2685747 [2,0,0,0,0,0|2,0,0]=4 2730 B10R1.13 CC(=O)c1ccc(F)cc1 Amb2688007 [2,0,0,0,0,0|2,0,0]=4 2731 B10R1.13 CC(=O)c1ccc(I)cc1 Amb1233200 [2,0,0,0,0,0|2,0,0]=4 2732 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [2,0,0,0,0,0|2,0,0]=4 2733 B10R1.13 CC(=O)c1ccc(N)cc1 Amb534112 [2,0,0,0,0,0|2,0,0]=4 2734 B10R1.13 CC(=O)c1ccc(O)cc1 Amb1212250 [2,0,0,0,0,0|1,0,0]=3 2735 B10R1.13 CC(=O)c1ccc(O)cn1 Amb16231971 [2,0,0,0,0,0|2,0,0]=4 2736 B10R1.13 CC(=O)c1ccc(S)cc1 Amb17593795 [2,0,0,0,0,0|1,1,0]=4 2737 B10R1.13 CC(O)=C1C=CC(=O)C=C1 Amb24480664 [2,0,0,0,0,0|1,0,1]=4 2738 B10R1.13 CC(O)c1ccc(O)cc1 Amb9748260 [2,0,0,0,0,0|1,0,1]=4 2739 B10R1.13 CS(=O)c1ccc(O)cc1 Amb17873067 [2,0,0,0,0,0|2,0,0]=4 2740 B10R1.13 C[C@@H](O)c1ccc(O)cc1 Amb25273162 [2,0,0,0,0,0|1,0,1]=4 2741 B10R1.13 C[C@H](O)c1ccc(O)cc1 Amb24644699 [2,0,0,0,0,0|1,0,1]=4 2742 B10R1.13 Cc1ccc(C(=O)Cl)cc1 Amb3939031 [2,0,0,0,0,0|2,0,0]=4 2743 B10R1.13 Cc1ccc(C(=O)F)cc1 Amb27791617 [2,0,0,0,0,0|2,0,0]=4 2744 B10R1.13 Cc1ccc(C(=O)O)cc1 Amb2609016 [2,0,0,0,0,0|1,0,0]=3 2745 B10R1.13 Cc1ccc(C(=O)O)cn1 Amb2371808 [2,0,0,0,0,0|2,0,0]=4 2746 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb22276156 [2,0,0,0,0,0|2,0,0]=4 2747 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb33550856 [2,0,0,0,0,0|2,0,0]=4 2748 B10R1.13 Cc1ccc(C(=O)O)nc1 Amb8386316 [2,0,0,0,0,0|2,0,0]=4 2749 B10R1.13 Cc1ccc(C(N)=O)cc1 Amb6335792 [2,0,0,0,0,0|2,0,0]=4 2750 B10R1.13 Cc1ccc(S(=O)O)cc1 Amb22436806 [2,0,0,0,0,0|2,0,0]=4 2751 B10R1.13 Cc1ccc(S(=O)O)cc1 Amb6843901 [2,0,0,0,0,0|2,0,0]=4 2752 B10R1.13 Cc1ccc([PH](=O)O)cc1 Amb3371950 [2,0,0,0,0,0|2,0,0]=4 2753 B10R1.13 N=C(N)c1ccc(O)cc1 Amb2691367 [2,0,0,0,0,0|2,0,0]=4 2754 B10R1.13 N=C(N)c1ccc(O)cc1 Amb2696161 [2,0,0,0,0,0|2,0,0]=4 2755 B10R1.13 NC(=O)c1ccc(Br)cc1 Amb1232839 [2,0,0,0,0,0|2,0,0]=4 2756 B10R1.13 NC(=O)c1ccc(Cl)cc1 Amb2778205 [2,0,0,0,0,0|2,0,0]=4 2757 B10R1.13 NC(=O)c1ccc(F)cc1 Amb1230540 [2,0,0,0,0,0|2,0,0]=4 2758 B10R1.13 NC(=O)c1ccc(I)cc1 Amb2227687 [2,0,0,0,0,0|2,0,0]=4 2759 B10R1.13 NC(=O)c1ccc(N)cc1 Amb6364742 [2,0,0,0,0,0|2,0,0]=4 2760 B10R1.13 NC(=O)c1ccc(O)cc1 Amb1240570 [2,0,0,0,0,0|1,0,0]=3 2761 B10R1.13 NC(=O)c1ccc(O)cc1 Amb13951374 [2,0,0,0,0,0|1,0,0]=3 2762 B10R1.13 NC(=O)c1ccc(O)cn1 Amb27175316 [2,0,0,0,0,0|2,0,0]=4 2763 B10R1.13 NC(=O)c1ccc(O)nc1 Amb2371669 [2,0,0,0,0,0|2,0,0]=4 2764 B10R1.13 NC(=O)c1ccc(S)cc1 Amb27471980 [2,0,0,0,0,0|1,1,0]=4 2765 B10R1.13 NC(=S)c1ccc(O)cc1 Amb1154194 [2,0,0,0,0,0|1,1,0]=4 2766 B10R1.13 Nc1ccc(C(=O)Br)cc1 Amb28186157 [2,0,0,0,0,0|2,0,0]=4 2767 B10R1.13 Nc1ccc(C(=O)Cl)cc1 Amb2609001 [2,0,0,0,0,0|2,0,0]=4 2768 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb24066899 [2,0,0,0,0,0|1,0,0]=3 2769 B10R1.13 Nc1ccc(C(=O)O)cc1 Amb6238177 [2,0,0,0,0,0|1,0,0]=3 2770 B10R1.13 Nc1ccc(C(=O)O)cn1 Amb1215277 [2,0,0,0,0,0|2,0,0]=4 2771 B10R1.13 Nc1ccc(C(=O)O)cn1 Amb2697552 [2,0,0,0,0,0|2,0,0]=4 2772 B10R1.13 Nc1ccc(C(=O)O)nc1 Amb2612660 [2,0,0,0,0,0|2,0,0]=4 2773 B10R1.13 Nc1ccc(C(=O)O)nc1 Amb2697551 [2,0,0,0,0,0|2,0,0]=4 2774 B10R1.13 Nc1ccc(C(=O)[O-])cc1 Amb6296721 [2,0,0,0,0,0|1,0,1]=4 2775 B10R1.13 Nc1ccc(C(=O)[O-])cc1 Amb6366456 [2,0,0,0,0,0|1,0,1]=4 2776 B10R1.13 Nc1ccc(S(=O)O)cc1 Amb6374224 [2,0,0,0,0,0|2,0,0]=4 2777 B10R1.13 O=C(Cl)c1ccc(Br)cc1 Amb2684956 [2,0,0,0,0,0|2,0,0]=4 2778 B10R1.13 O=C(Cl)c1ccc(Cl)cc1 Amb3939199 [2,0,0,0,0,0|2,0,0]=4 2779 B10R1.13 O=C(Cl)c1ccc(F)cc1 Amb2688034 [2,0,0,0,0,0|2,0,0]=4 2780 B10R1.13 O=C(Cl)c1ccc(I)cc1 Amb3939136 [2,0,0,0,0,0|2,0,0]=4 2781 B10R1.13 O=C(Cl)c1ccc(O)cc1 Amb6743399 [2,0,0,0,0,0|1,0,0]=3 2782 B10R1.13 O=C(Cl)c1ccc(O)cn1 Amb27860850 [2,0,0,0,0,0|2,0,0]=4 2783 B10R1.13 O=C(F)c1ccc(Br)cc1 Amb27403647 [2,0,0,0,0,0|2,0,0]=4 2784 B10R1.13 O=C(F)c1ccc(Cl)cc1 Amb27798433 [2,0,0,0,0,0|2,0,0]=4 2785 B10R1.13 O=C(F)c1ccc(F)cc1 Amb27871316 [2,0,0,0,0,0|2,0,0]=4 2786 B10R1.13 O=C(O)C1=CNC(=S)C=C1 Amb18947773 [2,0,0,0,0,0|1,1,0]=4 2787 B10R1.13 O=C(O)C1=CNC(O)C=C1 Amb27783769 [2,0,0,0,0,0|1,0,1]=4 2788 B10R1.13 O=C(O)c1cc[n+]([O-])cc1 Amb751855 [2,0,0,0,0,0|1,0,1]=4 2789 B10R1.13 O=C(O)c1ccc(Br)cc1 Amb1935068 [2,0,0,0,0,0|1,0,0]=3 2790 B10R1.13 O=C(O)c1ccc(Br)cn1 Amb2447466 [2,0,0,0,0,0|2,0,0]=4 2791 B10R1.13 O=C(O)c1ccc(Br)nc1 Amb2611408 [2,0,0,0,0,0|2,0,0]=4 2792 B10R1.13 O=C(O)c1ccc(Cl)cc1 Amb2792854 [2,0,0,0,0,0|1,0,0]=3 2793 B10R1.13 O=C(O)c1ccc(Cl)cn1 Amb6384305 [2,0,0,0,0,0|2,0,0]=4 2794 B10R1.13 O=C(O)c1ccc(Cl)nc1 Amb535150 [2,0,0,0,0,0|2,0,0]=4 2795 B10R1.13 O=C(O)c1ccc(F)cc1 Amb2688024 [2,0,0,0,0,0|1,0,0]=3 2796 B10R1.13 O=C(O)c1ccc(F)cn1 Amb33069076 [2,0,0,0,0,0|2,0,0]=4 2797 B10R1.13 O=C(O)c1ccc(F)cn1 Amb6306446 [2,0,0,0,0,0|2,0,0]=4 2798 B10R1.13 O=C(O)c1ccc(F)nc1 Amb2447507 [2,0,0,0,0,0|2,0,0]=4 2799 B10R1.13 O=C(O)c1ccc(I)cc1 Amb6446256 [2,0,0,0,0,0|1,0,0]=3 2800 B10R1.13 O=C(O)c1ccc(I)cn1 Amb33548875 [2,0,0,0,0,0|2,0,0]=4 2801 B10R1.13 O=C(O)c1ccc(O)cc1 Amb2569657 [2,0,0,0,0,0|0,0,0]=2 2802 B10R1.13 O=C(O)c1ccc(O)cn1 Amb2235994 [2,0,0,0,0,0|1,0,0]=3 2803 B10R1.13 O=C(O)c1ccc(O)cn1 Amb2697988 [2,0,0,0,0,0|1,0,0]=3 2804 B10R1.13 O=C(O)c1ccc(O)cn1 Amb30594273 [2,0,0,0,0,0|1,0,0]=3 2805 B10R1.13 O=C(O)c1ccc(O)nc1 Amb1085852 [2,0,0,0,0,0|1,0,0]=3 2806 B10R1.13 O=C(O)c1ccc(O)nn1 Amb17755179 [2,0,0,0,0,0|2,0,0]=4 2807 B10R1.13 O=C(O)c1ccc(O)nn1 Amb30634341 [2,0,0,0,0,0|2,0,0]=4 2808 B10R1.13 O=C(O)c1ccc(S)cc1 Amb2371749 [2,0,0,0,0,0|0,1,0]=3 2809 B10R1.13 O=C(O)c1ccc(S)cn1 Amb18644721 [2,0,0,0,0,0|1,1,0]=4 2810 B10R1.13 O=C(O)c1cnc(O)cn1 Amb6892308 [2,0,0,0,0,0|2,0,0]=4 2811 B10R1.13 O=C(O)c1cnc(O)nc1 Amb10067812 [2,0,0,0,0,0|2,0,0]=4 2812 B10R1.13 O=C(O)c1ncc(O)cn1 Amb18831952 [2,0,0,0,0,0|2,0,0]=4 2813 B10R1.13 O=C([O-])c1ccc(F)cc1 Amb8397065 [2,0,0,0,0,0|1,0,1]=4 2814 B10R1.13 O=C([O-])c1ccc(O)cc1 Amb8517584 [2,0,0,0,0,0|0,0,1]=3 2815 B10R1.13 O=C1C=CC(C(=O)O)=CN1 Amb18028595 [2,0,0,0,0,0|1,0,1]=4 2816 B10R1.13 O=C1C=CC(C(=O)O)=CO1 Amb19723416 [2,0,0,0,0,0|1,0,1]=4 2817 B10R1.13 O=C1C=CC(C(=O)O)=CO1 Amb20661802 [2,0,0,0,0,0|1,0,1]=4 2818 B10R1.13 O=N(=O)c1ccc(O)cc1 Amb20621866 [2,0,0,0,0,0|1,0,1]=4 2819 B10R1.13 O=S(O)c1ccc(Br)cc1 Amb18570792 [2,0,0,0,0,0|2,0,0]=4 2820 B10R1.13 O=S(O)c1ccc(Cl)cc1 Amb18564047 [2,0,0,0,0,0|2,0,0]=4 2821 B10R1.13 O=S(O)c1ccc(F)cc1 Amb18065461 [2,0,0,0,0,0|2,0,0]=4 2822 B10R1.13 O=S(O)c1ccc(O)cc1 Amb27768727 [2,0,0,0,0,0|1,0,0]=3 2823 B10R1.13 O=S([O-])c1ccc(O)cc1 Amb32754881 [2,0,0,0,0,0|1,0,1]=4 2824 B10R1.13 O=[N+]([O-])c1ccc(O)cc1 Amb17679040 [2,0,0,0,0,0|1,0,1]=4 2825 B10R1.13 O=[PH](O)c1ccc(Cl)cc1 Amb348488 [2,0,0,0,0,0|2,0,0]=4 2826 B10R1.13 O=[Se](O)c1ccc(Cl)cc1 Amb9809799 [2,0,0,0,0,0|2,0,0]=4 2827 B10R1.13 OB(O)c1ccc(O)cc1 Amb2447026 [2,0,0,0,0,0|1,0,1]=4 2828 B10R1.113 C=C(C)c1cccc(C)c1 Amb10844683 [2,0,0,0,0,0|2,0,0]=4 2829 B10R1.113 C=C(C)c1cccc(O)c1 Amb18124424 [2,0,0,0,0,0|2,0,0]=4 2830 B10R1.113 CC(=O)c1cc(C)ccn1 Amb8392275 [2,0,0,0,0,0|2,0,0]=4 2831 B10R1.113 CC(=O)c1cc(O)ccn1 Amb23399916 [2,0,0,0,0,0|2,0,0]=4 2832 B10R1.113 CC(=O)c1ccc[n+](C)c1 Amb32455996 [2,0,0,0,0,0|2,0,0]=4 2833 B10R1.113 CC(=O)c1cccc(Br)c1 Amb2684932 [2,0,0,0,0,0|2,0,0]=4 2834 B10R1.113 CC(=O)c1cccc(C)c1 Amb3940080 [2,0,0,0,0,0|1,0,0]=3 2835 B10R1.113 CC(=O)c1cccc(C)n1 Amb10069245 [2,0,0,0,0,0|2,0,0]=4 2836 B10R1.113 CC(=O)c1cccc(Cl)c1 Amb3940078 [2,0,0,0,0,0|2,0,0]=4 2837 B10R1.113 CC(=O)c1cccc(F)c1 Amb2688006 [2,0,0,0,0,0|2,0,0]=4 2838 B10R1.113 CC(=O)c1cccc(I)c1 Amb2688831 [2,0,0,0,0,0|2,0,0]=4 2839 B10R1.113 CC(=O)c1cccc(N)c1 Amb2684314 [2,0,0,0,0,0|2,0,0]=4 2840 B10R1.113 CC(=O)c1cccc(O)c1 Amb2792768 [2,0,0,0,0,0|1,0,0]=3 2841 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [2,0,0,0,0,0|1,1,0]=4 2842 B10R1.113 CC(=O)c1ccnc(C)c1 Amb19957654 [2,0,0,0,0,0|2,0,0]=4 2843 B10R1.113 CC(=O)c1ccnc(O)c1 Amb27259914 [2,0,0,0,0,0|2,0,0]=4 2844 B10R1.113 CC(=O)c1cncc(C)c1 Amb21964245 [2,0,0,0,0,0|2,0,0]=4 2845 B10R1.113 CC(=O)c1cncc(O)c1 Amb23399982 [2,0,0,0,0,0|2,0,0]=4 2846 B10R1.113 CC(O)c1cccc(O)c1 Amb6705775 [2,0,0,0,0,0|1,0,1]=4 2847 B10R1.113 CS(=O)c1cccc(O)c1 Amb26343856 [2,0,0,0,0,0|2,0,0]=4 2848 B10R1.113 C[C@@H](O)c1cccc(O)c1 Amb13952964 [2,0,0,0,0,0|1,0,1]=4 2849 B10R1.113 C[C@H](O)c1cccc(O)c1 Amb13952963 [2,0,0,0,0,0|1,0,1]=4 2850 B10R1.113 C[n+]1cccc(C(=O)O)c1 Amb2609599 [2,0,0,0,0,0|1,0,0]=3 2851 B10R1.113 C[n+]1cccc(C(=O)[O-])c1 Amb2613156 [2,0,0,0,0,0|1,0,1]=4 2852 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb17778548 [2,0,0,0,0,0|2,0,0]=4 2853 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb2609608 [2,0,0,0,0,0|2,0,0]=4 2854 B10R1.113 C[n+]1cccc(C(N)=O)c1 Amb6366501 [2,0,0,0,0,0|2,0,0]=4 2855 B10R1.113 Cc1cc(C(=O)Cl)ccn1 Amb25138191 [2,0,0,0,0,0|2,0,0]=4 2856 B10R1.113 Cc1cc(C(=O)O)ccn1 Amb33313466 [2,0,0,0,0,0|1,0,0]=3 2857 B10R1.113 Cc1cc(C(=O)O)ccn1 Amb33545061 [2,0,0,0,0,0|1,0,0]=3 2858 B10R1.113 Cc1cc(C(=O)O)cnn1 Amb24505306 [2,0,0,0,0,0|2,0,0]=4 2859 B10R1.113 Cc1cc(C(=O)O)cnn1 Amb28555551 [2,0,0,0,0,0|2,0,0]=4 2860 B10R1.113 Cc1cc(C(=O)O)ncn1 Amb18948013 [2,0,0,0,0,0|2,0,0]=4 2861 B10R1.113 Cc1cc(C(N)=O)ccn1 Amb22496777 [2,0,0,0,0,0|2,0,0]=4 2862 B10R1.113 Cc1cccc(B(O)O)c1 Amb22044323 [2,0,0,0,0,0|1,0,1]=4 2863 B10R1.113 Cc1cccc(B(O)O)c1 Amb2447082 [2,0,0,0,0,0|1,0,1]=4 2864 B10R1.113 Cc1cccc(C(=N)N)c1 Amb2696293 [2,0,0,0,0,0|2,0,0]=4 2865 B10R1.113 Cc1cccc(C(=N)N)c1 Amb2726132 [2,0,0,0,0,0|2,0,0]=4 2866 B10R1.113 Cc1cccc(C(=O)Br)n1 Amb26869433 [2,0,0,0,0,0|2,0,0]=4 2867 B10R1.113 Cc1cccc(C(=O)Cl)c1 Amb3939040 [2,0,0,0,0,0|1,0,0]=3 2868 B10R1.113 Cc1cccc(C(=O)Cl)n1 Amb10610376 [2,0,0,0,0,0|2,0,0]=4 2869 B10R1.113 Cc1cccc(C(=O)O)c1 Amb2609027 [2,0,0,0,0,0|0,0,0]=2 2870 B10R1.113 Cc1cccc(C(=O)O)n1 Amb24081761 [2,0,0,0,0,0|1,0,0]=3 2871 B10R1.113 Cc1cccc(C(=O)O)n1 Amb2612995 [2,0,0,0,0,0|1,0,0]=3 2872 B10R1.113 Cc1cccc(C(C)O)c1 Amb33527067 [2,0,0,0,0,0|1,0,1]=4 2873 B10R1.113 Cc1cccc(C(N)=O)c1 Amb2720843 [2,0,0,0,0,0|1,0,0]=3 2874 B10R1.113 Cc1cccc(C(N)=O)n1 Amb8858808 [2,0,0,0,0,0|2,0,0]=4 2875 B10R1.113 Cc1cccc(C(N)=S)c1 Amb6549110 [2,0,0,0,0,0|1,1,0]=4 2876 B10R1.113 Cc1cccc(C(O)=S)c1 Amb24535989 [2,0,0,0,0,0|0,1,0]=3 2877 B10R1.113 Cc1cccc(S(=O)Cl)c1 Amb18065521 [2,0,0,0,0,0|2,0,0]=4 2878 B10R1.113 Cc1cccc(S(=O)O)c1 Amb18563469 [2,0,0,0,0,0|1,0,0]=3 2879 B10R1.113 Cc1cccc(S(=O)O)n1 Amb32992461 [2,0,0,0,0,0|2,0,0]=4 2880 B10R1.113 Cc1cccc(S(=O)[O-])c1 Amb19944453 [2,0,0,0,0,0|1,0,1]=4 2881 B10R1.113 Cc1cccc(S(C)=O)c1 Amb19892225 [2,0,0,0,0,0|2,0,0]=4 2882 B10R1.113 Cc1cccc([C@@H](C)O)c1 Amb24476868 [2,0,0,0,0,0|1,0,1]=4 2883 B10R1.113 Cc1cccc([C@H](C)O)c1 Amb25335556 [2,0,0,0,0,0|1,0,1]=4 2884 B10R1.113 Cc1cccc([N+](=O)[O-])c1 Amb6297214 [2,0,0,0,0,0|1,0,1]=4 2885 B10R1.113 Cc1ccnc(C(=O)O)c1 Amb22490414 [2,0,0,0,0,0|1,0,0]=3 2886 B10R1.113 Cc1ccnc(C(=O)O)c1 Amb2795204 [2,0,0,0,0,0|1,0,0]=3 2887 B10R1.113 Cc1ccnc(C(=O)O)n1 Amb33204433 [2,0,0,0,0,0|2,0,0]=4 2888 B10R1.113 Cc1ccnc(C(=O)O)n1 Amb8010644 [2,0,0,0,0,0|2,0,0]=4 2889 B10R1.113 Cc1ccnc(C(N)=O)c1 Amb16231199 [2,0,0,0,0,0|2,0,0]=4 2890 B10R1.113 Cc1ccnc(S(=O)O)c1 Amb32992447 [2,0,0,0,0,0|2,0,0]=4 2891 B10R1.113 Cc1cncc(C(=O)O)c1 Amb10068354 [2,0,0,0,0,0|1,0,0]=3 2892 B10R1.113 Cc1cncc(C(=O)O)c1 Amb2694191 [2,0,0,0,0,0|1,0,0]=3 2893 B10R1.113 Cc1cncc(C(=O)O)n1 Amb8011544 [2,0,0,0,0,0|2,0,0]=4 2894 B10R1.113 Cc1cncc(C(N)=O)c1 Amb8388683 [2,0,0,0,0,0|2,0,0]=4 2895 B10R1.113 Cc1cnnc(C(=O)O)c1 Amb18832254 [2,0,0,0,0,0|2,0,0]=4 2896 B10R1.113 Cc1nccc(C(=O)O)n1 Amb10602122 [2,0,0,0,0,0|2,0,0]=4 2897 B10R1.113 N=C(N)c1cccc(O)c1 Amb33552630 [2,0,0,0,0,0|2,0,0]=4 2898 B10R1.113 N=C(N)c1cccc(O)c1 Amb8831695 [2,0,0,0,0,0|2,0,0]=4 2899 B10R1.113 NC(=O)c1cccc(Br)c1 Amb2716206 [2,0,0,0,0,0|2,0,0]=4 2900 B10R1.113 NC(=O)c1cccc(Cl)c1 Amb1218066 [2,0,0,0,0,0|2,0,0]=4 2901 B10R1.113 NC(=O)c1cccc(F)c1 Amb3886563 [2,0,0,0,0,0|2,0,0]=4 2902 B10R1.113 NC(=O)c1cccc(I)c1 Amb3887764 [2,0,0,0,0,0|2,0,0]=4 2903 B10R1.113 NC(=O)c1cccc(N)c1 Amb1106189 [2,0,0,0,0,0|2,0,0]=4 2904 B10R1.113 NC(=O)c1cccc(O)c1 Amb3939531 [2,0,0,0,0,0|1,0,0]=3 2905 B10R1.113 NC(=O)c1cccc(O)n1 Amb24182048 [2,0,0,0,0,0|2,0,0]=4 2906 B10R1.113 NC(=O)c1cccc(S)c1 Amb24059371 [2,0,0,0,0,0|1,1,0]=4 2907 B10R1.113 NC(=O)c1cncc(O)c1 Amb33541953 [2,0,0,0,0,0|2,0,0]=4 2908 B10R1.113 NC(=S)c1cccc(O)c1 Amb2688797 [2,0,0,0,0,0|1,1,0]=4 2909 B10R1.113 Nc1cc(C(=O)O)ccn1 Amb842470 [2,0,0,0,0,0|2,0,0]=4 2910 B10R1.113 Nc1cc(C(=O)O)ccn1 Amb8503396 [2,0,0,0,0,0|2,0,0]=4 2911 B10R1.113 Nc1cccc(C(=O)O)c1 Amb1935166 [2,0,0,0,0,0|1,0,0]=3 2912 B10R1.113 Nc1cccc(C(=O)O)n1 Amb1235493 [2,0,0,0,0,0|2,0,0]=4 2913 B10R1.113 Nc1cccc([PH](=O)O)c1 Amb27823374 [2,0,0,0,0,0|2,0,0]=4 2914 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb19958023 [2,0,0,0,0,0|2,0,0]=4 2915 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb2794992 [2,0,0,0,0,0|2,0,0]=4 2916 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb30588548 [2,0,0,0,0,0|2,0,0]=4 2917 B10R1.113 Nc1ccnc(C(=O)O)c1 Amb30640048 [2,0,0,0,0,0|2,0,0]=4 2918 B10R1.113 Nc1cncc(C(=O)O)c1 Amb535918 [2,0,0,0,0,0|2,0,0]=4 2919 B10R1.113 O=C(Br)c1cccc(Br)c1 Amb27633153 [2,0,0,0,0,0|2,0,0]=4 2920 B10R1.113 O=C(Cl)c1cc(O)ccn1 Amb27199840 [2,0,0,0,0,0|2,0,0]=4 2921 B10R1.113 O=C(Cl)c1cccc(Br)c1 Amb2691918 [2,0,0,0,0,0|2,0,0]=4 2922 B10R1.113 O=C(Cl)c1cccc(Cl)c1 Amb3939312 [2,0,0,0,0,0|2,0,0]=4 2923 B10R1.113 O=C(Cl)c1cccc(F)c1 Amb2688033 [2,0,0,0,0,0|2,0,0]=4 2924 B10R1.113 O=C(Cl)c1cccc(I)c1 Amb3939575 [2,0,0,0,0,0|2,0,0]=4 2925 B10R1.113 O=C(F)c1cccc(Br)c1 Amb28315574 [2,0,0,0,0,0|2,0,0]=4 2926 B10R1.113 O=C(F)c1cccc(Cl)c1 Amb28046129 [2,0,0,0,0,0|2,0,0]=4 2927 B10R1.113 O=C(O)C1=CC(=S)NC=C1 Amb19514542 [2,0,0,0,0,0|1,1,0]=4 2928 B10R1.113 O=C(O)c1cc(Br)ccn1 Amb2541475 [2,0,0,0,0,0|2,0,0]=4 2929 B10R1.113 O=C(O)c1cc(Cl)ccn1 Amb1106613 [2,0,0,0,0,0|2,0,0]=4 2930 B10R1.113 O=C(O)c1cc(F)ccn1 Amb19958323 [2,0,0,0,0,0|2,0,0]=4 2931 B10R1.113 O=C(O)c1cc(I)ccn1 Amb10975473 [2,0,0,0,0,0|2,0,0]=4 2932 B10R1.113 O=C(O)c1cc(I)ccn1 Amb2540668 [2,0,0,0,0,0|2,0,0]=4 2933 B10R1.113 O=C(O)c1cc(O)ccn1 Amb1303199 [2,0,0,0,0,0|1,0,0]=3 2934 B10R1.113 O=C(O)c1cc(O)ncn1 Amb2591546 [2,0,0,0,0,0|2,0,0]=4 2935 B10R1.113 O=C(O)c1cc(S)ccn1 Amb18278971 [2,0,0,0,0,0|1,1,0]=4 2936 B10R1.113 O=C(O)c1cccc(Br)c1 Amb264315 [2,0,0,0,0,0|1,0,0]=3 2937 B10R1.113 O=C(O)c1cccc(Br)n1 Amb2610030 [2,0,0,0,0,0|2,0,0]=4 2938 B10R1.113 O=C(O)c1cccc(Cl)c1 Amb2223069 [2,0,0,0,0,0|1,0,0]=3 2939 B10R1.113 O=C(O)c1cccc(Cl)n1 Amb33544792 [2,0,0,0,0,0|2,0,0]=4 2940 B10R1.113 O=C(O)c1cccc(F)c1 Amb2688023 [2,0,0,0,0,0|1,0,0]=3 2941 B10R1.113 O=C(O)c1cccc(F)c1 Amb33513022 [2,0,0,0,0,0|1,0,0]=3 2942 B10R1.113 O=C(O)c1cccc(F)n1 Amb2688411 [2,0,0,0,0,0|2,0,0]=4 2943 B10R1.113 O=C(O)c1cccc(I)c1 Amb6456607 [2,0,0,0,0,0|1,0,0]=3 2944 B10R1.113 O=C(O)c1cccc(I)n1 Amb6565075 [2,0,0,0,0,0|2,0,0]=4 2945 B10R1.113 O=C(O)c1cccc(O)c1 Amb1208301 [2,0,0,0,0,0|0,0,0]=2 2946 B10R1.113 O=C(O)c1cccc(O)n1 Amb535788 [2,0,0,0,0,0|1,0,0]=3 2947 B10R1.113 O=C(O)c1cccc(S)c1 Amb5721847 [2,0,0,0,0,0|0,1,0]=3 2948 B10R1.113 O=C(O)c1cccc(S)n1 Amb1208363 [2,0,0,0,0,0|1,1,0]=4 2949 B10R1.113 O=C(O)c1cccn(=O)c1 Amb17749046 [2,0,0,0,0,0|1,0,1]=4 2950 B10R1.113 O=C(O)c1ccnc(Br)c1 Amb1353186 [2,0,0,0,0,0|2,0,0]=4 2951 B10R1.113 O=C(O)c1ccnc(Cl)c1 Amb1221736 [2,0,0,0,0,0|2,0,0]=4 2952 B10R1.113 O=C(O)c1ccnc(F)c1 Amb2447269 [2,0,0,0,0,0|2,0,0]=4 2953 B10R1.113 O=C(O)c1ccnc(I)c1 Amb6565049 [2,0,0,0,0,0|2,0,0]=4 2954 B10R1.113 O=C(O)c1ccnc(O)c1 Amb842469 [2,0,0,0,0,0|1,0,0]=3 2955 B10R1.113 O=C(O)c1ccnc(O)n1 Amb21927951 [2,0,0,0,0,0|2,0,0]=4 2956 B10R1.113 O=C(O)c1cncc(Br)c1 Amb1232836 [2,0,0,0,0,0|2,0,0]=4 2957 B10R1.113 O=C(O)c1cncc(Cl)c1 Amb2540665 [2,0,0,0,0,0|2,0,0]=4 2958 B10R1.113 O=C(O)c1cncc(F)c1 Amb8009491 [2,0,0,0,0,0|2,0,0]=4 2959 B10R1.113 O=C(O)c1cncc(I)c1 Amb8630991 [2,0,0,0,0,0|2,0,0]=4 2960 B10R1.113 O=C(O)c1cncc(O)c1 Amb2610681 [2,0,0,0,0,0|1,0,0]=3 2961 B10R1.113 O=C(O)c1cncc(S)c1 Amb26366326 [2,0,0,0,0,0|1,1,0]=4 2962 B10R1.113 O=C(O)c1cncc(S)c1 Amb28555512 [2,0,0,0,0,0|1,1,0]=4 2963 B10R1.113 O=C([O-])c1cccc(F)c1 Amb8397064 [2,0,0,0,0,0|1,0,1]=4 2964 B10R1.113 O=C([O-])c1cccc(O)c1 Amb22277134 [2,0,0,0,0,0|0,0,1]=3 2965 B10R1.113 O=C1C=C(C(=O)O)C=CN1 Amb18124536 [2,0,0,0,0,0|1,0,1]=4 2966 B10R1.113 O=C1C=CC=C(C(=O)O)N1 Amb19514344 [2,0,0,0,0,0|1,0,1]=4 2967 B10R1.113 O=C1C=CC=C(C(=O)O)O1 Amb33533266 [2,0,0,0,0,0|1,0,1]=4 2968 B10R1.113 O=C1C=CNC(C(=O)O)=C1 Amb18832139 [2,0,0,0,0,0|1,0,1]=4 2969 B10R1.113 O=C1C=COC(C(=O)O)=C1 Amb18643476 [2,0,0,0,0,0|1,0,1]=4 2970 B10R1.113 O=N(=O)c1cccc(O)c1 Amb20621867 [2,0,0,0,0,0|1,0,1]=4 2971 B10R1.113 O=S(O)c1cccc(Cl)c1 Amb18564048 [2,0,0,0,0,0|2,0,0]=4 2972 B10R1.113 O=S(O)c1cccc(F)c1 Amb25263422 [2,0,0,0,0,0|2,0,0]=4 2973 B10R1.113 O=S([O-])c1cccc(O)c1 Amb27823656 [2,0,0,0,0,0|1,0,1]=4 2974 B10R1.113 O=[N+]([O-])c1cccc(O)c1 Amb1929299 [2,0,0,0,0,0|1,0,1]=4 2975 B10R1.113 OB(O)c1cccc(O)c1 Amb2447025 [2,0,0,0,0,0|1,0,1]=4 2976 B10R1.113 [NH3+]c1cccc(C(=O)O)c1 Amb6365978 [2,0,0,0,0,0|1,0,0]=3 2977 B10R1.176 C#Cc1ccc(O)c(O)c1 Amb24079174 [2,0,0,0,0,0|1,0,1]=4 2978 B10R1.176 C=Cc1cc(C)c(O)cn1 Amb26888850 [2,0,0,0,0,0|2,0,0]=4 2979 B10R1.176 C=Cc1ccc(Br)c(C)c1 Amb26556463 [2,0,0,0,0,0|2,0,0]=4 2980 B10R1.176 C=Cc1ccc(C)c(C)c1 Amb24749575 [2,0,0,0,0,0|2,0,0]=4 2981 B10R1.176 C=Cc1ccc(C)c(O)c1 Amb28401574 [2,0,0,0,0,0|2,0,0]=4 2982 B10R1.176 C=Cc1ccc(Cl)c(C)c1 Amb25857536 [2,0,0,0,0,0|2,0,0]=4 2983 B10R1.176 C=Cc1ccc(F)c(C)c1 Amb24408128 [2,0,0,0,0,0|2,0,0]=4 2984 B10R1.176 C=Cc1ccc(O)c(Br)c1 Amb33388574 [2,0,0,0,0,0|2,0,0]=4 2985 B10R1.176 C=Cc1ccc(O)c(C)n1 Amb24402281 [2,0,0,0,0,0|2,0,0]=4 2986 B10R1.176 C=Cc1ccc(O)c(Cl)c1 Amb24104203 [2,0,0,0,0,0|2,0,0]=4 2987 B10R1.176 C=Cc1ccc(O)c(F)c1 Amb26653938 [2,0,0,0,0,0|2,0,0]=4 2988 B10R1.176 C=Cc1cnc(O)c(O)c1 Amb26357432 [2,0,0,0,0,0|2,0,0]=4 2989 B10R1.176 CC1=CC(C=O)=CNC1=S Amb23446850 [2,0,0,0,0,0|1,1,0]=4 2990 B10R1.176 CCc1ccc(O)c(C)c1 Amb18643084 [2,0,0,0,0,0|1,0,1]=4 2991 B10R1.176 CCc1ccc(O)c(O)c1 Amb6296662 [2,0,0,0,0,0|1,0,1]=4 2992 B10R1.176 CN1C=C(C=O)C=CC1=O Amb18643126 [2,0,0,0,0,0|1,0,1]=4 2993 B10R1.176 CNc1ccc(O)c(C)c1 Amb24079685 [2,0,0,0,0,0|2,0,0]=4 2994 B10R1.176 COc1ccc(O)c(C)c1 Amb16231155 [2,0,0,0,0,0|2,0,0]=4 2995 B10R1.176 COc1ccc(O)c(O)c1 Amb18554833 [2,0,0,0,0,0|2,0,0]=4 2996 B10R1.176 CSc1ccc(O)c(C)c1 Amb3941011 [2,0,0,0,0,0|2,0,0]=4 2997 B10R1.176 CSc1ccc(O)c(O)c1 Amb26062124 [2,0,0,0,0,0|2,0,0]=4 2998 B10R1.176 Cc1cc(C#N)ccc1O Amb13952425 [2,0,0,0,0,0|1,0,1]=4 2999 B10R1.176 Cc1cc(C=O)ccc1Br Amb17337376 [2,0,0,0,0,0|1,0,0]=3 3000 B10R1.176 Cc1cc(C=O)ccc1Cl Amb2686186 [2,0,0,0,0,0|1,0,0]=3 3001 B10R1.176 Cc1cc(C=O)ccc1F Amb2447643 [2,0,0,0,0,0|1,0,0]=3 3002 B10R1.176 Cc1cc(C=O)ccc1I Amb28315672 [2,0,0,0,0,0|1,0,0]=3 3003 B10R1.176 Cc1cc(C=O)ccc1O Amb3939955 [2,0,0,0,0,0|0,0,0]=2 3004 B10R1.176 Cc1cc(C=O)ccc1S Amb27433713 [2,0,0,0,0,0|0,1,0]=3 3005 B10R1.176 Cc1cc(C=O)cnc1Br Amb19959260 [2,0,0,0,0,0|2,0,0]=4 3006 B10R1.176 Cc1cc(C=O)cnc1C Amb22491621 [2,0,0,0,0,0|2,0,0]=4 3007 B10R1.176 Cc1cc(C=O)cnc1Cl Amb10975414 [2,0,0,0,0,0|2,0,0]=4 3008 B10R1.176 Cc1cc(C=O)cnc1F Amb13890583 [2,0,0,0,0,0|2,0,0]=4 3009 B10R1.176 Cc1cc(C=O)cnc1O Amb22411455 [2,0,0,0,0,0|1,0,0]=3 3010 B10R1.176 Cc1cc(C=O)ncc1Br Amb21963620 [2,0,0,0,0,0|2,0,0]=4 3011 B10R1.176 Cc1cc(C=O)ncc1Cl Amb22489905 [2,0,0,0,0,0|2,0,0]=4 3012 B10R1.176 Cc1cc(C=O)ncc1F Amb27476853 [2,0,0,0,0,0|2,0,0]=4 3013 B10R1.176 Cc1cc(C=O)ncc1N Amb18832460 [2,0,0,0,0,0|2,0,0]=4 3014 B10R1.176 Cc1cc(C=O)ncc1O Amb26539701 [2,0,0,0,0,0|1,0,0]=3 3015 B10R1.176 Cc1cc(CBr)ccc1O Amb26938268 [2,0,0,0,0,0|1,0,1]=4 3016 B10R1.176 Cc1cc(CCl)ccc1O Amb26481292 [2,0,0,0,0,0|1,0,1]=4 3017 B10R1.176 Cc1cc(CN)ccc1O Amb18944098 [2,0,0,0,0,0|1,0,1]=4 3018 B10R1.176 Cc1cc(CN)ccc1O Amb33465347 [2,0,0,0,0,0|1,0,1]=4 3019 B10R1.176 Cc1cc(CO)ccc1Br Amb17471003 [2,0,0,0,0,0|1,0,1]=4 3020 B10R1.176 Cc1cc(CO)ccc1Cl Amb19928754 [2,0,0,0,0,0|1,0,1]=4 3021 B10R1.176 Cc1cc(CO)ccc1F Amb2688197 [2,0,0,0,0,0|1,0,1]=4 3022 B10R1.176 Cc1cc(CO)ccc1N Amb4296985 [2,0,0,0,0,0|1,0,1]=4 3023 B10R1.176 Cc1cc(CO)ccc1O Amb6298428 [2,0,0,0,0,0|0,0,1]=3 3024 B10R1.176 Cc1cc(CO)ncc1O Amb27857491 [2,0,0,0,0,0|1,0,1]=4 3025 B10R1.176 Cc1cc(N=O)ccc1O Amb4034439 [2,0,0,0,0,0|1,0,0]=3 3026 B10R1.176 Cc1cc(NN)ccc1O Amb26994035 [2,0,0,0,0,0|2,0,0]=4 3027 B10R1.176 Cc1cc([N+]#N)ccc1O Amb27409609 [2,0,0,0,0,0|2,0,0]=4 3028 B10R1.176 Cc1ccc(C=O)cc1Br Amb837237 [2,0,0,0,0,0|2,0,0]=4 3029 B10R1.176 Cc1ccc(C=O)cc1C Amb2726166 [2,0,0,0,0,0|1,0,0]=3 3030 B10R1.176 Cc1ccc(C=O)cc1Cl Amb6306223 [2,0,0,0,0,0|2,0,0]=4 3031 B10R1.176 Cc1ccc(C=O)cc1F Amb2688178 [2,0,0,0,0,0|2,0,0]=4 3032 B10R1.176 Cc1ccc(C=O)cc1N Amb18832504 [2,0,0,0,0,0|2,0,0]=4 3033 B10R1.176 Cc1ccc(C=O)cc1O Amb6298096 [2,0,0,0,0,0|1,0,0]=3 3034 B10R1.176 Cc1ccc(C=O)nc1C Amb23454934 [2,0,0,0,0,0|2,0,0]=4 3035 B10R1.176 Cc1ccc(C=O)nc1O Amb26895032 [2,0,0,0,0,0|2,0,0]=4 3036 B10R1.176 Cc1ccc(CO)cc1C Amb2726219 [2,0,0,0,0,0|1,0,1]=4 3037 B10R1.176 Cc1ccc(CO)cc1O Amb27494016 [2,0,0,0,0,0|1,0,1]=4 3038 B10R1.176 Cc1ccc(N=O)cc1O Amb24478299 [2,0,0,0,0,0|2,0,0]=4 3039 B10R1.176 Cc1nc(C=O)ccc1Br Amb21864702 [2,0,0,0,0,0|2,0,0]=4 3040 B10R1.176 Cc1nc(C=O)ccc1F Amb20671022 [2,0,0,0,0,0|2,0,0]=4 3041 B10R1.176 Cc1nc(C=O)ccc1N Amb27617075 [2,0,0,0,0,0|2,0,0]=4 3042 B10R1.176 Cc1nc(C=O)ccc1O Amb27191865 [2,0,0,0,0,0|1,0,0]=3 3043 B10R1.176 Cc1ncc(C=O)cc1O Amb18643113 [2,0,0,0,0,0|2,0,0]=4 3044 B10R1.176 N#Cc1ccc(O)c(O)c1 Amb2721313 [2,0,0,0,0,0|1,0,1]=4 3045 B10R1.176 NCc1ccc(O)c(O)c1 Amb1120981 [2,0,0,0,0,0|1,0,1]=4 3046 B10R1.176 NCc1ccc(O)c(O)c1 Amb33549968 [2,0,0,0,0,0|1,0,1]=4 3047 B10R1.176 NCc1ccc(O)c(O)c1 Amb4037111 [2,0,0,0,0,0|1,0,1]=4 3048 B10R1.176 NNc1ccc(O)c(O)c1 Amb26569814 [2,0,0,0,0,0|2,0,0]=4 3049 B10R1.176 Nc1cc(C=O)ccc1Br Amb18187525 [2,0,0,0,0,0|2,0,0]=4 3050 B10R1.176 Nc1cc(C=O)ccc1Cl Amb18830817 [2,0,0,0,0,0|2,0,0]=4 3051 B10R1.176 Nc1cc(C=O)ccc1F Amb8396794 [2,0,0,0,0,0|2,0,0]=4 3052 B10R1.176 Nc1cc(C=O)ccc1I Amb28315752 [2,0,0,0,0,0|2,0,0]=4 3053 B10R1.176 Nc1cc(C=O)ccc1O Amb17208089 [2,0,0,0,0,0|1,0,0]=3 3054 B10R1.176 Nc1cc(C=O)ccc1O Amb24117570 [2,0,0,0,0,0|1,0,0]=3 3055 B10R1.176 Nc1cc(CO)ccc1O Amb17477834 [2,0,0,0,0,0|1,0,1]=4 3056 B10R1.176 Nc1ccc(C=O)cc1Br Amb22753557 [2,0,0,0,0,0|2,0,0]=4 3057 B10R1.176 Nc1ccc(C=O)cc1Cl Amb22059450 [2,0,0,0,0,0|2,0,0]=4 3058 B10R1.176 Nc1ccc(C=O)cc1I Amb28252269 [2,0,0,0,0,0|2,0,0]=4 3059 B10R1.176 Nc1ccc(C=O)cc1O Amb18832405 [2,0,0,0,0,0|1,0,0]=3 3060 B10R1.176 Nc1ccc(C=O)cc1S Amb32671569 [2,0,0,0,0,0|1,1,0]=4 3061 B10R1.176 Nc1ccc(CO)cc1O Amb24746649 [2,0,0,0,0,0|1,0,1]=4 3062 B10R1.176 O=CC1=CC(=O)C(O)=CN1 Amb18643356 [2,0,0,0,0,0|1,0,1]=4 3063 B10R1.176 O=CC1=CC(=O)C(O)=CO1 Amb24309090 [2,0,0,0,0,0|1,0,1]=4 3064 B10R1.176 O=Cc1cc(Br)c(O)cn1 Amb28203630 [2,0,0,0,0,0|2,0,0]=4 3065 B10R1.176 O=Cc1cc(F)c(O)cn1 Amb25842870 [2,0,0,0,0,0|2,0,0]=4 3066 B10R1.176 O=Cc1cc(O)c(F)cn1 Amb25889969 [2,0,0,0,0,0|2,0,0]=4 3067 B10R1.176 O=Cc1ccc(Br)c(Br)c1 Amb3939907 [2,0,0,0,0,0|2,0,0]=4 3068 B10R1.176 O=Cc1ccc(Br)c(Cl)c1 Amb19889375 [2,0,0,0,0,0|2,0,0]=4 3069 B10R1.176 O=Cc1ccc(Br)c(F)c1 Amb8397115 [2,0,0,0,0,0|2,0,0]=4 3070 B10R1.176 O=Cc1ccc(Br)c(I)c1 Amb19889874 [2,0,0,0,0,0|2,0,0]=4 3071 B10R1.176 O=Cc1ccc(Br)c(O)c1 Amb18810383 [2,0,0,0,0,0|1,0,0]=3 3072 B10R1.176 O=Cc1ccc(Br)c(O)n1 Amb27640994 [2,0,0,0,0,0|2,0,0]=4 3073 B10R1.176 O=Cc1ccc(Cl)c(Br)c1 Amb8397295 [2,0,0,0,0,0|2,0,0]=4 3074 B10R1.176 O=Cc1ccc(Cl)c(Cl)c1 Amb17731352 [2,0,0,0,0,0|2,0,0]=4 3075 B10R1.176 O=Cc1ccc(Cl)c(F)c1 Amb2685931 [2,0,0,0,0,0|2,0,0]=4 3076 B10R1.176 O=Cc1ccc(Cl)c(I)c1 Amb5722301 [2,0,0,0,0,0|2,0,0]=4 3077 B10R1.176 O=Cc1ccc(Cl)c(O)c1 Amb18644874 [2,0,0,0,0,0|1,0,0]=3 3078 B10R1.176 O=Cc1ccc(Cl)c(O)n1 Amb27950393 [2,0,0,0,0,0|2,0,0]=4 3079 B10R1.176 O=Cc1ccc(F)c(Br)c1 Amb535691 [2,0,0,0,0,0|2,0,0]=4 3080 B10R1.176 O=Cc1ccc(F)c(Cl)c1 Amb2404868 [2,0,0,0,0,0|2,0,0]=4 3081 B10R1.176 O=Cc1ccc(F)c(F)c1 Amb2404872 [2,0,0,0,0,0|2,0,0]=4 3082 B10R1.176 O=Cc1ccc(F)c(I)c1 Amb9677796 [2,0,0,0,0,0|2,0,0]=4 3083 B10R1.176 O=Cc1ccc(F)c(O)c1 Amb10067009 [2,0,0,0,0,0|1,0,0]=3 3084 B10R1.176 O=Cc1ccc(F)c(O)n1 Amb25238571 [2,0,0,0,0,0|2,0,0]=4 3085 B10R1.176 O=Cc1ccc(I)c(Br)c1 Amb24057222 [2,0,0,0,0,0|2,0,0]=4 3086 B10R1.176 O=Cc1ccc(I)c(F)c1 Amb10603693 [2,0,0,0,0,0|2,0,0]=4 3087 B10R1.176 O=Cc1ccc(I)c(I)c1 Amb24099136 [2,0,0,0,0,0|2,0,0]=4 3088 B10R1.176 O=Cc1ccc(I)c(O)c1 Amb2722896 [2,0,0,0,0,0|1,0,0]=3 3089 B10R1.176 O=Cc1ccc(O)c(Br)c1 Amb1209778 [2,0,0,0,0,0|1,0,0]=3 3090 B10R1.176 O=Cc1ccc(O)c(Br)n1 Amb25271861 [2,0,0,0,0,0|2,0,0]=4 3091 B10R1.176 O=Cc1ccc(O)c(Cl)c1 Amb1056376 [2,0,0,0,0,0|1,0,0]=3 3092 B10R1.176 O=Cc1ccc(O)c(Cl)n1 Amb18830522 [2,0,0,0,0,0|2,0,0]=4 3093 B10R1.176 O=Cc1ccc(O)c(F)c1 Amb2688105 [2,0,0,0,0,0|1,0,0]=3 3094 B10R1.176 O=Cc1ccc(O)c(F)n1 Amb25299189 [2,0,0,0,0,0|2,0,0]=4 3095 B10R1.176 O=Cc1ccc(O)c(I)c1 Amb1794205 [2,0,0,0,0,0|1,0,0]=3 3096 B10R1.176 O=Cc1ccc(O)c(O)c1 Amb1209685 [2,0,0,0,0,0|0,0,0]=2 3097 B10R1.176 O=Cc1ccc(O)c(O)n1 Amb28196603 [2,0,0,0,0,0|1,0,0]=3 3098 B10R1.176 O=Cc1ccc(S)c(Br)c1 Amb27424793 [2,0,0,0,0,0|1,1,0]=4 3099 B10R1.176 O=Cc1ccc(S)c(F)c1 Amb25094350 [2,0,0,0,0,0|1,1,0]=4 3100 B10R1.176 O=Cc1cnc(Br)c(O)c1 Amb25700464 [2,0,0,0,0,0|2,0,0]=4 3101 B10R1.176 O=Cc1cnc(Cl)c(O)c1 Amb25264655 [2,0,0,0,0,0|2,0,0]=4 3102 B10R1.176 O=Cc1cnc(F)c(O)c1 Amb27201292 [2,0,0,0,0,0|2,0,0]=4 3103 B10R1.176 OCc1cc(O)c(O)cn1 Amb10607292 [2,0,0,0,0,0|1,0,1]=4 3104 B10R1.176 OCc1ccc(Br)c(O)c1 Amb18130883 [2,0,0,0,0,0|1,0,1]=4 3105 B10R1.176 OCc1ccc(Cl)c(O)c1 Amb22501138 [2,0,0,0,0,0|1,0,1]=4 3106 B10R1.176 OCc1ccc(F)c(O)c1 Amb24056019 [2,0,0,0,0,0|1,0,1]=4 3107 B10R1.176 OCc1ccc(I)c(O)c1 Amb2725028 [2,0,0,0,0,0|1,0,1]=4 3108 B10R1.176 OCc1ccc(O)c(Br)c1 Amb2697656 [2,0,0,0,0,0|1,0,1]=4 3109 B10R1.176 OCc1ccc(O)c(Cl)c1 Amb17509697 [2,0,0,0,0,0|1,0,1]=4 3110 B10R1.176 OCc1ccc(O)c(F)c1 Amb8855328 [2,0,0,0,0,0|1,0,1]=4 3111 B10R1.176 OCc1ccc(O)c(I)c1 Amb837475 [2,0,0,0,0,0|1,0,1]=4 3112 B10R1.176 OCc1ccc(O)c(O)c1 Amb6296856 [2,0,0,0,0,0|0,0,1]=3 3113 B10R1.176 Oc1ccc(CBr)cc1O Amb26894887 [2,0,0,0,0,0|1,0,1]=4 3114 B10R1.176 Oc1ccc(CCl)cc1O Amb33256463 [2,0,0,0,0,0|1,0,1]=4 3115 B10R1.176 Oc1ccc(CS)cc1O Amb32788781 [2,0,0,0,0,0|0,1,1]=4 3116 B10R1.172 C#Cc1cccc(C=O)c1 Amb10070110 [2,0,0,0,0,0|1,0,1]=4 3117 B10R1.172 C#Cc1cccc(OC)c1 Amb10071341 [2,0,0,0,0,0|1,0,1]=4 3118 B10R1.172 C=Cc1cc(OC)ccn1 Amb21857205 [2,0,0,0,0,0|2,0,0]=4 3119 B10R1.172 C=Cc1cccc(C=O)c1 Amb17593386 [2,0,0,0,0,0|1,0,1]=4 3120 B10R1.172 C=Cc1cccc(CC)c1 Amb24529283 [2,0,0,0,0,0|2,0,0]=4 3121 B10R1.172 C=Cc1cccc(OC)c1 Amb21962858 [2,0,0,0,0,0|1,0,0]=3 3122 B10R1.172 C=Cc1cccc(OC)n1 Amb20621538 [2,0,0,0,0,0|2,0,0]=4 3123 B10R1.172 C=Cc1cccc(SC)c1 Amb33148833 [2,0,0,0,0,0|1,1,0]=4 3124 B10R1.172 C=Cc1ccnc(OC)c1 Amb20247859 [2,0,0,0,0,0|2,0,0]=4 3125 B10R1.172 C=Cc1cncc(OC)c1 Amb27975411 [2,0,0,0,0,0|2,0,0]=4 3126 B10R1.172 CCc1cc(C=O)ccn1 Amb26556373 [2,0,0,0,0,0|2,0,0]=4 3127 B10R1.172 CCc1cccc(C=O)c1 Amb16231764 [2,0,0,0,0,0|1,0,0]=3 3128 B10R1.172 CCc1cccc(C=O)n1 Amb18643004 [2,0,0,0,0,0|2,0,0]=4 3129 B10R1.172 CCc1cccc(CO)c1 Amb22497287 [2,0,0,0,0,0|1,0,1]=4 3130 B10R1.172 CCc1cccc(OC)c1 Amb4035879 [2,0,0,0,0,0|1,0,1]=4 3131 B10R1.172 CCc1ccnc(C=O)c1 Amb25114155 [2,0,0,0,0,0|2,0,0]=4 3132 B10R1.172 CCc1cncc(C=O)c1 Amb18832506 [2,0,0,0,0,0|2,0,0]=4 3133 B10R1.172 CNc1cccc(C=O)c1 Amb10571863 [2,0,0,0,0,0|1,0,0]=3 3134 B10R1.172 CNc1cccc(CO)c1 Amb18967635 [2,0,0,0,0,0|1,0,1]=4 3135 B10R1.172 CNc1cccc(CO)c1 Amb32686927 [2,0,0,0,0,0|1,0,1]=4 3136 B10R1.172 CNc1cccc(OC)c1 Amb22274077 [2,0,0,0,0,0|2,0,0]=4 3137 B10R1.172 CNc1cccc(OC)c1 Amb6713925 [2,0,0,0,0,0|2,0,0]=4 3138 B10R1.172 COC1=CC=CC(C=O)N1 Amb27469491 [2,0,0,0,0,0|1,0,1]=4 3139 B10R1.172 COc1cc(C=O)ccn1 Amb8010894 [2,0,0,0,0,0|1,0,0]=3 3140 B10R1.172 COc1cc(C=O)ncn1 Amb27476419 [2,0,0,0,0,0|2,0,0]=4 3141 B10R1.172 COc1cc(CO)ccn1 Amb10975797 [2,0,0,0,0,0|1,0,1]=4 3142 B10R1.172 COc1cccc(C#N)c1 Amb1209415 [2,0,0,0,0,0|1,0,1]=4 3143 B10R1.172 COc1cccc(C=O)c1 Amb2792765 [2,0,0,0,0,0|0,0,0]=2 3144 B10R1.172 COc1cccc(C=O)n1 Amb8010839 [2,0,0,0,0,0|1,0,0]=3 3145 B10R1.172 COc1cccc(CBr)c1 Amb3939737 [2,0,0,0,0,0|1,0,1]=4 3146 B10R1.172 COc1cccc(CCl)c1 Amb1677622 [2,0,0,0,0,0|1,0,1]=4 3147 B10R1.172 COc1cccc(CI)c1 Amb27184036 [2,0,0,0,0,0|1,0,1]=4 3148 B10R1.172 COc1cccc(CN)c1 Amb1212559 [2,0,0,0,0,0|1,0,1]=4 3149 B10R1.172 COc1cccc(CO)c1 Amb1215247 [2,0,0,0,0,0|0,0,1]=3 3150 B10R1.172 COc1cccc(CO)n1 Amb6565096 [2,0,0,0,0,0|1,0,1]=4 3151 B10R1.172 COc1cccc(CS)c1 Amb6255516 [2,0,0,0,0,0|0,1,1]=4 3152 B10R1.172 COc1cccc(NN)c1 Amb22489461 [2,0,0,0,0,0|2,0,0]=4 3153 B10R1.172 COc1cccc(NN)c1 Amb33141033 [2,0,0,0,0,0|2,0,0]=4 3154 B10R1.172 COc1cccc(NN)c1 Amb439872 [2,0,0,0,0,0|2,0,0]=4 3155 B10R1.172 COc1cccc(NN)c1 Amb6662802 [2,0,0,0,0,0|2,0,0]=4 3156 B10R1.172 COc1cccc(NO)n1 Amb28043636 [2,0,0,0,0,0|2,0,0]=4 3157 B10R1.172 COc1cccc(OC)c1 Amb6296064 [2,0,0,0,0,0|2,0,0]=4 3158 B10R1.172 COc1cccc(SC)c1 Amb2689280 [2,0,0,0,0,0|2,0,0]=4 3159 B10R1.172 COc1cccc([Mg]Br)c1 Amb22000522 [2,0,0,0,0,0|2,0,0]=4 3160 B10R1.172 COc1cccc([Zn]I)c1 Amb6300186 [2,0,0,0,0,0|2,0,0]=4 3161 B10R1.172 COc1ccnc(C=O)c1 Amb18643123 [2,0,0,0,0,0|1,0,0]=3 3162 B10R1.172 COc1ccnc(C=O)n1 Amb22492001 [2,0,0,0,0,0|2,0,0]=4 3163 B10R1.172 COc1ccnc(CO)c1 Amb5722272 [2,0,0,0,0,0|1,0,1]=4 3164 B10R1.172 COc1cncc(C=O)c1 Amb33546870 [2,0,0,0,0,0|1,0,0]=3 3165 B10R1.172 COc1cncc(C=O)n1 Amb24537941 [2,0,0,0,0,0|2,0,0]=4 3166 B10R1.172 COc1cncc(CO)c1 Amb8426286 [2,0,0,0,0,0|1,0,1]=4 3167 B10R1.172 COc1nccc(C=O)n1 Amb19957790 [2,0,0,0,0,0|2,0,0]=4 3168 B10R1.172 CSc1cccc(C=O)c1 Amb10607360 [2,0,0,0,0,0|0,1,0]=3 3169 B10R1.172 CSc1cccc(C=O)n1 Amb24480540 [2,0,0,0,0,0|1,1,0]=4 3170 B10R1.172 CSc1cccc(CO)c1 Amb25744345 [2,0,0,0,0,0|0,1,1]=4 3171 B10R1.172 CSc1cncc(C=O)c1 Amb27789033 [2,0,0,0,0,0|1,1,0]=4 3172 B10R1.172 N#Cc1cccc(C=O)c1 Amb2686567 [2,0,0,0,0,0|2,0,0]=4 3173 B10R1.172 NCc1cccc(C=O)c1 Amb25255250 [2,0,0,0,0,0|2,0,0]=4 3174 B10R1.172 NCc1cccc(C=O)c1 Amb33734629 [2,0,0,0,0,0|2,0,0]=4 3175 B10R1.172 NNc1cccc(C=O)c1 Amb25952039 [2,0,0,0,0,0|2,0,0]=4 3176 B10R1.172 O=Cc1cccc(C=O)c1 Amb6891969 [2,0,0,0,0,0|2,0,0]=4 3177 B10R1.172 O=Cc1cccc(CBr)c1 Amb2724987 [2,0,0,0,0,0|2,0,0]=4 3178 B10R1.172 O=Cc1cccc(CCl)c1 Amb26555106 [2,0,0,0,0,0|2,0,0]=4 3179 B10R1.172 O=Cc1cccc(CF)c1 Amb26010625 [2,0,0,0,0,0|2,0,0]=4 3180 B10R1.172 O=Cc1cccc(CO)c1 Amb6298249 [2,0,0,0,0,0|2,0,0]=4 3181 B10R1.172 O=Cc1cccc(N=O)c1 Amb17593427 [2,0,0,0,0,0|2,0,0]=4 3182 B10R1.172 O=Cc1cccc(NO)c1 Amb28047724 [2,0,0,0,0,0|2,0,0]=4 3183 B10R1.172 [C-]#[N+]c1cccc(OC)c1 Amb2234454 [2,0,0,0,0,0|2,0,0]=4 3184 B10R1.30 C#Cc1cc(O)ccc1O Amb24093647 [2,0,0,0,0,0|1,0,1]=4 3185 B10R1.30 C=C1C=CC(=O)C(OC)=C1 Amb27948733 [2,0,0,0,0,0|0,0,1]=3 3186 B10R1.30 C=Cc1cc(O)ccc1O Amb17593445 [2,0,0,0,0,0|1,0,1]=4 3187 B10R1.30 CCC1=CC(=O)C=CC1=O Amb25129510 [2,0,0,0,0,0|1,0,1]=4 3188 B10R1.30 CCc1cc(Br)ccc1O Amb5781634 [2,0,0,0,0,0|2,0,0]=4 3189 B10R1.30 CCc1cc(C)ccc1O Amb18643083 [2,0,0,0,0,0|1,0,1]=4 3190 B10R1.30 CCc1cc(F)ccc1O Amb2687860 [2,0,0,0,0,0|2,0,0]=4 3191 B10R1.30 CCc1cc(I)ccc1O Amb27599772 [2,0,0,0,0,0|2,0,0]=4 3192 B10R1.30 CCc1cc(N)ccc1O Amb24126341 [2,0,0,0,0,0|2,0,0]=4 3193 B10R1.30 CCc1cc(O)ccc1Br Amb22886723 [2,0,0,0,0,0|2,0,0]=4 3194 B10R1.30 CCc1cc(O)ccc1C Amb18124481 [2,0,0,0,0,0|2,0,0]=4 3195 B10R1.30 CCc1cc(O)ccc1Cl Amb3939152 [2,0,0,0,0,0|2,0,0]=4 3196 B10R1.30 CCc1cc(O)ccc1F Amb22229300 [2,0,0,0,0,0|2,0,0]=4 3197 B10R1.30 CCc1cc(O)ccc1N Amb18556011 [2,0,0,0,0,0|2,0,0]=4 3198 B10R1.30 CCc1cc(O)ccc1O Amb6365570 [2,0,0,0,0,0|1,0,0]=3 3199 B10R1.30 CCc1cc(O)ccc1S Amb25715223 [2,0,0,0,0,0|1,1,0]=4 3200 B10R1.30 CNc1cc(Br)ccc1O Amb25123781 [2,0,0,0,0,0|2,0,0]=4 3201 B10R1.30 CNc1cc(C)ccc1O Amb18054014 [2,0,0,0,0,0|1,0,1]=4 3202 B10R1.30 CNc1cc(Cl)ccc1O Amb18940927 [2,0,0,0,0,0|2,0,0]=4 3203 B10R1.30 CNc1cc(F)ccc1O Amb18057749 [2,0,0,0,0,0|2,0,0]=4 3204 B10R1.30 CNc1cc(O)ccc1Br Amb26914310 [2,0,0,0,0,0|2,0,0]=4 3205 B10R1.30 CNc1cc(O)ccc1C Amb24066158 [2,0,0,0,0,0|2,0,0]=4 3206 B10R1.30 CNc1cc(O)ccc1Cl Amb27668801 [2,0,0,0,0,0|2,0,0]=4 3207 B10R1.30 CNc1cc(O)ccc1F Amb24718764 [2,0,0,0,0,0|2,0,0]=4 3208 B10R1.30 CNc1cc(O)ccc1I Amb27244177 [2,0,0,0,0,0|2,0,0]=4 3209 B10R1.30 COC1=CC(=O)C=CC1=O Amb6296784 [2,0,0,0,0,0|0,0,1]=3 3210 B10R1.30 COC1=CC(=O)C=CN1C Amb27780836 [2,0,0,0,0,0|2,0,0]=4 3211 B10R1.30 COc1cc(Br)ccc1Br Amb19890937 [2,0,0,0,0,0|2,0,0]=4 3212 B10R1.30 COc1cc(Br)ccc1C Amb19958411 [2,0,0,0,0,0|2,0,0]=4 3213 B10R1.30 COc1cc(Br)ccc1Cl Amb4015845 [2,0,0,0,0,0|2,0,0]=4 3214 B10R1.30 COc1cc(Br)ccc1F Amb10605531 [2,0,0,0,0,0|2,0,0]=4 3215 B10R1.30 COc1cc(Br)ccc1I Amb19888022 [2,0,0,0,0,0|2,0,0]=4 3216 B10R1.30 COc1cc(Br)ccc1N Amb4021792 [2,0,0,0,0,0|2,0,0]=4 3217 B10R1.30 COc1cc(Br)ccc1O Amb2778777 [2,0,0,0,0,0|1,0,0]=3 3218 B10R1.30 COc1cc(Br)ccc1S Amb19887982 [2,0,0,0,0,0|1,1,0]=4 3219 B10R1.30 COc1cc(Br)ncc1O Amb26855456 [2,0,0,0,0,0|2,0,0]=4 3220 B10R1.30 COc1cc(C)ccc1Br Amb8385357 [2,0,0,0,0,0|1,0,1]=4 3221 B10R1.30 COc1cc(C)ccc1C Amb6297215 [2,0,0,0,0,0|1,0,1]=4 3222 B10R1.30 COc1cc(C)ccc1Cl Amb16191917 [2,0,0,0,0,0|1,0,1]=4 3223 B10R1.30 COc1cc(C)ccc1F Amb6296868 [2,0,0,0,0,0|1,0,1]=4 3224 B10R1.30 COc1cc(C)ccc1I Amb19888209 [2,0,0,0,0,0|1,0,1]=4 3225 B10R1.30 COc1cc(C)ccc1N Amb33545802 [2,0,0,0,0,0|1,0,1]=4 3226 B10R1.30 COc1cc(C)ccc1N Amb4303789 [2,0,0,0,0,0|1,0,1]=4 3227 B10R1.30 COc1cc(C)ccc1O Amb2721097 [2,0,0,0,0,0|0,0,1]=3 3228 B10R1.30 COc1cc(C)ncc1O Amb24726190 [2,0,0,0,0,0|1,0,1]=4 3229 B10R1.30 COc1cc(Cl)ccc1Br Amb6366097 [2,0,0,0,0,0|2,0,0]=4 3230 B10R1.30 COc1cc(Cl)ccc1C Amb9786789 [2,0,0,0,0,0|2,0,0]=4 3231 B10R1.30 COc1cc(Cl)ccc1Cl Amb6365648 [2,0,0,0,0,0|2,0,0]=4 3232 B10R1.30 COc1cc(Cl)ccc1I Amb19958758 [2,0,0,0,0,0|2,0,0]=4 3233 B10R1.30 COc1cc(Cl)ccc1N Amb2607777 [2,0,0,0,0,0|2,0,0]=4 3234 B10R1.30 COc1cc(Cl)ccc1N Amb8629181 [2,0,0,0,0,0|2,0,0]=4 3235 B10R1.30 COc1cc(Cl)ccc1O Amb3939206 [2,0,0,0,0,0|1,0,0]=3 3236 B10R1.30 COc1cc(Cl)ccc1S Amb27199189 [2,0,0,0,0,0|1,1,0]=4 3237 B10R1.30 COc1cc(Cl)ccc1[Mg+] Amb30589964 [2,0,0,0,0,0|2,0,0]=4 3238 B10R1.30 COc1cc(Cl)ncc1O Amb25889824 [2,0,0,0,0,0|2,0,0]=4 3239 B10R1.30 COc1cc(F)ccc1Br Amb2685178 [2,0,0,0,0,0|2,0,0]=4 3240 B10R1.30 COc1cc(F)ccc1C Amb10807371 [2,0,0,0,0,0|2,0,0]=4 3241 B10R1.30 COc1cc(F)ccc1Cl Amb6365643 [2,0,0,0,0,0|2,0,0]=4 3242 B10R1.30 COc1cc(F)ccc1F Amb2687041 [2,0,0,0,0,0|2,0,0]=4 3243 B10R1.30 COc1cc(F)ccc1I Amb27225839 [2,0,0,0,0,0|2,0,0]=4 3244 B10R1.30 COc1cc(F)ccc1N Amb10841411 [2,0,0,0,0,0|2,0,0]=4 3245 B10R1.30 COc1cc(F)ccc1N Amb1141067 [2,0,0,0,0,0|2,0,0]=4 3246 B10R1.30 COc1cc(F)ccc1O Amb3939617 [2,0,0,0,0,0|1,0,0]=3 3247 B10R1.30 COc1cc(F)ccc1S Amb24070252 [2,0,0,0,0,0|1,1,0]=4 3248 B10R1.30 COc1cc(F)cnc1O Amb26907883 [2,0,0,0,0,0|2,0,0]=4 3249 B10R1.30 COc1cc(F)ncc1O Amb24537942 [2,0,0,0,0,0|2,0,0]=4 3250 B10R1.30 COc1cc(I)ccc1Br Amb6298288 [2,0,0,0,0,0|2,0,0]=4 3251 B10R1.30 COc1cc(I)ccc1Cl Amb10071359 [2,0,0,0,0,0|2,0,0]=4 3252 B10R1.30 COc1cc(I)ccc1I Amb24321170 [2,0,0,0,0,0|2,0,0]=4 3253 B10R1.30 COc1cc(I)ccc1N Amb22002185 [2,0,0,0,0,0|2,0,0]=4 3254 B10R1.30 COc1cc(I)ccc1N Amb28555587 [2,0,0,0,0,0|2,0,0]=4 3255 B10R1.30 COc1cc(I)ccc1O Amb5717632 [2,0,0,0,0,0|1,0,0]=3 3256 B10R1.30 COc1cc(I)ccc1S Amb25213589 [2,0,0,0,0,0|1,1,0]=4 3257 B10R1.30 COc1cc(N)ccc1Br Amb6366098 [2,0,0,0,0,0|2,0,0]=4 3258 B10R1.30 COc1cc(N)ccc1C Amb33531678 [2,0,0,0,0,0|2,0,0]=4 3259 B10R1.30 COc1cc(N)ccc1Cl Amb10068702 [2,0,0,0,0,0|2,0,0]=4 3260 B10R1.30 COc1cc(N)ccc1F Amb10839685 [2,0,0,0,0,0|2,0,0]=4 3261 B10R1.30 COc1cc(N)ccc1F Amb3941090 [2,0,0,0,0,0|2,0,0]=4 3262 B10R1.30 COc1cc(N)ccc1I Amb10609996 [2,0,0,0,0,0|2,0,0]=4 3263 B10R1.30 COc1cc(N)ccc1I Amb10610092 [2,0,0,0,0,0|2,0,0]=4 3264 B10R1.30 COc1cc(N)ccc1I Amb9677499 [2,0,0,0,0,0|2,0,0]=4 3265 B10R1.30 COc1cc(N)ccc1N Amb16234089 [2,0,0,0,0,0|2,0,0]=4 3266 B10R1.30 COc1cc(N)ccc1N Amb17399832 [2,0,0,0,0,0|2,0,0]=4 3267 B10R1.30 COc1cc(N)ccc1O Amb17608136 [2,0,0,0,0,0|1,0,0]=3 3268 B10R1.30 COc1cc(N)ccc1O Amb6336157 [2,0,0,0,0,0|1,0,0]=3 3269 B10R1.30 COc1cc(N)ccc1S Amb20623558 [2,0,0,0,0,0|1,1,0]=4 3270 B10R1.30 COc1cc(O)ccc1Br Amb3941025 [2,0,0,0,0,0|1,0,0]=3 3271 B10R1.30 COc1cc(O)ccc1C Amb22229347 [2,0,0,0,0,0|1,0,0]=3 3272 B10R1.30 COc1cc(O)ccc1Cl Amb22169622 [2,0,0,0,0,0|1,0,0]=3 3273 B10R1.30 COc1cc(O)ccc1F Amb18643810 [2,0,0,0,0,0|1,0,0]=3 3274 B10R1.30 COc1cc(O)ccc1N Amb17739939 [2,0,0,0,0,0|1,0,0]=3 3275 B10R1.30 COc1cc(O)ccc1N Amb17740010 [2,0,0,0,0,0|1,0,0]=3 3276 B10R1.30 COc1cc(O)ccc1O Amb2725526 [2,0,0,0,0,0|0,0,0]=2 3277 B10R1.30 COc1cc(O)ccc1S Amb27653376 [2,0,0,0,0,0|0,1,0]=3 3278 B10R1.30 COc1cc(O)cnc1Br Amb22898919 [2,0,0,0,0,0|2,0,0]=4 3279 B10R1.30 COc1cc(O)cnc1C Amb24713185 [2,0,0,0,0,0|2,0,0]=4 3280 B10R1.30 COc1cc(O)cnc1Cl Amb23439954 [2,0,0,0,0,0|2,0,0]=4 3281 B10R1.30 COc1cc(O)cnc1F Amb25889826 [2,0,0,0,0,0|2,0,0]=4 3282 B10R1.30 COc1cc(O)cnc1I Amb21959517 [2,0,0,0,0,0|2,0,0]=4 3283 B10R1.30 COc1cc(O)cnc1N Amb26572072 [2,0,0,0,0,0|2,0,0]=4 3284 B10R1.30 COc1cc(O)ncc1Br Amb18176663 [2,0,0,0,0,0|2,0,0]=4 3285 B10R1.30 COc1cc(O)ncc1C Amb25921264 [2,0,0,0,0,0|2,0,0]=4 3286 B10R1.30 COc1cc(O)ncc1F Amb27478141 [2,0,0,0,0,0|2,0,0]=4 3287 B10R1.30 COc1cc(O)ncc1N Amb28049367 [2,0,0,0,0,0|2,0,0]=4 3288 B10R1.30 COc1cc(S)ccc1Br Amb19890685 [2,0,0,0,0,0|1,1,0]=4 3289 B10R1.30 COc1cc(S)ccc1C Amb26327939 [2,0,0,0,0,0|1,1,0]=4 3290 B10R1.30 COc1cc(S)ccc1Cl Amb26858791 [2,0,0,0,0,0|1,1,0]=4 3291 B10R1.30 COc1cc(S)ccc1F Amb27221665 [2,0,0,0,0,0|1,1,0]=4 3292 B10R1.30 COc1cc(S)ccc1I Amb24479273 [2,0,0,0,0,0|1,1,0]=4 3293 B10R1.30 COc1cc(S)ccc1N Amb27836155 [2,0,0,0,0,0|1,1,0]=4 3294 B10R1.30 COc1cc(S)ccc1O Amb18644820 [2,0,0,0,0,0|0,1,0]=3 3295 B10R1.30 COc1cc(S)ccc1S Amb26921113 [2,0,0,0,0,0|0,2,0]=4 3296 B10R1.30 COc1nc(Br)ccc1O Amb26876575 [2,0,0,0,0,0|2,0,0]=4 3297 B10R1.30 COc1nc(C)ccc1O Amb27945624 [2,0,0,0,0,0|1,0,1]=4 3298 B10R1.30 COc1nc(Cl)ccc1O Amb24606525 [2,0,0,0,0,0|2,0,0]=4 3299 B10R1.30 COc1nc(I)ccc1O Amb25248959 [2,0,0,0,0,0|2,0,0]=4 3300 B10R1.30 COc1nc(O)ccc1F Amb27225048 [2,0,0,0,0,0|2,0,0]=4 3301 B10R1.30 COc1nc(O)ccc1N Amb33526910 [2,0,0,0,0,0|2,0,0]=4 3302 B10R1.30 CSC1=CC(=O)C=CC1=O Amb24575921 [2,0,0,0,0,0|0,1,1]=4 3303 B10R1.30 CSc1cc(Br)ccc1O Amb24558581 [2,0,0,0,0,0|1,1,0]=4 3304 B10R1.30 CSc1cc(C)ccc1O Amb18644671 [2,0,0,0,0,0|0,1,1]=4 3305 B10R1.30 CSc1cc(F)ccc1O Amb18645013 [2,0,0,0,0,0|1,1,0]=4 3306 B10R1.30 CSc1cc(N)ccc1O Amb18644746 [2,0,0,0,0,0|1,1,0]=4 3307 B10R1.30 CSc1cc(O)ccc1Br Amb26445111 [2,0,0,0,0,0|1,1,0]=4 3308 B10R1.30 CSc1cc(O)ccc1C Amb18644670 [2,0,0,0,0,0|1,1,0]=4 3309 B10R1.30 CSc1cc(O)ccc1Cl Amb26550598 [2,0,0,0,0,0|1,1,0]=4 3310 B10R1.30 CSc1cc(O)ccc1I Amb28186963 [2,0,0,0,0,0|1,1,0]=4 3311 B10R1.30 CSc1cc(O)ccc1N Amb22552401 [2,0,0,0,0,0|1,1,0]=4 3312 B10R1.30 CSc1cc(O)ccc1O Amb27969922 [2,0,0,0,0,0|0,1,0]=3 3313 B10R1.30 N#Cc1cc(O)ccc1O Amb9788746 [2,0,0,0,0,0|2,0,0]=4 3314 B10R1.30 NCc1cc(O)ccc1O Amb24093484 [2,0,0,0,0,0|2,0,0]=4 3315 B10R1.30 NCc1cc(O)ccc1O Amb30359799 [2,0,0,0,0,0|2,0,0]=4 3316 B10R1.30 NNc1cc(O)ccc1O Amb28246859 [2,0,0,0,0,0|2,0,0]=4 3317 B10R1.30 O=Cc1cc(O)ccc1O Amb3939949 [2,0,0,0,0,0|2,0,0]=4 3318 B10R1.30 OCc1cc(O)ccc1O Amb16184173 [2,0,0,0,0,0|2,0,0]=4 3319 B10R1.30 Oc1ccc(O)c(CBr)c1 Amb26629736 [2,0,0,0,0,0|2,0,0]=4 3320 B10R1.30 Oc1ccc(O)c(CCl)c1 Amb27234643 [2,0,0,0,0,0|2,0,0]=4 3321 B10R1.30 Oc1ccc(O)c(CS)c1 Amb22388691 [2,0,0,0,0,0|2,0,0]=4 3322 B12R1.23 CC(C)(O)c1ccc(O)c(O)c1 Amb33375746 [1,1,0,0,0,0|1,0,1]=4 3323 B12R1.23 CS(=O)(=O)c1ccc(O)c(O)c1 Amb33328341 [1,1,0,0,0,0|1,0,1]=4 3324 B12R1.23 Cc1cc(C(C)(C)O)ccc1O Amb27802584 [1,1,0,0,0,0|1,0,1]=4 3325 B12R1.23 Cc1cc(S(=O)(=O)Cl)ccc1O Amb18780155 [1,1,0,0,0,0|1,0,1]=4 3326 B12R1.23 Cc1cc(S(=O)(=O)O)ccc1Br Amb28048829 [1,1,0,0,0,0|2,0,0]=4 3327 B12R1.23 Cc1cc(S(=O)(=O)O)ccc1Cl Amb23551964 [1,1,0,0,0,0|2,0,0]=4 3328 B12R1.23 Cc1cc(S(=O)(=O)O)ccc1F Amb18863494 [1,1,0,0,0,0|2,0,0]=4 3329 B12R1.23 Cc1cc(S(=O)(=O)O)ccc1O Amb16192717 [1,1,0,0,0,0|1,0,0]=3 3330 B12R1.23 Cc1cc(S(C)(=O)=O)ccc1O Amb18129618 [1,1,0,0,0,0|1,0,1]=4 3331 B12R1.23 Cc1cc(S(N)(=O)=O)ccc1O Amb28254642 [1,1,0,0,0,0|1,0,1]=4 3332 B12R1.23 Cc1ccc(S(=O)(=O)O)cc1C Amb18863189 [1,1,0,0,0,0|2,0,0]=4 3333 B12R1.23 NS(=O)(=O)c1ccc(O)c(O)c1 Amb24085497 [1,1,0,0,0,0|1,0,1]=4 3334 B12R1.23 Nc1cc(S(=O)(=O)O)ccc1O Amb32409663 [1,1,0,0,0,0|2,0,0]=4 3335 B12R1.23 Nc1cc(S(=O)(=O)O)ccc1O Amb4314503 [1,1,0,0,0,0|2,0,0]=4 3336 B12R1.23 Nc1ccc(S(=O)(=O)O)cc1O Amb13882957 [1,1,0,0,0,0|2,0,0]=4 3337 B12R1.23 O=P(O)(O)c1ccc(O)c(O)c1 Amb27749797 [1,1,0,0,0,0|1,0,0]=3 3338 B12R1.23 O=S(=O)(O)c1ccc(O)c(O)c1 Amb17594935 [1,1,0,0,0,0|1,0,0]=3 3339 B12R1.48 C#Cc1ccc(C(=O)O)cc1C Amb26934643 [1,1,0,0,0,0|1,0,0]=3 3340 B12R1.48 C#Cc1ccc(C(=O)O)cc1Cl Amb25936298 [1,1,0,0,0,0|2,0,0]=4 3341 B12R1.48 C#Cc1ccc(C(=O)O)cc1N Amb26841099 [1,1,0,0,0,0|2,0,0]=4 3342 B12R1.48 C#Cc1ccc(C(=O)O)nc1C Amb25894822 [1,1,0,0,0,0|2,0,0]=4 3343 B12R1.48 C#Cc1ccc(C(=O)O)nc1O Amb25797439 [1,1,0,0,0,0|2,0,0]=4 3344 B12R1.48 C#Cc1cnc(C(=O)O)cc1C Amb25125338 [1,1,0,0,0,0|2,0,0]=4 3345 B12R1.48 C#Cc1cnc(C(=O)O)cc1O Amb25913619 [1,1,0,0,0,0|2,0,0]=4 3346 B12R1.48 C#Cc1ncc(C(=O)O)cc1C Amb25125941 [1,1,0,0,0,0|2,0,0]=4 3347 B12R1.48 C#Cc1ncc(C(=O)O)cc1O Amb25894705 [1,1,0,0,0,0|2,0,0]=4 3348 B12R1.48 C=Cc1ccc(C(=O)O)cc1F Amb28324455 [1,1,0,0,0,0|2,0,0]=4 3349 B12R1.48 C=Cc1ccc(C(=O)O)nc1C Amb25256001 [1,1,0,0,0,0|2,0,0]=4 3350 B12R1.48 C=Cc1ccc(C(=O)O)nc1O Amb26392551 [1,1,0,0,0,0|2,0,0]=4 3351 B12R1.48 C=Cc1cnc(C(=O)O)cc1C Amb28041412 [1,1,0,0,0,0|2,0,0]=4 3352 B12R1.48 C=Cc1cnc(C(=O)O)cc1O Amb26978258 [1,1,0,0,0,0|2,0,0]=4 3353 B12R1.48 C=Cc1ncc(C(=O)O)cc1O Amb27951023 [1,1,0,0,0,0|2,0,0]=4 3354 B12R1.48 CC(=O)c1ccc(CO)c(Br)c1 Amb24689659 [1,1,0,0,0,0|2,0,0]=4 3355 B12R1.48 CC(=O)c1ccc(CO)c(C)n1 Amb28197639 [1,1,0,0,0,0|2,0,0]=4 3356 B12R1.48 CC(=O)c1ccc(CO)c(I)c1 Amb27856356 [1,1,0,0,0,0|2,0,0]=4 3357 B12R1.48 CCc1ccc(C(=O)O)cc1Br Amb1060319 [1,1,0,0,0,0|2,0,0]=4 3358 B12R1.48 CCc1ccc(C(=O)O)cc1C Amb24660519 [1,1,0,0,0,0|1,0,0]=3 3359 B12R1.48 CCc1ccc(C(=O)O)cc1Cl Amb18649029 [1,1,0,0,0,0|2,0,0]=4 3360 B12R1.48 CCc1ccc(C(=O)O)cc1F Amb25697073 [1,1,0,0,0,0|2,0,0]=4 3361 B12R1.48 CCc1ccc(C(=O)O)cc1I Amb16232634 [1,1,0,0,0,0|2,0,0]=4 3362 B12R1.48 CCc1ccc(C(=O)O)cc1N Amb8383859 [1,1,0,0,0,0|2,0,0]=4 3363 B12R1.48 CCc1ccc(C(=O)O)cc1O Amb8394685 [1,1,0,0,0,0|1,0,0]=3 3364 B12R1.48 CCc1ccc(C(=O)O)cc1S Amb25336578 [1,1,0,0,0,0|1,1,0]=4 3365 B12R1.48 CCc1ccc(C(C)=O)cc1C Amb26926136 [1,1,0,0,0,0|2,0,0]=4 3366 B12R1.48 CCc1ncc(C(=O)O)cc1C Amb18828411 [1,1,0,0,0,0|2,0,0]=4 3367 B12R1.48 CNc1ccc(C(=O)O)cc1Br Amb16232738 [1,1,0,0,0,0|2,0,0]=4 3368 B12R1.48 CNc1ccc(C(=O)O)cc1C Amb18963552 [1,1,0,0,0,0|1,0,0]=3 3369 B12R1.48 CNc1ccc(C(=O)O)cc1Cl Amb18288675 [1,1,0,0,0,0|2,0,0]=4 3370 B12R1.48 CNc1ccc(C(=O)O)cc1F Amb18963551 [1,1,0,0,0,0|2,0,0]=4 3371 B12R1.48 CNc1ccc(C(=O)O)cc1N Amb28555699 [1,1,0,0,0,0|2,0,0]=4 3372 B12R1.48 CNc1ccc(C(=O)O)cc1N Amb8391538 [1,1,0,0,0,0|2,0,0]=4 3373 B12R1.48 CNc1ccc(C(C)=O)cc1C Amb26539550 [1,1,0,0,0,0|2,0,0]=4 3374 B12R1.48 CNc1ncc(C(=O)O)cc1C Amb23578565 [1,1,0,0,0,0|2,0,0]=4 3375 B12R1.48 COC1=CC=C(C(=O)O)NC1=O Amb25127882 [1,1,0,0,0,0|1,0,1]=4 3376 B12R1.48 COC1=CNC(C(=O)O)=CC1=O Amb18384686 [1,1,0,0,0,0|1,0,1]=4 3377 B12R1.48 COC1=COC(C(=O)O)=CC1=O Amb19516805 [1,1,0,0,0,0|1,0,1]=4 3378 B12R1.48 COc1ccc(B(O)O)cc1C Amb2720496 [1,1,0,0,0,0|1,0,1]=4 3379 B12R1.48 COc1ccc(B(O)O)cc1O Amb20171348 [1,1,0,0,0,0|1,0,1]=4 3380 B12R1.48 COc1ccc(C(=N)N)cc1C Amb18792556 [1,1,0,0,0,0|2,0,0]=4 3381 B12R1.48 COc1ccc(C(=N)N)cc1O Amb8834131 [1,1,0,0,0,0|2,0,0]=4 3382 B12R1.48 COc1ccc(C(=O)Cl)cc1Br Amb3583907 [1,1,0,0,0,0|2,0,0]=4 3383 B12R1.48 COc1ccc(C(=O)Cl)cc1Cl Amb3598168 [1,1,0,0,0,0|2,0,0]=4 3384 B12R1.48 COc1ccc(C(=O)Cl)cc1F Amb2688154 [1,1,0,0,0,0|2,0,0]=4 3385 B12R1.48 COc1ccc(C(=O)Cl)cc1I Amb19888078 [1,1,0,0,0,0|2,0,0]=4 3386 B12R1.48 COc1ccc(C(=O)Cl)cc1O Amb24102243 [1,1,0,0,0,0|1,0,0]=3 3387 B12R1.48 COc1ccc(C(=O)O)c[n+]1[O-] Amb27840659 [1,1,0,0,0,0|1,0,1]=4 3388 B12R1.48 COc1ccc(C(=O)O)cc1Br Amb6336112 [1,1,0,0,0,0|1,0,0]=3 3389 B12R1.48 COc1ccc(C(=O)O)cc1C Amb841879 [1,1,0,0,0,0|0,0,0]=2 3390 B12R1.48 COc1ccc(C(=O)O)cc1Cl Amb2508444 [1,1,0,0,0,0|1,0,0]=3 3391 B12R1.48 COc1ccc(C(=O)O)cc1F Amb1214421 [1,1,0,0,0,0|1,0,0]=3 3392 B12R1.48 COc1ccc(C(=O)O)cc1I Amb6325201 [1,1,0,0,0,0|1,0,0]=3 3393 B12R1.48 COc1ccc(C(=O)O)cc1N Amb24117566 [1,1,0,0,0,0|1,0,0]=3 3394 B12R1.48 COc1ccc(C(=O)O)cc1N Amb535733 [1,1,0,0,0,0|1,0,0]=3 3395 B12R1.48 COc1ccc(C(=O)O)cc1O Amb3940319 [1,1,0,0,0,0|0,0,0]=2 3396 B12R1.48 COc1ccc(C(=O)O)cc1S Amb18648895 [1,1,0,0,0,0|0,1,0]=3 3397 B12R1.48 COc1ccc(C(=O)O)nc1Br Amb2612495 [1,1,0,0,0,0|2,0,0]=4 3398 B12R1.48 COc1ccc(C(=O)O)nc1C Amb26599993 [1,1,0,0,0,0|1,0,0]=3 3399 B12R1.48 COc1ccc(C(=O)O)nc1Cl Amb2612505 [1,1,0,0,0,0|2,0,0]=4 3400 B12R1.48 COc1ccc(C(=O)O)nc1F Amb27803674 [1,1,0,0,0,0|2,0,0]=4 3401 B12R1.48 COc1ccc(C(=O)O)nc1I Amb2612498 [1,1,0,0,0,0|2,0,0]=4 3402 B12R1.48 COc1ccc(C(=O)[O-])cc1Cl Amb33513203 [1,1,0,0,0,0|1,0,1]=4 3403 B12R1.48 COc1ccc(C(=O)[O-])cc1F Amb33513075 [1,1,0,0,0,0|1,0,1]=4 3404 B12R1.48 COc1ccc(C(=O)[O-])cc1N Amb33513056 [1,1,0,0,0,0|1,0,1]=4 3405 B12R1.48 COc1ccc(C(C)=O)cc1Br Amb1056189 [1,1,0,0,0,0|2,0,0]=4 3406 B12R1.48 COc1ccc(C(C)=O)cc1C Amb33528311 [1,1,0,0,0,0|1,0,0]=3 3407 B12R1.48 COc1ccc(C(C)=O)cc1Cl Amb2209369 [1,1,0,0,0,0|2,0,0]=4 3408 B12R1.48 COc1ccc(C(C)=O)cc1F Amb1655434 [1,1,0,0,0,0|2,0,0]=4 3409 B12R1.48 COc1ccc(C(C)=O)cc1I Amb6296432 [1,1,0,0,0,0|2,0,0]=4 3410 B12R1.48 COc1ccc(C(C)=O)cc1N Amb1102517 [1,1,0,0,0,0|2,0,0]=4 3411 B12R1.48 COc1ccc(C(C)=O)cc1O Amb8387069 [1,1,0,0,0,0|1,0,0]=3 3412 B12R1.48 COc1ccc(C(C)O)cc1C Amb17138605 [1,1,0,0,0,0|1,0,1]=4 3413 B12R1.48 COc1ccc(C(N)=O)cc1Br Amb6754253 [1,1,0,0,0,0|2,0,0]=4 3414 B12R1.48 COc1ccc(C(N)=O)cc1C Amb17232524 [1,1,0,0,0,0|1,0,0]=3 3415 B12R1.48 COc1ccc(C(N)=O)cc1Cl Amb6754250 [1,1,0,0,0,0|2,0,0]=4 3416 B12R1.48 COc1ccc(C(N)=O)cc1F Amb8998215 [1,1,0,0,0,0|2,0,0]=4 3417 B12R1.48 COc1ccc(C(N)=O)cc1I Amb23491841 [1,1,0,0,0,0|2,0,0]=4 3418 B12R1.48 COc1ccc(C(N)=O)cc1N Amb1116792 [1,1,0,0,0,0|2,0,0]=4 3419 B12R1.48 COc1ccc(C(N)=O)cc1O Amb27403011 [1,1,0,0,0,0|1,0,0]=3 3420 B12R1.48 COc1ccc(C(N)=S)cc1C Amb17233849 [1,1,0,0,0,0|1,1,0]=4 3421 B12R1.48 COc1ccc(C(N)=S)cc1O Amb1118278 [1,1,0,0,0,0|1,1,0]=4 3422 B12R1.48 COc1ccc(N(=O)=O)cc1C Amb20621531 [1,1,0,0,0,0|1,0,1]=4 3423 B12R1.48 COc1ccc(N(=O)=O)cc1O Amb20621527 [1,1,0,0,0,0|1,0,1]=4 3424 B12R1.48 COc1ccc(S(=O)Cl)cc1C Amb18567175 [1,1,0,0,0,0|2,0,0]=4 3425 B12R1.48 COc1ccc(S(=O)O)cc1Br Amb18876758 [1,1,0,0,0,0|2,0,0]=4 3426 B12R1.48 COc1ccc(S(=O)O)cc1C Amb18564382 [1,1,0,0,0,0|1,0,0]=3 3427 B12R1.48 COc1ccc(S(=O)O)cc1Cl Amb18567838 [1,1,0,0,0,0|2,0,0]=4 3428 B12R1.48 COc1ccc(S(=O)O)cc1F Amb18224847 [1,1,0,0,0,0|2,0,0]=4 3429 B12R1.48 COc1ccc(S(=O)[O-])cc1C Amb25230527 [1,1,0,0,0,0|1,0,1]=4 3430 B12R1.48 COc1ccc([C@@H](C)O)cc1C Amb24546350 [1,1,0,0,0,0|1,0,1]=4 3431 B12R1.48 COc1ccc([C@@H](C)O)cc1O Amb28430460 [1,1,0,0,0,0|1,0,1]=4 3432 B12R1.48 COc1ccc([C@H](C)O)cc1C Amb25337353 [1,1,0,0,0,0|1,0,1]=4 3433 B12R1.48 COc1ccc([C@H](C)O)cc1O Amb24367881 [1,1,0,0,0,0|1,0,1]=4 3434 B12R1.48 COc1ccc([N+](=O)[O-])cc1C Amb17617644 [1,1,0,0,0,0|1,0,1]=4 3435 B12R1.48 COc1ccc([N+](=O)[O-])cc1O Amb6357796 [1,1,0,0,0,0|1,0,1]=4 3436 B12R1.48 COc1cnc(C(=O)O)cc1Br Amb25249336 [1,1,0,0,0,0|2,0,0]=4 3437 B12R1.48 COc1cnc(C(=O)O)cc1C Amb18827333 [1,1,0,0,0,0|1,0,0]=3 3438 B12R1.48 COc1cnc(C(=O)O)cc1Cl Amb22750140 [1,1,0,0,0,0|2,0,0]=4 3439 B12R1.48 COc1cnc(C(=O)O)cc1F Amb28076064 [1,1,0,0,0,0|2,0,0]=4 3440 B12R1.48 COc1cnc(C(=O)O)cc1O Amb22587310 [1,1,0,0,0,0|1,0,0]=3 3441 B12R1.48 COc1cnc(C(=O)O)cc1O Amb8439088 [1,1,0,0,0,0|1,0,0]=3 3442 B12R1.48 COc1cnc(C(C)=O)cc1C Amb28118530 [1,1,0,0,0,0|2,0,0]=4 3443 B12R1.48 COc1ncc(C(=O)O)cc1Br Amb33549340 [1,1,0,0,0,0|2,0,0]=4 3444 B12R1.48 COc1ncc(C(=O)O)cc1C Amb22174138 [1,1,0,0,0,0|1,0,0]=3 3445 B12R1.48 COc1ncc(C(=O)O)cc1Cl Amb33543173 [1,1,0,0,0,0|2,0,0]=4 3446 B12R1.48 COc1ncc(C(=O)O)cc1F Amb21857151 [1,1,0,0,0,0|2,0,0]=4 3447 B12R1.48 COc1ncc(C(=O)O)cc1O Amb27175778 [1,1,0,0,0,0|1,0,0]=3 3448 B12R1.48 COc1ncc(C(C)=O)cc1C Amb32882055 [1,1,0,0,0,0|2,0,0]=4 3449 B12R1.48 COc1ncc(S(=O)O)cc1C Amb32992441 [1,1,0,0,0,0|2,0,0]=4 3450 B12R1.48 CSc1ccc(C(=O)O)c[n+]1C Amb2612033 [1,1,0,0,0,0|1,1,0]=4 3451 B12R1.48 CSc1ccc(C(=O)O)cc1Br Amb26938455 [1,1,0,0,0,0|1,1,0]=4 3452 B12R1.48 CSc1ccc(C(=O)O)cc1C Amb18963584 [1,1,0,0,0,0|0,1,0]=3 3453 B12R1.48 CSc1ccc(C(=O)O)cc1Cl Amb18967592 [1,1,0,0,0,0|1,1,0]=4 3454 B12R1.48 CSc1ccc(C(=O)O)cc1I Amb26513035 [1,1,0,0,0,0|1,1,0]=4 3455 B12R1.48 CSc1ccc(C(=O)O)cc1N Amb18281544 [1,1,0,0,0,0|1,1,0]=4 3456 B12R1.48 CSc1ccc(C(N)=O)cc1O Amb27616755 [1,1,0,0,0,0|1,1,0]=4 3457 B12R1.48 CSc1ncc(C(=O)O)cc1C Amb23578541 [1,1,0,0,0,0|1,1,0]=4 3458 B12R1.48 Cc1cc(B(O)O)ccc1CO Amb13890532 [1,1,0,0,0,0|1,0,1]=4 3459 B12R1.48 Cc1cc(C(=O)Cl)ccc1C#N Amb25684160 [1,1,0,0,0,0|2,0,0]=4 3460 B12R1.48 Cc1cc(C(=O)O)ccc1C#N Amb16231792 [1,1,0,0,0,0|1,0,0]=3 3461 B12R1.48 Cc1cc(C(=O)O)ccc1C=O Amb25935381 [1,1,0,0,0,0|0,0,1]=3 3462 B12R1.48 Cc1cc(C(=O)O)ccc1CBr Amb25353603 [1,1,0,0,0,0|1,0,0]=3 3463 B12R1.48 Cc1cc(C(=O)O)ccc1CCl Amb27426615 [1,1,0,0,0,0|1,0,0]=3 3464 B12R1.48 Cc1cc(C(=O)O)ccc1CF Amb24402257 [1,1,0,0,0,0|1,0,0]=3 3465 B12R1.48 Cc1cc(C(=O)O)ccc1CI Amb24382266 [1,1,0,0,0,0|1,0,0]=3 3466 B12R1.48 Cc1cc(C(=O)O)ccc1CN Amb18646312 [1,1,0,0,0,0|1,0,0]=3 3467 B12R1.48 Cc1cc(C(=O)O)ccc1NN Amb25891917 [1,1,0,0,0,0|1,0,0]=3 3468 B12R1.48 Cc1cc(C(=O)O)ccc1NO Amb22753291 [1,1,0,0,0,0|0,0,0]=2 3469 B12R1.48 Cc1cc(C(=O)O)cnc1C#N Amb24637110 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.48 Cc1cc(C(=O)O)cnc1C=O Amb33728715 [1,1,0,0,0,0|1,0,1]=4 3471 B12R1.48 Cc1cc(C(=O)O)ncc1C#N Amb24658573 [1,1,0,0,0,0|2,0,0]=4 3472 B12R1.48 Cc1cc(C(=O)O)ncc1C=O Amb27762916 [1,1,0,0,0,0|1,0,1]=4 3473 B12R1.48 Cc1cc(C(=O)O)ncc1CCl Amb27450975 [1,1,0,0,0,0|2,0,0]=4 3474 B12R1.48 Cc1cc(C(=O)O)ncc1CO Amb35749931 [1,1,0,0,0,0|1,0,0]=3 3475 B12R1.48 Cc1cc(C(N)=O)ccc1C#N Amb25802352 [1,1,0,0,0,0|2,0,0]=4 3476 B12R1.48 Cc1cc(C(N)=O)ccc1CBr Amb27615281 [1,1,0,0,0,0|2,0,0]=4 3477 B12R1.48 Cc1cc(C(N)=O)ccc1CO Amb27875952 [1,1,0,0,0,0|1,0,0]=3 3478 B12R1.48 Cc1cc(C(N)=O)ccc1NN Amb28365620 [1,1,0,0,0,0|2,0,0]=4 3479 B12R1.48 Cc1cc(C(N)=O)ccc1ON Amb28397712 [1,1,0,0,0,0|1,0,0]=3 3480 B12R1.48 Cc1cc(N(=O)=O)ccc1CO Amb22396516 [1,1,0,0,0,0|1,0,1]=4 3481 B12R1.48 Cc1nc(C(=O)O)ccc1C#N Amb6892871 [1,1,0,0,0,0|2,0,0]=4 3482 B12R1.48 Cc1nc(C(=O)O)ccc1C=O Amb33072985 [1,1,0,0,0,0|1,0,1]=4 3483 B12R1.48 N#Cc1ccc(C(=O)Cl)cc1O Amb24650613 [1,1,0,0,0,0|2,0,0]=4 3484 B12R1.48 N#Cc1ccc(C(=O)O)cc1Br Amb21857027 [1,1,0,0,0,0|2,0,0]=4 3485 B12R1.48 N#Cc1ccc(C(=O)O)cc1Cl Amb27175624 [1,1,0,0,0,0|2,0,0]=4 3486 B12R1.48 N#Cc1ccc(C(=O)O)cc1F Amb8393839 [1,1,0,0,0,0|2,0,0]=4 3487 B12R1.48 N#Cc1ccc(C(=O)O)cc1I Amb26850408 [1,1,0,0,0,0|2,0,0]=4 3488 B12R1.48 N#Cc1ccc(C(=O)O)cc1N Amb27592141 [1,1,0,0,0,0|2,0,0]=4 3489 B12R1.48 N#Cc1ccc(C(=O)O)cc1O Amb27793163 [1,1,0,0,0,0|1,0,0]=3 3490 B12R1.48 N#Cc1ccc(C(=O)O)cc1S Amb27248560 [1,1,0,0,0,0|1,1,0]=4 3491 B12R1.48 N#Cc1ccc(C(N)=O)cc1O Amb27668927 [1,1,0,0,0,0|2,0,0]=4 3492 B12R1.48 N#Cc1cnc(C(=O)O)cc1O Amb28284491 [1,1,0,0,0,0|2,0,0]=4 3493 B12R1.48 N#Cc1ncc(C(=O)O)cc1O Amb27777404 [1,1,0,0,0,0|2,0,0]=4 3494 B12R1.48 NC(=O)c1ccc(C=O)c(O)c1 Amb27263073 [1,1,0,0,0,0|1,0,1]=4 3495 B12R1.48 NC(=O)c1ccc(CO)c(F)c1 Amb9421541 [1,1,0,0,0,0|2,0,0]=4 3496 B12R1.48 NCc1ccc(C(=O)O)cc1Br Amb26611406 [1,1,0,0,0,0|2,0,0]=4 3497 B12R1.48 NCc1ccc(C(=O)O)cc1Br Amb30585030 [1,1,0,0,0,0|2,0,0]=4 3498 B12R1.48 NCc1ccc(C(=O)O)cc1Cl Amb27454849 [1,1,0,0,0,0|2,0,0]=4 3499 B12R1.48 NCc1ccc(C(=O)O)cc1F Amb21984594 [1,1,0,0,0,0|2,0,0]=4 3500 B12R1.48 NCc1ccc(C(=O)O)cc1F Amb25149911 [1,1,0,0,0,0|2,0,0]=4 3501 B12R1.48 NCc1ccc(C(=O)O)cc1N Amb25957466 [1,1,0,0,0,0|2,0,0]=4 3502 B12R1.48 NCc1ccc(C(=O)O)cc1O Amb25806241 [1,1,0,0,0,0|1,0,0]=3 3503 B12R1.48 NCc1ccc(C(=O)O)cc1O Amb33734446 [1,1,0,0,0,0|1,0,0]=3 3504 B12R1.48 NNc1ccc(C(=O)O)cc1Br Amb27855556 [1,1,0,0,0,0|2,0,0]=4 3505 B12R1.48 NNc1ccc(C(=O)O)cc1Cl Amb27170639 [1,1,0,0,0,0|2,0,0]=4 3506 B12R1.48 NNc1ccc(C(=O)O)cc1F Amb28280061 [1,1,0,0,0,0|2,0,0]=4 3507 B12R1.48 NNc1ccc(C(=O)O)cc1S Amb27239014 [1,1,0,0,0,0|1,1,0]=4 3508 B12R1.48 Nc1cc(C(=O)O)ccc1CBr Amb27868604 [1,1,0,0,0,0|2,0,0]=4 3509 B12R1.48 Nc1cc(C(=O)O)ccc1CCl Amb26933112 [1,1,0,0,0,0|2,0,0]=4 3510 B12R1.48 Nc1cc(C(=O)O)ccc1CI Amb26356634 [1,1,0,0,0,0|2,0,0]=4 3511 B12R1.48 Nc1cc(C(=O)O)ccc1CO Amb27863618 [1,1,0,0,0,0|1,0,0]=3 3512 B12R1.48 O=C(O)c1ccc(CBr)c(Br)c1 Amb26343188 [1,1,0,0,0,0|2,0,0]=4 3513 B12R1.48 O=C(O)c1ccc(CBr)c(Cl)c1 Amb20620507 [1,1,0,0,0,0|2,0,0]=4 3514 B12R1.48 O=C(O)c1ccc(CBr)c(F)c1 Amb8834431 [1,1,0,0,0,0|2,0,0]=4 3515 B12R1.48 O=C(O)c1ccc(CBr)c(I)c1 Amb22735959 [1,1,0,0,0,0|2,0,0]=4 3516 B12R1.48 O=C(O)c1ccc(CCl)c(Br)c1 Amb27968402 [1,1,0,0,0,0|2,0,0]=4 3517 B12R1.48 O=C(O)c1ccc(CCl)c(F)c1 Amb27162731 [1,1,0,0,0,0|2,0,0]=4 3518 B12R1.48 O=C(O)c1ccc(CCl)c(I)c1 Amb26080856 [1,1,0,0,0,0|2,0,0]=4 3519 B12R1.48 O=C(O)c1ccc(CF)c(Br)c1 Amb25817243 [1,1,0,0,0,0|2,0,0]=4 3520 B12R1.48 O=C(O)c1ccc(CF)c(Cl)c1 Amb25342126 [1,1,0,0,0,0|2,0,0]=4 3521 B12R1.48 O=C(O)c1ccc(CF)c(F)c1 Amb26639583 [1,1,0,0,0,0|2,0,0]=4 3522 B12R1.48 O=C(O)c1ccc(CF)c(I)c1 Amb27462764 [1,1,0,0,0,0|2,0,0]=4 3523 B12R1.48 O=C(O)c1ccc(CF)c(O)c1 Amb28241248 [1,1,0,0,0,0|1,0,0]=3 3524 B12R1.48 O=C(O)c1ccc(CI)c(Br)c1 Amb25783168 [1,1,0,0,0,0|2,0,0]=4 3525 B12R1.48 O=C(O)c1ccc(CI)c(Cl)c1 Amb26519065 [1,1,0,0,0,0|2,0,0]=4 3526 B12R1.48 O=C(O)c1ccc(CI)c(F)c1 Amb27273100 [1,1,0,0,0,0|2,0,0]=4 3527 B12R1.48 O=C(O)c1ccc(CI)c(O)c1 Amb24730825 [1,1,0,0,0,0|1,0,0]=3 3528 B12R1.48 O=C(O)c1ccc(CO)c(Br)c1 Amb25998865 [1,1,0,0,0,0|1,0,0]=3 3529 B12R1.48 O=C(O)c1ccc(CO)c(Cl)c1 Amb25281582 [1,1,0,0,0,0|1,0,0]=3 3530 B12R1.48 O=C(O)c1ccc(CO)c(F)c1 Amb18967400 [1,1,0,0,0,0|1,0,0]=3 3531 B12R1.48 O=C(O)c1ccc(CO)c(O)c1 Amb18646835 [1,1,0,0,0,0|0,0,0]=2 3532 B12R1.48 O=C(O)c1ccc(CS)c(F)c1 Amb8834435 [1,1,0,0,0,0|1,1,0]=4 3533 B12R1.48 O=Cc1ccc(C(=O)O)cc1Br Amb21857331 [1,1,0,0,0,0|1,0,1]=4 3534 B12R1.48 O=Cc1ccc(C(=O)O)cc1Cl Amb18649008 [1,1,0,0,0,0|1,0,1]=4 3535 B12R1.48 O=Cc1ccc(C(=O)O)cc1F Amb22494636 [1,1,0,0,0,0|1,0,1]=4 3536 B12R1.48 O=Cc1ccc(C(=O)O)cc1O Amb10602735 [1,1,0,0,0,0|0,0,1]=3 3537 B12R1.48 O=Cc1ncc(C(=O)O)cc1O Amb25876182 [1,1,0,0,0,0|1,0,1]=4 3538 B12R1.48 O=[N+]([O-])c1ccc(CO)c(O)c1 Amb10842186 [1,1,0,0,0,0|1,0,1]=4 3539 B12R1.232 CC(=O)c1cc(Br)c(O)cc1C Amb33191930 [1,1,0,0,0,0|2,0,0]=4 3540 B12R1.232 CC(=O)c1cc(Br)c(O)cc1Cl Amb33191958 [1,1,0,0,0,0|2,0,0]=4 3541 B12R1.232 CC(=O)c1cc(Br)c(O)cc1F Amb28291082 [1,1,0,0,0,0|2,0,0]=4 3542 B12R1.232 CC(=O)c1cc(Br)c(O)cc1O Amb1923718 [1,1,0,0,0,0|2,0,0]=4 3543 B12R1.232 CC(=O)c1cc(C)c(Br)cc1N Amb32687598 [1,1,0,0,0,0|2,0,0]=4 3544 B12R1.232 CC(=O)c1cc(C)c(Br)cc1O Amb10807904 [1,1,0,0,0,0|2,0,0]=4 3545 B12R1.232 CC(=O)c1cc(C)c(C)cc1C Amb4020580 [1,1,0,0,0,0|2,0,0]=4 3546 B12R1.232 CC(=O)c1cc(C)c(C)cc1Cl Amb27448211 [1,1,0,0,0,0|2,0,0]=4 3547 B12R1.232 CC(=O)c1cc(C)c(C)cc1N Amb18645872 [1,1,0,0,0,0|2,0,0]=4 3548 B12R1.232 CC(=O)c1cc(C)c(C)cc1O Amb2488102 [1,1,0,0,0,0|2,0,0]=4 3549 B12R1.232 CC(=O)c1cc(C)c(C)cc1S Amb25681472 [1,1,0,0,0,0|2,0,0]=4 3550 B12R1.232 CC(=O)c1cc(C)c(Cl)cc1Cl Amb10603511 [1,1,0,0,0,0|2,0,0]=4 3551 B12R1.232 CC(=O)c1cc(C)c(Cl)cc1F Amb2608460 [1,1,0,0,0,0|2,0,0]=4 3552 B12R1.232 CC(=O)c1cc(C)c(Cl)cc1N Amb26348985 [1,1,0,0,0,0|2,0,0]=4 3553 B12R1.232 CC(=O)c1cc(C)c(Cl)cc1O Amb26315623 [1,1,0,0,0,0|2,0,0]=4 3554 B12R1.232 CC(=O)c1cc(C)c(F)cc1C Amb26583367 [1,1,0,0,0,0|2,0,0]=4 3555 B12R1.232 CC(=O)c1cc(C)c(F)cc1Cl Amb25071021 [1,1,0,0,0,0|2,0,0]=4 3556 B12R1.232 CC(=O)c1cc(C)c(F)cc1F Amb26371830 [1,1,0,0,0,0|2,0,0]=4 3557 B12R1.232 CC(=O)c1cc(C)c(F)cc1N Amb32687594 [1,1,0,0,0,0|2,0,0]=4 3558 B12R1.232 CC(=O)c1cc(C)c(F)cc1O Amb24689598 [1,1,0,0,0,0|2,0,0]=4 3559 B12R1.232 CC(=O)c1cc(C)c(N)cc1C Amb24309006 [1,1,0,0,0,0|2,0,0]=4 3560 B12R1.232 CC(=O)c1cc(C)c(O)cc1C Amb4036292 [1,1,0,0,0,0|1,0,0]=3 3561 B12R1.232 CC(=O)c1cc(Cl)c(O)cc1Cl Amb18654815 [1,1,0,0,0,0|2,0,0]=4 3562 B12R1.232 CC(=O)c1cc(Cl)c(O)cc1F Amb26006464 [1,1,0,0,0,0|2,0,0]=4 3563 B12R1.232 CC(=O)c1cc(Cl)c(O)cc1O Amb2209360 [1,1,0,0,0,0|2,0,0]=4 3564 B12R1.232 CC(=O)c1cc(F)c(O)cc1C Amb27816764 [1,1,0,0,0,0|2,0,0]=4 3565 B12R1.232 CC(=O)c1cc(O)c(Br)cc1F Amb25919854 [1,1,0,0,0,0|2,0,0]=4 3566 B12R1.232 CC(=O)c1cc(O)c(C)cc1C Amb27836850 [1,1,0,0,0,0|2,0,0]=4 3567 B12R1.232 CC(=O)c1cc(O)c(C)cc1O Amb4009530 [1,1,0,0,0,0|2,0,0]=4 3568 B12R1.232 CC(=O)c1cc(O)c(F)cc1Br Amb27791290 [1,1,0,0,0,0|2,0,0]=4 3569 B12R1.232 CC(=O)c1cc(O)c(F)cc1C Amb27229188 [1,1,0,0,0,0|2,0,0]=4 3570 B12R1.232 CC(=O)c1cc(O)c(F)cc1O Amb27874995 [1,1,0,0,0,0|2,0,0]=4 3571 B12R1.232 CC(=O)c1cc(O)c(O)cc1C Amb24057159 [1,1,0,0,0,0|1,0,0]=3 3572 B12R1.232 CC(=O)c1cc(O)c(O)cc1O Amb6378082 [1,1,0,0,0,0|1,0,0]=3 3573 B12R1.232 CC1=C(C)NC(=O)C(C(=O)O)=C1 Amb18279279 [1,1,0,0,0,0|2,0,0]=4 3574 B12R1.232 CC1=C(C)NC(=S)C(C(=O)O)=C1 Amb26491501 [1,1,0,0,0,0|2,0,0]=4 3575 B12R1.232 CC1=CC(=O)C(C(=O)O)=CN1C Amb22232095 [1,1,0,0,0,0|2,0,0]=4 3576 B12R1.232 CN1C=C(C(=O)O)C(Cl)=CC1=O Amb21927468 [1,1,0,0,0,0|1,0,1]=4 3577 B12R1.232 CN1C=C(C(=O)O)C(O)=CC1=O Amb20243448 [1,1,0,0,0,0|1,0,1]=4 3578 B12R1.232 CN1C=C(O)C(=O)C=C1C(=O)O Amb26075107 [1,1,0,0,0,0|1,0,1]=4 3579 B12R1.232 Cc1cc(B(O)O)c(C)cc1O Amb22277793 [1,1,0,0,0,0|1,0,1]=4 3580 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1Br Amb24080578 [1,1,0,0,0,0|2,0,0]=4 3581 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1C Amb18277356 [1,1,0,0,0,0|1,0,0]=3 3582 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1Cl Amb26501483 [1,1,0,0,0,0|2,0,0]=4 3583 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1F Amb20242747 [1,1,0,0,0,0|2,0,0]=4 3584 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1I Amb26519574 [1,1,0,0,0,0|2,0,0]=4 3585 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1N Amb21962178 [1,1,0,0,0,0|2,0,0]=4 3586 B12R1.232 Cc1cc(Br)c(C(=O)O)cc1O Amb25048549 [1,1,0,0,0,0|1,0,0]=3 3587 B12R1.232 Cc1cc(Br)c(C(=O)O)nc1O Amb27959085 [1,1,0,0,0,0|2,0,0]=4 3588 B12R1.232 Cc1cc(Br)c(C(N)=O)cc1C Amb18277162 [1,1,0,0,0,0|2,0,0]=4 3589 B12R1.232 Cc1cc(Br)c(Cl)cc1C(=O)O Amb19892524 [1,1,0,0,0,0|2,0,0]=4 3590 B12R1.232 Cc1cc(Br)c(F)cc1C(=O)O Amb19892520 [1,1,0,0,0,0|2,0,0]=4 3591 B12R1.232 Cc1cc(Br)c(I)cc1C(=O)O Amb25188316 [1,1,0,0,0,0|2,0,0]=4 3592 B12R1.232 Cc1cc(Br)c(N)cc1C(=O)O Amb22886418 [1,1,0,0,0,0|2,0,0]=4 3593 B12R1.232 Cc1cc(C(=O)Cl)c(C)cc1F Amb26905967 [1,1,0,0,0,0|2,0,0]=4 3594 B12R1.232 Cc1cc(C(=O)Cl)c(C)cc1O Amb26895040 [1,1,0,0,0,0|1,0,0]=3 3595 B12R1.232 Cc1cc(C(=O)Cl)c(Cl)cc1Cl Amb26907749 [1,1,0,0,0,0|2,0,0]=4 3596 B12R1.232 Cc1cc(C(=O)Cl)c(Cl)cc1F Amb26569911 [1,1,0,0,0,0|2,0,0]=4 3597 B12R1.232 Cc1cc(C(=O)Cl)c(F)cc1F Amb19891023 [1,1,0,0,0,0|2,0,0]=4 3598 B12R1.232 Cc1cc(C(=O)O)c(Br)cc1F Amb20242745 [1,1,0,0,0,0|1,0,0]=3 3599 B12R1.232 Cc1cc(C(=O)O)c(Br)cc1N Amb32665257 [1,1,0,0,0,0|1,0,0]=3 3600 B12R1.232 Cc1cc(C(=O)O)c(Br)nc1C Amb25802377 [1,1,0,0,0,0|2,0,0]=4 3601 B12R1.232 Cc1cc(C(=O)O)c(C)cc1Br Amb2387606 [1,1,0,0,0,0|1,0,0]=3 3602 B12R1.232 Cc1cc(C(=O)O)c(C)cc1Cl Amb33544577 [1,1,0,0,0,0|1,0,0]=3 3603 B12R1.232 Cc1cc(C(=O)O)c(C)cc1N Amb22898895 [1,1,0,0,0,0|1,0,0]=3 3604 B12R1.232 Cc1cc(C(=O)O)c(C)cc1O Amb22235639 [1,1,0,0,0,0|0,0,0]=2 3605 B12R1.232 Cc1cc(C(=O)O)c(C)nc1C Amb25949773 [1,1,0,0,0,0|2,0,0]=4 3606 B12R1.232 Cc1cc(C(=O)O)c(C)nc1Cl Amb27169252 [1,1,0,0,0,0|2,0,0]=4 3607 B12R1.232 Cc1cc(C(=O)O)c(Cl)cc1Br Amb19930143 [1,1,0,0,0,0|1,0,0]=3 3608 B12R1.232 Cc1cc(C(=O)O)c(Cl)cc1Cl Amb8627728 [1,1,0,0,0,0|1,0,0]=3 3609 B12R1.232 Cc1cc(C(=O)O)c(Cl)cc1F Amb20669066 [1,1,0,0,0,0|1,0,0]=3 3610 B12R1.232 Cc1cc(C(=O)O)c(Cl)cc1N Amb26367605 [1,1,0,0,0,0|1,0,0]=3 3611 B12R1.232 Cc1cc(C(=O)O)c(Cl)cc1S Amb26519172 [1,1,0,0,0,0|0,1,0]=3 3612 B12R1.232 Cc1cc(C(=O)O)c(Cl)nc1C Amb2721950 [1,1,0,0,0,0|2,0,0]=4 3613 B12R1.232 Cc1cc(C(=O)O)c(Cl)nc1Cl Amb33743882 [1,1,0,0,0,0|2,0,0]=4 3614 B12R1.232 Cc1cc(C(=O)O)c(F)cc1Br Amb8628794 [1,1,0,0,0,0|1,0,0]=3 3615 B12R1.232 Cc1cc(C(=O)O)c(F)cc1Cl Amb24692895 [1,1,0,0,0,0|1,0,0]=3 3616 B12R1.232 Cc1cc(C(=O)O)c(F)cc1F Amb16231855 [1,1,0,0,0,0|1,0,0]=3 3617 B12R1.232 Cc1cc(C(=O)O)c(F)cc1N Amb27621436 [1,1,0,0,0,0|1,0,0]=3 3618 B12R1.232 Cc1cc(C(=O)O)c(F)cc1N Amb33483548 [1,1,0,0,0,0|1,0,0]=3 3619 B12R1.232 Cc1cc(C(=O)O)c(I)cc1Cl Amb26428652 [1,1,0,0,0,0|1,0,0]=3 3620 B12R1.232 Cc1cc(C(=O)O)c(N)cc1Cl Amb20241072 [1,1,0,0,0,0|1,0,0]=3 3621 B12R1.232 Cc1cc(C(=O)O)c(N)cc1F Amb26371761 [1,1,0,0,0,0|1,0,0]=3 3622 B12R1.232 Cc1cc(C(=O)O)c(N)nc1C Amb28342210 [1,1,0,0,0,0|2,0,0]=4 3623 B12R1.232 Cc1cc(C(=O)O)c(O)cc1Cl Amb25975371 [1,1,0,0,0,0|1,0,0]=3 3624 B12R1.232 Cc1cc(C(=O)O)c(O)cc1N Amb27974143 [1,1,0,0,0,0|1,0,0]=3 3625 B12R1.232 Cc1cc(C(=O)O)c(O)cc1O Amb6298097 [1,1,0,0,0,0|0,0,0]=2 3626 B12R1.232 Cc1cc(C(=O)O)c(S)cc1F Amb25687553 [1,1,0,0,0,0|1,0,0]=3 3627 B12R1.232 Cc1cc(C(N)=O)c(C)cc1Br Amb18941059 [1,1,0,0,0,0|2,0,0]=4 3628 B12R1.232 Cc1cc(C(N)=O)c(C)cc1Cl Amb18941084 [1,1,0,0,0,0|2,0,0]=4 3629 B12R1.232 Cc1cc(C(N)=O)c(C)cc1F Amb26608324 [1,1,0,0,0,0|2,0,0]=4 3630 B12R1.232 Cc1cc(C(N)=O)c(Cl)cc1Cl Amb24757762 [1,1,0,0,0,0|2,0,0]=4 3631 B12R1.232 Cc1cc(C(N)=O)c(Cl)cc1F Amb26971827 [1,1,0,0,0,0|2,0,0]=4 3632 B12R1.232 Cc1cc(C(N)=O)c(F)cc1Br Amb32413169 [1,1,0,0,0,0|2,0,0]=4 3633 B12R1.232 Cc1cc(C(N)=O)c(F)cc1Cl Amb25970741 [1,1,0,0,0,0|2,0,0]=4 3634 B12R1.232 Cc1cc(C(N)=O)c(F)cc1F Amb27861730 [1,1,0,0,0,0|2,0,0]=4 3635 B12R1.232 Cc1cc(C)c(C(=O)Cl)cc1O Amb25218076 [1,1,0,0,0,0|2,0,0]=4 3636 B12R1.232 Cc1cc(C)c(C(=O)O)cc1Br Amb22488644 [1,1,0,0,0,0|2,0,0]=4 3637 B12R1.232 Cc1cc(C)c(C(=O)O)cc1C Amb6358004 [1,1,0,0,0,0|1,0,0]=3 3638 B12R1.232 Cc1cc(C)c(C(=O)O)cc1Cl Amb18649028 [1,1,0,0,0,0|2,0,0]=4 3639 B12R1.232 Cc1cc(C)c(C(=O)O)cc1F Amb27436194 [1,1,0,0,0,0|2,0,0]=4 3640 B12R1.232 Cc1cc(C)c(C(=O)O)cc1I Amb16232629 [1,1,0,0,0,0|2,0,0]=4 3641 B12R1.232 Cc1cc(C)c(C(=O)O)cc1N Amb18948978 [1,1,0,0,0,0|2,0,0]=4 3642 B12R1.232 Cc1cc(C)c(C(=O)O)cc1O Amb18646462 [1,1,0,0,0,0|1,0,0]=3 3643 B12R1.232 Cc1cc(C)c(C(=O)O)cc1S Amb24054267 [1,1,0,0,0,0|1,1,0]=4 3644 B12R1.232 Cc1cc(C)c(C(=O)O)nc1C Amb24607279 [1,1,0,0,0,0|2,0,0]=4 3645 B12R1.232 Cc1cc(C)c(C(N)=O)cc1C Amb18893480 [1,1,0,0,0,0|2,0,0]=4 3646 B12R1.232 Cc1cc(C)c(C(N)=O)cc1O Amb28323469 [1,1,0,0,0,0|2,0,0]=4 3647 B12R1.232 Cc1cc(C)c(S(=O)O)cc1C Amb18863096 [1,1,0,0,0,0|2,0,0]=4 3648 B12R1.232 Cc1cc(Cl)c(C(=O)Cl)cc1C Amb33471794 [1,1,0,0,0,0|2,0,0]=4 3649 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1Br Amb25349081 [1,1,0,0,0,0|2,0,0]=4 3650 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1C Amb18275360 [1,1,0,0,0,0|1,0,0]=3 3651 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1Cl Amb25785555 [1,1,0,0,0,0|2,0,0]=4 3652 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1F Amb18650032 [1,1,0,0,0,0|2,0,0]=4 3653 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1I Amb27861934 [1,1,0,0,0,0|2,0,0]=4 3654 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1N Amb25363420 [1,1,0,0,0,0|2,0,0]=4 3655 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1O Amb16233259 [1,1,0,0,0,0|1,0,0]=3 3656 B12R1.232 Cc1cc(Cl)c(C(=O)O)cc1S Amb27591425 [1,1,0,0,0,0|1,1,0]=4 3657 B12R1.232 Cc1cc(Cl)c(C(N)=O)cc1C Amb18275353 [1,1,0,0,0,0|2,0,0]=4 3658 B12R1.232 Cc1cc(Cl)c(Cl)cc1C(=O)O Amb25103345 [1,1,0,0,0,0|2,0,0]=4 3659 B12R1.232 Cc1cc(Cl)c(O)nc1C(=O)O Amb27623549 [1,1,0,0,0,0|2,0,0]=4 3660 B12R1.232 Cc1cc(F)c(Br)cc1C(=O)O Amb24053146 [1,1,0,0,0,0|2,0,0]=4 3661 B12R1.232 Cc1cc(F)c(C(=O)O)cc1Br Amb24088515 [1,1,0,0,0,0|2,0,0]=4 3662 B12R1.232 Cc1cc(F)c(C(=O)O)cc1Cl Amb20242303 [1,1,0,0,0,0|2,0,0]=4 3663 B12R1.232 Cc1cc(F)c(C(=O)O)cc1F Amb16231712 [1,1,0,0,0,0|2,0,0]=4 3664 B12R1.232 Cc1cc(F)c(C(=O)O)cc1I Amb33532917 [1,1,0,0,0,0|2,0,0]=4 3665 B12R1.232 Cc1cc(F)c(C(=O)O)cc1N Amb24331721 [1,1,0,0,0,0|2,0,0]=4 3666 B12R1.232 Cc1cc(F)c(C(=O)O)cc1O Amb21964641 [1,1,0,0,0,0|1,0,0]=3 3667 B12R1.232 Cc1cc(F)c(C(=O)O)cc1S Amb24054266 [1,1,0,0,0,0|1,1,0]=4 3668 B12R1.232 Cc1cc(F)c(Cl)cc1C(=O)O Amb27751714 [1,1,0,0,0,0|2,0,0]=4 3669 B12R1.232 Cc1cc(F)c(F)cc1C(=O)O Amb16231854 [1,1,0,0,0,0|2,0,0]=4 3670 B12R1.232 Cc1cc(F)c(N)cc1C(=O)O Amb24677601 [1,1,0,0,0,0|2,0,0]=4 3671 B12R1.232 Cc1cc(F)c(O)cc1C(=O)O Amb28246129 [1,1,0,0,0,0|1,0,0]=3 3672 B12R1.232 Cc1cc(F)c(O)cc1C(N)=O Amb32413213 [1,1,0,0,0,0|2,0,0]=4 3673 B12R1.232 Cc1cc(I)c(C(=O)O)cc1C Amb25858918 [1,1,0,0,0,0|1,0,0]=3 3674 B12R1.232 Cc1cc(I)c(C(=O)O)cc1I Amb25742874 [1,1,0,0,0,0|2,0,0]=4 3675 B12R1.232 Cc1cc(I)c(C(N)=O)cc1C Amb28077868 [1,1,0,0,0,0|2,0,0]=4 3676 B12R1.232 Cc1cc(N(=O)O)c(Cl)cc1N Amb33782141 [1,1,0,0,0,0|2,0,0]=4 3677 B12R1.232 Cc1cc(N)c(Br)cc1C(=O)O Amb25894819 [1,1,0,0,0,0|2,0,0]=4 3678 B12R1.232 Cc1cc(N)c(C(=O)O)cc1Br Amb18135201 [1,1,0,0,0,0|2,0,0]=4 3679 B12R1.232 Cc1cc(N)c(C(=O)O)cc1C Amb10807718 [1,1,0,0,0,0|1,0,0]=3 3680 B12R1.232 Cc1cc(N)c(C(=O)O)cc1Cl Amb26536460 [1,1,0,0,0,0|2,0,0]=4 3681 B12R1.232 Cc1cc(N)c(C(=O)O)cc1F Amb18647115 [1,1,0,0,0,0|2,0,0]=4 3682 B12R1.232 Cc1cc(N)c(C(=O)O)cc1O Amb24181917 [1,1,0,0,0,0|1,0,0]=3 3683 B12R1.232 Cc1cc(N)c(C(=O)O)nc1C Amb32417125 [1,1,0,0,0,0|2,0,0]=4 3684 B12R1.232 Cc1cc(N)c(C(N)=O)cc1C Amb27232920 [1,1,0,0,0,0|2,0,0]=4 3685 B12R1.232 Cc1cc(N)c(C)nc1C(=O)O Amb26542177 [1,1,0,0,0,0|2,0,0]=4 3686 B12R1.232 Cc1cc(N)c(C)nc1C(=O)O Amb32826098 [1,1,0,0,0,0|2,0,0]=4 3687 B12R1.232 Cc1cc(N)c(I)cc1C(=O)O Amb27187709 [1,1,0,0,0,0|2,0,0]=4 3688 B12R1.232 Cc1cc(O)c(C(=O)Cl)cc1C Amb25208711 [1,1,0,0,0,0|2,0,0]=4 3689 B12R1.232 Cc1cc(O)c(C(=O)O)cc1C Amb18646452 [1,1,0,0,0,0|1,0,0]=3 3690 B12R1.232 Cc1cc(O)c(C(=O)O)cc1Cl Amb18055836 [1,1,0,0,0,0|2,0,0]=4 3691 B12R1.232 Cc1cc(O)c(C(=O)O)cc1I Amb8393488 [1,1,0,0,0,0|2,0,0]=4 3692 B12R1.232 Cc1cc(O)c(C(=O)O)cc1O Amb17594191 [1,1,0,0,0,0|1,0,0]=3 3693 B12R1.232 Cc1cc(O)c(C(=O)O)cc1S Amb27816139 [1,1,0,0,0,0|1,1,0]=4 3694 B12R1.232 Cc1cc(O)c(C(N)=O)cc1C Amb26442481 [1,1,0,0,0,0|2,0,0]=4 3695 B12R1.232 Cc1cc(O)c(Cl)cc1C(=O)O Amb25898968 [1,1,0,0,0,0|1,0,0]=3 3696 B12R1.232 Cc1cc(O)c(I)cc1C(=O)O Amb28205163 [1,1,0,0,0,0|1,0,0]=3 3697 B12R1.232 Cc1cc(O)c(O)cc1C(=O)O Amb3994572 [1,1,0,0,0,0|0,0,0]=2 3698 B12R1.232 Cc1cc(O)c(O)cc1[N+](=O)[O-] Amb17617650 [1,1,0,0,0,0|1,0,1]=4 3699 B12R1.232 Cc1cc(S)c(C(=O)O)cc1O Amb26356512 [1,1,0,0,0,0|1,0,0]=3 3700 B12R1.232 Cc1cc([N+](=O)[O-])c(C)cc1O Amb6892207 [1,1,0,0,0,0|1,0,1]=4 3701 B12R1.232 Cc1cc([N+](=O)[O-])c(Cl)cc1O Amb28244080 [1,1,0,0,0,0|1,0,1]=4 3702 B12R1.232 Cc1cc([N+](=O)[O-])c(F)cc1O Amb26375489 [1,1,0,0,0,0|1,0,1]=4 3703 B12R1.232 Cc1nc(C(=O)O)c(O)cc1Br Amb28196129 [1,1,0,0,0,0|2,0,0]=4 3704 B12R1.232 Cc1nc(C)c(C(=O)O)cc1O Amb28138083 [1,1,0,0,0,0|2,0,0]=4 3705 B12R1.232 Cc1nc(Cl)c(C(=O)O)cc1O Amb18649690 [1,1,0,0,0,0|2,0,0]=4 3706 B12R1.232 N=C(N)c1cc(O)c(O)cc1O Amb27614520 [1,1,0,0,0,0|2,0,0]=4 3707 B12R1.232 NC(=O)c1cc(Br)c(O)cc1F Amb28140826 [1,1,0,0,0,0|2,0,0]=4 3708 B12R1.232 NC(=O)c1cc(Cl)c(O)cc1Cl Amb25342186 [1,1,0,0,0,0|2,0,0]=4 3709 B12R1.232 NC(=O)c1cc(F)c(O)cc1Br Amb25895202 [1,1,0,0,0,0|2,0,0]=4 3710 B12R1.232 NC(=O)c1cc(I)c(O)cc1I Amb24628228 [1,1,0,0,0,0|2,0,0]=4 3711 B12R1.232 NC(=O)c1cc(O)c(Br)cc1N Amb27644176 [1,1,0,0,0,0|2,0,0]=4 3712 B12R1.232 NC(=O)c1cc(O)c(Cl)cc1Cl Amb28196652 [1,1,0,0,0,0|2,0,0]=4 3713 B12R1.232 NC(=O)c1cc(O)c(F)cc1F Amb27445766 [1,1,0,0,0,0|2,0,0]=4 3714 B12R1.232 NC(=O)c1cc(O)c(I)cc1I Amb27670028 [1,1,0,0,0,0|2,0,0]=4 3715 B12R1.232 NC(=O)c1cc(O)c(O)cc1N Amb27430562 [1,1,0,0,0,0|1,0,0]=3 3716 B12R1.232 Nc1cc(Br)c(Br)cc1C(=O)O Amb2324705 [1,1,0,0,0,0|2,0,0]=4 3717 B12R1.232 Nc1cc(Br)c(C(=O)O)cc1Cl Amb27482483 [1,1,0,0,0,0|2,0,0]=4 3718 B12R1.232 Nc1cc(Br)c(C(=O)O)cc1F Amb24058408 [1,1,0,0,0,0|2,0,0]=4 3719 B12R1.232 Nc1cc(Br)c(C(=O)O)cc1N Amb28196353 [1,1,0,0,0,0|2,0,0]=4 3720 B12R1.232 Nc1cc(Br)c(C(=O)O)cc1S Amb24730962 [1,1,0,0,0,0|1,1,0]=4 3721 B12R1.232 Nc1cc(Br)c(Cl)cc1C(=O)O Amb17609944 [1,1,0,0,0,0|2,0,0]=4 3722 B12R1.232 Nc1cc(Br)c(F)cc1C(=O)O Amb22735722 [1,1,0,0,0,0|2,0,0]=4 3723 B12R1.232 Nc1cc(Br)c(I)cc1C(=O)O Amb28455071 [1,1,0,0,0,0|2,0,0]=4 3724 B12R1.232 Nc1cc(C(=O)O)c(Br)cc1Br Amb28047382 [1,1,0,0,0,0|2,0,0]=4 3725 B12R1.232 Nc1cc(C(=O)O)c(Br)cc1Cl Amb19888243 [1,1,0,0,0,0|2,0,0]=4 3726 B12R1.232 Nc1cc(C(=O)O)c(Br)cc1F Amb18280666 [1,1,0,0,0,0|2,0,0]=4 3727 B12R1.232 Nc1cc(C(=O)O)c(Cl)cc1Cl Amb1088848 [1,1,0,0,0,0|2,0,0]=4 3728 B12R1.232 Nc1cc(C(=O)O)c(Cl)cc1F Amb18949084 [1,1,0,0,0,0|2,0,0]=4 3729 B12R1.232 Nc1cc(C(=O)O)c(Cl)cc1I Amb27439208 [1,1,0,0,0,0|2,0,0]=4 3730 B12R1.232 Nc1cc(C(=O)O)c(Cl)cc1S Amb18273823 [1,1,0,0,0,0|1,1,0]=4 3731 B12R1.232 Nc1cc(C(=O)O)c(F)cc1Cl Amb18949085 [1,1,0,0,0,0|2,0,0]=4 3732 B12R1.232 Nc1cc(C(=O)O)c(F)cc1Cl Amb19959136 [1,1,0,0,0,0|2,0,0]=4 3733 B12R1.232 Nc1cc(C(=O)O)c(F)cc1F Amb9200685 [1,1,0,0,0,0|2,0,0]=4 3734 B12R1.232 Nc1cc(C(=O)O)c(F)cc1O Amb27399206 [1,1,0,0,0,0|1,0,0]=3 3735 B12R1.232 Nc1cc(C(=O)O)c(F)cc1S Amb27480625 [1,1,0,0,0,0|1,1,0]=4 3736 B12R1.232 Nc1cc(C(=O)O)c(I)cc1Cl Amb28282227 [1,1,0,0,0,0|2,0,0]=4 3737 B12R1.232 Nc1cc(C(=O)O)c(I)cc1F Amb27833022 [1,1,0,0,0,0|2,0,0]=4 3738 B12R1.232 Nc1cc(C(=O)O)c(I)cc1I Amb26457977 [1,1,0,0,0,0|2,0,0]=4 3739 B12R1.232 Nc1cc(C(=O)O)c(O)cc1O Amb21858880 [1,1,0,0,0,0|1,0,0]=3 3740 B12R1.232 Nc1cc(C(=O)O)c(S)cc1F Amb27395867 [1,1,0,0,0,0|2,0,0]=4 3741 B12R1.232 Nc1cc(Cl)c(Br)cc1C(=O)O Amb22057836 [1,1,0,0,0,0|2,0,0]=4 3742 B12R1.232 Nc1cc(Cl)c(C(=O)O)cc1N Amb23559486 [1,1,0,0,0,0|2,0,0]=4 3743 B12R1.232 Nc1cc(Cl)c(Cl)cc1C(=O)O Amb10601677 [1,1,0,0,0,0|2,0,0]=4 3744 B12R1.232 Nc1cc(Cl)c(F)cc1C(=O)O Amb21857932 [1,1,0,0,0,0|2,0,0]=4 3745 B12R1.232 Nc1cc(Cl)c(I)cc1C(=O)O Amb23412477 [1,1,0,0,0,0|2,0,0]=4 3746 B12R1.232 Nc1cc(Cl)c(O)cc1C(=O)O Amb25086976 [1,1,0,0,0,0|1,0,0]=3 3747 B12R1.232 Nc1cc(F)c(Br)cc1C(=O)O Amb19887795 [1,1,0,0,0,0|2,0,0]=4 3748 B12R1.232 Nc1cc(F)c(C(=O)O)cc1Br Amb24088451 [1,1,0,0,0,0|2,0,0]=4 3749 B12R1.232 Nc1cc(F)c(C(=O)O)cc1Cl Amb27983722 [1,1,0,0,0,0|2,0,0]=4 3750 B12R1.232 Nc1cc(F)c(C(=O)O)cc1F Amb16231856 [1,1,0,0,0,0|2,0,0]=4 3751 B12R1.232 Nc1cc(F)c(C(=O)O)cc1I Amb24088454 [1,1,0,0,0,0|2,0,0]=4 3752 B12R1.232 Nc1cc(F)c(C(=O)O)cc1N Amb25315639 [1,1,0,0,0,0|2,0,0]=4 3753 B12R1.232 Nc1cc(F)c(Cl)cc1C(=O)O Amb22011639 [1,1,0,0,0,0|2,0,0]=4 3754 B12R1.232 Nc1cc(F)c(F)cc1C(=O)O Amb3940791 [1,1,0,0,0,0|2,0,0]=4 3755 B12R1.232 Nc1cc(F)c(I)cc1C(=O)O Amb25687909 [1,1,0,0,0,0|2,0,0]=4 3756 B12R1.232 Nc1cc(F)c(O)cc1C(=O)O Amb18946373 [1,1,0,0,0,0|1,0,0]=3 3757 B12R1.232 Nc1cc(I)c(I)cc1C(=O)O Amb26444622 [1,1,0,0,0,0|2,0,0]=4 3758 B12R1.232 Nc1cc(N)c(C(=O)O)cc1F Amb27869609 [1,1,0,0,0,0|2,0,0]=4 3759 B12R1.232 Nc1cc(O)c(C(=O)O)cc1Cl Amb27668805 [1,1,0,0,0,0|2,0,0]=4 3760 B12R1.232 Nc1cc(O)c(C(=O)O)cc1O Amb27607723 [1,1,0,0,0,0|1,0,0]=3 3761 B12R1.232 Nc1cc(O)c(C(=O)O)cc1S Amb18274044 [1,1,0,0,0,0|1,1,0]=4 3762 B12R1.232 O=C(Cl)c1cc(Br)c(O)cc1F Amb26456946 [1,1,0,0,0,0|2,0,0]=4 3763 B12R1.232 O=C(Cl)c1cc(F)c(O)cc1Br Amb28434935 [1,1,0,0,0,0|2,0,0]=4 3764 B12R1.232 O=C(Cl)c1cc(F)c(O)cc1F Amb24393326 [1,1,0,0,0,0|2,0,0]=4 3765 B12R1.232 O=C(Cl)c1cc(I)c(O)cc1I Amb27614050 [1,1,0,0,0,0|2,0,0]=4 3766 B12R1.232 O=C(Cl)c1cc(O)c(Br)cc1F Amb26994072 [1,1,0,0,0,0|2,0,0]=4 3767 B12R1.232 O=C(Cl)c1cc(O)c(F)cc1Br Amb27237824 [1,1,0,0,0,0|2,0,0]=4 3768 B12R1.232 O=C(O)c1cc(Br)c(Br)cc1Br Amb22547200 [1,1,0,0,0,0|2,0,0]=4 3769 B12R1.232 O=C(O)c1cc(Br)c(Br)cc1F Amb10841513 [1,1,0,0,0,0|2,0,0]=4 3770 B12R1.232 O=C(O)c1cc(Br)c(Cl)cc1Cl Amb20671517 [1,1,0,0,0,0|2,0,0]=4 3771 B12R1.232 O=C(O)c1cc(Br)c(Cl)cc1F Amb10841369 [1,1,0,0,0,0|2,0,0]=4 3772 B12R1.232 O=C(O)c1cc(Br)c(Cl)cc1I Amb26448278 [1,1,0,0,0,0|2,0,0]=4 3773 B12R1.232 O=C(O)c1cc(Br)c(Cl)cc1O Amb10069162 [1,1,0,0,0,0|2,0,0]=4 3774 B12R1.232 O=C(O)c1cc(Br)c(F)cc1Br Amb26370804 [1,1,0,0,0,0|2,0,0]=4 3775 B12R1.232 O=C(O)c1cc(Br)c(F)cc1Cl Amb25765612 [1,1,0,0,0,0|2,0,0]=4 3776 B12R1.232 O=C(O)c1cc(Br)c(F)cc1F Amb20248103 [1,1,0,0,0,0|2,0,0]=4 3777 B12R1.232 O=C(O)c1cc(Br)c(F)cc1I Amb25274564 [1,1,0,0,0,0|2,0,0]=4 3778 B12R1.232 O=C(O)c1cc(Br)c(F)cc1O Amb22001545 [1,1,0,0,0,0|2,0,0]=4 3779 B12R1.232 O=C(O)c1cc(Br)c(I)cc1I Amb25686107 [1,1,0,0,0,0|2,0,0]=4 3780 B12R1.232 O=C(O)c1cc(Br)c(O)cc1F Amb22739369 [1,1,0,0,0,0|1,0,0]=3 3781 B12R1.232 O=C(O)c1cc(Br)c(O)cc1O Amb1994164 [1,1,0,0,0,0|1,0,0]=3 3782 B12R1.232 O=C(O)c1cc(Br)c(O)cc1O Amb8517291 [1,1,0,0,0,0|1,0,0]=3 3783 B12R1.232 O=C(O)c1cc(Cl)c(Br)cc1Cl Amb2371908 [1,1,0,0,0,0|2,0,0]=4 3784 B12R1.232 O=C(O)c1cc(Cl)c(Br)cc1F Amb33549060 [1,1,0,0,0,0|2,0,0]=4 3785 B12R1.232 O=C(O)c1cc(Cl)c(Br)cc1O Amb25219553 [1,1,0,0,0,0|2,0,0]=4 3786 B12R1.232 O=C(O)c1cc(Cl)c(Cl)cc1Br Amb27642575 [1,1,0,0,0,0|2,0,0]=4 3787 B12R1.232 O=C(O)c1cc(Cl)c(Cl)cc1Cl Amb10070950 [1,1,0,0,0,0|2,0,0]=4 3788 B12R1.232 O=C(O)c1cc(Cl)c(Cl)cc1F Amb8397075 [1,1,0,0,0,0|2,0,0]=4 3789 B12R1.232 O=C(O)c1cc(Cl)c(Cl)cc1I Amb27433837 [1,1,0,0,0,0|2,0,0]=4 3790 B12R1.232 O=C(O)c1cc(Cl)c(Cl)cc1O Amb18276570 [1,1,0,0,0,0|2,0,0]=4 3791 B12R1.232 O=C(O)c1cc(Cl)c(F)cc1Br Amb33541554 [1,1,0,0,0,0|2,0,0]=4 3792 B12R1.232 O=C(O)c1cc(Cl)c(F)cc1Cl Amb33551184 [1,1,0,0,0,0|2,0,0]=4 3793 B12R1.232 O=C(O)c1cc(Cl)c(F)cc1F Amb8393514 [1,1,0,0,0,0|2,0,0]=4 3794 B12R1.232 O=C(O)c1cc(Cl)c(F)cc1I Amb26512559 [1,1,0,0,0,0|2,0,0]=4 3795 B12R1.232 O=C(O)c1cc(Cl)c(F)cc1O Amb22500903 [1,1,0,0,0,0|2,0,0]=4 3796 B12R1.232 O=C(O)c1cc(Cl)c(I)cc1I Amb27201947 [1,1,0,0,0,0|2,0,0]=4 3797 B12R1.232 O=C(O)c1cc(Cl)c(O)cc1O Amb10576217 [1,1,0,0,0,0|1,0,0]=3 3798 B12R1.232 O=C(O)c1cc(F)c(Br)cc1Br Amb21963251 [1,1,0,0,0,0|2,0,0]=4 3799 B12R1.232 O=C(O)c1cc(F)c(Br)cc1Cl Amb10841941 [1,1,0,0,0,0|2,0,0]=4 3800 B12R1.232 O=C(O)c1cc(F)c(Br)cc1F Amb2624352 [1,1,0,0,0,0|2,0,0]=4 3801 B12R1.232 O=C(O)c1cc(F)c(Br)cc1I Amb28423635 [1,1,0,0,0,0|2,0,0]=4 3802 B12R1.232 O=C(O)c1cc(F)c(Br)cc1O Amb24058375 [1,1,0,0,0,0|2,0,0]=4 3803 B12R1.232 O=C(O)c1cc(F)c(Cl)cc1Br Amb26381528 [1,1,0,0,0,0|2,0,0]=4 3804 B12R1.232 O=C(O)c1cc(F)c(Cl)cc1Cl Amb1228454 [1,1,0,0,0,0|2,0,0]=4 3805 B12R1.232 O=C(O)c1cc(F)c(Cl)cc1F Amb2685848 [1,1,0,0,0,0|2,0,0]=4 3806 B12R1.232 O=C(O)c1cc(F)c(Cl)cc1O Amb25981345 [1,1,0,0,0,0|2,0,0]=4 3807 B12R1.232 O=C(O)c1cc(F)c(F)cc1Br Amb16231729 [1,1,0,0,0,0|2,0,0]=4 3808 B12R1.232 O=C(O)c1cc(F)c(F)cc1Cl Amb2227600 [1,1,0,0,0,0|2,0,0]=4 3809 B12R1.232 O=C(O)c1cc(F)c(F)cc1F Amb2690742 [1,1,0,0,0,0|2,0,0]=4 3810 B12R1.232 O=C(O)c1cc(F)c(F)cc1I Amb8387502 [1,1,0,0,0,0|2,0,0]=4 3811 B12R1.232 O=C(O)c1cc(F)c(F)cc1O Amb22641796 [1,1,0,0,0,0|2,0,0]=4 3812 B12R1.232 O=C(O)c1cc(F)c(I)cc1Br Amb24058403 [1,1,0,0,0,0|2,0,0]=4 3813 B12R1.232 O=C(O)c1cc(F)c(I)cc1F Amb26894975 [1,1,0,0,0,0|2,0,0]=4 3814 B12R1.232 O=C(O)c1cc(F)c(I)cc1I Amb28135888 [1,1,0,0,0,0|2,0,0]=4 3815 B12R1.232 O=C(O)c1cc(F)c(O)cc1Br Amb26486670 [1,1,0,0,0,0|1,0,0]=3 3816 B12R1.232 O=C(O)c1cc(F)c(O)cc1F Amb22325214 [1,1,0,0,0,0|1,0,0]=3 3817 B12R1.232 O=C(O)c1cc(F)c(S)cc1Br Amb27833787 [1,1,0,0,0,0|1,1,0]=4 3818 B12R1.232 O=C(O)c1cc(F)c(S)cc1F Amb27600434 [1,1,0,0,0,0|1,1,0]=4 3819 B12R1.232 O=C(O)c1cc(I)c(Br)cc1Cl Amb27983423 [1,1,0,0,0,0|2,0,0]=4 3820 B12R1.232 O=C(O)c1cc(I)c(Br)cc1F Amb27178373 [1,1,0,0,0,0|2,0,0]=4 3821 B12R1.232 O=C(O)c1cc(I)c(Br)cc1I Amb24637063 [1,1,0,0,0,0|2,0,0]=4 3822 B12R1.232 O=C(O)c1cc(I)c(Cl)cc1Br Amb19888261 [1,1,0,0,0,0|2,0,0]=4 3823 B12R1.232 O=C(O)c1cc(I)c(Cl)cc1Cl Amb26054287 [1,1,0,0,0,0|2,0,0]=4 3824 B12R1.232 O=C(O)c1cc(I)c(Cl)cc1F Amb22057912 [1,1,0,0,0,0|2,0,0]=4 3825 B12R1.232 O=C(O)c1cc(I)c(F)cc1Br Amb26637938 [1,1,0,0,0,0|2,0,0]=4 3826 B12R1.232 O=C(O)c1cc(I)c(F)cc1Cl Amb22057916 [1,1,0,0,0,0|2,0,0]=4 3827 B12R1.232 O=C(O)c1cc(I)c(F)cc1F Amb10982557 [1,1,0,0,0,0|2,0,0]=4 3828 B12R1.232 O=C(O)c1cc(I)c(O)cc1O Amb26352300 [1,1,0,0,0,0|1,0,0]=3 3829 B12R1.232 O=C(O)c1cc(O)c(Br)cc1F Amb22262960 [1,1,0,0,0,0|1,0,0]=3 3830 B12R1.232 O=C(O)c1cc(O)c(Cl)cc1Cl Amb26629079 [1,1,0,0,0,0|1,0,0]=3 3831 B12R1.232 O=C(O)c1cc(O)c(F)cc1Br Amb21926754 [1,1,0,0,0,0|1,0,0]=3 3832 B12R1.232 O=C(O)c1cc(O)c(F)cc1F Amb22325209 [1,1,0,0,0,0|1,0,0]=3 3833 B12R1.232 O=C(O)c1cc(O)c(I)nc1I Amb21811923 [1,1,0,0,0,0|2,0,0]=4 3834 B12R1.232 O=C(O)c1cc(O)c(O)cc1F Amb3499176 [1,1,0,0,0,0|0,0,0]=2 3835 B12R1.232 O=C(O)c1cc(O)c(O)cc1O Amb8629065 [1,1,0,0,0,0|0,0,0]=2 3836 B12R1.232 O=C(O)c1cc(S)c(Br)cc1F Amb27597789 [1,1,0,0,0,0|1,1,0]=4 3837 B12R1.232 O=C(O)c1cc(S)c(Cl)cc1F Amb27817063 [1,1,0,0,0,0|1,1,0]=4 3838 B12R1.232 O=C(O)c1cc(S)c(F)cc1Br Amb27389411 [1,1,0,0,0,0|1,1,0]=4 3839 B12R1.232 O=C(O)c1cc(S)c(F)cc1F Amb27625014 [1,1,0,0,0,0|1,1,0]=4 3840 B12R1.232 O=[N+]([O-])c1cc(O)c(O)cc1O Amb27643166 [1,1,0,0,0,0|1,0,1]=4 3841 B12R1.367 C#CC(=O)c1ccc(C)c(C)c1 Amb27262934 [1,1,0,0,0,0|2,0,0]=4 3842 B12R1.367 C#CC(=O)c1ccc(Cl)c(C)c1 Amb28381889 [1,1,0,0,0,0|2,0,0]=4 3843 B12R1.367 C#CC(=O)c1ccc(F)c(C)c1 Amb27946348 [1,1,0,0,0,0|2,0,0]=4 3844 B12R1.367 C#CC(=O)c1ccc(N)c(C)c1 Amb27389390 [1,1,0,0,0,0|2,0,0]=4 3845 B12R1.367 C=C(CBr)c1ccc(O)c(O)c1 Amb33478782 [1,1,0,0,0,0|2,0,0]=4 3846 B12R1.367 C=C(CCl)c1ccc(O)c(O)c1 Amb33256079 [1,1,0,0,0,0|2,0,0]=4 3847 B12R1.367 C=C(CN)c1ccc(O)c(O)c1 Amb33224271 [1,1,0,0,0,0|2,0,0]=4 3848 B12R1.367 C=C1C=C(C(=O)OC)C=CC1=O Amb27409620 [1,1,0,0,0,0|0,0,2]=4 3849 B12R1.367 C=C1C=CC(C(=O)OC)=CC1=O Amb27164604 [1,1,0,0,0,0|1,0,1]=4 3850 B12R1.367 C=CC(=O)c1ccc(Br)c(C)c1 Amb25849667 [1,1,0,0,0,0|2,0,0]=4 3851 B12R1.367 C=CC(=O)c1ccc(C)c(C)c1 Amb18563494 [1,1,0,0,0,0|2,0,0]=4 3852 B12R1.367 C=CC(=O)c1ccc(C)c(O)c1 Amb33372160 [1,1,0,0,0,0|2,0,0]=4 3853 B12R1.367 C=CC(=O)c1ccc(Cl)c(C)c1 Amb24438254 [1,1,0,0,0,0|2,0,0]=4 3854 B12R1.367 C=CC(=O)c1ccc(F)c(C)c1 Amb18563602 [1,1,0,0,0,0|2,0,0]=4 3855 B12R1.367 C=CC(=O)c1ccc(N)c(C)c1 Amb27840587 [1,1,0,0,0,0|2,0,0]=4 3856 B12R1.367 C=CC(=O)c1ccc(O)c(Br)c1 Amb33388533 [1,1,0,0,0,0|2,0,0]=4 3857 B12R1.367 C=CC(=O)c1ccc(O)c(Cl)c1 Amb33261379 [1,1,0,0,0,0|2,0,0]=4 3858 B12R1.367 C=CC(=O)c1ccc(O)c(F)c1 Amb33421257 [1,1,0,0,0,0|2,0,0]=4 3859 B12R1.367 C=CC(=O)c1ccc(O)c(O)c1 Amb26965368 [1,1,0,0,0,0|1,0,0]=3 3860 B12R1.367 C=CC(O)c1ccc(O)c(O)c1 Amb25830070 [1,1,0,0,0,0|1,0,1]=4 3861 B12R1.367 CC(C=O)c1ccc(O)c(O)c1 Amb26966061 [1,1,0,0,0,0|1,0,1]=4 3862 B12R1.367 CC(ON)c1ccc(O)c(O)c1 Amb33375722 [1,1,0,0,0,0|1,0,1]=4 3863 B12R1.367 CCC(=O)c1ccc(Br)c(C)c1 Amb17343721 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.367 CCC(=O)c1ccc(Br)c(O)c1 Amb27441716 [1,1,0,0,0,0|2,0,0]=4 3865 B12R1.367 CCC(=O)c1ccc(C)c(C)c1 Amb3360024 [1,1,0,0,0,0|2,0,0]=4 3866 B12R1.367 CCC(=O)c1ccc(Cl)c(C)c1 Amb17109157 [1,1,0,0,0,0|2,0,0]=4 3867 B12R1.367 CCC(=O)c1ccc(Cl)c(O)c1 Amb24417811 [1,1,0,0,0,0|2,0,0]=4 3868 B12R1.367 CCC(=O)c1ccc(F)c(C)c1 Amb5740250 [1,1,0,0,0,0|2,0,0]=4 3869 B12R1.367 CCC(=O)c1ccc(F)c(O)c1 Amb26517535 [1,1,0,0,0,0|2,0,0]=4 3870 B12R1.367 CCC(=O)c1ccc(I)c(C)c1 Amb25148836 [1,1,0,0,0,0|2,0,0]=4 3871 B12R1.367 CCC(=O)c1ccc(I)c(O)c1 Amb24696551 [1,1,0,0,0,0|2,0,0]=4 3872 B12R1.367 CCC(=O)c1ccc(N)c(C)c1 Amb17138561 [1,1,0,0,0,0|2,0,0]=4 3873 B12R1.367 CCC(=O)c1ccc(O)c(Br)c1 Amb10074851 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.367 CCC(=O)c1ccc(O)c(C)c1 Amb9786376 [1,1,0,0,0,0|1,0,0]=3 3875 B12R1.367 CCC(=O)c1ccc(O)c(Cl)c1 Amb2612558 [1,1,0,0,0,0|2,0,0]=4 3876 B12R1.367 CCC(=O)c1ccc(O)c(F)c1 Amb18646874 [1,1,0,0,0,0|2,0,0]=4 3877 B12R1.367 CCC(=O)c1ccc(O)c(I)c1 Amb25865567 [1,1,0,0,0,0|2,0,0]=4 3878 B12R1.367 CCC(=O)c1ccc(O)c(N)c1 Amb17218505 [1,1,0,0,0,0|2,0,0]=4 3879 B12R1.367 CCC(=O)c1ccc(O)c(N)c1 Amb28719635 [1,1,0,0,0,0|2,0,0]=4 3880 B12R1.367 CCC(=O)c1ccc(O)c(O)c1 Amb3372056 [1,1,0,0,0,0|1,0,0]=3 3881 B12R1.367 CCC(=O)c1ccc(S)c(C)c1 Amb25920211 [1,1,0,0,0,0|1,1,0]=4 3882 B12R1.367 CCC(=O)c1ccc(S)c(O)c1 Amb27200477 [1,1,0,0,0,0|1,1,0]=4 3883 B12R1.367 CN(N=O)c1ccc(O)c(O)c1 Amb22362729 [1,1,0,0,0,0|2,0,0]=4 3884 B12R1.367 CNC(=O)c1ccc(Br)c(O)c1 Amb27239792 [1,1,0,0,0,0|2,0,0]=4 3885 B12R1.367 CNC(=O)c1ccc(Cl)c(C)c1 Amb28453622 [1,1,0,0,0,0|2,0,0]=4 3886 B12R1.367 CNC(=O)c1ccc(Cl)c(O)c1 Amb24379528 [1,1,0,0,0,0|2,0,0]=4 3887 B12R1.367 CNC(=O)c1ccc(F)c(C)c1 Amb27467406 [1,1,0,0,0,0|2,0,0]=4 3888 B12R1.367 CNC(=O)c1ccc(F)c(O)c1 Amb26978100 [1,1,0,0,0,0|2,0,0]=4 3889 B12R1.367 CNC(=O)c1ccc(I)c(C)c1 Amb20642441 [1,1,0,0,0,0|2,0,0]=4 3890 B12R1.367 CNC(=O)c1ccc(N)c(C)c1 Amb1113210 [1,1,0,0,0,0|2,0,0]=4 3891 B12R1.367 CNC(=O)c1ccc(N)c(C)c1 Amb17622089 [1,1,0,0,0,0|2,0,0]=4 3892 B12R1.367 CNC(=O)c1ccc(N)c(O)c1 Amb25739952 [1,1,0,0,0,0|2,0,0]=4 3893 B12R1.367 CNC(=O)c1ccc(O)c(I)c1 Amb27412429 [1,1,0,0,0,0|2,0,0]=4 3894 B12R1.367 CNC(=O)c1ccc(O)c(N)c1 Amb24725166 [1,1,0,0,0,0|2,0,0]=4 3895 B12R1.367 CN[C@H](O)c1ccc(O)c(O)c1 Amb27446586 [1,1,0,0,0,0|1,0,1]=4 3896 B12R1.367 COC(=O)C1=CC(=O)C(=O)C=C1 Amb27176058 [1,1,0,0,0,0|0,0,2]=4 3897 B12R1.367 COC(=O)C1=CC(=O)C(O)=CO1 Amb20671455 [1,1,0,0,0,0|1,0,1]=4 3898 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 Amb22277007 [1,1,0,0,0,0|1,0,1]=4 3899 B12R1.367 COC(=O)C1=CN(C)C(=S)C=C1 Amb21998481 [1,1,0,0,0,0|1,1,0]=4 3900 B12R1.367 COC(=O)C1=CNC(=O)C(C)=C1 Amb22490973 [1,1,0,0,0,0|1,0,1]=4 3901 B12R1.367 COC(=O)c1cc(Br)c(O)cn1 Amb26442222 [1,1,0,0,0,0|2,0,0]=4 3902 B12R1.367 COC(=O)c1cc(C)c(Br)cn1 Amb19957837 [1,1,0,0,0,0|2,0,0]=4 3903 B12R1.367 COC(=O)c1cc(C)c(C)cn1 Amb27803864 [1,1,0,0,0,0|2,0,0]=4 3904 B12R1.367 COC(=O)c1cc(C)c(F)cn1 Amb22490920 [1,1,0,0,0,0|2,0,0]=4 3905 B12R1.367 COC(=O)c1cc(C)c(N)cn1 Amb22755073 [1,1,0,0,0,0|2,0,0]=4 3906 B12R1.367 COC(=O)c1cc(C)c(O)cn1 Amb26644164 [1,1,0,0,0,0|1,0,0]=3 3907 B12R1.367 COC(=O)c1cc(Cl)c(O)cn1 Amb27974592 [1,1,0,0,0,0|2,0,0]=4 3908 B12R1.367 COC(=O)c1cc(N)c(O)cn1 Amb27796630 [1,1,0,0,0,0|2,0,0]=4 3909 B12R1.367 COC(=O)c1cc(O)c(Br)cn1 Amb27816665 [1,1,0,0,0,0|2,0,0]=4 3910 B12R1.367 COC(=O)c1cc(O)c(C)cn1 Amb26865477 [1,1,0,0,0,0|2,0,0]=4 3911 B12R1.367 COC(=O)c1cc(O)c(Cl)cn1 Amb25684162 [1,1,0,0,0,0|2,0,0]=4 3912 B12R1.367 COC(=O)c1cc(O)c(F)cn1 Amb26880096 [1,1,0,0,0,0|2,0,0]=4 3913 B12R1.367 COC(=O)c1cc(O)c(O)cn1 Amb22406052 [1,1,0,0,0,0|1,0,0]=3 3914 B12R1.367 COC(=O)c1ccc(Br)c(Br)c1 Amb25784682 [1,1,0,0,0,0|2,0,0]=4 3915 B12R1.367 COC(=O)c1ccc(Br)c(C)c1 Amb3939594 [1,1,0,0,0,0|1,0,0]=3 3916 B12R1.367 COC(=O)c1ccc(Br)c(C)n1 Amb21964786 [1,1,0,0,0,0|2,0,0]=4 3917 B12R1.367 COC(=O)c1ccc(Br)c(Cl)c1 Amb21981730 [1,1,0,0,0,0|2,0,0]=4 3918 B12R1.367 COC(=O)c1ccc(Br)c(F)c1 Amb16185903 [1,1,0,0,0,0|2,0,0]=4 3919 B12R1.367 COC(=O)c1ccc(Br)c(I)c1 Amb24056417 [1,1,0,0,0,0|2,0,0]=4 3920 B12R1.367 COC(=O)c1ccc(Br)c(N)c1 Amb13883589 [1,1,0,0,0,0|2,0,0]=4 3921 B12R1.367 COC(=O)c1ccc(Br)c(O)c1 Amb5722316 [1,1,0,0,0,0|1,0,0]=3 3922 B12R1.367 COC(=O)c1ccc(C)c(Br)c1 Amb6366086 [1,1,0,0,0,0|2,0,0]=4 3923 B12R1.367 COC(=O)c1ccc(C)c(C)c1 Amb2724675 [1,1,0,0,0,0|1,0,0]=3 3924 B12R1.367 COC(=O)c1ccc(C)c(C)n1 Amb27389149 [1,1,0,0,0,0|2,0,0]=4 3925 B12R1.367 COC(=O)c1ccc(C)c(Cl)c1 Amb2726228 [1,1,0,0,0,0|2,0,0]=4 3926 B12R1.367 COC(=O)c1ccc(C)c(F)c1 Amb9246798 [1,1,0,0,0,0|2,0,0]=4 3927 B12R1.367 COC(=O)c1ccc(C)c(I)c1 Amb10068924 [1,1,0,0,0,0|2,0,0]=4 3928 B12R1.367 COC(=O)c1ccc(C)c(N)c1 Amb10609410 [1,1,0,0,0,0|2,0,0]=4 3929 B12R1.367 COC(=O)c1ccc(C)c(N)c1 Amb2196481 [1,1,0,0,0,0|2,0,0]=4 3930 B12R1.367 COC(=O)c1ccc(C)c(O)c1 Amb6892310 [1,1,0,0,0,0|1,0,0]=3 3931 B12R1.367 COC(=O)c1ccc(Cl)c(Br)c1 Amb19516215 [1,1,0,0,0,0|2,0,0]=4 3932 B12R1.367 COC(=O)c1ccc(Cl)c(C)c1 Amb6365998 [1,1,0,0,0,0|1,0,0]=3 3933 B12R1.367 COC(=O)c1ccc(Cl)c(Cl)c1 Amb2726191 [1,1,0,0,0,0|2,0,0]=4 3934 B12R1.367 COC(=O)c1ccc(Cl)c(F)c1 Amb2780970 [1,1,0,0,0,0|2,0,0]=4 3935 B12R1.367 COC(=O)c1ccc(Cl)c(I)c1 Amb8394575 [1,1,0,0,0,0|2,0,0]=4 3936 B12R1.367 COC(=O)c1ccc(Cl)c(N)c1 Amb1106009 [1,1,0,0,0,0|2,0,0]=4 3937 B12R1.367 COC(=O)c1ccc(Cl)c(O)c1 Amb21961763 [1,1,0,0,0,0|1,0,0]=3 3938 B12R1.367 COC(=O)c1ccc(F)c(Br)c1 Amb10838939 [1,1,0,0,0,0|2,0,0]=4 3939 B12R1.367 COC(=O)c1ccc(F)c(C)c1 Amb10576355 [1,1,0,0,0,0|1,0,0]=3 3940 B12R1.367 COC(=O)c1ccc(F)c(C)n1 Amb22001003 [1,1,0,0,0,0|2,0,0]=4 3941 B12R1.367 COC(=O)c1ccc(F)c(Cl)c1 Amb984990 [1,1,0,0,0,0|2,0,0]=4 3942 B12R1.367 COC(=O)c1ccc(F)c(F)c1 Amb2726088 [1,1,0,0,0,0|2,0,0]=4 3943 B12R1.367 COC(=O)c1ccc(F)c(I)c1 Amb19889912 [1,1,0,0,0,0|2,0,0]=4 3944 B12R1.367 COC(=O)c1ccc(F)c(N)c1 Amb1106416 [1,1,0,0,0,0|2,0,0]=4 3945 B12R1.367 COC(=O)c1ccc(F)c(N)c1 Amb19870753 [1,1,0,0,0,0|2,0,0]=4 3946 B12R1.367 COC(=O)c1ccc(F)c(N)c1 Amb22587346 [1,1,0,0,0,0|2,0,0]=4 3947 B12R1.367 COC(=O)c1ccc(F)c(O)c1 Amb10807944 [1,1,0,0,0,0|1,0,0]=3 3948 B12R1.367 COC(=O)c1ccc(F)c(O)n1 Amb27453723 [1,1,0,0,0,0|2,0,0]=4 3949 B12R1.367 COC(=O)c1ccc(I)c(Br)c1 Amb10975995 [1,1,0,0,0,0|2,0,0]=4 3950 B12R1.367 COC(=O)c1ccc(I)c(C)c1 Amb6298135 [1,1,0,0,0,0|1,0,0]=3 3951 B12R1.367 COC(=O)c1ccc(I)c(Cl)c1 Amb19887809 [1,1,0,0,0,0|2,0,0]=4 3952 B12R1.367 COC(=O)c1ccc(I)c(F)c1 Amb19887816 [1,1,0,0,0,0|2,0,0]=4 3953 B12R1.367 COC(=O)c1ccc(I)c(I)c1 Amb28123204 [1,1,0,0,0,0|2,0,0]=4 3954 B12R1.367 COC(=O)c1ccc(I)c(N)c1 Amb9826856 [1,1,0,0,0,0|2,0,0]=4 3955 B12R1.367 COC(=O)c1ccc(I)c(O)c1 Amb10975709 [1,1,0,0,0,0|1,0,0]=3 3956 B12R1.367 COC(=O)c1ccc(N)c(Br)c1 Amb1060161 [1,1,0,0,0,0|2,0,0]=4 3957 B12R1.367 COC(=O)c1ccc(N)c(C)c1 Amb309270 [1,1,0,0,0,0|1,0,0]=3 3958 B12R1.367 COC(=O)c1ccc(N)c(C)c1 Amb844780 [1,1,0,0,0,0|1,0,0]=3 3959 B12R1.367 COC(=O)c1ccc(N)c(C)n1 Amb18646489 [1,1,0,0,0,0|2,0,0]=4 3960 B12R1.367 COC(=O)c1ccc(N)c(Cl)c1 Amb19373024 [1,1,0,0,0,0|2,0,0]=4 3961 B12R1.367 COC(=O)c1ccc(N)c(Cl)c1 Amb844783 [1,1,0,0,0,0|2,0,0]=4 3962 B12R1.367 COC(=O)c1ccc(N)c(F)c1 Amb19375582 [1,1,0,0,0,0|2,0,0]=4 3963 B12R1.367 COC(=O)c1ccc(N)c(F)c1 Amb2608791 [1,1,0,0,0,0|2,0,0]=4 3964 B12R1.367 COC(=O)c1ccc(N)c(I)c1 Amb4030753 [1,1,0,0,0,0|2,0,0]=4 3965 B12R1.367 COC(=O)c1ccc(N)c(N)c1 Amb6384695 [1,1,0,0,0,0|2,0,0]=4 3966 B12R1.367 COC(=O)c1ccc(N)c(O)c1 Amb20670740 [1,1,0,0,0,0|1,0,0]=3 3967 B12R1.367 COC(=O)c1ccc(N)c(O)c1 Amb2608809 [1,1,0,0,0,0|1,0,0]=3 3968 B12R1.367 COC(=O)c1ccc(N)c(O)n1 Amb28289048 [1,1,0,0,0,0|2,0,0]=4 3969 B12R1.367 COC(=O)c1ccc(N)c(S)c1 Amb18648762 [1,1,0,0,0,0|1,1,0]=4 3970 B12R1.367 COC(=O)c1ccc(O)c(Br)c1 Amb6540578 [1,1,0,0,0,0|1,0,0]=3 3971 B12R1.367 COC(=O)c1ccc(O)c(Br)n1 Amb8439720 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.367 COC(=O)c1ccc(O)c(C)c1 Amb2698014 [1,1,0,0,0,0|0,0,0]=2 3973 B12R1.367 COC(=O)c1ccc(O)c(C)n1 Amb25327642 [1,1,0,0,0,0|1,0,0]=3 3974 B12R1.367 COC(=O)c1ccc(O)c(Cl)c1 Amb6298852 [1,1,0,0,0,0|1,0,0]=3 3975 B12R1.367 COC(=O)c1ccc(O)c(Cl)n1 Amb27590205 [1,1,0,0,0,0|2,0,0]=4 3976 B12R1.367 COC(=O)c1ccc(O)c(F)c1 Amb2697881 [1,1,0,0,0,0|1,0,0]=3 3977 B12R1.367 COC(=O)c1ccc(O)c(F)n1 Amb28399554 [1,1,0,0,0,0|2,0,0]=4 3978 B12R1.367 COC(=O)c1ccc(O)c(I)c1 Amb16233212 [1,1,0,0,0,0|1,0,0]=3 3979 B12R1.367 COC(=O)c1ccc(O)c(I)n1 Amb24309229 [1,1,0,0,0,0|2,0,0]=4 3980 B12R1.367 COC(=O)c1ccc(O)c(N)c1 Amb1074185 [1,1,0,0,0,0|1,0,0]=3 3981 B12R1.367 COC(=O)c1ccc(O)c(N)c1 Amb32652098 [1,1,0,0,0,0|1,0,0]=3 3982 B12R1.367 COC(=O)c1ccc(O)c(N)n1 Amb22495990 [1,1,0,0,0,0|2,0,0]=4 3983 B12R1.367 COC(=O)c1ccc(O)c(N)n1 Amb33526965 [1,1,0,0,0,0|2,0,0]=4 3984 B12R1.367 COC(=O)c1ccc(O)c(O)c1 Amb3988908 [1,1,0,0,0,0|0,0,0]=2 3985 B12R1.367 COC(=O)c1ccc(O)c(O)n1 Amb22496000 [1,1,0,0,0,0|1,0,0]=3 3986 B12R1.367 COC(=O)c1ccc(S)c(Br)c1 Amb28368253 [1,1,0,0,0,0|1,1,0]=4 3987 B12R1.367 COC(=O)c1ccc(S)c(C)c1 Amb24053416 [1,1,0,0,0,0|0,1,0]=3 3988 B12R1.367 COC(=O)c1ccc(S)c(N)c1 Amb18939268 [1,1,0,0,0,0|1,1,0]=4 3989 B12R1.367 COC(=O)c1cnc(Br)c(C)c1 Amb22496132 [1,1,0,0,0,0|2,0,0]=4 3990 B12R1.367 COC(=O)c1cnc(C)c(C)c1 Amb22749134 [1,1,0,0,0,0|2,0,0]=4 3991 B12R1.367 COC(=O)c1cnc(C)c(O)c1 Amb25321721 [1,1,0,0,0,0|2,0,0]=4 3992 B12R1.367 COC(=O)c1cnc(Cl)c(C)c1 Amb22410820 [1,1,0,0,0,0|2,0,0]=4 3993 B12R1.367 COC(=O)c1cnc(Cl)c(O)c1 Amb22497441 [1,1,0,0,0,0|2,0,0]=4 3994 B12R1.367 COC(=O)c1cnc(F)c(C)c1 Amb22886644 [1,1,0,0,0,0|2,0,0]=4 3995 B12R1.367 COC(=O)c1cnc(F)c(O)c1 Amb25684687 [1,1,0,0,0,0|2,0,0]=4 3996 B12R1.367 COC(=O)c1cnc(I)c(C)c1 Amb23446993 [1,1,0,0,0,0|2,0,0]=4 3997 B12R1.367 COC(=O)c1cnc(I)c(O)c1 Amb24687042 [1,1,0,0,0,0|2,0,0]=4 3998 B12R1.367 COC(=O)c1cnc(N)c(C)c1 Amb16233380 [1,1,0,0,0,0|2,0,0]=4 3999 B12R1.367 COC(=O)c1cnc(N)c(O)c1 Amb24099363 [1,1,0,0,0,0|2,0,0]=4 4000 B12R1.367 COC(=O)c1cnc(O)c(C)c1 Amb18646679 [1,1,0,0,0,0|1,0,0]=3 4001 B12R1.367 COC(=O)c1cnc(O)c(Cl)c1 Amb22735769 [1,1,0,0,0,0|2,0,0]=4 4002 B12R1.367 COC(=O)c1cnc(O)c(I)c1 Amb22735770 [1,1,0,0,0,0|2,0,0]=4 4003 B12R1.367 COC(=O)c1cnc(O)c(N)c1 Amb22292230 [1,1,0,0,0,0|2,0,0]=4 4004 B12R1.367 COC(=O)c1cnc(O)c(O)c1 Amb23440177 [1,1,0,0,0,0|1,0,0]=3 4005 B12R1.367 COC(=O)c1ncc(O)c(C)n1 Amb25195500 [1,1,0,0,0,0|2,0,0]=4 4006 B12R1.367 C\C(=N/O)c1ccc(C)c(C)c1 Amb2612428 [1,1,0,0,0,0|2,0,0]=4 4007 B12R1.367 C\C(=N/O)c1ccc(F)c(C)c1 Amb27223412 [1,1,0,0,0,0|2,0,0]=4 4008 B12R1.367 C\C(=N/O)c1ccc(O)c(C)c1 Amb28133233 [1,1,0,0,0,0|1,0,0]=3 4009 B12R1.367 C\C(=N\O)c1ccc(C)c(C)c1 Amb28065413 [1,1,0,0,0,0|2,0,0]=4 4010 B12R1.367 C\C(=N\O)c1ccc(F)c(C)c1 Amb28421845 [1,1,0,0,0,0|2,0,0]=4 4011 B12R1.367 C\C(=N\O)c1ccc(O)c(O)c1 Amb28351477 [1,1,0,0,0,0|1,0,0]=3 4012 B12R1.367 Cc1cc(C(=O)C=O)ccc1Cl Amb27398664 [1,1,0,0,0,0|1,0,1]=4 4013 B12R1.367 Cc1cc(C(=O)C=O)ccc1F Amb18646441 [1,1,0,0,0,0|1,0,1]=4 4014 B12R1.367 Cc1cc(C(=O)CBr)ccc1Br Amb18891790 [1,1,0,0,0,0|2,0,0]=4 4015 B12R1.367 Cc1cc(C(=O)CBr)ccc1Cl Amb2722590 [1,1,0,0,0,0|2,0,0]=4 4016 B12R1.367 Cc1cc(C(=O)CBr)ccc1F Amb18049137 [1,1,0,0,0,0|2,0,0]=4 4017 B12R1.367 Cc1cc(C(=O)CBr)ccc1N Amb26519108 [1,1,0,0,0,0|2,0,0]=4 4018 B12R1.367 Cc1cc(C(=O)CBr)ccc1O Amb20668524 [1,1,0,0,0,0|1,0,0]=3 4019 B12R1.367 Cc1cc(C(=O)CCl)ccc1Br Amb18055323 [1,1,0,0,0,0|2,0,0]=4 4020 B12R1.367 Cc1cc(C(=O)CCl)ccc1Cl Amb10069447 [1,1,0,0,0,0|2,0,0]=4 4021 B12R1.367 Cc1cc(C(=O)CCl)ccc1F Amb17109192 [1,1,0,0,0,0|2,0,0]=4 4022 B12R1.367 Cc1cc(C(=O)CN)ccc1Br Amb18227511 [1,1,0,0,0,0|2,0,0]=4 4023 B12R1.367 Cc1cc(C(=O)CN)ccc1Cl Amb18623705 [1,1,0,0,0,0|2,0,0]=4 4024 B12R1.367 Cc1cc(C(=O)CN)ccc1F Amb10606574 [1,1,0,0,0,0|2,0,0]=4 4025 B12R1.367 Cc1cc(C(=O)CN)ccc1F Amb5739538 [1,1,0,0,0,0|2,0,0]=4 4026 B12R1.367 Cc1cc(C(=O)CN)ccc1O Amb24532789 [1,1,0,0,0,0|1,0,0]=3 4027 B12R1.367 Cc1cc(C(=O)CO)ccc1F Amb18563832 [1,1,0,0,0,0|1,0,0]=3 4028 B12R1.367 Cc1cc(C(=O)CS)ccc1F Amb17401022 [1,1,0,0,0,0|1,1,0]=4 4029 B12R1.367 Cc1cc(C(=O)NN)ccc1Br Amb21959359 [1,1,0,0,0,0|2,0,0]=4 4030 B12R1.367 Cc1cc(C(=O)NN)ccc1Cl Amb10789224 [1,1,0,0,0,0|2,0,0]=4 4031 B12R1.367 Cc1cc(C(=O)NN)ccc1I Amb21959370 [1,1,0,0,0,0|2,0,0]=4 4032 B12R1.367 Cc1cc(C(=O)NN)ccc1O Amb27791672 [1,1,0,0,0,0|1,0,0]=3 4033 B12R1.367 Cc1cc(C(=O)NO)ccc1F Amb24369658 [1,1,0,0,0,0|1,0,0]=3 4034 B12R1.367 Cc1cc(C(N)CO)ccc1O Amb27413836 [1,1,0,0,0,0|1,0,1]=4 4035 B12R1.367 Cc1cc(C(O)CN)ccc1O Amb25733456 [1,1,0,0,0,0|1,0,1]=4 4036 B12R1.367 Cc1cc(\C(Cl)=N\O)ccc1Br Amb26050437 [1,1,0,0,0,0|2,0,0]=4 4037 B12R1.367 Cc1cc(\C(N)=N/O)ccc1F Amb10609759 [1,1,0,0,0,0|2,0,0]=4 4038 B12R1.367 Cc1cc(\C(N)=N\O)ccc1Br Amb24660372 [1,1,0,0,0,0|2,0,0]=4 4039 B12R1.367 Cc1cc(\C(N)=N\O)ccc1F Amb1117074 [1,1,0,0,0,0|2,0,0]=4 4040 B12R1.367 Cc1cc(\C(N)=N\O)cnc1O Amb35706855 [1,1,0,0,0,0|2,0,0]=4 4041 B12R1.367 Cc1ccc(C(=O)C#N)cc1C Amb17232283 [1,1,0,0,0,0|2,0,0]=4 4042 B12R1.367 Cc1ccc(C(=O)CBr)cc1C Amb1107167 [1,1,0,0,0,0|2,0,0]=4 4043 B12R1.367 Cc1ccc(C(=O)CBr)cc1O Amb18135145 [1,1,0,0,0,0|2,0,0]=4 4044 B12R1.367 Cc1ccc(C(=O)CCl)cc1C Amb1103689 [1,1,0,0,0,0|2,0,0]=4 4045 B12R1.367 Cc1ccc(C(=O)CCl)cc1O Amb24341688 [1,1,0,0,0,0|2,0,0]=4 4046 B12R1.367 Cc1ccc(C(=O)CN)cc1C Amb22963507 [1,1,0,0,0,0|2,0,0]=4 4047 B12R1.367 Cc1ccc(C(=O)CN)cc1C Amb5739534 [1,1,0,0,0,0|2,0,0]=4 4048 B12R1.367 Cc1ccc(C(=O)CN)cc1O Amb24497405 [1,1,0,0,0,0|2,0,0]=4 4049 B12R1.367 Cc1ccc(C(=O)CO)cc1C Amb5638987 [1,1,0,0,0,0|1,0,0]=3 4050 B12R1.367 Cc1ccc(C(=O)CS)cc1C Amb17400838 [1,1,0,0,0,0|1,1,0]=4 4051 B12R1.367 Cc1ccc(C(=O)NN)cc1C Amb6559294 [1,1,0,0,0,0|2,0,0]=4 4052 B12R1.367 Cc1ccc(C(=O)NN)cc1O Amb1124189 [1,1,0,0,0,0|2,0,0]=4 4053 B12R1.367 Cc1ccc(C(=O)NO)cc1C Amb6272713 [1,1,0,0,0,0|1,0,0]=3 4054 B12R1.367 Cc1ccc(C(=O)NO)cc1Cl Amb23551857 [1,1,0,0,0,0|2,0,0]=4 4055 B12R1.367 Cc1ccc(C(=O)NO)cc1N Amb28342921 [1,1,0,0,0,0|2,0,0]=4 4056 B12R1.367 Cc1ccc(C(=O)NO)cc1O Amb6267652 [1,1,0,0,0,0|1,0,0]=3 4057 B12R1.367 Cc1ccc(\C(N)=N/O)cc1C Amb2696216 [1,1,0,0,0,0|2,0,0]=4 4058 B12R1.367 Cc1ccc(\C(N)=N\O)cc1O Amb27220303 [1,1,0,0,0,0|2,0,0]=4 4059 B12R1.367 NC(CO)c1ccc(O)c(O)c1 Amb24460714 [1,1,0,0,0,0|1,0,1]=4 4060 B12R1.367 NCC(=O)c1ccc(Br)c(O)c1 Amb27466199 [1,1,0,0,0,0|2,0,0]=4 4061 B12R1.367 NCC(=O)c1ccc(Cl)c(O)c1 Amb27450732 [1,1,0,0,0,0|2,0,0]=4 4062 B12R1.367 NCC(=O)c1ccc(F)c(O)c1 Amb24497555 [1,1,0,0,0,0|2,0,0]=4 4063 B12R1.367 NCC(=O)c1ccc(O)c(Br)c1 Amb26376222 [1,1,0,0,0,0|2,0,0]=4 4064 B12R1.367 NCC(=O)c1ccc(O)c(Cl)c1 Amb25123985 [1,1,0,0,0,0|2,0,0]=4 4065 B12R1.367 NCC(=O)c1ccc(O)c(F)c1 Amb25801020 [1,1,0,0,0,0|2,0,0]=4 4066 B12R1.367 NCC(=O)c1ccc(O)c(O)c1 Amb17594163 [1,1,0,0,0,0|1,0,0]=3 4067 B12R1.367 NCC(O)c1ccc(O)c(O)c1 Amb10609973 [1,1,0,0,0,0|1,0,1]=4 4068 B12R1.367 NCC(O)c1ccc(O)c(O)c1 Amb1108587 [1,1,0,0,0,0|1,0,1]=4 4069 B12R1.367 NCC(O)c1ccc(O)c(O)c1 Amb17618683 [1,1,0,0,0,0|1,0,1]=4 4070 B12R1.367 NCC(O)c1ccc(O)c(O)c1 Amb6358016 [1,1,0,0,0,0|1,0,1]=4 4071 B12R1.367 NC[C@@H](O)c1ccc(O)c(O)c1 Amb16204998 [1,1,0,0,0,0|1,0,1]=4 4072 B12R1.367 NC[C@@H](O)c1ccc(O)c(O)c1 Amb8628647 [1,1,0,0,0,0|1,0,1]=4 4073 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 Amb6600037 [1,1,0,0,0,0|1,0,1]=4 4074 B12R1.367 NC[C@H](O)c1ccc(O)c(O)c1 Amb8628213 [1,1,0,0,0,0|1,0,1]=4 4075 B12R1.367 NNC(=O)c1cc(O)c(O)cn1 Amb25772430 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.367 NNC(=O)c1ccc(Br)c(O)c1 Amb27950412 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.367 NNC(=O)c1ccc(Cl)c(O)c1 Amb27168718 [1,1,0,0,0,0|2,0,0]=4 4078 B12R1.367 NNC(=O)c1ccc(I)c(O)c1 Amb27947830 [1,1,0,0,0,0|2,0,0]=4 4079 B12R1.367 NNC(=O)c1ccc(O)c(Cl)c1 Amb6247968 [1,1,0,0,0,0|2,0,0]=4 4080 B12R1.367 NNC(=O)c1ccc(O)c(I)c1 Amb26868987 [1,1,0,0,0,0|2,0,0]=4 4081 B12R1.367 NNC(=O)c1ccc(O)c(O)c1 Amb2687305 [1,1,0,0,0,0|1,0,0]=3 4082 B12R1.367 N[C@@H](CO)c1ccc(O)c(O)c1 Amb22406449 [1,1,0,0,0,0|1,0,1]=4 4083 B12R1.367 N[C@H](CO)c1ccc(O)c(O)c1 Amb22406448 [1,1,0,0,0,0|1,0,1]=4 4084 B12R1.367 N\C(=N/O)c1ccc(O)c(F)c1 Amb9523457 [1,1,0,0,0,0|2,0,0]=4 4085 B12R1.367 N\C(=N\O)c1ccc(O)c(Cl)c1 Amb19070645 [1,1,0,0,0,0|2,0,0]=4 4086 B12R1.367 N\C(=N\O)c1ccc(O)c(O)c1 Amb22047958 [1,1,0,0,0,0|1,0,0]=3 4087 B12R1.367 Nc1cc(C(=O)NO)ccc1Cl Amb27407469 [1,1,0,0,0,0|2,0,0]=4 4088 B12R1.367 Nc1ccc(C(=O)NO)cc1Cl Amb27952703 [1,1,0,0,0,0|2,0,0]=4 4089 B12R1.367 O=C(CBr)c1ccc(Br)c(O)c1 Amb27601011 [1,1,0,0,0,0|2,0,0]=4 4090 B12R1.367 O=C(CBr)c1ccc(Cl)c(O)c1 Amb18136996 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.367 O=C(CBr)c1ccc(I)c(O)c1 Amb26080855 [1,1,0,0,0,0|2,0,0]=4 4092 B12R1.367 O=C(CBr)c1ccc(O)c(Cl)c1 Amb18666689 [1,1,0,0,0,0|2,0,0]=4 4093 B12R1.367 O=C(CCl)c1ccc(Cl)c(O)c1 Amb27619151 [1,1,0,0,0,0|2,0,0]=4 4094 B12R1.367 O=C(CCl)c1ccc(O)c(Br)c1 Amb26542203 [1,1,0,0,0,0|2,0,0]=4 4095 B12R1.367 O=C(CCl)c1ccc(O)c(Cl)c1 Amb16230294 [1,1,0,0,0,0|2,0,0]=4 4096 B12R1.367 O=C(CCl)c1ccc(O)c(F)c1 Amb24650954 [1,1,0,0,0,0|2,0,0]=4 4097 B12R1.367 O=C(CCl)c1ccc(O)c(O)c1 Amb1807898 [1,1,0,0,0,0|1,0,0]=3 4098 B12R1.367 O=C(CF)c1ccc(O)c(O)c1 Amb25263110 [1,1,0,0,0,0|1,0,0]=3 4099 B12R1.367 O=C(CO)c1ccc(Cl)c(Cl)c1 Amb5638964 [1,1,0,0,0,0|2,0,0]=4 4100 B12R1.367 O=C(CO)c1ccc(F)c(Br)c1 Amb24383882 [1,1,0,0,0,0|2,0,0]=4 4101 B12R1.367 O=C(CO)c1ccc(F)c(Cl)c1 Amb25915374 [1,1,0,0,0,0|2,0,0]=4 4102 B12R1.367 O=C(CO)c1ccc(F)c(F)c1 Amb5638954 [1,1,0,0,0,0|2,0,0]=4 4103 B12R1.367 O=C(CO)c1ccc(O)c(O)c1 Amb5639006 [1,1,0,0,0,0|0,0,0]=2 4104 B12R1.367 O=C(NO)c1ccc(Br)c(Cl)c1 Amb27615411 [1,1,0,0,0,0|2,0,0]=4 4105 B12R1.367 O=C(NO)c1ccc(Br)c(F)c1 Amb27875679 [1,1,0,0,0,0|2,0,0]=4 4106 B12R1.367 O=C(NO)c1ccc(Cl)c(Cl)c1 Amb6259484 [1,1,0,0,0,0|2,0,0]=4 4107 B12R1.367 O=C(NO)c1ccc(F)c(F)c1 Amb6276803 [1,1,0,0,0,0|2,0,0]=4 4108 B12R1.367 O=C(NO)c1ccc(I)c(Br)c1 Amb27977375 [1,1,0,0,0,0|2,0,0]=4 4109 B12R1.367 O=C(NO)c1ccc(O)c(F)c1 Amb27163822 [1,1,0,0,0,0|1,0,0]=3 4110 B12R1.367 O=C(NO)c1ccc(O)c(O)c1 Amb27216660 [1,1,0,0,0,0|0,0,0]=2 4111 B12R1.367 OCC(O)c1ccc(O)c(O)c1 Amb6358193 [1,1,0,0,0,0|0,0,2]=4 4112 B12R1.367 Oc1ccc(C(O)CBr)cc1O Amb33478678 [1,1,0,0,0,0|1,0,1]=4 4113 B12R1.367 Oc1ccc(C(O)CCl)cc1O Amb26495644 [1,1,0,0,0,0|1,0,1]=4 4114 B12R1.367 Oc1ccc(C(O)CF)cc1O Amb26549425 [1,1,0,0,0,0|1,0,1]=4 4115 B12R1.367 Oc1ccc([C@@H](O)CCl)cc1O Amb27858676 [1,1,0,0,0,0|1,0,1]=4 4116 B12R1.893 CC(=O)c1ccc(C)c(C)c1F Amb25952148 [1,1,0,0,0,0|2,0,0]=4 4117 B12R1.893 CC(=O)c1ccc(C)c(C)c1N Amb22829912 [1,1,0,0,0,0|2,0,0]=4 4118 B12R1.893 CC(=O)c1ccc(C)c(C)c1O Amb18538488 [1,1,0,0,0,0|2,0,0]=4 4119 B12R1.893 CC(=O)c1ccc(Cl)c(C)c1F Amb26879112 [1,1,0,0,0,0|2,0,0]=4 4120 B12R1.893 CC(=O)c1ccc(F)c(C)c1C Amb25234268 [1,1,0,0,0,0|2,0,0]=4 4121 B12R1.893 CC(=O)c1ccc(F)c(O)c1F Amb24059892 [1,1,0,0,0,0|2,0,0]=4 4122 B12R1.893 CC(=O)c1ccc(F)c(O)c1O Amb27229312 [1,1,0,0,0,0|2,0,0]=4 4123 B12R1.893 CC(=O)c1ccc(N)c(C)c1C Amb25669462 [1,1,0,0,0,0|2,0,0]=4 4124 B12R1.893 CC(=O)c1ccc(N)c(C)c1Cl Amb27607259 [1,1,0,0,0,0|2,0,0]=4 4125 B12R1.893 CC(=O)c1ccc(N)c(C)c1F Amb28341370 [1,1,0,0,0,0|2,0,0]=4 4126 B12R1.893 CC(=O)c1ccc(O)c(C)c1C Amb18056768 [1,1,0,0,0,0|1,0,0]=3 4127 B12R1.893 CC(=O)c1ccc(O)c(C)c1F Amb27802548 [1,1,0,0,0,0|1,0,0]=3 4128 B12R1.893 CC(=O)c1ccc(O)c(C)c1N Amb22232239 [1,1,0,0,0,0|1,0,0]=3 4129 B12R1.893 CC(=O)c1ccc(O)c(C)c1O Amb2725239 [1,1,0,0,0,0|1,0,0]=3 4130 B12R1.893 CC(=O)c1ccc(O)c(Cl)c1Cl Amb27175222 [1,1,0,0,0,0|2,0,0]=4 4131 B12R1.893 CC(=O)c1ccc(O)c(F)c1Br Amb26449120 [1,1,0,0,0,0|2,0,0]=4 4132 B12R1.893 CC(=O)c1ccc(O)c(F)c1F Amb26560804 [1,1,0,0,0,0|2,0,0]=4 4133 B12R1.893 CC(=O)c1ccc(O)c(F)c1O Amb25730091 [1,1,0,0,0,0|2,0,0]=4 4134 B12R1.893 CC(=O)c1ccc(O)c(I)c1O Amb10604763 [1,1,0,0,0,0|2,0,0]=4 4135 B12R1.893 CC(=O)c1ccc(O)c(N)c1O Amb28325593 [1,1,0,0,0,0|2,0,0]=4 4136 B12R1.893 CC(=O)c1ccc(O)c(O)c1C Amb27177957 [1,1,0,0,0,0|1,0,0]=3 4137 B12R1.893 CC(=O)c1ccc(O)c(O)c1Cl Amb6296419 [1,1,0,0,0,0|1,0,0]=3 4138 B12R1.893 CC(=O)c1ccc(O)c(O)c1O Amb2510180 [1,1,0,0,0,0|1,0,0]=3 4139 B12R1.893 CC(=O)c1ccc(S)c(C)c1C Amb27650417 [1,1,0,0,0,0|1,1,0]=4 4140 B12R1.893 CC(O)c1ccc(O)c(O)c1O Amb18553726 [1,1,0,0,0,0|1,0,1]=4 4141 B12R1.893 CC1=C(C(=O)O)C=CC(=O)N1C Amb23592138 [1,1,0,0,0,0|1,0,1]=4 4142 B12R1.893 CC1=C(O)C(=O)C(C(=O)O)=CN1 Amb18826215 [1,1,0,0,0,0|2,0,0]=4 4143 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C Amb18037718 [1,1,0,0,0,0|2,0,0]=4 4144 B12R1.893 C[C@@H](O)c1ccc(O)c(O)c1O Amb25140254 [1,1,0,0,0,0|1,0,1]=4 4145 B12R1.893 C[C@H](O)c1ccc(O)c(O)c1O Amb24658507 [1,1,0,0,0,0|1,0,1]=4 4146 B12R1.893 Cc1c(Br)ccc(C(=O)O)c1C Amb19892501 [1,1,0,0,0,0|1,0,0]=3 4147 B12R1.893 Cc1c(Br)ccc(C(=O)O)c1F Amb22757230 [1,1,0,0,0,0|1,0,0]=3 4148 B12R1.893 Cc1c(Br)ccc(C(=O)O)c1N Amb18948557 [1,1,0,0,0,0|1,0,0]=3 4149 B12R1.893 Cc1c(Br)ccc(C(=O)O)c1O Amb27416790 [1,1,0,0,0,0|1,0,0]=3 4150 B12R1.893 Cc1c(C(=O)O)ccc(Br)c1Cl Amb19892730 [1,1,0,0,0,0|2,0,0]=4 4151 B12R1.893 Cc1c(C(=O)O)ccc(Br)c1F Amb19892521 [1,1,0,0,0,0|2,0,0]=4 4152 B12R1.893 Cc1c(C(=O)O)ccc(Cl)c1Cl Amb27597079 [1,1,0,0,0,0|2,0,0]=4 4153 B12R1.893 Cc1c(C(=O)O)ccc(Cl)c1F Amb25866577 [1,1,0,0,0,0|2,0,0]=4 4154 B12R1.893 Cc1c(C(=O)O)ccc(Cl)c1N Amb23403416 [1,1,0,0,0,0|2,0,0]=4 4155 B12R1.893 Cc1c(C(=O)O)ccc(F)c1Br Amb25894677 [1,1,0,0,0,0|2,0,0]=4 4156 B12R1.893 Cc1c(C(=O)O)ccc(F)c1F Amb16231853 [1,1,0,0,0,0|2,0,0]=4 4157 B12R1.893 Cc1c(C(=O)O)ccc(N)c1Br Amb28067977 [1,1,0,0,0,0|2,0,0]=4 4158 B12R1.893 Cc1c(C(=O)O)ccc(O)c1Br Amb27399104 [1,1,0,0,0,0|1,0,0]=3 4159 B12R1.893 Cc1c(C(=O)O)ccc(O)c1N Amb24596165 [1,1,0,0,0,0|1,0,0]=3 4160 B12R1.893 Cc1c(C(=O)O)ccc(O)c1O Amb22001576 [1,1,0,0,0,0|0,0,0]=2 4161 B12R1.893 Cc1c(C(=O)O)cnc(O)c1Br Amb17912724 [1,1,0,0,0,0|2,0,0]=4 4162 B12R1.893 Cc1c(Cl)ccc(C(=O)Cl)c1Cl Amb25851225 [1,1,0,0,0,0|2,0,0]=4 4163 B12R1.893 Cc1c(Cl)ccc(C(=O)Cl)c1F Amb27615527 [1,1,0,0,0,0|2,0,0]=4 4164 B12R1.893 Cc1c(Cl)ccc(C(=O)O)c1C Amb19892502 [1,1,0,0,0,0|1,0,0]=3 4165 B12R1.893 Cc1c(Cl)ccc(C(=O)O)c1Cl Amb18130941 [1,1,0,0,0,0|1,0,0]=3 4166 B12R1.893 Cc1c(Cl)ccc(C(=O)O)c1F Amb25103551 [1,1,0,0,0,0|1,0,0]=3 4167 B12R1.893 Cc1c(Cl)ccc(C(=O)O)c1N Amb1218238 [1,1,0,0,0,0|1,0,0]=3 4168 B12R1.893 Cc1c(Cl)ccc(C(N)=O)c1Cl Amb26578987 [1,1,0,0,0,0|2,0,0]=4 4169 B12R1.893 Cc1c(Cl)ccc(C(N)=O)c1F Amb25312298 [1,1,0,0,0,0|2,0,0]=4 4170 B12R1.893 Cc1c(Cl)ccc(C(N)=O)c1N Amb27770234 [1,1,0,0,0,0|2,0,0]=4 4171 B12R1.893 Cc1c(Cl)ncc(C(=O)O)c1Cl Amb27231442 [1,1,0,0,0,0|2,0,0]=4 4172 B12R1.893 Cc1c(F)ccc(C(=O)Cl)c1Cl Amb26392511 [1,1,0,0,0,0|2,0,0]=4 4173 B12R1.893 Cc1c(F)ccc(C(=O)Cl)c1F Amb10607097 [1,1,0,0,0,0|2,0,0]=4 4174 B12R1.893 Cc1c(F)ccc(C(=O)O)c1C Amb24402367 [1,1,0,0,0,0|1,0,0]=3 4175 B12R1.893 Cc1c(F)ccc(C(=O)O)c1Cl Amb22044131 [1,1,0,0,0,0|1,0,0]=3 4176 B12R1.893 Cc1c(F)ccc(C(=O)O)c1F Amb16231714 [1,1,0,0,0,0|1,0,0]=3 4177 B12R1.893 Cc1c(F)ccc(C(=O)O)c1N Amb18945924 [1,1,0,0,0,0|1,0,0]=3 4178 B12R1.893 Cc1c(F)ccc(C(N)=O)c1C Amb24596746 [1,1,0,0,0,0|2,0,0]=4 4179 B12R1.893 Cc1c(F)ccc(C(N)=O)c1F Amb27144346 [1,1,0,0,0,0|2,0,0]=4 4180 B12R1.893 Cc1c(N)ccc(C(=O)O)c1C Amb2610457 [1,1,0,0,0,0|1,0,0]=3 4181 B12R1.893 Cc1c(N)ccc(C(=O)O)c1F Amb25061253 [1,1,0,0,0,0|1,0,0]=3 4182 B12R1.893 Cc1c(O)c(C(=O)O)cc[n+]1[O-] Amb28436363 [1,1,0,0,0,0|1,0,1]=4 4183 B12R1.893 Cc1c(O)ccc(C(=O)Cl)c1C Amb26895039 [1,1,0,0,0,0|1,0,0]=3 4184 B12R1.893 Cc1c(O)ccc(C(=O)O)c1C Amb18555446 [1,1,0,0,0,0|0,0,0]=2 4185 B12R1.893 Cc1c(O)ccc(C(N)=O)c1C Amb18056777 [1,1,0,0,0,0|1,0,0]=3 4186 B12R1.893 Cc1c(O)ccc(C(N)=O)c1O Amb27442071 [1,1,0,0,0,0|1,0,0]=3 4187 B12R1.893 Cc1c(O)ccc([N+](=O)[O-])c1Br Amb27424082 [1,1,0,0,0,0|1,0,1]=4 4188 B12R1.893 Cc1c(O)ccc([N+](=O)[O-])c1C Amb19958644 [1,1,0,0,0,0|1,0,1]=4 4189 B12R1.893 Cc1c(O)ccc([N+](=O)[O-])c1Cl Amb28321901 [1,1,0,0,0,0|1,0,1]=4 4190 B12R1.893 Cc1c(O)ccc([N+](=O)[O-])c1F Amb25301659 [1,1,0,0,0,0|1,0,1]=4 4191 B12R1.893 Cc1c(O)ccc([N+](=O)[O-])c1O Amb3994129 [1,1,0,0,0,0|1,0,1]=4 4192 B12R1.893 Cc1c(S)ccc(C(=O)O)c1O Amb27248573 [1,1,0,0,0,0|0,1,0]=3 4193 B12R1.893 Cc1c([N+](=O)[O-])ccc(O)c1O Amb33330771 [1,1,0,0,0,0|1,0,1]=4 4194 B12R1.893 Cc1ccc(C(=O)Cl)c(F)c1C Amb25942116 [1,1,0,0,0,0|2,0,0]=4 4195 B12R1.893 Cc1ccc(C(=O)Cl)c(O)c1C Amb26895043 [1,1,0,0,0,0|2,0,0]=4 4196 B12R1.893 Cc1ccc(C(=O)O)c(C)c1Br Amb25978131 [1,1,0,0,0,0|2,0,0]=4 4197 B12R1.893 Cc1ccc(C(=O)O)c(C)c1C Amb10844074 [1,1,0,0,0,0|1,0,0]=3 4198 B12R1.893 Cc1ccc(C(=O)O)c(C)c1Cl Amb34911464 [1,1,0,0,0,0|2,0,0]=4 4199 B12R1.893 Cc1ccc(C(=O)O)c(C)c1F Amb19887346 [1,1,0,0,0,0|2,0,0]=4 4200 B12R1.893 Cc1ccc(C(=O)O)c(C)c1O Amb5718398 [1,1,0,0,0,0|1,0,0]=3 4201 B12R1.893 Cc1ccc(C(=O)O)c(Cl)c1C Amb18649034 [1,1,0,0,0,0|1,0,0]=3 4202 B12R1.893 Cc1ccc(C(=O)O)c(Cl)c1Cl Amb24452263 [1,1,0,0,0,0|2,0,0]=4 4203 B12R1.893 Cc1ccc(C(=O)O)c(Cl)c1F Amb25329796 [1,1,0,0,0,0|2,0,0]=4 4204 B12R1.893 Cc1ccc(C(=O)O)c(F)c1Br Amb26635222 [1,1,0,0,0,0|2,0,0]=4 4205 B12R1.893 Cc1ccc(C(=O)O)c(F)c1Cl Amb27641079 [1,1,0,0,0,0|2,0,0]=4 4206 B12R1.893 Cc1ccc(C(=O)O)c(F)c1F Amb2687181 [1,1,0,0,0,0|2,0,0]=4 4207 B12R1.893 Cc1ccc(C(=O)O)c(F)c1I Amb26068765 [1,1,0,0,0,0|2,0,0]=4 4208 B12R1.893 Cc1ccc(C(=O)O)c(I)c1C Amb19929972 [1,1,0,0,0,0|1,0,0]=3 4209 B12R1.893 Cc1ccc(C(=O)O)c(N)c1C Amb6357611 [1,1,0,0,0,0|1,0,0]=3 4210 B12R1.893 Cc1ccc(C(=O)O)c(N)c1Cl Amb24365961 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.893 Cc1ccc(C(=O)O)c(N)c1F Amb26371434 [1,1,0,0,0,0|2,0,0]=4 4212 B12R1.893 Cc1ccc(C(=O)O)c(N)c1I Amb10601937 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.893 Cc1ccc(C(=O)O)c(O)c1C Amb7807407 [1,1,0,0,0,0|1,0,0]=3 4214 B12R1.893 Cc1ccc(C(=O)O)c(O)c1O Amb7807431 [1,1,0,0,0,0|1,0,0]=3 4215 B12R1.893 Cc1ccc(C(=O)O)c(S)c1C Amb24707049 [1,1,0,0,0,0|1,0,0]=3 4216 B12R1.893 Cc1ccc(C(=O)O)c(S)c1N Amb18939270 [1,1,0,0,0,0|2,0,0]=4 4217 B12R1.893 Cc1ccc(C(N)=O)c(C)c1O Amb27613693 [1,1,0,0,0,0|2,0,0]=4 4218 B12R1.893 Cc1ccc(C(N)=O)c(O)c1C Amb26002031 [1,1,0,0,0,0|2,0,0]=4 4219 B12R1.893 Cc1cnc(C(=O)O)c(C)c1O Amb26601071 [1,1,0,0,0,0|2,0,0]=4 4220 B12R1.893 Cc1cnc(C(=O)O)c(N)c1C Amb27402994 [1,1,0,0,0,0|2,0,0]=4 4221 B12R1.893 Cc1ncc(C(=O)O)c(C)c1C Amb8010602 [1,1,0,0,0,0|2,0,0]=4 4222 B12R1.893 N=C(N)c1ccc(O)c(O)c1O Amb26336094 [1,1,0,0,0,0|2,0,0]=4 4223 B12R1.893 NC(=O)c1ccc(Br)c(O)c1F Amb28071312 [1,1,0,0,0,0|2,0,0]=4 4224 B12R1.893 NC(=O)c1ccc(Cl)c(O)c1Cl Amb26417026 [1,1,0,0,0,0|2,0,0]=4 4225 B12R1.893 NC(=O)c1ccc(F)c(O)c1Br Amb26952093 [1,1,0,0,0,0|2,0,0]=4 4226 B12R1.893 NC(=O)c1ccc(I)c(O)c1I Amb25376443 [1,1,0,0,0,0|2,0,0]=4 4227 B12R1.893 NC(=O)c1ccc(N)c(O)c1Br Amb27642310 [1,1,0,0,0,0|2,0,0]=4 4228 B12R1.893 NC(=O)c1ccc(O)c(Br)c1F Amb28245477 [1,1,0,0,0,0|2,0,0]=4 4229 B12R1.893 NC(=O)c1ccc(O)c(Cl)c1Cl Amb26939053 [1,1,0,0,0,0|2,0,0]=4 4230 B12R1.893 NC(=O)c1ccc(O)c(F)c1F Amb27795284 [1,1,0,0,0,0|2,0,0]=4 4231 B12R1.893 NC(=O)c1ccc(O)c(I)c1I Amb25995678 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.893 NC(=O)c1ccc(O)c(O)c1O Amb18054291 [1,1,0,0,0,0|1,0,0]=3 4233 B12R1.893 NC(=S)c1ccc(O)c(O)c1O Amb24587150 [1,1,0,0,0,0|1,1,0]=4 4234 B12R1.893 Nc1c(C(=O)O)ccc(Br)c1Cl Amb27880723 [1,1,0,0,0,0|2,0,0]=4 4235 B12R1.893 Nc1c(C(=O)O)ccc(Br)c1F Amb22739188 [1,1,0,0,0,0|2,0,0]=4 4236 B12R1.893 Nc1c(C(=O)O)ccc(Cl)c1Cl Amb7784307 [1,1,0,0,0,0|2,0,0]=4 4237 B12R1.893 Nc1c(C(=O)O)ccc(Cl)c1F Amb7784322 [1,1,0,0,0,0|2,0,0]=4 4238 B12R1.893 Nc1c(C(=O)O)ccc(Cl)c1O Amb18129725 [1,1,0,0,0,0|1,0,0]=3 4239 B12R1.893 Nc1c(C(=O)O)ccc(Cl)c1O Amb33483021 [1,1,0,0,0,0|1,0,0]=3 4240 B12R1.893 Nc1c(C(=O)O)ccc(F)c1F Amb18944463 [1,1,0,0,0,0|2,0,0]=4 4241 B12R1.893 Nc1c(C(=O)O)ccc(I)c1F Amb22739599 [1,1,0,0,0,0|2,0,0]=4 4242 B12R1.893 Nc1c(C(=O)O)ccc(I)c1I Amb28455828 [1,1,0,0,0,0|2,0,0]=4 4243 B12R1.893 Nc1c(Cl)ccc(C(=O)O)c1Cl Amb22547135 [1,1,0,0,0,0|2,0,0]=4 4244 B12R1.893 Nc1c(Cl)ccc(C(=O)O)c1N Amb28291416 [1,1,0,0,0,0|2,0,0]=4 4245 B12R1.893 Nc1c(F)ccc(C(=O)O)c1F Amb24596458 [1,1,0,0,0,0|2,0,0]=4 4246 B12R1.893 Nc1c(F)ccc(C(=O)O)c1N Amb28129336 [1,1,0,0,0,0|2,0,0]=4 4247 B12R1.893 Nc1c(O)ccc(C(=O)O)c1F Amb27959024 [1,1,0,0,0,0|1,0,0]=3 4248 B12R1.893 Nc1c(O)ccc(C(=O)O)c1O Amb25149854 [1,1,0,0,0,0|1,0,0]=3 4249 B12R1.893 Nc1ccc(C(=O)O)c(Br)c1F Amb28194499 [1,1,0,0,0,0|2,0,0]=4 4250 B12R1.893 Nc1ccc(C(=O)O)c(Cl)c1Cl Amb22455800 [1,1,0,0,0,0|2,0,0]=4 4251 B12R1.893 Nc1ccc(C(=O)O)c(Cl)c1F Amb27614829 [1,1,0,0,0,0|2,0,0]=4 4252 B12R1.893 Nc1ccc(C(=O)O)c(F)c1Br Amb27620644 [1,1,0,0,0,0|2,0,0]=4 4253 B12R1.893 Nc1ccc(C(=O)O)c(F)c1F Amb2382929 [1,1,0,0,0,0|2,0,0]=4 4254 B12R1.893 Nc1ccc(C(=O)O)c(I)c1I Amb28062480 [1,1,0,0,0,0|2,0,0]=4 4255 B12R1.893 Nc1ccc(C(=O)O)c(O)c1Cl Amb24677733 [1,1,0,0,0,0|2,0,0]=4 4256 B12R1.893 O=C(Cl)c1ccc(Br)c(O)c1F Amb24654064 [1,1,0,0,0,0|2,0,0]=4 4257 B12R1.893 O=C(Cl)c1ccc(Cl)c(O)c1Cl Amb27844575 [1,1,0,0,0,0|2,0,0]=4 4258 B12R1.893 O=C(Cl)c1ccc(F)c(O)c1Br Amb26896516 [1,1,0,0,0,0|2,0,0]=4 4259 B12R1.893 O=C(Cl)c1ccc(I)c(O)c1I Amb28436251 [1,1,0,0,0,0|2,0,0]=4 4260 B12R1.893 O=C(Cl)c1ccc(O)c(Cl)c1Cl Amb27844574 [1,1,0,0,0,0|2,0,0]=4 4261 B12R1.893 O=C(Cl)c1ccc(O)c(F)c1Br Amb27429058 [1,1,0,0,0,0|2,0,0]=4 4262 B12R1.893 O=C(Cl)c1ccc(O)c(F)c1F Amb27209707 [1,1,0,0,0,0|2,0,0]=4 4263 B12R1.893 O=C(O)c1ccc(Br)c(Br)c1Br Amb25858858 [1,1,0,0,0,0|2,0,0]=4 4264 B12R1.893 O=C(O)c1ccc(Br)c(Br)c1F Amb26608272 [1,1,0,0,0,0|2,0,0]=4 4265 B12R1.893 O=C(O)c1ccc(Br)c(Cl)c1Cl Amb19892735 [1,1,0,0,0,0|2,0,0]=4 4266 B12R1.893 O=C(O)c1ccc(Br)c(Cl)c1F Amb21961713 [1,1,0,0,0,0|2,0,0]=4 4267 B12R1.893 O=C(O)c1ccc(Br)c(F)c1Br Amb25238870 [1,1,0,0,0,0|2,0,0]=4 4268 B12R1.893 O=C(O)c1ccc(Br)c(F)c1F Amb8386580 [1,1,0,0,0,0|2,0,0]=4 4269 B12R1.893 O=C(O)c1ccc(Br)c(F)c1I Amb22739484 [1,1,0,0,0,0|2,0,0]=4 4270 B12R1.893 O=C(O)c1ccc(Br)c(F)c1O Amb22735686 [1,1,0,0,0,0|2,0,0]=4 4271 B12R1.893 O=C(O)c1ccc(Br)c(I)c1F Amb24581881 [1,1,0,0,0,0|2,0,0]=4 4272 B12R1.893 O=C(O)c1ccc(Br)c(I)c1I Amb27606011 [1,1,0,0,0,0|2,0,0]=4 4273 B12R1.893 O=C(O)c1ccc(Br)c(O)c1Br Amb26616461 [1,1,0,0,0,0|1,0,0]=3 4274 B12R1.893 O=C(O)c1ccc(Br)c(O)c1F Amb26650022 [1,1,0,0,0,0|1,0,0]=3 4275 B12R1.893 O=C(O)c1ccc(Br)c(O)c1O Amb10603751 [1,1,0,0,0,0|1,0,0]=3 4276 B12R1.893 O=C(O)c1ccc(Cl)c(Br)c1Cl Amb10068262 [1,1,0,0,0,0|2,0,0]=4 4277 B12R1.893 O=C(O)c1ccc(Cl)c(Br)c1F Amb27804102 [1,1,0,0,0,0|2,0,0]=4 4278 B12R1.893 O=C(O)c1ccc(Cl)c(Cl)c1Cl Amb18274573 [1,1,0,0,0,0|2,0,0]=4 4279 B12R1.893 O=C(O)c1ccc(Cl)c(Cl)c1F Amb19892752 [1,1,0,0,0,0|2,0,0]=4 4280 B12R1.893 O=C(O)c1ccc(Cl)c(Cl)c1O Amb33532092 [1,1,0,0,0,0|2,0,0]=4 4281 B12R1.893 O=C(O)c1ccc(Cl)c(Cl)c1S Amb25304205 [1,1,0,0,0,0|2,0,0]=4 4282 B12R1.893 O=C(O)c1ccc(Cl)c(F)c1Br Amb25036240 [1,1,0,0,0,0|2,0,0]=4 4283 B12R1.893 O=C(O)c1ccc(Cl)c(F)c1Cl Amb20670189 [1,1,0,0,0,0|2,0,0]=4 4284 B12R1.893 O=C(O)c1ccc(Cl)c(F)c1F Amb6307614 [1,1,0,0,0,0|2,0,0]=4 4285 B12R1.893 O=C(O)c1ccc(Cl)c(F)c1O Amb33551876 [1,1,0,0,0,0|2,0,0]=4 4286 B12R1.893 O=C(O)c1ccc(Cl)c(F)c1S Amb26504115 [1,1,0,0,0,0|2,0,0]=4 4287 B12R1.893 O=C(O)c1ccc(Cl)c(O)c1Cl Amb22325215 [1,1,0,0,0,0|1,0,0]=3 4288 B12R1.893 O=C(O)c1ccc(Cl)c(O)c1O Amb26032442 [1,1,0,0,0,0|1,0,0]=3 4289 B12R1.893 O=C(O)c1ccc(F)c(Br)c1Br Amb26644399 [1,1,0,0,0,0|2,0,0]=4 4290 B12R1.893 O=C(O)c1ccc(F)c(Br)c1Cl Amb27605992 [1,1,0,0,0,0|2,0,0]=4 4291 B12R1.893 O=C(O)c1ccc(F)c(Br)c1F Amb19893313 [1,1,0,0,0,0|2,0,0]=4 4292 B12R1.893 O=C(O)c1ccc(F)c(Br)c1O Amb19895411 [1,1,0,0,0,0|2,0,0]=4 4293 B12R1.893 O=C(O)c1ccc(F)c(Cl)c1Br Amb25040170 [1,1,0,0,0,0|2,0,0]=4 4294 B12R1.893 O=C(O)c1ccc(F)c(Cl)c1Cl Amb16231718 [1,1,0,0,0,0|2,0,0]=4 4295 B12R1.893 O=C(O)c1ccc(F)c(Cl)c1F Amb2685846 [1,1,0,0,0,0|2,0,0]=4 4296 B12R1.893 O=C(O)c1ccc(F)c(Cl)c1O Amb22325212 [1,1,0,0,0,0|2,0,0]=4 4297 B12R1.893 O=C(O)c1ccc(F)c(F)c1Br Amb20242786 [1,1,0,0,0,0|2,0,0]=4 4298 B12R1.893 O=C(O)c1ccc(F)c(F)c1Cl Amb22233872 [1,1,0,0,0,0|2,0,0]=4 4299 B12R1.893 O=C(O)c1ccc(F)c(F)c1F Amb535707 [1,1,0,0,0,0|2,0,0]=4 4300 B12R1.893 O=C(O)c1ccc(F)c(F)c1I Amb27246753 [1,1,0,0,0,0|2,0,0]=4 4301 B12R1.893 O=C(O)c1ccc(F)c(F)c1O Amb2687138 [1,1,0,0,0,0|2,0,0]=4 4302 B12R1.893 O=C(O)c1ccc(F)c(I)c1I Amb28129854 [1,1,0,0,0,0|2,0,0]=4 4303 B12R1.893 O=C(O)c1ccc(F)c(O)c1F Amb6298255 [1,1,0,0,0,0|1,0,0]=3 4304 B12R1.893 O=C(O)c1ccc(F)c(O)c1O Amb24091586 [1,1,0,0,0,0|1,0,0]=3 4305 B12R1.893 O=C(O)c1ccc(I)c(Br)c1I Amb26334973 [1,1,0,0,0,0|2,0,0]=4 4306 B12R1.893 O=C(O)c1ccc(I)c(Cl)c1I Amb27429100 [1,1,0,0,0,0|2,0,0]=4 4307 B12R1.893 O=C(O)c1ccc(I)c(F)c1Br Amb22739479 [1,1,0,0,0,0|2,0,0]=4 4308 B12R1.893 O=C(O)c1ccc(I)c(F)c1F Amb8386581 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.893 O=C(O)c1ccc(I)c(F)c1O Amb22739376 [1,1,0,0,0,0|2,0,0]=4 4310 B12R1.893 O=C(O)c1ccc(I)c(I)c1Br Amb25696650 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.893 O=C(O)c1ccc(I)c(I)c1Cl Amb27777588 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.893 O=C(O)c1ccc(I)c(I)c1F Amb22547566 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.893 O=C(O)c1ccc(I)c(I)c1I Amb2819689 [1,1,0,0,0,0|2,0,0]=4 4314 B12R1.893 O=C(O)c1ccc(I)c(I)c1O Amb27613863 [1,1,0,0,0,0|2,0,0]=4 4315 B12R1.893 O=C(O)c1ccc(O)c(Br)c1F Amb25248257 [1,1,0,0,0,0|1,0,0]=3 4316 B12R1.893 O=C(O)c1ccc(O)c(Cl)c1Cl Amb17595539 [1,1,0,0,0,0|1,0,0]=3 4317 B12R1.893 O=C(O)c1ccc(O)c(Cl)c1F Amb22325211 [1,1,0,0,0,0|1,0,0]=3 4318 B12R1.893 O=C(O)c1ccc(O)c(F)c1F Amb2687137 [1,1,0,0,0,0|1,0,0]=3 4319 B12R1.893 O=C(O)c1ccc(O)c(I)c1I Amb27441826 [1,1,0,0,0,0|1,0,0]=3 4320 B12R1.893 O=C(O)c1ccc(O)c(O)c1Cl Amb26944880 [1,1,0,0,0,0|0,0,0]=2 4321 B12R1.893 O=C(O)c1ccc(O)c(O)c1F Amb28291562 [1,1,0,0,0,0|0,0,0]=2 4322 B12R1.893 O=C(O)c1ccc(O)c(O)c1O Amb8627754 [1,1,0,0,0,0|0,0,0]=2 4323 B12R1.893 O=C(O)c1ccc(S)c(Cl)c1Cl Amb24707053 [1,1,0,0,0,0|1,1,0]=4 4324 B12R1.893 O=C(O)c1ccc(S)c(F)c1Cl Amb27143969 [1,1,0,0,0,0|1,1,0]=4 4325 B12R1.893 O=C(O)c1cnc(O)c(Br)c1O Amb16230634 [1,1,0,0,0,0|2,0,0]=4 4326 B12R1.893 O=C(O)c1ncc(Br)c(O)c1Br Amb26595977 [1,1,0,0,0,0|2,0,0]=4 4327 B12R1.893 O=C(O)c1ncc(I)c(O)c1I Amb24483744 [1,1,0,0,0,0|2,0,0]=4 4328 B12R1.1005 C=C(C)c1cc(C)c(O)c(C)c1 Amb28201152 [1,1,0,0,0,0|2,0,0]=4 4329 B12R1.1005 CC(=O)c1cc(Br)c(O)c(Br)c1 Amb839100 [1,1,0,0,0,0|2,0,0]=4 4330 B12R1.1005 CC(=O)c1cc(C)c(Br)c(C)c1 Amb22484915 [1,1,0,0,0,0|2,0,0]=4 4331 B12R1.1005 CC(=O)c1cc(C)c(C)c(N)c1 Amb25100890 [1,1,0,0,0,0|2,0,0]=4 4332 B12R1.1005 CC(=O)c1cc(C)c(Cl)c(Cl)c1 Amb25922019 [1,1,0,0,0,0|2,0,0]=4 4333 B12R1.1005 CC(=O)c1cc(C)c(Cl)c(F)c1 Amb25212085 [1,1,0,0,0,0|2,0,0]=4 4334 B12R1.1005 CC(=O)c1cc(C)c(F)c(C)c1 Amb10807755 [1,1,0,0,0,0|2,0,0]=4 4335 B12R1.1005 CC(=O)c1cc(C)c(F)c(Cl)c1 Amb27816825 [1,1,0,0,0,0|2,0,0]=4 4336 B12R1.1005 CC(=O)c1cc(C)c(F)c(F)c1 Amb25971855 [1,1,0,0,0,0|2,0,0]=4 4337 B12R1.1005 CC(=O)c1cc(C)c(N)c(C)c1 Amb27227852 [1,1,0,0,0,0|2,0,0]=4 4338 B12R1.1005 CC(=O)c1cc(C)c(O)c(C)c1 Amb6297371 [1,1,0,0,0,0|1,0,0]=3 4339 B12R1.1005 CC(=O)c1cc(C)c(O)c(Cl)c1 Amb6334847 [1,1,0,0,0,0|1,0,0]=3 4340 B12R1.1005 CC(=O)c1cc(C)c(O)c(O)c1 Amb18646463 [1,1,0,0,0,0|1,0,0]=3 4341 B12R1.1005 CC(=O)c1cc(Cl)c(O)c(Cl)c1 Amb6365493 [1,1,0,0,0,0|2,0,0]=4 4342 B12R1.1005 CC(=O)c1cc(F)c(O)c(Br)c1 Amb28061036 [1,1,0,0,0,0|2,0,0]=4 4343 B12R1.1005 CC(=O)c1cc(F)c(O)c(Cl)c1 Amb26519079 [1,1,0,0,0,0|2,0,0]=4 4344 B12R1.1005 CC(=O)c1cc(F)c(O)c(F)c1 Amb10873143 [1,1,0,0,0,0|2,0,0]=4 4345 B12R1.1005 CC(=O)c1cc(N)c(O)c(Cl)c1 Amb17319973 [1,1,0,0,0,0|2,0,0]=4 4346 B12R1.1005 CC(=O)c1cc(N)c(O)c(F)c1 Amb17319974 [1,1,0,0,0,0|2,0,0]=4 4347 B12R1.1005 CC(=O)c1cc(N)c(O)c(F)c1 Amb32684628 [1,1,0,0,0,0|2,0,0]=4 4348 B12R1.1005 CC(=O)c1cc(O)c(Br)c(F)c1 Amb27791291 [1,1,0,0,0,0|2,0,0]=4 4349 B12R1.1005 CC(=O)c1cc(O)c(C)c(F)c1 Amb27186627 [1,1,0,0,0,0|2,0,0]=4 4350 B12R1.1005 CC(=O)c1cc(O)c(Cl)c(Cl)c1 Amb27963207 [1,1,0,0,0,0|2,0,0]=4 4351 B12R1.1005 CC(=O)c1cc(O)c(Cl)c(F)c1 Amb27842392 [1,1,0,0,0,0|2,0,0]=4 4352 B12R1.1005 CC(=O)c1cc(O)c(F)c(Br)c1 Amb25217251 [1,1,0,0,0,0|2,0,0]=4 4353 B12R1.1005 CC(=O)c1cc(O)c(F)c(F)c1 Amb27667331 [1,1,0,0,0,0|2,0,0]=4 4354 B12R1.1005 CC(=O)c1cc(O)c(O)c(O)c1 Amb24121181 [1,1,0,0,0,0|1,0,0]=3 4355 B12R1.1005 CC1=C(C)C(=O)C=C(C(=O)O)O1 Amb18646850 [1,1,0,0,0,0|2,0,0]=4 4356 B12R1.1005 CC1=C(C)C(=O)OC(C(=O)O)=C1 Amb27637695 [1,1,0,0,0,0|2,0,0]=4 4357 B12R1.1005 CC1=CC(C(=O)O)=CC(=O)N1C Amb23590700 [1,1,0,0,0,0|2,0,0]=4 4358 B12R1.1005 CC1=CC(C(=O)O)=CN(C)C1=O Amb22490972 [1,1,0,0,0,0|1,0,1]=4 4359 B12R1.1005 CN1C=C(C(=O)O)C=C(I)C1=O Amb23589471 [1,1,0,0,0,0|1,0,1]=4 4360 B12R1.1005 CN1C=C(C(=O)O)C=C(N)C1=O Amb28046783 [1,1,0,0,0,0|1,0,1]=4 4361 B12R1.1005 Cc1c(Br)cc(C(=O)O)cc1Br Amb6335072 [1,1,0,0,0,0|2,0,0]=4 4362 B12R1.1005 Cc1c(Br)cc(C(=O)O)cc1I Amb28341161 [1,1,0,0,0,0|2,0,0]=4 4363 B12R1.1005 Cc1c(Cl)cc(C(=O)O)cc1Br Amb9855061 [1,1,0,0,0,0|2,0,0]=4 4364 B12R1.1005 Cc1c(Cl)cc(C(=O)O)cc1Cl Amb9855060 [1,1,0,0,0,0|2,0,0]=4 4365 B12R1.1005 Cc1c(Cl)cc(C(=O)O)cc1I Amb9855062 [1,1,0,0,0,0|2,0,0]=4 4366 B12R1.1005 Cc1c(F)cc(C(=O)O)cc1Br Amb22756276 [1,1,0,0,0,0|2,0,0]=4 4367 B12R1.1005 Cc1c(F)cc(C(=O)O)cc1Cl Amb27591890 [1,1,0,0,0,0|2,0,0]=4 4368 B12R1.1005 Cc1c(F)cc(C(=O)O)cc1F Amb18647573 [1,1,0,0,0,0|2,0,0]=4 4369 B12R1.1005 Cc1c(F)cc(C(=O)O)cc1I Amb13882932 [1,1,0,0,0,0|2,0,0]=4 4370 B12R1.1005 Cc1c(I)cc(C(=O)O)cc1I Amb17940208 [1,1,0,0,0,0|2,0,0]=4 4371 B12R1.1005 Cc1c(N)cc(C(=O)O)cc1Br Amb22751277 [1,1,0,0,0,0|2,0,0]=4 4372 B12R1.1005 Cc1c(N)cc(C(=O)O)cc1Cl Amb9855057 [1,1,0,0,0,0|2,0,0]=4 4373 B12R1.1005 Cc1c(N)cc(C(=O)O)cc1F Amb16231784 [1,1,0,0,0,0|2,0,0]=4 4374 B12R1.1005 Cc1c(N)cc(C(=O)O)cc1N Amb522220 [1,1,0,0,0,0|2,0,0]=4 4375 B12R1.1005 Cc1c(O)cc(C(=O)O)cc1O Amb6357518 [1,1,0,0,0,0|1,0,0]=3 4376 B12R1.1005 Cc1c(S)cc(C(=O)O)cc1Cl Amb27389796 [1,1,0,0,0,0|1,1,0]=4 4377 B12R1.1005 Cc1cc(B(O)O)cc(C)c1O Amb22229786 [1,1,0,0,0,0|1,0,1]=4 4378 B12R1.1005 Cc1cc(C(=N)N)cc(C)c1O Amb8834119 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.1005 Cc1cc(C(=O)Cl)cc(C)c1Cl Amb26576687 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.1005 Cc1cc(C(=O)Cl)cc(C)c1F Amb22738382 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.1005 Cc1cc(C(=O)Cl)cc(Cl)c1Cl Amb26557385 [1,1,0,0,0,0|2,0,0]=4 4382 B12R1.1005 Cc1cc(C(=O)Cl)cc(F)c1C Amb27239123 [1,1,0,0,0,0|2,0,0]=4 4383 B12R1.1005 Cc1cc(C(=O)Cl)cc(F)c1F Amb24674312 [1,1,0,0,0,0|2,0,0]=4 4384 B12R1.1005 Cc1cc(C(=O)O)cc(Br)c1Br Amb23514965 [1,1,0,0,0,0|1,0,0]=3 4385 B12R1.1005 Cc1cc(C(=O)O)cc(Br)c1C Amb26875115 [1,1,0,0,0,0|1,0,0]=3 4386 B12R1.1005 Cc1cc(C(=O)O)cc(Br)c1N Amb2414096 [1,1,0,0,0,0|1,0,0]=3 4387 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1Br Amb19892497 [1,1,0,0,0,0|1,0,0]=3 4388 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1C Amb6298414 [1,1,0,0,0,0|1,0,0]=3 4389 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1Cl Amb19944124 [1,1,0,0,0,0|1,0,0]=3 4390 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1F Amb10808109 [1,1,0,0,0,0|1,0,0]=3 4391 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1N Amb8439107 [1,1,0,0,0,0|1,0,0]=3 4392 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1O Amb6356391 [1,1,0,0,0,0|0,0,0]=2 4393 B12R1.1005 Cc1cc(C(=O)O)cc(C)c1S Amb28410467 [1,1,0,0,0,0|0,1,0]=3 4394 B12R1.1005 Cc1cc(C(=O)O)cc(Cl)c1Br Amb33553100 [1,1,0,0,0,0|1,0,0]=3 4395 B12R1.1005 Cc1cc(C(=O)O)cc(Cl)c1Cl Amb25894792 [1,1,0,0,0,0|1,0,0]=3 4396 B12R1.1005 Cc1cc(C(=O)O)cc(Cl)c1F Amb25690165 [1,1,0,0,0,0|1,0,0]=3 4397 B12R1.1005 Cc1cc(C(=O)O)cc(Cl)c1N Amb2726266 [1,1,0,0,0,0|1,0,0]=3 4398 B12R1.1005 Cc1cc(C(=O)O)cc(Cl)c1O Amb26652947 [1,1,0,0,0,0|0,0,0]=2 4399 B12R1.1005 Cc1cc(C(=O)O)cc(F)c1F Amb20621034 [1,1,0,0,0,0|1,0,0]=3 4400 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1Br Amb27198520 [1,1,0,0,0,0|1,0,0]=3 4401 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1C Amb18949063 [1,1,0,0,0,0|1,0,0]=3 4402 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1Cl Amb26464141 [1,1,0,0,0,0|1,0,0]=3 4403 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1Cl Amb31217540 [1,1,0,0,0,0|1,0,0]=3 4404 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1N Amb28130591 [1,1,0,0,0,0|1,0,0]=3 4405 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1O Amb28208747 [1,1,0,0,0,0|0,0,0]=2 4406 B12R1.1005 Cc1cc(C(=O)O)cc(N)c1O Amb31240181 [1,1,0,0,0,0|0,0,0]=2 4407 B12R1.1005 Cc1cc(C(=O)O)cc(O)c1Br Amb27390734 [1,1,0,0,0,0|1,0,0]=3 4408 B12R1.1005 Cc1cc(C(=O)O)cc(O)c1C Amb26371636 [1,1,0,0,0,0|1,0,0]=3 4409 B12R1.1005 Cc1cc(C(=O)O)cc(O)c1F Amb28292986 [1,1,0,0,0,0|1,0,0]=3 4410 B12R1.1005 Cc1cc(C(=O)O)cc(O)c1O Amb27223345 [1,1,0,0,0,0|0,0,0]=2 4411 B12R1.1005 Cc1cc(C(=O)O)cc(S)c1C Amb27407060 [1,1,0,0,0,0|1,0,0]=3 4412 B12R1.1005 Cc1cc(C(=O)O)cc(S)c1F Amb27754654 [1,1,0,0,0,0|1,0,0]=3 4413 B12R1.1005 Cc1cc(C(=O)O)nc(C)c1C Amb25759476 [1,1,0,0,0,0|2,0,0]=4 4414 B12R1.1005 Cc1cc(C(=O)O)nc(Cl)c1C Amb27246725 [1,1,0,0,0,0|2,0,0]=4 4415 B12R1.1005 Cc1cc(C(=O)S)cc(N)c1Cl Amb28340999 [1,1,0,0,0,0|1,1,0]=4 4416 B12R1.1005 Cc1cc(C(=O)[O-])cc(C)c1O Amb33513049 [1,1,0,0,0,0|0,0,1]=3 4417 B12R1.1005 Cc1cc(C(N)=O)cc(C)c1Br Amb8629371 [1,1,0,0,0,0|2,0,0]=4 4418 B12R1.1005 Cc1cc(C(N)=O)cc(C)c1F Amb22738423 [1,1,0,0,0,0|2,0,0]=4 4419 B12R1.1005 Cc1cc(C(N)=O)cc(C)c1I Amb15692057 [1,1,0,0,0,0|2,0,0]=4 4420 B12R1.1005 Cc1cc(C(N)=O)cc(C)c1N Amb8631308 [1,1,0,0,0,0|2,0,0]=4 4421 B12R1.1005 Cc1cc(C(N)=O)cc(C)c1O Amb23536393 [1,1,0,0,0,0|1,0,0]=3 4422 B12R1.1005 Cc1cc(C(N)=O)cc(Cl)c1Cl Amb24629894 [1,1,0,0,0,0|2,0,0]=4 4423 B12R1.1005 Cc1cc(C(N)=O)cc(F)c1C Amb25996749 [1,1,0,0,0,0|2,0,0]=4 4424 B12R1.1005 Cc1cc(C(N)=O)cc(F)c1Cl Amb26574953 [1,1,0,0,0,0|2,0,0]=4 4425 B12R1.1005 Cc1cc(C(N)=O)cc(O)c1C Amb28196604 [1,1,0,0,0,0|2,0,0]=4 4426 B12R1.1005 Cc1cc(C(N)=S)cc(C)c1O Amb8834039 [1,1,0,0,0,0|1,1,0]=4 4427 B12R1.1005 Cc1cc([C@@H](C)O)cc(C)c1O Amb33311376 [1,1,0,0,0,0|1,0,1]=4 4428 B12R1.1005 Cc1cc([C@H](C)O)cc(C)c1O Amb33225733 [1,1,0,0,0,0|1,0,1]=4 4429 B12R1.1005 Cc1cc([N+](=O)[O-])cc(Br)c1O Amb22735800 [1,1,0,0,0,0|1,0,1]=4 4430 B12R1.1005 Cc1cc([N+](=O)[O-])cc(C)c1O Amb8629056 [1,1,0,0,0,0|1,0,1]=4 4431 B12R1.1005 Cc1cc([N+](=O)[O-])cc(Cl)c1O Amb2778109 [1,1,0,0,0,0|1,0,1]=4 4432 B12R1.1005 Cc1cc([N+](=O)[O-])cc(F)c1O Amb27192474 [1,1,0,0,0,0|1,0,1]=4 4433 B12R1.1005 Cc1cc([N+](=O)[O-])cc(N)c1O Amb20527746 [1,1,0,0,0,0|1,0,1]=4 4434 B12R1.1005 Cc1cc([N+](=O)[O-])cc(O)c1O Amb27440200 [1,1,0,0,0,0|1,0,1]=4 4435 B12R1.1005 Cc1nc(C(=O)O)cc(Cl)c1Br Amb28368540 [1,1,0,0,0,0|2,0,0]=4 4436 B12R1.1005 NC(=O)c1cc(Cl)c(O)c(Cl)c1 Amb1397702 [1,1,0,0,0,0|2,0,0]=4 4437 B12R1.1005 NC(=O)c1cc(F)c(O)c(F)c1 Amb25849895 [1,1,0,0,0,0|2,0,0]=4 4438 B12R1.1005 NC(=O)c1cc(I)c(O)c(I)c1 Amb22055162 [1,1,0,0,0,0|2,0,0]=4 4439 B12R1.1005 NC(=O)c1cc(O)c(Br)c(O)c1 Amb6296660 [1,1,0,0,0,0|2,0,0]=4 4440 B12R1.1005 NC(=O)c1cc(O)c(Cl)c(Cl)c1 Amb27621609 [1,1,0,0,0,0|2,0,0]=4 4441 B12R1.1005 NC(=O)c1cc(O)c(F)c(Br)c1 Amb27635390 [1,1,0,0,0,0|2,0,0]=4 4442 B12R1.1005 NC(=O)c1cc(O)c(F)c(F)c1 Amb25921821 [1,1,0,0,0,0|2,0,0]=4 4443 B12R1.1005 NC(=O)c1cc(O)c(O)c(O)c1 Amb2716249 [1,1,0,0,0,0|1,0,0]=3 4444 B12R1.1005 NC1=C(O)C(=O)C=C(C(=O)O)O1 Amb27863507 [1,1,0,0,0,0|1,0,1]=4 4445 B12R1.1005 Nc1c(Br)cc(C(=O)O)cc1Br Amb6297884 [1,1,0,0,0,0|2,0,0]=4 4446 B12R1.1005 Nc1c(Br)cc(C(=O)O)cc1I Amb27234509 [1,1,0,0,0,0|2,0,0]=4 4447 B12R1.1005 Nc1c(Cl)cc(C(=O)O)cc1Br Amb19887780 [1,1,0,0,0,0|2,0,0]=4 4448 B12R1.1005 Nc1c(Cl)cc(C(=O)O)cc1Cl Amb2720104 [1,1,0,0,0,0|2,0,0]=4 4449 B12R1.1005 Nc1c(F)cc(C(=O)O)cc1Br Amb19887789 [1,1,0,0,0,0|2,0,0]=4 4450 B12R1.1005 Nc1c(F)cc(C(=O)O)cc1F Amb21963468 [1,1,0,0,0,0|2,0,0]=4 4451 B12R1.1005 Nc1c(F)cc(C(=O)O)cc1I Amb22495414 [1,1,0,0,0,0|2,0,0]=4 4452 B12R1.1005 Nc1c(I)cc(C(=O)O)cc1I Amb2780962 [1,1,0,0,0,0|2,0,0]=4 4453 B12R1.1005 Nc1c(O)cc(C(=O)O)cc1O Amb16193529 [1,1,0,0,0,0|1,0,0]=3 4454 B12R1.1005 Nc1c(S)cc(C(=O)O)cc1Br Amb18274047 [1,1,0,0,0,0|1,1,0]=4 4455 B12R1.1005 Nc1c(S)cc(C(=O)O)cc1Cl Amb18274051 [1,1,0,0,0,0|1,1,0]=4 4456 B12R1.1005 Nc1cc(C(=O)O)cc(Br)c1F Amb25133695 [1,1,0,0,0,0|2,0,0]=4 4457 B12R1.1005 Nc1cc(C(=O)O)cc(Br)c1N Amb23589146 [1,1,0,0,0,0|2,0,0]=4 4458 B12R1.1005 Nc1cc(C(=O)O)cc(Br)c1O Amb22396320 [1,1,0,0,0,0|1,0,0]=3 4459 B12R1.1005 Nc1cc(C(=O)O)cc(Cl)c1Cl Amb16231769 [1,1,0,0,0,0|2,0,0]=4 4460 B12R1.1005 Nc1cc(C(=O)O)cc(Cl)c1Cl Amb28465565 [1,1,0,0,0,0|2,0,0]=4 4461 B12R1.1005 Nc1cc(C(=O)O)cc(Cl)c1F Amb27178021 [1,1,0,0,0,0|2,0,0]=4 4462 B12R1.1005 Nc1cc(C(=O)O)cc(Cl)c1N Amb20410839 [1,1,0,0,0,0|2,0,0]=4 4463 B12R1.1005 Nc1cc(C(=O)O)cc(F)c1Br Amb18949087 [1,1,0,0,0,0|2,0,0]=4 4464 B12R1.1005 Nc1cc(C(=O)O)cc(F)c1F Amb27587439 [1,1,0,0,0,0|2,0,0]=4 4465 B12R1.1005 Nc1cc(C(=O)O)cc(F)c1N Amb27951082 [1,1,0,0,0,0|2,0,0]=4 4466 B12R1.1005 Nc1cc(C(=O)O)cc(F)c1O Amb27959025 [1,1,0,0,0,0|1,0,0]=3 4467 B12R1.1005 Nc1cc(C(=O)O)cc(I)c1I Amb26987931 [1,1,0,0,0,0|2,0,0]=4 4468 B12R1.1005 Nc1cc(C(=O)O)cc(N)c1Cl Amb1071173 [1,1,0,0,0,0|2,0,0]=4 4469 B12R1.1005 Nc1cc(C(=O)O)cc(O)c1Cl Amb26371478 [1,1,0,0,0,0|1,0,0]=3 4470 B12R1.1005 Nc1cc(C(=O)O)cc(O)c1F Amb27211209 [1,1,0,0,0,0|1,0,0]=3 4471 B12R1.1005 Nc1cc(C(=O)O)cc(O)c1O Amb23559314 [1,1,0,0,0,0|0,0,0]=2 4472 B12R1.1005 Nc1cc(C(=O)O)cc(O)c1O Amb24117562 [1,1,0,0,0,0|0,0,0]=2 4473 B12R1.1005 Nc1cc(C(=O)O)nc(O)c1Cl Amb27659002 [1,1,0,0,0,0|2,0,0]=4 4474 B12R1.1005 O=C(Cl)c1cc(F)c(O)c(Br)c1 Amb27201885 [1,1,0,0,0,0|2,0,0]=4 4475 B12R1.1005 O=C(Cl)c1cc(F)c(O)c(F)c1 Amb28293517 [1,1,0,0,0,0|2,0,0]=4 4476 B12R1.1005 O=C(Cl)c1cc(I)c(O)c(I)c1 Amb27406802 [1,1,0,0,0,0|2,0,0]=4 4477 B12R1.1005 O=C(Cl)c1cc(O)c(Br)c(F)c1 Amb27964343 [1,1,0,0,0,0|2,0,0]=4 4478 B12R1.1005 O=C(Cl)c1cc(O)c(Cl)c(Cl)c1 Amb25971993 [1,1,0,0,0,0|2,0,0]=4 4479 B12R1.1005 O=C(Cl)c1cc(O)c(F)c(Br)c1 Amb24527935 [1,1,0,0,0,0|2,0,0]=4 4480 B12R1.1005 O=C(Cl)c1cc(O)c(O)c(O)c1 Amb17594903 [1,1,0,0,0,0|1,0,0]=3 4481 B12R1.1005 O=C(O)C1=CC(=O)C(=O)C(O)=C1 Amb27878747 [1,1,0,0,0,0|0,0,1]=3 4482 B12R1.1005 O=C(O)C1=CC(=O)N(O)C(O)=C1 Amb27228034 [1,1,0,0,0,0|1,0,0]=3 4483 B12R1.1005 O=C(O)C1=CN(O)C(=O)C(Br)=C1 Amb35748296 [1,1,0,0,0,0|1,0,1]=4 4484 B12R1.1005 O=C(O)c1cc(Br)c(Br)c(Br)c1 Amb25055270 [1,1,0,0,0,0|2,0,0]=4 4485 B12R1.1005 O=C(O)c1cc(Br)c(Cl)c(Br)c1 Amb25110506 [1,1,0,0,0,0|2,0,0]=4 4486 B12R1.1005 O=C(O)c1cc(Br)c(F)c(Br)c1 Amb25895177 [1,1,0,0,0,0|2,0,0]=4 4487 B12R1.1005 O=C(O)c1cc(Br)c(F)c(I)c1 Amb27813244 [1,1,0,0,0,0|2,0,0]=4 4488 B12R1.1005 O=C(O)c1cc(Br)c(O)c(Br)c1 Amb2720572 [1,1,0,0,0,0|1,0,0]=3 4489 B12R1.1005 O=C(O)c1cc(Br)c(O)c(Br)n1 Amb19959838 [1,1,0,0,0,0|2,0,0]=4 4490 B12R1.1005 O=C(O)c1cc(Br)c(O)c(I)c1 Amb22737740 [1,1,0,0,0,0|1,0,0]=3 4491 B12R1.1005 O=C(O)c1cc(Br)c(S)c(Br)c1 Amb27234892 [1,1,0,0,0,0|1,1,0]=4 4492 B12R1.1005 O=C(O)c1cc(Cl)c(Br)c(Cl)c1 Amb19748219 [1,1,0,0,0,0|2,0,0]=4 4493 B12R1.1005 O=C(O)c1cc(Cl)c(Cl)c(Br)c1 Amb27791388 [1,1,0,0,0,0|2,0,0]=4 4494 B12R1.1005 O=C(O)c1cc(Cl)c(Cl)c(Cl)c1 Amb19516142 [1,1,0,0,0,0|2,0,0]=4 4495 B12R1.1005 O=C(O)c1cc(Cl)c(Cl)c(I)c1 Amb24391204 [1,1,0,0,0,0|2,0,0]=4 4496 B12R1.1005 O=C(O)c1cc(Cl)c(F)c(Br)c1 Amb26519124 [1,1,0,0,0,0|2,0,0]=4 4497 B12R1.1005 O=C(O)c1cc(Cl)c(F)c(Cl)c1 Amb6297079 [1,1,0,0,0,0|2,0,0]=4 4498 B12R1.1005 O=C(O)c1cc(Cl)c(I)c(Br)c1 Amb26392502 [1,1,0,0,0,0|2,0,0]=4 4499 B12R1.1005 O=C(O)c1cc(Cl)c(I)c(Cl)c1 Amb15772391 [1,1,0,0,0,0|2,0,0]=4 4500 B12R1.1005 O=C(O)c1cc(Cl)c(O)c(Br)c1 Amb19870138 [1,1,0,0,0,0|1,0,0]=3 4501 B12R1.1005 O=C(O)c1cc(Cl)c(O)c(Cl)c1 Amb1209416 [1,1,0,0,0,0|1,0,0]=3 4502 B12R1.1005 O=C(O)c1cc(F)c(Br)c(Br)c1 Amb28240076 [1,1,0,0,0,0|2,0,0]=4 4503 B12R1.1005 O=C(O)c1cc(F)c(Br)c(Cl)c1 Amb26935673 [1,1,0,0,0,0|2,0,0]=4 4504 B12R1.1005 O=C(O)c1cc(F)c(Br)c(F)c1 Amb19892518 [1,1,0,0,0,0|2,0,0]=4 4505 B12R1.1005 O=C(O)c1cc(F)c(Cl)c(Br)c1 Amb22495382 [1,1,0,0,0,0|2,0,0]=4 4506 B12R1.1005 O=C(O)c1cc(F)c(Cl)c(Cl)c1 Amb19944026 [1,1,0,0,0,0|2,0,0]=4 4507 B12R1.1005 O=C(O)c1cc(F)c(Cl)c(F)c1 Amb19944084 [1,1,0,0,0,0|2,0,0]=4 4508 B12R1.1005 O=C(O)c1cc(F)c(F)c(Br)c1 Amb19893241 [1,1,0,0,0,0|2,0,0]=4 4509 B12R1.1005 O=C(O)c1cc(F)c(F)c(Cl)c1 Amb16231717 [1,1,0,0,0,0|2,0,0]=4 4510 B12R1.1005 O=C(O)c1cc(F)c(F)c(F)c1 Amb535708 [1,1,0,0,0,0|2,0,0]=4 4511 B12R1.1005 O=C(O)c1cc(F)c(I)c(F)c1 Amb24378909 [1,1,0,0,0,0|2,0,0]=4 4512 B12R1.1005 O=C(O)c1cc(F)c(O)c(Br)c1 Amb27976062 [1,1,0,0,0,0|1,0,0]=3 4513 B12R1.1005 O=C(O)c1cc(F)c(O)c(Cl)c1 Amb25362061 [1,1,0,0,0,0|1,0,0]=3 4514 B12R1.1005 O=C(O)c1cc(F)c(O)c(F)c1 Amb18647779 [1,1,0,0,0,0|1,0,0]=3 4515 B12R1.1005 O=C(O)c1cc(I)c(Cl)c(I)c1 Amb25882448 [1,1,0,0,0,0|2,0,0]=4 4516 B12R1.1005 O=C(O)c1cc(I)c(I)c(I)c1 Amb4034636 [1,1,0,0,0,0|2,0,0]=4 4517 B12R1.1005 O=C(O)c1cc(I)c(O)c(I)c1 Amb2611908 [1,1,0,0,0,0|1,0,0]=3 4518 B12R1.1005 O=C(O)c1cc(I)c(O)c(I)n1 Amb28461397 [1,1,0,0,0,0|2,0,0]=4 4519 B12R1.1005 O=C(O)c1cc(O)c(Br)c(F)c1 Amb27630939 [1,1,0,0,0,0|1,0,0]=3 4520 B12R1.1005 O=C(O)c1cc(O)c(Br)c(O)c1 Amb6296033 [1,1,0,0,0,0|1,0,0]=3 4521 B12R1.1005 O=C(O)c1cc(O)c(Cl)c(Br)c1 Amb27190785 [1,1,0,0,0,0|1,0,0]=3 4522 B12R1.1005 O=C(O)c1cc(O)c(Cl)c(Cl)c1 Amb26850971 [1,1,0,0,0,0|1,0,0]=3 4523 B12R1.1005 O=C(O)c1cc(O)c(Cl)c(O)c1 Amb6297883 [1,1,0,0,0,0|1,0,0]=3 4524 B12R1.1005 O=C(O)c1cc(O)c(F)c(Br)c1 Amb25304097 [1,1,0,0,0,0|1,0,0]=3 4525 B12R1.1005 O=C(O)c1cc(O)c(F)c(Cl)c1 Amb28121187 [1,1,0,0,0,0|1,0,0]=3 4526 B12R1.1005 O=C(O)c1cc(O)c(F)c(F)c1 Amb8385499 [1,1,0,0,0,0|1,0,0]=3 4527 B12R1.1005 O=C(O)c1cc(O)c(F)c(O)c1 Amb22752315 [1,1,0,0,0,0|1,0,0]=3 4528 B12R1.1005 O=C(O)c1cc(O)c(I)c(O)c1 Amb2612585 [1,1,0,0,0,0|1,0,0]=3 4529 B12R1.1005 O=C(O)c1cc(O)c(O)c(Cl)c1 Amb22495659 [1,1,0,0,0,0|0,0,0]=2 4530 B12R1.1005 O=C(O)c1cc(O)c(O)c(F)c1 Amb28291589 [1,1,0,0,0,0|0,0,0]=2 4531 B12R1.1005 O=C(O)c1cc(O)c(O)c(O)c1 Amb1933716 [1,1,0,0,0,0|0,0,0]=2 4532 B12R1.1005 O=C(O)c1cc(O)c(O)c(O)c1 Amb6297926 [1,1,0,0,0,0|0,0,0]=2 4533 B12R1.1005 O=C(O)c1cc(S)c(Cl)c(Cl)c1 Amb25329810 [1,1,0,0,0,0|1,1,0]=4 4534 B12R1.1005 O=C([O-])c1cc(O)c(O)c(O)c1 Amb6298846 [1,1,0,0,0,0|0,0,1]=3 4535 B12R1.1005 OB(O)c1cc(O)c(O)c(O)c1 Amb28243800 [1,1,0,0,0,0|1,0,1]=4 4536 B12R1.11 C#Cc1cc(Br)cc(C(=O)O)c1 Amb28042555 [1,1,0,0,0,0|1,0,1]=4 4537 B12R1.11 C#Cc1cc(F)cc(C(=O)O)c1 Amb25260389 [1,1,0,0,0,0|1,0,1]=4 4538 B12R1.11 C=C(C)c1cc(F)cc(OC)c1 Amb32721879 [1,1,0,0,0,0|2,0,0]=4 4539 B12R1.11 C=Cc1cc(Cl)cc(C(=O)O)c1 Amb28186682 [1,1,0,0,0,0|1,0,1]=4 4540 B12R1.11 CCC1=CC(=O)C=C(C(=O)O)O1 Amb24497438 [1,1,0,0,0,0|2,0,0]=4 4541 B12R1.11 CCC1=CC(C(=O)O)=CC(=O)N1 Amb18048504 [1,1,0,0,0,0|2,0,0]=4 4542 B12R1.11 CCc1cc(Br)cc(C(=O)O)c1 Amb8439054 [1,1,0,0,0,0|1,0,0]=3 4543 B12R1.11 CCc1cc(C(=O)O)cc(Br)n1 Amb26540195 [1,1,0,0,0,0|2,0,0]=4 4544 B12R1.11 CCc1cc(C(=O)O)cc(C)n1 Amb18828392 [1,1,0,0,0,0|2,0,0]=4 4545 B12R1.11 CCc1cc(C(=O)O)cc(Cl)n1 Amb9834239 [1,1,0,0,0,0|2,0,0]=4 4546 B12R1.11 CCc1cc(C(=O)O)cc(N)n1 Amb25830489 [1,1,0,0,0,0|2,0,0]=4 4547 B12R1.11 CCc1cc(C)cc(C(=O)Cl)c1 Amb19892487 [1,1,0,0,0,0|2,0,0]=4 4548 B12R1.11 CCc1cc(C)cc(C(=O)O)c1 Amb19888198 [1,1,0,0,0,0|1,0,0]=3 4549 B12R1.11 CCc1cc(Cl)cc(C(=O)O)c1 Amb24365221 [1,1,0,0,0,0|1,0,0]=3 4550 B12R1.11 CCc1cc(Cl)cc(C(=O)O)n1 Amb26552976 [1,1,0,0,0,0|2,0,0]=4 4551 B12R1.11 CCc1cc(F)cc(C(=O)O)c1 Amb27214588 [1,1,0,0,0,0|1,0,0]=3 4552 B12R1.11 CCc1cc(F)cc(C(C)=O)c1 Amb27958854 [1,1,0,0,0,0|2,0,0]=4 4553 B12R1.11 CCc1cc(I)cc(C(=O)O)c1 Amb26595177 [1,1,0,0,0,0|1,0,0]=3 4554 B12R1.11 CCc1cc(N)cc(C(=O)O)c1 Amb26478442 [1,1,0,0,0,0|1,0,0]=3 4555 B12R1.11 CCc1cc(O)cc(C(=O)O)c1 Amb26847063 [1,1,0,0,0,0|1,0,0]=3 4556 B12R1.11 CCc1cc(O)cc(C(=O)O)n1 Amb25313397 [1,1,0,0,0,0|2,0,0]=4 4557 B12R1.11 CCc1cc(O)cc(C(C)=O)c1 Amb25087226 [1,1,0,0,0,0|2,0,0]=4 4558 B12R1.11 CCc1cc(O)cc(C(N)=O)c1 Amb27613494 [1,1,0,0,0,0|2,0,0]=4 4559 B12R1.11 CCc1cc(O)nc(C(=O)O)c1 Amb26607168 [1,1,0,0,0,0|2,0,0]=4 4560 B12R1.11 CCc1cc(S)cc(C(=O)O)c1 Amb27630350 [1,1,0,0,0,0|1,0,0]=3 4561 B12R1.11 CNc1cc(C(=O)O)cc(Br)n1 Amb27638915 [1,1,0,0,0,0|2,0,0]=4 4562 B12R1.11 CNc1cc(C(=O)O)cc(C)n1 Amb25790304 [1,1,0,0,0,0|2,0,0]=4 4563 B12R1.11 CNc1cc(C(=O)O)cc(Cl)n1 Amb33545941 [1,1,0,0,0,0|2,0,0]=4 4564 B12R1.11 CNc1cc(C)nc(C(=O)O)c1 Amb27983485 [1,1,0,0,0,0|2,0,0]=4 4565 B12R1.11 CNc1cc(F)cc(C(=O)O)c1 Amb18270555 [1,1,0,0,0,0|1,0,0]=3 4566 B12R1.11 CNc1cc(F)cc(C(C)=O)c1 Amb18267383 [1,1,0,0,0,0|2,0,0]=4 4567 B12R1.11 CNc1cc(N)cc(C(=O)O)c1 Amb27400324 [1,1,0,0,0,0|1,0,0]=3 4568 B12R1.11 CNc1cc(O)cc(C(=O)O)c1 Amb28291396 [1,1,0,0,0,0|1,0,0]=3 4569 B12R1.11 COC1=CC(=O)OC(C(=O)O)=C1 Amb27876088 [1,1,0,0,0,0|1,0,0]=3 4570 B12R1.11 COC1=NC(C(=O)O)=CC(=O)N1 Amb26510294 [1,1,0,0,0,0|2,0,0]=4 4571 B12R1.11 COC1C=C(N)C=C(C(=O)O)N1 Amb27409314 [1,1,0,0,0,0|1,0,1]=4 4572 B12R1.11 COc1cc(Br)cc(B(O)O)c1 Amb10070382 [1,1,0,0,0,0|1,0,1]=4 4573 B12R1.11 COc1cc(Br)cc(C(=O)Cl)c1 Amb28368447 [1,1,0,0,0,0|1,0,0]=3 4574 B12R1.11 COc1cc(Br)cc(C(=O)O)c1 Amb3987320 [1,1,0,0,0,0|0,0,0]=2 4575 B12R1.11 COc1cc(Br)cc(C(=O)O)n1 Amb27393653 [1,1,0,0,0,0|1,0,0]=3 4576 B12R1.11 COc1cc(Br)cc(C(C)=O)c1 Amb22234354 [1,1,0,0,0,0|1,0,0]=3 4577 B12R1.11 COc1cc(Br)cc(C(C)=O)n1 Amb24317827 [1,1,0,0,0,0|2,0,0]=4 4578 B12R1.11 COc1cc(Br)cc(C(N)=O)c1 Amb26025833 [1,1,0,0,0,0|1,0,0]=3 4579 B12R1.11 COc1cc(Br)cc(N(=O)=O)c1 Amb20620498 [1,1,0,0,0,0|1,0,1]=4 4580 B12R1.11 COc1cc(Br)cc(S(=O)[O-])c1 Amb32754776 [1,1,0,0,0,0|1,0,1]=4 4581 B12R1.11 COc1cc(Br)cc([N+](=O)[O-])c1 Amb8439598 [1,1,0,0,0,0|1,0,1]=4 4582 B12R1.11 COc1cc(Br)nc(C(=O)O)c1 Amb22751532 [1,1,0,0,0,0|1,0,0]=3 4583 B12R1.11 COc1cc(Br)nc(C(C)=O)c1 Amb26597463 [1,1,0,0,0,0|2,0,0]=4 4584 B12R1.11 COc1cc(C(=O)Cl)cc(C)n1 Amb27851727 [1,1,0,0,0,0|2,0,0]=4 4585 B12R1.11 COc1cc(C(=O)Cl)cc(Cl)n1 Amb2725210 [1,1,0,0,0,0|2,0,0]=4 4586 B12R1.11 COc1cc(C(=O)O)cc(Br)n1 Amb19516104 [1,1,0,0,0,0|1,0,0]=3 4587 B12R1.11 COc1cc(C(=O)O)cc(C)n1 Amb28320684 [1,1,0,0,0,0|1,0,0]=3 4588 B12R1.11 COc1cc(C(=O)O)cc(C)n1 Amb32652066 [1,1,0,0,0,0|1,0,0]=3 4589 B12R1.11 COc1cc(C(=O)O)cc(Cl)n1 Amb2720371 [1,1,0,0,0,0|1,0,0]=3 4590 B12R1.11 COc1cc(C(=O)O)cc(F)n1 Amb28254440 [1,1,0,0,0,0|1,0,0]=3 4591 B12R1.11 COc1cc(C(=O)O)cc(N)n1 Amb27862465 [1,1,0,0,0,0|1,0,0]=3 4592 B12R1.11 COc1cc(C(=O)O)nc(C)n1 Amb23511826 [1,1,0,0,0,0|2,0,0]=4 4593 B12R1.11 COc1cc(C(=O)O)nc(Cl)n1 Amb1044959 [1,1,0,0,0,0|2,0,0]=4 4594 B12R1.11 COc1cc(C(=O)O)nc(N)n1 Amb27244103 [1,1,0,0,0,0|2,0,0]=4 4595 B12R1.11 COc1cc(C(=O)O)nc(O)n1 Amb25685353 [1,1,0,0,0,0|2,0,0]=4 4596 B12R1.11 COc1cc(C(C)=O)cc(C)n1 Amb28188326 [1,1,0,0,0,0|2,0,0]=4 4597 B12R1.11 COc1cc(C(C)=O)cc(Cl)n1 Amb20672036 [1,1,0,0,0,0|2,0,0]=4 4598 B12R1.11 COc1cc(C(C)=O)cc(I)n1 Amb27494679 [1,1,0,0,0,0|2,0,0]=4 4599 B12R1.11 COc1cc(C(N)=O)cc(C)n1 Amb25899486 [1,1,0,0,0,0|2,0,0]=4 4600 B12R1.11 COc1cc(C(N)=O)cc(Cl)n1 Amb2726059 [1,1,0,0,0,0|2,0,0]=4 4601 B12R1.11 COc1cc(C)cc(B(O)O)c1 Amb21856901 [1,1,0,0,0,0|1,0,1]=4 4602 B12R1.11 COc1cc(C)cc(C(=O)O)c1 Amb18646480 [1,1,0,0,0,0|0,0,0]=2 4603 B12R1.11 COc1cc(C)cc(C(C)=O)c1 Amb20621500 [1,1,0,0,0,0|1,0,0]=3 4604 B12R1.11 COc1cc(C)cc(C(C)O)c1 Amb28065270 [1,1,0,0,0,0|1,0,1]=4 4605 B12R1.11 COc1cc(C)cc(C(N)=S)c1 Amb24493345 [1,1,0,0,0,0|1,1,0]=4 4606 B12R1.11 COc1cc(C)cc([N+](=O)[O-])c1 Amb26642905 [1,1,0,0,0,0|1,0,1]=4 4607 B12R1.11 COc1cc(C)nc(C(=O)O)c1 Amb18646685 [1,1,0,0,0,0|1,0,0]=3 4608 B12R1.11 COc1cc(Cl)cc(B(O)O)c1 Amb10072126 [1,1,0,0,0,0|1,0,1]=4 4609 B12R1.11 COc1cc(Cl)cc(C(=N)N)c1 Amb16231147 [1,1,0,0,0,0|2,0,0]=4 4610 B12R1.11 COc1cc(Cl)cc(C(=O)Cl)n1 Amb28196380 [1,1,0,0,0,0|2,0,0]=4 4611 B12R1.11 COc1cc(Cl)cc(C(=O)O)c1 Amb10602289 [1,1,0,0,0,0|0,0,0]=2 4612 B12R1.11 COc1cc(Cl)cc(C(=O)O)n1 Amb18821294 [1,1,0,0,0,0|1,0,0]=3 4613 B12R1.11 COc1cc(Cl)cc(C(C)=O)c1 Amb22737723 [1,1,0,0,0,0|1,0,0]=3 4614 B12R1.11 COc1cc(Cl)cc(C(C)O)c1 Amb33873627 [1,1,0,0,0,0|1,0,1]=4 4615 B12R1.11 COc1cc(Cl)cc(C(N)=S)c1 Amb16231146 [1,1,0,0,0,0|1,1,0]=4 4616 B12R1.11 COc1cc(Cl)cc([N+](=O)[O-])c1 Amb10766393 [1,1,0,0,0,0|1,0,1]=4 4617 B12R1.11 COc1cc(Cl)nc(C(=O)O)c1 Amb21857955 [1,1,0,0,0,0|1,0,0]=3 4618 B12R1.11 COc1cc(Cl)nc(C(C)=O)c1 Amb26053636 [1,1,0,0,0,0|2,0,0]=4 4619 B12R1.11 COc1cc(Cl)nc(C(N)=O)c1 Amb24411590 [1,1,0,0,0,0|2,0,0]=4 4620 B12R1.11 COc1cc(F)cc(B(O)O)c1 Amb2455756 [1,1,0,0,0,0|1,0,1]=4 4621 B12R1.11 COc1cc(F)cc(C(=O)O)c1 Amb10607069 [1,1,0,0,0,0|0,0,0]=2 4622 B12R1.11 COc1cc(F)cc(C(=O)O)n1 Amb24545903 [1,1,0,0,0,0|1,0,0]=3 4623 B12R1.11 COc1cc(F)cc(C(C)=O)c1 Amb25189589 [1,1,0,0,0,0|1,0,0]=3 4624 B12R1.11 COc1cc(F)cc(C(C)O)c1 Amb27958623 [1,1,0,0,0,0|1,0,1]=4 4625 B12R1.11 COc1cc(F)cc(C(N)=S)c1 Amb27416924 [1,1,0,0,0,0|1,1,0]=4 4626 B12R1.11 COc1cc(F)cc([N+](=O)[O-])c1 Amb20668919 [1,1,0,0,0,0|1,0,1]=4 4627 B12R1.11 COc1cc(F)nc(C(=O)O)c1 Amb28282179 [1,1,0,0,0,0|1,0,0]=3 4628 B12R1.11 COc1cc(F)nc(C(C)=O)c1 Amb28204279 [1,1,0,0,0,0|2,0,0]=4 4629 B12R1.11 COc1cc(I)cc(C(=O)O)c1 Amb23401424 [1,1,0,0,0,0|0,0,0]=2 4630 B12R1.11 COc1cc(I)cc(C(=O)O)n1 Amb28041640 [1,1,0,0,0,0|1,0,0]=3 4631 B12R1.11 COc1cc(I)cc(C(C)=O)c1 Amb28136735 [1,1,0,0,0,0|1,0,0]=3 4632 B12R1.11 COc1cc(I)cc(C(C)=O)n1 Amb27239475 [1,1,0,0,0,0|2,0,0]=4 4633 B12R1.11 COc1cc(I)cc(C(N)=O)c1 Amb28287195 [1,1,0,0,0,0|1,0,0]=3 4634 B12R1.11 COc1cc(I)cc([N+](=O)[O-])c1 Amb24052994 [1,1,0,0,0,0|1,0,1]=4 4635 B12R1.11 COc1cc(N)cc(B(O)O)c1 Amb24313816 [1,1,0,0,0,0|1,0,1]=4 4636 B12R1.11 COc1cc(N)cc(C(=O)Cl)c1 Amb24684346 [1,1,0,0,0,0|1,0,0]=3 4637 B12R1.11 COc1cc(N)cc(C(=O)O)c1 Amb8631326 [1,1,0,0,0,0|0,0,0]=2 4638 B12R1.11 COc1cc(N)cc(C(=O)O)n1 Amb23400313 [1,1,0,0,0,0|1,0,0]=3 4639 B12R1.11 COc1cc(N)cc(C(C)=O)c1 Amb22498338 [1,1,0,0,0,0|1,0,0]=3 4640 B12R1.11 COc1cc(N)cc(C(N)=O)c1 Amb22498337 [1,1,0,0,0,0|1,0,0]=3 4641 B12R1.11 COc1cc(N)cc([N+](=O)[O-])c1 Amb1054484 [1,1,0,0,0,0|1,0,1]=4 4642 B12R1.11 COc1cc(N)cc([N+](=O)[O-])c1 Amb32412562 [1,1,0,0,0,0|1,0,1]=4 4643 B12R1.11 COc1cc(N)nc(C(=O)O)c1 Amb22755149 [1,1,0,0,0,0|1,0,0]=3 4644 B12R1.11 COc1cc(N)nc(C(=O)O)c1 Amb33276658 [1,1,0,0,0,0|1,0,0]=3 4645 B12R1.11 COc1cc(N)nc(C(N)=O)c1 Amb27193039 [1,1,0,0,0,0|2,0,0]=4 4646 B12R1.11 COc1cc(O)cc(B(O)O)c1 Amb27607092 [1,1,0,0,0,0|1,0,1]=4 4647 B12R1.11 COc1cc(O)cc(C(=N)N)c1 Amb28344431 [1,1,0,0,0,0|2,0,0]=4 4648 B12R1.11 COc1cc(O)cc(C(=O)Cl)c1 Amb27975416 [1,1,0,0,0,0|1,0,0]=3 4649 B12R1.11 COc1cc(O)cc(C(=O)O)c1 Amb2612582 [1,1,0,0,0,0|0,0,0]=2 4650 B12R1.11 COc1cc(O)cc(C(=O)O)n1 Amb28145906 [1,1,0,0,0,0|1,0,0]=3 4651 B12R1.11 COc1cc(O)cc(C(C)=O)c1 Amb25751763 [1,1,0,0,0,0|1,0,0]=3 4652 B12R1.11 COc1cc(O)cc(C(N)=O)c1 Amb27590288 [1,1,0,0,0,0|1,0,0]=3 4653 B12R1.11 COc1cc(O)cc([N+](=O)[O-])c1 Amb9781697 [1,1,0,0,0,0|1,0,1]=4 4654 B12R1.11 COc1cc(O)nc(C(C)=O)c1 Amb28127127 [1,1,0,0,0,0|2,0,0]=4 4655 B12R1.11 COc1cc(S)cc(C(=O)O)c1 Amb24373184 [1,1,0,0,0,0|0,0,0]=2 4656 B12R1.11 COc1cc(S)cc([N+](=O)[O-])c1 Amb24524959 [1,1,0,0,0,0|1,0,1]=4 4657 B12R1.11 COc1nc(C)cc(C(=O)O)n1 Amb23504237 [1,1,0,0,0,0|2,0,0]=4 4658 B12R1.11 COc1nc(Cl)cc(C(=O)O)n1 Amb26959447 [1,1,0,0,0,0|2,0,0]=4 4659 B12R1.11 CSc1cc(Br)cc(C(=O)O)c1 Amb27770871 [1,1,0,0,0,0|0,1,0]=3 4660 B12R1.11 CSc1cc(C(=O)O)c[n+](C)c1 Amb8439456 [1,1,0,0,0,0|1,1,0]=4 4661 B12R1.11 CSc1cc(C(=O)O)cc(C)n1 Amb27394386 [1,1,0,0,0,0|1,1,0]=4 4662 B12R1.11 CSc1cc(C)cc(C(=O)O)c1 Amb26345779 [1,1,0,0,0,0|0,1,0]=3 4663 B12R1.11 CSc1cc(Cl)cc(C(=O)O)c1 Amb28398483 [1,1,0,0,0,0|0,1,0]=3 4664 B12R1.11 CSc1cc(F)cc(C(=O)O)c1 Amb24649830 [1,1,0,0,0,0|0,1,0]=3 4665 B12R1.11 CSc1cc(I)cc(C(=O)O)c1 Amb25353848 [1,1,0,0,0,0|0,1,0]=3 4666 B12R1.11 CSc1cc(N)cc(C(=O)O)c1 Amb25156621 [1,1,0,0,0,0|0,1,0]=3 4667 B12R1.11 CSc1cc(O)cc(C(=O)O)c1 Amb26432666 [1,1,0,0,0,0|0,1,0]=3 4668 B12R1.11 CSc1cc(O)cc(C(N)=O)c1 Amb27860241 [1,1,0,0,0,0|1,1,0]=4 4669 B12R1.11 Cc1cc(C#N)cc(C(=O)O)c1 Amb16231869 [1,1,0,0,0,0|2,0,0]=4 4670 B12R1.11 Cc1cc(C=O)cc(C(=O)O)c1 Amb27657734 [1,1,0,0,0,0|2,0,0]=4 4671 B12R1.11 Cc1cc(CBr)cc(C(=O)O)c1 Amb28043901 [1,1,0,0,0,0|2,0,0]=4 4672 B12R1.11 Cc1cc(CCl)cc(C(=O)O)c1 Amb32679531 [1,1,0,0,0,0|2,0,0]=4 4673 B12R1.11 Cc1cc(CN)cc(C(=O)O)c1 Amb27660822 [1,1,0,0,0,0|2,0,0]=4 4674 B12R1.11 Cc1cc(CO)cc(C(=O)O)c1 Amb28119787 [1,1,0,0,0,0|2,0,0]=4 4675 B12R1.11 N#Cc1cc(Br)cc(C(=O)O)c1 Amb20672010 [1,1,0,0,0,0|2,0,0]=4 4676 B12R1.11 N#Cc1cc(Cl)cc(C(=O)O)c1 Amb21964561 [1,1,0,0,0,0|2,0,0]=4 4677 B12R1.11 N#Cc1cc(F)cc(C(=O)O)c1 Amb2686585 [1,1,0,0,0,0|2,0,0]=4 4678 B12R1.11 N#Cc1cc(N)cc(C(=O)O)c1 Amb6308356 [1,1,0,0,0,0|2,0,0]=4 4679 B12R1.11 N#Cc1cc(O)cc(C(=O)O)c1 Amb27482966 [1,1,0,0,0,0|2,0,0]=4 4680 B12R1.11 N#Cc1cc(S)cc(C(=O)O)c1 Amb26630332 [1,1,0,0,0,0|2,0,0]=4 4681 B12R1.11 NCc1cc(F)cc(C(=O)O)c1 Amb27812280 [1,1,0,0,0,0|2,0,0]=4 4682 B12R1.11 NNc1cc(Br)cc(C(=O)O)c1 Amb26392590 [1,1,0,0,0,0|2,0,0]=4 4683 B12R1.11 NNc1cc(F)cc(C(=O)O)c1 Amb27663401 [1,1,0,0,0,0|2,0,0]=4 4684 B12R1.11 O=C(O)c1cc(Br)cc(CBr)c1 Amb28187140 [1,1,0,0,0,0|2,0,0]=4 4685 B12R1.11 O=C(O)c1cc(Br)cc(CCl)c1 Amb27856532 [1,1,0,0,0,0|2,0,0]=4 4686 B12R1.11 O=C(O)c1cc(Br)cc(CO)c1 Amb2610492 [1,1,0,0,0,0|2,0,0]=4 4687 B12R1.11 O=C(O)c1cc(Cl)cc(CO)c1 Amb25072541 [1,1,0,0,0,0|2,0,0]=4 4688 B12R1.11 O=C(O)c1cc(F)cc(CBr)c1 Amb22735645 [1,1,0,0,0,0|2,0,0]=4 4689 B12R1.11 O=C(O)c1cc(F)cc(CCl)c1 Amb24435133 [1,1,0,0,0,0|2,0,0]=4 4690 B12R1.11 O=C(O)c1cc(F)cc(CO)c1 Amb24088830 [1,1,0,0,0,0|2,0,0]=4 4691 B12R1.11 O=Cc1cc(Br)cc(C(=O)O)c1 Amb24077431 [1,1,0,0,0,0|2,0,0]=4 4692 B12R1.11 O=Cc1cc(Cl)cc(C(=O)O)c1 Amb27875122 [1,1,0,0,0,0|2,0,0]=4 4693 B12R1.11 O=Cc1cc(F)cc(C(=O)O)c1 Amb24088821 [1,1,0,0,0,0|2,0,0]=4 4694 B12R1.11 O=Cc1cc(I)cc(C(=O)O)c1 Amb28203617 [1,1,0,0,0,0|2,0,0]=4 4695 B12R1.258 C=C(C)c1cc(C(=O)O)ccn1 Amb27658981 [1,1,0,0,0,0|2,0,0]=4 4696 B12R1.258 C=C(C)c1cccc(C(C)=O)c1 Amb27232666 [1,1,0,0,0,0|2,0,0]=4 4697 B12R1.258 CC(=O)c1cc(C(=O)O)ccn1 Amb18828613 [1,1,0,0,0,0|2,0,0]=4 4698 B12R1.258 CC(=O)c1cccc(C(=O)O)c1 Amb2684213 [1,1,0,0,0,0|1,0,0]=3 4699 B12R1.258 CC(=O)c1cccc(C(=O)O)n1 Amb8631243 [1,1,0,0,0,0|2,0,0]=4 4700 B12R1.258 CC(=O)c1cccc(C(=O)[O-])c1 Amb33513036 [1,1,0,0,0,0|1,0,1]=4 4701 B12R1.258 CC(=O)c1cccc(C(C)=O)c1 Amb17678852 [1,1,0,0,0,0|2,0,0]=4 4702 B12R1.258 CC(=O)c1cccc(C(C)C)c1 Amb22001971 [1,1,0,0,0,0|2,0,0]=4 4703 B12R1.258 CC(=O)c1cccc(C(C)N)c1 Amb27178051 [1,1,0,0,0,0|2,0,0]=4 4704 B12R1.258 CC(=O)c1cccc(C(C)O)c1 Amb27607795 [1,1,0,0,0,0|2,0,0]=4 4705 B12R1.258 CC(=O)c1cccc(N(C)C)c1 Amb6297300 [1,1,0,0,0,0|2,0,0]=4 4706 B12R1.258 CC(=O)c1cccc([C@@H](C)O)c1 Amb26586292 [1,1,0,0,0,0|2,0,0]=4 4707 B12R1.258 CC(=O)c1cccc([C@H](C)N)c1 Amb33872246 [1,1,0,0,0,0|2,0,0]=4 4708 B12R1.258 CC(=O)c1ccnc(C(=O)O)c1 Amb22500655 [1,1,0,0,0,0|2,0,0]=4 4709 B12R1.258 CC(=O)c1cncc(C(=O)O)c1 Amb18828612 [1,1,0,0,0,0|2,0,0]=4 4710 B12R1.258 CC(Br)c1cccc(C(=O)O)c1 Amb27770644 [1,1,0,0,0,0|1,0,0]=3 4711 B12R1.258 CC(C)c1cc(C(=O)O)ccn1 Amb18199714 [1,1,0,0,0,0|2,0,0]=4 4712 B12R1.258 CC(C)c1cccc(C(=O)O)c1 Amb8439095 [1,1,0,0,0,0|1,0,0]=3 4713 B12R1.258 CC(C)c1cccc(C(=O)O)n1 Amb18828390 [1,1,0,0,0,0|2,0,0]=4 4714 B12R1.258 CC(C)c1cccc(C(N)=O)c1 Amb27658980 [1,1,0,0,0,0|2,0,0]=4 4715 B12R1.258 CC(Cl)c1cccc(C(=O)O)c1 Amb27840584 [1,1,0,0,0,0|1,0,0]=3 4716 B12R1.258 CC(N)c1cccc(C(=O)O)c1 Amb22831607 [1,1,0,0,0,0|1,0,0]=3 4717 B12R1.258 CC(N)c1cccc(C(N)=O)c1 Amb27600203 [1,1,0,0,0,0|2,0,0]=4 4718 B12R1.258 CC(O)c1cccc(C(=O)O)c1 Amb8391838 [1,1,0,0,0,0|1,0,0]=3 4719 B12R1.258 CN(C)c1cc(C(=O)O)ccn1 Amb19373651 [1,1,0,0,0,0|2,0,0]=4 4720 B12R1.258 CN(C)c1cc(C(=O)O)ccn1 Amb2721874 [1,1,0,0,0,0|2,0,0]=4 4721 B12R1.258 CN(C)c1cccc(C(=O)Cl)c1 Amb3939581 [1,1,0,0,0,0|2,0,0]=4 4722 B12R1.258 CN(C)c1cccc(C(=O)F)c1 Amb27175727 [1,1,0,0,0,0|2,0,0]=4 4723 B12R1.258 CN(C)c1cccc(C(=O)O)c1 Amb6357385 [1,1,0,0,0,0|1,0,0]=3 4724 B12R1.258 CN(C)c1cccc(C(=O)O)n1 Amb18284999 [1,1,0,0,0,0|2,0,0]=4 4725 B12R1.258 CN(C)c1cccc(C(=O)O)n1 Amb32667496 [1,1,0,0,0,0|2,0,0]=4 4726 B12R1.258 CN(C)c1cccc(C(N)=O)c1 Amb8334358 [1,1,0,0,0,0|2,0,0]=4 4727 B12R1.258 CN(C)c1ccnc(C(=O)O)c1 Amb3319006 [1,1,0,0,0,0|2,0,0]=4 4728 B12R1.258 CN(C)c1cncc(C(=O)O)c1 Amb2795152 [1,1,0,0,0,0|2,0,0]=4 4729 B12R1.258 CS(=O)c1cccc(C(=O)O)c1 Amb33544227 [1,1,0,0,0,0|0,1,0]=3 4730 B12R1.258 C[C@@H](N)c1cccc(C(=O)O)c1 Amb25128034 [1,1,0,0,0,0|1,0,0]=3 4731 B12R1.258 C[C@@H](N)c1cccc(C(=O)O)n1 Amb27751970 [1,1,0,0,0,0|2,0,0]=4 4732 B12R1.258 C[C@@H](N)c1cccc(C(N)=O)c1 Amb28279998 [1,1,0,0,0,0|2,0,0]=4 4733 B12R1.258 C[C@H](N)c1cccc(C(=O)O)c1 Amb25340386 [1,1,0,0,0,0|1,0,0]=3 4734 B12R1.258 C[C@H](N)c1cccc(C(N)=O)c1 Amb27812044 [1,1,0,0,0,0|2,0,0]=4 4735 B12R1.258 C[NH+](C)c1cccc(C(=O)Cl)c1 Amb22049558 [1,1,0,0,0,0|2,0,0]=4 4736 B12R1.258 N=C(N)c1cccc(C(=O)O)c1 Amb2699528 [1,1,0,0,0,0|2,0,0]=4 4737 B12R1.258 NC(=O)c1cccc(C(=O)O)c1 Amb6892359 [1,1,0,0,0,0|2,0,0]=4 4738 B12R1.258 NC(=S)c1cccc(C(=O)O)c1 Amb7969874 [1,1,0,0,0,0|2,0,0]=4 4739 B12R1.258 O=C(O)c1cccc(B(O)O)c1 Amb836717 [1,1,0,0,0,0|2,0,0]=4 4740 B12R1.258 O=C(O)c1cccc(C(=O)Cl)c1 Amb24085339 [1,1,0,0,0,0|2,0,0]=4 4741 B12R1.258 O=C(O)c1cccc(C(=O)O)c1 Amb17776561 [1,1,0,0,0,0|2,0,0]=4 4742 B12R1.258 O=C(O)c1cccc(C(F)F)c1 Amb19514809 [1,1,0,0,0,0|2,0,0]=4 4743 B12R1.258 O=C(O)c1cccc(N(=O)=O)c1 Amb6357350 [1,1,0,0,0,0|2,0,0]=4 4744 B12R1.258 O=C(O)c1cccc(S(=O)O)c1 Amb24102610 [1,1,0,0,0,0|1,1,0]=4 4745 B12R1.258 O=C(O)c1cccc([N+](=O)[O-])c1 Amb1935190 [1,1,0,0,0,0|2,0,0]=4 4746 B12R1.279 C=CCc1cccc(C(=O)O)c1 Amb2699206 [1,1,0,0,0,0|1,0,1]=4 4747 B12R1.279 C=COc1cccc(C(C)=O)c1 Amb25978740 [1,1,0,0,0,0|1,0,1]=4 4748 B12R1.279 CC#Cc1cccc(C(N)=O)c1 Amb27607703 [1,1,0,0,0,0|2,0,0]=4 4749 B12R1.279 CC(=O)c1cccc(CCF)c1 Amb27448409 [1,1,0,0,0,0|2,0,0]=4 4750 B12R1.279 CC(=O)c1cccc(CCN)c1 Amb25149800 [1,1,0,0,0,0|2,0,0]=4 4751 B12R1.279 CC(=O)c1cccc(NCO)c1 Amb27587638 [1,1,0,0,0,0|2,0,0]=4 4752 B12R1.279 CC(=O)c1cccc(OCCl)c1 Amb26859150 [1,1,0,0,0,0|1,0,0]=3 4753 B12R1.279 CC(=O)c1cncc(OCF)c1 Amb27949152 [1,1,0,0,0,0|2,0,0]=4 4754 B12R1.279 CCCc1cc(C(=O)O)ccn1 Amb16229681 [1,1,0,0,0,0|2,0,0]=4 4755 B12R1.279 CCCc1cccc(C(=O)O)c1 Amb25221605 [1,1,0,0,0,0|1,0,0]=3 4756 B12R1.279 CCCc1cccc(C(=O)O)n1 Amb18646284 [1,1,0,0,0,0|2,0,0]=4 4757 B12R1.279 CCCc1cccc(C(C)=O)c1 Amb25086711 [1,1,0,0,0,0|2,0,0]=4 4758 B12R1.279 CCCc1cncc(C(=O)O)c1 Amb26023150 [1,1,0,0,0,0|2,0,0]=4 4759 B12R1.279 CCNc1cc(C(=O)O)ccn1 Amb33533114 [1,1,0,0,0,0|2,0,0]=4 4760 B12R1.279 CCNc1cccc(C(=O)O)c1 Amb8833318 [1,1,0,0,0,0|1,0,0]=3 4761 B12R1.279 CCNc1cccc(C(C)=O)c1 Amb17306671 [1,1,0,0,0,0|2,0,0]=4 4762 B12R1.279 CCNc1cncc(C(=O)O)c1 Amb18267343 [1,1,0,0,0,0|2,0,0]=4 4763 B12R1.279 CCOc1cc(C(=O)Cl)ccn1 Amb27186377 [1,1,0,0,0,0|2,0,0]=4 4764 B12R1.279 CCOc1cc(C(=O)O)ccn1 Amb33532974 [1,1,0,0,0,0|1,0,0]=3 4765 B12R1.279 CCOc1cc(C(=O)O)cnn1 Amb23401893 [1,1,0,0,0,0|2,0,0]=4 4766 B12R1.279 CCOc1cc(C(=O)O)ncn1 Amb24598713 [1,1,0,0,0,0|2,0,0]=4 4767 B12R1.279 CCOc1cccc(B(O)O)c1 Amb3939237 [1,1,0,0,0,0|1,0,1]=4 4768 B12R1.279 CCOc1cccc(C(=N)N)c1 Amb2696675 [1,1,0,0,0,0|2,0,0]=4 4769 B12R1.279 CCOc1cccc(C(=N)N)c1 Amb33552237 [1,1,0,0,0,0|2,0,0]=4 4770 B12R1.279 CCOc1cccc(C(=O)Cl)c1 Amb6298312 [1,1,0,0,0,0|1,0,0]=3 4771 B12R1.279 CCOc1cccc(C(=O)O)c1 Amb6336483 [1,1,0,0,0,0|0,0,0]=2 4772 B12R1.279 CCOc1cccc(C(=O)O)n1 Amb10069919 [1,1,0,0,0,0|1,0,0]=3 4773 B12R1.279 CCOc1cccc(C(C)=O)c1 Amb2221516 [1,1,0,0,0,0|1,0,0]=3 4774 B12R1.279 CCOc1cccc(C(C)=O)n1 Amb22754994 [1,1,0,0,0,0|2,0,0]=4 4775 B12R1.279 CCOc1cccc(C(C)O)c1 Amb9364633 [1,1,0,0,0,0|1,0,1]=4 4776 B12R1.279 CCOc1cccc(C(N)=O)c1 Amb6357760 [1,1,0,0,0,0|1,0,0]=3 4777 B12R1.279 CCOc1cccc(C(N)=O)n1 Amb25707886 [1,1,0,0,0,0|2,0,0]=4 4778 B12R1.279 CCOc1cccc(C(N)=S)c1 Amb403040 [1,1,0,0,0,0|1,1,0]=4 4779 B12R1.279 CCOc1cccc(S(=O)[O-])c1 Amb27796829 [1,1,0,0,0,0|1,0,1]=4 4780 B12R1.279 CCOc1cccc([C@@H](C)O)c1 Amb26584930 [1,1,0,0,0,0|1,0,1]=4 4781 B12R1.279 CCOc1cccc([C@H](C)O)c1 Amb25221134 [1,1,0,0,0,0|1,0,1]=4 4782 B12R1.279 CCOc1cccc([N+](=O)[O-])c1 Amb4016525 [1,1,0,0,0,0|1,0,1]=4 4783 B12R1.279 CCOc1ccnc(C(=O)O)c1 Amb8836820 [1,1,0,0,0,0|1,0,0]=3 4784 B12R1.279 CCOc1ccnc(C(=O)O)n1 Amb26612282 [1,1,0,0,0,0|2,0,0]=4 4785 B12R1.279 CCOc1ccnc(C(C)=O)c1 Amb22754989 [1,1,0,0,0,0|2,0,0]=4 4786 B12R1.279 CCOc1ccnc(C(N)=O)c1 Amb27452802 [1,1,0,0,0,0|2,0,0]=4 4787 B12R1.279 CCOc1cncc(C(=O)O)c1 Amb22752670 [1,1,0,0,0,0|1,0,0]=3 4788 B12R1.279 CCOc1cncc(C(=O)O)n1 Amb24355362 [1,1,0,0,0,0|2,0,0]=4 4789 B12R1.279 CCOc1cncc(C(N)=O)c1 Amb27983524 [1,1,0,0,0,0|2,0,0]=4 4790 B12R1.279 CCOc1nccc(C(=O)O)n1 Amb27657735 [1,1,0,0,0,0|2,0,0]=4 4791 B12R1.279 CCSc1cc(C(=O)O)ccn1 Amb6680239 [1,1,0,0,0,0|1,1,0]=4 4792 B12R1.279 CCSc1cccc(C(=O)O)c1 Amb18119564 [1,1,0,0,0,0|0,1,0]=3 4793 B12R1.279 CCSc1cccc(C(C)=O)c1 Amb27590483 [1,1,0,0,0,0|1,1,0]=4 4794 B12R1.279 CCSc1cncc(C(=O)O)c1 Amb2795672 [1,1,0,0,0,0|1,1,0]=4 4795 B12R1.279 CNCc1cccc(C(=O)O)c1 Amb17309028 [1,1,0,0,0,0|1,0,0]=3 4796 B12R1.279 CNCc1cccc(C(N)=O)c1 Amb10609787 [1,1,0,0,0,0|2,0,0]=4 4797 B12R1.279 CNCc1cccc(C(N)=O)c1 Amb6274563 [1,1,0,0,0,0|2,0,0]=4 4798 B12R1.279 CNCc1ccnc(C(=O)O)c1 Amb27793805 [1,1,0,0,0,0|2,0,0]=4 4799 B12R1.279 CNCc1cncc(C(=O)O)c1 Amb28195902 [1,1,0,0,0,0|2,0,0]=4 4800 B12R1.279 COCc1cc(C(=O)O)ncn1 Amb35673140 [1,1,0,0,0,0|2,0,0]=4 4801 B12R1.279 COCc1cccc(B(O)O)c1 Amb2447032 [1,1,0,0,0,0|1,0,1]=4 4802 B12R1.279 COCc1cccc(C(=N)N)c1 Amb6261504 [1,1,0,0,0,0|2,0,0]=4 4803 B12R1.279 COCc1cccc(C(=O)O)c1 Amb1215305 [1,1,0,0,0,0|0,0,0]=2 4804 B12R1.279 COCc1cccc(C(=O)O)n1 Amb19516970 [1,1,0,0,0,0|1,0,0]=3 4805 B12R1.279 COCc1cccc(C(=O)O)n1 Amb22587451 [1,1,0,0,0,0|1,0,0]=3 4806 B12R1.279 COCc1cccc(C(=O)O)n1 Amb32409792 [1,1,0,0,0,0|1,0,0]=3 4807 B12R1.279 COCc1cccc(C(C)=O)c1 Amb24086537 [1,1,0,0,0,0|1,0,0]=3 4808 B12R1.279 COCc1cccc(C(C)O)c1 Amb25683856 [1,1,0,0,0,0|1,0,1]=4 4809 B12R1.279 COCc1cccc(C(N)=O)c1 Amb8998267 [1,1,0,0,0,0|1,0,0]=3 4810 B12R1.279 COCc1cccc(C(N)=S)c1 Amb6261201 [1,1,0,0,0,0|1,1,0]=4 4811 B12R1.279 COCc1cccc(S(=O)O)n1 Amb32992476 [1,1,0,0,0,0|2,0,0]=4 4812 B12R1.279 COCc1cccc(S(=O)[O-])c1 Amb32754291 [1,1,0,0,0,0|1,0,1]=4 4813 B12R1.279 COCc1cccc([C@@H](C)O)c1 Amb33416102 [1,1,0,0,0,0|1,0,1]=4 4814 B12R1.279 COCc1cccc([C@H](C)O)c1 Amb33416827 [1,1,0,0,0,0|1,0,1]=4 4815 B12R1.279 COCc1cccc([N+](=O)[O-])c1 Amb22523385 [1,1,0,0,0,0|1,0,1]=4 4816 B12R1.279 COCc1ccnc(C(=O)O)c1 Amb27852041 [1,1,0,0,0,0|1,0,0]=3 4817 B12R1.279 COCc1ccnc(C(C)=O)c1 Amb22755049 [1,1,0,0,0,0|2,0,0]=4 4818 B12R1.279 COCc1cncc(C(=O)O)c1 Amb27266129 [1,1,0,0,0,0|1,0,0]=3 4819 B12R1.279 COCc1cncc(C(=O)O)c1 Amb32665372 [1,1,0,0,0,0|1,0,0]=3 4820 B12R1.279 COCc1nccc(C(=O)O)n1 Amb18996688 [1,1,0,0,0,0|2,0,0]=4 4821 B12R1.279 COSc1cc(C(N)=O)ccn1 Amb28244332 [1,1,0,0,0,0|2,0,0]=4 4822 B12R1.279 CSCc1cccc(C(=O)O)c1 Amb433836 [1,1,0,0,0,0|0,1,0]=3 4823 B12R1.279 CSSc1cc(C(=O)O)ccn1 Amb28254915 [1,1,0,0,0,0|1,1,0]=4 4824 B12R1.279 C\C=C\c1cccc(C(C)=O)c1 Amb8394460 [1,1,0,0,0,0|2,0,0]=4 4825 B12R1.279 N#CCc1cccc(C(=O)O)c1 Amb839917 [1,1,0,0,0,0|1,0,1]=4 4826 B12R1.279 N#CNc1cccc(C(=O)O)c1 Amb25794473 [1,1,0,0,0,0|1,0,1]=4 4827 B12R1.279 NCCc1cccc(C(=O)O)c1 Amb33548462 [1,1,0,0,0,0|1,0,0]=3 4828 B12R1.279 NCCc1cccc(C(=O)O)c1 Amb5722065 [1,1,0,0,0,0|1,0,0]=3 4829 B12R1.279 NCCc1cccc(C(=O)O)n1 Amb27160304 [1,1,0,0,0,0|2,0,0]=4 4830 B12R1.279 NCCc1cccc(C(N)=O)c1 Amb13952706 [1,1,0,0,0,0|2,0,0]=4 4831 B12R1.279 NCCc1cccc(C(N)=O)c1 Amb9677560 [1,1,0,0,0,0|2,0,0]=4 4832 B12R1.279 NNCc1cccc(C(=O)O)c1 Amb24447160 [1,1,0,0,0,0|2,0,0]=4 4833 B12R1.279 NNCc1cccc(C(=O)O)c1 Amb33734115 [1,1,0,0,0,0|2,0,0]=4 4834 B12R1.279 NOCc1cccc(C(=O)O)c1 Amb27983497 [1,1,0,0,0,0|1,0,0]=3 4835 B12R1.279 O=C(O)c1cc(CCO)ccn1 Amb2695569 [1,1,0,0,0,0|2,0,0]=4 4836 B12R1.279 O=C(O)c1ccc[n+](CCS)c1 Amb27643604 [1,1,0,0,0,0|2,0,0]=4 4837 B12R1.279 O=C(O)c1cccc(CCO)c1 Amb22284366 [1,1,0,0,0,0|1,0,0]=3 4838 B12R1.279 O=C(O)c1cccc(CCS)c1 Amb27878752 [1,1,0,0,0,0|1,0,0]=3 4839 B12R1.279 O=C(O)c1cccc(N=C=S)c1 Amb2685736 [1,1,0,0,0,0|1,0,1]=4 4840 B12R1.279 O=C(O)c1cccc(SCCl)c1 Amb24591530 [1,1,0,0,0,0|0,1,0]=3 4841 B12R1.279 O=C(O)c1cccc(\C=C\Br)c1 Amb33134972 [1,1,0,0,0,0|1,0,1]=4 4842 B12R1.279 O=C(O)c1cccc(\C=C\Cl)c1 Amb27454836 [1,1,0,0,0,0|1,0,1]=4 4843 B12R1.279 O=C(O)c1cncc(CCO)c1 Amb24702700 [1,1,0,0,0,0|2,0,0]=4 4844 B12R1.279 O=CCc1cccc(C(=O)O)c1 Amb33745237 [1,1,0,0,0,0|1,0,1]=4 4845 B12R1.279 O=[N+]([O-])c1cccc(OCCl)c1 Amb26975687 [1,1,0,0,0,0|1,0,1]=4 4846 B12R1.279 [N-]=[N+]=Nc1cccc(C(=O)O)c1 Amb28145945 [1,1,0,0,0,0|2,0,0]=4 4847 B12R1.435 C#Cc1cccc(C(=O)OC)c1 Amb19895030 [1,1,0,0,0,0|1,0,1]=4 4848 B12R1.435 C=C(C#N)c1cccc(OC)c1 Amb17232290 [1,1,0,0,0,0|2,0,0]=4 4849 B12R1.435 C=C(CBr)c1cccc(OC)c1 Amb33334693 [1,1,0,0,0,0|2,0,0]=4 4850 B12R1.435 C=C(CCl)c1cccc(OC)c1 Amb33259840 [1,1,0,0,0,0|2,0,0]=4 4851 B12R1.435 C=C(CN)c1cccc(OC)c1 Amb18645902 [1,1,0,0,0,0|2,0,0]=4 4852 B12R1.435 C=CC(=O)c1cc(OC)ccn1 Amb33319020 [1,1,0,0,0,0|2,0,0]=4 4853 B12R1.435 C=CC(=O)c1cccc(CC)c1 Amb27143812 [1,1,0,0,0,0|2,0,0]=4 4854 B12R1.435 C=CC(=O)c1cccc(OC)c1 Amb18563547 [1,1,0,0,0,0|1,0,0]=3 4855 B12R1.435 C=CC(=O)c1cccc(OC)n1 Amb33202120 [1,1,0,0,0,0|2,0,0]=4 4856 B12R1.435 C=CC(=O)c1cccc(SC)c1 Amb27792422 [1,1,0,0,0,0|1,1,0]=4 4857 B12R1.435 C=CC(=O)c1ccnc(OC)c1 Amb32730109 [1,1,0,0,0,0|2,0,0]=4 4858 B12R1.435 C=CC(=O)c1cncc(OC)c1 Amb25160064 [1,1,0,0,0,0|2,0,0]=4 4859 B12R1.435 C=CC(O)c1cccc(OC)c1 Amb25882812 [1,1,0,0,0,0|1,0,1]=4 4860 B12R1.435 C=C[C@@H](O)c1cccc(OC)c1 Amb28242274 [1,1,0,0,0,0|1,0,1]=4 4861 B12R1.435 C=C[C@H](O)c1cccc(OC)c1 Amb27753085 [1,1,0,0,0,0|1,0,1]=4 4862 B12R1.435 C=Cc1cccc(C(=O)OC)c1 Amb16185423 [1,1,0,0,0,0|1,0,1]=4 4863 B12R1.435 CCC(=O)c1cc(OC)ccn1 Amb25169563 [1,1,0,0,0,0|2,0,0]=4 4864 B12R1.435 CCC(=O)c1cccc(CC)c1 Amb26630120 [1,1,0,0,0,0|2,0,0]=4 4865 B12R1.435 CCC(=O)c1cccc(OC)c1 Amb16231919 [1,1,0,0,0,0|1,0,0]=3 4866 B12R1.435 CCC(=O)c1cccc(OC)n1 Amb32666977 [1,1,0,0,0,0|2,0,0]=4 4867 B12R1.435 CCC(=O)c1cccc(SC)c1 Amb24487204 [1,1,0,0,0,0|1,1,0]=4 4868 B12R1.435 CCC(=O)c1ccnc(OC)c1 Amb26425886 [1,1,0,0,0,0|2,0,0]=4 4869 B12R1.435 CCC(=O)c1cncc(OC)c1 Amb27175966 [1,1,0,0,0,0|2,0,0]=4 4870 B12R1.435 CCC(O)c1cccc(OC)c1 Amb17232589 [1,1,0,0,0,0|1,0,1]=4 4871 B12R1.435 CCc1cc(C(=O)OC)ccn1 Amb10606526 [1,1,0,0,0,0|2,0,0]=4 4872 B12R1.435 CCc1cccc(C(=N)NO)c1 Amb26891394 [1,1,0,0,0,0|2,0,0]=4 4873 B12R1.435 CCc1cccc(C(=O)CBr)c1 Amb10070992 [1,1,0,0,0,0|2,0,0]=4 4874 B12R1.435 CCc1cccc(C(=O)CCl)c1 Amb26452706 [1,1,0,0,0,0|2,0,0]=4 4875 B12R1.435 CCc1cccc(C(=O)CN)c1 Amb25727359 [1,1,0,0,0,0|2,0,0]=4 4876 B12R1.435 CCc1cccc(C(=O)OC)c1 Amb26017255 [1,1,0,0,0,0|1,0,0]=3 4877 B12R1.435 CCc1cccc(C(=O)OC)n1 Amb21857615 [1,1,0,0,0,0|2,0,0]=4 4878 B12R1.435 CCc1cncc(C(=O)NO)c1 Amb28291880 [1,1,0,0,0,0|2,0,0]=4 4879 B12R1.435 CCc1cncc(C(=O)OC)c1 Amb26600026 [1,1,0,0,0,0|2,0,0]=4 4880 B12R1.435 CNC(=O)c1cccc(NC)c1 Amb18967614 [1,1,0,0,0,0|2,0,0]=4 4881 B12R1.435 CNC(=O)c1cccc(NC)c1 Amb30584880 [1,1,0,0,0,0|2,0,0]=4 4882 B12R1.435 CNC(=O)c1cccc(OC)c1 Amb2613119 [1,1,0,0,0,0|1,0,0]=3 4883 B12R1.435 CNC(=O)c1cccc(OC)n1 Amb21811821 [1,1,0,0,0,0|2,0,0]=4 4884 B12R1.435 CNc1cc(C(=O)OC)ccn1 Amb26494957 [1,1,0,0,0,0|2,0,0]=4 4885 B12R1.435 CNc1cccc(C(=O)OC)c1 Amb17307207 [1,1,0,0,0,0|1,0,0]=3 4886 B12R1.435 CNc1cccc(C(=O)OC)n1 Amb25150886 [1,1,0,0,0,0|2,0,0]=4 4887 B12R1.435 CNc1cccc(\C(N)=N\O)c1 Amb27175552 [1,1,0,0,0,0|2,0,0]=4 4888 B12R1.435 CNc1cncc(C(=O)OC)c1 Amb27858262 [1,1,0,0,0,0|2,0,0]=4 4889 B12R1.435 COC(=O)c1cc(OC)ccn1 Amb2447592 [1,1,0,0,0,0|1,0,0]=3 4890 B12R1.435 COC(=O)c1cc(OC)ccn1 Amb2696330 [1,1,0,0,0,0|1,0,0]=3 4891 B12R1.435 COC(=O)c1cc(OC)ncn1 Amb22643107 [1,1,0,0,0,0|2,0,0]=4 4892 B12R1.435 COC(=O)c1cc(SC)ccn1 Amb27613115 [1,1,0,0,0,0|1,1,0]=4 4893 B12R1.435 COC(=O)c1ccc[n+](OC)c1 Amb10573252 [1,1,0,0,0,0|1,0,0]=3 4894 B12R1.435 COC(=O)c1cccc(C#N)c1 Amb2725334 [1,1,0,0,0,0|2,0,0]=4 4895 B12R1.435 COC(=O)c1cccc(C=O)c1 Amb3941035 [1,1,0,0,0,0|2,0,0]=4 4896 B12R1.435 COC(=O)c1cccc(CBr)c1 Amb1210760 [1,1,0,0,0,0|2,0,0]=4 4897 B12R1.435 COC(=O)c1cccc(CCl)c1 Amb6296206 [1,1,0,0,0,0|2,0,0]=4 4898 B12R1.435 COC(=O)c1cccc(CN)c1 Amb10976909 [1,1,0,0,0,0|2,0,0]=4 4899 B12R1.435 COC(=O)c1cccc(CN)c1 Amb2691285 [1,1,0,0,0,0|2,0,0]=4 4900 B12R1.435 COC(=O)c1cccc(CO)c1 Amb2698038 [1,1,0,0,0,0|2,0,0]=4 4901 B12R1.435 COC(=O)c1cccc(CS)c1 Amb27759098 [1,1,0,0,0,0|2,0,0]=4 4902 B12R1.435 COC(=O)c1cccc(C[NH3+])c1 Amb5722517 [1,1,0,0,0,0|2,0,0]=4 4903 B12R1.435 COC(=O)c1cccc(NN)c1 Amb22170359 [1,1,0,0,0,0|2,0,0]=4 4904 B12R1.435 COC(=O)c1cccc(NN)c1 Amb32409816 [1,1,0,0,0,0|2,0,0]=4 4905 B12R1.435 COC(=O)c1cccc(OC)c1 Amb534978 [1,1,0,0,0,0|0,0,0]=2 4906 B12R1.435 COC(=O)c1cccc(OC)n1 Amb6565088 [1,1,0,0,0,0|1,0,0]=3 4907 B12R1.435 COC(=O)c1cccc(ON)c1 Amb27615432 [1,1,0,0,0,0|1,0,0]=3 4908 B12R1.435 COC(=O)c1cccc(SC)c1 Amb22261603 [1,1,0,0,0,0|0,1,0]=3 4909 B12R1.435 COC(=O)c1cccc(SC)n1 Amb8447597 [1,1,0,0,0,0|1,1,0]=4 4910 B12R1.435 COC(=O)c1cccc(SCl)c1 Amb24702477 [1,1,0,0,0,0|1,1,0]=4 4911 B12R1.435 COC(=O)c1ccnc(OC)c1 Amb10072099 [1,1,0,0,0,0|1,0,0]=3 4912 B12R1.435 COC(=O)c1ccnc(OC)n1 Amb22498354 [1,1,0,0,0,0|2,0,0]=4 4913 B12R1.435 COC(=O)c1ccnc(SC)c1 Amb24731751 [1,1,0,0,0,0|1,1,0]=4 4914 B12R1.435 COC(=O)c1cncc(OC)c1 Amb8426266 [1,1,0,0,0,0|1,0,0]=3 4915 B12R1.435 COC(=O)c1cncc(OC)n1 Amb16233071 [1,1,0,0,0,0|2,0,0]=4 4916 B12R1.435 COC(=O)c1cncc(SC)c1 Amb22523383 [1,1,0,0,0,0|1,1,0]=4 4917 B12R1.435 COC(=O)c1cnnc(OC)c1 Amb23400496 [1,1,0,0,0,0|2,0,0]=4 4918 B12R1.435 COC(=O)c1nccc(OC)n1 Amb27654268 [1,1,0,0,0,0|2,0,0]=4 4919 B12R1.435 COC1=CC=C\C(=C(\O)N=N)N1 Amb27388324 [1,1,0,0,0,0|2,0,0]=4 4920 B12R1.435 COC1=C\C(=C(/N)N=O)C=CN1 Amb33553133 [1,1,0,0,0,0|2,0,0]=4 4921 B12R1.435 COc1cc(C(=O)CBr)ccn1 Amb27779161 [1,1,0,0,0,0|2,0,0]=4 4922 B12R1.435 COc1cc(C(=O)CBr)ccn1 Amb32653016 [1,1,0,0,0,0|2,0,0]=4 4923 B12R1.435 COc1cc(C(=O)CN)ccn1 Amb33320592 [1,1,0,0,0,0|2,0,0]=4 4924 B12R1.435 COc1cc(C(=O)NN)ccn1 Amb10975686 [1,1,0,0,0,0|2,0,0]=4 4925 B12R1.435 COc1cc(\C(C)=N\O)ccn1 Amb27248682 [1,1,0,0,0,0|2,0,0]=4 4926 B12R1.435 COc1cc(\C(N)=N\O)ccn1 Amb9718409 [1,1,0,0,0,0|2,0,0]=4 4927 B12R1.435 COc1cccc(C(=O)C#N)c1 Amb17232349 [1,1,0,0,0,0|1,0,0]=3 4928 B12R1.435 COc1cccc(C(=O)C=O)c1 Amb10067953 [1,1,0,0,0,0|0,0,1]=3 4929 B12R1.435 COc1cccc(C(=O)CBr)c1 Amb1239476 [1,1,0,0,0,0|1,0,0]=3 4930 B12R1.435 COc1cccc(C(=O)CBr)n1 Amb26876548 [1,1,0,0,0,0|2,0,0]=4 4931 B12R1.435 COc1cccc(C(=O)CCl)c1 Amb19069172 [1,1,0,0,0,0|1,0,0]=3 4932 B12R1.435 COc1cccc(C(=O)CCl)n1 Amb22754609 [1,1,0,0,0,0|2,0,0]=4 4933 B12R1.435 COc1cccc(C(=O)CF)c1 Amb24084128 [1,1,0,0,0,0|1,0,0]=3 4934 B12R1.435 COc1cccc(C(=O)CN)c1 Amb18972024 [1,1,0,0,0,0|1,0,0]=3 4935 B12R1.435 COc1cccc(C(=O)CN)c1 Amb2693533 [1,1,0,0,0,0|1,0,0]=3 4936 B12R1.435 COc1cccc(C(=O)CN)n1 Amb25208064 [1,1,0,0,0,0|2,0,0]=4 4937 B12R1.435 COc1cccc(C(=O)CO)c1 Amb18801000 [1,1,0,0,0,0|0,0,0]=2 4938 B12R1.435 COc1cccc(C(=O)CS)c1 Amb9696938 [1,1,0,0,0,0|0,1,0]=3 4939 B12R1.435 COc1cccc(C(=O)C[NH3+])c1 Amb20669854 [1,1,0,0,0,0|1,0,0]=3 4940 B12R1.435 COc1cccc(C(=O)NN)c1 Amb6356332 [1,1,0,0,0,0|1,0,0]=3 4941 B12R1.435 COc1cccc(C(=O)NN)n1 Amb27261075 [1,1,0,0,0,0|2,0,0]=4 4942 B12R1.435 COc1cccc(C(=O)NN)n1 Amb6565091 [1,1,0,0,0,0|2,0,0]=4 4943 B12R1.435 COc1cccc(C(=O)NO)c1 Amb6280528 [1,1,0,0,0,0|0,0,0]=2 4944 B12R1.435 COc1cccc(C(=O)NO)n1 Amb27187797 [1,1,0,0,0,0|1,0,0]=3 4945 B12R1.435 COc1cccc(C(=S)NN)c1 Amb27607913 [1,1,0,0,0,0|1,1,0]=4 4946 B12R1.435 COc1cccc(C(C)C=O)c1 Amb17232468 [1,1,0,0,0,0|1,0,1]=4 4947 B12R1.435 COc1cccc(C(C)CO)c1 Amb17232594 [1,1,0,0,0,0|1,0,1]=4 4948 B12R1.435 COc1cccc(C(C)ON)c1 Amb31296916 [1,1,0,0,0,0|1,0,1]=4 4949 B12R1.435 COc1cccc(C(N)CO)c1 Amb22756347 [1,1,0,0,0,0|1,0,1]=4 4950 B12R1.435 COc1cccc(C(N)CO)c1 Amb8855262 [1,1,0,0,0,0|1,0,1]=4 4951 B12R1.435 COc1cccc(C(O)CBr)c1 Amb17206125 [1,1,0,0,0,0|1,0,1]=4 4952 B12R1.435 COc1cccc(C(O)CCl)c1 Amb17234353 [1,1,0,0,0,0|1,0,1]=4 4953 B12R1.435 COc1cccc(C(O)CF)c1 Amb26009518 [1,1,0,0,0,0|1,0,1]=4 4954 B12R1.435 COc1cccc(C(O)CI)c1 Amb26332883 [1,1,0,0,0,0|1,0,1]=4 4955 B12R1.435 COc1cccc(C(O)CN)c1 Amb1108404 [1,1,0,0,0,0|1,0,1]=4 4956 B12R1.435 COc1cccc(C(O)CN)c1 Amb2699086 [1,1,0,0,0,0|1,0,1]=4 4957 B12R1.435 COc1cccc(C(O)CO)c1 Amb18563839 [1,1,0,0,0,0|0,0,2]=4 4958 B12R1.435 COc1cccc([C@@H](C)CO)c1 Amb25129765 [1,1,0,0,0,0|1,0,1]=4 4959 B12R1.435 COc1cccc([C@@H](F)CO)c1 Amb27764962 [1,1,0,0,0,0|1,0,1]=4 4960 B12R1.435 COc1cccc([C@@H](N)CO)c1 Amb24068209 [1,1,0,0,0,0|1,0,1]=4 4961 B12R1.435 COc1cccc([C@@H](N)CO)c1 Amb30634208 [1,1,0,0,0,0|1,0,1]=4 4962 B12R1.435 COc1cccc([C@@H](O)C#N)c1 Amb27872123 [1,1,0,0,0,0|1,0,1]=4 4963 B12R1.435 COc1cccc([C@@H](O)CF)c1 Amb27662142 [1,1,0,0,0,0|1,0,1]=4 4964 B12R1.435 COc1cccc([C@@H](O)CN)c1 Amb27862344 [1,1,0,0,0,0|1,0,1]=4 4965 B12R1.435 COc1cccc([C@@H](O)CO)c1 Amb27642152 [1,1,0,0,0,0|0,0,2]=4 4966 B12R1.435 COc1cccc([C@H](C)CO)c1 Amb26921920 [1,1,0,0,0,0|1,0,1]=4 4967 B12R1.435 COc1cccc([C@H](N)CO)c1 Amb24117993 [1,1,0,0,0,0|1,0,1]=4 4968 B12R1.435 COc1cccc([C@H](N)CO)c1 Amb26509234 [1,1,0,0,0,0|1,0,1]=4 4969 B12R1.435 COc1cccc([C@H](O)C#N)c1 Amb25112008 [1,1,0,0,0,0|1,0,1]=4 4970 B12R1.435 COc1cccc([C@H](O)CBr)c1 Amb6893367 [1,1,0,0,0,0|1,0,1]=4 4971 B12R1.435 COc1cccc([C@H](O)CF)c1 Amb28205942 [1,1,0,0,0,0|1,0,1]=4 4972 B12R1.435 COc1cccc([C@H](O)CN)c1 Amb26967003 [1,1,0,0,0,0|1,0,1]=4 4973 B12R1.435 COc1cccc([C@H](O)CO)c1 Amb27178602 [1,1,0,0,0,0|0,0,2]=4 4974 B12R1.435 COc1cccc(\C(C)=N\N)c1 Amb27178882 [1,1,0,0,0,0|2,0,0]=4 4975 B12R1.435 COc1cccc(\C(N)=N/O)c1 Amb2696157 [1,1,0,0,0,0|1,0,0]=3 4976 B12R1.435 COc1cccc(\C(N)=N\N)c1 Amb18788357 [1,1,0,0,0,0|2,0,0]=4 4977 B12R1.435 COc1cccc(\C(N)=N\O)c1 Amb33532682 [1,1,0,0,0,0|1,0,0]=3 4978 B12R1.435 COc1ccnc(C(=O)CBr)c1 Amb25715046 [1,1,0,0,0,0|2,0,0]=4 4979 B12R1.435 COc1ccnc(C(=O)CCl)c1 Amb26424740 [1,1,0,0,0,0|2,0,0]=4 4980 B12R1.435 COc1ccnc(C(=O)CN)c1 Amb33319340 [1,1,0,0,0,0|2,0,0]=4 4981 B12R1.435 COc1ccnc(C(=O)NN)c1 Amb6565082 [1,1,0,0,0,0|2,0,0]=4 4982 B12R1.435 COc1ccnc(C(=O)NO)c1 Amb28064787 [1,1,0,0,0,0|1,0,0]=3 4983 B12R1.435 COc1cncc(C(=O)CCl)c1 Amb27460274 [1,1,0,0,0,0|2,0,0]=4 4984 B12R1.435 COc1cncc(C(=O)CN)c1 Amb24484197 [1,1,0,0,0,0|2,0,0]=4 4985 B12R1.435 COc1cncc(C(O)C=O)c1 Amb28241740 [1,1,0,0,0,0|1,0,1]=4 4986 B12R1.435 COc1cncc(\C(Cl)=N\O)c1 Amb35665399 [1,1,0,0,0,0|2,0,0]=4 4987 B12R1.435 COc1cncc(\C(N)=N\O)c1 Amb26557462 [1,1,0,0,0,0|2,0,0]=4 4988 B12R1.435 CSc1cc(C(=O)NO)ccn1 Amb27983039 [1,1,0,0,0,0|1,1,0]=4 4989 B12R1.435 CSc1cccc(C(=O)CBr)c1 Amb27438045 [1,1,0,0,0,0|1,1,0]=4 4990 B12R1.435 CSc1cccc(C(=O)CCl)c1 Amb25667469 [1,1,0,0,0,0|1,1,0]=4 4991 B12R1.435 CSc1cccc(C(=O)CN)c1 Amb33144878 [1,1,0,0,0,0|1,1,0]=4 4992 B12R1.435 CSc1cccc(C(=O)NN)c1 Amb27946785 [1,1,0,0,0,0|1,1,0]=4 4993 B12R1.435 N#Cc1cccc(C(=O)CO)c1 Amb33551726 [1,1,0,0,0,0|2,0,0]=4 4994 B12R1.435 O=C(NO)c1cccc(CCl)c1 Amb27758285 [1,1,0,0,0,0|2,0,0]=4 4995 B12R1.435 [C-]#[N+]c1cccc(C(=O)OC)c1 Amb2689478 [1,1,0,0,0,0|1,0,1]=4 4996 B12R1.436 CCc1cccc(S(=O)(=O)O)c1 Amb25111504 [1,1,0,0,0,0|2,0,0]=4 4997 B12R1.436 CNc1cccc(P(=O)(O)O)c1 Amb27393188 [1,1,0,0,0,0|2,0,0]=4 4998 B12R1.436 COc1cccc(C(C)(C)O)c1 Amb9676990 [1,1,0,0,0,0|1,0,1]=4 4999 B12R1.436 COc1cccc(S(=O)(=O)Br)c1 Amb27468172 [1,1,0,0,0,0|1,0,1]=4 5000 B12R1.436 COc1cccc(S(=O)(=O)Cl)c1 Amb1128693 [1,1,0,0,0,0|1,0,1]=4 5001 B12R1.436 COc1cccc(S(=O)(=O)F)c1 Amb18564679 [1,1,0,0,0,0|1,0,1]=4 5002 B12R1.436 COc1cccc(S(=O)(=O)O)c1 Amb18863293 [1,1,0,0,0,0|1,0,0]=3 5003 B12R1.436 COc1cccc(S(C)(=N)=O)c1 Amb32667790 [1,1,0,0,0,0|2,0,0]=4 5004 B12R1.436 COc1cccc(S(C)(=N)=O)c1 Amb33456442 [1,1,0,0,0,0|2,0,0]=4 5005 B12R1.436 COc1cccc(S(N)(=O)=O)c1 Amb9023525 [1,1,0,0,0,0|1,0,1]=4 5006 B12R1.436 COc1cccc([S@](C)(=N)=O)c1 Amb33744007 [1,1,0,0,0,0|2,0,0]=4 5007 B12R1.440 C#Cc1cccc(C(=O)O)c1F Amb25213486 [1,1,0,0,0,0|1,0,1]=4 5008 B12R1.440 C=Nc1cccc(C(=O)O)c1O Amb27758653 [1,1,0,0,0,0|1,0,1]=4 5009 B12R1.440 CCN1C=CC=C(C(=O)O)C1=O Amb18540686 [1,1,0,0,0,0|2,0,0]=4 5010 B12R1.440 CCc1cccc(C(=O)O)c1Br Amb26968415 [1,1,0,0,0,0|1,0,0]=3 5011 B12R1.440 CCc1cccc(C(=O)O)c1C Amb24470061 [1,1,0,0,0,0|1,0,0]=3 5012 B12R1.440 CCc1cccc(C(=O)O)c1F Amb24707738 [1,1,0,0,0,0|1,0,0]=3 5013 B12R1.440 CCc1cccc(C(=O)O)c1I Amb25800185 [1,1,0,0,0,0|1,0,0]=3 5014 B12R1.440 CCc1cccc(C(=O)O)c1N Amb28555679 [1,1,0,0,0,0|1,0,0]=3 5015 B12R1.440 CCc1cccc(C(=O)O)c1N Amb7784317 [1,1,0,0,0,0|1,0,0]=3 5016 B12R1.440 CCc1cccc(C(=O)O)c1O Amb7807388 [1,1,0,0,0,0|1,0,0]=3 5017 B12R1.440 CCc1cccc(C(=O)O)c1S Amb27628706 [1,1,0,0,0,0|1,0,0]=3 5018 B12R1.440 CCc1cccc(C(C)=O)c1O Amb17232473 [1,1,0,0,0,0|2,0,0]=4 5019 B12R1.440 CCc1cccc(C(O)=S)c1C Amb24403119 [1,1,0,0,0,0|1,1,0]=4 5020 B12R1.440 CCc1cncc(C(=O)O)c1C Amb28041942 [1,1,0,0,0,0|2,0,0]=4 5021 B12R1.440 CCc1nccc(C(=O)O)c1C Amb18199715 [1,1,0,0,0,0|2,0,0]=4 5022 B12R1.440 CNc1cccc(C(=O)O)c1Br Amb27230834 [1,1,0,0,0,0|1,0,0]=3 5023 B12R1.440 CNc1cccc(C(=O)O)c1C Amb18288704 [1,1,0,0,0,0|1,0,0]=3 5024 B12R1.440 CNc1cccc(C(=O)O)c1F Amb28059785 [1,1,0,0,0,0|1,0,0]=3 5025 B12R1.440 CNc1cccc(C(=O)O)c1O Amb27847574 [1,1,0,0,0,0|1,0,0]=3 5026 B12R1.440 CNc1cccc(C(N)=O)c1O Amb27175684 [1,1,0,0,0,0|2,0,0]=4 5027 B12R1.440 CNc1nccc(C(=O)O)c1F Amb27623820 [1,1,0,0,0,0|2,0,0]=4 5028 B12R1.440 CNc1nccc(C(=O)O)c1N Amb24724197 [1,1,0,0,0,0|2,0,0]=4 5029 B12R1.440 COC1=CC=NC(=C(O)O)C1=O Amb27615289 [1,1,0,0,0,0|1,0,1]=4 5030 B12R1.440 COc1cccc(B(O)O)c1Br Amb23438919 [1,1,0,0,0,0|1,0,1]=4 5031 B12R1.440 COc1cccc(B(O)O)c1C Amb22735876 [1,1,0,0,0,0|1,0,1]=4 5032 B12R1.440 COc1cccc(B(O)O)c1Cl Amb22169496 [1,1,0,0,0,0|1,0,1]=4 5033 B12R1.440 COc1cccc(B(O)O)c1F Amb2447230 [1,1,0,0,0,0|1,0,1]=4 5034 B12R1.440 COc1cccc(B(O)O)c1O Amb13890337 [1,1,0,0,0,0|1,0,1]=4 5035 B12R1.440 COc1cccc(C(=N)N)c1Br Amb33331635 [1,1,0,0,0,0|2,0,0]=4 5036 B12R1.440 COc1cccc(C(=N)N)c1C Amb27459294 [1,1,0,0,0,0|2,0,0]=4 5037 B12R1.440 COc1cccc(C(=N)N)c1O Amb25242583 [1,1,0,0,0,0|2,0,0]=4 5038 B12R1.440 COc1cccc(C(=O)Cl)c1Br Amb25883422 [1,1,0,0,0,0|1,0,0]=3 5039 B12R1.440 COc1cccc(C(=O)Cl)c1F Amb10841825 [1,1,0,0,0,0|1,0,0]=3 5040 B12R1.440 COc1cccc(C(=O)Cl)c1N Amb27453500 [1,1,0,0,0,0|1,0,0]=3 5041 B12R1.440 COc1cccc(C(=O)Cl)c1O Amb6743391 [1,1,0,0,0,0|1,0,0]=3 5042 B12R1.440 COc1cccc(C(=O)O)c1Br Amb22228665 [1,1,0,0,0,0|0,0,0]=2 5043 B12R1.440 COc1cccc(C(=O)O)c1C Amb3941571 [1,1,0,0,0,0|0,0,0]=2 5044 B12R1.440 COc1cccc(C(=O)O)c1Cl Amb6366167 [1,1,0,0,0,0|0,0,0]=2 5045 B12R1.440 COc1cccc(C(=O)O)c1F Amb8397077 [1,1,0,0,0,0|0,0,0]=2 5046 B12R1.440 COc1cccc(C(=O)O)c1N Amb33534756 [1,1,0,0,0,0|0,0,0]=2 5047 B12R1.440 COc1cccc(C(=O)O)c1N Amb6297702 [1,1,0,0,0,0|0,0,0]=2 5048 B12R1.440 COc1cccc(C(=O)O)c1O Amb2780776 [1,1,0,0,0,0|0,0,0]=2 5049 B12R1.440 COc1cccc(C(=O)O)c1S Amb26075231 [1,1,0,0,0,0|0,0,0]=2 5050 B12R1.440 COc1cccc(C(C)=O)c1Br Amb22737598 [1,1,0,0,0,0|1,0,0]=3 5051 B12R1.440 COc1cccc(C(C)=O)c1C Amb25374940 [1,1,0,0,0,0|1,0,0]=3 5052 B12R1.440 COc1cccc(C(C)=O)c1Cl Amb33553102 [1,1,0,0,0,0|1,0,0]=3 5053 B12R1.440 COc1cccc(C(C)=O)c1F Amb22735543 [1,1,0,0,0,0|1,0,0]=3 5054 B12R1.440 COc1cccc(C(C)=O)c1N Amb18646261 [1,1,0,0,0,0|1,0,0]=3 5055 B12R1.440 COc1cccc(C(C)=O)c1O Amb10603308 [1,1,0,0,0,0|1,0,0]=3 5056 B12R1.440 COc1cccc(C(C)O)c1Cl Amb27146488 [1,1,0,0,0,0|1,0,1]=4 5057 B12R1.440 COc1cccc(C(N)=O)c1Br Amb22228664 [1,1,0,0,0,0|1,0,0]=3 5058 B12R1.440 COc1cccc(C(N)=O)c1Cl Amb24684560 [1,1,0,0,0,0|1,0,0]=3 5059 B12R1.440 COc1cccc(C(N)=O)c1F Amb22738941 [1,1,0,0,0,0|1,0,0]=3 5060 B12R1.440 COc1cccc(C(N)=O)c1I Amb28323029 [1,1,0,0,0,0|1,0,0]=3 5061 B12R1.440 COc1cccc(C(N)=O)c1N Amb17616912 [1,1,0,0,0,0|1,0,0]=3 5062 B12R1.440 COc1cccc(C(N)=O)c1O Amb416211 [1,1,0,0,0,0|1,0,0]=3 5063 B12R1.440 COc1cccc(C(N)=S)c1Br Amb33331631 [1,1,0,0,0,0|1,1,0]=4 5064 B12R1.440 COc1cccc(C(N)=S)c1C Amb25771060 [1,1,0,0,0,0|1,1,0]=4 5065 B12R1.440 COc1cccc(C(N)=S)c1Cl Amb27954219 [1,1,0,0,0,0|1,1,0]=4 5066 B12R1.440 COc1cccc(C(N)=S)c1F Amb27494714 [1,1,0,0,0,0|1,1,0]=4 5067 B12R1.440 COc1cccc(C(N)=S)c1N Amb28289756 [1,1,0,0,0,0|1,1,0]=4 5068 B12R1.440 COc1cccc(C(N)=S)c1O Amb26916618 [1,1,0,0,0,0|1,1,0]=4 5069 B12R1.440 COc1cccc(C(O)=S)c1C Amb24702455 [1,1,0,0,0,0|0,1,0]=3 5070 B12R1.440 COc1cccc(N(=O)=O)c1Br Amb20620540 [1,1,0,0,0,0|1,0,1]=4 5071 B12R1.440 COc1cccc(N(=O)=O)c1C Amb20621654 [1,1,0,0,0,0|1,0,1]=4 5072 B12R1.440 COc1cccc(N(=O)=O)c1Cl Amb20620772 [1,1,0,0,0,0|1,0,1]=4 5073 B12R1.440 COc1cccc(N(=O)=O)c1N Amb20621511 [1,1,0,0,0,0|1,0,1]=4 5074 B12R1.440 COc1cccc(S(=O)[O-])c1F Amb32754997 [1,1,0,0,0,0|1,0,1]=4 5075 B12R1.440 COc1cccc([C@@H](C)O)c1Br Amb33334210 [1,1,0,0,0,0|1,0,1]=4 5076 B12R1.440 COc1cccc([C@@H](C)O)c1C Amb33269558 [1,1,0,0,0,0|1,0,1]=4 5077 B12R1.440 COc1cccc([C@@H](C)O)c1O Amb24716929 [1,1,0,0,0,0|1,0,1]=4 5078 B12R1.440 COc1cccc([C@H](C)O)c1Br Amb33334216 [1,1,0,0,0,0|1,0,1]=4 5079 B12R1.440 COc1cccc([C@H](C)O)c1C Amb33226022 [1,1,0,0,0,0|1,0,1]=4 5080 B12R1.440 COc1cccc([C@H](C)O)c1F Amb27784504 [1,1,0,0,0,0|1,0,1]=4 5081 B12R1.440 COc1cccc([C@H](C)O)c1O Amb25969051 [1,1,0,0,0,0|1,0,1]=4 5082 B12R1.440 COc1cccc([N+](=O)[O-])c1Br Amb2721354 [1,1,0,0,0,0|1,0,1]=4 5083 B12R1.440 COc1cccc([N+](=O)[O-])c1C Amb2780414 [1,1,0,0,0,0|1,0,1]=4 5084 B12R1.440 COc1cccc([N+](=O)[O-])c1Cl Amb10766391 [1,1,0,0,0,0|1,0,1]=4 5085 B12R1.440 COc1cccc([N+](=O)[O-])c1F Amb26359784 [1,1,0,0,0,0|1,0,1]=4 5086 B12R1.440 COc1cccc([N+](=O)[O-])c1I Amb25890586 [1,1,0,0,0,0|1,0,1]=4 5087 B12R1.440 COc1cccc([N+](=O)[O-])c1N Amb10603621 [1,1,0,0,0,0|1,0,1]=4 5088 B12R1.440 COc1cccc([N+](=O)[O-])c1N Amb24105790 [1,1,0,0,0,0|1,0,1]=4 5089 B12R1.440 COc1cccc([N+](=O)[O-])c1O Amb5718420 [1,1,0,0,0,0|1,0,1]=4 5090 B12R1.440 COc1cccc([N+](=O)[O-])c1S Amb27248448 [1,1,0,0,0,0|1,0,1]=4 5091 B12R1.440 COc1ccnc(C(=O)Cl)c1Cl Amb27265485 [1,1,0,0,0,0|2,0,0]=4 5092 B12R1.440 COc1ccnc(C(=O)O)c1C Amb22728380 [1,1,0,0,0,0|1,0,0]=3 5093 B12R1.440 COc1ccnc(C(=O)O)c1Cl Amb23539036 [1,1,0,0,0,0|1,0,0]=3 5094 B12R1.440 COc1ccnc(C(=O)O)c1F Amb26447814 [1,1,0,0,0,0|1,0,0]=3 5095 B12R1.440 COc1ccnc(C(=O)O)c1F Amb33127825 [1,1,0,0,0,0|1,0,0]=3 5096 B12R1.440 COc1ccnc(C(=O)O)c1N Amb22755142 [1,1,0,0,0,0|1,0,0]=3 5097 B12R1.440 COc1ccnc(C(=O)O)c1O Amb18826216 [1,1,0,0,0,0|1,0,0]=3 5098 B12R1.440 COc1ccnc(C(C)=O)c1C Amb27872553 [1,1,0,0,0,0|2,0,0]=4 5099 B12R1.440 COc1ccnc(C(N)=O)c1N Amb32418065 [1,1,0,0,0,0|2,0,0]=4 5100 B12R1.440 COc1ccnc(S(=O)O)c1F Amb32992481 [1,1,0,0,0,0|2,0,0]=4 5101 B12R1.440 COc1cncc(C(=O)Cl)c1Cl Amb28368340 [1,1,0,0,0,0|2,0,0]=4 5102 B12R1.440 COc1cncc(C(=O)O)c1C Amb22728379 [1,1,0,0,0,0|1,0,0]=3 5103 B12R1.440 COc1cncc(C(=O)O)c1C Amb30584959 [1,1,0,0,0,0|1,0,0]=3 5104 B12R1.440 COc1cncc(C(=O)O)c1Cl Amb24639720 [1,1,0,0,0,0|1,0,0]=3 5105 B12R1.440 COc1cncc(C(C)=O)c1F Amb27453677 [1,1,0,0,0,0|2,0,0]=4 5106 B12R1.440 COc1cncc(C(N)=O)c1C Amb27877414 [1,1,0,0,0,0|2,0,0]=4 5107 B12R1.440 COc1nccc(C(=O)Cl)c1Cl Amb27667919 [1,1,0,0,0,0|2,0,0]=4 5108 B12R1.440 COc1nccc(C(=O)O)c1Br Amb24483689 [1,1,0,0,0,0|1,0,0]=3 5109 B12R1.440 COc1nccc(C(=O)O)c1C Amb19516446 [1,1,0,0,0,0|1,0,0]=3 5110 B12R1.440 COc1nccc(C(=O)O)c1Cl Amb19958463 [1,1,0,0,0,0|1,0,0]=3 5111 B12R1.440 COc1nccc(C(=O)O)c1F Amb26979771 [1,1,0,0,0,0|1,0,0]=3 5112 B12R1.440 COc1nccc(C(=O)O)c1N Amb18826803 [1,1,0,0,0,0|1,0,0]=3 5113 B12R1.440 COc1nccc(C(C)=O)c1O Amb27250608 [1,1,0,0,0,0|2,0,0]=4 5114 B12R1.440 COc1nccc(S(=O)O)c1Cl Amb32992457 [1,1,0,0,0,0|2,0,0]=4 5115 B12R1.440 COc1nccc(S(=O)O)c1F Amb32992453 [1,1,0,0,0,0|2,0,0]=4 5116 B12R1.440 COc1ncnc(C(=O)O)c1C Amb27764404 [1,1,0,0,0,0|2,0,0]=4 5117 B12R1.440 COc1ncnc(C(=O)O)c1F Amb23598079 [1,1,0,0,0,0|2,0,0]=4 5118 B12R1.440 CSc1cccc(C(=O)Cl)c1F Amb27945846 [1,1,0,0,0,0|1,1,0]=4 5119 B12R1.440 CSc1cccc(C(=O)O)[n+]1C Amb2612034 [1,1,0,0,0,0|1,1,0]=4 5120 B12R1.440 CSc1cccc(C(=O)O)c1Br Amb28249766 [1,1,0,0,0,0|0,1,0]=3 5121 B12R1.440 CSc1cccc(C(=O)O)c1C Amb28344762 [1,1,0,0,0,0|0,1,0]=3 5122 B12R1.440 CSc1cccc(C(=O)O)c1Cl Amb25219870 [1,1,0,0,0,0|0,1,0]=3 5123 B12R1.440 CSc1cccc(C(=O)O)c1F Amb26846146 [1,1,0,0,0,0|0,1,0]=3 5124 B12R1.440 CSc1cccc(C(=O)O)c1I Amb25825363 [1,1,0,0,0,0|0,1,0]=3 5125 B12R1.440 CSc1cccc(C(=O)O)c1N Amb24376192 [1,1,0,0,0,0|0,1,0]=3 5126 B12R1.440 CSc1cccc(C(=O)O)c1O Amb28122851 [1,1,0,0,0,0|0,1,0]=3 5127 B12R1.440 CSc1cccc(C(N)=O)c1N Amb27627769 [1,1,0,0,0,0|1,1,0]=4 5128 B12R1.440 CSc1nccc(C(=O)O)c1Cl Amb27798053 [1,1,0,0,0,0|1,1,0]=4 5129 B12R1.440 Cc1c(C#N)cccc1C(=O)O Amb24432817 [1,1,0,0,0,0|2,0,0]=4 5130 B12R1.440 Cc1c(C=O)cccc1C(=O)O Amb25339306 [1,1,0,0,0,0|2,0,0]=4 5131 B12R1.440 Cc1c(CBr)cccc1C(=O)O Amb32679499 [1,1,0,0,0,0|2,0,0]=4 5132 B12R1.440 Cc1c(CCl)cccc1C(=O)O Amb32679496 [1,1,0,0,0,0|2,0,0]=4 5133 B12R1.440 Cc1c(CN)cccc1C(=O)O Amb25980994 [1,1,0,0,0,0|2,0,0]=4 5134 B12R1.440 Cc1c(CO)cccc1C(=O)O Amb27654094 [1,1,0,0,0,0|2,0,0]=4 5135 B12R1.440 Cc1c(NN)cccc1C(=O)O Amb24102216 [1,1,0,0,0,0|2,0,0]=4 5136 B12R1.440 Cc1c(NN)cccc1C(=O)O Amb33546599 [1,1,0,0,0,0|2,0,0]=4 5137 B12R1.440 Cc1c([N+]#N)cccc1C(=O)O Amb27657846 [1,1,0,0,0,0|2,0,0]=4 5138 B12R1.440 N#Cc1cccc(C(=O)O)c1Br Amb26880738 [1,1,0,0,0,0|2,0,0]=4 5139 B12R1.440 N#Cc1cccc(C(=O)O)c1Cl Amb22406476 [1,1,0,0,0,0|2,0,0]=4 5140 B12R1.440 N#Cc1cccc(C(=O)O)c1F Amb21857822 [1,1,0,0,0,0|2,0,0]=4 5141 B12R1.440 N#Cc1cccc(C(=O)O)c1I Amb22751100 [1,1,0,0,0,0|2,0,0]=4 5142 B12R1.440 N#Cc1cccc(C(=O)O)c1N Amb24565721 [1,1,0,0,0,0|2,0,0]=4 5143 B12R1.440 N#Cc1cccc(C(=O)O)c1O Amb20248956 [1,1,0,0,0,0|2,0,0]=4 5144 B12R1.440 N#Cc1cccc(C(=O)O)c1S Amb24591653 [1,1,0,0,0,0|2,0,0]=4 5145 B12R1.440 NCc1cccc(C(=O)O)c1F Amb27466175 [1,1,0,0,0,0|2,0,0]=4 5146 B12R1.440 NCc1cccc(C(=O)O)c1O Amb27949158 [1,1,0,0,0,0|2,0,0]=4 5147 B12R1.440 NNc1cccc(C(=O)O)c1Br Amb25129021 [1,1,0,0,0,0|2,0,0]=4 5148 B12R1.440 NNc1cccc(C(=O)O)c1F Amb25861950 [1,1,0,0,0,0|2,0,0]=4 5149 B12R1.440 NNc1cccc(C(=O)O)c1F Amb32662906 [1,1,0,0,0,0|2,0,0]=4 5150 B12R1.440 NNc1cccc(C(=O)O)c1N Amb27239122 [1,1,0,0,0,0|2,0,0]=4 5151 B12R1.440 Nc1c(C=O)cccc1C(=O)O Amb8383850 [1,1,0,0,0,0|2,0,0]=4 5152 B12R1.440 O=C(O)c1cccc(CBr)c1Br Amb25771772 [1,1,0,0,0,0|2,0,0]=4 5153 B12R1.440 O=C(O)c1cccc(CBr)c1Cl Amb26057801 [1,1,0,0,0,0|2,0,0]=4 5154 B12R1.440 O=C(O)c1cccc(CBr)c1F Amb22735644 [1,1,0,0,0,0|2,0,0]=4 5155 B12R1.440 O=C(O)c1cccc(CCl)c1Br Amb27238743 [1,1,0,0,0,0|2,0,0]=4 5156 B12R1.440 O=C(O)c1cccc(CF)c1Cl Amb8629146 [1,1,0,0,0,0|2,0,0]=4 5157 B12R1.440 O=C(O)c1cccc(CF)c1F Amb27842233 [1,1,0,0,0,0|2,0,0]=4 5158 B12R1.440 O=C(O)c1cccc(CF)c1O Amb27199771 [1,1,0,0,0,0|2,0,0]=4 5159 B12R1.440 O=C(O)c1cccc(CO)c1Br Amb27247544 [1,1,0,0,0,0|2,0,0]=4 5160 B12R1.440 O=C(O)c1cccc(CO)c1Cl Amb26846170 [1,1,0,0,0,0|2,0,0]=4 5161 B12R1.440 O=C(O)c1cccc(CO)c1F Amb2697883 [1,1,0,0,0,0|2,0,0]=4 5162 B12R1.440 O=C(O)c1cccc(CO)c1O Amb24487324 [1,1,0,0,0,0|2,0,0]=4 5163 B12R1.440 O=C(O)c1cccc(CS)c1F Amb28421952 [1,1,0,0,0,0|2,0,0]=4 5164 B12R1.440 O=Cc1cccc(C(=O)O)c1Br Amb24077427 [1,1,0,0,0,0|2,0,0]=4 5165 B12R1.440 O=Cc1cccc(C(=O)O)c1Cl Amb24398873 [1,1,0,0,0,0|2,0,0]=4 5166 B12R1.440 O=Cc1cccc(C(=O)O)c1F Amb24088819 [1,1,0,0,0,0|2,0,0]=4 5167 B12R1.440 O=Cc1cccc(C(=O)O)c1O Amb33542397 [1,1,0,0,0,0|2,0,0]=4 5168 B12R1.440 O=Cc1cccc(C(=O)O)c1O Amb4238026 [1,1,0,0,0,0|2,0,0]=4 5169 B12R1.453 C#Cc1ccc(C)c(C(=O)O)c1 Amb28422618 [1,1,0,0,0,0|1,0,1]=4 5170 B12R1.453 C#Cc1ccc(F)c(C(=O)O)c1 Amb27169470 [1,1,0,0,0,0|1,0,1]=4 5171 B12R1.453 C#Cc1ccc(N)c(C(=O)O)c1 Amb24118091 [1,1,0,0,0,0|1,0,1]=4 5172 B12R1.453 C#Cc1ccc(N)c(C(=O)O)c1 Amb26841100 [1,1,0,0,0,0|1,0,1]=4 5173 B12R1.453 C#Cc1ccc(O)c(C(=O)O)c1 Amb27883593 [1,1,0,0,0,0|1,0,1]=4 5174 B12R1.453 C=Cc1ccc(C)c(C(=O)O)c1 Amb27624993 [1,1,0,0,0,0|1,0,1]=4 5175 B12R1.453 C=Cc1ccc(O)c(C(=O)O)c1 Amb27258006 [1,1,0,0,0,0|1,0,1]=4 5176 B12R1.453 CCC1=CNC(=O)C(C(=O)O)=C1 Amb18286717 [1,1,0,0,0,0|2,0,0]=4 5177 B12R1.453 CCN1C=CC(=O)C(C(=O)O)=C1 Amb24384856 [1,1,0,0,0,0|2,0,0]=4 5178 B12R1.453 CCc1cc(C(=O)O)c(F)cn1 Amb28122894 [1,1,0,0,0,0|2,0,0]=4 5179 B12R1.453 CCc1ccc(Br)c(C(=O)O)c1 Amb28398103 [1,1,0,0,0,0|1,0,0]=3 5180 B12R1.453 CCc1ccc(Br)c(C(C)=O)c1 Amb27649065 [1,1,0,0,0,0|2,0,0]=4 5181 B12R1.453 CCc1ccc(C)c(C(C)=O)c1 Amb25768433 [1,1,0,0,0,0|2,0,0]=4 5182 B12R1.453 CCc1ccc(C)c(C(O)=S)c1 Amb25177476 [1,1,0,0,0,0|1,1,0]=4 5183 B12R1.453 CCc1ccc(Cl)c(C(=O)O)c1 Amb18649032 [1,1,0,0,0,0|1,0,0]=3 5184 B12R1.453 CCc1ccc(F)c(C(=O)O)c1 Amb27784852 [1,1,0,0,0,0|1,0,0]=3 5185 B12R1.453 CCc1ccc(I)c(C(=O)O)c1 Amb27817278 [1,1,0,0,0,0|1,0,0]=3 5186 B12R1.453 CCc1ccc(I)c(C(C)=O)c1 Amb25238657 [1,1,0,0,0,0|2,0,0]=4 5187 B12R1.453 CCc1ccc(N)c(C(=O)O)c1 Amb1485407 [1,1,0,0,0,0|1,0,0]=3 5188 B12R1.453 CCc1ccc(N)c(C(C)=O)c1 Amb26518794 [1,1,0,0,0,0|2,0,0]=4 5189 B12R1.453 CCc1ccc(O)c(C(=O)O)c1 Amb7807395 [1,1,0,0,0,0|1,0,0]=3 5190 B12R1.453 CCc1ccc(O)c(C(=O)O)n1 Amb28461121 [1,1,0,0,0,0|2,0,0]=4 5191 B12R1.453 CCc1ccc(O)c(C(C)=O)c1 Amb2687865 [1,1,0,0,0,0|2,0,0]=4 5192 B12R1.453 CCc1ccc(S)c(C(=O)O)c1 Amb25343319 [1,1,0,0,0,0|1,0,0]=3 5193 B12R1.453 CNc1cc(C(=O)O)c(Br)cn1 Amb27416750 [1,1,0,0,0,0|2,0,0]=4 5194 B12R1.453 CNc1ccc(Cl)c(C(=O)O)c1 Amb17306523 [1,1,0,0,0,0|1,0,0]=3 5195 B12R1.453 CNc1ccc(Cl)c(C(=O)O)c1 Amb28555737 [1,1,0,0,0,0|1,0,0]=3 5196 B12R1.453 COc1cc(C(=O)O)c(Br)cn1 Amb22234795 [1,1,0,0,0,0|1,0,0]=3 5197 B12R1.453 COc1cc(C(=O)O)c(Cl)cn1 Amb10603092 [1,1,0,0,0,0|1,0,0]=3 5198 B12R1.453 COc1cc(C(=O)O)c(F)cn1 Amb20241189 [1,1,0,0,0,0|1,0,0]=3 5199 B12R1.453 COc1cc(C(=O)O)c(N)cn1 Amb2697482 [1,1,0,0,0,0|1,0,0]=3 5200 B12R1.453 COc1cc(C(C)=O)c(C)cn1 Amb27615525 [1,1,0,0,0,0|2,0,0]=4 5201 B12R1.453 COc1cc(C(C)=O)c(F)cn1 Amb27175769 [1,1,0,0,0,0|2,0,0]=4 5202 B12R1.453 COc1cc(S(=O)O)c(Cl)cn1 Amb32992437 [1,1,0,0,0,0|2,0,0]=4 5203 B12R1.453 COc1cc(S(=O)O)c(F)cn1 Amb32992458 [1,1,0,0,0,0|2,0,0]=4 5204 B12R1.453 COc1cc[n+]([O-])c(C(=O)Cl)c1 Amb28282763 [1,1,0,0,0,0|2,0,0]=4 5205 B12R1.453 COc1cc[n+]([O-])c(C(=O)O)c1 Amb26021620 [1,1,0,0,0,0|1,0,0]=3 5206 B12R1.453 COc1ccc(Br)c(B(O)O)c1 Amb10069018 [1,1,0,0,0,0|1,0,1]=4 5207 B12R1.453 COc1ccc(Br)c(C(=N)N)c1 Amb26605214 [1,1,0,0,0,0|2,0,0]=4 5208 B12R1.453 COc1ccc(Br)c(C(=O)Cl)c1 Amb2725136 [1,1,0,0,0,0|1,0,0]=3 5209 B12R1.453 COc1ccc(Br)c(C(=O)O)c1 Amb1233211 [1,1,0,0,0,0|0,0,0]=2 5210 B12R1.453 COc1ccc(Br)c(C(=O)O)n1 Amb19959840 [1,1,0,0,0,0|1,0,0]=3 5211 B12R1.453 COc1ccc(Br)c(C(C)=O)c1 Amb6296989 [1,1,0,0,0,0|1,0,0]=3 5212 B12R1.453 COc1ccc(Br)c(C(C)=O)n1 Amb26988696 [1,1,0,0,0,0|2,0,0]=4 5213 B12R1.453 COc1ccc(Br)c(C(C)O)c1 Amb24395151 [1,1,0,0,0,0|1,0,1]=4 5214 B12R1.453 COc1ccc(Br)c(C(N)=O)c1 Amb1482238 [1,1,0,0,0,0|1,0,0]=3 5215 B12R1.453 COc1ccc(Br)c(C(N)=S)c1 Amb9677285 [1,1,0,0,0,0|1,1,0]=4 5216 B12R1.453 COc1ccc(Br)c(N(=O)=O)c1 Amb20620541 [1,1,0,0,0,0|1,0,1]=4 5217 B12R1.453 COc1ccc(Br)c(S(=O)[O-])c1 Amb24669837 [1,1,0,0,0,0|1,0,1]=4 5218 B12R1.453 COc1ccc(Br)c([C@@H](C)O)c1 Amb25688949 [1,1,0,0,0,0|1,0,1]=4 5219 B12R1.453 COc1ccc(Br)c([C@H](C)O)c1 Amb26375637 [1,1,0,0,0,0|1,0,1]=4 5220 B12R1.453 COc1ccc(Br)c([N+](=O)[O-])c1 Amb2716277 [1,1,0,0,0,0|1,0,1]=4 5221 B12R1.453 COc1ccc(C)c(B(O)O)c1 Amb20621509 [1,1,0,0,0,0|1,0,1]=4 5222 B12R1.453 COc1ccc(C)c(C(=O)O)c1 Amb8384397 [1,1,0,0,0,0|0,0,0]=2 5223 B12R1.453 COc1ccc(C)c(C(=O)O)n1 Amb27265818 [1,1,0,0,0,0|1,0,0]=3 5224 B12R1.453 COc1ccc(C)c(C(C)=O)c1 Amb17199689 [1,1,0,0,0,0|1,0,0]=3 5225 B12R1.453 COc1ccc(C)c(C(N)=O)c1 Amb25065173 [1,1,0,0,0,0|1,0,0]=3 5226 B12R1.453 COc1ccc(C)c(C(N)=O)n1 Amb27408685 [1,1,0,0,0,0|2,0,0]=4 5227 B12R1.453 COc1ccc(C)c(C(O)=S)c1 Amb25856676 [1,1,0,0,0,0|0,1,0]=3 5228 B12R1.453 COc1ccc(C)c(N(=O)=O)c1 Amb6357433 [1,1,0,0,0,0|1,0,1]=4 5229 B12R1.453 COc1ccc(C)c(S(=O)[O-])c1 Amb32754846 [1,1,0,0,0,0|1,0,1]=4 5230 B12R1.453 COc1ccc(C)c([N+](=O)[O-])c1 Amb2721250 [1,1,0,0,0,0|1,0,1]=4 5231 B12R1.453 COc1ccc(Cl)c(B(O)O)c1 Amb8396836 [1,1,0,0,0,0|1,0,1]=4 5232 B12R1.453 COc1ccc(Cl)c(C(=N)N)c1 Amb24087579 [1,1,0,0,0,0|2,0,0]=4 5233 B12R1.453 COc1ccc(Cl)c(C(=O)O)c1 Amb6888295 [1,1,0,0,0,0|0,0,0]=2 5234 B12R1.453 COc1ccc(Cl)c(C(=O)O)n1 Amb16185790 [1,1,0,0,0,0|1,0,0]=3 5235 B12R1.453 COc1ccc(Cl)c(C(C)=O)n1 Amb27658793 [1,1,0,0,0,0|2,0,0]=4 5236 B12R1.453 COc1ccc(Cl)c(C(C)O)c1 Amb27208203 [1,1,0,0,0,0|1,0,1]=4 5237 B12R1.453 COc1ccc(Cl)c(C(N)=O)c1 Amb28291501 [1,1,0,0,0,0|1,0,0]=3 5238 B12R1.453 COc1ccc(Cl)c(S(=O)[O-])c1 Amb32754177 [1,1,0,0,0,0|1,0,1]=4 5239 B12R1.453 COc1ccc(Cl)c([N+](=O)[O-])c1 Amb6296047 [1,1,0,0,0,0|1,0,1]=4 5240 B12R1.453 COc1ccc(F)c(B(O)O)c1 Amb19889368 [1,1,0,0,0,0|1,0,1]=4 5241 B12R1.453 COc1ccc(F)c(C(=N)N)c1 Amb24556270 [1,1,0,0,0,0|2,0,0]=4 5242 B12R1.453 COc1ccc(F)c(C(=O)Cl)c1 Amb22738943 [1,1,0,0,0,0|1,0,0]=3 5243 B12R1.453 COc1ccc(F)c(C(=O)O)c1 Amb8397078 [1,1,0,0,0,0|0,0,0]=2 5244 B12R1.453 COc1ccc(F)c(C(=O)O)n1 Amb21959537 [1,1,0,0,0,0|1,0,0]=3 5245 B12R1.453 COc1ccc(F)c(C(C)=O)c1 Amb22001731 [1,1,0,0,0,0|1,0,0]=3 5246 B12R1.453 COc1ccc(F)c(C(C)=O)n1 Amb27234120 [1,1,0,0,0,0|2,0,0]=4 5247 B12R1.453 COc1ccc(F)c(C(C)O)c1 Amb27951746 [1,1,0,0,0,0|1,0,1]=4 5248 B12R1.453 COc1ccc(F)c(C(N)=O)c1 Amb22584077 [1,1,0,0,0,0|1,0,0]=3 5249 B12R1.453 COc1ccc(F)c(C(N)=O)n1 Amb26432508 [1,1,0,0,0,0|2,0,0]=4 5250 B12R1.453 COc1ccc(F)c(S(=O)O)n1 Amb32992480 [1,1,0,0,0,0|2,0,0]=4 5251 B12R1.453 COc1ccc(F)c(S(=O)[O-])c1 Amb32755700 [1,1,0,0,0,0|1,0,1]=4 5252 B12R1.453 COc1ccc(F)c([N+](=O)[O-])c1 Amb10603780 [1,1,0,0,0,0|1,0,1]=4 5253 B12R1.453 COc1ccc(I)c(B(O)O)c1 Amb22411447 [1,1,0,0,0,0|1,0,1]=4 5254 B12R1.453 COc1ccc(I)c(C(=O)Cl)c1 Amb27765627 [1,1,0,0,0,0|1,0,0]=3 5255 B12R1.453 COc1ccc(I)c(C(=O)O)c1 Amb6298412 [1,1,0,0,0,0|0,0,0]=2 5256 B12R1.453 COc1ccc(I)c(C(C)=O)c1 Amb26932120 [1,1,0,0,0,0|1,0,0]=3 5257 B12R1.453 COc1ccc(I)c(N(=O)=O)c1 Amb20621471 [1,1,0,0,0,0|1,0,1]=4 5258 B12R1.453 COc1ccc(I)c([N+](=O)[O-])c1 Amb3940641 [1,1,0,0,0,0|1,0,1]=4 5259 B12R1.453 COc1ccc(N)c(C(=O)Cl)c1 Amb26075087 [1,1,0,0,0,0|1,0,0]=3 5260 B12R1.453 COc1ccc(N)c(C(=O)O)c1 Amb31291607 [1,1,0,0,0,0|0,0,0]=2 5261 B12R1.453 COc1ccc(N)c(C(=O)O)c1 Amb6357788 [1,1,0,0,0,0|0,0,0]=2 5262 B12R1.453 COc1ccc(N)c(C(C)=O)c1 Amb18646262 [1,1,0,0,0,0|1,0,0]=3 5263 B12R1.453 COc1ccc(N)c(C(C)O)c1 Amb29875065 [1,1,0,0,0,0|1,0,1]=4 5264 B12R1.453 COc1ccc(N)c(C(N)=O)c1 Amb10240728 [1,1,0,0,0,0|1,0,0]=3 5265 B12R1.453 COc1ccc(N)c(C(N)=O)n1 Amb22284658 [1,1,0,0,0,0|2,0,0]=4 5266 B12R1.453 COc1ccc(N)c(N(=O)=O)c1 Amb5279698 [1,1,0,0,0,0|1,0,1]=4 5267 B12R1.453 COc1ccc(N)c(S(C)=O)c1 Amb27830763 [1,1,0,0,0,0|2,0,0]=4 5268 B12R1.453 COc1ccc(N)c([N+](=O)[O-])c1 Amb1815434 [1,1,0,0,0,0|1,0,1]=4 5269 B12R1.453 COc1ccc(O)c(B(O)O)c1 Amb25751225 [1,1,0,0,0,0|1,0,1]=4 5270 B12R1.453 COc1ccc(O)c(C(=N)N)c1 Amb28042938 [1,1,0,0,0,0|2,0,0]=4 5271 B12R1.453 COc1ccc(O)c(C(=O)Cl)c1 Amb19070644 [1,1,0,0,0,0|1,0,0]=3 5272 B12R1.453 COc1ccc(O)c(C(=O)O)c1 Amb3940318 [1,1,0,0,0,0|0,0,0]=2 5273 B12R1.453 COc1ccc(O)c(C(=O)O)n1 Amb27781066 [1,1,0,0,0,0|1,0,0]=3 5274 B12R1.453 COc1ccc(O)c(C(=O)S)c1 Amb28054391 [1,1,0,0,0,0|0,1,0]=3 5275 B12R1.453 COc1ccc(O)c(C(C)=O)c1 Amb844170 [1,1,0,0,0,0|1,0,0]=3 5276 B12R1.453 COc1ccc(O)c(C(C)O)c1 Amb1111456 [1,1,0,0,0,0|1,0,1]=4 5277 B12R1.453 COc1ccc(O)c(C(N)=O)c1 Amb8998949 [1,1,0,0,0,0|1,0,0]=3 5278 B12R1.453 COc1ccc(O)c(C(N)=S)c1 Amb28130970 [1,1,0,0,0,0|1,1,0]=4 5279 B12R1.453 COc1ccc(O)c(N(=O)=O)c1 Amb6357110 [1,1,0,0,0,0|1,0,1]=4 5280 B12R1.453 COc1ccc(O)c(S(=O)[O-])c1 Amb32754384 [1,1,0,0,0,0|1,0,1]=4 5281 B12R1.453 COc1ccc(O)c([C@@H](C)O)c1 Amb26992494 [1,1,0,0,0,0|1,0,1]=4 5282 B12R1.453 COc1ccc(O)c([C@H](C)O)c1 Amb32876026 [1,1,0,0,0,0|1,0,1]=4 5283 B12R1.453 COc1ccc(O)c([N+](=O)[O-])c1 Amb2721221 [1,1,0,0,0,0|1,0,1]=4 5284 B12R1.453 COc1ccc(S)c(C(=O)O)c1 Amb17616845 [1,1,0,0,0,0|0,0,0]=2 5285 B12R1.453 COc1ccc(S)c([N+](=O)[O-])c1 Amb27436557 [1,1,0,0,0,0|1,0,1]=4 5286 B12R1.453 COc1cnc(Br)c(C(=O)O)c1 Amb27401048 [1,1,0,0,0,0|1,0,0]=3 5287 B12R1.453 COc1cnc(C)c(C(=O)O)c1 Amb23400408 [1,1,0,0,0,0|1,0,0]=3 5288 B12R1.453 COc1cnc(C)c(C(C)=O)c1 Amb23400415 [1,1,0,0,0,0|2,0,0]=4 5289 B12R1.453 COc1cnc(C)c(C(N)=O)c1 Amb23400407 [1,1,0,0,0,0|2,0,0]=4 5290 B12R1.453 COc1cnc(Cl)c(C(=O)Cl)c1 Amb28046776 [1,1,0,0,0,0|2,0,0]=4 5291 B12R1.453 COc1cnc(Cl)c(C(=O)O)c1 Amb18649692 [1,1,0,0,0,0|1,0,0]=3 5292 B12R1.453 COc1cnc(Cl)c(C(=O)O)n1 Amb27490884 [1,1,0,0,0,0|2,0,0]=4 5293 B12R1.453 COc1cnc(F)c(C(=O)O)c1 Amb24183662 [1,1,0,0,0,0|1,0,0]=3 5294 B12R1.453 COc1cnc(F)c(C(C)=O)c1 Amb27860180 [1,1,0,0,0,0|2,0,0]=4 5295 B12R1.453 COc1cnc(N)c(C(=O)O)n1 Amb25148557 [1,1,0,0,0,0|2,0,0]=4 5296 B12R1.453 COc1cnc(O)c(C(=O)O)c1 Amb24627424 [1,1,0,0,0,0|1,0,0]=3 5297 B12R1.453 COc1cnc(O)c(C(C)=O)c1 Amb28252904 [1,1,0,0,0,0|2,0,0]=4 5298 B12R1.453 COc1ncc(Cl)c(C(=O)O)n1 Amb2607274 [1,1,0,0,0,0|2,0,0]=4 5299 B12R1.453 CSc1cc[n+](C)c(C(=O)O)c1 Amb8439455 [1,1,0,0,0,0|1,1,0]=4 5300 B12R1.453 CSc1ccc(C)c(C(=O)O)c1 Amb2372749 [1,1,0,0,0,0|0,1,0]=3 5301 B12R1.453 CSc1ccc(C)c(C(N)=O)c1 Amb8998984 [1,1,0,0,0,0|1,1,0]=4 5302 B12R1.453 CSc1ccc(Cl)c(C(=O)Cl)c1 Amb22264376 [1,1,0,0,0,0|1,1,0]=4 5303 B12R1.453 CSc1ccc(Cl)c(C(=O)O)c1 Amb264321 [1,1,0,0,0,0|0,1,0]=3 5304 B12R1.453 CSc1ccc(Cl)c(C(=O)O)n1 Amb18281637 [1,1,0,0,0,0|1,1,0]=4 5305 B12R1.453 CSc1ccc(Cl)c(C(C)=O)c1 Amb27639692 [1,1,0,0,0,0|1,1,0]=4 5306 B12R1.453 CSc1ccc(Cl)c(C(N)=O)c1 Amb36169 [1,1,0,0,0,0|1,1,0]=4 5307 B12R1.453 CSc1ccc(F)c(C(=O)O)c1 Amb20621304 [1,1,0,0,0,0|0,1,0]=3 5308 B12R1.453 CSc1ccc(I)c(C(=O)O)c1 Amb28367730 [1,1,0,0,0,0|0,1,0]=3 5309 B12R1.453 CSc1ccc(N)c(C(=O)O)c1 Amb18281649 [1,1,0,0,0,0|0,1,0]=3 5310 B12R1.453 CSc1ccc(N)c(C(C)=O)c1 Amb25120177 [1,1,0,0,0,0|1,1,0]=4 5311 B12R1.453 CSc1ccc(N)c(C(N)=O)c1 Amb18953005 [1,1,0,0,0,0|1,1,0]=4 5312 B12R1.453 CSc1ccc(O)c(C(=O)O)c1 Amb6360405 [1,1,0,0,0,0|0,1,0]=3 5313 B12R1.453 Cc1ccc(C#N)cc1C(=O)O Amb33547653 [1,1,0,0,0,0|2,0,0]=4 5314 B12R1.453 Cc1ccc(C=O)cc1C(=O)O Amb22899064 [1,1,0,0,0,0|2,0,0]=4 5315 B12R1.453 Cc1ccc(CBr)cc1C(=O)O Amb24493595 [1,1,0,0,0,0|2,0,0]=4 5316 B12R1.453 Cc1ccc(CO)cc1C(=O)O Amb27955230 [1,1,0,0,0,0|2,0,0]=4 5317 B12R1.453 Cc1ccc(NN)cc1C(=O)O Amb27776549 [1,1,0,0,0,0|2,0,0]=4 5318 B12R1.453 Cc1ccc(NO)cc1C(=O)O Amb27407096 [1,1,0,0,0,0|2,0,0]=4 5319 B12R1.453 N#Cc1ccc(Br)c(C(=O)O)c1 Amb19892465 [1,1,0,0,0,0|2,0,0]=4 5320 B12R1.453 N#Cc1ccc(Cl)c(C(=O)O)c1 Amb33544082 [1,1,0,0,0,0|2,0,0]=4 5321 B12R1.453 N#Cc1ccc(F)c(C(=O)O)c1 Amb10606409 [1,1,0,0,0,0|2,0,0]=4 5322 B12R1.453 N#Cc1ccc(I)c(C(=O)O)c1 Amb21857849 [1,1,0,0,0,0|2,0,0]=4 5323 B12R1.453 N#Cc1ccc(N)c(C(=O)O)c1 Amb21857693 [1,1,0,0,0,0|2,0,0]=4 5324 B12R1.453 N#Cc1ccc(O)c(C(=O)O)c1 Amb18645753 [1,1,0,0,0,0|2,0,0]=4 5325 B12R1.453 N#Cc1ccc(S)c(C(=O)O)c1 Amb27494725 [1,1,0,0,0,0|2,0,0]=4 5326 B12R1.453 N#[N+]c1ccc(Cl)c(C(=O)O)c1 Amb28388665 [1,1,0,0,0,0|2,0,0]=4 5327 B12R1.453 NCc1ccc(Cl)c(C(=O)O)c1 Amb24639987 [1,1,0,0,0,0|2,0,0]=4 5328 B12R1.453 NCc1ccc(Cl)c(C(=O)O)c1 Amb33801474 [1,1,0,0,0,0|2,0,0]=4 5329 B12R1.453 NCc1ccc(F)c(C(=O)O)c1 Amb27753859 [1,1,0,0,0,0|2,0,0]=4 5330 B12R1.453 NNc1ccc(Br)c(C(=O)O)c1 Amb25132718 [1,1,0,0,0,0|2,0,0]=4 5331 B12R1.453 NNc1ccc(Cl)c(C(=O)O)c1 Amb1104437 [1,1,0,0,0,0|2,0,0]=4 5332 B12R1.453 NNc1ccc(Cl)c(C(=O)O)c1 Amb2031915 [1,1,0,0,0,0|2,0,0]=4 5333 B12R1.453 NNc1ccc(F)c(C(=O)O)c1 Amb24627235 [1,1,0,0,0,0|2,0,0]=4 5334 B12R1.453 NNc1ccc(F)c(C(=O)O)c1 Amb32662791 [1,1,0,0,0,0|2,0,0]=4 5335 B12R1.453 NNc1ccc(F)c(C(=O)O)c1 Amb32662809 [1,1,0,0,0,0|2,0,0]=4 5336 B12R1.453 NNc1ccc(S)c(C(=O)O)c1 Amb28134394 [1,1,0,0,0,0|2,0,0]=4 5337 B12R1.453 Nc1ccc(C=O)cc1C(=O)O Amb27210210 [1,1,0,0,0,0|2,0,0]=4 5338 B12R1.453 O=C(O)c1cc(CBr)ccc1Br Amb27203924 [1,1,0,0,0,0|2,0,0]=4 5339 B12R1.453 O=C(O)c1cc(CBr)ccc1Cl Amb26504357 [1,1,0,0,0,0|2,0,0]=4 5340 B12R1.453 O=C(O)c1cc(CBr)ccc1F Amb22735646 [1,1,0,0,0,0|2,0,0]=4 5341 B12R1.453 O=C(O)c1cc(CF)ccc1O Amb27624623 [1,1,0,0,0,0|2,0,0]=4 5342 B12R1.453 O=C(O)c1cc(CO)ccc1Br Amb27411734 [1,1,0,0,0,0|2,0,0]=4 5343 B12R1.453 O=C(O)c1cc(CO)ccc1F Amb2697882 [1,1,0,0,0,0|2,0,0]=4 5344 B12R1.453 O=C(O)c1cc(CS)ccc1Br Amb26477911 [1,1,0,0,0,0|2,0,0]=4 5345 B12R1.453 O=Cc1ccc(Br)c(C(=O)O)c1 Amb24077428 [1,1,0,0,0,0|2,0,0]=4 5346 B12R1.453 O=Cc1ccc(Cl)c(C(=O)O)c1 Amb24532571 [1,1,0,0,0,0|2,0,0]=4 5347 B12R1.453 O=Cc1ccc(F)c(C(=O)O)c1 Amb2725038 [1,1,0,0,0,0|2,0,0]=4 5348 B12R1.453 O=Cc1ccc(O)c(C(=O)O)c1 Amb1486640 [1,1,0,0,0,0|2,0,0]=4 5349 B12R1.453 O=Cc1ccc(S)c(C(=O)O)c1 Amb32688035 [1,1,0,0,0,0|2,0,0]=4 5350 B12R1.453 O=Nc1ccc(O)c(C(=O)O)c1 Amb17594156 [1,1,0,0,0,0|2,0,0]=4 5351 B12R1.1960 COC1=CC(C)(C(=O)O)C=CC1 Amb27233459 [1,1,0,0,0,0|0,0,2]=4 5352 B12R1.78 C#Cc1ccc(C=O)nc1OC Amb27951627 [1,1,0,0,0,0|2,0,0]=4 5353 B12R1.78 C#Cc1ccc(OC)c(OC)c1 Amb8390522 [1,1,0,0,0,0|1,0,1]=4 5354 B12R1.78 C#Cc1cnc(C=O)cc1OC Amb25990596 [1,1,0,0,0,0|2,0,0]=4 5355 B12R1.78 C=Cc1cc(C=O)ccc1OC Amb32682039 [1,1,0,0,0,0|1,0,1]=4 5356 B12R1.78 C=Cc1ccc(C=O)nc1OC Amb27770669 [1,1,0,0,0,0|2,0,0]=4 5357 B12R1.78 C=Cc1ccc(OC)c(OC)c1 Amb17613145 [1,1,0,0,0,0|1,0,0]=3 5358 B12R1.78 C=Cc1cnc(C=O)cc1OC Amb25329652 [1,1,0,0,0,0|2,0,0]=4 5359 B12R1.78 C=Cc1cnc(CO)c(OC)c1 Amb27198449 [1,1,0,0,0,0|2,0,0]=4 5360 B12R1.78 C=Cc1cnc(OC)c(OC)c1 Amb26374699 [1,1,0,0,0,0|2,0,0]=4 5361 B12R1.78 CCc1cc(C=O)ccc1C#N Amb24084026 [1,1,0,0,0,0|2,0,0]=4 5362 B12R1.78 CCc1cc(C=O)ccc1NN Amb24651365 [1,1,0,0,0,0|2,0,0]=4 5363 B12R1.78 CCc1cc(C=O)ccc1OC Amb10807959 [1,1,0,0,0,0|1,0,0]=3 5364 B12R1.78 CCc1cc(CO)ccc1OC Amb18862664 [1,1,0,0,0,0|1,0,1]=4 5365 B12R1.78 CCc1ccc(OC)c(OC)c1 Amb20242487 [1,1,0,0,0,0|1,0,1]=4 5366 B12R1.78 CCc1cnc(C=O)cc1OC Amb27803865 [1,1,0,0,0,0|2,0,0]=4 5367 B12R1.78 CNc1ccc(C=O)cc1OC Amb27813329 [1,1,0,0,0,0|1,0,0]=3 5368 B12R1.78 CNc1ccc(N=O)cc1OC Amb27392087 [1,1,0,0,0,0|2,0,0]=4 5369 B12R1.78 CNc1ccc(OC)c(OC)c1 Amb10610446 [1,1,0,0,0,0|2,0,0]=4 5370 B12R1.78 CNc1ccc(OC)c(OC)c1 Amb6710041 [1,1,0,0,0,0|2,0,0]=4 5371 B12R1.78 COc1cc(C#N)ccc1CO Amb25079658 [1,1,0,0,0,0|1,0,1]=4 5372 B12R1.78 COc1cc(C=O)ccc1C#N Amb22490052 [1,1,0,0,0,0|1,0,0]=3 5373 B12R1.78 COc1cc(C=O)ccc1NN Amb26621061 [1,1,0,0,0,0|1,0,0]=3 5374 B12R1.78 COc1cc(C=O)ccc1SC Amb13951518 [1,1,0,0,0,0|0,1,0]=3 5375 B12R1.78 COc1cc(C=O)cnc1OC Amb8426323 [1,1,0,0,0,0|1,0,0]=3 5376 B12R1.78 COc1cc(CO)ccc1C#N Amb27483166 [1,1,0,0,0,0|1,0,1]=4 5377 B12R1.78 COc1cc(CO)ccc1C=O Amb27958851 [1,1,0,0,0,0|0,0,2]=4 5378 B12R1.78 COc1cc(CO)ccc1CN Amb28136064 [1,1,0,0,0,0|1,0,1]=4 5379 B12R1.78 COc1cc(CO)ccc1NN Amb25943446 [1,1,0,0,0,0|1,0,1]=4 5380 B12R1.78 COc1cc(CO)ccc1SC Amb25194639 [1,1,0,0,0,0|0,1,1]=4 5381 B12R1.78 COc1cc(CO)cnc1OC Amb13889771 [1,1,0,0,0,0|1,0,1]=4 5382 B12R1.78 COc1cc(NN)ccc1CO Amb27793931 [1,1,0,0,0,0|2,0,0]=4 5383 B12R1.78 COc1cc(SC)ccc1CO Amb28137767 [1,1,0,0,0,0|2,0,0]=4 5384 B12R1.78 COc1ccc(C#N)cc1OC Amb6355881 [1,1,0,0,0,0|1,0,1]=4 5385 B12R1.78 COc1ccc(C=O)cc1C#N Amb19375054 [1,1,0,0,0,0|2,0,0]=4 5386 B12R1.78 COc1ccc(C=O)cc1C=O Amb2781469 [1,1,0,0,0,0|2,0,0]=4 5387 B12R1.78 COc1ccc(C=O)cc1CCl Amb6335565 [1,1,0,0,0,0|2,0,0]=4 5388 B12R1.78 COc1ccc(C=O)cc1CN Amb17666426 [1,1,0,0,0,0|2,0,0]=4 5389 B12R1.78 COc1ccc(C=O)cc1CO Amb534039 [1,1,0,0,0,0|2,0,0]=4 5390 B12R1.78 COc1ccc(C=O)cc1NN Amb26569353 [1,1,0,0,0,0|2,0,0]=4 5391 B12R1.78 COc1ccc(C=O)cc1OC Amb1873766 [1,1,0,0,0,0|0,0,0]=2 5392 B12R1.78 COc1ccc(C=O)cc1SC Amb19515075 [1,1,0,0,0,0|0,1,0]=3 5393 B12R1.78 COc1ccc(CBr)cc1OC Amb8395256 [1,1,0,0,0,0|1,0,1]=4 5394 B12R1.78 COc1ccc(CCl)cc1OC Amb6717224 [1,1,0,0,0,0|1,0,1]=4 5395 B12R1.78 COc1ccc(CN)cc1OC Amb1215005 [1,1,0,0,0,0|1,0,1]=4 5396 B12R1.78 COc1ccc(CN)cc1OC Amb2222274 [1,1,0,0,0,0|1,0,1]=4 5397 B12R1.78 COc1ccc(CO)c(OC)c1 Amb837424 [1,1,0,0,0,0|2,0,0]=4 5398 B12R1.78 COc1ccc(CO)cc1OC Amb3939320 [1,1,0,0,0,0|0,0,1]=3 5399 B12R1.78 COc1ccc(CO)cc1SC Amb27749052 [1,1,0,0,0,0|0,1,1]=4 5400 B12R1.78 COc1ccc(CO)nc1OC Amb8426326 [1,1,0,0,0,0|1,0,1]=4 5401 B12R1.78 COc1ccc(CS)cc1OC Amb17401033 [1,1,0,0,0,0|0,1,1]=4 5402 B12R1.78 COc1ccc(C[Zn+])cc1OC Amb22349187 [1,1,0,0,0,0|1,0,1]=4 5403 B12R1.78 COc1ccc(NN)cc1OC Amb10070256 [1,1,0,0,0,0|2,0,0]=4 5404 B12R1.78 COc1ccc(NN)cc1OC Amb17138629 [1,1,0,0,0,0|2,0,0]=4 5405 B12R1.78 COc1ccc(OC)c(OC)c1 Amb6357331 [1,1,0,0,0,0|2,0,0]=4 5406 B12R1.78 COc1ccc(SC)cc1OC Amb2687432 [1,1,0,0,0,0|2,0,0]=4 5407 B12R1.78 COc1ccc([Mg]Br)cc1OC Amb6300360 [1,1,0,0,0,0|2,0,0]=4 5408 B12R1.78 COc1cnc(C=O)cc1OC Amb18827380 [1,1,0,0,0,0|1,0,0]=3 5409 B12R1.78 COc1cnc(CO)cc1OC Amb22756212 [1,1,0,0,0,0|1,0,1]=4 5410 B12R1.78 COc1ncc(C=O)nc1OC Amb27799767 [1,1,0,0,0,0|2,0,0]=4 5411 B12R1.78 CSc1cc(C=O)ccc1NN Amb28323443 [1,1,0,0,0,0|1,1,0]=4 5412 B12R1.78 [C-]#[N+]c1ccc(OC)c(OC)c1 Amb2687398 [1,1,0,0,0,0|2,0,0]=4 5413 B12R1.270 C#Cc1ccc(O)c(OCC)c1 Amb27149603 [1,1,0,0,0,0|1,0,1]=4 5414 B12R1.270 C=CCc1cc(C=O)ccc1O Amb2496484 [1,1,0,0,0,0|1,0,1]=4 5415 B12R1.270 C=Cc1ccc(O)c(OCC)c1 Amb33376113 [1,1,0,0,0,0|1,0,0]=3 5416 B12R1.270 CCCc1cc(C=O)ccc1O Amb27403523 [1,1,0,0,0,0|1,0,0]=3 5417 B12R1.270 CCOc1cc(C#N)ccc1O Amb1657776 [1,1,0,0,0,0|1,0,1]=4 5418 B12R1.270 CCOc1cc(C=O)ccc1Br Amb22500717 [1,1,0,0,0,0|1,0,0]=3 5419 B12R1.270 CCOc1cc(C=O)ccc1C Amb22500724 [1,1,0,0,0,0|1,0,0]=3 5420 B12R1.270 CCOc1cc(C=O)ccc1F Amb10066935 [1,1,0,0,0,0|1,0,0]=3 5421 B12R1.270 CCOc1cc(C=O)ccc1O Amb837240 [1,1,0,0,0,0|0,0,0]=2 5422 B12R1.270 CCOc1cc(C=O)ccc1S Amb32688027 [1,1,0,0,0,0|0,1,0]=3 5423 B12R1.270 CCOc1cc(CBr)ccc1O Amb33386402 [1,1,0,0,0,0|1,0,1]=4 5424 B12R1.270 CCOc1cc(CCl)ccc1O Amb17477719 [1,1,0,0,0,0|1,0,1]=4 5425 B12R1.270 CCOc1cc(CN)ccc1O Amb1117009 [1,1,0,0,0,0|1,0,1]=4 5426 B12R1.270 CCOc1cc(CN)ccc1O Amb19260515 [1,1,0,0,0,0|1,0,1]=4 5427 B12R1.270 CCOc1cc(CO)ccc1Cl Amb25868761 [1,1,0,0,0,0|1,0,1]=4 5428 B12R1.270 CCOc1cc(CO)ccc1F Amb27267479 [1,1,0,0,0,0|1,0,1]=4 5429 B12R1.270 CCOc1cc(CO)ccc1O Amb2687724 [1,1,0,0,0,0|0,0,1]=3 5430 B12R1.270 CCOc1cc(CS)ccc1O Amb32788795 [1,1,0,0,0,0|0,1,1]=4 5431 B12R1.270 CCOc1cc(NN)ccc1O Amb25921861 [1,1,0,0,0,0|2,0,0]=4 5432 B12R1.270 CCOc1nc(C=O)ccc1C Amb22755012 [1,1,0,0,0,0|2,0,0]=4 5433 B12R1.270 COCC1=C\C(=N/O)C=CC1=O Amb28253656 [1,1,0,0,0,0|1,0,1]=4 5434 B12R1.270 O=CNc1cc(C=O)ccc1O Amb28397239 [1,1,0,0,0,0|1,0,1]=4 5435 B12R1.270 O=Cc1ccc(O)c(CCF)c1 Amb27256343 [1,1,0,0,0,0|1,0,0]=3 5436 B12R1.286 C#CCc1ccc(O)c(OC)c1 Amb33429356 [1,1,0,0,0,0|1,0,1]=4 5437 B12R1.286 C=CCc1ccc(Cl)c(OC)c1 Amb25751292 [1,1,0,0,0,0|2,0,0]=4 5438 B12R1.286 C=CCc1ccc(F)c(OC)c1 Amb24341763 [1,1,0,0,0,0|2,0,0]=4 5439 B12R1.286 C=CCc1ccc(O)c(OC)c1 Amb1211895 [1,1,0,0,0,0|1,0,0]=3 5440 B12R1.286 C=C\C=C1/C=CC(=O)C(OC)=C1 Amb27409498 [1,1,0,0,0,0|1,0,1]=4 5441 B12R1.286 C=C\C=C1\C=CC(=O)C(OC)=C1 Amb28246518 [1,1,0,0,0,0|1,0,1]=4 5442 B12R1.286 CCCc1ccc(O)c(OC)c1 Amb533282 [1,1,0,0,0,0|1,0,1]=4 5443 B12R1.286 CCSc1ccc(O)c(OC)c1 Amb27841853 [1,1,0,0,0,0|1,0,1]=4 5444 B12R1.286 CC\C=C1\C=CC(=O)C(OC)=C1 Amb28054407 [1,1,0,0,0,0|1,0,1]=4 5445 B12R1.286 CCc1cc(NC=O)ccc1C Amb28349702 [1,1,0,0,0,0|2,0,0]=4 5446 B12R1.286 CCc1cc(NC=O)ccc1F Amb29859470 [1,1,0,0,0,0|2,0,0]=4 5447 B12R1.286 CNCc1ccc(O)c(OC)c1 Amb1115180 [1,1,0,0,0,0|1,0,1]=4 5448 B12R1.286 CNCc1ccc(O)c(OC)c1 Amb6892323 [1,1,0,0,0,0|1,0,1]=4 5449 B12R1.286 COC1=C\C(=C\NO)C=CC1=O Amb33513057 [1,1,0,0,0,0|0,0,1]=3 5450 B12R1.286 COCc1ccc(O)c(OC)c1 Amb18646892 [1,1,0,0,0,0|0,0,1]=3 5451 B12R1.286 CO\N=C1/C=CC(=O)C(OC)=C1 Amb27802533 [1,1,0,0,0,0|1,0,1]=4 5452 B12R1.286 COc1cc(CC#N)ccc1O Amb2688760 [1,1,0,0,0,0|1,0,1]=4 5453 B12R1.286 COc1cc(CC=O)ccc1Br Amb33331780 [1,1,0,0,0,0|1,0,0]=3 5454 B12R1.286 COc1cc(CC=O)ccc1C Amb26883318 [1,1,0,0,0,0|1,0,0]=3 5455 B12R1.286 COc1cc(CC=O)ccc1Cl Amb27167085 [1,1,0,0,0,0|1,0,0]=3 5456 B12R1.286 COc1cc(CC=O)ccc1F Amb26588916 [1,1,0,0,0,0|1,0,0]=3 5457 B12R1.286 COc1cc(CC=O)ccc1O Amb13883641 [1,1,0,0,0,0|0,0,0]=2 5458 B12R1.286 COc1cc(CCBr)ccc1O Amb26375645 [1,1,0,0,0,0|1,0,1]=4 5459 B12R1.286 COc1cc(CCN)ccc1O Amb2688756 [1,1,0,0,0,0|1,0,1]=4 5460 B12R1.286 COc1cc(CCN)ccc1O Amb2720234 [1,1,0,0,0,0|1,0,1]=4 5461 B12R1.286 COc1cc(CCO)ccc1Br Amb25280180 [1,1,0,0,0,0|1,0,1]=4 5462 B12R1.286 COc1cc(CCO)ccc1C Amb33419935 [1,1,0,0,0,0|1,0,1]=4 5463 B12R1.286 COc1cc(CCO)ccc1Cl Amb26372084 [1,1,0,0,0,0|1,0,1]=4 5464 B12R1.286 COc1cc(CCO)ccc1F Amb24713679 [1,1,0,0,0,0|1,0,1]=4 5465 B12R1.286 COc1cc(CCO)ccc1N Amb25093156 [1,1,0,0,0,0|1,0,1]=4 5466 B12R1.286 COc1cc(CCO)ccc1N Amb33532830 [1,1,0,0,0,0|1,0,1]=4 5467 B12R1.286 COc1cc(CCO)ccc1O Amb2099567 [1,1,0,0,0,0|0,0,1]=3 5468 B12R1.286 COc1cc(CCS)ccc1O Amb28199859 [1,1,0,0,0,0|0,1,1]=4 5469 B12R1.286 COc1cc(CNN)ccc1O Amb27975237 [1,1,0,0,0,0|1,0,1]=4 5470 B12R1.286 COc1cc(CNO)ccc1Br Amb33337076 [1,1,0,0,0,0|1,0,1]=4 5471 B12R1.286 COc1cc(CNO)ccc1C Amb33427089 [1,1,0,0,0,0|1,0,1]=4 5472 B12R1.286 COc1cc(CNO)ccc1Cl Amb33261929 [1,1,0,0,0,0|1,0,1]=4 5473 B12R1.286 COc1cc(CNO)ccc1F Amb33313685 [1,1,0,0,0,0|1,0,1]=4 5474 B12R1.286 COc1cc(CNO)ccc1O Amb27836799 [1,1,0,0,0,0|0,0,1]=3 5475 B12R1.286 COc1cc(CON)ccc1Br Amb24368625 [1,1,0,0,0,0|1,0,1]=4 5476 B12R1.286 COc1cc(CON)ccc1C Amb24368624 [1,1,0,0,0,0|1,0,1]=4 5477 B12R1.286 COc1cc(CON)ccc1Cl Amb28320929 [1,1,0,0,0,0|1,0,1]=4 5478 B12R1.286 COc1cc(CON)ccc1F Amb26518863 [1,1,0,0,0,0|1,0,1]=4 5479 B12R1.286 COc1cc(CON)ccc1O Amb33429370 [1,1,0,0,0,0|0,0,1]=3 5480 B12R1.286 COc1cc(N=C=O)ccc1Br Amb26017210 [1,1,0,0,0,0|1,0,1]=4 5481 B12R1.286 COc1cc(N=C=O)ccc1C Amb2371929 [1,1,0,0,0,0|1,0,1]=4 5482 B12R1.286 COc1cc(N=C=O)ccc1Cl Amb27250674 [1,1,0,0,0,0|1,0,1]=4 5483 B12R1.286 COc1cc(N=C=O)ccc1F Amb25331734 [1,1,0,0,0,0|1,0,1]=4 5484 B12R1.286 COc1cc(N=C=O)ccc1N Amb28399433 [1,1,0,0,0,0|1,0,1]=4 5485 B12R1.286 COc1cc(NC=O)ccc1Br Amb27234972 [1,1,0,0,0,0|1,0,0]=3 5486 B12R1.286 COc1cc(NC=O)ccc1C Amb35690502 [1,1,0,0,0,0|1,0,0]=3 5487 B12R1.286 COc1cc(OC=O)ccc1O Amb18646844 [1,1,0,0,0,0|0,0,0]=2 5488 B12R1.286 COc1cc(SC#N)ccc1O Amb2196497 [1,1,0,0,0,0|1,0,1]=4 5489 B12R1.286 COc1cc(\C=C\Br)ccc1C Amb33135088 [1,1,0,0,0,0|2,0,0]=4 5490 B12R1.286 COc1cc(\C=C\Br)ccc1O Amb33134810 [1,1,0,0,0,0|1,0,0]=3 5491 B12R1.286 COc1cc(\C=C\Br)ccc1S Amb33135134 [1,1,0,0,0,0|1,1,0]=4 5492 B12R1.286 COc1cc(\C=N\N)ccc1C Amb27764623 [1,1,0,0,0,0|2,0,0]=4 5493 B12R1.286 COc1cc(\C=N\N)ccc1O Amb3096551 [1,1,0,0,0,0|1,0,0]=3 5494 B12R1.286 COc1cc(\C=N\O)ccc1F Amb10840855 [1,1,0,0,0,0|1,0,0]=3 5495 B12R1.286 COc1cc(\C=N\O)ccc1O Amb3988050 [1,1,0,0,0,0|0,0,0]=2 5496 B12R1.286 C\C=C\c1ccc(O)c(OC)c1 Amb6608888 [1,1,0,0,0,0|1,0,0]=3 5497 B12R1.300 C#Cc1cc(Br)c(O)c(OC)c1 Amb27397304 [1,1,0,0,0,0|1,0,1]=4 5498 B12R1.300 C#Cc1cc(O)c(O)c(OC)c1 Amb33372193 [1,1,0,0,0,0|1,0,1]=4 5499 B12R1.300 C=Cc1cc(Br)c(O)c(OC)c1 Amb33336177 [1,1,0,0,0,0|1,0,0]=3 5500 B12R1.300 C=Cc1cc(O)c(O)c(OC)c1 Amb25667446 [1,1,0,0,0,0|1,0,0]=3 5501 B12R1.300 CCc1cc(Br)c(O)c(OC)c1 Amb25069463 [1,1,0,0,0,0|1,0,1]=4 5502 B12R1.300 CCc1cc(C)c(O)c(OC)c1 Amb22752216 [1,1,0,0,0,0|1,0,1]=4 5503 B12R1.300 CCc1cc(C=O)cc(C)c1O Amb28251170 [1,1,0,0,0,0|1,0,0]=3 5504 B12R1.300 CCc1cc(I)c(O)c(OC)c1 Amb26362909 [1,1,0,0,0,0|1,0,1]=4 5505 B12R1.300 CCc1cc(O)c(O)c(OC)c1 Amb25981146 [1,1,0,0,0,0|1,0,1]=4 5506 B12R1.300 COc1cc(Br)c(O)c(OC)c1 Amb33008684 [1,1,0,0,0,0|2,0,0]=4 5507 B12R1.300 COc1cc(C#N)cc(Br)c1O Amb2519387 [1,1,0,0,0,0|1,0,1]=4 5508 B12R1.300 COc1cc(C#N)cc(C)c1O Amb26843143 [1,1,0,0,0,0|1,0,1]=4 5509 B12R1.300 COc1cc(C#N)cc(Cl)c1O Amb1154259 [1,1,0,0,0,0|1,0,1]=4 5510 B12R1.300 COc1cc(C#N)cc(F)c1O Amb27830666 [1,1,0,0,0,0|1,0,1]=4 5511 B12R1.300 COc1cc(C#N)cc(I)c1O Amb6888418 [1,1,0,0,0,0|1,0,1]=4 5512 B12R1.300 COc1cc(C#N)cc(N)c1O Amb20243468 [1,1,0,0,0,0|1,0,1]=4 5513 B12R1.300 COc1cc(C#N)cc(N)c1O Amb24117557 [1,1,0,0,0,0|1,0,1]=4 5514 B12R1.300 COc1cc(C#N)cc(O)c1O Amb33804260 [1,1,0,0,0,0|1,0,1]=4 5515 B12R1.300 COc1cc(C)c(O)c(OC)c1 Amb18126503 [1,1,0,0,0,0|2,0,0]=4 5516 B12R1.300 COc1cc(C=O)cc(Br)c1O Amb1395836 [1,1,0,0,0,0|0,0,0]=2 5517 B12R1.300 COc1cc(C=O)cc(Br)c1S Amb32688026 [1,1,0,0,0,0|0,1,0]=3 5518 B12R1.300 COc1cc(C=O)cc(C)c1F Amb33998133 [1,1,0,0,0,0|1,0,0]=3 5519 B12R1.300 COc1cc(C=O)cc(C)c1O Amb2408165 [1,1,0,0,0,0|0,0,0]=2 5520 B12R1.300 COc1cc(C=O)cc(Cl)c1O Amb1033070 [1,1,0,0,0,0|0,0,0]=2 5521 B12R1.300 COc1cc(C=O)cc(F)c1F Amb8385497 [1,1,0,0,0,0|1,0,0]=3 5522 B12R1.300 COc1cc(C=O)cc(F)c1O Amb6297568 [1,1,0,0,0,0|0,0,0]=2 5523 B12R1.300 COc1cc(C=O)cc(I)c1I Amb28428663 [1,1,0,0,0,0|1,0,0]=3 5524 B12R1.300 COc1cc(C=O)cc(I)c1O Amb6335581 [1,1,0,0,0,0|0,0,0]=2 5525 B12R1.300 COc1cc(C=O)cc(N)c1O Amb17208090 [1,1,0,0,0,0|0,0,0]=2 5526 B12R1.300 COc1cc(C=O)cc(N)c1O Amb24117560 [1,1,0,0,0,0|0,0,0]=2 5527 B12R1.300 COc1cc(C=O)cc(O)c1C Amb27268411 [1,1,0,0,0,0|1,0,0]=3 5528 B12R1.300 COc1cc(C=O)cc(O)c1O Amb403042 [1,1,0,0,0,0|0,0,0]=2 5529 B12R1.300 COc1cc(CBr)cc(O)c1O Amb33336073 [1,1,0,0,0,0|1,0,1]=4 5530 B12R1.300 COc1cc(CCl)cc(Br)c1O Amb25270087 [1,1,0,0,0,0|1,0,1]=4 5531 B12R1.300 COc1cc(CCl)cc(N)c1O Amb17477791 [1,1,0,0,0,0|1,0,1]=4 5532 B12R1.300 COc1cc(CN)cc(Br)c1O Amb1118564 [1,1,0,0,0,0|1,0,1]=4 5533 B12R1.300 COc1cc(CN)cc(Br)c1O Amb24117551 [1,1,0,0,0,0|1,0,1]=4 5534 B12R1.300 COc1cc(CN)cc(N)c1O Amb17477778 [1,1,0,0,0,0|1,0,1]=4 5535 B12R1.300 COc1cc(CN)cc(N)c1O Amb24117556 [1,1,0,0,0,0|1,0,1]=4 5536 B12R1.300 COc1cc(CN)cc(O)c1O Amb25866409 [1,1,0,0,0,0|1,0,1]=4 5537 B12R1.300 COc1cc(CO)cc(Br)c1O Amb2781541 [1,1,0,0,0,0|0,0,1]=3 5538 B12R1.300 COc1cc(CO)cc(C)c1C Amb27239203 [1,1,0,0,0,0|1,0,1]=4 5539 B12R1.300 COc1cc(CO)cc(Cl)c1F Amb27186816 [1,1,0,0,0,0|1,0,1]=4 5540 B12R1.300 COc1cc(CO)cc(F)c1Cl Amb27796329 [1,1,0,0,0,0|1,0,1]=4 5541 B12R1.300 COc1cc(CO)cc(F)c1O Amb25710198 [1,1,0,0,0,0|0,0,1]=3 5542 B12R1.300 COc1cc(CO)cc(I)c1I Amb27847043 [1,1,0,0,0,0|1,0,1]=4 5543 B12R1.300 COc1cc(CO)cc(I)c1O Amb1111381 [1,1,0,0,0,0|0,0,1]=3 5544 B12R1.300 COc1cc(CO)cc(N)c1O Amb17477788 [1,1,0,0,0,0|0,0,1]=3 5545 B12R1.300 COc1cc(CO)cc(O)c1O Amb25111982 [1,1,0,0,0,0|0,0,1]=3 5546 B12R1.300 COc1cc(CS)cc(Br)c1O Amb32788684 [1,1,0,0,0,0|0,1,1]=4 5547 B12R1.300 COc1cc(CS)cc(O)c1O Amb33427875 [1,1,0,0,0,0|0,1,1]=4 5548 B12R1.300 COc1cc(F)c(O)c(OC)c1 Amb27642821 [1,1,0,0,0,0|2,0,0]=4 5549 B12R1.300 COc1cc(NN)cc(Br)c1O Amb33334828 [1,1,0,0,0,0|2,0,0]=4 5550 B12R1.300 COc1cc(NN)cc(O)c1O Amb33427871 [1,1,0,0,0,0|2,0,0]=4 5551 B12R1.300 COc1cc(O)c(O)c(OC)c1 Amb28243895 [1,1,0,0,0,0|2,0,0]=4 5552 B12R1.300 COc1nc(C=O)cc(Br)c1C Amb27219516 [1,1,0,0,0,0|2,0,0]=4 5553 B12R1.300 Cc1cc(C=O)cc(C=O)c1O Amb2610700 [1,1,0,0,0,0|2,0,0]=4 5554 B12R1.300 N#Cc1cc(C=O)cc(N)c1O Amb24117590 [1,1,0,0,0,0|2,0,0]=4 5555 B12R1.300 NCc1cc(C=O)cc(Br)c1O Amb23559336 [1,1,0,0,0,0|2,0,0]=4 5556 B12R1.300 NCc1cc(C=O)cc(Br)c1O Amb24117579 [1,1,0,0,0,0|2,0,0]=4 5557 B12R1.300 NCc1cc(C=O)cc(N)c1O Amb24117582 [1,1,0,0,0,0|2,0,0]=4 5558 B12R1.300 NCc1cc(C=O)cc(O)c1O Amb23559333 [1,1,0,0,0,0|2,0,0]=4 5559 B12R1.300 NCc1cc(C=O)cc(O)c1O Amb24117576 [1,1,0,0,0,0|2,0,0]=4 5560 B12R1.300 Nc1cc(C=O)cc(CCl)c1O Amb24117575 [1,1,0,0,0,0|2,0,0]=4 5561 B12R1.300 O=Cc1cc(Br)c(O)c(C=O)c1 Amb17596283 [1,1,0,0,0,0|2,0,0]=4 5562 B12R1.300 O=Cc1cc(Cl)c(O)c(C=O)c1 Amb27851496 [1,1,0,0,0,0|2,0,0]=4 5563 B12R1.300 O=Cc1cc(F)c(O)c(C=O)c1 Amb26517441 [1,1,0,0,0,0|2,0,0]=4 5564 B12R1.300 O=Cc1cc(O)c(O)c(C=O)c1 Amb24418038 [1,1,0,0,0,0|2,0,0]=4 5565 B12R1.449 C#Cc1cc(OC)c(O)cc1Br Amb33333668 [1,1,0,0,0,0|1,0,1]=4 5566 B12R1.449 C=Cc1cc(OC)c(O)cc1Br Amb33333678 [1,1,0,0,0,0|1,0,0]=3 5567 B12R1.449 C=Cc1cc(OC)c(O)cc1C Amb28243955 [1,1,0,0,0,0|1,0,0]=3 5568 B12R1.449 CCc1cc(C=O)c(C)cc1O Amb27616890 [1,1,0,0,0,0|1,0,0]=3 5569 B12R1.449 CCc1cc(C=O)c(F)cc1Cl Amb28069416 [1,1,0,0,0,0|2,0,0]=4 5570 B12R1.449 CCc1cc(C=O)c(O)cc1O Amb22495489 [1,1,0,0,0,0|1,0,0]=3 5571 B12R1.449 CCc1cc(CO)c(O)cc1O Amb27186629 [1,1,0,0,0,0|1,0,1]=4 5572 B12R1.449 CCc1cc(N=O)c(O)cc1O Amb28243845 [1,1,0,0,0,0|2,0,0]=4 5573 B12R1.449 CCc1cc(OC)c(O)cc1F Amb10839866 [1,1,0,0,0,0|1,0,1]=4 5574 B12R1.449 COc1cc(C#N)c(Br)cc1O Amb2692194 [1,1,0,0,0,0|1,0,1]=4 5575 B12R1.449 COc1cc(C#N)c(C)cc1O Amb33309542 [1,1,0,0,0,0|1,0,1]=4 5576 B12R1.449 COc1cc(C#N)c(F)cc1O Amb27211008 [1,1,0,0,0,0|1,0,1]=4 5577 B12R1.449 COc1cc(C=O)c(Br)cc1Br Amb26472292 [1,1,0,0,0,0|1,0,0]=3 5578 B12R1.449 COc1cc(C=O)c(Br)cc1C Amb18135043 [1,1,0,0,0,0|1,0,0]=3 5579 B12R1.449 COc1cc(C=O)c(Br)cc1Cl Amb27186096 [1,1,0,0,0,0|1,0,0]=3 5580 B12R1.449 COc1cc(C=O)c(Br)cc1F Amb25969437 [1,1,0,0,0,0|1,0,0]=3 5581 B12R1.449 COc1cc(C=O)c(Br)cc1O Amb2220976 [1,1,0,0,0,0|0,0,0]=2 5582 B12R1.449 COc1cc(C=O)c(Br)cc1S Amb32688042 [1,1,0,0,0,0|0,1,0]=3 5583 B12R1.449 COc1cc(C=O)c(C)cc1C Amb27446617 [1,1,0,0,0,0|1,0,0]=3 5584 B12R1.449 COc1cc(C=O)c(Cl)cc1C Amb18649026 [1,1,0,0,0,0|1,0,0]=3 5585 B12R1.449 COc1cc(C=O)c(Cl)cc1Cl Amb19892761 [1,1,0,0,0,0|1,0,0]=3 5586 B12R1.449 COc1cc(C=O)c(Cl)cc1O Amb2002357 [1,1,0,0,0,0|0,0,0]=2 5587 B12R1.449 COc1cc(C=O)c(F)cc1Br Amb24531536 [1,1,0,0,0,0|1,0,0]=3 5588 B12R1.449 COc1cc(C=O)c(F)cc1C Amb27389166 [1,1,0,0,0,0|1,0,0]=3 5589 B12R1.449 COc1cc(C=O)c(F)cc1Cl Amb10844949 [1,1,0,0,0,0|1,0,0]=3 5590 B12R1.449 COc1cc(C=O)c(F)cc1F Amb26853203 [1,1,0,0,0,0|1,0,0]=3 5591 B12R1.449 COc1cc(C=O)c(F)cc1O Amb18825814 [1,1,0,0,0,0|0,0,0]=2 5592 B12R1.449 COc1cc(C=O)c(I)cc1I Amb27798961 [1,1,0,0,0,0|1,0,0]=3 5593 B12R1.449 COc1cc(C=O)c(N)cc1C Amb26573610 [1,1,0,0,0,0|1,0,0]=3 5594 B12R1.449 COc1cc(C=O)c(O)cc1Br Amb18660821 [1,1,0,0,0,0|1,0,0]=3 5595 B12R1.449 COc1cc(C=O)c(O)cc1C Amb2692065 [1,1,0,0,0,0|1,0,0]=3 5596 B12R1.449 COc1cc(C=O)c(O)cc1Cl Amb26355931 [1,1,0,0,0,0|1,0,0]=3 5597 B12R1.449 COc1cc(C=O)c(O)cc1O Amb6374190 [1,1,0,0,0,0|0,0,0]=2 5598 B12R1.449 COc1cc(CCl)c(Br)cc1O Amb33335238 [1,1,0,0,0,0|1,0,1]=4 5599 B12R1.449 COc1cc(CCl)c(F)cc1O Amb28245605 [1,1,0,0,0,0|1,0,1]=4 5600 B12R1.449 COc1cc(CN)c(Br)cc1O Amb32664433 [1,1,0,0,0,0|1,0,1]=4 5601 B12R1.449 COc1cc(CN)c(Br)cc1O Amb6298748 [1,1,0,0,0,0|1,0,1]=4 5602 B12R1.449 COc1cc(CN)c(F)cc1O Amb18198680 [1,1,0,0,0,0|1,0,1]=4 5603 B12R1.449 COc1cc(CO)c(Br)cc1C Amb21926800 [1,1,0,0,0,0|1,0,1]=4 5604 B12R1.449 COc1cc(CO)c(Br)cc1O Amb837449 [1,1,0,0,0,0|0,0,1]=3 5605 B12R1.449 COc1cc(CO)c(C)cc1C Amb28281922 [1,1,0,0,0,0|1,0,1]=4 5606 B12R1.449 COc1cc(CO)c(Cl)cc1O Amb23541418 [1,1,0,0,0,0|0,0,1]=3 5607 B12R1.449 COc1cc(CO)c(F)cc1Br Amb27166022 [1,1,0,0,0,0|1,0,1]=4 5608 B12R1.449 COc1cc(CO)c(F)cc1Cl Amb28344968 [1,1,0,0,0,0|1,0,1]=4 5609 B12R1.449 COc1cc(CO)c(F)cc1F Amb28077380 [1,1,0,0,0,0|1,0,1]=4 5610 B12R1.449 COc1cc(CO)c(O)cc1F Amb28208764 [1,1,0,0,0,0|1,0,1]=4 5611 B12R1.449 COc1cc(CS)c(Br)cc1O Amb33333287 [1,1,0,0,0,0|0,1,1]=4 5612 B12R1.449 COc1cc(NN)c(Br)cc1O Amb33333008 [1,1,0,0,0,0|2,0,0]=4 5613 B12R1.449 COc1cc(OC)c(Cl)cc1O Amb17199620 [1,1,0,0,0,0|2,0,0]=4 5614 B12R1.449 COc1cc(OC)c(F)cc1O Amb25053357 [1,1,0,0,0,0|2,0,0]=4 5615 B12R1.449 COc1cc(OC)c(S)cc1O Amb26519062 [1,1,0,0,0,0|2,0,0]=4 5616 B12R1.449 COc1cc(SC)c(N)cc1O Amb27390973 [1,1,0,0,0,0|2,0,0]=4 5617 B12R1.449 COc1nc(C=O)c(C)cc1C Amb27250901 [1,1,0,0,0,0|2,0,0]=4 5618 B12R1.449 O=Cc1cc(C=O)c(O)cc1O Amb17779766 [1,1,0,0,0,0|2,0,0]=4 5619 B12R1.654 COc1c(Br)ccc(C=O)c1F Amb28244330 [1,1,0,0,0,0|1,0,0]=3 5620 B12R1.654 COc1c(Br)cnc(C=O)c1C Amb27224272 [1,1,0,0,0,0|2,0,0]=4 5621 B12R1.654 COc1c(C)ccc(C=O)c1Br Amb27442134 [1,1,0,0,0,0|1,0,0]=3 5622 B12R1.654 COc1c(C)ccc(C=O)c1F Amb27592596 [1,1,0,0,0,0|1,0,0]=3 5623 B12R1.654 COc1c(C)ccc(C=O)c1N Amb27407730 [1,1,0,0,0,0|1,0,0]=3 5624 B12R1.654 COc1c(C)ccc(CO)c1C Amb28368614 [1,1,0,0,0,0|1,0,1]=4 5625 B12R1.654 COc1c(C)cnc(C=O)c1C Amb13883477 [1,1,0,0,0,0|2,0,0]=4 5626 B12R1.654 COc1c(C)cnc(C=O)c1Cl Amb18822256 [1,1,0,0,0,0|2,0,0]=4 5627 B12R1.654 COc1c(Cl)ccc(CO)c1F Amb22738087 [1,1,0,0,0,0|1,0,1]=4 5628 B12R1.654 COc1c(Cl)cnc(C=O)c1C Amb18822255 [1,1,0,0,0,0|2,0,0]=4 5629 B12R1.654 COc1c(F)ccc(C=O)c1F Amb10605759 [1,1,0,0,0,0|1,0,0]=3 5630 B12R1.654 COc1c(F)ccc(CO)c1F Amb22738232 [1,1,0,0,0,0|1,0,1]=4 5631 B12R1.654 COc1c(F)ccc(CO)c1O Amb27441216 [1,1,0,0,0,0|1,0,1]=4 5632 B12R1.654 COc1c(I)ccc(C=O)c1I Amb27192407 [1,1,0,0,0,0|1,0,0]=3 5633 B12R1.654 COc1c(N)ccc(C=O)c1N Amb27790785 [1,1,0,0,0,0|1,0,0]=3 5634 B12R1.654 COc1c(O)ccc(C=N)c1O Amb28386576 [1,1,0,0,0,0|1,0,0]=3 5635 B12R1.654 COc1c(O)ccc(C=O)c1C Amb27605772 [1,1,0,0,0,0|0,0,0]=2 5636 B12R1.654 COc1c(O)ccc(C=O)c1Cl Amb24106546 [1,1,0,0,0,0|0,0,0]=2 5637 B12R1.654 COc1c(O)ccc(C=O)c1O Amb17594194 [1,1,0,0,0,0|0,0,0]=2 5638 B12R1.654 COc1ccc(O)c(OC)c1Br Amb27653832 [1,1,0,0,0,0|2,0,0]=4 5639 B12R1.654 COc1ccc(O)c(OC)c1C Amb18646894 [1,1,0,0,0,0|2,0,0]=4 5640 B12R1.654 COc1ccc(O)c(OC)c1O Amb28461234 [1,1,0,0,0,0|2,0,0]=4 5641 B12R1.654 O=Cc1ccc(O)c(C=O)c1O Amb8392180 [1,1,0,0,0,0|2,0,0]=4 5642 B12R1.63 COC(=O)c1cc(Br)c(OC)o1 Amb23538026 [0,1,0,0,1,0|2,0,0]=4 5643 B12R1.63 COC(=O)c1cc(Cl)c(OC)o1 Amb23538065 [0,1,0,0,1,0|2,0,0]=4 5644 B12R1.63 COC(=O)c1cc(OC)c(Br)s1 Amb23509542 [0,1,0,0,1,0|2,0,0]=4 5645 B12R1.63 COC(=O)c1cc(OC)c(Cl)s1 Amb23509543 [0,1,0,0,1,0|2,0,0]=4 5646 B12R1.63 COC(=O)c1cc(OC)c(N)s1 Amb28125917 [0,1,0,0,1,0|2,0,0]=4 5647 B12R1.63 COc1cc(C(=O)NO)sc1Br Amb27588557 [0,1,0,0,1,0|2,0,0]=4 5648 B12R1.111 CC(=O)c1sc(C(=O)O)cc1O Amb18822222 [0,1,0,0,1,0|2,0,0]=4 5649 B12R1.274 CCOc1oc(C(=O)O)cc1Br Amb29860900 [0,1,0,0,1,0|2,0,0]=4 5650 B12R1.274 COCc1cc(C(=O)O)oc1C Amb18987850 [0,1,0,0,1,0|2,0,0]=4 5651 B12R1.274 COCc1cc(C(=O)O)sc1Br Amb27966116 [0,1,0,0,1,0|2,0,0]=4 5652 B12R1.274 COCc1cc(C(=O)O)sc1Cl Amb27814207 [0,1,0,0,1,0|2,0,0]=4 5653 B12R1.489 CCOc1c(Br)csc1C(=O)O Amb23509750 [0,1,0,0,1,0|2,0,0]=4 5654 B12R1.489 CCOc1c(C(=O)O)csc1Br Amb18137052 [0,1,0,0,1,0|2,0,0]=4 5655 B12R1.622 COc1c(SC)csc1C(=O)O Amb27614230 [0,1,0,0,1,0|1,1,0]=4 5656 B12R1.622 COc1coc(C(=O)Cl)c1OC Amb27668954 [0,1,0,0,1,0|2,0,0]=4 5657 B12R1.622 COc1coc(C(=O)O)c1OC Amb1088749 [0,1,0,0,1,0|1,0,0]=3 5658 B12R1.622 COc1coc(C(C)=O)c1OC Amb27175844 [0,1,0,0,1,0|2,0,0]=4 5659 B12R1.622 COc1csc(C(=O)O)c1OC Amb18129758 [0,1,0,0,1,0|1,0,0]=3 5660 B12R1.622 COc1csc(C(C)=O)c1OC Amb18822077 [0,1,0,0,1,0|2,0,0]=4 5661 B12R1.743 COC(=O)c1csc(Br)c1OC Amb22494905 [0,1,0,0,1,0|2,0,0]=4 5662 B12R1.743 COC(=O)c1csc(N)c1OC Amb27614839 [0,1,0,0,1,0|2,0,0]=4 5663 B12R1.743 COC(=O)c1scc(Br)c1OC Amb2724315 [0,1,0,0,1,0|2,0,0]=4 5664 B12R1.743 COC(=O)c1scc(Cl)c1OC Amb23509705 [0,1,0,0,1,0|2,0,0]=4 5665 B12R1.766 COc1c(C(=O)O)sc(Br)c1Br Amb23509814 [0,1,0,0,1,0|2,0,0]=4 5666 B12R1.766 COc1c(C(=O)O)sc(C)c1Br Amb18667015 [0,1,0,0,1,0|2,0,0]=4 5667 B12R1.766 COc1c(C(=O)O)sc(C)c1C Amb18649373 [0,1,0,0,1,0|2,0,0]=4 5668 B12R1.766 COc1c(C(=O)O)sc(Cl)c1Cl Amb23509795 [0,1,0,0,1,0|2,0,0]=4 5669 B12R1.800 COc1c(Br)sc(C)c1C(=O)O Amb28196513 [0,1,0,0,1,0|2,0,0]=4 5670 B12R1.800 COc1c(Cl)sc(C)c1C(=O)O Amb27240166 [0,1,0,0,1,0|2,0,0]=4 5671 B14R1.41 C=C(C(=O)O)c1ccc(Br)c(OC)c1 Amb33331781 [0,1,0,0,0,1|1,0,0]=3 5672 B14R1.41 C=C(C(=O)O)c1ccc(C)c(OC)c1 Amb32687899 [0,1,0,0,0,1|1,0,0]=3 5673 B14R1.41 C=C(C(=O)O)c1ccc(Cl)c(OC)c1 Amb33256441 [0,1,0,0,0,1|1,0,0]=3 5674 B14R1.41 C=C(C(=O)O)c1ccc(F)c(OC)c1 Amb33313152 [0,1,0,0,0,1|1,0,0]=3 5675 B14R1.41 C=C(C(=O)O)c1ccc(O)c(OC)c1 Amb25256122 [0,1,0,0,0,1|0,0,0]=2 5676 B14R1.41 CC(C(=O)O)c1ccc(O)c(C#N)c1 Amb27801587 [0,1,0,0,0,1|2,0,0]=4 5677 B14R1.41 CCc1cc(C(Br)C(C)=O)ccc1O Amb27240025 [0,1,0,0,0,1|2,0,0]=4 5678 B14R1.41 CCc1cc(C(Cl)C(C)=O)ccc1O Amb27844413 [0,1,0,0,0,1|2,0,0]=4 5679 B14R1.41 COc1cc(C(=O)C(=O)O)ccc1Br Amb33331442 [0,1,0,0,0,1|1,0,0]=3 5680 B14R1.41 COc1cc(C(=O)C(=O)O)ccc1C Amb33419992 [0,1,0,0,0,1|1,0,0]=3 5681 B14R1.41 COc1cc(C(=O)C(=O)O)ccc1Cl Amb24629858 [0,1,0,0,0,1|1,0,0]=3 5682 B14R1.41 COc1cc(C(=O)C(=O)O)ccc1F Amb25813518 [0,1,0,0,0,1|1,0,0]=3 5683 B14R1.41 COc1cc(C(=O)C(=O)O)ccc1O Amb28244764 [0,1,0,0,0,1|0,0,0]=2 5684 B14R1.41 COc1cc(C(=O)C(C)O)ccc1O Amb22828178 [0,1,0,0,0,1|1,0,1]=4 5685 B14R1.41 COc1cc(C(=O)C(O)O)ccc1O Amb22056312 [0,1,0,0,0,1|0,0,2]=4 5686 B14R1.41 COc1cc(C(Br)C(C)=O)ccc1Br Amb26576212 [0,1,0,0,0,1|2,0,0]=4 5687 B14R1.41 COc1cc(C(Br)C(C)=O)ccc1C Amb26008249 [0,1,0,0,0,1|2,0,0]=4 5688 B14R1.41 COc1cc(C(Br)C(C)=O)ccc1Cl Amb28367792 [0,1,0,0,0,1|2,0,0]=4 5689 B14R1.41 COc1cc(C(Br)C(C)=O)ccc1F Amb26023925 [0,1,0,0,0,1|2,0,0]=4 5690 B14R1.41 COc1cc(C(Br)C(C)=O)ccc1N Amb28435583 [0,1,0,0,0,1|2,0,0]=4 5691 B14R1.41 COc1cc(C(C)C(=O)O)ccc1Br Amb27242514 [0,1,0,0,0,1|1,0,0]=3 5692 B14R1.41 COc1cc(C(C)C(=O)O)ccc1C Amb24366618 [0,1,0,0,0,1|1,0,0]=3 5693 B14R1.41 COc1cc(C(C)C(=O)O)ccc1Cl Amb25664622 [0,1,0,0,0,1|1,0,0]=3 5694 B14R1.41 COc1cc(C(C)C(=O)O)ccc1F Amb26538292 [0,1,0,0,0,1|1,0,0]=3 5695 B14R1.41 COc1cc(C(C)C(=O)O)ccc1N Amb28131855 [0,1,0,0,0,1|1,0,0]=3 5696 B14R1.41 COc1cc(C(C)C(=O)O)ccc1O Amb25331210 [0,1,0,0,0,1|0,0,0]=2 5697 B14R1.41 COc1cc(C(Cl)C(C)=O)ccc1Br Amb27796353 [0,1,0,0,0,1|2,0,0]=4 5698 B14R1.41 COc1cc(C(Cl)C(C)=O)ccc1F Amb27487773 [0,1,0,0,0,1|2,0,0]=4 5699 B14R1.41 COc1cc(C(Cl)C(C)=O)ccc1N Amb27441512 [0,1,0,0,0,1|2,0,0]=4 5700 B14R1.41 COc1cc(C(F)C(=O)O)ccc1Cl Amb25957583 [0,1,0,0,0,1|1,0,0]=3 5701 B14R1.41 COc1cc(C(N)C(=O)O)ccc1Br Amb27157148 [0,1,0,0,0,1|1,0,0]=3 5702 B14R1.41 COc1cc(C(N)C(=O)O)ccc1C Amb28119936 [0,1,0,0,0,1|1,0,0]=3 5703 B14R1.41 COc1cc(C(N)C(=O)O)ccc1Cl Amb27230289 [0,1,0,0,0,1|1,0,0]=3 5704 B14R1.41 COc1cc(C(N)C(=O)O)ccc1F Amb18187799 [0,1,0,0,0,1|1,0,0]=3 5705 B14R1.41 COc1cc(C(N)C(=O)O)ccc1I Amb27418154 [0,1,0,0,0,1|1,0,0]=3 5706 B14R1.41 COc1cc(C(N)C(=O)O)ccc1O Amb1803093 [0,1,0,0,0,1|0,0,0]=2 5707 B14R1.41 COc1cc(C(N)C(C)=O)ccc1C Amb28313735 [0,1,0,0,0,1|2,0,0]=4 5708 B14R1.41 COc1cc(C(N)C(C)O)ccc1O Amb27461416 [0,1,0,0,0,1|1,0,1]=4 5709 B14R1.41 COc1cc(C(N)C(N)=O)ccc1O Amb17337067 [0,1,0,0,0,1|1,0,0]=3 5710 B14R1.41 COc1cc(C(O)C(=O)O)ccc1Br Amb26074333 [0,1,0,0,0,1|1,0,0]=3 5711 B14R1.41 COc1cc(C(O)C(=O)O)ccc1C Amb25861873 [0,1,0,0,0,1|1,0,0]=3 5712 B14R1.41 COc1cc(C(O)C(=O)O)ccc1Cl Amb25664377 [0,1,0,0,0,1|1,0,0]=3 5713 B14R1.41 COc1cc(C(O)C(=O)O)ccc1F Amb18810905 [0,1,0,0,0,1|1,0,0]=3 5714 B14R1.41 COc1cc(C(O)C(=O)O)ccc1N Amb27417625 [0,1,0,0,0,1|1,0,0]=3 5715 B14R1.41 COc1cc(C(O)C(=O)O)ccc1O Amb540926 [0,1,0,0,0,1|0,0,0]=2 5716 B14R1.41 COc1cc(C(O)C(=O)[O-])ccc1O Amb22263098 [0,1,0,0,0,1|0,0,1]=3 5717 B14R1.41 COc1cc(N(C)C(C)=O)ccc1O Amb18652095 [0,1,0,0,0,1|1,0,0]=3 5718 B14R1.41 COc1cc([C@@H](C)C(=O)O)ccc1C Amb33747381 [0,1,0,0,0,1|1,0,0]=3 5719 B14R1.41 COc1cc([C@@H](N)C(=O)O)ccc1Cl Amb27465719 [0,1,0,0,0,1|1,0,0]=3 5720 B14R1.41 COc1cc([C@@H](N)C(C)O)ccc1O Amb27494695 [0,1,0,0,0,1|1,0,1]=4 5721 B14R1.41 COc1cc([C@@H](N)[C@H](C)O)ccc1O Amb27170748 [0,1,0,0,0,1|1,0,1]=4 5722 B14R1.41 COc1cc([C@@H](O)C(=O)O)ccc1O Amb25200997 [0,1,0,0,0,1|0,0,0]=2 5723 B14R1.41 COc1cc([C@@H](O)[C@@H](C)O)ccc1O Amb25956292 [0,1,0,0,0,1|1,0,1]=4 5724 B14R1.41 COc1cc([C@@H](O)[C@H](C)O)ccc1O Amb27242707 [0,1,0,0,0,1|1,0,1]=4 5725 B14R1.41 COc1cc([C@H](C)C(=O)O)ccc1C Amb33747825 [0,1,0,0,0,1|1,0,0]=3 5726 B14R1.41 COc1cc([C@H](N)C(=O)O)ccc1C Amb28239715 [0,1,0,0,0,1|1,0,0]=3 5727 B14R1.41 COc1cc([C@H](N)C(=O)O)ccc1F Amb25873910 [0,1,0,0,0,1|1,0,0]=3 5728 B14R1.41 COc1cc([C@H](N)C(=O)O)ccc1F Amb33872482 [0,1,0,0,0,1|1,0,0]=3 5729 B14R1.41 COc1cc([C@H](N)[C@H](C)O)ccc1O Amb27655622 [0,1,0,0,0,1|1,0,1]=4 5730 B14R1.41 COc1cc([C@H](O)[C@H](C)O)ccc1O Amb26063202 [0,1,0,0,0,1|1,0,1]=4 5731 B14R1.41 CSc1cc(C(Br)C(C)=O)ccc1O Amb27239008 [0,1,0,0,0,1|1,1,0]=4 5732 B14R1.41 CSc1cc(C(Cl)C(C)=O)ccc1O Amb27793930 [0,1,0,0,0,1|1,1,0]=4 5733 B14R1.41 N#Cc1cc(C(O)C(=O)O)ccc1O Amb27773837 [0,1,0,0,0,1|2,0,0]=4 5734 B14R1.41 NC(C(=O)O)c1ccc(O)c(CCl)c1 Amb28434580 [0,1,0,0,0,1|2,0,0]=4 5735 B14R1.41 NNc1cc(C(O)C(=O)O)ccc1O Amb26644306 [0,1,0,0,0,1|2,0,0]=4 5736 B14R1.343 COc1cc(C=C(Br)Br)cc(Br)c1O Amb27772858 [0,1,0,0,0,1|2,0,0]=4 5737 B14R1.343 COc1cc(CC(=N)N)cc(Br)c1O Amb24758851 [0,1,0,0,0,1|2,0,0]=4 5738 B14R1.343 COc1cc(CC(=N)N)cc(O)c1O Amb33427870 [0,1,0,0,0,1|2,0,0]=4 5739 B14R1.343 COc1cc(CC(=O)O)cc(Br)c1O Amb2685269 [0,1,0,0,0,1|0,0,0]=2 5740 B14R1.343 COc1cc(CC(=O)O)cc(C)c1C Amb27642666 [0,1,0,0,0,1|1,0,0]=3 5741 B14R1.343 COc1cc(CC(=O)O)cc(Cl)c1F Amb27186349 [0,1,0,0,0,1|1,0,0]=3 5742 B14R1.343 COc1cc(CC(=O)O)cc(F)c1Cl Amb27186350 [0,1,0,0,0,1|1,0,0]=3 5743 B14R1.343 COc1cc(CC(=O)O)cc(F)c1F Amb8385505 [0,1,0,0,0,1|1,0,0]=3 5744 B14R1.343 COc1cc(CC(=O)O)cc(F)c1N Amb27657797 [0,1,0,0,0,1|1,0,0]=3 5745 B14R1.343 COc1cc(CC(=O)O)cc(O)c1O Amb24357428 [0,1,0,0,0,1|0,0,0]=2 5746 B14R1.343 COc1cc(CC(C)=O)cc(Br)c1O Amb6296853 [0,1,0,0,0,1|1,0,0]=3 5747 B14R1.343 COc1cc(CC(C)=O)cc(Cl)c1O Amb6297044 [0,1,0,0,0,1|1,0,0]=3 5748 B14R1.343 COc1cc(CC(C)=O)cc(N)c1O Amb17477593 [0,1,0,0,0,1|1,0,0]=3 5749 B14R1.343 COc1cc(CC(C)=O)cc(O)c1C Amb28202192 [0,1,0,0,0,1|2,0,0]=4 5750 B14R1.343 COc1cc(CC(C)=O)cc(O)c1O Amb6297624 [0,1,0,0,0,1|1,0,0]=3 5751 B14R1.343 COc1cc(CC(C)O)cc(Br)c1O Amb27241425 [0,1,0,0,0,1|1,0,1]=4 5752 B14R1.343 COc1cc(CC(C)O)cc(O)c1O Amb33372682 [0,1,0,0,0,1|1,0,1]=4 5753 B14R1.343 COc1cc(CC(N)=S)cc(Br)c1O Amb33334829 [0,1,0,0,0,1|1,1,0]=4 5754 B14R1.343 COc1cc(CC(N)=S)cc(O)c1O Amb33427869 [0,1,0,0,0,1|1,1,0]=4 5755 B14R1.343 COc1cc(CN(C)O)cc(Br)c1O Amb33336128 [0,1,0,0,0,1|2,0,0]=4 5756 B14R1.343 COc1cc(CN(C)O)cc(O)c1O Amb33225532 [0,1,0,0,0,1|2,0,0]=4 5757 B14R1.343 COc1cc(C[C@@H](C)O)cc(Br)c1O Amb33336164 [0,1,0,0,0,1|1,0,1]=4 5758 B14R1.343 COc1cc(C[C@@H](C)O)cc(O)c1O Amb33372194 [0,1,0,0,0,1|1,0,1]=4 5759 B14R1.343 COc1cc(C[C@H](C)O)cc(Br)c1O Amb33336160 [0,1,0,0,0,1|1,0,1]=4 5760 B14R1.343 COc1cc(C[C@H](C)O)cc(O)c1O Amb33372195 [0,1,0,0,0,1|1,0,1]=4 5761 B14R1.343 COc1cc(C[N+](=O)[O-])cc(Br)c1O Amb33336471 [0,1,0,0,0,1|1,0,1]=4 5762 B14R1.343 COc1cc(C[N+](=O)[O-])cc(O)c1O Amb33372180 [0,1,0,0,0,1|1,0,1]=4 5763 B14R1.343 COc1cc(OC(C)=O)cc(C)c1O Amb27433103 [0,1,0,0,0,1|1,0,0]=3 5764 B14R1.343 CSc1cc(CC(=O)O)cc(Cl)c1C Amb26460988 [0,1,0,0,0,1|1,1,0]=4 5765 B14R1.343 Cc1cc(CC(=O)O)cc(C#N)c1O Amb25970777 [0,1,0,0,0,1|2,0,0]=4 5766 B14R1.343 N#Cc1cc(CC(=O)O)cc(Br)c1O Amb27482041 [0,1,0,0,0,1|2,0,0]=4 5767 B14R1.343 N#Cc1cc(CC(=O)O)cc(I)c1O Amb27634021 [0,1,0,0,0,1|2,0,0]=4 5768 B14R1.343 N#Cc1cc(CC(=O)O)cc(S)c1O Amb28135591 [0,1,0,0,0,1|2,0,0]=4 5769 B14R1.439 CCCc1cc(NC(C)=O)ccc1O Amb27585597 [0,1,0,0,0,1|2,0,0]=4 5770 B14R1.439 CCOc1cc(CC(=N)N)ccc1O Amb33358673 [0,1,0,0,0,1|2,0,0]=4 5771 B14R1.439 CCOc1cc(CC(=O)O)ccc1O Amb2687726 [0,1,0,0,0,1|0,0,0]=2 5772 B14R1.439 CCOc1cc(CC(C)=O)ccc1O Amb18041940 [0,1,0,0,0,1|1,0,0]=3 5773 B14R1.439 CCOc1cc(CC(C)O)ccc1O Amb33429980 [0,1,0,0,0,1|1,0,1]=4 5774 B14R1.439 CCOc1cc(CC(N)=S)ccc1O Amb33375771 [0,1,0,0,0,1|1,1,0]=4 5775 B14R1.439 CCOc1cc(CN(C)O)ccc1O Amb33376429 [0,1,0,0,0,1|2,0,0]=4 5776 B14R1.439 CCOc1cc(C[C@@H](C)O)ccc1O Amb33377437 [0,1,0,0,0,1|1,0,1]=4 5777 B14R1.439 CCOc1cc(C[C@H](C)O)ccc1O Amb33377438 [0,1,0,0,0,1|1,0,1]=4 5778 B14R1.439 CCOc1cc(C[N+](=O)[O-])ccc1O Amb33376101 [0,1,0,0,0,1|1,0,1]=4 5779 B14R1.439 CCOc1cc(NC(=O)Cl)ccc1C Amb35625922 [0,1,0,0,0,1|2,0,0]=4 5780 B14R1.439 CCOc1cc(NC(C)=O)ccc1C Amb22000095 [0,1,0,0,0,1|2,0,0]=4 5781 B14R1.439 CCOc1cc(NC(C)=O)ccc1Cl Amb27230544 [0,1,0,0,0,1|2,0,0]=4 5782 B14R1.439 CNCc1cc(NC(C)=O)ccc1O Amb9776246 [0,1,0,0,0,1|2,0,0]=4 5783 B14R1.705 CC(=O)Nc1ccc(O)c(C(C)=O)c1 Amb2570006 [0,1,0,0,0,1|2,0,0]=4 5784 B14R1.705 CC(=O)Oc1ccc(O)c(C(C)=O)c1 Amb6356944 [0,1,0,0,0,1|2,0,0]=4 5785 B14R1.705 CC(=O)c1cc(CC(=O)O)ccc1Br Amb25250750 [0,1,0,0,0,1|2,0,0]=4 5786 B14R1.705 CC(=O)c1cc(CC(=O)O)ccc1Cl Amb25812678 [0,1,0,0,0,1|2,0,0]=4 5787 B14R1.705 CC(=O)c1cc(CC(=O)O)ccc1I Amb28141089 [0,1,0,0,0,1|2,0,0]=4 5788 B14R1.705 CC(=O)c1cc(CC(=O)O)ccc1N Amb25977658 [0,1,0,0,0,1|2,0,0]=4 5789 B14R1.705 CC(=O)c1cc(CC(=O)O)ccc1O Amb18651680 [0,1,0,0,0,1|1,0,0]=3 5790 B14R1.705 CC(F)c1cc(CC(=O)O)ccc1O Amb27193260 [0,1,0,0,0,1|1,0,0]=3 5791 B14R1.705 CC(N)c1cc(CC(=O)O)ccc1F Amb27873424 [0,1,0,0,0,1|2,0,0]=4 5792 B14R1.705 C[C@H](N)c1cc(CC(=O)O)ccc1O Amb27759952 [0,1,0,0,0,1|1,0,0]=3 5793 B14R1.705 O=C(O)Cc1ccc(O)c(C(=O)O)c1 Amb7807443 [0,1,0,0,0,1|2,0,0]=4 5794 B14R1.705 O=C(O)Cc1ccc(O)c(C(F)F)c1 Amb27208692 [0,1,0,0,0,1|2,0,0]=4 5795 B14R1.705 O=C(O)Cc1ccc(O)c(N(=O)=O)c1 Amb6357417 [0,1,0,0,0,1|2,0,0]=4 5796 B14R1.705 O=C(O)Cc1ccc(O)c([N+](=O)[O-])c1 Amb2235344 [0,1,0,0,0,1|2,0,0]=4 5797 B14R1.881 COC1=CN(CC(=O)O)C(C)=CC1=O Amb26393281 [0,1,0,0,0,1|1,0,1]=4 5798 B14R1.881 COc1cc(CC(=N)N)c(Br)cc1O Amb33333011 [0,1,0,0,0,1|2,0,0]=4 5799 B14R1.881 COc1cc(CC(=O)O)c(Br)cc1C Amb18668072 [0,1,0,0,0,1|1,0,0]=3 5800 B14R1.881 COc1cc(CC(=O)O)c(Br)cc1O Amb10070961 [0,1,0,0,0,1|0,0,0]=2 5801 B14R1.881 COc1cc(CC(=O)O)c(F)cc1F Amb27421567 [0,1,0,0,0,1|1,0,0]=3 5802 B14R1.881 COc1cc(CC(=O)O)c(F)cc1N Amb28322831 [0,1,0,0,0,1|1,0,0]=3 5803 B14R1.881 COc1cc(CC(=O)O)c(F)cc1O Amb18810902 [0,1,0,0,0,1|0,0,0]=2 5804 B14R1.881 COc1cc(CC(=O)O)c(I)cc1I Amb28290894 [0,1,0,0,0,1|1,0,0]=3 5805 B14R1.881 COc1cc(CC(=O)O)c(S)cc1F Amb25783129 [0,1,0,0,0,1|1,0,0]=3 5806 B14R1.881 COc1cc(CC(C)=O)c(Br)cc1O Amb6297725 [0,1,0,0,0,1|1,0,0]=3 5807 B14R1.881 COc1cc(CC(C)=O)c(F)cc1Cl Amb28135759 [0,1,0,0,0,1|2,0,0]=4 5808 B14R1.881 COc1cc(CC(C)=O)c(O)cc1F Amb27965600 [0,1,0,0,0,1|2,0,0]=4 5809 B14R1.881 COc1cc(CC(C)O)c(Br)cc1O Amb33333637 [0,1,0,0,0,1|1,0,1]=4 5810 B14R1.881 COc1cc(CC(N)=S)c(Br)cc1O Amb33333013 [0,1,0,0,0,1|1,1,0]=4 5811 B14R1.881 COc1cc(CN(C)O)c(Br)cc1O Amb33333356 [0,1,0,0,0,1|2,0,0]=4 5812 B14R1.881 COc1cc(C[C@@H](C)O)c(Br)cc1O Amb33333671 [0,1,0,0,0,1|1,0,1]=4 5813 B14R1.881 COc1cc(C[C@H](C)O)c(Br)cc1O Amb33333666 [0,1,0,0,0,1|1,0,1]=4 5814 B14R1.881 COc1cc(C[N+](=O)[O-])c(Br)cc1O Amb33333698 [0,1,0,0,0,1|1,0,1]=4 5815 B14R1.881 COc1cc(NC(=O)Cl)c(Br)cc1Br Amb35633521 [0,1,0,0,0,1|2,0,0]=4 5816 B14R1.881 COc1cc(NC(C)=O)c(Cl)cc1Cl Amb22756147 [0,1,0,0,0,1|2,0,0]=4 5817 B14R1.881 COc1cc(NC(C)=O)c(Cl)cc1N Amb27827402 [0,1,0,0,0,1|2,0,0]=4 5818 B14R1.881 COc1cc(NC(C)=O)c(N)cc1C Amb27182772 [0,1,0,0,0,1|2,0,0]=4 5819 B14R1.881 COc1cc(NC(N)=O)c(Br)cc1Br Amb28386146 [0,1,0,0,0,1|2,0,0]=4 5820 B14R1.881 Cc1cc(O)c(C#N)cc1CC(=O)O Amb24696740 [0,1,0,0,0,1|2,0,0]=4 5821 B14R1.881 N#Cc1cc(CC(=O)O)c(Br)cc1O Amb25040179 [0,1,0,0,0,1|2,0,0]=4 5822 B14R1.881 N#Cc1cc(CC(=O)O)c(Cl)cc1O Amb28132896 [0,1,0,0,0,1|2,0,0]=4 5823 B14R1.881 N#Cc1cc(CC(=O)O)c(F)cc1O Amb27259664 [0,1,0,0,0,1|2,0,0]=4 5824 B14R1.3405 C#CC(=O)Nc1ccc(Br)c(OC)c1 Amb29862708 [0,1,0,0,0,1|2,0,0]=4 5825 B14R1.3405 C#CC(=O)Nc1ccc(C)c(OC)c1 Amb35724364 [0,1,0,0,0,1|2,0,0]=4 5826 B14R1.3405 C#CC(=O)Nc1ccc(Cl)c(OC)c1 Amb35699760 [0,1,0,0,0,1|2,0,0]=4 5827 B14R1.3405 C#CC(=O)Nc1ccc(F)c(OC)c1 Amb29849975 [0,1,0,0,0,1|2,0,0]=4 5828 B14R1.3405 C#CC(=O)Nc1ccc(N)c(OC)c1 Amb18952086 [0,1,0,0,0,1|2,0,0]=4 5829 B14R1.3405 C=CC(=O)Nc1ccc(Br)c(OC)c1 Amb27879788 [0,1,0,0,0,1|2,0,0]=4 5830 B14R1.3405 C=CC(=O)Nc1ccc(C)c(OC)c1 Amb25077251 [0,1,0,0,0,1|2,0,0]=4 5831 B14R1.3405 C=CC(=O)Nc1ccc(N)c(OC)c1 Amb18973791 [0,1,0,0,0,1|2,0,0]=4 5832 B14R1.3405 CCC(=O)Nc1ccc(Br)c(OC)c1 Amb27248611 [0,1,0,0,0,1|2,0,0]=4 5833 B14R1.3405 CCC(=O)Nc1ccc(C)c(OC)c1 Amb35690503 [0,1,0,0,0,1|2,0,0]=4 5834 B14R1.3405 CCc1cc(NC(=O)OC)ccc1F Amb35690398 [0,1,0,0,0,1|2,0,0]=4 5835 B14R1.3405 CNC(=O)Cc1ccc(C)c(OC)c1 Amb8329117 [0,1,0,0,0,1|2,0,0]=4 5836 B14R1.3405 CNC(=O)Nc1ccc(Br)c(OC)c1 Amb22143797 [0,1,0,0,0,1|2,0,0]=4 5837 B14R1.3405 CNC(=O)Nc1ccc(C)c(OC)c1 Amb35714535 [0,1,0,0,0,1|2,0,0]=4 5838 B14R1.3405 COC(=O)Cc1ccc(Br)c(OC)c1 Amb33545669 [0,1,0,0,0,1|1,0,0]=3 5839 B14R1.3405 COC(=O)Cc1ccc(F)c(OC)c1 Amb31291467 [0,1,0,0,0,1|1,0,0]=3 5840 B14R1.3405 COC(=O)Cc1ccc(O)c(C=O)c1 Amb8385519 [0,1,0,0,0,1|2,0,0]=4 5841 B14R1.3405 COC(=O)Cc1ccc(O)c(NN)c1 Amb27208773 [0,1,0,0,0,1|2,0,0]=4 5842 B14R1.3405 COC(=O)Cc1ccc(O)c(OC)c1 Amb18652307 [0,1,0,0,0,1|0,0,0]=2 5843 B14R1.3405 COC(=O)Nc1ccc(C)c(OC)c1 Amb35690395 [0,1,0,0,0,1|1,0,0]=3 5844 B14R1.3405 COC(=O)Nc1ccc(F)c(OC)c1 Amb27493712 [0,1,0,0,0,1|1,0,0]=3 5845 B14R1.3405 COc1cc(CC(=O)CO)ccc1O Amb28653380 [0,1,0,0,0,1|0,0,0]=2 5846 B14R1.3405 COc1cc(CC(C)NO)ccc1O Amb24103305 [0,1,0,0,0,1|1,0,1]=4 5847 B14R1.3405 COc1cc(CC(N)CO)ccc1O Amb17062708 [0,1,0,0,0,1|1,0,1]=4 5848 B14R1.3405 COc1cc(CC(O)CN)ccc1O Amb33225370 [0,1,0,0,0,1|1,0,1]=4 5849 B14R1.3405 COc1cc(C\C(N)=N\O)ccc1O Amb8384541 [0,1,0,0,0,1|1,0,0]=3 5850 B14R1.3405 COc1cc(NC(=O)CBr)ccc1C Amb35690267 [0,1,0,0,0,1|2,0,0]=4 5851 B14R1.3405 COc1cc(NC(=O)CBr)ccc1O Amb30623466 [0,1,0,0,0,1|1,0,0]=3 5852 B14R1.3405 COc1cc(NC(=O)CCl)ccc1C Amb2582785 [0,1,0,0,0,1|2,0,0]=4 5853 B14R1.3405 COc1cc(NC(=O)CCl)ccc1Cl Amb2092318 [0,1,0,0,0,1|2,0,0]=4 5854 B14R1.3405 COc1cc(NC(=O)CCl)ccc1O Amb27387765 [0,1,0,0,0,1|1,0,0]=3 5855 B14R1.3405 COc1cc(NC(=O)CN)ccc1Cl Amb27477560 [0,1,0,0,0,1|2,0,0]=4 5856 B14R1.3405 COc1cc(NC(=O)CN)ccc1N Amb28205858 [0,1,0,0,0,1|2,0,0]=4 5857 B14R1.3405 COc1cc(NC(=O)CS)ccc1C Amb35690219 [0,1,0,0,0,1|1,1,0]=4 5858 B14R1.3405 COc1cc(NC(=O)NN)ccc1Br Amb27172174 [0,1,0,0,0,1|2,0,0]=4 5859 B14R1.3405 COc1cc(NC(=O)NN)ccc1C Amb35690278 [0,1,0,0,0,1|2,0,0]=4 5860 B14R1.3405 COc1cc(N\C(N)=N\O)ccc1Br Amb28430480 [0,1,0,0,0,1|2,0,0]=4 5861 B14R1.3405 COc1cc(N\C(N)=N\O)ccc1C Amb35690245 [0,1,0,0,0,1|2,0,0]=4 5862 B14R1.3405 COc1cc(N\C(N)=N\O)ccc1F Amb27468524 [0,1,0,0,0,1|2,0,0]=4 5863 B14R1.3405 COc1cc(\C=C(/C)C=O)ccc1O Amb17336403 [0,1,0,0,0,1|1,0,0]=3 5864 B14R1.3412 COc1cc(CC(C)(C)O)ccc1O Amb33429527 [0,1,0,0,0,1|1,0,1]=4 5865 B14R1.3412 COc1cc(CS(=O)(=O)O)ccc1O Amb28314106 [0,1,0,0,0,1|1,0,0]=3 5866 B14R1.3412 COc1cc(CS(N)(=O)=O)ccc1O Amb33054400 [0,1,0,0,0,1|1,0,1]=4 5867 B14R1.3412 COc1cc(OS(N)(=O)=O)ccc1O Amb33054394 [0,1,0,0,0,1|1,0,1]=4 5868 B14R1.3651 C=C(C)Cc1ccc(OC)c(OC)c1 Amb6299283 [0,1,0,0,0,1|2,0,0]=4 5869 B14R1.3651 C=C(Cl)Cc1ccc(OC)c(OC)c1 Amb6299280 [0,1,0,0,0,1|2,0,0]=4 5870 B14R1.3651 CCc1cc(CC(=O)O)ccc1NN Amb28134409 [0,1,0,0,0,1|2,0,0]=4 5871 B14R1.3651 CCc1cc(CC(C)=O)ccc1OC Amb18894211 [0,1,0,0,0,1|2,0,0]=4 5872 B14R1.3651 CCc1cc(CC(N)=O)ccc1OC Amb17401781 [0,1,0,0,0,1|2,0,0]=4 5873 B14R1.3651 CCc1cc(NC(N)=O)ccc1OC Amb18244055 [0,1,0,0,0,1|2,0,0]=4 5874 B14R1.3651 COc1cc(CC(=O)O)ccc1C#N Amb26455704 [0,1,0,0,0,1|1,0,0]=3 5875 B14R1.3651 COc1cc(CC(C)=O)ccc1C#N Amb25279934 [0,1,0,0,0,1|2,0,0]=4 5876 B14R1.3651 COc1ccc(C=C(Br)Br)cc1OC Amb18635917 [0,1,0,0,0,1|2,0,0]=4 5877 B14R1.3651 COc1ccc(CC(=N)N)cc1OC Amb2696130 [0,1,0,0,0,1|2,0,0]=4 5878 B14R1.3651 COc1ccc(CC(=N)N)cc1OC Amb7365559 [0,1,0,0,0,1|2,0,0]=4 5879 B14R1.3651 COc1ccc(CC(=O)Cl)cc1OC Amb3939123 [0,1,0,0,0,1|1,0,0]=3 5880 B14R1.3651 COc1ccc(CC(=O)O)cc1C#N Amb28066642 [0,1,0,0,0,1|2,0,0]=4 5881 B14R1.3651 COc1ccc(CC(=O)O)cc1OC Amb1208483 [0,1,0,0,0,1|0,0,0]=2 5882 B14R1.3651 COc1ccc(CC(C)=O)cc1OC Amb4605982 [0,1,0,0,0,1|1,0,0]=3 5883 B14R1.3651 COc1ccc(CC(C)O)cc1OC Amb9358392 [0,1,0,0,0,1|1,0,1]=4 5884 B14R1.3651 COc1ccc(CC(N)=O)cc1OC Amb33545702 [0,1,0,0,0,1|1,0,0]=3 5885 B14R1.3651 COc1ccc(CC(N)=S)cc1OC Amb2687431 [0,1,0,0,0,1|1,1,0]=4 5886 B14R1.3651 COc1ccc(CN(C)O)cc1OC Amb33362096 [0,1,0,0,0,1|2,0,0]=4 5887 B14R1.3651 COc1ccc(C[C@@H](C)O)cc1OC Amb20241605 [0,1,0,0,0,1|1,0,1]=4 5888 B14R1.3651 COc1ccc(C[C@H](C)O)cc1OC Amb19889766 [0,1,0,0,0,1|1,0,1]=4 5889 B14R1.3651 COc1ccc(C[N+](=O)[O-])cc1OC Amb23589324 [0,1,0,0,0,1|1,0,1]=4 5890 B14R1.3651 COc1ccc(N=C(N)N)cc1OC Amb33839607 [0,1,0,0,0,1|2,0,0]=4 5891 B14R1.3651 COc1ccc(NC(=N)N)cc1OC Amb31197400 [0,1,0,0,0,1|2,0,0]=4 5892 B14R1.3651 COc1ccc(NC(=N)N)cc1OC Amb9175306 [0,1,0,0,0,1|2,0,0]=4 5893 B14R1.3651 COc1ccc(NC(=O)Cl)cc1OC Amb35637062 [0,1,0,0,0,1|1,0,0]=3 5894 B14R1.3651 COc1ccc(NC(C)=O)cc1OC Amb1196134 [0,1,0,0,0,1|1,0,0]=3 5895 B14R1.3651 COc1ccc(NC(C)=O)cc1SC Amb25185735 [0,1,0,0,0,1|1,1,0]=4 5896 B14R1.3651 COc1ccc(NC(C)=S)cc1OC Amb2237535 [0,1,0,0,0,1|1,1,0]=4 5897 B14R1.3651 COc1ccc(NC(N)=O)cc1OC Amb6250717 [0,1,0,0,0,1|1,0,0]=3 5898 B14R1.3651 COc1ccc(NC(N)=S)cc1OC Amb2372762 [0,1,0,0,0,1|1,1,0]=4 5899 B14R1.3651 COc1ccc(OC(=O)Cl)cc1OC Amb33297332 [0,1,0,0,0,1|1,0,0]=3 5900 B14R1.3651 COc1ccc(OC(=S)Cl)cc1OC Amb8629401 [0,1,0,0,0,1|1,1,0]=4 5901 B14R1.3651 N#Cc1cc(CC(=O)O)ccc1CO Amb25956989 [0,1,0,0,0,1|2,0,0]=4 5902 B14R1.3651 NNc1cc(CC(=O)O)ccc1CO Amb27779258 [0,1,0,0,0,1|2,0,0]=4 5903 B14R1.4106 COc1c(Br)ccc(CC(=O)O)c1F Amb28350074 [0,1,0,0,0,1|1,0,0]=3 5904 B14R1.4106 COc1c(C)ccc(CC(=O)O)c1C Amb27847092 [0,1,0,0,0,1|1,0,0]=3 5905 B14R1.4106 COc1c(C)ccc(NC(C)=O)c1C Amb27209413 [0,1,0,0,0,1|2,0,0]=4 5906 B14R1.4106 COc1c(F)ccc(CC(=O)Cl)c1F Amb27635947 [0,1,0,0,0,1|2,0,0]=4 5907 B14R1.4106 COc1c(F)ccc(CC(=O)O)c1F Amb10807937 [0,1,0,0,0,1|1,0,0]=3 5908 B14R1.4106 N#Cc1c(O)ccc(CC(=O)O)c1F Amb27200405 [0,1,0,0,0,1|2,0,0]=4 5909 B14R1.4106 N#Cc1c(O)ccc(CC(=O)O)c1I Amb28284700 [0,1,0,0,0,1|2,0,0]=4 5910 B14R1.4106 N#Cc1c(O)ccc(CC(=O)O)c1S Amb27813626 [0,1,0,0,0,1|2,0,0]=4 5911 B14R1.21327 CCC1=CC(=O)C(O)=CC(C(=O)O)=C1 Amb27401867 [0,1,0,0,0,1|1,0,1]=4 5912 B14R1.12 CC(=O)c1ccc(O)c(C(C)(C)C)c1 Amb18553800 [0,2,0,0,0,0|2,0,0]=4 5913 B14R1.12 CC(C)(C)c1cc(C(=O)O)ccc1F Amb27654228 [0,2,0,0,0,0|2,0,0]=4 5914 B14R1.12 CC(C)(C)c1cc(C(=O)O)ccc1N Amb25976776 [0,2,0,0,0,0|2,0,0]=4 5915 B14R1.12 CC(C)(C)c1cc(C(=O)O)ccc1O Amb6296126 [0,2,0,0,0,0|1,0,0]=3 5916 B14R1.12 CC(C)(N)c1cc(C(=O)O)ccc1F Amb27869874 [0,2,0,0,0,0|2,0,0]=4 5917 B14R1.12 CC(F)(F)c1cc(C(=O)O)ccc1F Amb25363944 [0,2,0,0,0,0|2,0,0]=4 5918 B14R1.12 CP(C)(=O)c1cc(C(=O)O)ccc1Br Amb33803961 [0,2,0,0,0,0|2,0,0]=4 5919 B14R1.12 CP(C)(=O)c1cc(C(=O)O)ccc1N Amb33803960 [0,2,0,0,0,0|2,0,0]=4 5920 B14R1.12 CS(=O)(=O)c1cc(C(=O)O)ccc1Br Amb8834958 [0,2,0,0,0,0|1,1,0]=4 5921 B14R1.12 CS(=O)(=O)c1cc(C(=O)O)ccc1Cl Amb1105369 [0,2,0,0,0,0|1,1,0]=4 5922 B14R1.12 CS(=O)(=O)c1cc(C(=O)O)ccc1F Amb8834829 [0,2,0,0,0,0|1,1,0]=4 5923 B14R1.12 CS(=O)(=O)c1cc(C(=O)O)ccc1N Amb26348319 [0,2,0,0,0,0|1,1,0]=4 5924 B14R1.12 Cc1ccc(C(=O)O)cc1C(C)(C)C Amb27229189 [0,2,0,0,0,0|2,0,0]=4 5925 B14R1.12 Cc1ccc(C(=O)O)cc1S(C)(=O)=O Amb8834739 [0,2,0,0,0,0|1,1,0]=4 5926 B14R1.12 NS(=O)(=O)c1cc(C(=O)O)ccc1O Amb1116681 [0,2,0,0,0,0|1,1,0]=4 5927 B14R1.12 O=C(O)c1ccc(O)c(C(F)(F)F)c1 Amb2688806 [0,2,0,0,0,0|2,0,0]=4 5928 B14R1.12 O=C(O)c1ccc(O)c(S(=O)(=O)Cl)c1 Amb1115705 [0,2,0,0,0,0|1,1,0]=4 5929 B14R1.12 O=C(O)c1ccc(O)c(S(=O)(=O)F)c1 Amb32716668 [0,2,0,0,0,0|1,1,0]=4 5930 B14R1.12 O=C(O)c1ccc(O)c(S(=O)(=O)O)c1 Amb27622159 [0,2,0,0,0,0|1,1,0]=4 5931 B14R1.31 CC(=O)c1cc(C(=O)O)ccc1C#N Amb27495406 [0,2,0,0,0,0|2,0,0]=4 5932 B14R1.31 CCc1ccc(C(=O)O)cc1C(C)=O Amb27783912 [0,2,0,0,0,0|2,0,0]=4 5933 B14R1.31 CCc1ccc(C(=O)O)cc1C(C)N Amb28346885 [0,2,0,0,0,0|2,0,0]=4 5934 B14R1.31 CN(C)c1cc(C(=O)O)ccc1C#N Amb27800262 [0,2,0,0,0,0|2,0,0]=4 5935 B14R1.31 CNc1ccc(C(=O)O)cc1C(C)C Amb27879164 [0,2,0,0,0,0|2,0,0]=4 5936 B14R1.31 COc1ccc(C(=O)O)cc1B(O)O Amb10067057 [0,2,0,0,0,0|2,0,0]=4 5937 B14R1.31 COc1ccc(C(=O)O)cc1C(=O)O Amb16231891 [0,2,0,0,0,0|2,0,0]=4 5938 B14R1.31 COc1ccc(C(=O)O)cc1C(C)=O Amb17201693 [0,2,0,0,0,0|1,0,0]=3 5939 B14R1.31 COc1ccc(C(=O)O)cc1C(C)C Amb17235907 [0,2,0,0,0,0|1,0,0]=3 5940 B14R1.31 COc1ccc(C(=O)O)cc1C(F)F Amb26458012 [0,2,0,0,0,0|2,0,0]=4 5941 B14R1.31 COc1ccc(C(=O)O)cc1C(N)=O Amb32678416 [0,2,0,0,0,0|2,0,0]=4 5942 B14R1.31 COc1ccc(C(=O)O)cc1N(C)C Amb13883654 [0,2,0,0,0,0|1,0,0]=3 5943 B14R1.31 COc1ccc(C(=O)O)cc1N(C)C Amb21964530 [0,2,0,0,0,0|1,0,0]=3 5944 B14R1.31 COc1ccc(C(=O)O)cc1[N+](=O)[O-] Amb6461412 [0,2,0,0,0,0|2,0,0]=4 5945 B14R1.31 COc1ccc(C(C)=O)cc1C(C)C Amb9173503 [0,2,0,0,0,0|2,0,0]=4 5946 B14R1.31 COc1ccc(C(C)=O)cc1N(C)C Amb26839908 [0,2,0,0,0,0|2,0,0]=4 5947 B14R1.31 COc1ccc(C(N)=O)cc1C(C)C Amb17235633 [0,2,0,0,0,0|2,0,0]=4 5948 B14R1.31 COc1ccc(S(=O)O)cc1C(C)C Amb18225236 [0,2,0,0,0,0|2,0,0]=4 5949 B14R1.31 C[C@@H](N)c1cc(C(=O)O)ccc1C#N Amb28120571 [0,2,0,0,0,0|2,0,0]=4 5950 B14R1.31 O=C(O)c1ccc(CO)c(C(=O)O)c1 Amb27221644 [0,2,0,0,0,0|2,0,0]=4 5951 B14R1.31 O=C(O)c1ccc(CO)c(N(=O)=O)c1 Amb8384579 [0,2,0,0,0,0|2,0,0]=4 5952 B14R1.31 O=C(O)c1ccc(CO)c([N+](=O)[O-])c1 Amb2694763 [0,2,0,0,0,0|2,0,0]=4 5953 B14R1.31 O=C(O)c1ccc(NO)c([N+](=O)[O-])c1 Amb22753289 [0,2,0,0,0,0|2,0,0]=4 5954 B14R1.680 CC(=O)c1cc(S(=O)(=O)O)ccc1O Amb22500925 [0,2,0,0,0,0|2,0,0]=4 5955 B14R1.706 C=C[C@@H](N)c1cc(C(=O)O)ccc1O Amb28401446 [0,2,0,0,0,0|1,0,1]=4 5956 B14R1.706 CC(C#N)c1cc(C(=O)O)ccc1F Amb27405349 [0,2,0,0,0,0|2,0,0]=4 5957 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1Br Amb27428113 [0,2,0,0,0,0|2,0,0]=4 5958 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1C Amb17201602 [0,2,0,0,0,0|2,0,0]=4 5959 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1Cl Amb27200042 [0,2,0,0,0,0|2,0,0]=4 5960 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1F Amb25900734 [0,2,0,0,0,0|2,0,0]=4 5961 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1N Amb28199313 [0,2,0,0,0,0|2,0,0]=4 5962 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1O Amb25724321 [0,2,0,0,0,0|1,0,0]=3 5963 B14R1.706 CCC(=O)c1cc(C(=O)O)ccc1S Amb27423600 [0,2,0,0,0,0|1,1,0]=4 5964 B14R1.706 CCC(=O)c1cc(C(C)=O)ccc1O Amb18651064 [0,2,0,0,0,0|2,0,0]=4 5965 B14R1.706 CCC(C)c1cc(C(C)=O)ccc1O Amb24388734 [0,2,0,0,0,0|2,0,0]=4 5966 B14R1.706 CCC(N)c1cc(C(=O)O)ccc1N Amb27446538 [0,2,0,0,0,0|2,0,0]=4 5967 B14R1.706 CCN(C)c1cc(C(=O)O)ccc1N Amb25117239 [0,2,0,0,0,0|2,0,0]=4 5968 B14R1.706 CC[C@@H](N)c1cc(C(=O)O)ccc1F Amb27760341 [0,2,0,0,0,0|2,0,0]=4 5969 B14R1.706 CC[C@@H](N)c1cc(C(=O)O)ccc1O Amb27253087 [0,2,0,0,0,0|1,0,0]=3 5970 B14R1.706 CC[C@H](N)c1cc(C(=O)O)ccc1O Amb27871363 [0,2,0,0,0,0|1,0,0]=3 5971 B14R1.706 CNC(C)c1cc(C(=O)O)ccc1C Amb27201602 [0,2,0,0,0,0|2,0,0]=4 5972 B14R1.706 CN[C@H](C)c1cc(C(=O)O)ccc1Cl Amb27419475 [0,2,0,0,0,0|2,0,0]=4 5973 B14R1.706 COC(=O)c1cc(B(O)O)ccc1O Amb27658846 [0,2,0,0,0,0|1,0,1]=4 5974 B14R1.706 COC(=O)c1cc(C(=N)N)ccc1O Amb25974091 [0,2,0,0,0,0|2,0,0]=4 5975 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1Br Amb25812773 [0,2,0,0,0,0|1,0,0]=3 5976 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1C Amb6307232 [0,2,0,0,0,0|1,0,0]=3 5977 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1Cl Amb26068481 [0,2,0,0,0,0|1,0,0]=3 5978 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1F Amb27878729 [0,2,0,0,0,0|1,0,0]=3 5979 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1I Amb28059168 [0,2,0,0,0,0|1,0,0]=3 5980 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1N Amb7092211 [0,2,0,0,0,0|1,0,0]=3 5981 B14R1.706 COC(=O)c1cc(C(=O)O)ccc1O Amb10071056 [0,2,0,0,0,0|0,0,0]=2 5982 B14R1.706 COC(=O)c1cc(C(=O)[O-])ccc1C Amb34915946 [0,2,0,0,0,0|1,0,1]=4 5983 B14R1.706 COC(=O)c1cc(C(C)=O)ccc1Br Amb22295907 [0,2,0,0,0,0|2,0,0]=4 5984 B14R1.706 COC(=O)c1cc(C(C)=O)ccc1Cl Amb26059716 [0,2,0,0,0,0|2,0,0]=4 5985 B14R1.706 COC(=O)c1cc(C(C)=O)ccc1F Amb27977853 [0,2,0,0,0,0|2,0,0]=4 5986 B14R1.706 COC(=O)c1cc(C(C)=O)ccc1O Amb2722883 [0,2,0,0,0,0|1,0,0]=3 5987 B14R1.706 COC(=O)c1cc(C(N)=O)ccc1Br Amb22751450 [0,2,0,0,0,0|2,0,0]=4 5988 B14R1.706 COC(=O)c1cc(C(N)=O)ccc1C Amb25901021 [0,2,0,0,0,0|2,0,0]=4 5989 B14R1.706 COC(=O)c1cc(C(N)=O)ccc1O Amb18652025 [0,2,0,0,0,0|1,0,0]=3 5990 B14R1.706 COC(=O)c1cc(C(N)=S)ccc1O Amb33426695 [0,2,0,0,0,0|1,1,0]=4 5991 B14R1.706 COC(=O)c1cc(N(=O)=O)ccc1O Amb8384829 [0,2,0,0,0,0|1,0,1]=4 5992 B14R1.706 COC(=O)c1cc(S(=O)[O-])ccc1O Amb32754018 [0,2,0,0,0,0|1,0,1]=4 5993 B14R1.706 COC(=O)c1cc([C@@H](C)O)ccc1O Amb26020770 [0,2,0,0,0,0|1,0,1]=4 5994 B14R1.706 COC(=O)c1cc([C@H](C)O)ccc1O Amb33310549 [0,2,0,0,0,0|1,0,1]=4 5995 B14R1.706 COC(=O)c1cc([N+](=O)[O-])ccc1O Amb2569658 [0,2,0,0,0,0|1,0,1]=4 5996 B14R1.706 COC(=O)c1nc(C(=O)O)ccc1C Amb32670069 [0,2,0,0,0,0|2,0,0]=4 5997 B14R1.706 Cc1ccc(C(=O)O)cc1C(N)CN Amb27455064 [0,2,0,0,0,0|2,0,0]=4 5998 B14R1.706 Cc1ccc(C(=O)O)cc1C(N)CO Amb27957937 [0,2,0,0,0,0|2,0,0]=4 5999 B14R1.706 Cc1ccc(C(=O)O)cc1[C@H](N)CN Amb27627374 [0,2,0,0,0,0|2,0,0]=4 6000 B14R1.706 NC(CO)c1cc(C(=O)O)ccc1Br Amb28135437 [0,2,0,0,0,0|2,0,0]=4 6001 B14R1.706 NCC(=O)c1cc(C(=O)O)ccc1O Amb27424011 [0,2,0,0,0,0|1,0,0]=3 6002 B14R1.706 NCC(N)c1cc(C(=O)O)ccc1F Amb27173237 [0,2,0,0,0,0|2,0,0]=4 6003 B14R1.706 NCC(N)c1cc(C(=O)O)ccc1I Amb27626523 [0,2,0,0,0,0|2,0,0]=4 6004 B14R1.706 NC[C@@H](N)c1cc(C(=O)O)ccc1Br Amb27181941 [0,2,0,0,0,0|2,0,0]=4 6005 B14R1.706 NC[C@@H](N)c1cc(C(=O)O)ccc1I Amb27174434 [0,2,0,0,0,0|2,0,0]=4 6006 B14R1.706 NC[C@@H](N)c1cc(C(=O)O)ccc1O Amb27748237 [0,2,0,0,0,0|1,0,0]=3 6007 B14R1.706 NC[C@@H](N)c1cc(C(N)=O)ccc1O Amb27957026 [0,2,0,0,0,0|2,0,0]=4 6008 B14R1.706 NC[C@H](N)c1cc(C(=O)O)ccc1I Amb27657008 [0,2,0,0,0,0|2,0,0]=4 6009 B14R1.706 NC[C@H](N)c1cc(C(=O)O)ccc1O Amb28143413 [0,2,0,0,0,0|1,0,0]=3 6010 B14R1.706 N[C@@H](CO)c1cc(C(=O)O)ccc1Br Amb27612214 [0,2,0,0,0,0|2,0,0]=4 6011 B14R1.706 N[C@@H](CO)c1cc(C(=O)O)ccc1F Amb27773663 [0,2,0,0,0,0|2,0,0]=4 6012 B14R1.706 N[C@H](CO)c1cc(C(=O)O)ccc1I Amb27237192 [0,2,0,0,0,0|2,0,0]=4 6013 B14R1.706 N[C@H](CO)c1cc(C(=O)O)ccc1O Amb28250773 [0,2,0,0,0,0|1,0,0]=3 6014 B14R1.706 Nc1ccc(C(=O)O)cc1[C@@H](N)CO Amb27623134 [0,2,0,0,0,0|2,0,0]=4 6015 B14R1.706 O=C(O)c1ccc(O)c(C(=O)CBr)c1 Amb18137223 [0,2,0,0,0,0|1,0,0]=3 6016 B14R1.706 O=C(O)c1ccc(O)c(\C(Cl)=N\O)c1 Amb28365141 [0,2,0,0,0,0|2,0,0]=4 6017 B14R1.748 CC(C)c1cc(C(=O)CBr)ccc1O Amb27970267 [0,2,0,0,0,0|2,0,0]=4 6018 B14R1.748 CCC(=O)c1ccc(O)c(C(C)C)c1 Amb18555072 [0,2,0,0,0,0|2,0,0]=4 6019 B14R1.748 CNC(=O)c1ccc(O)c(C(C)C)c1 Amb27476091 [0,2,0,0,0,0|2,0,0]=4 6020 B14R1.748 CNC(=O)c1ccc(O)c(N(C)C)c1 Amb27882225 [0,2,0,0,0,0|2,0,0]=4 6021 B14R1.748 COC(=O)c1ccc(Br)c(C(C)=O)c1 Amb27798767 [0,2,0,0,0,0|2,0,0]=4 6022 B14R1.748 COC(=O)c1ccc(Br)c(C(C)N)c1 Amb28136617 [0,2,0,0,0,0|2,0,0]=4 6023 B14R1.748 COC(=O)c1ccc(Br)c([C@@H](C)N)c1 Amb27626540 [0,2,0,0,0,0|2,0,0]=4 6024 B14R1.748 COC(=O)c1ccc(Br)c([C@H](C)N)c1 Amb27222575 [0,2,0,0,0,0|2,0,0]=4 6025 B14R1.748 COC(=O)c1ccc(C)c(C(C)=O)c1 Amb24534875 [0,2,0,0,0,0|2,0,0]=4 6026 B14R1.748 COC(=O)c1ccc(C)c(C(C)N)c1 Amb28250830 [0,2,0,0,0,0|2,0,0]=4 6027 B14R1.748 COC(=O)c1ccc(C)c(C(C)N)c1 Amb31157050 [0,2,0,0,0,0|2,0,0]=4 6028 B14R1.748 COC(=O)c1ccc(C)c([C@@H](C)N)c1 Amb27170676 [0,2,0,0,0,0|2,0,0]=4 6029 B14R1.748 COC(=O)c1ccc(Cl)c(C(C)C)c1 Amb25920176 [0,2,0,0,0,0|2,0,0]=4 6030 B14R1.748 COC(=O)c1ccc(F)c(C(C)=O)c1 Amb24438238 [0,2,0,0,0,0|2,0,0]=4 6031 B14R1.748 COC(=O)c1ccc(F)c(N(C)C)c1 Amb27478719 [0,2,0,0,0,0|2,0,0]=4 6032 B14R1.748 COC(=O)c1ccc(I)c(N(C)C)c1 Amb27264706 [0,2,0,0,0,0|2,0,0]=4 6033 B14R1.748 COC(=O)c1ccc(N)c(C(C)=O)c1 Amb18651388 [0,2,0,0,0,0|2,0,0]=4 6034 B14R1.748 COC(=O)c1ccc(N)c(C(C)C)c1 Amb28255546 [0,2,0,0,0,0|2,0,0]=4 6035 B14R1.748 COC(=O)c1ccc(N)c(N(C)C)c1 Amb32729399 [0,2,0,0,0,0|2,0,0]=4 6036 B14R1.748 COC(=O)c1ccc(O)c(C(=O)O)c1 Amb17595169 [0,2,0,0,0,0|2,0,0]=4 6037 B14R1.748 COC(=O)c1ccc(O)c(C(C)=O)c1 Amb1126310 [0,2,0,0,0,0|1,0,0]=3 6038 B14R1.748 COC(=O)c1ccc(O)c(C(C)=O)n1 Amb27404829 [0,2,0,0,0,0|2,0,0]=4 6039 B14R1.748 COC(=O)c1ccc(O)c(N(=O)=O)c1 Amb20621619 [0,2,0,0,0,0|2,0,0]=4 6040 B14R1.748 COC(=O)c1ccc(O)c([N+](=O)[O-])c1 Amb6334872 [0,2,0,0,0,0|2,0,0]=4 6041 B14R1.6035 CC(=O)c1cc(C(C)=O)c(Cl)cc1O Amb27612577 [0,2,0,0,0,0|2,0,0]=4 6042 B14R1.6035 CC(=O)c1cc(C(C)=O)c(O)cc1C Amb18651076 [0,2,0,0,0,0|2,0,0]=4 6043 B14R1.6035 CC(=O)c1cc(C(C)=O)c(O)cc1N Amb28190961 [0,2,0,0,0,0|2,0,0]=4 6044 B14R1.6035 CC(=O)c1cc(C(C)=O)c(O)cc1O Amb1344861 [0,2,0,0,0,0|2,0,0]=4 6045 B14R1.6035 CC(=O)c1cc(C(C)C)c(O)cc1C Amb4035885 [0,2,0,0,0,0|2,0,0]=4 6046 B14R1.6035 CC(=O)c1cc(C(C)C)c(O)cc1O Amb21963932 [0,2,0,0,0,0|2,0,0]=4 6047 B14R1.6035 CC(C)c1cc(C(=O)O)c(O)cc1O Amb24090069 [0,2,0,0,0,0|1,0,0]=3 6048 B14R1.6035 CC(N)c1cc(C(=O)O)c(F)cc1O Amb27816455 [0,2,0,0,0,0|1,0,0]=3 6049 B14R1.6035 C[C@@H](N)c1cc(C(=O)O)c(F)cc1O Amb27957036 [0,2,0,0,0,0|1,0,0]=3 6050 B14R1.6035 C[C@@H](N)c1cc(C(=O)O)c(N)cc1F Amb27175403 [0,2,0,0,0,0|2,0,0]=4 6051 B14R1.6035 C[C@H](N)c1cc(C(=O)O)c(N)cc1F Amb28119949 [0,2,0,0,0,0|2,0,0]=4 6052 B14R1.6035 Cc1cc(Br)c(C(=O)O)cc1N(C)C Amb27854775 [0,2,0,0,0,0|2,0,0]=4 6053 B14R1.6035 Cc1cc(C)c(N(C)C)cc1C(=O)O Amb26969952 [0,2,0,0,0,0|2,0,0]=4 6054 B14R1.6035 Cc1cc(C)c([C@@H](C)N)cc1C(=O)O Amb27817855 [0,2,0,0,0,0|2,0,0]=4 6055 B14R1.6035 Cc1cc(F)c(C(=O)O)cc1[C@@H](C)N Amb27412980 [0,2,0,0,0,0|2,0,0]=4 6056 B14R1.6035 Cc1cc(O)c(C(=O)O)cc1C(=O)O Amb28291553 [0,2,0,0,0,0|2,0,0]=4 6057 B14R1.6035 Cc1cc(O)c(C(=O)O)cc1C(C)C Amb27606174 [0,2,0,0,0,0|2,0,0]=4 6058 B14R1.6035 Cc1cc(O)c(C(C)C)cc1C(=O)O Amb18056461 [0,2,0,0,0,0|1,0,0]=3 6059 B14R1.6035 Cc1cc(O)c([N+](=O)[O-])cc1C(=O)O Amb22166895 [0,2,0,0,0,0|2,0,0]=4 6060 B14R1.6035 Nc1cc(O)c(C(=O)O)cc1C(=O)O Amb18652528 [0,2,0,0,0,0|2,0,0]=4 6061 B14R1.6035 Nc1cc(O)c([N+](=O)[O-])cc1C(=O)O Amb24106109 [0,2,0,0,0,0|2,0,0]=4 6062 B14R1.6035 O=C(O)c1cc(C(=O)O)c(O)cc1O Amb5718475 [0,2,0,0,0,0|2,0,0]=4 6063 B14R1.6035 O=C(O)c1cc([N+](=O)[O-])c(O)cc1Cl Amb22166892 [0,2,0,0,0,0|2,0,0]=4 6064 B14R1.6035 O=C(O)c1cc([N+](=O)[O-])c(O)cc1F Amb22739356 [0,2,0,0,0,0|2,0,0]=4 6065 B14R1.6035 O=C(O)c1cc([N+](=O)[O-])c(O)cc1O Amb5718049 [0,2,0,0,0,0|2,0,0]=4 6066 B14R1.6045 CC(=O)c1c(Cl)ccc(C(=O)O)c1O Amb27167660 [0,2,0,0,0,0|2,0,0]=4 6067 B14R1.6045 CC(=O)c1c(F)ccc(C(=O)O)c1F Amb27183455 [0,2,0,0,0,0|2,0,0]=4 6068 B14R1.6045 CC(=O)c1c(O)ccc(C(=O)O)c1O Amb27758635 [0,2,0,0,0,0|1,0,0]=3 6069 B14R1.6045 CC(=O)c1ccc(O)c(C(C)=O)c1C Amb27434160 [0,2,0,0,0,0|2,0,0]=4 6070 B14R1.6045 CC(=O)c1ccc(O)c(C(C)=O)c1O Amb18651665 [0,2,0,0,0,0|2,0,0]=4 6071 B14R1.6045 CC(=O)c1ccc(O)c(C(C)C)c1O Amb28202389 [0,2,0,0,0,0|2,0,0]=4 6072 B14R1.6045 CC(N)c1c(F)ccc(C(=O)O)c1F Amb27189785 [0,2,0,0,0,0|2,0,0]=4 6073 B14R1.6045 CC(N)c1c(F)ccc(C(=O)O)c1O Amb27635816 [0,2,0,0,0,0|2,0,0]=4 6074 B14R1.6045 CN(C)c1c(Cl)ccc(C(=O)O)c1Cl Amb22547146 [0,2,0,0,0,0|2,0,0]=4 6075 B14R1.6045 C[C@H](N)c1c(F)ccc(C(=O)O)c1O Amb27830395 [0,2,0,0,0,0|2,0,0]=4 6076 B14R1.6045 Cc1c(C(=O)O)ccc(F)c1S(C)=O Amb28129845 [0,2,0,0,0,0|1,1,0]=4 6077 B14R1.14211 CC(=O)c1cc(C(=O)O)cc(N)c1O Amb17319964 [0,2,0,0,0,0|1,0,0]=3 6078 B14R1.14211 CC(=O)c1cc(N)c(O)c(C(C)C)c1 Amb17319972 [0,2,0,0,0,0|2,0,0]=4 6079 B14R1.14211 CC(O)c1cc(C(=O)O)cc(Cl)c1F Amb27238039 [0,2,0,0,0,0|2,0,0]=4 6080 B14R1.14211 CS(=O)c1cc(C(=O)O)cc(N)c1Cl Amb28200921 [0,2,0,0,0,0|1,1,0]=4 6081 B14R1.14211 C[C@H](N)c1cc(C(=O)O)cc(Br)c1O Amb28129310 [0,2,0,0,0,0|1,0,0]=3 6082 B14R1.14211 Cc1cc(C(=O)O)cc(C(=O)O)c1O Amb543867 [0,2,0,0,0,0|2,0,0]=4 6083 B14R1.14211 Cc1cc(C(=O)O)cc([C@@H](C)N)c1O Amb28040861 [0,2,0,0,0,0|1,0,0]=3 6084 B14R1.14211 Cc1cc(C(=O)O)cc([N+](=O)[O-])c1O Amb27204253 [0,2,0,0,0,0|2,0,0]=4 6085 B14R1.14211 Nc1cc(C(=O)O)cc(C(=O)O)c1O Amb25774970 [0,2,0,0,0,0|2,0,0]=4 6086 B14R1.14211 Nc1cc(C(=O)O)cc(C(=O)O)c1O Amb31239753 [0,2,0,0,0,0|2,0,0]=4 6087 B14R1.14211 O=C(O)c1cc(Br)c(O)c(N(=O)=O)c1 Amb22396342 [0,2,0,0,0,0|2,0,0]=4 6088 B14R1.14211 O=C(O)c1cc(Br)c(O)c([N+](=O)[O-])c1 Amb21964873 [0,2,0,0,0,0|2,0,0]=4 6089 B14R1.14211 O=C(O)c1cc(F)c(O)c([N+](=O)[O-])c1 Amb27966086 [0,2,0,0,0,0|2,0,0]=4 6090 B14R1.14211 O=C(O)c1cc(O)c(O)c([N+](=O)[O-])c1 Amb20243486 [0,2,0,0,0,0|2,0,0]=4 6091 B14R1.44 COc1cc(C(CN)CO)ccc1O Amb32954267 [0,2,0,0,0,0|1,0,1]=4 6092 B14R1.358 C=C(CBr)c1cc(O)c(O)c(OC)c1 Amb33336445 [0,2,0,0,0,0|2,0,0]=4 6093 B14R1.358 C=C(CCl)c1cc(Br)c(O)c(OC)c1 Amb33334850 [0,2,0,0,0,0|2,0,0]=4 6094 B14R1.358 C=C(CN)c1cc(Br)c(O)c(OC)c1 Amb33336466 [0,2,0,0,0,0|2,0,0]=4 6095 B14R1.358 C=C(CN)c1cc(O)c(O)c(OC)c1 Amb33372182 [0,2,0,0,0,0|2,0,0]=4 6096 B14R1.358 C=CC(=O)c1cc(Br)c(O)c(OC)c1 Amb33336173 [0,2,0,0,0,0|1,0,0]=3 6097 B14R1.358 C=CC(=O)c1cc(O)c(O)c(OC)c1 Amb33372673 [0,2,0,0,0,0|1,0,0]=3 6098 B14R1.358 C=CC(O)c1cc(Br)c(O)c(OC)c1 Amb33336171 [0,2,0,0,0,0|1,0,1]=4 6099 B14R1.358 C=CC(O)c1cc(O)c(O)c(OC)c1 Amb33372674 [0,2,0,0,0,0|1,0,1]=4 6100 B14R1.358 C=Cc1cc(C(=O)OC)cc(F)c1O Amb28290240 [0,2,0,0,0,0|1,0,1]=4 6101 B14R1.358 CCC(=O)c1cc(F)c(F)c(OC)c1 Amb27224107 [0,2,0,0,0,0|2,0,0]=4 6102 B14R1.358 CCc1cc(C(=O)OC)cc(F)c1F Amb26969867 [0,2,0,0,0,0|2,0,0]=4 6103 B14R1.358 CCc1cc(C(=O)OC)cc(F)c1O Amb28141299 [0,2,0,0,0,0|1,0,0]=3 6104 B14R1.358 CCc1cc(\C(N)=N\O)cc(C)c1O Amb26352081 [0,2,0,0,0,0|2,0,0]=4 6105 B14R1.358 COC(=N)c1cc(Br)c(O)c(OC)c1 Amb27954328 [0,2,0,0,0,0|1,0,0]=3 6106 B14R1.358 COC(=O)c1cc(Br)c(Cl)c(OC)c1 Amb26638375 [0,2,0,0,0,0|1,0,0]=3 6107 B14R1.358 COC(=O)c1cc(Br)c(N)c(OC)c1 Amb10975707 [0,2,0,0,0,0|1,0,0]=3 6108 B14R1.358 COC(=O)c1cc(Br)c(O)c(C#N)c1 Amb28071617 [0,2,0,0,0,0|2,0,0]=4 6109 B14R1.358 COC(=O)c1cc(Br)c(O)c(C=O)c1 Amb22057646 [0,2,0,0,0,0|2,0,0]=4 6110 B14R1.358 COC(=O)c1cc(Br)c(O)c(OC)c1 Amb8388565 [0,2,0,0,0,0|0,0,0]=2 6111 B14R1.358 COC(=O)c1cc(C)c(C)c(OC)c1 Amb26444912 [0,2,0,0,0,0|1,0,0]=3 6112 B14R1.358 COC(=O)c1cc(C)c(F)c(OC)c1 Amb27198503 [0,2,0,0,0,0|1,0,0]=3 6113 B14R1.358 COC(=O)c1cc(C)c(I)c(OC)c1 Amb25800957 [0,2,0,0,0,0|1,0,0]=3 6114 B14R1.358 COC(=O)c1cc(C)c(O)c(C#N)c1 Amb28196019 [0,2,0,0,0,0|2,0,0]=4 6115 B14R1.358 COC(=O)c1cc(C)c(O)c(C=O)c1 Amb28348452 [0,2,0,0,0,0|2,0,0]=4 6116 B14R1.358 COC(=O)c1cc(Cl)c(N)c(OC)c1 Amb25902008 [0,2,0,0,0,0|1,0,0]=3 6117 B14R1.358 COC(=O)c1cc(Cl)c(O)c(C#N)c1 Amb22751098 [0,2,0,0,0,0|2,0,0]=4 6118 B14R1.358 COC(=O)c1cc(Cl)c(O)c(C=O)c1 Amb27164556 [0,2,0,0,0,0|2,0,0]=4 6119 B14R1.358 COC(=O)c1cc(F)c(F)c(OC)c1 Amb27237101 [0,2,0,0,0,0|1,0,0]=3 6120 B14R1.358 COC(=O)c1cc(F)c(N)c(OC)c1 Amb27648878 [0,2,0,0,0,0|1,0,0]=3 6121 B14R1.358 COC(=O)c1cc(I)c(I)c(OC)c1 Amb26571419 [0,2,0,0,0,0|1,0,0]=3 6122 B14R1.358 COC(=O)c1cc(I)c(N)c(OC)c1 Amb22057900 [0,2,0,0,0,0|1,0,0]=3 6123 B14R1.358 COC(=O)c1cc(I)c(O)c(C#N)c1 Amb28284693 [0,2,0,0,0,0|2,0,0]=4 6124 B14R1.358 COC(=O)c1cc(N)c(C)c(OC)c1 Amb23596326 [0,2,0,0,0,0|1,0,0]=3 6125 B14R1.358 COC(=O)c1cc(N)c(Cl)c(OC)c1 Amb13882923 [0,2,0,0,0,0|1,0,0]=3 6126 B14R1.358 COC(=O)c1cc(N)c(F)c(OC)c1 Amb27646692 [0,2,0,0,0,0|1,0,0]=3 6127 B14R1.358 COC(=O)c1cc(N)c(F)c(OC)c1 Amb32651649 [0,2,0,0,0,0|1,0,0]=3 6128 B14R1.358 COC(=O)c1cc(N)c(N)c(OC)c1 Amb31156382 [0,2,0,0,0,0|1,0,0]=3 6129 B14R1.358 COC(=O)c1cc(N)c(N)c(OC)c1 Amb33189303 [0,2,0,0,0,0|1,0,0]=3 6130 B14R1.358 COC(=O)c1cc(N)c(O)c(OC)c1 Amb13949504 [0,2,0,0,0,0|0,0,0]=2 6131 B14R1.358 COC(=O)c1cc(O)c(Br)c(OC)c1 Amb26490745 [0,2,0,0,0,0|1,0,0]=3 6132 B14R1.358 COC(=O)c1cc(O)c(F)c(OC)c1 Amb25267900 [0,2,0,0,0,0|1,0,0]=3 6133 B14R1.358 COC(=O)c1cc(O)c(O)c(C#N)c1 Amb25940195 [0,2,0,0,0,0|2,0,0]=4 6134 B14R1.358 COC(=O)c1cc(O)c(O)c(OC)c1 Amb18652726 [0,2,0,0,0,0|0,0,0]=2 6135 B14R1.358 COC(=O)c1cc(S)c(O)c(C#N)c1 Amb27967513 [0,2,0,0,0,0|2,0,0]=4 6136 B14R1.358 COc1cc(C(=N)NO)cc(C)c1O Amb28074687 [0,2,0,0,0,0|1,0,0]=3 6137 B14R1.358 COc1cc(C(=N)NO)cc(Cl)c1O Amb27612773 [0,2,0,0,0,0|1,0,0]=3 6138 B14R1.358 COc1cc(C(=O)CBr)cc(I)c1I Amb27642715 [0,2,0,0,0,0|2,0,0]=4 6139 B14R1.358 COc1cc(C(=O)CCl)cc(Br)c1O Amb33334840 [0,2,0,0,0,0|1,0,0]=3 6140 B14R1.358 COc1cc(C(=O)CCl)cc(C)c1C Amb27192573 [0,2,0,0,0,0|2,0,0]=4 6141 B14R1.358 COc1cc(C(=O)CN)cc(Br)c1O Amb33335828 [0,2,0,0,0,0|1,0,0]=3 6142 B14R1.358 COc1cc(C(=O)CN)cc(F)c1C Amb27962441 [0,2,0,0,0,0|2,0,0]=4 6143 B14R1.358 COc1cc(C(=O)CN)cc(O)c1F Amb27636490 [0,2,0,0,0,0|2,0,0]=4 6144 B14R1.358 COc1cc(C(=O)CN)cc(O)c1O Amb33373312 [0,2,0,0,0,0|1,0,0]=3 6145 B14R1.358 COc1cc(C(=O)NN)cc(Cl)c1O Amb25833616 [0,2,0,0,0,0|1,0,0]=3 6146 B14R1.358 COc1cc(C(C)C=O)cc(Br)c1O Amb33336176 [0,2,0,0,0,0|1,0,1]=4 6147 B14R1.358 COc1cc(C(C)C=O)cc(O)c1O Amb33372187 [0,2,0,0,0,0|1,0,1]=4 6148 B14R1.358 COc1cc(C(C)ON)cc(Br)c1O Amb33336156 [0,2,0,0,0,0|1,0,1]=4 6149 B14R1.358 COc1cc(C(C)ON)cc(O)c1O Amb33225518 [0,2,0,0,0,0|1,0,1]=4 6150 B14R1.358 COc1cc(C(N)CO)cc(Br)c1O Amb26036713 [0,2,0,0,0,0|1,0,1]=4 6151 B14R1.358 COc1cc(C(N)CO)cc(I)c1O Amb28131013 [0,2,0,0,0,0|1,0,1]=4 6152 B14R1.358 COc1cc(C(N)CO)cc(O)c1O Amb26587548 [0,2,0,0,0,0|1,0,1]=4 6153 B14R1.358 COc1cc(C(O)CBr)cc(O)c1O Amb33336387 [0,2,0,0,0,0|1,0,1]=4 6154 B14R1.358 COc1cc(C(O)CCl)cc(Br)c1O Amb33336181 [0,2,0,0,0,0|1,0,1]=4 6155 B14R1.358 COc1cc(C(O)CF)cc(Br)c1O Amb33336184 [0,2,0,0,0,0|1,0,1]=4 6156 B14R1.358 COc1cc(C(O)CF)cc(O)c1O Amb33372186 [0,2,0,0,0,0|1,0,1]=4 6157 B14R1.358 COc1cc(C(O)CN)cc(Br)c1O Amb6740181 [0,2,0,0,0,0|1,0,1]=4 6158 B14R1.358 COc1cc(C(O)CN)cc(F)c1O Amb28073113 [0,2,0,0,0,0|1,0,1]=4 6159 B14R1.358 COc1cc(C(O)CO)cc(Br)c1O Amb33336179 [0,2,0,0,0,0|0,0,2]=4 6160 B14R1.358 COc1cc(C(O)CO)cc(O)c1O Amb25273057 [0,2,0,0,0,0|0,0,2]=4 6161 B14R1.358 COc1cc([C@@H](N)CO)cc(Br)c1O Amb28047765 [0,2,0,0,0,0|1,0,1]=4 6162 B14R1.358 COc1cc([C@@H](N)CO)cc(O)c1O Amb26366308 [0,2,0,0,0,0|1,0,1]=4 6163 B14R1.358 COc1cc([C@@H](O)CN)cc(Br)c1O Amb33336130 [0,2,0,0,0,0|1,0,1]=4 6164 B14R1.358 COc1cc([C@@H](O)CN)cc(O)c1O Amb33372228 [0,2,0,0,0,0|1,0,1]=4 6165 B14R1.358 COc1cc([C@H](N)CO)cc(Br)c1O Amb27425400 [0,2,0,0,0,0|1,0,1]=4 6166 B14R1.358 COc1cc([C@H](N)CO)cc(O)c1O Amb26067104 [0,2,0,0,0,0|1,0,1]=4 6167 B14R1.358 COc1cc([C@H](O)CN)cc(Br)c1O Amb33336132 [0,2,0,0,0,0|1,0,1]=4 6168 B14R1.358 COc1cc([C@H](O)CN)cc(O)c1O Amb33372227 [0,2,0,0,0,0|1,0,1]=4 6169 B14R1.436 C=C(CBr)c1ccc(O)c(OCC)c1 Amb33387498 [0,2,0,0,0,0|2,0,0]=4 6170 B14R1.436 C=C(CCl)c1ccc(O)c(OCC)c1 Amb33256535 [0,2,0,0,0,0|2,0,0]=4 6171 B14R1.436 C=C(CN)c1ccc(O)c(OCC)c1 Amb33376105 [0,2,0,0,0,0|2,0,0]=4 6172 B14R1.436 C=CC(=O)c1ccc(O)c(OCC)c1 Amb33376406 [0,2,0,0,0,0|1,0,0]=3 6173 B14R1.436 C=CC(O)c1ccc(O)c(OCC)c1 Amb33376407 [0,2,0,0,0,0|1,0,1]=4 6174 B14R1.436 C=CCc1cc(C(=O)OC)ccc1O Amb1092123 [0,2,0,0,0,0|1,0,1]=4 6175 B14R1.436 CCCc1cc(C(=O)OC)ccc1O Amb16229656 [0,2,0,0,0,0|1,0,0]=3 6176 B14R1.436 CCNc1cc(C(=O)OC)ccc1N Amb15695283 [0,2,0,0,0,0|2,0,0]=4 6177 B14R1.436 CCOc1cc(C(=O)CCl)ccc1O Amb33256531 [0,2,0,0,0,0|1,0,0]=3 6178 B14R1.436 CCOc1cc(C(=O)CN)ccc1O Amb33376440 [0,2,0,0,0,0|1,0,0]=3 6179 B14R1.436 CCOc1cc(C(=O)NC)ccc1N Amb17225582 [0,2,0,0,0,0|2,0,0]=4 6180 B14R1.436 CCOc1cc(C(=O)NC)ccc1O Amb28283347 [0,2,0,0,0,0|1,0,0]=3 6181 B14R1.436 CCOc1cc(C(=O)NN)ccc1Cl Amb27488357 [0,2,0,0,0,0|2,0,0]=4 6182 B14R1.436 CCOc1cc(C(=O)OC)ccc1Br Amb24105585 [0,2,0,0,0,0|1,0,0]=3 6183 B14R1.436 CCOc1cc(C(=O)OC)ccc1N Amb32680453 [0,2,0,0,0,0|1,0,0]=3 6184 B14R1.436 CCOc1cc(C(=O)OC)ccc1N Amb8963427 [0,2,0,0,0,0|1,0,0]=3 6185 B14R1.436 CCOc1cc(C(C)C=O)ccc1O Amb33376114 [0,2,0,0,0,0|1,0,1]=4 6186 B14R1.436 CCOc1cc(C(C)ON)ccc1O Amb33223766 [0,2,0,0,0,0|1,0,1]=4 6187 B14R1.436 CCOc1cc(C(N)CO)ccc1O Amb19009211 [0,2,0,0,0,0|1,0,1]=4 6188 B14R1.436 CCOc1cc(C(O)CBr)ccc1O Amb33386444 [0,2,0,0,0,0|1,0,1]=4 6189 B14R1.436 CCOc1cc(C(O)CCl)ccc1O Amb33256993 [0,2,0,0,0,0|1,0,1]=4 6190 B14R1.436 CCOc1cc(C(O)CF)ccc1O Amb33376111 [0,2,0,0,0,0|1,0,1]=4 6191 B14R1.436 CCOc1cc(C(O)CO)ccc1O Amb33376112 [0,2,0,0,0,0|0,0,2]=4 6192 B14R1.436 CCOc1cc([C@@H](N)CO)ccc1O Amb33171418 [0,2,0,0,0,0|1,0,1]=4 6193 B14R1.436 CCOc1cc([C@@H](O)CN)ccc1O Amb33376399 [0,2,0,0,0,0|1,0,1]=4 6194 B14R1.436 CCOc1cc([C@H](N)CO)ccc1O Amb33361974 [0,2,0,0,0,0|1,0,1]=4 6195 B14R1.436 CCOc1cc([C@H](O)CN)ccc1O Amb33376397 [0,2,0,0,0,0|1,0,1]=4 6196 B14R1.436 CCSc1cc(C(=O)OC)ccc1N Amb33743389 [0,2,0,0,0,0|1,1,0]=4 6197 B14R1.436 COC(=O)c1ccc(C)c(CCN)c1 Amb32650171 [0,2,0,0,0,0|2,0,0]=4 6198 B14R1.436 COC(=O)c1ccc(C)c(CCN)c1 Amb32650172 [0,2,0,0,0,0|2,0,0]=4 6199 B14R1.436 COC(=O)c1ccc(O)c(N=[N+]=[N-])c1 Amb27387713 [0,2,0,0,0,0|2,0,0]=4 6200 B14R1.436 COC(=O)c1ccc(O)c(NC=O)c1 Amb26533540 [0,2,0,0,0,0|1,0,1]=4 6201 B14R1.436 COC(=O)c1ccc(O)c(\C=C\Br)c1 Amb33135159 [0,2,0,0,0,0|1,0,1]=4 6202 B14R1.436 C\C=C/c1cc(C(=O)OC)ccc1O Amb27486158 [0,2,0,0,0,0|1,0,0]=3 6203 B14R1.626 C#CCC(=O)c1ccc(C)c(OC)c1 Amb27656480 [0,2,0,0,0,0|2,0,0]=4 6204 B14R1.626 C#CCC(=O)c1ccc(F)c(OC)c1 Amb28041343 [0,2,0,0,0,0|2,0,0]=4 6205 B14R1.626 C=C(CCN)c1ccc(O)c(OC)c1 Amb33429210 [0,2,0,0,0,0|2,0,0]=4 6206 B14R1.626 C=C(OCC)c1ccc(N)c(OC)c1 Amb33136017 [0,2,0,0,0,0|2,0,0]=4 6207 B14R1.626 C=C(OCC)c1ccc(O)c(OC)c1 Amb33136319 [0,2,0,0,0,0|1,0,0]=3 6208 B14R1.626 C=CCC(=O)c1ccc(O)c(OC)c1 Amb17336404 [0,2,0,0,0,0|1,0,0]=3 6209 B14R1.626 CCNC(=N)c1ccc(O)c(OC)c1 Amb27238192 [0,2,0,0,0,0|2,0,0]=4 6210 B14R1.626 CCNC(=O)c1ccc(Br)c(OC)c1 Amb22001133 [0,2,0,0,0,0|2,0,0]=4 6211 B14R1.626 CCNC(=O)c1ccc(N)c(OC)c1 Amb17226359 [0,2,0,0,0,0|2,0,0]=4 6212 B14R1.626 CCNC(=O)c1ccc(O)c(OC)c1 Amb27622179 [0,2,0,0,0,0|1,0,0]=3 6213 B14R1.626 CCOC(=O)c1ccc(Br)c(OC)c1 Amb22500727 [0,2,0,0,0,0|1,0,0]=3 6214 B14R1.626 CCOC(=O)c1ccc(Cl)c(OC)c1 Amb22501140 [0,2,0,0,0,0|1,0,0]=3 6215 B14R1.626 CCOC(=O)c1ccc(F)c(CC)c1 Amb16233180 [0,2,0,0,0,0|2,0,0]=4 6216 B14R1.626 CCOC(=O)c1ccc(I)c(OC)c1 Amb23437512 [0,2,0,0,0,0|1,0,0]=3 6217 B14R1.626 CCOC(=O)c1ccc(N)c(CC)c1 Amb32695506 [0,2,0,0,0,0|2,0,0]=4 6218 B14R1.626 CCOC(=O)c1ccc(N)c(OC)c1 Amb17208687 [0,2,0,0,0,0|1,0,0]=3 6219 B14R1.626 CCOC(=O)c1ccc(N)c(OC)n1 Amb22751242 [0,2,0,0,0,0|2,0,0]=4 6220 B14R1.626 CCOC(=O)c1ccc(N)c(SC)c1 Amb33727300 [0,2,0,0,0,0|1,1,0]=4 6221 B14R1.626 CCOC(=O)c1ccc(O)c(C#N)c1 Amb20242161 [0,2,0,0,0,0|2,0,0]=4 6222 B14R1.626 CCOC(=O)c1ccc(O)c(C=O)c1 Amb22497411 [0,2,0,0,0,0|2,0,0]=4 6223 B14R1.626 CCOC(=O)c1ccc(O)c(NC)c1 Amb16229667 [0,2,0,0,0,0|1,0,0]=3 6224 B14R1.626 CCOC(=O)c1ccc(O)c(OC)c1 Amb2720493 [0,2,0,0,0,0|0,0,0]=2 6225 B14R1.626 CCOC(=O)c1cnc(Br)c(OC)c1 Amb31204825 [0,2,0,0,0,0|2,0,0]=4 6226 B14R1.626 CCOC(=O)c1cnc(Cl)c(OC)c1 Amb34136967 [0,2,0,0,0,0|2,0,0]=4 6227 B14R1.626 CNCC(=O)c1ccc(Br)c(OC)c1 Amb33331437 [0,2,0,0,0,0|2,0,0]=4 6228 B14R1.626 CNCC(=O)c1ccc(C)c(OC)c1 Amb33419995 [0,2,0,0,0,0|2,0,0]=4 6229 B14R1.626 CNCC(=O)c1ccc(Cl)c(OC)c1 Amb33407183 [0,2,0,0,0,0|2,0,0]=4 6230 B14R1.626 CNCC(=O)c1ccc(F)c(OC)c1 Amb33313665 [0,2,0,0,0,0|2,0,0]=4 6231 B14R1.626 CNCC(=O)c1ccc(O)c(OC)c1 Amb32953813 [0,2,0,0,0,0|1,0,0]=3 6232 B14R1.626 CNCC(O)c1ccc(O)c(OC)c1 Amb10845690 [0,2,0,0,0,0|1,0,1]=4 6233 B14R1.626 CNCC(O)c1ccc(O)c(OC)c1 Amb6365439 [0,2,0,0,0,0|1,0,1]=4 6234 B14R1.626 CNNC(=O)c1ccc(Cl)c(OC)c1 Amb27622661 [0,2,0,0,0,0|2,0,0]=4 6235 B14R1.626 CONC(=O)c1ccc(O)c(OC)c1 Amb27780830 [0,2,0,0,0,0|0,0,0]=2 6236 B14R1.626 COc1cc(C(=O)CC#N)ccc1F Amb27418090 [0,2,0,0,0,0|2,0,0]=4 6237 B14R1.626 COc1cc(C(=O)CCN)ccc1Br Amb33331420 [0,2,0,0,0,0|2,0,0]=4 6238 B14R1.626 COc1cc(C(=O)CCN)ccc1C Amb33419998 [0,2,0,0,0,0|2,0,0]=4 6239 B14R1.626 COc1cc(C(=O)CCN)ccc1Cl Amb33407317 [0,2,0,0,0,0|2,0,0]=4 6240 B14R1.626 COc1cc(C(=O)CCN)ccc1F Amb33449759 [0,2,0,0,0,0|2,0,0]=4 6241 B14R1.626 COc1cc(C(=O)CCN)ccc1O Amb33429541 [0,2,0,0,0,0|1,0,0]=3 6242 B14R1.626 COc1cc(C(=O)\C=C\Cl)ccc1C Amb29880165 [0,2,0,0,0,0|2,0,0]=4 6243 B14R1.626 COc1cc(C(=O)\C=C\Cl)ccc1F Amb29880459 [0,2,0,0,0,0|2,0,0]=4 6244 B14R1.626 COc1cc(C(C)CON)ccc1O Amb33429365 [0,2,0,0,0,0|1,0,1]=4 6245 B14R1.626 COc1cc(C(N)CCO)ccc1O Amb19887674 [0,2,0,0,0,0|1,0,1]=4 6246 B14R1.626 COc1cc(C(O)CC#N)ccc1O Amb33429334 [0,2,0,0,0,0|1,0,1]=4 6247 B14R1.626 COc1cc(C(O)CCN)ccc1O Amb33429575 [0,2,0,0,0,0|1,0,1]=4 6248 B14R1.626 COc1cc(C(O)CNO)ccc1O Amb17337388 [0,2,0,0,0,0|0,0,2]=4 6249 B14R1.626 COc1cc([C@@H](O)CCN)ccc1O Amb33429372 [0,2,0,0,0,0|1,0,1]=4 6250 B14R1.626 COc1cc([C@H](N)CCO)ccc1O Amb31291114 [0,2,0,0,0,0|1,0,1]=4 6251 B14R1.626 COc1cc([C@H](O)CCN)ccc1O Amb33429373 [0,2,0,0,0,0|1,0,1]=4 6252 B14R1.626 C\C=C\C(=O)c1ccc(F)c(OC)c1 Amb27836013 [0,2,0,0,0,0|2,0,0]=4 6253 B14R1.1864 C#CC(O)c1ccc(OC)c(OC)c1 Amb6360845 [0,2,0,0,0,0|1,0,1]=4 6254 B14R1.1864 C#C[C@@H](O)c1ccc(OC)c(OC)c1 Amb27972557 [0,2,0,0,0,0|1,0,1]=4 6255 B14R1.1864 C#C[C@H](O)c1ccc(OC)c(OC)c1 Amb27598534 [0,2,0,0,0,0|1,0,1]=4 6256 B14R1.1864 C#Cc1cc(C(=O)OC)ccc1OC Amb28434826 [0,2,0,0,0,0|1,0,1]=4 6257 B14R1.1864 C=C(C#N)c1ccc(OC)c(OC)c1 Amb17234639 [0,2,0,0,0,0|2,0,0]=4 6258 B14R1.1864 C=C(CBr)c1ccc(OC)c(OC)c1 Amb33451475 [0,2,0,0,0,0|2,0,0]=4 6259 B14R1.1864 C=C(CCl)c1ccc(OC)c(OC)c1 Amb33052729 [0,2,0,0,0,0|2,0,0]=4 6260 B14R1.1864 C=C(CN)c1ccc(OC)c(OC)c1 Amb18651541 [0,2,0,0,0,0|2,0,0]=4 6261 B14R1.1864 C=CC(=O)c1ccc(OC)c(CC)c1 Amb18564727 [0,2,0,0,0,0|2,0,0]=4 6262 B14R1.1864 C=CC(=O)c1ccc(OC)c(OC)c1 Amb18565068 [0,2,0,0,0,0|1,0,0]=3 6263 B14R1.1864 C=CC(O)c1ccc(OC)c(OC)c1 Amb33358613 [0,2,0,0,0,0|1,0,1]=4 6264 B14R1.1864 C=Cc1cc(C(=O)OC)ccc1OC Amb33267771 [0,2,0,0,0,0|1,0,1]=4 6265 B14R1.1864 CCC(=O)c1ccc(OC)c(OC)c1 Amb1103341 [0,2,0,0,0,0|1,0,0]=3 6266 B14R1.1864 CCC(O)c1ccc(OC)c(OC)c1 Amb3372060 [0,2,0,0,0,0|1,0,1]=4 6267 B14R1.1864 CCc1cc(C(=O)CBr)ccc1OC Amb18228523 [0,2,0,0,0,0|2,0,0]=4 6268 B14R1.1864 CCc1cc(C(=O)CN)ccc1OC Amb18565251 [0,2,0,0,0,0|2,0,0]=4 6269 B14R1.1864 CCc1cc(C(=O)CO)ccc1OC Amb18565484 [0,2,0,0,0,0|1,0,0]=3 6270 B14R1.1864 CCc1cc(C(=O)OC)ccc1C#N Amb26877368 [0,2,0,0,0,0|2,0,0]=4 6271 B14R1.1864 CNC(=O)c1ccc(OC)c(NC)c1 Amb27651137 [0,2,0,0,0,0|2,0,0]=4 6272 B14R1.1864 CNC(=O)c1ccc(OC)c(OC)c1 Amb2676417 [0,2,0,0,0,0|1,0,0]=3 6273 B14R1.1864 COC(=O)c1cc(OC)c(C#N)cn1 Amb24664577 [0,2,0,0,0,0|2,0,0]=4 6274 B14R1.1864 COC(=O)c1ccc(C#N)c(OC)c1 Amb26075086 [0,2,0,0,0,0|1,0,0]=3 6275 B14R1.1864 COC(=O)c1ccc(C#N)c(SC)c1 Amb26503980 [0,2,0,0,0,0|1,1,0]=4 6276 B14R1.1864 COC(=O)c1ccc(C=O)c(OC)c1 Amb22491721 [0,2,0,0,0,0|0,0,1]=3 6277 B14R1.1864 COC(=O)c1ccc(C=O)c(SC)c1 Amb33747455 [0,2,0,0,0,0|0,1,1]=4 6278 B14R1.1864 COC(=O)c1ccc(CBr)c(OC)c1 Amb2689380 [0,2,0,0,0,0|1,0,0]=3 6279 B14R1.1864 COC(=O)c1ccc(CBr)c(OC)n1 Amb8388510 [0,2,0,0,0,0|2,0,0]=4 6280 B14R1.1864 COC(=O)c1ccc(CN)c(OC)c1 Amb21984599 [0,2,0,0,0,0|1,0,0]=3 6281 B14R1.1864 COC(=O)c1ccc(CN)c(OC)c1 Amb33744051 [0,2,0,0,0,0|1,0,0]=3 6282 B14R1.1864 COC(=O)c1ccc(CO)c(OC)c1 Amb21984598 [0,2,0,0,0,0|0,0,0]=2 6283 B14R1.1864 COC(=O)c1ccc(NN)c(OC)c1 Amb27782293 [0,2,0,0,0,0|1,0,0]=3 6284 B14R1.1864 COC(=O)c1ccc(NN)c(SC)c1 Amb27200472 [0,2,0,0,0,0|1,1,0]=4 6285 B14R1.1864 COC(=O)c1ccc(OC)c(C#N)c1 Amb2726177 [0,2,0,0,0,0|2,0,0]=4 6286 B14R1.1864 COC(=O)c1ccc(OC)c(C=O)c1 Amb22232647 [0,2,0,0,0,0|2,0,0]=4 6287 B14R1.1864 COC(=O)c1ccc(OC)c(CBr)c1 Amb22263608 [0,2,0,0,0,0|2,0,0]=4 6288 B14R1.1864 COC(=O)c1ccc(OC)c(CCl)c1 Amb1911522 [0,2,0,0,0,0|2,0,0]=4 6289 B14R1.1864 COC(=O)c1ccc(OC)c(CN)c1 Amb24096014 [0,2,0,0,0,0|2,0,0]=4 6290 B14R1.1864 COC(=O)c1ccc(OC)c(CO)c1 Amb32954339 [0,2,0,0,0,0|2,0,0]=4 6291 B14R1.1864 COC(=O)c1ccc(OC)c(CS)c1 Amb33272849 [0,2,0,0,0,0|2,0,0]=4 6292 B14R1.1864 COC(=O)c1ccc(OC)c(NN)c1 Amb28045862 [0,2,0,0,0,0|2,0,0]=4 6293 B14R1.1864 COC(=O)c1ccc(OC)c(OC)c1 Amb2221630 [0,2,0,0,0,0|0,0,0]=2 6294 B14R1.1864 COC(=O)c1cnc(C#N)c(OC)c1 Amb27877036 [0,2,0,0,0,0|2,0,0]=4 6295 B14R1.1864 COc1cc(C(=O)NN)ccc1SC Amb27388833 [0,2,0,0,0,0|1,1,0]=4 6296 B14R1.1864 COc1ccc(C(=N)NN)cc1OC Amb22229048 [0,2,0,0,0,0|2,0,0]=4 6297 B14R1.1864 COc1ccc(C(=N)NO)cc1OC Amb19514220 [0,2,0,0,0,0|1,0,0]=3 6298 B14R1.1864 COc1ccc(C(=O)C#N)cc1OC Amb17235021 [0,2,0,0,0,0|1,0,0]=3 6299 B14R1.1864 COc1ccc(C(=O)C=O)cc1OC Amb10067939 [0,2,0,0,0,0|0,0,1]=3 6300 B14R1.1864 COc1ccc(C(=O)CBr)cc1OC Amb1107596 [0,2,0,0,0,0|1,0,0]=3 6301 B14R1.1864 COc1ccc(C(=O)CBr)cc1SC Amb29082931 [0,2,0,0,0,0|1,1,0]=4 6302 B14R1.1864 COc1ccc(C(=O)CCl)cc1OC Amb6260001 [0,2,0,0,0,0|1,0,0]=3 6303 B14R1.1864 COc1ccc(C(=O)CN)cc1OC Amb20668079 [0,2,0,0,0,0|1,0,0]=3 6304 B14R1.1864 COc1ccc(C(=O)CN)cc1OC Amb5739541 [0,2,0,0,0,0|1,0,0]=3 6305 B14R1.1864 COc1ccc(C(=O)CN)cc1SC Amb29082932 [0,2,0,0,0,0|1,1,0]=4 6306 B14R1.1864 COc1ccc(C(=O)CO)cc1OC Amb18066390 [0,2,0,0,0,0|0,0,0]=2 6307 B14R1.1864 COc1ccc(C(=O)CS)cc1OC Amb17404179 [0,2,0,0,0,0|0,1,0]=3 6308 B14R1.1864 COc1ccc(C(=O)C[NH3+])cc1OC Amb20669853 [0,2,0,0,0,0|1,0,0]=3 6309 B14R1.1864 COc1ccc(C(=O)NN)cc1OC Amb6355770 [0,2,0,0,0,0|1,0,0]=3 6310 B14R1.1864 COc1ccc(C(=O)NO)cc1OC Amb6273320 [0,2,0,0,0,0|0,0,0]=2 6311 B14R1.1864 COc1ccc(C(C)C=O)cc1OC Amb17139453 [0,2,0,0,0,0|1,0,1]=4 6312 B14R1.1864 COc1ccc(C(C)CO)cc1OC Amb17236396 [0,2,0,0,0,0|1,0,1]=4 6313 B14R1.1864 COc1ccc(C(C)NO)cc1OC Amb17089217 [0,2,0,0,0,0|1,0,1]=4 6314 B14R1.1864 COc1ccc(C(C)ON)cc1OC Amb17089200 [0,2,0,0,0,0|1,0,1]=4 6315 B14R1.1864 COc1ccc(C(N)CO)cc1OC Amb8855243 [0,2,0,0,0,0|1,0,1]=4 6316 B14R1.1864 COc1ccc(C(O)CBr)cc1OC Amb17206126 [0,2,0,0,0,0|1,0,1]=4 6317 B14R1.1864 COc1ccc(C(O)CCl)cc1OC Amb17195244 [0,2,0,0,0,0|1,0,1]=4 6318 B14R1.1864 COc1ccc(C(O)CF)cc1OC Amb32953496 [0,2,0,0,0,0|1,0,1]=4 6319 B14R1.1864 COc1ccc(C(O)CN)cc1OC Amb1108181 [0,2,0,0,0,0|1,0,1]=4 6320 B14R1.1864 COc1ccc(C(O)CN)cc1OC Amb2697339 [0,2,0,0,0,0|1,0,1]=4 6321 B14R1.1864 COc1ccc(C(O)CO)cc1OC Amb18566021 [0,2,0,0,0,0|0,0,2]=4 6322 B14R1.1864 COc1ccc([C@@H](C)CO)cc1OC Amb33741047 [0,2,0,0,0,0|1,0,1]=4 6323 B14R1.1864 COc1ccc([C@@H](N)CO)cc1OC Amb33449191 [0,2,0,0,0,0|1,0,1]=4 6324 B14R1.1864 COc1ccc([C@@H](O)C#N)cc1OC Amb19928660 [0,2,0,0,0,0|1,0,1]=4 6325 B14R1.1864 COc1ccc([C@@H](O)CBr)cc1OC Amb6893385 [0,2,0,0,0,0|1,0,1]=4 6326 B14R1.1864 COc1ccc([C@@H](O)CN)cc1OC Amb32942069 [0,2,0,0,0,0|1,0,1]=4 6327 B14R1.1864 COc1ccc([C@H](C)CO)cc1OC Amb33748467 [0,2,0,0,0,0|1,0,1]=4 6328 B14R1.1864 COc1ccc([C@H](N)CO)cc1OC Amb33079361 [0,2,0,0,0,0|1,0,1]=4 6329 B14R1.1864 COc1ccc([C@H](O)CN)cc1OC Amb32942071 [0,2,0,0,0,0|1,0,1]=4 6330 B14R1.1864 COc1ccc(\C(C)=N/O)cc1OC Amb6497605 [0,2,0,0,0,0|1,0,0]=3 6331 B14R1.1864 COc1ccc(\C(C)=N\O)cc1OC Amb928421 [0,2,0,0,0,0|1,0,0]=3 6332 B14R1.1864 COc1ccc(\C(N)=N/O)cc1OC Amb2696165 [0,2,0,0,0,0|1,0,0]=3 6333 B14R1.1864 COc1ccc(\C(N)=N\O)cc1OC Amb8384533 [0,2,0,0,0,0|1,0,0]=3 6334 B14R1.1864 [C-]#[N+]c1cc(C(=O)OC)ccc1OC Amb27244003 [0,2,0,0,0,0|1,0,1]=4 6335 B14R1.2283 C=C(CCl)c1cc(OC)c(O)cc1Br Amb33332994 [0,2,0,0,0,0|2,0,0]=4 6336 B14R1.2283 C=C(CN)c1cc(OC)c(O)cc1Br Amb33333685 [0,2,0,0,0,0|2,0,0]=4 6337 B14R1.2283 C=CC(=O)c1cc(OC)c(O)cc1Br Amb33333626 [0,2,0,0,0,0|1,0,0]=3 6338 B14R1.2283 C=CC(O)c1cc(OC)c(O)cc1Br Amb33333623 [0,2,0,0,0,0|1,0,1]=4 6339 B14R1.2283 CCC(=O)c1cc(CC)c(O)cc1O Amb28461142 [0,2,0,0,0,0|2,0,0]=4 6340 B14R1.2283 CCC(=O)c1cc(OC)c(Br)cc1N Amb32687632 [0,2,0,0,0,0|2,0,0]=4 6341 B14R1.2283 CCC(=O)c1cc(OC)c(Cl)cc1N Amb28129387 [0,2,0,0,0,0|2,0,0]=4 6342 B14R1.2283 CCC(=O)c1cc(OC)c(F)cc1N Amb25164404 [0,2,0,0,0,0|2,0,0]=4 6343 B14R1.2283 CCC(=O)c1cc(OC)c(O)cc1C Amb18651819 [0,2,0,0,0,0|1,0,0]=3 6344 B14R1.2283 CCc1cc(C(=O)NN)c(O)cc1O Amb27612731 [0,2,0,0,0,0|2,0,0]=4 6345 B14R1.2283 CCc1cc(C(=O)OC)c(C)cc1Br Amb27960941 [0,2,0,0,0,0|2,0,0]=4 6346 B14R1.2283 CCc1cc(C(=O)OC)c(F)cc1N Amb27240348 [0,2,0,0,0,0|2,0,0]=4 6347 B14R1.2283 CCc1cc(C(=O)OC)c(N)cc1Cl Amb29864868 [0,2,0,0,0,0|2,0,0]=4 6348 B14R1.2283 CNc1cc(C(=O)OC)c(F)cc1F Amb19002841 [0,2,0,0,0,0|2,0,0]=4 6349 B14R1.2283 CNc1cc(C(=O)OC)c(N)cc1F Amb18984754 [0,2,0,0,0,0|2,0,0]=4 6350 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1Br Amb24420034 [0,2,0,0,0,0|2,0,0]=4 6351 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1C Amb26897077 [0,2,0,0,0,0|2,0,0]=4 6352 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1Cl Amb27209333 [0,2,0,0,0,0|2,0,0]=4 6353 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1F Amb25349646 [0,2,0,0,0,0|2,0,0]=4 6354 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1I Amb25255679 [0,2,0,0,0,0|2,0,0]=4 6355 B14R1.2283 COC(=O)c1cc(C#N)c(O)cc1O Amb27624705 [0,2,0,0,0,0|2,0,0]=4 6356 B14R1.2283 COC(=O)c1cc(OC)c(Br)cc1Cl Amb28409578 [0,2,0,0,0,0|1,0,0]=3 6357 B14R1.2283 COC(=O)c1cc(OC)c(Br)cc1F Amb25864361 [0,2,0,0,0,0|1,0,0]=3 6358 B14R1.2283 COC(=O)c1cc(OC)c(Br)cc1N Amb25044922 [0,2,0,0,0,0|1,0,0]=3 6359 B14R1.2283 COC(=O)c1cc(OC)c(C)cc1Br Amb21926746 [0,2,0,0,0,0|1,0,0]=3 6360 B14R1.2283 COC(=O)c1cc(OC)c(C)cc1C Amb26575123 [0,2,0,0,0,0|1,0,0]=3 6361 B14R1.2283 COC(=O)c1cc(OC)c(Cl)cc1N Amb25841028 [0,2,0,0,0,0|1,0,0]=3 6362 B14R1.2283 COC(=O)c1cc(OC)c(Cl)nc1C Amb24382194 [0,2,0,0,0,0|2,0,0]=4 6363 B14R1.2283 COC(=O)c1cc(OC)c(F)cc1Br Amb21926758 [0,2,0,0,0,0|1,0,0]=3 6364 B14R1.2283 COC(=O)c1cc(OC)c(F)cc1F Amb26057486 [0,2,0,0,0,0|1,0,0]=3 6365 B14R1.2283 COC(=O)c1cc(OC)c(F)cc1N Amb18984770 [0,2,0,0,0,0|1,0,0]=3 6366 B14R1.2283 COC(=O)c1cc(OC)c(I)cc1I Amb27613923 [0,2,0,0,0,0|1,0,0]=3 6367 B14R1.2283 COC(=O)c1cc(OC)c(N)cc1Cl Amb22756076 [0,2,0,0,0,0|1,0,0]=3 6368 B14R1.2283 COC(=O)c1cc(OC)c(N)cc1F Amb27802850 [0,2,0,0,0,0|1,0,0]=3 6369 B14R1.2283 COC(=O)c1cc(OC)c(O)cc1N Amb27816123 [0,2,0,0,0,0|0,0,0]=2 6370 B14R1.2283 COC(=O)c1cc(SC)c(Br)cc1N Amb27418859 [0,2,0,0,0,0|1,1,0]=4 6371 B14R1.2283 COC(=O)c1cc(SC)c(F)cc1N Amb18984784 [0,2,0,0,0,0|1,1,0]=4 6372 B14R1.2283 COC(=O)c1nc(OC)c(Br)cc1Cl Amb25253507 [0,2,0,0,0,0|2,0,0]=4 6373 B14R1.2283 COc1cc(C(=O)CBr)c(F)cc1O Amb10839986 [0,2,0,0,0,0|1,0,0]=3 6374 B14R1.2283 COc1cc(C(=O)CCl)c(Br)cc1O Amb33335274 [0,2,0,0,0,0|1,0,0]=3 6375 B14R1.2283 COc1cc(C(=O)CCl)c(Cl)cc1Cl Amb27641946 [0,2,0,0,0,0|2,0,0]=4 6376 B14R1.2283 COc1cc(C(=O)CCl)c(I)cc1I Amb27615927 [0,2,0,0,0,0|2,0,0]=4 6377 B14R1.2283 COc1cc(C(=O)CCl)c(N)cc1Cl Amb27164489 [0,2,0,0,0,0|2,0,0]=4 6378 B14R1.2283 COc1cc(C(=O)CN)c(Br)cc1O Amb28056063 [0,2,0,0,0,0|1,0,0]=3 6379 B14R1.2283 COc1cc(C(=O)CN)c(C)cc1F Amb28323293 [0,2,0,0,0,0|2,0,0]=4 6380 B14R1.2283 COc1cc(C(=O)CN)c(F)cc1O Amb27193503 [0,2,0,0,0,0|1,0,0]=3 6381 B14R1.2283 COc1cc(C(=O)CN)c(O)cc1F Amb27635892 [0,2,0,0,0,0|2,0,0]=4 6382 B14R1.2283 COc1cc(C(=O)NN)c(Cl)cc1O Amb27635521 [0,2,0,0,0,0|1,0,0]=3 6383 B14R1.2283 COc1cc(C(C)C=O)c(Br)cc1O Amb33333688 [0,2,0,0,0,0|1,0,1]=4 6384 B14R1.2283 COc1cc(C(C)ON)c(Br)cc1O Amb33333680 [0,2,0,0,0,0|1,0,1]=4 6385 B14R1.2283 COc1cc(C(N)CO)c(Br)cc1O Amb27748000 [0,2,0,0,0,0|1,0,1]=4 6386 B14R1.2283 COc1cc(C(N)CO)c(F)cc1O Amb28060510 [0,2,0,0,0,0|1,0,1]=4 6387 B14R1.2283 COc1cc(C(O)CCl)c(Br)cc1O Amb33333697 [0,2,0,0,0,0|1,0,1]=4 6388 B14R1.2283 COc1cc(C(O)CF)c(Br)cc1O Amb33333700 [0,2,0,0,0,0|1,0,1]=4 6389 B14R1.2283 COc1cc(C(O)CO)c(Br)cc1O Amb33333696 [0,2,0,0,0,0|0,0,2]=4 6390 B14R1.2283 COc1cc([C@@H](N)CO)c(Br)cc1O Amb25742478 [0,2,0,0,0,0|1,0,1]=4 6391 B14R1.2283 COc1cc([C@@H](O)CN)c(Br)cc1O Amb33333631 [0,2,0,0,0,0|1,0,1]=4 6392 B14R1.2283 COc1cc([C@H](N)CO)c(Br)cc1O Amb24511173 [0,2,0,0,0,0|1,0,1]=4 6393 B14R1.2283 COc1cc([C@H](O)CN)c(Br)cc1O Amb33333633 [0,2,0,0,0,0|1,0,1]=4 6394 B14R1.2283 COc1cc(\C(N)=N\O)c(F)cc1Cl Amb27215648 [0,2,0,0,0,0|2,0,0]=4 6395 B14R1.3413 COc1cc(C(C)(C)C=O)ccc1O Amb26973251 [0,2,0,0,0,0|1,0,1]=4 6396 B14R1.3413 COc1cc(C(C)(C)CO)ccc1O Amb24596241 [0,2,0,0,0,0|1,0,1]=4 6397 B14R1.3413 COc1cc(C(C)(C)ON)ccc1O Amb33429362 [0,2,0,0,0,0|1,0,1]=4 6398 B14R1.3413 COc1cc(C(C)(N)CO)ccc1O Amb18971957 [0,2,0,0,0,0|1,0,1]=4 6399 B14R1.3413 COc1cc(C(F)(F)CO)ccc1O Amb32813557 [0,2,0,0,0,0|1,0,1]=4 6400 B14R1.3413 COc1cc([C@](C)(N)CO)ccc1O Amb27473369 [0,2,0,0,0,0|1,0,1]=4 6401 B14R1.4114 CCc1c(Br)ccc(C(=O)OC)c1F Amb27273324 [0,2,0,0,0,0|2,0,0]=4 6402 B14R1.4114 CCc1c(N)ccc(C(=O)OC)c1Cl Amb28118515 [0,2,0,0,0,0|2,0,0]=4 6403 B14R1.4114 CCc1c(O)ccc(C(=O)OC)c1O Amb28202175 [0,2,0,0,0,0|1,0,0]=3 6404 B14R1.4114 COC(=O)c1ccc(Br)c(OC)c1C Amb25790450 [0,2,0,0,0,0|1,0,0]=3 6405 B14R1.4114 COC(=O)c1ccc(Br)c(OC)c1F Amb25121765 [0,2,0,0,0,0|1,0,0]=3 6406 B14R1.4114 COC(=O)c1ccc(C)c(OC)c1C Amb27200670 [0,2,0,0,0,0|1,0,0]=3 6407 B14R1.4114 COC(=O)c1ccc(C)c(SC)c1Cl Amb28207436 [0,2,0,0,0,0|1,1,0]=4 6408 B14R1.4114 COC(=O)c1ccc(C)c(SC)c1F Amb24466210 [0,2,0,0,0,0|1,1,0]=4 6409 B14R1.4114 COC(=O)c1ccc(C)c(SC)c1I Amb28401105 [0,2,0,0,0,0|1,1,0]=4 6410 B14R1.4114 COC(=O)c1ccc(Cl)c(OC)c1F Amb34911443 [0,2,0,0,0,0|1,0,0]=3 6411 B14R1.4114 COC(=O)c1ccc(Cl)c(OC)c1N Amb18292085 [0,2,0,0,0,0|1,0,0]=3 6412 B14R1.4114 COC(=O)c1ccc(F)c(OC)c1N Amb31156311 [0,2,0,0,0,0|1,0,0]=3 6413 B14R1.4114 COC(=O)c1ccc(I)c(OC)c1I Amb27613922 [0,2,0,0,0,0|1,0,0]=3 6414 B14R1.4114 COC(=O)c1ccc(N)c(OC)c1Cl Amb28409305 [0,2,0,0,0,0|1,0,0]=3 6415 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1Br Amb25996697 [0,2,0,0,0,0|2,0,0]=4 6416 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1C Amb26041020 [0,2,0,0,0,0|2,0,0]=4 6417 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1Cl Amb25963812 [0,2,0,0,0,0|2,0,0]=4 6418 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1F Amb27791049 [0,2,0,0,0,0|2,0,0]=4 6419 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1I Amb25202341 [0,2,0,0,0,0|2,0,0]=4 6420 B14R1.4114 COC(=O)c1ccc(O)c(C#N)c1S Amb25970708 [0,2,0,0,0,0|2,0,0]=4 6421 B14R1.4114 COC(=O)c1ccc(O)c(C=O)c1O Amb22347340 [0,2,0,0,0,0|2,0,0]=4 6422 B14R1.4114 COC(=O)c1ncc(C)c(OC)c1C Amb22749140 [0,2,0,0,0,0|2,0,0]=4 6423 B14R1.4114 COc1c(Br)ccc(C(=O)CBr)c1F Amb27651814 [0,2,0,0,0,0|2,0,0]=4 6424 B14R1.4114 COc1c(Br)ccc(C(=O)NN)c1F Amb27805376 [0,2,0,0,0,0|2,0,0]=4 6425 B14R1.4114 COc1c(F)ccc(C(=O)CBr)c1F Amb27869567 [0,2,0,0,0,0|2,0,0]=4 6426 B14R1.4114 COc1c(F)ccc(C(=O)CN)c1O Amb27793556 [0,2,0,0,0,0|2,0,0]=4 6427 B14R1.4114 COc1c(F)ccc(C(=O)NN)c1F Amb27189853 [0,2,0,0,0,0|2,0,0]=4 6428 B14R1.4114 COc1c(I)ccc(C(=O)CBr)c1I Amb27615931 [0,2,0,0,0,0|2,0,0]=4 6429 B14R1.4114 COc1c(I)ccc(C(=O)CCl)c1I Amb27441868 [0,2,0,0,0,0|2,0,0]=4 6430 B14R1.359 COc1cc(C(C)(C)O)cc(Br)c1O Amb33336152 [0,2,0,0,0,0|1,0,1]=4 6431 B14R1.359 COc1cc(C(C)(C)O)cc(O)c1O Amb33372680 [0,2,0,0,0,0|1,0,1]=4 6432 B14R1.359 COc1cc(S(=O)(=O)Cl)cc(Br)c1O Amb33745538 [0,2,0,0,0,0|1,0,1]=4 6433 B14R1.359 COc1cc(S(=O)(=O)F)cc(Br)c1O Amb33745803 [0,2,0,0,0,0|1,0,1]=4 6434 B14R1.359 COc1cc(S(N)(=O)=O)cc(Br)c1O Amb33056306 [0,2,0,0,0,0|1,0,1]=4 6435 B14R1.359 COc1cc(S(N)(=O)=O)cc(O)c1O Amb33055306 [0,2,0,0,0,0|1,0,1]=4 6436 B14R1.437 CCOc1cc(C(C)(C)O)ccc1O Amb33376413 [0,2,0,0,0,0|1,0,1]=4 6437 B14R1.437 CCOc1cc(S(=O)(=O)Cl)ccc1O Amb33745212 [0,2,0,0,0,0|1,0,1]=4 6438 B14R1.437 CCOc1cc(S(=O)(=O)F)ccc1O Amb33745801 [0,2,0,0,0,0|1,0,1]=4 6439 B14R1.437 CCOc1cc(S(N)(=O)=O)ccc1O Amb33056203 [0,2,0,0,0,0|1,0,1]=4 6440 B14R1.2279 COc1cc(C(C)(C)O)c(Br)cc1O Amb33333617 [0,2,0,0,0,0|1,0,1]=4 6441 B14R1.2279 COc1cc(S(=O)(=O)Cl)c(Br)cc1O Amb33745210 [0,2,0,0,0,0|1,0,1]=4 6442 B14R1.2279 COc1cc(S(=O)(=O)F)c(Br)cc1O Amb33745794 [0,2,0,0,0,0|1,0,1]=4 6443 B14R1.2279 COc1cc(S(=O)(=O)O)c(C)cc1N Amb8627730 [0,2,0,0,0,0|2,0,0]=4 6444 B14R1.2279 COc1cc(S(=O)(=O)O)c(N)cc1Cl Amb27604543 [0,2,0,0,0,0|2,0,0]=4 6445 B14R1.2279 COc1cc(S(N)(=O)=O)c(Br)cc1O Amb33056061 [0,2,0,0,0,0|1,0,1]=4 6446 B14R1.3654 CCc1cc(S(=O)(=O)O)ccc1OC Amb18225469 [0,2,0,0,0,0|2,0,0]=4 6447 B14R1.3654 COc1ccc(C(C)(C)O)cc1OC Amb17402107 [0,2,0,0,0,0|1,0,1]=4 6448 B14R1.3654 COc1ccc(S(=O)(=O)Br)cc1OC Amb27476662 [0,2,0,0,0,0|1,0,1]=4 6449 B14R1.3654 COc1ccc(S(=O)(=O)Cl)cc1OC Amb2687335 [0,2,0,0,0,0|1,0,1]=4 6450 B14R1.3654 COc1ccc(S(=O)(=O)F)cc1OC Amb18570834 [0,2,0,0,0,0|1,0,1]=4 6451 B14R1.3654 COc1ccc(S(=O)(=O)O)cc1OC Amb18866900 [0,2,0,0,0,0|1,0,0]=3 6452 B14R1.3654 COc1ccc(S(=O)(=O)[O-])cc1OC Amb27865775 [0,2,0,0,0,0|1,0,1]=4 6453 B14R1.3654 COc1ccc(S(C)(=O)=O)cc1OC Amb2687412 [0,2,0,0,0,0|1,0,1]=4 6454 B14R1.3654 COc1ccc(S(N)(=O)=O)cc1OC Amb1132899 [0,2,0,0,0,0|1,0,1]=4 6455 B14R1.350 CCc1cc(C(=O)O)cc(C)c1C#N Amb27964152 [0,2,0,0,0,0|2,0,0]=4 6456 B14R1.350 CCc1cc(C(=O)O)cc(I)c1C#N Amb25246973 [0,2,0,0,0,0|2,0,0]=4 6457 B14R1.350 CCc1cc(C(=O)O)cc(O)c1C#N Amb28071387 [0,2,0,0,0,0|2,0,0]=4 6458 B14R1.350 CCc1cc(C(=O)O)cc(S)c1C#N Amb26033871 [0,2,0,0,0,0|2,0,0]=4 6459 B14R1.350 COC1=C(OC)C(=O)C=C(C(=O)O)O1 Amb27643517 [0,2,0,0,0,0|1,0,0]=3 6460 B14R1.350 COc1c(Br)cc(C(=O)O)cc1C#N Amb9855093 [0,2,0,0,0,0|2,0,0]=4 6461 B14R1.350 COc1c(Br)cc(C(=O)O)cc1CN Amb24117608 [0,2,0,0,0,0|2,0,0]=4 6462 B14R1.350 COc1c(C)cc(C(=O)O)cc1C#N Amb26896889 [0,2,0,0,0,0|2,0,0]=4 6463 B14R1.350 COc1c(C)cc(C(=O)O)cc1C=O Amb32687840 [0,2,0,0,0,0|2,0,0]=4 6464 B14R1.350 COc1c(Cl)cc(C(=O)O)cc1C#N Amb9855092 [0,2,0,0,0,0|2,0,0]=4 6465 B14R1.350 COc1c(F)cc(C(=O)O)cc1C=O Amb32687837 [0,2,0,0,0,0|2,0,0]=4 6466 B14R1.350 COc1c(N)cc(C(=O)O)cc1CN Amb24117609 [0,2,0,0,0,0|2,0,0]=4 6467 B14R1.350 COc1c(O)cc(C(=O)O)cc1C#N Amb27984837 [0,2,0,0,0,0|2,0,0]=4 6468 B14R1.350 COc1c(S)cc(C(=O)O)cc1C#N Amb27211249 [0,2,0,0,0,0|2,0,0]=4 6469 B14R1.350 COc1cc(B(O)O)cc(Cl)c1OC Amb24539351 [0,2,0,0,0,0|1,0,1]=4 6470 B14R1.350 COc1cc(B(O)O)cc(F)c1OC Amb27441469 [0,2,0,0,0,0|1,0,1]=4 6471 B14R1.350 COc1cc(B(O)O)cc(I)c1OC Amb27844500 [0,2,0,0,0,0|1,0,1]=4 6472 B14R1.350 COc1cc(C(=N)N)cc(Br)c1OC Amb27467464 [0,2,0,0,0,0|2,0,0]=4 6473 B14R1.350 COc1cc(C(=N)N)cc(Cl)c1OC Amb24618080 [0,2,0,0,0,0|2,0,0]=4 6474 B14R1.350 COc1cc(C(=O)Cl)cc(Br)c1OC Amb16230218 [0,2,0,0,0,0|1,0,0]=3 6475 B14R1.350 COc1cc(C(=O)Cl)cc(Cl)c1OC Amb17144555 [0,2,0,0,0,0|1,0,0]=3 6476 B14R1.350 COc1cc(C(=O)Cl)cc(F)c1OC Amb27966216 [0,2,0,0,0,0|1,0,0]=3 6477 B14R1.350 COc1cc(C(=O)O)cc(Br)c1C#N Amb24711993 [0,2,0,0,0,0|1,0,0]=3 6478 B14R1.350 COc1cc(C(=O)O)cc(Br)c1OC Amb2747636 [0,2,0,0,0,0|0,0,0]=2 6479 B14R1.350 COc1cc(C(=O)O)cc(C)c1C#N Amb26644195 [0,2,0,0,0,0|1,0,0]=3 6480 B14R1.350 COc1cc(C(=O)O)cc(C)c1OC Amb27237302 [0,2,0,0,0,0|0,0,0]=2 6481 B14R1.350 COc1cc(C(=O)O)cc(Cl)c1C#N Amb27209092 [0,2,0,0,0,0|1,0,0]=3 6482 B14R1.350 COc1cc(C(=O)O)cc(Cl)c1OC Amb1105240 [0,2,0,0,0,0|0,0,0]=2 6483 B14R1.350 COc1cc(C(=O)O)cc(F)c1C#N Amb26892799 [0,2,0,0,0,0|1,0,0]=3 6484 B14R1.350 COc1cc(C(=O)O)cc(F)c1OC Amb26334942 [0,2,0,0,0,0|0,0,0]=2 6485 B14R1.350 COc1cc(C(=O)O)cc(I)c1C#N Amb27635496 [0,2,0,0,0,0|1,0,0]=3 6486 B14R1.350 COc1cc(C(=O)O)cc(N)c1OC Amb19002003 [0,2,0,0,0,0|0,0,0]=2 6487 B14R1.350 COc1cc(C(=O)O)cc(N)c1OC Amb24117553 [0,2,0,0,0,0|0,0,0]=2 6488 B14R1.350 COc1cc(C(=O)O)cc(O)c1C#N Amb27424091 [0,2,0,0,0,0|1,0,0]=3 6489 B14R1.350 COc1cc(C(=O)O)cc(O)c1OC Amb3987593 [0,2,0,0,0,0|0,0,0]=2 6490 B14R1.350 COc1cc(C(=O)O)cc(S)c1OC Amb28121537 [0,2,0,0,0,0|0,0,0]=2 6491 B14R1.350 COc1cc(C(=O)O)nc(C)c1OC Amb27186260 [0,2,0,0,0,0|1,0,0]=3 6492 B14R1.350 COc1cc(C(C)=O)cc(Br)c1OC Amb25705254 [0,2,0,0,0,0|1,0,0]=3 6493 B14R1.350 COc1cc(C(C)=O)cc(C)c1OC Amb2228833 [0,2,0,0,0,0|1,0,0]=3 6494 B14R1.350 COc1cc(C(C)=O)cc(Cl)c1OC Amb26436291 [0,2,0,0,0,0|1,0,0]=3 6495 B14R1.350 COc1cc(C(C)=O)cc(I)c1OC Amb27848213 [0,2,0,0,0,0|1,0,0]=3 6496 B14R1.350 COc1cc(C(C)=O)cc(N)c1OC Amb27813313 [0,2,0,0,0,0|1,0,0]=3 6497 B14R1.350 COc1cc(C(C)=O)cc(O)c1OC Amb28340510 [0,2,0,0,0,0|1,0,0]=3 6498 B14R1.350 COc1cc(C(N)=O)cc(Cl)c1OC Amb2304077 [0,2,0,0,0,0|1,0,0]=3 6499 B14R1.350 COc1cc(C(N)=O)cc(F)c1OC Amb27797443 [0,2,0,0,0,0|1,0,0]=3 6500 B14R1.350 COc1cc(C(N)=O)cc(F)c1SC Amb27866403 [0,2,0,0,0,0|1,1,0]=4 6501 B14R1.350 COc1cc(C(N)=O)cc(I)c1OC Amb2641786 [0,2,0,0,0,0|1,0,0]=3 6502 B14R1.350 COc1cc(C(N)=S)cc(Br)c1OC Amb5541918 [0,2,0,0,0,0|1,1,0]=4 6503 B14R1.350 COc1cc(C(N)=S)cc(Cl)c1OC Amb5762782 [0,2,0,0,0,0|1,1,0]=4 6504 B14R1.350 COc1cc(C(N)=S)cc(O)c1OC Amb27240325 [0,2,0,0,0,0|1,1,0]=4 6505 B14R1.350 COc1cc([C@@H](C)O)cc(Br)c1OC Amb33432735 [0,2,0,0,0,0|1,0,1]=4 6506 B14R1.350 COc1cc([C@@H](C)O)cc(Cl)c1OC Amb27181451 [0,2,0,0,0,0|1,0,1]=4 6507 B14R1.350 COc1cc([C@H](C)O)cc(Br)c1OC Amb33432736 [0,2,0,0,0,0|1,0,1]=4 6508 B14R1.350 COc1cc([C@H](C)O)cc(Cl)c1OC Amb27181450 [0,2,0,0,0,0|1,0,1]=4 6509 B14R1.350 COc1cc([N+](=O)[O-])cc(F)c1OC Amb26613278 [0,2,0,0,0,0|1,0,1]=4 6510 B14R1.350 COc1nc(C(=O)O)cc(N)c1C#N Amb27611764 [0,2,0,0,0,0|2,0,0]=4 6511 B14R1.350 Cc1cc(C(=O)O)cc(C#N)c1CO Amb24664626 [0,2,0,0,0,0|2,0,0]=4 6512 B14R1.350 N#Cc1cc(C(=O)O)cc(Br)c1CO Amb27777552 [0,2,0,0,0,0|2,0,0]=4 6513 B14R1.350 N#Cc1cc(C(=O)O)cc(Cl)c1CO Amb28284626 [0,2,0,0,0,0|2,0,0]=4 6514 B14R1.350 N#Cc1cc(C(=O)O)cc(S)c1CO Amb27237773 [0,2,0,0,0,0|2,0,0]=4 6515 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1Br Amb26422044 [0,2,0,0,0,0|2,0,0]=4 6516 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1C Amb25975619 [0,2,0,0,0,0|2,0,0]=4 6517 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1Cl Amb26452611 [0,2,0,0,0,0|2,0,0]=4 6518 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1I Amb24742712 [0,2,0,0,0,0|2,0,0]=4 6519 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1O Amb25217089 [0,2,0,0,0,0|1,0,0]=3 6520 B14R1.362 CCc1cc(C(=O)O)cc(C#N)c1S Amb24528351 [0,2,0,0,0,0|1,1,0]=4 6521 B14R1.362 CCc1cc(C(=O)O)cc(CC)c1O Amb25808630 [0,2,0,0,0,0|1,0,0]=3 6522 B14R1.362 CCc1cc(C(C)=O)cc(CC)c1O Amb27256675 [0,2,0,0,0,0|2,0,0]=4 6523 B14R1.362 COc1cc(C(=N)N)cc(OC)c1O Amb26845474 [0,2,0,0,0,0|2,0,0]=4 6524 B14R1.362 COc1cc(C(=O)Cl)cc(OC)c1Br Amb24079083 [0,2,0,0,0,0|2,0,0]=4 6525 B14R1.362 COc1cc(C(=O)Cl)cc(OC)c1C Amb9855239 [0,2,0,0,0,0|2,0,0]=4 6526 B14R1.362 COc1cc(C(=O)Cl)cc(OC)c1O Amb28201062 [0,2,0,0,0,0|1,0,0]=3 6527 B14R1.362 COc1cc(C(=O)O)cc(C#N)c1Br Amb25241751 [0,2,0,0,0,0|1,0,0]=3 6528 B14R1.362 COc1cc(C(=O)O)cc(C#N)c1C Amb25226703 [0,2,0,0,0,0|1,0,0]=3 6529 B14R1.362 COc1cc(C(=O)O)cc(C=O)c1O Amb26405839 [0,2,0,0,0,0|0,0,0]=2 6530 B14R1.362 COc1cc(C(=O)O)cc(CN)c1O Amb24117605 [0,2,0,0,0,0|0,0,0]=2 6531 B14R1.362 COc1cc(C(=O)O)cc(CO)c1O Amb28320718 [0,2,0,0,0,0|0,0,0]=2 6532 B14R1.362 COc1cc(C(=O)O)cc(OC)c1Br Amb1233277 [0,2,0,0,0,0|1,0,0]=3 6533 B14R1.362 COc1cc(C(=O)O)cc(OC)c1C Amb3939861 [0,2,0,0,0,0|1,0,0]=3 6534 B14R1.362 COc1cc(C(=O)O)cc(OC)c1Cl Amb26036740 [0,2,0,0,0,0|1,0,0]=3 6535 B14R1.362 COc1cc(C(=O)O)cc(OC)c1F Amb26064887 [0,2,0,0,0,0|1,0,0]=3 6536 B14R1.362 COc1cc(C(=O)O)cc(OC)c1N Amb6296457 [0,2,0,0,0,0|1,0,0]=3 6537 B14R1.362 COc1cc(C(=O)O)cc(OC)c1O Amb1280562 [0,2,0,0,0,0|0,0,0]=2 6538 B14R1.362 COc1cc(C(=O)O)nc(OC)c1C Amb28196131 [0,2,0,0,0,0|2,0,0]=4 6539 B14R1.362 COc1cc(C(C)=O)cc(OC)c1Br Amb33452143 [0,2,0,0,0,0|2,0,0]=4 6540 B14R1.362 COc1cc(C(C)=O)cc(OC)c1C Amb6298133 [0,2,0,0,0,0|2,0,0]=4 6541 B14R1.362 COc1cc(C(C)=O)cc(OC)c1F Amb27636757 [0,2,0,0,0,0|2,0,0]=4 6542 B14R1.362 COc1cc(C(C)=O)cc(OC)c1I Amb27613978 [0,2,0,0,0,0|2,0,0]=4 6543 B14R1.362 COc1cc(C(C)=O)cc(OC)c1O Amb3940480 [0,2,0,0,0,0|1,0,0]=3 6544 B14R1.362 COc1cc(C(C)O)cc(OC)c1O Amb16192679 [0,2,0,0,0,0|1,0,1]=4 6545 B14R1.362 COc1cc(C(N)=O)cc(OC)c1Br Amb8998362 [0,2,0,0,0,0|2,0,0]=4 6546 B14R1.362 COc1cc(C(N)=O)cc(OC)c1C Amb401808 [0,2,0,0,0,0|2,0,0]=4 6547 B14R1.362 COc1cc(C(N)=O)cc(OC)c1I Amb26557393 [0,2,0,0,0,0|2,0,0]=4 6548 B14R1.362 COc1cc(C(N)=S)cc(OC)c1O Amb27240323 [0,2,0,0,0,0|1,1,0]=4 6549 B14R1.362 COc1cc([C@@H](C)O)cc(OC)c1O Amb24472322 [0,2,0,0,0,0|1,0,1]=4 6550 B14R1.362 COc1cc([C@H](C)O)cc(OC)c1O Amb25665790 [0,2,0,0,0,0|1,0,1]=4 6551 B14R1.362 COc1cc([N+](=O)[O-])cc(C=O)c1O Amb1793415 [0,2,0,0,0,0|1,0,1]=4 6552 B14R1.362 COc1cc([N+](=O)[O-])cc(CO)c1O Amb837481 [0,2,0,0,0,0|1,0,1]=4 6553 B14R1.362 COc1cc([N+](=O)[O-])cc(OC)c1O Amb22483569 [0,2,0,0,0,0|1,0,1]=4 6554 B14R1.362 N#Cc1cc(C(=O)O)cc(CCl)c1O Amb27234060 [0,2,0,0,0,0|2,0,0]=4 6555 B14R1.362 N#Cc1cc(C(=O)O)cc(CN)c1O Amb26381438 [0,2,0,0,0,0|2,0,0]=4 6556 B14R1.362 N#Cc1cc(C(=O)O)cc(CO)c1O Amb27201834 [0,2,0,0,0,0|2,0,0]=4 6557 B14R1.569 CCc1cc(C(C)=O)c(O)c(O)c1O Amb18130265 [0,2,0,0,0,0|2,0,0]=4 6558 B14R1.569 COc1cc(C(=O)Cl)c(F)c(F)c1F Amb19891029 [0,2,0,0,0,0|2,0,0]=4 6559 B14R1.569 COc1cc(C(=O)O)c(Br)c(Br)c1O Amb27194335 [0,2,0,0,0,0|0,0,0]=2 6560 B14R1.569 COc1cc(C(=O)O)c(F)c(F)c1C Amb22738498 [0,2,0,0,0,0|1,0,0]=3 6561 B14R1.569 COc1cc(C(=O)O)c(F)c(F)c1Cl Amb34911772 [0,2,0,0,0,0|1,0,0]=3 6562 B14R1.569 COc1cc(C(=O)O)c(F)c(F)c1F Amb10602507 [0,2,0,0,0,0|1,0,0]=3 6563 B14R1.569 COc1cc(C(C)=O)c(F)c(F)c1C Amb22738534 [0,2,0,0,0,0|2,0,0]=4 6564 B14R1.569 COc1cc(C(C)=O)c(F)c(F)c1F Amb27613870 [0,2,0,0,0,0|2,0,0]=4 6565 B14R1.569 COc1cc(C(N)=O)c(F)c(F)c1F Amb25223809 [0,2,0,0,0,0|2,0,0]=4 6566 B14R1.569 COc1nc(C(=O)O)c(Cl)c(Cl)c1Cl Amb22750479 [0,2,0,0,0,0|2,0,0]=4 6567 B14R1.569 Cc1c(O)c(C=O)cc(C(=O)O)c1Cl Amb27624207 [0,2,0,0,0,0|2,0,0]=4 6568 B14R1.5293 CCOC1=C(Br)C(=O)OC(C(=O)O)=C1 Amb33741700 [0,2,0,0,0,0|2,0,0]=4 6569 B14R1.5293 CCOc1cc(C(=N)N)cc(Br)c1O Amb27181760 [0,2,0,0,0,0|2,0,0]=4 6570 B14R1.5293 CCOc1cc(C(=O)Cl)cc(F)c1F Amb25737050 [0,2,0,0,0,0|2,0,0]=4 6571 B14R1.5293 CCOc1cc(C(=O)O)cc(Br)c1O Amb25729852 [0,2,0,0,0,0|0,0,0]=2 6572 B14R1.5293 CCOc1cc(C(=O)O)cc(Cl)c1O Amb1105076 [0,2,0,0,0,0|0,0,0]=2 6573 B14R1.5293 CCOc1cc(C(=O)O)cc(F)c1C Amb23596314 [0,2,0,0,0,0|1,0,0]=3 6574 B14R1.5293 CCOc1cc(C(=O)O)cc(F)c1F Amb25238709 [0,2,0,0,0,0|1,0,0]=3 6575 B14R1.5293 CCOc1cc(C(=O)O)cc(O)c1Br Amb27183382 [0,2,0,0,0,0|1,0,0]=3 6576 B14R1.5293 CCOc1cc(C(C)=O)cc(Br)c1O Amb33434390 [0,2,0,0,0,0|1,0,0]=3 6577 B14R1.5293 CCOc1cc(C(C)=O)cc(F)c1F Amb24382627 [0,2,0,0,0,0|2,0,0]=4 6578 B14R1.5293 CCOc1cc(C(N)=S)cc(Br)c1O Amb33434947 [0,2,0,0,0,0|1,1,0]=4 6579 B14R1.5293 CCOc1cc([C@@H](C)O)cc(Br)c1O Amb33434565 [0,2,0,0,0,0|1,0,1]=4 6580 B14R1.5293 CCOc1cc([C@H](C)O)cc(Br)c1O Amb33434567 [0,2,0,0,0,0|1,0,1]=4 6581 B14R1.12249 CNc1c(N)c(C(=O)O)cc(F)c1F Amb28385104 [0,2,0,0,0,0|2,0,0]=4 6582 B14R1.12249 COc1c(C)c(C(=O)O)cc(C)c1F Amb27442146 [0,2,0,0,0,0|1,0,0]=3 6583 B14R1.12249 COc1c(C)c(C(=O)O)nc(C)c1Br Amb27968017 [0,2,0,0,0,0|2,0,0]=4 6584 B14R1.12249 COc1c(C)c(C(C)=O)cc(C)c1F Amb27201960 [0,2,0,0,0,0|2,0,0]=4 6585 B14R1.12249 COc1c(C)c(C)cc(C(=O)O)c1C Amb8392283 [0,2,0,0,0,0|1,0,0]=3 6586 B14R1.12249 COc1c(C)c(C)cc(C(=O)O)c1N Amb18652079 [0,2,0,0,0,0|1,0,0]=3 6587 B14R1.12249 COc1c(F)c(F)cc(C(=O)Cl)c1F Amb2725684 [0,2,0,0,0,0|2,0,0]=4 6588 B14R1.12249 COc1c(F)c(F)cc(C(=O)O)c1F Amb2689287 [0,2,0,0,0,0|1,0,0]=3 6589 B14R1.12249 COc1c(F)c(F)cc(C(N)=O)c1F Amb10841375 [0,2,0,0,0,0|2,0,0]=4 6590 B14R1.12249 COc1c(N)c(C(=O)O)cc(Br)c1Cl Amb28436365 [0,2,0,0,0,0|1,0,0]=3 6591 B14R1.12249 COc1c(N)c(C(=O)O)cc(Cl)c1Br Amb25350834 [0,2,0,0,0,0|1,0,0]=3 6592 B14R1.12249 COc1c(N)c(C(=O)O)cc(F)c1Br Amb27633517 [0,2,0,0,0,0|1,0,0]=3 6593 B14R1.12249 COc1c(O)c(C(C)=O)cc(Cl)c1F Amb28199176 [0,2,0,0,0,0|2,0,0]=4 6594 B14R1.12249 COc1c(O)c(O)cc(C(=O)O)c1O Amb25908149 [0,2,0,0,0,0|0,0,0]=2 6595 B14R1.441 C=CCc1cc(C(=O)O)ccc1OC Amb2721995 [0,2,0,0,0,0|1,0,1]=4 6596 B14R1.441 CCOc1cc(B(O)O)ccc1OC Amb20075829 [0,2,0,0,0,0|1,0,1]=4 6597 B14R1.441 CCOc1cc(C(=N)N)ccc1OC Amb4297140 [0,2,0,0,0,0|2,0,0]=4 6598 B14R1.441 CCOc1cc(C(=O)Cl)ccc1OC Amb17143627 [0,2,0,0,0,0|1,0,0]=3 6599 B14R1.441 CCOc1cc(C(=O)O)ccc1C=O Amb32665294 [0,2,0,0,0,0|0,0,1]=3 6600 B14R1.441 CCOc1cc(C(=O)O)ccc1OC Amb1215276 [0,2,0,0,0,0|0,0,0]=2 6601 B14R1.441 CCOc1cc(C(=O)[O-])ccc1OC Amb33513288 [0,2,0,0,0,0|0,0,1]=3 6602 B14R1.441 CCOc1cc(C(C)=O)ccc1OC Amb22499612 [0,2,0,0,0,0|1,0,0]=3 6603 B14R1.441 CCOc1cc(C(N)=O)ccc1OC Amb1963285 [0,2,0,0,0,0|1,0,0]=3 6604 B14R1.441 CCOc1cc(C(N)=S)ccc1OC Amb5769129 [0,2,0,0,0,0|1,1,0]=4 6605 B14R1.441 CCOc1cc([C@@H](C)O)ccc1OC Amb33359568 [0,2,0,0,0,0|1,0,1]=4 6606 B14R1.441 CCOc1cc([C@H](C)O)ccc1OC Amb33449340 [0,2,0,0,0,0|1,0,1]=4 6607 B14R1.441 CCSc1cc(C(=O)O)ccc1C#N Amb24445364 [0,2,0,0,0,0|1,1,0]=4 6608 B14R1.441 COCc1cc(B(O)O)ccc1OC Amb19053000 [0,2,0,0,0,0|1,0,1]=4 6609 B14R1.441 COCc1cc(C(=O)O)ccc1OC Amb9173540 [0,2,0,0,0,0|0,0,0]=2 6610 B14R1.441 COCc1cc(C(C)=O)ccc1OC Amb423525 [0,2,0,0,0,0|1,0,0]=3 6611 B14R1.441 COc1ccc(C(=O)O)cc1CC#N Amb28385741 [0,2,0,0,0,0|1,0,1]=4 6612 B14R1.441 COc1ccc(C(=O)O)cc1N=C=S Amb24336591 [0,2,0,0,0,0|1,0,1]=4 6613 B14R1.441 COc1ccc(C(=O)O)cc1NC#N Amb29870752 [0,2,0,0,0,0|1,0,1]=4 6614 B14R1.441 COc1ccc(C(=O)O)cc1NC=O Amb27395205 [0,2,0,0,0,0|1,0,1]=4 6615 B14R1.441 COc1ccc(C(C)=O)cc1CSC Amb7990412 [0,2,0,0,0,0|1,1,0]=4 6616 B14R1.676 CC(=N)Cc1cc(C(C)=O)ccc1O Amb28324411 [0,2,0,0,0,0|2,0,0]=4 6617 B14R1.676 CC(=O)Cc1cc(C(=O)O)ccc1C Amb25068455 [0,2,0,0,0,0|2,0,0]=4 6618 B14R1.676 CC(=O)Cc1cc(C(=O)O)ccc1F Amb27194862 [0,2,0,0,0,0|2,0,0]=4 6619 B14R1.676 CC(=O)Cc1cc(C(=O)O)ccc1S Amb27423613 [0,2,0,0,0,0|1,1,0]=4 6620 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1Br Amb23495738 [0,2,0,0,0,0|2,0,0]=4 6621 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1C Amb1119412 [0,2,0,0,0,0|2,0,0]=4 6622 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1Cl Amb6255246 [0,2,0,0,0,0|2,0,0]=4 6623 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1F Amb10610133 [0,2,0,0,0,0|2,0,0]=4 6624 B14R1.676 CC(=O)Nc1cc(C(=O)O)ccc1O Amb22735768 [0,2,0,0,0,0|1,0,0]=3 6625 B14R1.676 CC(=O)Nc1cc(C(C)=O)ccc1O Amb19831739 [0,2,0,0,0,0|2,0,0]=4 6626 B14R1.676 CC(=O)Oc1cc(C(=O)O)ccc1C Amb16231601 [0,2,0,0,0,0|1,0,0]=3 6627 B14R1.676 CC(=O)Oc1cc(C(=O)O)ccc1F Amb20247154 [0,2,0,0,0,0|1,0,0]=3 6628 B14R1.676 CC(=O)c1ccc(C)c(OC(F)F)c1 Amb33407301 [0,2,0,0,0,0|2,0,0]=4 6629 B14R1.676 CC(=O)c1ccc(O)c(CN(C)C)c1 Amb9283585 [0,2,0,0,0,0|2,0,0]=4 6630 B14R1.676 CC(C)Cc1cc(C(=O)O)ccc1F Amb27870648 [0,2,0,0,0,0|2,0,0]=4 6631 B14R1.676 CC(C)Cc1cc(C(=O)O)ccc1N Amb32697407 [0,2,0,0,0,0|2,0,0]=4 6632 B14R1.676 CC(C)Nc1cc(C(=O)O)ccc1N Amb26017398 [0,2,0,0,0,0|2,0,0]=4 6633 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1Br Amb26326990 [0,2,0,0,0,0|1,0,0]=3 6634 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1Cl Amb22001199 [0,2,0,0,0,0|1,0,0]=3 6635 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1F Amb26446255 [0,2,0,0,0,0|1,0,0]=3 6636 B14R1.676 CC(C)Oc1cc(C(=O)O)ccc1N Amb8963178 [0,2,0,0,0,0|1,0,0]=3 6637 B14R1.676 CC(C)Oc1cc(C(=O)O)cnc1F Amb27762578 [0,2,0,0,0,0|2,0,0]=4 6638 B14R1.676 CC(C)Oc1cc(C(=O)O)ncc1Br Amb32418352 [0,2,0,0,0,0|2,0,0]=4 6639 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1N Amb24666414 [0,2,0,0,0,0|2,0,0]=4 6640 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1N Amb32663719 [0,2,0,0,0,0|2,0,0]=4 6641 B14R1.676 CC(C)Oc1cc(C(N)=O)ccc1O Amb27419392 [0,2,0,0,0,0|1,0,0]=3 6642 B14R1.676 CC(C)Oc1cc([N+](=O)[O-])ccc1O Amb25716897 [0,2,0,0,0,0|1,0,1]=4 6643 B14R1.676 CC(C)Sc1cc(C(=O)O)ccc1Br Amb32672616 [0,2,0,0,0,0|1,1,0]=4 6644 B14R1.676 CC(C)Sc1cc(C(=O)O)ccc1Cl Amb4023361 [0,2,0,0,0,0|1,1,0]=4 6645 B14R1.676 CC(N)Cc1cc(C(=O)O)ccc1Br Amb27841679 [0,2,0,0,0,0|2,0,0]=4 6646 B14R1.676 CC(N)Cc1cc(C(=O)O)ccc1O Amb26589022 [0,2,0,0,0,0|1,0,0]=3 6647 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1Br Amb32722634 [0,2,0,0,0,0|2,0,0]=4 6648 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1F Amb19002536 [0,2,0,0,0,0|2,0,0]=4 6649 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1O Amb23559310 [0,2,0,0,0,0|1,0,0]=3 6650 B14R1.676 CN(C)Cc1cc(C(=O)O)ccc1O Amb24117547 [0,2,0,0,0,0|1,0,0]=3 6651 B14R1.676 CS(=O)Nc1cc(C(=O)O)ccc1Cl Amb27974421 [0,2,0,0,0,0|1,1,0]=4 6652 B14R1.676 CS(=O)Nc1cc(C(=O)O)ccc1F Amb28066810 [0,2,0,0,0,0|1,1,0]=4 6653 B14R1.676 CS(=O)Nc1cc(C(=O)O)ccc1I Amb27859318 [0,2,0,0,0,0|1,1,0]=4 6654 B14R1.676 CS(=O)Nc1cc(C(=O)O)ccc1O Amb27634427 [0,2,0,0,0,0|0,1,0]=3 6655 B14R1.676 C[C@H](N)Cc1cc(C(=O)O)ccc1Br Amb28324537 [0,2,0,0,0,0|2,0,0]=4 6656 B14R1.676 C[C@H](N)Cc1cc(C(N)=O)ccc1O Amb27224896 [0,2,0,0,0,0|2,0,0]=4 6657 B14R1.676 Cc1ccc(C(=O)O)cc1CC(C)N Amb27759286 [0,2,0,0,0,0|2,0,0]=4 6658 B14R1.676 Cc1ccc(C(=O)O)cc1OC(C)C Amb17483557 [0,2,0,0,0,0|1,0,0]=3 6659 B14R1.676 Cc1ccc(C(=O)O)cc1OC(F)F Amb18977440 [0,2,0,0,0,0|1,0,0]=3 6660 B14R1.676 NC(=O)c1ccc(F)c(OC(F)F)c1 Amb25951725 [0,2,0,0,0,0|2,0,0]=4 6661 B14R1.676 Nc1ccc(C(=O)O)cc1OC(F)F Amb8963176 [0,2,0,0,0,0|1,0,0]=3 6662 B14R1.676 O=C(Cl)c1ccc(Cl)c(OC(F)F)c1 Amb27876770 [0,2,0,0,0,0|2,0,0]=4 6663 B14R1.676 O=C(O)C1=CN(OC(F)F)C(=O)C=C1 Amb28129837 [0,2,0,0,0,0|1,0,1]=4 6664 B14R1.676 O=C(O)c1cc(OC(F)F)c(Cl)cn1 Amb26897131 [0,2,0,0,0,0|2,0,0]=4 6665 B14R1.676 O=C(O)c1cc(OC(F)F)c(F)cn1 Amb26965743 [0,2,0,0,0,0|2,0,0]=4 6666 B14R1.676 O=C(O)c1ccc(Br)c(OC(F)F)c1 Amb26379286 [0,2,0,0,0,0|1,0,0]=3 6667 B14R1.676 O=C(O)c1ccc(Cl)c(OC(F)F)n1 Amb28435244 [0,2,0,0,0,0|2,0,0]=4 6668 B14R1.676 O=C(O)c1ccc(F)c(OC(F)F)c1 Amb27231575 [0,2,0,0,0,0|1,0,0]=3 6669 B14R1.676 O=C(O)c1ccc(F)c(OC(F)F)n1 Amb27794483 [0,2,0,0,0,0|2,0,0]=4 6670 B14R1.676 O=C(O)c1ccc(I)c(OC(F)F)c1 Amb26462025 [0,2,0,0,0,0|1,0,0]=3 6671 B14R1.676 O=C(O)c1cnc(Cl)c(OC(F)F)c1 Amb27773680 [0,2,0,0,0,0|2,0,0]=4 6672 B14R1.676 O=C(O)c1cnc(F)c(OC(F)F)c1 Amb26572156 [0,2,0,0,0,0|2,0,0]=4 6673 B14R1.758 C#CCOc1cc(C(=O)O)ccc1Br Amb27813869 [0,2,0,0,0,0|1,0,0]=3 6674 B14R1.758 C#CCOc1cc(C(=O)O)ccc1C Amb19078132 [0,2,0,0,0,0|1,0,0]=3 6675 B14R1.758 C#CCSc1cc(C(=O)O)ccc1F Amb27202213 [0,2,0,0,0,0|1,1,0]=4 6676 B14R1.758 C=CCOc1cc(C(=O)O)ccc1F Amb30585366 [0,2,0,0,0,0|1,0,0]=3 6677 B14R1.758 C=CCOc1cc(C(=O)O)ccc1N Amb24085309 [0,2,0,0,0,0|1,0,0]=3 6678 B14R1.758 C=CCOc1cc([N+](=O)[O-])ccc1O Amb32644409 [0,2,0,0,0,0|1,0,1]=4 6679 B14R1.758 CCCCc1cc(C(=O)O)ccc1N Amb32697405 [0,2,0,0,0,0|2,0,0]=4 6680 B14R1.758 CCCNc1cc(C(=O)O)ccc1N Amb25101670 [0,2,0,0,0,0|2,0,0]=4 6681 B14R1.758 CCCOc1cc(C(=O)O)ccc1C Amb17483558 [0,2,0,0,0,0|1,0,0]=3 6682 B14R1.758 CCCOc1cc(C(=O)O)ccc1Cl Amb22001104 [0,2,0,0,0,0|1,0,0]=3 6683 B14R1.758 CCSCc1cc(C(C)=O)ccc1O Amb9654926 [0,2,0,0,0,0|1,1,0]=4 6684 B14R1.758 COCCN1C=C(C(=O)O)C=CC1=O Amb18307891 [0,2,0,0,0,0|1,0,1]=4 6685 B14R1.758 Cc1ccc(C(=O)O)cc1NCCN Amb27163623 [0,2,0,0,0,0|2,0,0]=4 6686 B14R1.758 Cc1ccc(C(=O)O)cc1OCC#N Amb18977424 [0,2,0,0,0,0|1,0,0]=3 6687 B14R1.758 N#CCCc1cc(C(=O)O)ccc1Br Amb27638882 [0,2,0,0,0,0|2,0,0]=4 6688 B14R1.758 N#CCCc1cc(C(=O)O)ccc1Cl Amb27844827 [0,2,0,0,0,0|2,0,0]=4 6689 B14R1.758 N#CCCc1cc(C(=O)O)ccc1F Amb27633741 [0,2,0,0,0,0|2,0,0]=4 6690 B14R1.758 N#CCCc1cc(C(=O)O)ccc1S Amb27619764 [0,2,0,0,0,0|1,1,0]=4 6691 B14R1.758 N#CCOc1cc(C(=O)O)ccc1Br Amb27657035 [0,2,0,0,0,0|1,0,0]=3 6692 B14R1.758 N#CCOc1cc(C(=O)O)ccc1N Amb8963123 [0,2,0,0,0,0|1,0,0]=3 6693 B14R1.758 NCCOc1cc([N+](=O)[O-])ccc1O Amb33080113 [0,2,0,0,0,0|1,0,1]=4 6694 B14R1.758 Nc1ccc(C(=O)O)cc1OCCO Amb8963194 [0,2,0,0,0,0|1,0,0]=3 6695 B14R1.758 O=C(O)c1ccc(Cl)c(NCCO)c1 Amb18933582 [0,2,0,0,0,0|2,0,0]=4 6696 B14R1.758 O=C(O)c1ccc(F)c(NCCO)c1 Amb18933586 [0,2,0,0,0,0|2,0,0]=4 6697 B14R1.3329 CCCc1cc(C(C)=O)c(O)cc1O Amb2778457 [0,2,0,0,0,0|2,0,0]=4 6698 B14R1.3329 CCNc1cc(C(=O)O)c(N)cc1F Amb18984755 [0,2,0,0,0,0|2,0,0]=4 6699 B14R1.3329 CCOc1cc(C(=O)O)c(Br)cc1C Amb25918133 [0,2,0,0,0,0|1,0,0]=3 6700 B14R1.3329 CCOc1cc(C(=O)O)c(F)cc1N Amb27777410 [0,2,0,0,0,0|1,0,0]=3 6701 B14R1.3329 CCOc1cc(C(=O)O)c(N)cc1Cl Amb27472554 [0,2,0,0,0,0|1,0,0]=3 6702 B14R1.3329 CCOc1cc(C(=O)O)c(N)cc1F Amb18984771 [0,2,0,0,0,0|1,0,0]=3 6703 B14R1.3329 CCOc1cc(C(N)=O)c(N)cc1F Amb18984772 [0,2,0,0,0,0|2,0,0]=4 6704 B14R1.3329 CCSc1cc(C(=O)O)c(N)cc1F Amb18984778 [0,2,0,0,0,0|1,1,0]=4 6705 B14R1.3329 CCSc1cc(C(C)=O)c(O)cc1O Amb27189443 [0,2,0,0,0,0|1,1,0]=4 6706 B14R1.3329 COCC1=C(C)NC(=O)C(C(=O)O)=C1 Amb18983812 [0,2,0,0,0,0|2,0,0]=4 6707 B14R1.5389 CCCc1c(O)ccc(C(C)=O)c1O Amb2778481 [0,2,0,0,0,0|2,0,0]=4 6708 B14R1.5389 CCOc1c(Cl)ccc(C(=O)Cl)c1F Amb22738090 [0,2,0,0,0,0|2,0,0]=4 6709 B14R1.5389 CCOc1c(Cl)ccc(C(=O)O)c1N Amb18977269 [0,2,0,0,0,0|1,0,0]=3 6710 B14R1.5389 CCOc1c(Cl)ccc(C(N)=O)c1F Amb22738203 [0,2,0,0,0,0|2,0,0]=4 6711 B14R1.5389 CCOc1c(F)ccc(C(=O)Cl)c1F Amb22047704 [0,2,0,0,0,0|2,0,0]=4 6712 B14R1.5389 CCOc1c(F)ccc(C(=O)O)c1F Amb22047554 [0,2,0,0,0,0|1,0,0]=3 6713 B14R1.5389 CCOc1c(F)ccc(C(C)=O)c1F Amb22047568 [0,2,0,0,0,0|2,0,0]=4 6714 B14R1.5389 CCOc1c(F)ccc(C(N)=O)c1F Amb22043628 [0,2,0,0,0,0|2,0,0]=4 6715 B14R1.1851 C=C(C)c1cc(OC)c(OC)cc1N Amb28184098 [0,2,0,0,0,0|2,0,0]=4 6716 B14R1.1851 CCc1cc(C(=O)O)c(Br)cc1C#N Amb26987749 [0,2,0,0,0,0|2,0,0]=4 6717 B14R1.1851 CCc1cc(C(=O)O)c(C)cc1C#N Amb25287500 [0,2,0,0,0,0|2,0,0]=4 6718 B14R1.1851 CCc1cc(C(=O)O)c(F)cc1C#N Amb27967532 [0,2,0,0,0,0|2,0,0]=4 6719 B14R1.1851 CCc1cc(C(=O)O)c(I)cc1C#N Amb26987864 [0,2,0,0,0,0|2,0,0]=4 6720 B14R1.1851 CCc1cc(C(=O)O)c(O)cc1C#N Amb28071388 [0,2,0,0,0,0|2,0,0]=4 6721 B14R1.1851 CCc1cc(C(=O)O)c(S)cc1C#N Amb24652901 [0,2,0,0,0,0|2,0,0]=4 6722 B14R1.1851 CCc1cc(Cl)c(C(=O)O)cc1SC Amb26982071 [0,2,0,0,0,0|1,1,0]=4 6723 B14R1.1851 CCc1cc(F)c(C(=O)O)cc1SC Amb25070770 [0,2,0,0,0,0|1,1,0]=4 6724 B14R1.1851 CCc1cc(N)c(C(=O)O)cc1OC Amb27403205 [0,2,0,0,0,0|1,0,0]=3 6725 B14R1.1851 COc1cc(Br)c(C(=N)N)cc1OC Amb24525258 [0,2,0,0,0,0|2,0,0]=4 6726 B14R1.1851 COc1cc(Br)c(C(=O)Cl)cc1OC Amb16230209 [0,2,0,0,0,0|1,0,0]=3 6727 B14R1.1851 COc1cc(Br)c(C(=O)O)cc1C#N Amb26012758 [0,2,0,0,0,0|2,0,0]=4 6728 B14R1.1851 COc1cc(Br)c(C(=O)O)cc1OC Amb2685126 [0,2,0,0,0,0|0,0,0]=2 6729 B14R1.1851 COc1cc(Br)c(C(C)=O)cc1OC Amb9205744 [0,2,0,0,0,0|1,0,0]=3 6730 B14R1.1851 COc1cc(Br)c(C(C)O)cc1OC Amb18057881 [0,2,0,0,0,0|1,0,1]=4 6731 B14R1.1851 COc1cc(Br)c(C(N)=O)cc1OC Amb18556453 [0,2,0,0,0,0|1,0,0]=3 6732 B14R1.1851 COc1cc(Br)c(C(N)=S)cc1OC Amb26318280 [0,2,0,0,0,0|1,1,0]=4 6733 B14R1.1851 COc1cc(Br)c(S(=O)[O-])cc1OC Amb27433680 [0,2,0,0,0,0|1,0,1]=4 6734 B14R1.1851 COc1cc(Br)c([C@@H](C)O)cc1OC Amb27806506 [0,2,0,0,0,0|1,0,1]=4 6735 B14R1.1851 COc1cc(Br)c([C@H](C)O)cc1OC Amb24635484 [0,2,0,0,0,0|1,0,1]=4 6736 B14R1.1851 COc1cc(Br)c([N+](=O)[O-])cc1OC Amb1102690 [0,2,0,0,0,0|1,0,1]=4 6737 B14R1.1851 COc1cc(C(=O)O)c(F)cc1C#N Amb27879096 [0,2,0,0,0,0|1,0,0]=3 6738 B14R1.1851 COc1cc(C(=O)O)c(I)cc1C#N Amb28245585 [0,2,0,0,0,0|1,0,0]=3 6739 B14R1.1851 COc1cc(C)c(B(O)O)cc1OC Amb28400153 [0,2,0,0,0,0|1,0,1]=4 6740 B14R1.1851 COc1cc(C)c(C(=N)N)cc1OC Amb18894417 [0,2,0,0,0,0|2,0,0]=4 6741 B14R1.1851 COc1cc(C)c(C(=O)O)cc1OC Amb17755403 [0,2,0,0,0,0|0,0,0]=2 6742 B14R1.1851 COc1cc(C)c(C(C)=O)cc1OC Amb3429604 [0,2,0,0,0,0|1,0,0]=3 6743 B14R1.1851 COc1cc(C)c(C(C)O)cc1OC Amb19053145 [0,2,0,0,0,0|1,0,1]=4 6744 B14R1.1851 COc1cc(C)c(C(N)=O)cc1OC Amb18894475 [0,2,0,0,0,0|1,0,0]=3 6745 B14R1.1851 COc1cc(C)c(S(=O)O)cc1OC Amb18225498 [0,2,0,0,0,0|1,0,0]=3 6746 B14R1.1851 COc1cc(C)c(S(=O)[O-])cc1OC Amb25793860 [0,2,0,0,0,0|1,0,1]=4 6747 B14R1.1851 COc1cc(C)c(S(C)=O)cc1OC Amb22731612 [0,2,0,0,0,0|2,0,0]=4 6748 B14R1.1851 COc1cc(C)c([N+](=O)[O-])cc1OC Amb2687380 [0,2,0,0,0,0|1,0,1]=4 6749 B14R1.1851 COc1cc(Cl)c(B(O)O)cc1OC Amb24453946 [0,2,0,0,0,0|1,0,1]=4 6750 B14R1.1851 COc1cc(Cl)c(C(=O)O)cc1OC Amb2685875 [0,2,0,0,0,0|0,0,0]=2 6751 B14R1.1851 COc1cc(Cl)c(C(=O)O)cc1SC Amb24702420 [0,2,0,0,0,0|0,1,0]=3 6752 B14R1.1851 COc1cc(Cl)c(C(C)=O)cc1OC Amb49931 [0,2,0,0,0,0|1,0,0]=3 6753 B14R1.1851 COc1cc(Cl)c(S(=O)[O-])cc1OC Amb32754317 [0,2,0,0,0,0|1,0,1]=4 6754 B14R1.1851 COc1cc(Cl)c([C@@H](C)O)cc1OC Amb27232471 [0,2,0,0,0,0|1,0,1]=4 6755 B14R1.1851 COc1cc(Cl)c([N+](=O)[O-])cc1OC Amb9272155 [0,2,0,0,0,0|1,0,1]=4 6756 B14R1.1851 COc1cc(F)c(B(O)O)cc1OC Amb25883492 [0,2,0,0,0,0|1,0,1]=4 6757 B14R1.1851 COc1cc(F)c(C(=O)O)cc1OC Amb18998934 [0,2,0,0,0,0|0,0,0]=2 6758 B14R1.1851 COc1cc(F)c(C(C)=O)cc1OC Amb19066838 [0,2,0,0,0,0|1,0,0]=3 6759 B14R1.1851 COc1cc(F)c(C(N)=O)cc1OC Amb27453451 [0,2,0,0,0,0|1,0,0]=3 6760 B14R1.1851 COc1cc(F)c(S(=O)Cl)cc1OC Amb27191917 [0,2,0,0,0,0|2,0,0]=4 6761 B14R1.1851 COc1cc(F)c(S(=O)[O-])cc1OC Amb25839688 [0,2,0,0,0,0|1,0,1]=4 6762 B14R1.1851 COc1cc(F)c([C@H](C)O)cc1OC Amb27397335 [0,2,0,0,0,0|1,0,1]=4 6763 B14R1.1851 COc1cc(F)c([N+](=O)[O-])cc1OC Amb9316869 [0,2,0,0,0,0|1,0,1]=4 6764 B14R1.1851 COc1cc(I)c(B(O)O)cc1OC Amb27844501 [0,2,0,0,0,0|1,0,1]=4 6765 B14R1.1851 COc1cc(I)c(C(=O)O)cc1OC Amb1137594 [0,2,0,0,0,0|0,0,0]=2 6766 B14R1.1851 COc1cc(I)c(C(C)=O)cc1OC Amb27613980 [0,2,0,0,0,0|1,0,0]=3 6767 B14R1.1851 COc1cc(N)c(C(=O)O)cc1OC Amb1232853 [0,2,0,0,0,0|0,0,0]=2 6768 B14R1.1851 COc1cc(N)c(C(=O)O)cc1SC Amb19148488 [0,2,0,0,0,0|0,1,0]=3 6769 B14R1.1851 COc1cc(N)c(C(C)=O)cc1OC Amb1894465 [0,2,0,0,0,0|1,0,0]=3 6770 B14R1.1851 COc1cc(N)c(C(N)=O)cc1OC Amb1120230 [0,2,0,0,0,0|1,0,0]=3 6771 B14R1.1851 COc1cc(N)c(C(N)=O)cc1SC Amb19148485 [0,2,0,0,0,0|1,1,0]=4 6772 B14R1.1851 COc1cc(N)c(C(N)=S)cc1OC Amb27654231 [0,2,0,0,0,0|1,1,0]=4 6773 B14R1.1851 COc1cc(N)c(N(=O)=O)cc1OC Amb22552552 [0,2,0,0,0,0|1,0,1]=4 6774 B14R1.1851 COc1cc(N)c([N+](=O)[O-])cc1OC Amb1106091 [0,2,0,0,0,0|1,0,1]=4 6775 B14R1.1851 COc1cc(O)c(C(=O)O)cc1OC Amb18652724 [0,2,0,0,0,0|0,0,0]=2 6776 B14R1.1851 COc1cc(O)c(C(C)=O)cc1OC Amb6325928 [0,2,0,0,0,0|1,0,0]=3 6777 B14R1.1851 COc1cc(O)c([N+](=O)[O-])cc1OC Amb17506746 [0,2,0,0,0,0|1,0,1]=4 6778 B14R1.1851 COc1cc(S)c(C(=O)O)cc1C#N Amb27813642 [0,2,0,0,0,0|2,0,0]=4 6779 B14R1.1851 COc1cc(S)c(C(=O)O)cc1OC Amb18131713 [0,2,0,0,0,0|0,0,0]=2 6780 B14R1.1851 COc1cc(S)c([N+](=O)[O-])cc1OC Amb33269677 [0,2,0,0,0,0|1,0,1]=4 6781 B14R1.1851 COc1cc([N+](=O)[O-])c(F)cc1CO Amb33624210 [0,2,0,0,0,0|1,0,1]=4 6782 B14R1.1851 CSc1cc(C(=O)O)c(Cl)cc1C#N Amb25304014 [0,2,0,0,0,0|1,1,0]=4 6783 B14R1.1851 CSc1cc(C(=O)O)c(F)cc1C#N Amb26378158 [0,2,0,0,0,0|1,1,0]=4 6784 B14R1.1851 N#Cc1cc(C(=O)O)c(Br)cc1CO Amb28132835 [0,2,0,0,0,0|2,0,0]=4 6785 B14R1.1851 N#Cc1cc(C(=O)O)c(Cl)cc1CO Amb27634162 [0,2,0,0,0,0|2,0,0]=4 6786 B14R1.1851 N#Cc1cc(C(=O)O)c(F)cc1CO Amb28071432 [0,2,0,0,0,0|2,0,0]=4 6787 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1Br Amb27792413 [0,2,0,0,0,0|2,0,0]=4 6788 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1C Amb27777350 [0,2,0,0,0,0|2,0,0]=4 6789 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1Cl Amb24563593 [0,2,0,0,0,0|2,0,0]=4 6790 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1I Amb25920563 [0,2,0,0,0,0|2,0,0]=4 6791 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1O Amb27793562 [0,2,0,0,0,0|1,0,0]=3 6792 B14R1.2288 CCc1cc(C(=O)O)c(C#N)cc1S Amb27861113 [0,2,0,0,0,0|1,1,0]=4 6793 B14R1.2288 CCc1cc(C(C)=O)c(OC)cc1O Amb28365260 [0,2,0,0,0,0|2,0,0]=4 6794 B14R1.2288 CCc1cc(O)c(C#N)cc1C(=O)O Amb24578608 [0,2,0,0,0,0|2,0,0]=4 6795 B14R1.2288 COc1cc(C(=O)O)c(C#N)cc1Br Amb27873569 [0,2,0,0,0,0|1,0,0]=3 6796 B14R1.2288 COc1cc(C(=O)O)c(C#N)cc1C Amb28051674 [0,2,0,0,0,0|1,0,0]=3 6797 B14R1.2288 COc1cc(C(=O)O)c(C#N)cc1Cl Amb27966301 [0,2,0,0,0,0|1,0,0]=3 6798 B14R1.2288 COc1cc(C(=O)O)c(C#N)cc1S Amb27877035 [0,2,0,0,0,0|0,1,0]=3 6799 B14R1.2288 COc1cc(C(=O)O)c(C=O)cc1O Amb32658452 [0,2,0,0,0,0|0,0,0]=2 6800 B14R1.2288 COc1cc(C(=O)O)c(OC)cc1Br Amb19515929 [0,2,0,0,0,0|1,0,0]=3 6801 B14R1.2288 COc1cc(C(=O)O)c(OC)cc1C Amb18565803 [0,2,0,0,0,0|1,0,0]=3 6802 B14R1.2288 COc1cc(C(=O)O)c(OC)cc1Cl Amb3430181 [0,2,0,0,0,0|1,0,0]=3 6803 B14R1.2288 COc1cc(C(=O)O)c(OC)cc1F Amb27193504 [0,2,0,0,0,0|1,0,0]=3 6804 B14R1.2288 COc1cc(C(=O)O)c(OC)cc1O Amb27632490 [0,2,0,0,0,0|0,0,0]=2 6805 B14R1.2288 COc1cc(C(C)=O)c(OC)cc1Br Amb22232692 [0,2,0,0,0,0|2,0,0]=4 6806 B14R1.2288 COc1cc(C(C)=O)c(OC)cc1C Amb6360674 [0,2,0,0,0,0|2,0,0]=4 6807 B14R1.2288 COc1cc(C(C)=O)c(OC)cc1Cl Amb18057773 [0,2,0,0,0,0|2,0,0]=4 6808 B14R1.2288 COc1cc(C(C)=O)c(OC)cc1O Amb18652338 [0,2,0,0,0,0|1,0,0]=3 6809 B14R1.2288 COc1cc(C(C)=O)c(OC)cc1S Amb26963313 [0,2,0,0,0,0|1,1,0]=4 6810 B14R1.2288 COc1cc(C(C)O)c(OC)cc1O Amb27836819 [0,2,0,0,0,0|1,0,1]=4 6811 B14R1.2288 COc1cc(C(N)=O)c(OC)cc1Br Amb27451336 [0,2,0,0,0,0|2,0,0]=4 6812 B14R1.2288 COc1cc(C(N)=O)c(OC)cc1C Amb18894473 [0,2,0,0,0,0|2,0,0]=4 6813 B14R1.2288 COc1cc(C(N)=O)c(OC)cc1F Amb25981629 [0,2,0,0,0,0|2,0,0]=4 6814 B14R1.2288 COc1cc(N)c(SC)cc1C(=O)O Amb24383071 [0,2,0,0,0,0|1,1,0]=4 6815 B14R1.2288 COc1cc(S(=O)O)c(OC)cc1C Amb18225493 [0,2,0,0,0,0|2,0,0]=4 6816 B14R1.2288 COc1cc([N+](=O)[O-])c(C#N)cc1O Amb28322120 [0,2,0,0,0,0|1,0,1]=4 6817 B14R1.2288 COc1cc([N+](=O)[O-])c(C=O)cc1O Amb2692093 [0,2,0,0,0,0|1,0,1]=4 6818 B14R1.2288 COc1cc([N+](=O)[O-])c(CN)cc1O Amb18253268 [0,2,0,0,0,0|1,0,1]=4 6819 B14R1.2288 COc1cc([N+](=O)[O-])c(CO)cc1O Amb27470877 [0,2,0,0,0,0|1,0,1]=4 6820 B14R1.2288 COc1cc([N+](=O)[O-])c(OC)cc1O Amb26559422 [0,2,0,0,0,0|1,0,1]=4 6821 B14R1.2288 N#Cc1cc(C(=O)O)c(CN)cc1O Amb27597122 [0,2,0,0,0,0|2,0,0]=4 6822 B14R1.2288 N#Cc1cc(O)c(CN)cc1C(=O)O Amb25683529 [0,2,0,0,0,0|2,0,0]=4 6823 B14R1.2288 N#Cc1cc(O)c(CO)cc1C(=O)O Amb28434892 [0,2,0,0,0,0|2,0,0]=4 6824 B14R1.4189 CCN1C(=O)C(C(=O)O)=C(C)C=C1O Amb27626008 [0,2,0,0,0,0|2,0,0]=4 6825 B14R1.4189 COc1c(C)cc(C)c(C(=O)O)c1C Amb18137496 [0,2,0,0,0,0|1,0,0]=3 6826 B14R1.4189 COc1c(C)cc(C)c(C(=O)O)c1N Amb18652080 [0,2,0,0,0,0|1,0,0]=3 6827 B14R1.4189 COc1c(C)cc(C)c(C(C)=O)c1C Amb18669621 [0,2,0,0,0,0|2,0,0]=4 6828 B14R1.4189 COc1c(C)cc(C)c(C(N)=O)c1C Amb27862348 [0,2,0,0,0,0|2,0,0]=4 6829 B14R1.4189 COc1c(Cl)cc(Cl)c(C(=O)O)c1N Amb28119588 [0,2,0,0,0,0|1,0,0]=3 6830 B14R1.4189 COc1c(F)cc(C)c(C(=O)O)c1N Amb27657594 [0,2,0,0,0,0|1,0,0]=3 6831 B14R1.4189 COc1c(F)cc(C)c(C(C)=O)c1O Amb28195986 [0,2,0,0,0,0|2,0,0]=4 6832 B14R1.4189 COc1c(F)cc(F)c(C(=O)Cl)c1F Amb27614056 [0,2,0,0,0,0|2,0,0]=4 6833 B14R1.4189 COc1c(F)cc(F)c(C(C)=O)c1O Amb28435400 [0,2,0,0,0,0|2,0,0]=4 6834 B14R1.43 C=Cc1cc(C(=O)O)ccc1C(=O)O Amb24711269 [0,2,0,0,0,0|1,0,1]=4 6835 B14R1.43 CCc1cc(C(=O)O)ccc1C(=O)O Amb25063812 [0,2,0,0,0,0|1,0,0]=3 6836 B14R1.43 CCc1cc(C(=O)O)ccc1N(C)C Amb27237799 [0,2,0,0,0,0|2,0,0]=4 6837 B14R1.43 CNc1cc(C(=O)O)ccc1[N+](=O)[O-] Amb22001368 [0,2,0,0,0,0|1,0,1]=4 6838 B14R1.43 COc1cc(B(O)O)ccc1C(=O)O Amb13890542 [0,2,0,0,0,0|1,0,1]=4 6839 B14R1.43 COc1cc(C(=O)Cl)ccc1[N+](=O)[O-] Amb27647638 [0,2,0,0,0,0|1,0,1]=4 6840 B14R1.43 COc1cc(C(=O)O)ccc1B(O)O Amb21963467 [0,2,0,0,0,0|0,0,0]=2 6841 B14R1.43 COc1cc(C(=O)O)ccc1C(=O)O Amb18652280 [0,2,0,0,0,0|0,0,0]=2 6842 B14R1.43 COc1cc(C(=O)O)ccc1C(C)=O Amb27773823 [0,2,0,0,0,0|0,0,1]=3 6843 B14R1.43 COc1cc(C(=O)O)ccc1C(C)C Amb23447100 [0,2,0,0,0,0|1,0,0]=3 6844 B14R1.43 COc1cc(C(=O)O)ccc1C(C)N Amb27602630 [0,2,0,0,0,0|1,0,0]=3 6845 B14R1.43 COc1cc(C(=O)O)ccc1C(F)F Amb33728793 [0,2,0,0,0,0|1,0,0]=3 6846 B14R1.43 COc1cc(C(=O)O)ccc1C(N)=O Amb24091355 [0,2,0,0,0,0|0,0,1]=3 6847 B14R1.43 COc1cc(C(=O)O)ccc1[N+](=O)[O-] Amb8396006 [0,2,0,0,0,0|0,0,1]=3 6848 B14R1.43 COc1cc(C(=O)O)cnc1C(=O)O Amb27231849 [0,2,0,0,0,0|1,0,0]=3 6849 B14R1.43 COc1cc(C(=O)O)cnc1C(F)F Amb27601037 [0,2,0,0,0,0|2,0,0]=4 6850 B14R1.43 COc1cc(C(=O)O)ncc1B(O)O Amb24530708 [0,2,0,0,0,0|1,0,0]=3 6851 B14R1.43 COc1cc(C(=O)O)ncc1C(C)C Amb27878500 [0,2,0,0,0,0|2,0,0]=4 6852 B14R1.43 COc1cc(C(=O)O)ncc1C(F)F Amb25710406 [0,2,0,0,0,0|2,0,0]=4 6853 B14R1.43 COc1cc(C(=O)[O-])ccc1S(=O)[O-] Amb32755779 [0,2,0,0,0,0|0,0,2]=4 6854 B14R1.43 COc1cc(C(C)=O)ccc1C(=O)O Amb27641579 [0,2,0,0,0,0|1,0,0]=3 6855 B14R1.43 COc1cc(C(C)=O)ccc1[N+](=O)[O-] Amb2608828 [0,2,0,0,0,0|1,0,1]=4 6856 B14R1.43 COc1cc(C(N)=O)ccc1B(O)O Amb24526086 [0,2,0,0,0,0|1,0,0]=3 6857 B14R1.43 COc1cc(C(N)=O)ccc1C(=O)O Amb32679493 [0,2,0,0,0,0|1,0,0]=3 6858 B14R1.43 COc1cc(C(N)=O)ccc1[N+](=O)[O-] Amb21929416 [0,2,0,0,0,0|1,0,1]=4 6859 B14R1.43 COc1cc(N(=O)O)ccc1C(=O)O Amb33789322 [0,2,0,0,0,0|1,0,0]=3 6860 B14R1.43 COc1cc(S(C)=O)ccc1C(=O)O Amb28428596 [0,2,0,0,0,0|2,0,0]=4 6861 B14R1.43 COc1cc([N+](=O)[O-])ccc1B(O)O Amb17226541 [0,2,0,0,0,0|1,0,1]=4 6862 B14R1.43 COc1cc([N+](=O)[O-])ccc1C(=O)O Amb2689163 [0,2,0,0,0,0|1,0,1]=4 6863 B14R1.43 COc1cc([N+](=O)[O-])ccc1[C@@H](C)O Amb32880624 [0,2,0,0,0,0|1,0,1]=4 6864 B14R1.43 COc1cc([N+](=O)[O-])ccc1[C@H](C)O Amb32880623 [0,2,0,0,0,0|1,0,1]=4 6865 B14R1.43 COc1nc(C(=O)O)ccc1B(O)O Amb26347926 [0,2,0,0,0,0|1,0,0]=3 6866 B14R1.43 COc1nc(C(=O)O)ccc1C(F)F Amb27157188 [0,2,0,0,0,0|2,0,0]=4 6867 B14R1.43 COc1nc(C(=O)O)ccc1[N+](=O)[O-] Amb22263356 [0,2,0,0,0,0|1,0,1]=4 6868 B14R1.43 CSc1cc(C(=O)O)ccc1C(=O)O Amb25308299 [0,2,0,0,0,0|0,1,0]=3 6869 B14R1.43 CSc1cc(C(=O)O)ccc1[N+](=O)[O-] Amb24394722 [0,2,0,0,0,0|0,1,1]=4 6870 B14R1.43 N#Cc1cc(C(=O)O)ccc1C(=O)O Amb24358063 [0,2,0,0,0,0|2,0,0]=4 6871 B14R1.43 NNc1cc(C(=O)O)ccc1C(=O)O Amb19805075 [0,2,0,0,0,0|2,0,0]=4 6872 B14R1.43 O=Cc1cc(C(=O)O)ccc1C(=O)O Amb25825713 [0,2,0,0,0,0|2,0,0]=4 6873 B14R1.43 O=Nc1cc(C(=O)O)ccc1C(=O)O Amb28325725 [0,2,0,0,0,0|2,0,0]=4 6874 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1Br Amb26896376 [0,2,0,0,0,0|2,0,0]=4 6875 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1C Amb27791007 [0,2,0,0,0,0|2,0,0]=4 6876 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1F Amb27877047 [0,2,0,0,0,0|2,0,0]=4 6877 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1I Amb25920567 [0,2,0,0,0,0|2,0,0]=4 6878 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1O Amb24754153 [0,2,0,0,0,0|2,0,0]=4 6879 B14R1.2023 CCc1c(C#N)ccc(C(=O)O)c1S Amb24528353 [0,2,0,0,0,0|2,0,0]=4 6880 B14R1.2023 CCc1c(OC)ccc(C(C)=O)c1N Amb28047280 [0,2,0,0,0,0|2,0,0]=4 6881 B14R1.2023 COc1c(C#N)ccc(C(=O)O)c1C Amb27657694 [0,2,0,0,0,0|1,0,0]=3 6882 B14R1.2023 COc1c(C#N)ccc(C(=O)O)c1Cl Amb27624734 [0,2,0,0,0,0|1,0,0]=3 6883 B14R1.2023 COc1c(C#N)ccc(C(=O)O)c1O Amb27791323 [0,2,0,0,0,0|1,0,0]=3 6884 B14R1.2023 COc1ccc(B(O)O)c(C)c1OC Amb28318170 [0,2,0,0,0,0|1,0,1]=4 6885 B14R1.2023 COc1ccc(B(O)O)c(O)c1OC Amb23438864 [0,2,0,0,0,0|1,0,1]=4 6886 B14R1.2023 COc1ccc(C(=N)N)c(Br)c1OC Amb33336451 [0,2,0,0,0,0|2,0,0]=4 6887 B14R1.2023 COc1ccc(C(=N)N)c(Cl)c1OC Amb28186898 [0,2,0,0,0,0|2,0,0]=4 6888 B14R1.2023 COc1ccc(C(=O)Cl)c(F)c1OC Amb27192614 [0,2,0,0,0,0|1,0,0]=3 6889 B14R1.2023 COc1ccc(C(=O)Cl)c(I)c1OC Amb27967626 [0,2,0,0,0,0|1,0,0]=3 6890 B14R1.2023 COc1ccc(C(=O)O)c(Br)c1C#N Amb28071339 [0,2,0,0,0,0|2,0,0]=4 6891 B14R1.2023 COc1ccc(C(=O)O)c(Br)c1OC Amb18668304 [0,2,0,0,0,0|0,0,0]=2 6892 B14R1.2023 COc1ccc(C(=O)O)c(C)c1C#N Amb26638145 [0,2,0,0,0,0|2,0,0]=4 6893 B14R1.2023 COc1ccc(C(=O)O)c(C)c1OC Amb8629676 [0,2,0,0,0,0|0,0,0]=2 6894 B14R1.2023 COc1ccc(C(=O)O)c(Cl)c1OC Amb2722760 [0,2,0,0,0,0|0,0,0]=2 6895 B14R1.2023 COc1ccc(C(=O)O)c(F)c1C#N Amb26945919 [0,2,0,0,0,0|2,0,0]=4 6896 B14R1.2023 COc1ccc(C(=O)O)c(F)c1CN Amb32697498 [0,2,0,0,0,0|2,0,0]=4 6897 B14R1.2023 COc1ccc(C(=O)O)c(F)c1OC Amb24511181 [0,2,0,0,0,0|0,0,0]=2 6898 B14R1.2023 COc1ccc(C(=O)O)c(I)c1C#N Amb27209169 [0,2,0,0,0,0|2,0,0]=4 6899 B14R1.2023 COc1ccc(C(=O)O)c(N)c1OC Amb4009517 [0,2,0,0,0,0|0,0,0]=2 6900 B14R1.2023 COc1ccc(C(=O)O)c(O)c1OC Amb2099735 [0,2,0,0,0,0|0,0,0]=2 6901 B14R1.2023 COc1ccc(C(=O)O)c(S)c1C#N Amb28196008 [0,2,0,0,0,0|2,0,0]=4 6902 B14R1.2023 COc1ccc(C(=O)O)c(S)c1OC Amb27957688 [0,2,0,0,0,0|0,0,0]=2 6903 B14R1.2023 COc1ccc(C(C)=O)c(Br)c1OC Amb23400630 [0,2,0,0,0,0|1,0,0]=3 6904 B14R1.2023 COc1ccc(C(C)=O)c(C)c1OC Amb17595093 [0,2,0,0,0,0|1,0,0]=3 6905 B14R1.2023 COc1ccc(C(C)=O)c(Cl)c1OC Amb23400629 [0,2,0,0,0,0|1,0,0]=3 6906 B14R1.2023 COc1ccc(C(C)=O)c(F)c1OC Amb23400628 [0,2,0,0,0,0|1,0,0]=3 6907 B14R1.2023 COc1ccc(C(C)=O)c(I)c1OC Amb23400631 [0,2,0,0,0,0|1,0,0]=3 6908 B14R1.2023 COc1ccc(C(C)=O)c(N)c1OC Amb19957630 [0,2,0,0,0,0|1,0,0]=3 6909 B14R1.2023 COc1ccc(C(C)=O)c(O)c1OC Amb5717629 [0,2,0,0,0,0|1,0,0]=3 6910 B14R1.2023 COc1ccc(C(N)=O)c(Cl)c1OC Amb2722766 [0,2,0,0,0,0|1,0,0]=3 6911 B14R1.2023 COc1ccc(C(N)=O)c(F)c1OC Amb26067753 [0,2,0,0,0,0|1,0,0]=3 6912 B14R1.2023 COc1ccc(C(N)=O)c(I)c1OC Amb27613986 [0,2,0,0,0,0|1,0,0]=3 6913 B14R1.2023 COc1ccc(C(N)=O)c(N)c1OC Amb25684783 [0,2,0,0,0,0|1,0,0]=3 6914 B14R1.2023 COc1ccc(C(N)=O)c(O)c1OC Amb28248706 [0,2,0,0,0,0|1,0,0]=3 6915 B14R1.2023 COc1ccc(C(N)=S)c(Br)c1OC Amb33336450 [0,2,0,0,0,0|1,1,0]=4 6916 B14R1.2023 COc1ccc(C(N)=S)c(Cl)c1OC Amb27394039 [0,2,0,0,0,0|1,1,0]=4 6917 B14R1.2023 COc1ccc([C@@H](C)O)c(Br)c1OC Amb33336777 [0,2,0,0,0,0|1,0,1]=4 6918 B14R1.2023 COc1ccc([C@@H](C)O)c(Cl)c1OC Amb33259612 [0,2,0,0,0,0|1,0,1]=4 6919 B14R1.2023 COc1ccc([C@H](C)O)c(Br)c1OC Amb33336780 [0,2,0,0,0,0|1,0,1]=4 6920 B14R1.2023 COc1ccc([C@H](C)O)c(Cl)c1OC Amb33261439 [0,2,0,0,0,0|1,0,1]=4 6921 B14R1.2023 COc1ccc([N+](=O)[O-])c(Br)c1OC Amb22492420 [0,2,0,0,0,0|1,0,1]=4 6922 B14R1.2023 COc1ccc([N+](=O)[O-])c(Cl)c1OC Amb25181635 [0,2,0,0,0,0|1,0,1]=4 6923 B14R1.2023 COc1ccc([N+](=O)[O-])c(F)c1OC Amb28208736 [0,2,0,0,0,0|1,0,1]=4 6924 B14R1.2023 COc1cnc(C(=O)O)c(N)c1OC Amb27445665 [0,2,0,0,0,0|1,0,0]=3 6925 B14R1.2023 Cc1c(C(=O)O)ccc(CO)c1C#N Amb27633986 [0,2,0,0,0,0|2,0,0]=4 6926 B14R1.2023 N#Cc1c(CO)ccc(C(=O)O)c1Br Amb26559300 [0,2,0,0,0,0|2,0,0]=4 6927 B14R1.2023 N#Cc1c(CO)ccc(C(=O)O)c1O Amb28251419 [0,2,0,0,0,0|2,0,0]=4 6928 B14R1.6723 CCOc1ccc(B(O)O)cc1OC Amb20075828 [0,2,0,0,0,0|1,0,1]=4 6929 B14R1.6723 CCOc1ccc(C(=N)N)cc1OC Amb4297138 [0,2,0,0,0,0|2,0,0]=4 6930 B14R1.6723 CCOc1ccc(C(=O)Cl)cc1OC Amb17143626 [0,2,0,0,0,0|1,0,0]=3 6931 B14R1.6723 CCOc1ccc(C(=O)O)cc1C=O Amb20236773 [0,2,0,0,0,0|2,0,0]=4 6932 B14R1.6723 CCOc1ccc(C(=O)O)cc1CC Amb17204001 [0,2,0,0,0,0|1,0,0]=3 6933 B14R1.6723 CCOc1ccc(C(=O)O)cc1OC Amb1210637 [0,2,0,0,0,0|0,0,0]=2 6934 B14R1.6723 CCOc1ccc(C(C)=O)cc1OC Amb6256409 [0,2,0,0,0,0|1,0,0]=3 6935 B14R1.6723 CCOc1ccc(C(N)=O)cc1OC Amb1210681 [0,2,0,0,0,0|1,0,0]=3 6936 B14R1.6723 CCOc1ccc(C(N)=S)cc1OC Amb1105161 [0,2,0,0,0,0|1,1,0]=4 6937 B14R1.6723 CCOc1ccc([C@@H](C)O)cc1OC Amb33475125 [0,2,0,0,0,0|1,0,1]=4 6938 B14R1.6723 CCOc1ccc([C@H](C)O)cc1OC Amb33448726 [0,2,0,0,0,0|1,0,1]=4 6939 B14R1.6723 CCc1cc(C(=O)O)ccc1CC#N Amb24684888 [0,2,0,0,0,0|2,0,0]=4 6940 B14R1.6723 COCc1ccc(C(=O)O)cc1C#N Amb27812072 [0,2,0,0,0,0|2,0,0]=4 6941 B14R1.6723 COCc1ccc(C(=O)O)cc1OC Amb20669044 [0,2,0,0,0,0|0,0,0]=2 6942 B14R1.6723 COc1cc(C(=O)O)ccc1CC#N Amb26981990 [0,2,0,0,0,0|1,0,0]=3 6943 B14R1.6723 COc1cc(C(=O)O)ccc1CCN Amb32661268 [0,2,0,0,0,0|1,0,0]=3 6944 B14R1.6723 COc1cc(C(=O)O)ccc1CCN Amb32992724 [0,2,0,0,0,0|1,0,0]=3 6945 B14R1.6723 COc1cc([N+](=O)[O-])ccc1CCO Amb32881352 [0,2,0,0,0,0|1,0,1]=4 6946 B14R1.6723 COc1cc([N+](=O)[O-])ccc1CNO Amb32880893 [0,2,0,0,0,0|1,0,1]=4 6947 B14R1.6723 COc1cc([N+](=O)[O-])ccc1CON Amb33079460 [0,2,0,0,0,0|1,0,1]=4 6948 B14R1.4102 CCc1c(Br)ccc(C(=O)O)c1C#N Amb26896379 [0,2,0,0,0,0|2,0,0]=4 6949 B14R1.4102 CCc1c(C(=O)O)ccc(O)c1C#N Amb28208638 [0,2,0,0,0,0|2,0,0]=4 6950 B14R1.4102 CCc1c(C)ccc(C(=O)O)c1C#N Amb25300604 [0,2,0,0,0,0|2,0,0]=4 6951 B14R1.4102 CCc1c(Cl)ccc(C(=O)O)c1C#N Amb25951269 [0,2,0,0,0,0|2,0,0]=4 6952 B14R1.4102 CCc1c(I)ccc(C(=O)O)c1C#N Amb27872701 [0,2,0,0,0,0|2,0,0]=4 6953 B14R1.4102 CCc1c(O)ccc(C(=O)O)c1C#N Amb25349728 [0,2,0,0,0,0|1,0,0]=3 6954 B14R1.4102 CCc1c(S)ccc(C(=O)O)c1C#N Amb27646722 [0,2,0,0,0,0|1,1,0]=4 6955 B14R1.4102 COc1c(C)ccc(C(=O)O)c1C#N Amb25258008 [0,2,0,0,0,0|1,0,0]=3 6956 B14R1.4102 COc1c(C)ccc(C(=O)O)c1OC Amb18652370 [0,2,0,0,0,0|1,0,0]=3 6957 B14R1.4102 COc1c(F)ccc(C(=O)Cl)c1OC Amb27192611 [0,2,0,0,0,0|2,0,0]=4 6958 B14R1.4102 COc1c(F)ccc(C(=O)O)c1SC Amb27390122 [0,2,0,0,0,0|1,0,0]=3 6959 B14R1.4102 COc1c(F)ccc(C(N)=O)c1OC Amb27215573 [0,2,0,0,0,0|2,0,0]=4 6960 B14R1.4102 COc1c(I)ccc(C(C)=O)c1OC Amb28140752 [0,2,0,0,0,0|2,0,0]=4 6961 B14R1.4102 COc1c(I)ccc(C(N)=O)c1OC Amb27613981 [0,2,0,0,0,0|2,0,0]=4 6962 B14R1.4102 COc1c(O)ccc(C(C)=O)c1OC Amb5718570 [0,2,0,0,0,0|1,0,0]=3 6963 B14R1.4102 COc1c(S)ccc(C(=O)O)c1C#N Amb27796370 [0,2,0,0,0,0|0,1,0]=3 6964 B14R1.4102 N#Cc1c(C(=O)O)ccc(O)c1CO Amb28245586 [0,2,0,0,0,0|2,0,0]=4 6965 B14R1.4102 N#Cc1c(O)ccc(C(=O)O)c1C=O Amb27482095 [0,2,0,0,0,0|2,0,0]=4 6966 B14R1.4102 N#Cc1c(O)ccc(C(=O)O)c1CCl Amb24564565 [0,2,0,0,0,0|2,0,0]=4 6967 B14R1.4102 N#Cc1c(O)ccc(C(=O)O)c1CN Amb27481807 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.283 COCc1ccccc1C(=O)O Amb6892881 [0,0,1,1,0,0|1,0,1]=4 6969 B12R1.283 C\C=C\c1ccccc1C(=O)O Amb17666459 [0,0,1,1,0,0|2,0,0]=4 6970 B12R1.125 O=C(O)\C=C\c1ccccc1O Amb8513188 [0,0,1,1,0,0|1,0,1]=4 6971 B12R1.125 O=C(O)\C=C\c1cnccc1O Amb18646198 [0,0,1,1,0,0|2,0,0]=4 6972 B12R1.1903 COC1=C(O)C(=O)C=C(O)C=C1 Amb27177989 [0,0,1,1,0,0|2,0,0]=4 6973 B12R1.113 COCc1ccc(C(=O)O)cc1 Amb1215734 [0,0,1,1,0,0|1,0,1]=4 6974 B12R1.113 COCc1ccc(C(=O)O)cn1 Amb25060084 [0,0,1,1,0,0|1,0,1]=4 6975 B12R1.113 C\N=C\c1ccc(C(=O)O)cc1 Amb27758648 [0,0,1,1,0,0|2,0,0]=4 6976 B12R1.225 C=C(C(=O)O)c1cccc(O)c1 Amb33310954 [0,0,1,1,0,0|1,0,1]=4 6977 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 Amb26475473 [1,0,0,1,0,0|2,0,0]=4 6978 B12R2.1384 NC(=O)c1ccc2c(c1)CC2 Amb25077153 [1,0,0,1,0,0|2,0,0]=4 6979 B12R2.1384 O=C(Cl)c1ccc2c(c1)CC2 Amb25684227 [1,0,0,1,0,0|2,0,0]=4 6980 B12R2.1384 O=C(O)c1ccc2c(c1)CC2 Amb8395931 [1,0,0,1,0,0|1,0,0]=3 6981 B12R2.43 COc1cccc(C2CO2)c1 Amb9707197 [1,0,0,1,0,0|1,0,1]=4 6982 B12R2.43 COc1cccc([C@@H]2CO2)c1 Amb25677783 [1,0,0,1,0,0|1,0,1]=4 6983 B12R2.43 COc1cccc([C@H]2CO2)c1 Amb26633145 [1,0,0,1,0,0|1,0,1]=4 6984 B12R2.313 COc1cccc2c1CC2=O Amb27186101 [1,0,0,1,0,0|1,0,0]=3 6985 B12R2.326 COc1ccc2c(c1)C(=O)C2 Amb17843963 [1,0,0,1,0,0|1,0,0]=3 6986 B12R2.1395 CC(=O)c1cccc2c1CC2 Amb28324305 [1,0,0,1,0,0|2,0,0]=4 6987 B12R2.1395 O=C(O)c1cccc2c1CC2 Amb8397136 [1,0,0,1,0,0|1,0,0]=3 6988 B12R2.44 BrCc1ccc2c(c1)OCO2 Amb8838756 [1,0,0,1,0,0|1,0,1]=4 6989 B12R2.44 Br[Mg]c1ccc2c(c1)OCO2 Amb17689220 [1,0,0,1,0,0|2,0,0]=4 6990 B12R2.44 C#Cc1ccc2c(c1)OCO2 Amb22170379 [1,0,0,1,0,0|1,0,1]=4 6991 B12R2.44 C=Cc1ccc2c(c1)CCO2 Amb24056357 [1,0,0,1,0,0|2,0,0]=4 6992 B12R2.44 C=Cc1ccc2c(c1)OCC2 Amb27171446 [1,0,0,1,0,0|2,0,0]=4 6993 B12R2.44 C=Cc1ccc2c(c1)OCO2 Amb22263780 [1,0,0,1,0,0|1,0,0]=3 6994 B12R2.44 CNc1ccc2c(c1)OCO2 Amb33527071 [1,0,0,1,0,0|2,0,0]=4 6995 B12R2.44 COc1ccc2c(c1)OCO2 Amb17673128 [1,0,0,1,0,0|2,0,0]=4 6996 B12R2.44 ClCc1ccc2c(c1)OCO2 Amb1105052 [1,0,0,1,0,0|1,0,1]=4 6997 B12R2.44 FCc1ccc2c(c1)OCO2 Amb25169462 [1,0,0,1,0,0|1,0,1]=4 6998 B12R2.44 N#Cc1ccc2c(c1)OCO2 Amb1102181 [1,0,0,1,0,0|1,0,1]=4 6999 B12R2.44 NCc1ccc2c(c1)OCO2 Amb1102008 [1,0,0,1,0,0|1,0,1]=4 7000 B12R2.44 NCc1ccc2c(c1)OCO2 Amb23566988 [1,0,0,1,0,0|1,0,1]=4 7001 B12R2.44 NNc1ccc2c(c1)OCO2 Amb13948975 [1,0,0,1,0,0|2,0,0]=4 7002 B12R2.44 NNc1ccc2c(c1)OCO2 Amb6251423 [1,0,0,1,0,0|2,0,0]=4 7003 B12R2.44 NOc1ccc2c(c1)OCO2 Amb25254771 [1,0,0,1,0,0|2,0,0]=4 7004 B12R2.44 O=Cc1cc2c(cn1)OCC2 Amb18202189 [1,0,0,1,0,0|2,0,0]=4 7005 B12R2.44 O=Cc1cc2c(cn1)OCO2 Amb18831275 [1,0,0,1,0,0|1,0,0]=3 7006 B12R2.44 O=Cc1ccc2c(c1)CCC2 Amb2688826 [1,0,0,1,0,0|2,0,0]=4 7007 B12R2.44 O=Cc1ccc2c(c1)CCN2 Amb18202303 [1,0,0,1,0,0|2,0,0]=4 7008 B12R2.44 O=Cc1ccc2c(c1)CCO2 Amb2408258 [1,0,0,1,0,0|1,0,0]=3 7009 B12R2.44 O=Cc1ccc2c(c1)CCS2 Amb18199757 [1,0,0,1,0,0|1,1,0]=4 7010 B12R2.44 O=Cc1ccc2c(c1)NCC2 Amb18202304 [1,0,0,1,0,0|2,0,0]=4 7011 B12R2.44 O=Cc1ccc2c(c1)NCC2 Amb21857958 [1,0,0,1,0,0|2,0,0]=4 7012 B12R2.44 O=Cc1ccc2c(c1)OCC2 Amb18202266 [1,0,0,1,0,0|1,0,0]=3 7013 B12R2.44 O=Cc1ccc2c(c1)OCO2 Amb1873767 [1,0,0,1,0,0|0,0,0]=2 7014 B12R2.44 O=Cc1ccc2c(n1)CCO2 Amb27660923 [1,0,0,1,0,0|2,0,0]=4 7015 B12R2.44 O=Cc1ccc2c(n1)OCO2 Amb27193321 [1,0,0,1,0,0|1,0,0]=3 7016 B12R2.44 O=Cc1ccc2ccoc2c1 Amb18831461 [1,0,0,1,0,0|1,0,1]=4 7017 B12R2.44 O=Cc1ccc2ncoc2c1 Amb18831439 [1,0,0,1,0,0|1,0,1]=4 7018 B12R2.44 O=Cc1ccc2occc2c1 Amb2723109 [1,0,0,1,0,0|1,0,1]=4 7019 B12R2.44 O=Cc1ccc2ocnc2c1 Amb18831438 [1,0,0,1,0,0|1,0,1]=4 7020 B12R2.44 O=Cc1ccc2oncc2c1 Amb33547526 [1,0,0,1,0,0|2,0,0]=4 7021 B12R2.44 O=Cc1ccc2onnc2c1 Amb18202281 [1,0,0,1,0,0|2,0,0]=4 7022 B12R2.44 O=Nc1ccc2c(c1)OCO2 Amb25719400 [1,0,0,1,0,0|1,0,0]=3 7023 B12R2.44 OCc1ccc2c(c1)CCO2 Amb2445141 [1,0,0,1,0,0|1,0,1]=4 7024 B12R2.44 OCc1ccc2c(c1)OCC2 Amb19516191 [1,0,0,1,0,0|1,0,1]=4 7025 B12R2.44 OCc1ccc2c(c1)OCO2 Amb533939 [1,0,0,1,0,0|0,0,1]=3 7026 B12R2.44 SCc1ccc2c(c1)OCO2 Amb17400252 [1,0,0,1,0,0|0,1,1]=4 7027 B12R2.44 [C-]#[N+]c1ccc2c(c1)OCO2 Amb1981070 [1,0,0,1,0,0|2,0,0]=4 7028 B12R2.252 CC(=O)c1cc2c(s1)OCO2 Amb18198938 [0,0,0,1,1,0|2,0,0]=4 7029 B12R2.252 O=C(O)C1=CC2=CCSC2=C1 Amb27231717 [0,0,0,1,1,0|1,1,0]=4 7030 B12R2.252 O=C(O)c1cc2c(s1)CCO2 Amb18198939 [0,0,0,1,1,0|2,0,0]=4 7031 B12R2.1362 CC(=O)c1scc2c1OCO2 Amb18198940 [0,0,0,1,1,0|2,0,0]=4 7032 B12R2.1362 O=C(O)c1ccc2n1CCO2 Amb18201184 [0,0,0,1,1,0|2,0,0]=4 7033 B14R2.1008 C=C(Br)Cc1ccc2c(c1)OCO2 Amb6299575 [0,0,0,1,0,1|2,0,0]=4 7034 B14R2.1008 C=C(C)Cc1ccc2c(c1)OCO2 Amb6299576 [0,0,0,1,0,1|2,0,0]=4 7035 B14R2.1008 C=C(Cl)Cc1ccc2c(c1)OCO2 Amb6299574 [0,0,0,1,0,1|2,0,0]=4 7036 B14R2.1008 CC(=N)Nc1ccc2c(c1)OCO2 Amb27190664 [0,0,0,1,0,1|2,0,0]=4 7037 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 Amb24368926 [0,0,0,1,0,1|2,0,0]=4 7038 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 Amb4103699 [0,0,0,1,0,1|1,0,0]=3 7039 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCC2 Amb23399922 [0,0,0,1,0,1|2,0,0]=4 7040 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 Amb1196404 [0,0,0,1,0,1|1,0,0]=3 7041 B14R2.1008 CC(=O)Oc1ccc2c(c1)OCC2 Amb10564579 [0,0,0,1,0,1|2,0,0]=4 7042 B14R2.1008 CC(=O)Oc1ccc2c(c1)OCO2 Amb6374216 [0,0,0,1,0,1|1,0,0]=3 7043 B14R2.1008 CC(=O)Sc1ccc2c(c1)OCO2 Amb28366067 [0,0,0,1,0,1|1,0,0]=3 7044 B14R2.1008 CC(=S)Nc1ccc2c(c1)OCO2 Amb1150918 [0,0,0,1,0,1|1,1,0]=4 7045 B14R2.1008 CC(O)Cc1ccc2c(c1)OCO2 Amb24496826 [0,0,0,1,0,1|1,0,1]=4 7046 B14R2.1008 CN(O)Cc1ccc2c(c1)OCO2 Amb33056947 [0,0,0,1,0,1|2,0,0]=4 7047 B14R2.1008 C[C@@H](O)Cc1ccc2c(c1)OCO2 Amb20241606 [0,0,0,1,0,1|1,0,1]=4 7048 B14R2.1008 C[C@H](O)Cc1ccc2c(c1)OCO2 Amb24432879 [0,0,0,1,0,1|1,0,1]=4 7049 B14R2.1008 N=C(N)Cc1ccc2c(c1)OCO2 Amb2695198 [0,0,0,1,0,1|2,0,0]=4 7050 B14R2.1008 N=C(N)Nc1ccc2c(c1)OCO2 Amb6608055 [0,0,0,1,0,1|2,0,0]=4 7051 B14R2.1008 N=C(N)Nc1ccc2c(c1)OCO2 Amb7088666 [0,0,0,1,0,1|2,0,0]=4 7052 B14R2.1008 NC(=O)Cc1ccc2c(c1)CCO2 Amb24182080 [0,0,0,1,0,1|2,0,0]=4 7053 B14R2.1008 NC(=O)Cc1ccc2c(c1)OCO2 Amb17400688 [0,0,0,1,0,1|1,0,0]=3 7054 B14R2.1008 NC(=O)Nc1ccc2c(c1)CCO2 Amb25180302 [0,0,0,1,0,1|2,0,0]=4 7055 B14R2.1008 NC(=O)Nc1ccc2c(c1)OCO2 Amb1155414 [0,0,0,1,0,1|1,0,0]=3 7056 B14R2.1008 NC(=S)Cc1ccc2c(c1)OCO2 Amb17402019 [0,0,0,1,0,1|1,1,0]=4 7057 B14R2.1008 NC(=S)Nc1ccc2c(c1)OCO2 Amb2418873 [0,0,0,1,0,1|1,1,0]=4 7058 B14R2.1008 O=C(Cl)Cc1ccc2c(c1)CCO2 Amb25674657 [0,0,0,1,0,1|2,0,0]=4 7059 B14R2.1008 O=C(Cl)Cc1ccc2c(c1)OCO2 Amb2684578 [0,0,0,1,0,1|1,0,0]=3 7060 B14R2.1008 O=C(Cl)Nc1ccc2c(c1)CCO2 Amb35625823 [0,0,0,1,0,1|2,0,0]=4 7061 B14R2.1008 O=C(Cl)Nc1ccc2c(c1)OCO2 Amb35636917 [0,0,0,1,0,1|1,0,0]=3 7062 B14R2.1008 O=C(Cl)Oc1ccc2c(c1)OCC2 Amb35718387 [0,0,0,1,0,1|2,0,0]=4 7063 B14R2.1008 O=C(O)Cc1cc2c(cn1)OCO2 Amb18193411 [0,0,0,1,0,1|1,0,0]=3 7064 B14R2.1008 O=C(O)Cc1ccc2c(c1)CCC2 Amb436353 [0,0,0,1,0,1|2,0,0]=4 7065 B14R2.1008 O=C(O)Cc1ccc2c(c1)CCN2 Amb28250791 [0,0,0,1,0,1|2,0,0]=4 7066 B14R2.1008 O=C(O)Cc1ccc2c(c1)CCO2 Amb1106297 [0,0,0,1,0,1|1,0,0]=3 7067 B14R2.1008 O=C(O)Cc1ccc2c(c1)NCC2 Amb26868581 [0,0,0,1,0,1|2,0,0]=4 7068 B14R2.1008 O=C(O)Cc1ccc2c(c1)NCC2 Amb28600401 [0,0,0,1,0,1|2,0,0]=4 7069 B14R2.1008 O=C(O)Cc1ccc2c(c1)OCC2 Amb19134335 [0,0,0,1,0,1|1,0,0]=3 7070 B14R2.1008 O=C(O)Cc1ccc2c(c1)OCO2 Amb544876 [0,0,0,1,0,1|0,0,0]=2 7071 B14R2.1008 O=C(O)Cc1ccc2c(c1)SCC2 Amb18814743 [0,0,0,1,0,1|1,1,0]=4 7072 B14R2.1008 O=C(O)Cc1ccc2ccoc2c1 Amb18197053 [0,0,0,1,0,1|1,0,1]=4 7073 B14R2.1008 O=C(O)Cc1ccc2ncoc2c1 Amb17131033 [0,0,0,1,0,1|1,0,1]=4 7074 B14R2.1008 O=C(O)Cc1ccc2occc2c1 Amb18197066 [0,0,0,1,0,1|1,0,1]=4 7075 B14R2.1008 O=C(O)Cc1ccc2ocnc2c1 Amb2420231 [0,0,0,1,0,1|1,0,1]=4 7076 B14R2.1008 O=C(O)Cc1cnc2c(c1)OCO2 Amb27221514 [0,0,0,1,0,1|1,0,0]=3 7077 B14R2.1008 O=[N+]([O-])Cc1ccc2c(c1)OCO2 Amb33056991 [0,0,0,1,0,1|1,0,1]=4 7078 B14R2.1197 CCc1cc2c(cc1O)SC(=O)O2 Amb24494574 [0,0,0,1,0,1|1,1,0]=4 7079 B14R2.1197 CCc1cc2cc(O)sc2cc1O Amb27778863 [0,0,0,1,0,1|1,1,0]=4 7080 B14R2.1197 CCc1cc2sc(O)cc2cc1O Amb27487607 [0,0,0,1,0,1|2,0,0]=4 7081 B14R2.1197 COc1cc2c(cc1Br)NC(=O)O2 Amb27243637 [0,0,0,1,0,1|2,0,0]=4 7082 B14R2.1197 COc1cc2c(cc1C)NC(=O)C2 Amb25757921 [0,0,0,1,0,1|2,0,0]=4 7083 B14R2.1197 COc1cc2c(cc1Cl)NC(=O)C2 Amb18244099 [0,0,0,1,0,1|2,0,0]=4 7084 B14R2.1197 COc1cc2c(cc1Cl)NC(=O)O2 Amb25790628 [0,0,0,1,0,1|2,0,0]=4 7085 B14R2.1197 COc1cc2c(cc1F)NC(=O)N2 Amb27868722 [0,0,0,1,0,1|2,0,0]=4 7086 B14R2.1197 COc1cc2c(cc1N)CC(=O)N2 Amb9311205 [0,0,0,1,0,1|2,0,0]=4 7087 B14R2.1197 COc1cc2c(cc1N)NC(=O)C2 Amb18062886 [0,0,0,1,0,1|2,0,0]=4 7088 B14R2.1197 COc1cc2c(cc1N)NC(=O)N2 Amb19516727 [0,0,0,1,0,1|2,0,0]=4 7089 B14R2.1197 COc1cc2c(cc1N)NC(=O)O2 Amb27203686 [0,0,0,1,0,1|2,0,0]=4 7090 B14R2.1197 COc1cc2c(cc1N)OC(=O)N2 Amb24724249 [0,0,0,1,0,1|1,0,0]=3 7091 B14R2.1197 COc1cc2c(cc1N)SC(=O)N2 Amb27164159 [0,0,0,1,0,1|1,1,0]=4 7092 B14R2.1197 COc1cc2c(cc1O)OC(C)C2 Amb28198585 [0,0,0,1,0,1|1,0,1]=4 7093 B14R2.1197 COc1cc2c(cc1O)SC(=O)O2 Amb24534240 [0,0,0,1,0,1|0,1,0]=3 7094 B14R2.1197 COc1cc2cc(C)oc2cc1C Amb27257980 [0,0,0,1,0,1|2,0,0]=4 7095 B14R2.1197 COc1cc2cc(C)oc2cc1N Amb18196185 [0,0,0,1,0,1|2,0,0]=4 7096 B14R2.1197 COc1cc2cc(C)sc2cc1O Amb27440610 [0,0,0,1,0,1|1,1,0]=4 7097 B14R2.1197 COc1cc2cc(F)sc2cc1O Amb27205318 [0,0,0,1,0,1|1,1,0]=4 7098 B14R2.1197 COc1cc2cc(I)sc2cc1O Amb27429517 [0,0,0,1,0,1|1,1,0]=4 7099 B14R2.1197 COc1cc2cc(O)sc2cc1Br Amb27871688 [0,0,0,1,0,1|1,1,0]=4 7100 B14R2.1197 COc1cc2cc(O)sc2cc1N Amb27216270 [0,0,0,1,0,1|1,1,0]=4 7101 B14R2.1197 COc1cc2nc(N)oc2cc1Cl Amb24463775 [0,0,0,1,0,1|2,0,0]=4 7102 B14R2.1197 COc1cc2sc(Cl)cc2cc1O Amb27964065 [0,0,0,1,0,1|2,0,0]=4 7103 B14R2.1197 COc1cc2sc(N)cc2cc1O Amb28429360 [0,0,0,1,0,1|2,0,0]=4 7104 B14R2.1197 COc1cc2sc(N)nc2cc1O Amb27445135 [0,0,0,1,0,1|2,0,0]=4 7105 B14R2.1197 COc1cc2sc(O)cc2cc1Br Amb28247428 [0,0,0,1,0,1|2,0,0]=4 7106 B14R2.1197 COc1cc2sc(O)cc2cc1O Amb27769940 [0,0,0,1,0,1|1,0,0]=3 7107 B14R2.1197 CSc1cc2cc(O)sc2cc1O Amb28287854 [0,0,0,1,0,1|0,2,0]=4 7108 B14R2.1197 NCc1cc2c(cc1O)OC(=O)S2 Amb28364133 [0,0,0,1,0,1|2,0,0]=4 7109 B14R2.1197 O=Cc1cc2c(cc1O)OC(=O)S2 Amb18189100 [0,0,0,1,0,1|2,0,0]=4 7110 B14R2.3809 CCc1c(O)ccc2c1SC(=O)O2 Amb26461149 [0,0,0,1,0,1|1,1,0]=4 7111 B14R2.3809 COc1c(Br)ccc2sc(O)cc12 Amb27619491 [0,0,0,1,0,1|2,0,0]=4 7112 B14R2.3809 COc1c(Cl)ccc2c1NC(=O)N2 Amb27852486 [0,0,0,1,0,1|2,0,0]=4 7113 B14R2.3809 COc1c(Cl)ccc2sc(O)cc12 Amb27216199 [0,0,0,1,0,1|2,0,0]=4 7114 B14R2.3809 COc1c(F)ccc2c1NC(=O)N2 Amb27784172 [0,0,0,1,0,1|2,0,0]=4 7115 B14R2.3809 COc1c(F)ccc2cc(O)sc12 Amb27252506 [0,0,0,1,0,1|1,1,0]=4 7116 B14R2.3809 COc1c(I)ccc2cc(O)sc12 Amb27442215 [0,0,0,1,0,1|1,1,0]=4 7117 B14R2.3809 COc1c(I)ccc2sc(O)cc12 Amb27963300 [0,0,0,1,0,1|2,0,0]=4 7118 B14R2.3809 COc1c(O)ccc2c1SC(=O)O2 Amb27431702 [0,0,0,1,0,1|0,1,0]=3 7119 B14R2.3809 COc1c(O)ccc2cc(Br)sc12 Amb27195147 [0,0,0,1,0,1|1,1,0]=4 7120 B14R2.3809 COc1c(O)ccc2cc(O)sc12 Amb27769944 [0,0,0,1,0,1|0,1,0]=3 7121 B14R2.3809 COc1c(O)ccc2sc(C)cc12 Amb27618637 [0,0,0,1,0,1|2,0,0]=4 7122 B14R2.3809 COc1c(O)ccc2sc(F)cc12 Amb28057913 [0,0,0,1,0,1|2,0,0]=4 7123 B14R2.3809 COc1c(O)ccc2sc(O)cc12 Amb28287406 [0,0,0,1,0,1|1,0,0]=3 7124 B14R2.955 Cc1ccc(C(=O)O)cc1C2CC2 Amb24489261 [0,1,0,1,0,0|2,0,0]=4 7125 B14R2.955 O=C(O)c1ccc(Cl)c(C2CC2)c1 Amb24490276 [0,1,0,1,0,0|2,0,0]=4 7126 B14R2.955 O=C(O)c1ccc(F)c(C2CC2)c1 Amb16233185 [0,1,0,1,0,0|2,0,0]=4 7127 B14R2.24358 CC(=O)c1ccc2c(c1)C(=O)CO2 Amb9783163 [0,1,0,1,0,0|2,0,0]=4 7128 B14R2.24358 CC(=O)c1ccc2c(c1)C(C)CO2 Amb4477250 [0,1,0,1,0,0|2,0,0]=4 7129 B14R2.24358 CC1CCc2ccc(C(=O)O)cc21 Amb27985862 [0,1,0,1,0,0|2,0,0]=4 7130 B14R2.24358 CC1CNc2ccc(C(=O)O)cc21 Amb25820545 [0,1,0,1,0,0|2,0,0]=4 7131 B14R2.24358 CC1CNc2ccc(C(=O)O)cc21 Amb33620575 [0,1,0,1,0,0|2,0,0]=4 7132 B14R2.24358 CC1COc2ccc(C(=O)O)cc21 Amb24685013 [0,1,0,1,0,0|1,0,0]=3 7133 B14R2.24358 CN1CCc2ccc(C(=O)O)cc21 Amb25124063 [0,1,0,1,0,0|2,0,0]=4 7134 B14R2.24358 C[C@@H]1NCc2ccc(C(=O)O)cc21 Amb28141255 [0,1,0,1,0,0|2,0,0]=4 7135 B14R2.24358 C[C@H]1NCc2ccc(C(=O)O)cc21 Amb28118493 [0,1,0,1,0,0|2,0,0]=4 7136 B14R2.24358 Cc1coc2ccc(C(=O)O)cc12 Amb24062161 [0,1,0,1,0,0|1,0,0]=3 7137 B14R2.24358 Cc1csc2ccc(C(=O)O)cc12 Amb2614626 [0,1,0,1,0,0|1,1,0]=4 7138 B14R2.24358 Cc1noc2ccc(C(=O)O)cc12 Amb28249563 [0,1,0,1,0,0|1,0,0]=3 7139 B14R2.24358 Cc1noc2ncc(C(=O)O)cc12 Amb1106419 [0,1,0,1,0,0|2,0,0]=4 7140 B14R2.24358 Cc1nsc2ccc(C(=O)O)cc12 Amb22754842 [0,1,0,1,0,0|1,1,0]=4 7141 B14R2.24358 Cc1onc2ncc(C(=O)O)cc12 Amb18195740 [0,1,0,1,0,0|2,0,0]=4 7142 B14R2.24358 Cc1snc2ccc(C(=O)O)cc12 Amb32758837 [0,1,0,1,0,0|1,1,0]=4 7143 B14R2.24358 Cn1ccc2ccc(C(=O)O)cc21 Amb2723768 [0,1,0,1,0,0|2,0,0]=4 7144 B14R2.24358 Cn1cnc2ccc(C(=O)O)cc21 Amb10602455 [0,1,0,1,0,0|2,0,0]=4 7145 B14R2.24358 Cn1ncc2ccc(C(=O)O)cc21 Amb20528167 [0,1,0,1,0,0|2,0,0]=4 7146 B14R2.24358 Cn1nnc2ccc(C(=O)O)cc21 Amb23403594 [0,1,0,1,0,0|2,0,0]=4 7147 B14R2.24358 NC1CCc2ccc(C(=O)O)cc21 Amb27468612 [0,1,0,1,0,0|2,0,0]=4 7148 B14R2.24358 NC1COc2ncc(C(=O)O)cc21 Amb33036440 [0,1,0,1,0,0|2,0,0]=4 7149 B14R2.24358 N[C@@H]1COc2ccc(C(=O)O)cc21 Amb28250816 [0,1,0,1,0,0|1,0,0]=3 7150 B14R2.24358 Nc1noc2ccc(C(=O)O)cc12 Amb27239968 [0,1,0,1,0,0|2,0,0]=4 7151 B14R2.24358 O=C(O)c1ccc2c(c1)B(O)OC2 Amb22411443 [0,1,0,1,0,0|2,0,0]=4 7152 B14R2.24358 O=C(O)c1ccc2c(c1)C(=O)CC2 Amb2699970 [0,1,0,1,0,0|2,0,0]=4 7153 B14R2.24358 O=C(O)c1ccc2c(c1)C(=O)OC2 Amb25858147 [0,1,0,1,0,0|2,0,0]=4 7154 B14R2.24358 O=C(O)c1ccc2c(c1)C(=O)ON2 Amb24330813 [0,1,0,1,0,0|2,0,0]=4 7155 B14R2.24358 O=C(O)c1ccc2c(c1)C(O)CC2 Amb27198471 [0,1,0,1,0,0|2,0,0]=4 7156 B14R2.24358 O=C(O)c1ccc2c(c1)C(O)CO2 Amb27634930 [0,1,0,1,0,0|1,0,0]=3 7157 B14R2.24358 O=C(O)c1ccc2no[n+]([O-])c2c1 Amb626468 [0,1,0,1,0,0|2,0,0]=4 7158 B14R2.24358 O=C(O)c1ccc2occ(Br)c2c1 Amb24328700 [0,1,0,1,0,0|1,0,1]=4 7159 B14R2.966 C#C[C@@H](O)c1ccc2c(c1)OCO2 Amb28249159 [0,1,0,1,0,0|1,0,1]=4 7160 B14R2.966 C=C(C#N)c1ccc2c(c1)OCO2 Amb17232928 [0,1,0,1,0,0|2,0,0]=4 7161 B14R2.966 C=C(CBr)c1ccc2c(c1)OCO2 Amb33053334 [0,1,0,1,0,0|2,0,0]=4 7162 B14R2.966 C=C(CCl)c1ccc2c(c1)OCO2 Amb33053336 [0,1,0,1,0,0|2,0,0]=4 7163 B14R2.966 C=C(CN)c1ccc2c(c1)OCO2 Amb18252338 [0,1,0,1,0,0|2,0,0]=4 7164 B14R2.966 C=CC(=O)c1ccc2c(c1)CCO2 Amb28041323 [0,1,0,1,0,0|2,0,0]=4 7165 B14R2.966 C=CC(=O)c1ccc2c(c1)OCC2 Amb27590417 [0,1,0,1,0,0|2,0,0]=4 7166 B14R2.966 C=CC(=O)c1ccc2c(c1)OCO2 Amb18564036 [0,1,0,1,0,0|1,0,0]=3 7167 B14R2.966 C=CC(O)c1ccc2c(c1)OCO2 Amb26477975 [0,1,0,1,0,0|1,0,1]=4 7168 B14R2.966 CC(C=O)c1ccc2c(c1)OCO2 Amb17194520 [0,1,0,1,0,0|1,0,1]=4 7169 B14R2.966 CC(CO)c1ccc2c(c1)OCO2 Amb17233666 [0,1,0,1,0,0|1,0,1]=4 7170 B14R2.966 CC(NO)c1ccc2c(c1)OCO2 Amb10606963 [0,1,0,1,0,0|1,0,1]=4 7171 B14R2.966 CC(ON)c1ccc2c(c1)OCO2 Amb33056957 [0,1,0,1,0,0|1,0,1]=4 7172 B14R2.966 CCC(=O)c1ccc2c(c1)CCO2 Amb3433156 [0,1,0,1,0,0|2,0,0]=4 7173 B14R2.966 CCC(=O)c1ccc2c(c1)OCO2 Amb4114875 [0,1,0,1,0,0|1,0,0]=3 7174 B14R2.966 CCC(O)c1ccc2c(c1)OCO2 Amb17194540 [0,1,0,1,0,0|1,0,1]=4 7175 B14R2.966 CNC(=O)c1cc2c(cn1)OCO2 Amb27187974 [0,1,0,1,0,0|2,0,0]=4 7176 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 Amb2751330 [0,1,0,1,0,0|2,0,0]=4 7177 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 Amb2408120 [0,1,0,1,0,0|1,0,0]=3 7178 B14R2.966 COC(=N)c1ccc2c(c1)OCO2 Amb18180899 [0,1,0,1,0,0|1,0,0]=3 7179 B14R2.966 COC(=O)c1ccc2c(c1)CCN2 Amb6892079 [0,1,0,1,0,0|2,0,0]=4 7180 B14R2.966 COC(=O)c1ccc2c(c1)CCO2 Amb2751343 [0,1,0,1,0,0|1,0,0]=3 7181 B14R2.966 COC(=O)c1ccc2c(c1)NCC2 Amb22490872 [0,1,0,1,0,0|2,0,0]=4 7182 B14R2.966 COC(=O)c1ccc2c(c1)NCC2 Amb2383430 [0,1,0,1,0,0|2,0,0]=4 7183 B14R2.966 COC(=O)c1ccc2c(c1)OCC2 Amb23412189 [0,1,0,1,0,0|1,0,0]=3 7184 B14R2.966 COC(=O)c1ccc2c(c1)OCO2 Amb6360543 [0,1,0,1,0,0|0,0,0]=2 7185 B14R2.966 COC(=O)c1ccc2ccoc2c1 Amb21964802 [0,1,0,1,0,0|1,0,1]=4 7186 B14R2.966 COC(=O)c1ccc2ncoc2c1 Amb21857275 [0,1,0,1,0,0|1,0,1]=4 7187 B14R2.966 COC(=O)c1ccc2occc2c1 Amb2797842 [0,1,0,1,0,0|1,0,1]=4 7188 B14R2.966 COC(=O)c1ccc2ocnc2c1 Amb2608775 [0,1,0,1,0,0|1,0,1]=4 7189 B14R2.966 COC(=O)c1ccc2oncc2c1 Amb33716130 [0,1,0,1,0,0|2,0,0]=4 7190 B14R2.966 C[C@@H](CO)c1ccc2c(c1)OCO2 Amb33735136 [0,1,0,1,0,0|1,0,1]=4 7191 B14R2.966 C[C@H](CO)c1ccc2c(c1)OCO2 Amb26436695 [0,1,0,1,0,0|1,0,1]=4 7192 B14R2.966 C[C@H](NO)c1ccc2c(c1)OCO2 Amb28348451 [0,1,0,1,0,0|1,0,1]=4 7193 B14R2.966 C\C(=N/O)c1ccc2c(c1)CCO2 Amb2751087 [0,1,0,1,0,0|2,0,0]=4 7194 B14R2.966 C\C(=N\O)c1ccc2c(c1)CCO2 Amb13951627 [0,1,0,1,0,0|2,0,0]=4 7195 B14R2.966 C\C=C(/C)c1ccc2c(c1)OCO2 Amb27409434 [0,1,0,1,0,0|2,0,0]=4 7196 B14R2.966 C\C=C(\C)c1ccc2c(c1)OCO2 Amb27439383 [0,1,0,1,0,0|2,0,0]=4 7197 B14R2.966 N#CC(O)c1ccc2c(c1)OCO2 Amb27816309 [0,1,0,1,0,0|1,0,1]=4 7198 B14R2.966 N#C[C@@H](O)c1ccc2c(c1)OCO2 Amb27951752 [0,1,0,1,0,0|1,0,1]=4 7199 B14R2.966 N#C[C@H](O)c1ccc2c(c1)OCO2 Amb24591768 [0,1,0,1,0,0|1,0,1]=4 7200 B14R2.966 NC(CO)c1ccc2c(c1)OCO2 Amb8855254 [0,1,0,1,0,0|1,0,1]=4 7201 B14R2.966 NCC(=O)c1ccc2c(c1)CCO2 Amb17194037 [0,1,0,1,0,0|2,0,0]=4 7202 B14R2.966 NCC(=O)c1ccc2c(c1)OCO2 Amb17194533 [0,1,0,1,0,0|1,0,0]=3 7203 B14R2.966 NCC(O)c1ccc2c(c1)OCO2 Amb1107906 [0,1,0,1,0,0|1,0,1]=4 7204 B14R2.966 NCC(O)c1ccc2c(c1)OCO2 Amb19889359 [0,1,0,1,0,0|1,0,1]=4 7205 B14R2.966 NC[C@@H](O)c1ccc2c(c1)OCO2 Amb26642761 [0,1,0,1,0,0|1,0,1]=4 7206 B14R2.966 NC[C@H](O)c1ccc2c(c1)OCO2 Amb27179365 [0,1,0,1,0,0|1,0,1]=4 7207 B14R2.966 NNC(=O)c1ccc2c(c1)CCO2 Amb8999087 [0,1,0,1,0,0|2,0,0]=4 7208 B14R2.966 NNC(=O)c1ccc2c(c1)OCO2 Amb6357062 [0,1,0,1,0,0|1,0,0]=3 7209 B14R2.966 N[C@@H](CO)c1ccc2c(c1)OCO2 Amb24493913 [0,1,0,1,0,0|1,0,1]=4 7210 B14R2.966 N[C@H](CO)c1ccc2c(c1)OCO2 Amb26415780 [0,1,0,1,0,0|1,0,1]=4 7211 B14R2.966 N\C(=N/O)c1ccc2c(c1)CCO2 Amb9284752 [0,1,0,1,0,0|2,0,0]=4 7212 B14R2.966 N\C(=N/O)c1ccc2c(c1)OCO2 Amb2695207 [0,1,0,1,0,0|1,0,0]=3 7213 B14R2.966 N\C(=N\O)c1ccc2c(c1)CCO2 Amb2768965 [0,1,0,1,0,0|2,0,0]=4 7214 B14R2.966 N\C(=N\O)c1ccc2c(c1)OCO2 Amb10075282 [0,1,0,1,0,0|1,0,0]=3 7215 B14R2.966 N\N=C(\N)c1ccc2c(c1)OCO2 Amb18178634 [0,1,0,1,0,0|2,0,0]=4 7216 B14R2.966 O=C(CBr)c1ccc2c(c1)CCO2 Amb1106280 [0,1,0,1,0,0|2,0,0]=4 7217 B14R2.966 O=C(CBr)c1ccc2c(c1)OCO2 Amb1159304 [0,1,0,1,0,0|1,0,0]=3 7218 B14R2.966 O=C(CCl)c1ccc2c(c1)CCO2 Amb5492698 [0,1,0,1,0,0|2,0,0]=4 7219 B14R2.966 O=C(CCl)c1ccc2c(c1)OCO2 Amb17039760 [0,1,0,1,0,0|1,0,0]=3 7220 B14R2.966 O=C(CF)c1ccc2c(c1)OCO2 Amb26599475 [0,1,0,1,0,0|1,0,0]=3 7221 B14R2.966 O=C(CO)c1ccc2c(c1)CCC2 Amb5638949 [0,1,0,1,0,0|2,0,0]=4 7222 B14R2.966 O=C(CO)c1ccc2c(c1)CCO2 Amb25335362 [0,1,0,1,0,0|1,0,0]=3 7223 B14R2.966 O=C(CO)c1ccc2ncoc2c1 Amb25776931 [0,1,0,1,0,0|1,0,1]=4 7224 B14R2.966 O=C(NO)c1cc2c(cn1)OCO2 Amb28183827 [0,1,0,1,0,0|1,0,0]=3 7225 B14R2.966 O=C(NO)c1ccc2c(c1)NCC2 Amb27470475 [0,1,0,1,0,0|2,0,0]=4 7226 B14R2.966 O=C(NO)c1ccc2c(c1)OCO2 Amb6277646 [0,1,0,1,0,0|0,0,0]=2 7227 B14R2.966 O=C(NO)c1ccc2occc2c1 Amb27631577 [0,1,0,1,0,0|1,0,1]=4 7228 B14R2.966 O=CC(=O)c1ccc2c(c1)CCO2 Amb27230612 [0,1,0,1,0,0|1,0,1]=4 7229 B14R2.966 O=CC(=O)c1ccc2c(c1)OCO2 Amb10067938 [0,1,0,1,0,0|0,0,1]=3 7230 B14R2.966 O=CC(=O)c1ccc2c(c1)OCO2 Amb5721710 [0,1,0,1,0,0|0,0,1]=3 7231 B14R2.966 O=CC(O)c1ccc2c(c1)OCC2 Amb27760546 [0,1,0,1,0,0|1,0,1]=4 7232 B14R2.966 OC(CBr)c1ccc2c(c1)OCO2 Amb17206131 [0,1,0,1,0,0|1,0,1]=4 7233 B14R2.966 OC(CCl)c1ccc2c(c1)OCO2 Amb17194814 [0,1,0,1,0,0|1,0,1]=4 7234 B14R2.966 OC(CF)c1ccc2c(c1)OCO2 Amb25954587 [0,1,0,1,0,0|1,0,1]=4 7235 B14R2.966 OC(CS)c1ccc2c(c1)OCO2 Amb16192501 [0,1,0,1,0,0|0,1,1]=4 7236 B14R2.966 OCC(O)c1ccc2c(c1)OCO2 Amb18066054 [0,1,0,1,0,0|0,0,2]=4 7237 B14R2.966 OC[C@H](O)c1ccc2c(c1)OCO2 Amb28060622 [0,1,0,1,0,0|0,0,2]=4 7238 B14R2.966 O[C@@H](CF)c1ccc2c(c1)OCO2 Amb28043907 [0,1,0,1,0,0|1,0,1]=4 7239 B14R2.966 O[C@H](CBr)c1ccc2c(c1)OCO2 Amb6893390 [0,1,0,1,0,0|1,0,1]=4 7240 B14R2.966 O[C@H](CCl)c1ccc2c(c1)OCO2 Amb20241556 [0,1,0,1,0,0|1,0,1]=4 7241 B14R2.966 O[C@H](CF)c1ccc2c(c1)OCO2 Amb26610339 [0,1,0,1,0,0|1,0,1]=4 7242 B14R2.966 O\N=C(/Cl)c1ccc2c(c1)CCO2 Amb27480241 [0,1,0,1,0,0|2,0,0]=4 7243 B14R2.966 [NH3+]CC(=O)c1ccc2c(c1)OCO2 Amb20669851 [0,1,0,1,0,0|1,0,0]=3 7244 B14R2.2167 CCc1cc2c(O)coc2cc1O Amb28202032 [0,1,0,1,0,0|1,0,1]=4 7245 B14R2.2167 CCc1cc2c(cc1O)CCC2=O Amb16232963 [0,1,0,1,0,0|2,0,0]=4 7246 B14R2.2167 CCc1cc2c(cc1O)OCC2=O Amb27640194 [0,1,0,1,0,0|1,0,0]=3 7247 B14R2.2167 COc1cc2c(Br)csc2cc1O Amb27639375 [0,1,0,1,0,0|1,1,0]=4 7248 B14R2.2167 COc1cc2c(N)csc2cc1O Amb27654467 [0,1,0,1,0,0|1,1,0]=4 7249 B14R2.2167 COc1cc2c(O)csc2cc1C Amb27205306 [0,1,0,1,0,0|1,1,0]=4 7250 B14R2.2167 COc1cc2c(O)csc2cc1F Amb27447424 [0,1,0,1,0,0|1,1,0]=4 7251 B14R2.2167 COc1cc2c(O)csc2cc1O Amb27798566 [0,1,0,1,0,0|0,1,0]=3 7252 B14R2.2167 COc1cc2c(O)csc2cc1S Amb27216826 [0,1,0,1,0,0|0,2,0]=4 7253 B14R2.2167 COc1cc2c(S)csc2cc1O Amb27850182 [0,1,0,1,0,0|0,2,0]=4 7254 B14R2.2167 COc1cc2c(cc1Br)CCC2=O Amb22491808 [0,1,0,1,0,0|2,0,0]=4 7255 B14R2.2167 COc1cc2c(cc1C)CNC2=O Amb21927562 [0,1,0,1,0,0|2,0,0]=4 7256 B14R2.2167 COc1cc2c(cc1Cl)CCC2=O Amb16232655 [0,1,0,1,0,0|2,0,0]=4 7257 B14R2.2167 COc1cc2c(cc1Cl)NCC2=O Amb18188174 [0,1,0,1,0,0|2,0,0]=4 7258 B14R2.2167 COc1cc2c(cc1F)CCC2=O Amb16232656 [0,1,0,1,0,0|2,0,0]=4 7259 B14R2.2167 COc1cc2c(cc1F)OCC2=O Amb27754149 [0,1,0,1,0,0|1,0,0]=3 7260 B14R2.2167 COc1cc2c(cc1I)CCC2=O Amb22476424 [0,1,0,1,0,0|2,0,0]=4 7261 B14R2.2167 COc1cc2c(cc1N)CNC2=O Amb28042376 [0,1,0,1,0,0|2,0,0]=4 7262 B14R2.2167 COc1cc2c(cc1O)CCC2=O Amb17615499 [0,1,0,1,0,0|1,0,0]=3 7263 B14R2.2167 COc1cc2c(cc1O)OCC2=O Amb25770165 [0,1,0,1,0,0|0,0,0]=2 7264 B14R2.2167 COc1cc2c(cc1O)OCC2N Amb27168209 [0,1,0,1,0,0|1,0,1]=4 7265 B14R2.2167 CSc1cc2c(O)csc2cc1O Amb27963310 [0,1,0,1,0,0|0,2,0]=4 7266 B14R2.3163 COc1cc(C2(O)CC2)ccc1O Amb24567235 [0,1,0,1,0,0|1,0,1]=4 7267 B14R2.3818 CCc1c(Br)ccc2c1COC2=O Amb27437187 [0,1,0,1,0,0|2,0,0]=4 7268 B14R2.3818 CCc1c(O)ccc2c(O)csc12 Amb27782755 [0,1,0,1,0,0|1,1,0]=4 7269 B14R2.3818 CCc1c(O)ccc2c1OCC2=O Amb28401451 [0,1,0,1,0,0|1,0,0]=3 7270 B14R2.3818 COc1c(Br)ccc2c1CCC2=O Amb24616835 [0,1,0,1,0,0|2,0,0]=4 7271 B14R2.3818 COc1c(Br)ccc2c1CNC2=O Amb27641309 [0,1,0,1,0,0|2,0,0]=4 7272 B14R2.3818 COc1c(C)ccc2c1CCC2=O Amb27630632 [0,1,0,1,0,0|2,0,0]=4 7273 B14R2.3818 COc1c(Cl)ccc2c1CCC2=O Amb24349772 [0,1,0,1,0,0|2,0,0]=4 7274 B14R2.3818 COc1c(F)ccc2c1CCC2=O Amb25798445 [0,1,0,1,0,0|2,0,0]=4 7275 B14R2.3818 COc1c(N)ccc2c(O)csc12 Amb27493199 [0,1,0,1,0,0|1,1,0]=4 7276 B14R2.3818 COc1c(N)ccc2c1CCC2=O Amb27459768 [0,1,0,1,0,0|2,0,0]=4 7277 B14R2.3818 COc1c(O)ccc2c(C)csc12 Amb27216796 [0,1,0,1,0,0|1,1,0]=4 7278 B14R2.3818 COc1c(O)ccc2c(Cl)csc12 Amb28142031 [0,1,0,1,0,0|1,1,0]=4 7279 B14R2.3818 COc1c(O)ccc2c(F)csc12 Amb28195421 [0,1,0,1,0,0|1,1,0]=4 7280 B14R2.3818 COc1c(O)ccc2c(I)csc12 Amb28290575 [0,1,0,1,0,0|1,1,0]=4 7281 B14R2.3818 COc1c(O)ccc2c(S)csc12 Amb27196026 [0,1,0,1,0,0|0,2,0]=4 7282 B14R2.3818 COc1c(O)ccc2c1OCC2=O Amb27830539 [0,1,0,1,0,0|0,0,0]=2 7283 B14R2.3818 COc1c(O)ccc2c1OCC2N Amb27170632 [0,1,0,1,0,0|1,0,1]=4 7284 B14R2.3818 COc1c(O)ccc2c1OC[C@@H]2N Amb27473376 [0,1,0,1,0,0|1,0,1]=4 7285 B14R2.3125 CC(C)(O)c1ccc2c(c1)OCO2 Amb25063311 [0,1,0,1,0,0|1,0,1]=4 7286 B14R2.3125 NS(=O)(=O)c1ccc2c(c1)OCO2 Amb9023520 [0,1,0,1,0,0|1,0,1]=4 7287 B14R2.3125 O=S(=O)(Cl)c1ccc2c(c1)OCO2 Amb1136578 [0,1,0,1,0,0|1,0,1]=4 7288 B14R2.3125 O=S(=O)(F)c1ccc2c(c1)OCO2 Amb18566859 [0,1,0,1,0,0|1,0,1]=4 7289 B14R2.3125 O=S(=O)(O)c1ccc2c(c1)OCO2 Amb18864496 [0,1,0,1,0,0|1,0,0]=3 7290 B14R2.8824 CC(=O)c1cc(C)c2c(c1)OCO2 Amb28074613 [0,1,0,1,0,0|1,0,0]=3 7291 B14R2.8824 CC(=O)c1cc(Cl)c2c(c1)OCO2 Amb33222740 [0,1,0,1,0,0|1,0,0]=3 7292 B14R2.8824 CC(O)c1cc(Br)c2c(c1)OCO2 Amb27486660 [0,1,0,1,0,0|1,0,1]=4 7293 B14R2.8824 CC(O)c1cc(Cl)c2c(c1)OCO2 Amb27872008 [0,1,0,1,0,0|1,0,1]=4 7294 B14R2.8824 C[C@@H](O)c1cc(Cl)c2c(c1)OCO2 Amb33053886 [0,1,0,1,0,0|1,0,1]=4 7295 B14R2.8824 C[C@H](O)c1cc(Cl)c2c(c1)OCO2 Amb33054032 [0,1,0,1,0,0|1,0,1]=4 7296 B14R2.8824 Cc1cc(C(=O)O)cc2c1CCC2 Amb27179169 [0,1,0,1,0,0|2,0,0]=4 7297 B14R2.8824 Cc1cc(C(=O)O)cc2c1NCC2 Amb27233579 [0,1,0,1,0,0|2,0,0]=4 7298 B14R2.8824 Cc1cc(C(=O)O)cc2c1OCN2 Amb33133024 [0,1,0,1,0,0|1,0,0]=3 7299 B14R2.8824 Cc1cc(C(=O)O)cc2ncoc12 Amb18560472 [0,1,0,1,0,0|1,0,1]=4 7300 B14R2.8824 N=C(N)c1cc(Cl)c2c(c1)OCO2 Amb8837604 [0,1,0,1,0,0|2,0,0]=4 7301 B14R2.8824 NC(=O)c1cc(Br)c2c(c1)OCO2 Amb27764504 [0,1,0,1,0,0|1,0,0]=3 7302 B14R2.8824 NC(=S)c1cc(Br)c2c(c1)OCO2 Amb9211043 [0,1,0,1,0,0|1,1,0]=4 7303 B14R2.8824 NC(=S)c1cc(Cl)c2c(c1)OCO2 Amb9211026 [0,1,0,1,0,0|1,1,0]=4 7304 B14R2.8824 O=C(O)c1cc(Br)c2c(c1)OCO2 Amb33528808 [0,1,0,1,0,0|0,0,0]=2 7305 B14R2.8824 O=C(O)c1cc(Br)c2occc2c1 Amb28398170 [0,1,0,1,0,0|1,0,1]=4 7306 B14R2.8824 O=C(O)c1cc(Cl)c2c(c1)CCN2 Amb27794980 [0,1,0,1,0,0|2,0,0]=4 7307 B14R2.8824 O=C(O)c1cc(Cl)c2c(c1)CCO2 Amb28323628 [0,1,0,1,0,0|1,0,0]=3 7308 B14R2.8824 O=C(O)c1cc(Cl)c2c(c1)OCO2 Amb36613 [0,1,0,1,0,0|0,0,0]=2 7309 B14R2.8824 O=C(O)c1cc(Cl)c2ncoc2c1 Amb28129258 [0,1,0,1,0,0|1,0,1]=4 7310 B14R2.8824 O=C(O)c1cc(Cl)c2oncc2c1 Amb27209931 [0,1,0,1,0,0|2,0,0]=4 7311 B14R2.8824 O=C(O)c1cc(F)c2c(c1)CCN2 Amb27428942 [0,1,0,1,0,0|2,0,0]=4 7312 B14R2.8824 O=C(O)c1cc(F)c2c(c1)CCO2 Amb27861027 [0,1,0,1,0,0|1,0,0]=3 7313 B14R2.8824 O=C(O)c1cc(F)c2occc2c1 Amb27633566 [0,1,0,1,0,0|1,0,1]=4 7314 B14R2.8824 O=C(O)c1cc(O)c2c(c1)OCO2 Amb8386090 [0,1,0,1,0,0|0,0,0]=2 7315 B14R2.8824 O=C(O)c1cc(O)c2ccoc2c1 Amb18128039 [0,1,0,1,0,0|1,0,1]=4 7316 B14R2.601 CC(=O)c1ccc2c(c1)CC(C)O2 Amb2227444 [0,1,0,1,0,0|2,0,0]=4 7317 B14R2.601 CC(=O)c1ccc2nc(C)oc2c1 Amb18243606 [0,1,0,1,0,0|2,0,0]=4 7318 B14R2.601 CC(=O)c1ccc2oc(C)nc2c1 Amb18065549 [0,1,0,1,0,0|2,0,0]=4 7319 B14R2.601 CC1=Nc2ccc(C(=O)O)cc2C1 Amb28139944 [0,1,0,1,0,0|2,0,0]=4 7320 B14R2.601 CC1Cc2cc(C(=O)Cl)ccc2O1 Amb9784258 [0,1,0,1,0,0|2,0,0]=4 7321 B14R2.601 CC1Cc2cc(C(=O)O)ccc2N1 Amb22371910 [0,1,0,1,0,0|2,0,0]=4 7322 B14R2.601 CC1Cc2cc(C(=O)O)ccc2O1 Amb1781525 [0,1,0,1,0,0|1,0,0]=3 7323 B14R2.601 CC1Cc2cc(C(N)=O)ccc2O1 Amb24696533 [0,1,0,1,0,0|2,0,0]=4 7324 B14R2.601 CC1Oc2ccc(C(=O)O)cc2O1 Amb27478098 [0,1,0,1,0,0|0,0,0]=2 7325 B14R2.601 CN1Cc2ccc(C(=O)O)cc2C1 Amb17480041 [0,1,0,1,0,0|2,0,0]=4 7326 B14R2.601 CN1Cc2ccc(C(=O)O)cc2C1 Amb33330866 [0,1,0,1,0,0|2,0,0]=4 7327 B14R2.601 Cc1cc2cc(C(=O)O)ccc2o1 Amb1099008 [0,1,0,1,0,0|1,0,0]=3 7328 B14R2.601 Cc1cc2cc(C(=O)O)ncc2o1 Amb28129273 [0,1,0,1,0,0|2,0,0]=4 7329 B14R2.601 Cc1cc2ccc(C(=O)O)cc2s1 Amb27659261 [0,1,0,1,0,0|1,1,0]=4 7330 B14R2.601 Cc1cc2cnc(C(=O)O)cc2o1 Amb18196459 [0,1,0,1,0,0|2,0,0]=4 7331 B14R2.601 Cc1nc2cc(C(=O)O)ccc2o1 Amb8629962 [0,1,0,1,0,0|1,0,0]=3 7332 B14R2.601 Cc1nc2cc(C(=O)O)ccc2s1 Amb8056357 [0,1,0,1,0,0|1,1,0]=4 7333 B14R2.601 Cc1nc2cc(C(=O)O)cnc2o1 Amb21965102 [0,1,0,1,0,0|2,0,0]=4 7334 B14R2.601 Cc1nc2cc(C(N)=O)ccc2o1 Amb18243643 [0,1,0,1,0,0|2,0,0]=4 7335 B14R2.601 Cc1nc2ccc(C(=O)O)cc2o1 Amb8629961 [0,1,0,1,0,0|1,0,0]=3 7336 B14R2.601 Cc1nc2ccc(C(=O)O)cc2s1 Amb2608733 [0,1,0,1,0,0|1,1,0]=4 7337 B14R2.601 Cc1nc2ccc(C(N)=O)cc2o1 Amb18243644 [0,1,0,1,0,0|2,0,0]=4 7338 B14R2.601 Cc1nc2ncc(C(=O)O)cc2o1 Amb27760865 [0,1,0,1,0,0|2,0,0]=4 7339 B14R2.601 Cn1cc2cc(C(=O)O)ccc2n1 Amb21928008 [0,1,0,1,0,0|2,0,0]=4 7340 B14R2.601 Cn1cc2ccc(C(=O)O)cc2c1 Amb17480216 [0,1,0,1,0,0|2,0,0]=4 7341 B14R2.601 Cn1cc2ccc(C(=O)O)cc2n1 Amb21928009 [0,1,0,1,0,0|2,0,0]=4 7342 B14R2.601 Cn1nc2ccc(C(=O)O)cc2n1 Amb23403589 [0,1,0,1,0,0|2,0,0]=4 7343 B14R2.601 NC1Cc2ccc(C(=O)O)cc2C1 Amb24694299 [0,1,0,1,0,0|2,0,0]=4 7344 B14R2.601 NC1Cc2ccc(C(=O)O)cc2C1 Amb32721635 [0,1,0,1,0,0|2,0,0]=4 7345 B14R2.601 Nc1nc2cc(C(=O)O)ccc2o1 Amb23527683 [0,1,0,1,0,0|1,0,1]=4 7346 B14R2.601 Nc1nc2ccc(C(=O)O)cc2o1 Amb19515264 [0,1,0,1,0,0|1,0,1]=4 7347 B14R2.601 O=C(O)c1ccc2nc(Br)oc2c1 Amb26500517 [0,1,0,1,0,0|1,0,1]=4 7348 B14R2.601 O=C(O)c1ccc2nc(F)oc2c1 Amb26568162 [0,1,0,1,0,0|1,0,1]=4 7349 B14R2.601 O=C(O)c1ccc2nc(I)oc2c1 Amb26907603 [0,1,0,1,0,0|1,0,1]=4 7350 B14R2.601 O=C(O)c1ccc2nc(S)oc2c1 Amb19515488 [0,1,0,1,0,0|1,0,1]=4 7351 B14R2.601 O=C(O)c1ccc2oc(Cl)nc2c1 Amb24054160 [0,1,0,1,0,0|1,0,1]=4 7352 B14R2.601 O=C(O)c1ccc2oc(F)nc2c1 Amb27782237 [0,1,0,1,0,0|1,0,1]=4 7353 B14R2.601 O=C(O)c1ccc2oc(I)nc2c1 Amb28133107 [0,1,0,1,0,0|1,0,1]=4 7354 B14R2.601 O=C(O)c1ccc2oc(S)nc2c1 Amb6373368 [0,1,0,1,0,0|1,0,1]=4 7355 B14R2.601 O=C1Cc2ccc(C(=O)O)cc2O1 Amb28436861 [0,1,0,1,0,0|1,0,1]=4 7356 B14R2.601 O=C1Nc2cc(C(=O)O)ccc2O1 Amb18537810 [0,1,0,1,0,0|1,0,1]=4 7357 B14R2.601 O=C1Nc2ccc(C(=O)O)cc2O1 Amb18537809 [0,1,0,1,0,0|1,0,1]=4 7358 B14R2.601 O=C1Oc2ccc(C(=O)Cl)cc2O1 Amb26644101 [0,1,0,1,0,0|1,0,1]=4 7359 B14R2.601 O=C1Oc2ccc(C(=O)O)cc2O1 Amb27179343 [0,1,0,1,0,0|0,0,1]=3 7360 B14R2.601 O=C1Oc2ccc(C(=O)O)cc2S1 Amb27494987 [0,1,0,1,0,0|0,1,1]=4 7361 B14R2.781 CC(=O)c1ccc2c(c1)CCCO2 Amb18196804 [0,1,0,1,0,0|2,0,0]=4 7362 B14R2.781 CC(=O)c1ccc2c(c1)CCOC2 Amb27776573 [0,1,0,1,0,0|2,0,0]=4 7363 B14R2.781 CC(=O)c1ccc2c(c1)COCO2 Amb18195573 [0,1,0,1,0,0|1,0,0]=3 7364 B14R2.781 CC(=O)c1ccc2c(c1)NCCO2 Amb17094120 [0,1,0,1,0,0|2,0,0]=4 7365 B14R2.781 CC(=O)c1ccc2c(c1)OCCC2 Amb27948661 [0,1,0,1,0,0|2,0,0]=4 7366 B14R2.781 CC(=O)c1ccc2c(c1)OCCO2 Amb1039808 [0,1,0,1,0,0|1,0,0]=3 7367 B14R2.781 CC(O)c1ccc2c(c1)OCCO2 Amb9748259 [0,1,0,1,0,0|1,0,1]=4 7368 B14R2.781 C[C@@H](O)c1ccc2c(c1)OCCO2 Amb6893533 [0,1,0,1,0,0|1,0,1]=4 7369 B14R2.781 C[C@H](O)c1ccc2c(c1)OCCO2 Amb6893532 [0,1,0,1,0,0|1,0,1]=4 7370 B14R2.781 N=C(N)c1ccc2c(c1)OCCO2 Amb9211240 [0,1,0,1,0,0|2,0,0]=4 7371 B14R2.781 NC(=O)c1ccc2c(c1)CCCO2 Amb9677671 [0,1,0,1,0,0|2,0,0]=4 7372 B14R2.781 NC(=O)c1ccc2c(c1)COCO2 Amb27604122 [0,1,0,1,0,0|1,0,0]=3 7373 B14R2.781 NC(=O)c1ccc2c(c1)NCCO2 Amb28058966 [0,1,0,1,0,0|2,0,0]=4 7374 B14R2.781 NC(=O)c1ccc2c(c1)OCCN2 Amb24384286 [0,1,0,1,0,0|2,0,0]=4 7375 B14R2.781 NC(=O)c1ccc2c(c1)OCCO2 Amb21962596 [0,1,0,1,0,0|1,0,0]=3 7376 B14R2.781 NC(=O)c1ccc2c(c1)OCCO2 Amb614109 [0,1,0,1,0,0|1,0,0]=3 7377 B14R2.781 NC(=S)c1ccc2c(c1)OCCO2 Amb2724735 [0,1,0,1,0,0|1,1,0]=4 7378 B14R2.781 O=C(Cl)c1ccc2c(c1)CCCO2 Amb9677573 [0,1,0,1,0,0|2,0,0]=4 7379 B14R2.781 O=C(Cl)c1ccc2c(c1)OCCO2 Amb1160211 [0,1,0,1,0,0|1,0,0]=3 7380 B14R2.781 O=C(O)C1=CC2=NCCN=C2C=C1 Amb24729451 [0,1,0,1,0,0|2,0,0]=4 7381 B14R2.781 O=C(O)C1=CNC2=NCCOC2=C1 Amb25061197 [0,1,0,1,0,0|2,0,0]=4 7382 B14R2.781 O=C(O)c1cc2c(cn1)OCCC2 Amb25350106 [0,1,0,1,0,0|2,0,0]=4 7383 B14R2.781 O=C(O)c1cc2c(cn1)OCCO2 Amb23455868 [0,1,0,1,0,0|1,0,0]=3 7384 B14R2.781 O=C(O)c1cc2c(cn1)OCCO2 Amb30526877 [0,1,0,1,0,0|1,0,0]=3 7385 B14R2.781 O=C(O)c1ccc2c(c1)C=CCC2 Amb26847796 [0,1,0,1,0,0|2,0,0]=4 7386 B14R2.781 O=C(O)c1ccc2c(c1)CCC=C2 Amb26304214 [0,1,0,1,0,0|2,0,0]=4 7387 B14R2.781 O=C(O)c1ccc2c(c1)CCCC2 Amb1215335 [0,1,0,1,0,0|2,0,0]=4 7388 B14R2.781 O=C(O)c1ccc2c(c1)CCCN2 Amb19427816 [0,1,0,1,0,0|2,0,0]=4 7389 B14R2.781 O=C(O)c1ccc2c(c1)CCCN2 Amb2724732 [0,1,0,1,0,0|2,0,0]=4 7390 B14R2.781 O=C(O)c1ccc2c(c1)CCCO2 Amb1101065 [0,1,0,1,0,0|1,0,0]=3 7391 B14R2.781 O=C(O)c1ccc2c(c1)CCCS2 Amb18130093 [0,1,0,1,0,0|1,1,0]=4 7392 B14R2.781 O=C(O)c1ccc2c(c1)CCNC2 Amb32835531 [0,1,0,1,0,0|2,0,0]=4 7393 B14R2.781 O=C(O)c1ccc2c(c1)CCNC2 Amb8630872 [0,1,0,1,0,0|2,0,0]=4 7394 B14R2.781 O=C(O)c1ccc2c(c1)CCOC2 Amb26590884 [0,1,0,1,0,0|1,0,0]=3 7395 B14R2.781 O=C(O)c1ccc2c(c1)CNCC2 Amb21963308 [0,1,0,1,0,0|2,0,0]=4 7396 B14R2.781 O=C(O)c1ccc2c(c1)CNCC2 Amb2696443 [0,1,0,1,0,0|2,0,0]=4 7397 B14R2.781 O=C(O)c1ccc2c(c1)COCC2 Amb25953924 [0,1,0,1,0,0|1,0,0]=3 7398 B14R2.781 O=C(O)c1ccc2c(c1)COCO2 Amb19149319 [0,1,0,1,0,0|0,0,0]=2 7399 B14R2.781 O=C(O)c1ccc2c(c1)NCCC2 Amb33533242 [0,1,0,1,0,0|2,0,0]=4 7400 B14R2.781 O=C(O)c1ccc2c(c1)NCCC2 Amb5846612 [0,1,0,1,0,0|2,0,0]=4 7401 B14R2.781 O=C(O)c1ccc2c(c1)NCCN2 Amb10606639 [0,1,0,1,0,0|2,0,0]=4 7402 B14R2.781 O=C(O)c1ccc2c(c1)NCCO2 Amb17199839 [0,1,0,1,0,0|1,0,0]=3 7403 B14R2.781 O=C(O)c1ccc2c(c1)NCCS2 Amb15695098 [0,1,0,1,0,0|1,1,0]=4 7404 B14R2.781 O=C(O)c1ccc2c(c1)OCCC2 Amb22234652 [0,1,0,1,0,0|1,0,0]=3 7405 B14R2.781 O=C(O)c1ccc2c(c1)OCCN2 Amb22002707 [0,1,0,1,0,0|1,0,0]=3 7406 B14R2.781 O=C(O)c1ccc2c(c1)OCCN2 Amb33330869 [0,1,0,1,0,0|1,0,0]=3 7407 B14R2.781 O=C(O)c1ccc2c(c1)OCCO2 Amb1102835 [0,1,0,1,0,0|0,0,0]=2 7408 B14R2.781 O=C(O)c1ccc2c(c1)SCCN2 Amb27408976 [0,1,0,1,0,0|1,1,0]=4 7409 B14R2.781 O=C(O)c1ccc2c(n1)CCOC2 Amb28315315 [0,1,0,1,0,0|2,0,0]=4 7410 B14R2.781 O=C(O)c1ccc2c(n1)OCCN2 Amb27219544 [0,1,0,1,0,0|2,0,0]=4 7411 B14R2.781 O=C(O)c1ccc2c(n1)OCCO2 Amb22585735 [0,1,0,1,0,0|1,0,0]=3 7412 B14R2.781 O=C(O)c1cnc2c(c1)CCCO2 Amb21961015 [0,1,0,1,0,0|2,0,0]=4 7413 B14R2.781 O=C(O)c1cnc2c(c1)CCOC2 Amb18194952 [0,1,0,1,0,0|2,0,0]=4 7414 B14R2.781 O=C(O)c1cnc2c(c1)COCC2 Amb18194963 [0,1,0,1,0,0|2,0,0]=4 7415 B14R2.781 O=C(O)c1cnc2c(c1)OCCN2 Amb33330837 [0,1,0,1,0,0|2,0,0]=4 7416 B14R2.781 O=C(O)c1cnc2c(c1)OCCO2 Amb21959491 [0,1,0,1,0,0|1,0,0]=3 7417 B14R2.781 O=C(O)c1ncc2c(n1)OCCO2 Amb27774840 [0,1,0,1,0,0|2,0,0]=4 7418 B14R2.781 O=N(=O)c1ccc2c(c1)OCCO2 Amb5630064 [0,1,0,1,0,0|1,0,1]=4 7419 B14R2.781 O=S(Cl)c1ccc2c(c1)OCCO2 Amb18570696 [0,1,0,1,0,0|2,0,0]=4 7420 B14R2.781 O=S(O)c1ccc2c(c1)CCCO2 Amb18864158 [0,1,0,1,0,0|2,0,0]=4 7421 B14R2.781 O=S(O)c1ccc2c(c1)OCCO2 Amb18566201 [0,1,0,1,0,0|1,0,0]=3 7422 B14R2.781 O=S([O-])c1ccc2c(c1)OCCO2 Amb26593862 [0,1,0,1,0,0|1,0,1]=4 7423 B14R2.781 O=[N+]([O-])c1ccc2c(c1)COCO2 Amb1351899 [0,1,0,1,0,0|1,0,1]=4 7424 B14R2.781 O=[N+]([O-])c1ccc2c(c1)OCCO2 Amb1008941 [0,1,0,1,0,0|1,0,1]=4 7425 B14R2.781 OB(O)c1ccc2c(c1)OCCO2 Amb1102732 [0,1,0,1,0,0|1,0,1]=4 7426 B14R2.8653 CC(=O)c1ccc(Br)c2c1OCO2 Amb32405759 [0,1,0,1,0,0|2,0,0]=4 7427 B14R2.8653 CC(=O)c1ccc(O)c2c1CCC2 Amb26592809 [0,1,0,1,0,0|2,0,0]=4 7428 B14R2.8653 CC(=O)c1ccc(O)c2c1OCO2 Amb26026638 [0,1,0,1,0,0|1,0,0]=3 7429 B14R2.8653 Cc1ccc(C(=O)O)c2c1CCC2 Amb18127740 [0,1,0,1,0,0|2,0,0]=4 7430 B14R2.8653 Cc1ncc(C(=O)O)c2c1COC2 Amb18824768 [0,1,0,1,0,0|2,0,0]=4 7431 B14R2.8653 Cc1ncc(C(=O)O)c2c1OCO2 Amb18193417 [0,1,0,1,0,0|2,0,0]=4 7432 B14R2.8653 NC(=O)c1ccc(Cl)c2c1CCO2 Amb33229379 [0,1,0,1,0,0|2,0,0]=4 7433 B14R2.8653 Nc1ccc(C(=O)O)c2c1CCO2 Amb28291607 [0,1,0,1,0,0|2,0,0]=4 7434 B14R2.8653 Nc1ccc(C(=O)O)c2ccoc12 Amb18196441 [0,1,0,1,0,0|1,0,1]=4 7435 B14R2.8653 O=C(O)c1ccc(Br)c2c1CCC2 Amb28240007 [0,1,0,1,0,0|2,0,0]=4 7436 B14R2.8653 O=C(O)c1ccc(Br)c2occc12 Amb26919296 [0,1,0,1,0,0|1,0,1]=4 7437 B14R2.8653 O=C(O)c1ccc(Br)c2oncc12 Amb33189277 [0,1,0,1,0,0|1,0,1]=4 7438 B14R2.8653 O=C(O)c1ccc(Cl)c2c1CCO2 Amb33229378 [0,1,0,1,0,0|1,0,0]=3 7439 B14R2.8653 O=C(O)c1ccc(Cl)c2occc12 Amb24739673 [0,1,0,1,0,0|1,0,1]=4 7440 B14R2.8653 O=C(O)c1ccc(F)c2c1OCC2 Amb33039648 [0,1,0,1,0,0|2,0,0]=4 7441 B14R2.8653 O=C(O)c1ccc(F)c2occc12 Amb27979053 [0,1,0,1,0,0|1,0,1]=4 7442 B14R2.624 CC(=O)c1cc2c(cc1Br)OCO2 Amb33223067 [0,1,0,1,0,0|1,0,0]=3 7443 B14R2.624 CC(=O)c1cc2c(cc1C)OCO2 Amb3431814 [0,1,0,1,0,0|1,0,0]=3 7444 B14R2.624 CC(=O)c1cc2c(cc1Cl)OCO2 Amb17199925 [0,1,0,1,0,0|1,0,0]=3 7445 B14R2.624 CC(=O)c1cc2c(cc1N)OCO2 Amb6335763 [0,1,0,1,0,0|1,0,0]=3 7446 B14R2.624 CC(=O)c1cc2c(cc1N)OCO2 Amb6365883 [0,1,0,1,0,0|1,0,0]=3 7447 B14R2.624 CC(=O)c1cc2c(cc1O)OCO2 Amb7172886 [0,1,0,1,0,0|1,0,0]=3 7448 B14R2.624 CC(O)c1cc2c(cc1N)OCO2 Amb24489142 [0,1,0,1,0,0|1,0,1]=4 7449 B14R2.624 C[C@@H](O)c1cc2c(cc1Br)OCO2 Amb25304177 [0,1,0,1,0,0|1,0,1]=4 7450 B14R2.624 C[C@H](O)c1cc2c(cc1Br)OCO2 Amb25710587 [0,1,0,1,0,0|1,0,1]=4 7451 B14R2.624 Cc1cc2c(cc1C(=O)O)OCC2 Amb27659637 [0,1,0,1,0,0|1,0,0]=3 7452 B14R2.624 Cc1cc2c(cc1C(=O)O)OCO2 Amb3989452 [0,1,0,1,0,0|0,0,0]=2 7453 B14R2.624 Cc1cc2c(cc1C(N)=S)OCO2 Amb27610219 [0,1,0,1,0,0|1,1,0]=4 7454 B14R2.624 Cc1cc2c(cc1S(=O)[O-])OCO2 Amb32754060 [0,1,0,1,0,0|1,0,1]=4 7455 B14R2.624 Cc1cc2c(cc1[N+](=O)[O-])OCO2 Amb6367622 [0,1,0,1,0,0|1,0,1]=4 7456 B14R2.624 Cc1cc2ccoc2cc1C(=O)O Amb27966853 [0,1,0,1,0,0|1,0,1]=4 7457 B14R2.624 N=C(N)c1cc2c(cc1Br)OCO2 Amb33056676 [0,1,0,1,0,0|2,0,0]=4 7458 B14R2.624 NC(=O)c1cc2c(cc1Br)OCO2 Amb10608762 [0,1,0,1,0,0|1,0,0]=3 7459 B14R2.624 NC(=O)c1cc2c(cc1N)OCO2 Amb24740687 [0,1,0,1,0,0|1,0,0]=3 7460 B14R2.624 NC(=S)c1cc2c(cc1Br)OCO2 Amb33056668 [0,1,0,1,0,0|1,1,0]=4 7461 B14R2.624 Nc1cc2c(cc1C(=O)O)OCO2 Amb460745 [0,1,0,1,0,0|0,0,0]=2 7462 B14R2.624 Nc1cc2c(cc1[N+](=O)[O-])OCO2 Amb1262727 [0,1,0,1,0,0|1,0,1]=4 7463 B14R2.624 O=C(O)c1cc2c(cc1Br)CCC2 Amb32670258 [0,1,0,1,0,0|2,0,0]=4 7464 B14R2.624 O=C(O)c1cc2c(cc1Br)CCN2 Amb32753842 [0,1,0,1,0,0|2,0,0]=4 7465 B14R2.624 O=C(O)c1cc2c(cc1Br)CCN2 Amb32992662 [0,1,0,1,0,0|2,0,0]=4 7466 B14R2.624 O=C(O)c1cc2c(cc1Br)OCO2 Amb33548879 [0,1,0,1,0,0|0,0,0]=2 7467 B14R2.624 O=C(O)c1cc2c(cc1Cl)CCC2 Amb32668346 [0,1,0,1,0,0|2,0,0]=4 7468 B14R2.624 O=C(O)c1cc2c(cc1Cl)NCC2 Amb20623741 [0,1,0,1,0,0|2,0,0]=4 7469 B14R2.624 O=C(O)c1cc2c(cc1Cl)OCO2 Amb17199920 [0,1,0,1,0,0|0,0,0]=2 7470 B14R2.624 O=C(O)c1cc2c(cc1F)NCC2 Amb28382289 [0,1,0,1,0,0|2,0,0]=4 7471 B14R2.624 O=C(O)c1cc2c(cc1F)OCN2 Amb33133022 [0,1,0,1,0,0|1,0,0]=3 7472 B14R2.624 O=C(O)c1cc2c(cc1I)OCO2 Amb1140567 [0,1,0,1,0,0|0,0,0]=2 7473 B14R2.624 O=C(O)c1cc2c(cc1O)OCC2 Amb27165703 [0,1,0,1,0,0|1,0,0]=3 7474 B14R2.624 O=C(O)c1cc2c(cc1O)OCO2 Amb33532086 [0,1,0,1,0,0|0,0,0]=2 7475 B14R2.624 O=C(O)c1cc2ccoc2cc1F Amb31156374 [0,1,0,1,0,0|1,0,1]=4 7476 B14R2.624 O=C(O)c1cc2occc2cc1F Amb24365902 [0,1,0,1,0,0|1,0,1]=4 7477 B14R2.624 O=[N+]([O-])c1cc2c(cc1Br)OCO2 Amb6315772 [0,1,0,1,0,0|1,0,1]=4 7478 B14R2.624 O=[N+]([O-])c1cc2c(cc1Cl)OCO2 Amb22474026 [0,1,0,1,0,0|1,0,1]=4 7479 B14R2.624 O=[N+]([O-])c1cc2c(cc1F)OCO2 Amb26632607 [0,1,0,1,0,0|1,0,1]=4 7480 B14R2.624 O=[N+]([O-])c1cc2c(cc1I)OCO2 Amb1038241 [0,1,0,1,0,0|1,0,1]=4 7481 B14R2.624 O=[N+]([O-])c1cc2c(cc1O)OCO2 Amb1089461 [0,1,0,1,0,0|1,0,1]=4 7482 B14R2.624 OB(O)c1cc2c(cc1Cl)OCO2 Amb24358253 [0,1,0,1,0,0|1,0,1]=4 7483 B14R2.624 [NH3+]c1cc2c(cc1[N+](=O)[O-])OCO2 Amb24113212 [0,1,0,1,0,0|1,0,1]=4 7484 B14R2.3062 COc1ccc(C2CO2)cc1OC Amb1138481 [0,1,0,1,0,0|1,0,1]=4 7485 B14R2.3062 COc1ccc([C@@H]2CO2)cc1OC Amb26457060 [0,1,0,1,0,0|1,0,1]=4 7486 B14R2.3062 COc1ccc([C@H]2CO2)cc1OC Amb25783373 [0,1,0,1,0,0|1,0,1]=4 7487 B14R2.5719 CN1CCc2cc(C(=O)O)ccc21 Amb6572181 [0,1,0,1,0,0|2,0,0]=4 7488 B14R2.5719 NC1CCc2cc(C(=O)O)ccc21 Amb24496724 [0,1,0,1,0,0|2,0,0]=4 7489 B14R2.5719 N[C@@H]1CCc2cc(C(=O)O)ccc21 Amb25090384 [0,1,0,1,0,0|2,0,0]=4 7490 B14R2.5719 N[C@H]1CCc2cc(C(=O)O)ccc21 Amb25062551 [0,1,0,1,0,0|2,0,0]=4 7491 B14R2.5719 N[C@H]1COc2cc(C(=O)O)ccc21 Amb27810818 [0,1,0,1,0,0|1,0,0]=3 7492 B14R2.5719 O=C(O)c1ccc2c(Cl)coc2c1 Amb27454176 [0,1,0,1,0,0|1,0,1]=4 7493 B14R2.5719 O=C(O)c1ccc2c(c1)CCC2=O Amb2699972 [0,1,0,1,0,0|1,0,1]=4 7494 B14R2.5719 O=C(O)c1ccc2c(c1)COB2O Amb27143477 [0,1,0,1,0,0|2,0,0]=4 7495 B14R2.11593 COc1cc2c(cc1OC)C(=O)C2 Amb17843972 [0,1,0,1,0,0|1,0,0]=3 7496 B14R2.5998 Cc1c(C(=O)Cl)ccc2c1OCO2 Amb27847517 [0,1,0,1,0,0|1,0,0]=3 7497 B14R2.5998 Cc1c(C(=O)O)ccc2c1NCO2 Amb33133020 [0,1,0,1,0,0|1,0,0]=3 7498 B14R2.5998 Cc1c(C(=O)O)ccc2c1OCC2 Amb27985007 [0,1,0,1,0,0|1,0,0]=3 7499 B14R2.5998 Cc1c(C(=O)O)ccc2c1OCO2 Amb28119776 [0,1,0,1,0,0|0,0,0]=2 7500 B14R2.5998 Cc1c(C(=O)O)ccc2occc12 Amb27443223 [0,1,0,1,0,0|1,0,1]=4 7501 B14R2.5998 Nc1c(C(=O)O)ccc2c1OCO2 Amb27268532 [0,1,0,1,0,0|0,0,0]=2 7502 B14R2.5998 O=C(O)c1ccc2c(c1I)CCC2 Amb27476334 [0,1,0,1,0,0|2,0,0]=4 7503 B14R2.5998 O=C(O)c1ccc2c(c1O)CCC2 Amb27179141 [0,1,0,1,0,0|2,0,0]=4 7504 B14R2.5998 O=C(O)c1ccc2c(c1O)OCO2 Amb17842912 [0,1,0,1,0,0|0,0,0]=2 7505 B14R2.5998 O=C(O)c1ccc2occc2c1O Amb18195743 [0,1,0,1,0,0|1,0,1]=4 7506 B14R2.5998 OB(O)c1ccc2c(c1F)OCO2 Amb22228823 [0,1,0,1,0,0|1,0,1]=4 7507 B14R3.3015 c1cc2c(cc1C3CO3)OCO2 Amb1127751 [0,0,0,2,0,0|1,0,1]=4 7508 B14R3.3015 c1cc2c(cc1[C@@H]3CO3)OCO2 Amb27770711 [0,0,0,2,0,0|1,0,1]=4 7509 B14R3.3015 c1cc2c(cc1[C@H]3CO3)OCO2 Amb25822548 [0,0,0,2,0,0|1,0,1]=4 7510 B14R3.8268 O=C1Cc2cc3c(cc21)OCO3 Amb17850797 [0,0,0,2,0,0|1,0,0]=3 7511 B14R3.8268 OC1Cc2cc3c(cc21)OCO3 Amb27653182 [0,0,0,2,0,0|1,0,1]=4 7512 B10R1.58 Cc1cc(C(=O)O)cn1C Amb22886607 [1,0,0,0,1,0|2,0,0]=4 7513 B10R1.58 Cc1cc(C(=O)O)oc1Br Amb32679203 [1,0,0,0,1,0|2,0,0]=4 7514 B10R1.58 Cc1cc(C(=O)O)oc1C Amb2722738 [1,0,0,0,1,0|2,0,0]=4 7515 B10R1.58 Cc1cc(C(=O)O)oc1N Amb18831791 [1,0,0,0,1,0|2,0,0]=4 7516 B10R1.58 Cc1cc(C(=O)O)sc1Br Amb20622803 [1,0,0,0,1,0|2,0,0]=4 7517 B10R1.58 Cc1cc(C(=O)O)sc1C Amb1107632 [1,0,0,0,1,0|2,0,0]=4 7518 B10R1.58 Cc1cc(C(=O)O)sc1Cl Amb4056788 [1,0,0,0,1,0|2,0,0]=4 7519 B10R1.58 Cc1cc(C(=O)O)sc1N Amb18830630 [1,0,0,0,1,0|2,0,0]=4 7520 B10R1.58 Cc1oc(C(=O)O)cc1Br Amb23537903 [1,0,0,0,1,0|2,0,0]=4 7521 B10R1.58 Cc1oc(C(=O)O)cc1Cl Amb28049350 [1,0,0,0,1,0|2,0,0]=4 7522 B10R1.58 Cc1oc(C(=O)O)cc1N Amb18280933 [1,0,0,0,1,0|2,0,0]=4 7523 B10R1.58 Cc1sc(C(=O)O)cc1Br Amb2611509 [1,0,0,0,1,0|2,0,0]=4 7524 B10R1.58 Cc1sc(C(=O)O)cc1Cl Amb23537641 [1,0,0,0,1,0|2,0,0]=4 7525 B10R1.58 Cc1sc(C(=O)O)cc1F Amb18830296 [1,0,0,0,1,0|2,0,0]=4 7526 B10R1.58 Cc1sc(C(=O)O)nc1O Amb24061368 [1,0,0,0,1,0|2,0,0]=4 7527 B10R1.58 Cn1cc(C(=O)O)cc1Br Amb27446881 [1,0,0,0,1,0|2,0,0]=4 7528 B10R1.58 Cn1nc(C(=O)O)cc1O Amb10067428 [1,0,0,0,1,0|2,0,0]=4 7529 B10R1.58 O=C(O)c1cc(Br)c(O)o1 Amb29860796 [1,0,0,0,1,0|2,0,0]=4 7530 B10R1.194 Cc1c(Br)csc1C(=O)O Amb2685345 [1,0,0,0,1,0|2,0,0]=4 7531 B10R1.194 Cc1c(Br)csc1C(=O)O Amb29599234 [1,0,0,0,1,0|2,0,0]=4 7532 B10R1.194 Cc1c(C(=O)O)ccn1C Amb18832115 [1,0,0,0,1,0|2,0,0]=4 7533 B10R1.194 Cc1c(C(=O)O)coc1Br Amb28255748 [1,0,0,0,1,0|2,0,0]=4 7534 B10R1.194 Cc1c(C(=O)O)csc1Br Amb26320492 [1,0,0,0,1,0|2,0,0]=4 7535 B10R1.194 Cc1c(C(=O)O)csc1N Amb27425082 [1,0,0,0,1,0|2,0,0]=4 7536 B10R1.194 Cc1c(C(=O)O)noc1O Amb27622492 [1,0,0,0,1,0|2,0,0]=4 7537 B10R1.194 Cc1c(I)csc1C(=O)O Amb22755166 [1,0,0,0,1,0|2,0,0]=4 7538 B10R1.194 Cc1c(N)csc1C(=O)O Amb18830627 [1,0,0,0,1,0|2,0,0]=4 7539 B10R1.194 Cc1ccc(C(=O)O)n1C Amb33545041 [1,0,0,0,1,0|2,0,0]=4 7540 B10R1.194 Cc1coc(C(=O)O)c1C Amb25713755 [1,0,0,0,1,0|2,0,0]=4 7541 B10R1.194 Cc1csc(C(=O)O)c1C Amb18830772 [1,0,0,0,1,0|2,0,0]=4 7542 B10R1.194 Cc1scc(C(=O)O)c1C Amb6497427 [1,0,0,0,1,0|2,0,0]=4 7543 B10R1.194 Cn1c(Br)ccc1C(=O)O Amb17595416 [1,0,0,0,1,0|2,0,0]=4 7544 B10R1.194 Cn1c(C(=O)O)cnc1O Amb18862463 [1,0,0,0,1,0|2,0,0]=4 7545 B10R1.194 Cn1c(Cl)ccc1C(=O)O Amb18199516 [1,0,0,0,1,0|2,0,0]=4 7546 B10R1.194 Cn1c(N)ccc1C(=O)O Amb27445912 [1,0,0,0,1,0|2,0,0]=4 7547 B10R1.194 O=C(O)c1occ(O)c1O Amb28050064 [1,0,0,0,1,0|1,0,0]=3 7548 B10R1.194 O=C(O)c1scc(Br)c1O Amb25103760 [1,0,0,0,1,0|2,0,0]=4 7549 B10R1.31 CCc1cc(C(=O)O)co1 Amb27968844 [1,0,0,0,1,0|2,0,0]=4 7550 B10R1.31 CCc1cc(C(=O)O)cs1 Amb1934809 [1,0,0,0,1,0|2,0,0]=4 7551 B10R1.31 CCc1ccc(C(=O)O)o1 Amb1071829 [1,0,0,0,1,0|2,0,0]=4 7552 B10R1.31 CCc1ccc(C(=O)O)s1 Amb1216581 [1,0,0,0,1,0|2,0,0]=4 7553 B10R1.31 CCn1ccc(C(=O)O)c1 Amb23441090 [1,0,0,0,1,0|2,0,0]=4 7554 B10R1.31 COc1cc(C(=O)O)on1 Amb2447451 [1,0,0,0,1,0|2,0,0]=4 7555 B10R1.31 COc1cc(C(=O)O)sn1 Amb24504313 [1,0,0,0,1,0|2,0,0]=4 7556 B10R1.31 COc1ccc(C(=O)Cl)o1 Amb27969766 [1,0,0,0,1,0|2,0,0]=4 7557 B10R1.31 COc1ccc(C(=O)O)o1 Amb4292093 [1,0,0,0,1,0|1,0,0]=3 7558 B10R1.31 COc1ccc(C(=O)O)s1 Amb2611701 [1,0,0,0,1,0|1,0,0]=3 7559 B10R1.31 COc1ccc(C(C)=O)s1 Amb28126809 [1,0,0,0,1,0|2,0,0]=4 7560 B10R1.31 COc1ccc(C(N)=O)o1 Amb28388834 [1,0,0,0,1,0|2,0,0]=4 7561 B10R1.31 COc1ccc(C(N)=O)s1 Amb27974232 [1,0,0,0,1,0|2,0,0]=4 7562 B10R1.31 COc1cnc(C(=O)O)o1 Amb3428237 [1,0,0,0,1,0|2,0,0]=4 7563 B10R1.31 COc1cnc(C(=O)O)s1 Amb28343037 [1,0,0,0,1,0|2,0,0]=4 7564 B10R1.31 COc1coc(C(=O)O)c1 Amb18643783 [1,0,0,0,1,0|1,0,0]=3 7565 B10R1.31 COc1coc(C(=O)O)n1 Amb18202497 [1,0,0,0,1,0|2,0,0]=4 7566 B10R1.31 COc1csc(C(=O)Cl)c1 Amb25182501 [1,0,0,0,1,0|2,0,0]=4 7567 B10R1.31 COc1csc(C(=O)O)c1 Amb33528140 [1,0,0,0,1,0|1,0,0]=3 7568 B10R1.31 COc1csc(C(N)=O)c1 Amb26967077 [1,0,0,0,1,0|2,0,0]=4 7569 B10R1.31 COc1nc(C(=O)O)co1 Amb25064800 [1,0,0,0,1,0|2,0,0]=4 7570 B10R1.31 COc1nc(C(=O)O)cs1 Amb27658512 [1,0,0,0,1,0|2,0,0]=4 7571 B10R1.31 COc1ncc(C(=O)O)s1 Amb2592213 [1,0,0,0,1,0|2,0,0]=4 7572 B10R1.31 CSc1cc(C(=O)O)co1 Amb28645149 [1,0,0,0,1,0|1,1,0]=4 7573 B10R1.31 CSc1cc(C(=O)O)cs1 Amb27617118 [1,0,0,0,1,0|1,1,0]=4 7574 B10R1.31 CSc1ccc(C(=O)O)o1 Amb18959560 [1,0,0,0,1,0|1,1,0]=4 7575 B10R1.31 CSc1ccc(C(=O)O)s1 Amb1102122 [1,0,0,0,1,0|1,1,0]=4 7576 B10R1.39 CCc1ccoc1C(=O)O Amb26074341 [1,0,0,0,1,0|2,0,0]=4 7577 B10R1.39 CCc1ccsc1C(=O)O Amb5492701 [1,0,0,0,1,0|2,0,0]=4 7578 B10R1.39 CCc1cscc1C(=O)O Amb18830769 [1,0,0,0,1,0|2,0,0]=4 7579 B10R1.39 CCc1occc1C(=O)O Amb18643495 [1,0,0,0,1,0|2,0,0]=4 7580 B10R1.39 CCc1sccc1C(=O)O Amb8439411 [1,0,0,0,1,0|2,0,0]=4 7581 B10R1.39 CCn1cccc1C(=O)O Amb33531567 [1,0,0,0,1,0|2,0,0]=4 7582 B10R1.39 COc1ccoc1C(C)=O Amb18831941 [1,0,0,0,1,0|2,0,0]=4 7583 B10R1.39 COc1ccsc1C(=O)Cl Amb25299101 [1,0,0,0,1,0|2,0,0]=4 7584 B10R1.39 COc1ccsc1C(=O)O Amb2434046 [1,0,0,0,1,0|1,0,0]=3 7585 B10R1.39 COc1ccsc1C(C)=O Amb18830768 [1,0,0,0,1,0|2,0,0]=4 7586 B10R1.39 COc1ccsc1C(N)=O Amb9677680 [1,0,0,0,1,0|2,0,0]=4 7587 B10R1.39 COc1cscc1C(=O)Cl Amb10071432 [1,0,0,0,1,0|2,0,0]=4 7588 B10R1.39 COc1cscc1C(=O)O Amb2689283 [1,0,0,0,1,0|1,0,0]=3 7589 B10R1.39 COc1cscc1C(N)=O Amb2724429 [1,0,0,0,1,0|2,0,0]=4 7590 B10R1.39 COc1nscc1C(=O)O Amb8010604 [1,0,0,0,1,0|2,0,0]=4 7591 B10R1.39 COc1occc1C(C)=O Amb26021214 [1,0,0,0,1,0|2,0,0]=4 7592 B10R1.39 COc1oncc1C(=O)O Amb8010900 [1,0,0,0,1,0|2,0,0]=4 7593 B10R1.39 COc1sccc1C(=O)Cl Amb26432347 [1,0,0,0,1,0|2,0,0]=4 7594 B10R1.39 COc1sccc1C(=O)O Amb18645000 [1,0,0,0,1,0|1,0,0]=3 7595 B10R1.39 COn1cccc1C(=O)Cl Amb27634057 [1,0,0,0,1,0|2,0,0]=4 7596 B10R1.39 CSc1ccsc1C(=O)O Amb18126750 [1,0,0,0,1,0|1,1,0]=4 7597 B10R1.39 CSc1sccc1C(=O)O Amb2611519 [1,0,0,0,1,0|1,1,0]=4 7598 B10R1.35 COc1cc(C=O)cn1C Amb18832098 [1,0,0,0,1,0|2,0,0]=4 7599 B10R1.35 COc1cc(C=O)sc1Br Amb33728226 [1,0,0,0,1,0|2,0,0]=4 7600 B10R1.35 COc1sc(C=O)cc1Br Amb18658456 [1,0,0,0,1,0|2,0,0]=4 7601 B10R1.257 COc1c(C)csc1C=O Amb27425099 [1,0,0,0,1,0|2,0,0]=4 7602 B12R1.438 C#Cc1cccc(CC(=O)O)c1 Amb23399902 [1,0,0,0,0,1|1,0,1]=4 7603 B12R1.438 CCc1cc(CC(=O)O)ccn1 Amb26478727 [1,0,0,0,0,1|2,0,0]=4 7604 B12R1.438 CCc1cccc(CC(=O)O)c1 Amb10844304 [1,0,0,0,0,1|1,0,0]=3 7605 B12R1.438 CCc1cccc(CC(=O)O)n1 Amb18828389 [1,0,0,0,0,1|2,0,0]=4 7606 B12R1.438 CCc1cccc(CC(C)=O)c1 Amb25973022 [1,0,0,0,0,1|2,0,0]=4 7607 B12R1.438 CCc1cccc(NC(=O)Cl)c1 Amb35637102 [1,0,0,0,0,1|2,0,0]=4 7608 B12R1.438 CCc1cccc(NC(C)=O)c1 Amb3372524 [1,0,0,0,0,1|2,0,0]=4 7609 B12R1.438 CCc1cccc(NC(N)=O)c1 Amb1132162 [1,0,0,0,0,1|2,0,0]=4 7610 B12R1.438 CCc1cccc(OC(=O)Cl)c1 Amb24360368 [1,0,0,0,0,1|2,0,0]=4 7611 B12R1.438 CCc1cccc(OC(C)=O)c1 Amb25899498 [1,0,0,0,0,1|2,0,0]=4 7612 B12R1.438 CCc1ccnc(CC(=O)O)c1 Amb18828432 [1,0,0,0,0,1|2,0,0]=4 7613 B12R1.438 CCc1cncc(CC(=O)O)c1 Amb28322834 [1,0,0,0,0,1|2,0,0]=4 7614 B12R1.438 CNc1cccc(NC(C)=O)c1 Amb6711403 [1,0,0,0,0,1|2,0,0]=4 7615 B12R1.438 COc1cc(CC(=O)O)ccn1 Amb20247912 [1,0,0,0,0,1|1,0,0]=3 7616 B12R1.438 COc1cc(CC(=O)O)ccn1 Amb33552599 [1,0,0,0,0,1|1,0,0]=3 7617 B12R1.438 COc1cc(CC(C)=O)ccn1 Amb28370305 [1,0,0,0,0,1|2,0,0]=4 7618 B12R1.438 COc1cccc(CB(O)O)c1 Amb27648726 [1,0,0,0,0,1|1,0,1]=4 7619 B12R1.438 COc1cccc(CC(=N)N)c1 Amb2696301 [1,0,0,0,0,1|2,0,0]=4 7620 B12R1.438 COc1cccc(CC(=N)N)c1 Amb33551944 [1,0,0,0,0,1|2,0,0]=4 7621 B12R1.438 COc1cccc(CC(=O)Cl)c1 Amb2720506 [1,0,0,0,0,1|1,0,0]=3 7622 B12R1.438 COc1cccc(CC(=O)O)c1 Amb2722757 [1,0,0,0,0,1|0,0,0]=2 7623 B12R1.438 COc1cccc(CC(=O)O)n1 Amb20247608 [1,0,0,0,0,1|1,0,0]=3 7624 B12R1.438 COc1cccc(CC(=O)O)n1 Amb30594596 [1,0,0,0,0,1|1,0,0]=3 7625 B12R1.438 COc1cccc(CC(=O)[O-])c1 Amb33513052 [1,0,0,0,0,1|0,0,1]=3 7626 B12R1.438 COc1cccc(CC(=O)[O-])n1 Amb33534206 [1,0,0,0,0,1|1,0,1]=4 7627 B12R1.438 COc1cccc(CC(C)=O)c1 Amb2689177 [1,0,0,0,0,1|1,0,0]=3 7628 B12R1.438 COc1cccc(CC(C)=O)n1 Amb24675749 [1,0,0,0,0,1|2,0,0]=4 7629 B12R1.438 COc1cccc(CC(C)O)c1 Amb17477577 [1,0,0,0,0,1|1,0,1]=4 7630 B12R1.438 COc1cccc(CC(N)=O)c1 Amb2722759 [1,0,0,0,0,1|1,0,0]=3 7631 B12R1.438 COc1cccc(CC(N)=O)n1 Amb28125400 [1,0,0,0,0,1|2,0,0]=4 7632 B12R1.438 COc1cccc(CC(N)=S)c1 Amb6247687 [1,0,0,0,0,1|1,1,0]=4 7633 B12R1.438 COc1cccc(CC(O)=S)c1 Amb25132921 [1,0,0,0,0,1|0,1,0]=3 7634 B12R1.438 COc1cccc(CN(C)O)c1 Amb33200965 [1,0,0,0,0,1|2,0,0]=4 7635 B12R1.438 COc1cccc(CS(=O)[O-])c1 Amb32753969 [1,0,0,0,0,1|1,0,1]=4 7636 B12R1.438 COc1cccc(CS(C)=O)c1 Amb27187790 [1,0,0,0,0,1|2,0,0]=4 7637 B12R1.438 COc1cccc(C[C@@H](C)O)c1 Amb22896917 [1,0,0,0,0,1|1,0,1]=4 7638 B12R1.438 COc1cccc(C[C@H](C)O)c1 Amb27243727 [1,0,0,0,0,1|1,0,1]=4 7639 B12R1.438 COc1cccc(C[N+](=O)[O-])c1 Amb31378498 [1,0,0,0,0,1|1,0,1]=4 7640 B12R1.438 COc1cccc(NC(=N)N)c1 Amb6429693 [1,0,0,0,0,1|2,0,0]=4 7641 B12R1.438 COc1cccc(NC(C)=O)c1 Amb1208566 [1,0,0,0,0,1|1,0,0]=3 7642 B12R1.438 COc1cccc(NC(C)=S)c1 Amb27490932 [1,0,0,0,0,1|1,1,0]=4 7643 B12R1.438 COc1cccc(NC(N)=O)c1 Amb1126089 [1,0,0,0,0,1|1,0,0]=3 7644 B12R1.438 COc1cccc(NC(N)=S)c1 Amb1207975 [1,0,0,0,0,1|1,1,0]=4 7645 B12R1.438 COc1cccc(OB(O)O)c1 Amb27653602 [1,0,0,0,0,1|1,0,1]=4 7646 B12R1.438 COc1cccc(OC(C)=O)c1 Amb4017885 [1,0,0,0,0,1|1,0,0]=3 7647 B12R1.438 COc1cccc(SC(=O)Cl)c1 Amb2689203 [1,0,0,0,0,1|1,0,0]=3 7648 B12R1.438 COc1cccc(SC(C)=O)c1 Amb25837474 [1,0,0,0,0,1|1,0,0]=3 7649 B12R1.438 COc1cccc(\C=C(\C)N)c1 Amb27860335 [1,0,0,0,0,1|2,0,0]=4 7650 B12R1.438 COc1ccnc(CC(=O)O)c1 Amb25279462 [1,0,0,0,0,1|1,0,0]=3 7651 B12R1.438 COc1ccnc(CC(=O)O)n1 Amb24580078 [1,0,0,0,0,1|2,0,0]=4 7652 B12R1.438 COc1ccnc(CC(=O)[O-])c1 Amb30634090 [1,0,0,0,0,1|1,0,1]=4 7653 B12R1.438 COc1ccnc(CC(C)=O)c1 Amb28066667 [1,0,0,0,0,1|2,0,0]=4 7654 B12R1.438 COc1cncc(CC(=O)O)c1 Amb20247609 [1,0,0,0,0,1|1,0,0]=3 7655 B12R1.438 COc1cncc(CC(=O)O)n1 Amb27760338 [1,0,0,0,0,1|2,0,0]=4 7656 B12R1.438 COc1cncc(CC(C)=O)c1 Amb27240243 [1,0,0,0,0,1|2,0,0]=4 7657 B12R1.438 CSc1cc(CC(=O)O)ccn1 Amb27983306 [1,0,0,0,0,1|1,1,0]=4 7658 B12R1.438 CSc1cccc(CC(=O)O)c1 Amb10070613 [1,0,0,0,0,1|0,1,0]=3 7659 B12R1.438 CSc1cccc(CC(C)=O)c1 Amb27636740 [1,0,0,0,0,1|1,1,0]=4 7660 B12R1.438 CSc1cccc(CC(N)=O)c1 Amb26503441 [1,0,0,0,0,1|1,1,0]=4 7661 B12R1.438 CSc1cccc(NC(=O)Cl)c1 Amb35636943 [1,0,0,0,0,1|1,1,0]=4 7662 B12R1.438 CSc1cccc(NC(C)=O)c1 Amb2661171 [1,0,0,0,0,1|1,1,0]=4 7663 B12R1.438 CSc1cccc(NC(N)=O)c1 Amb2762964 [1,0,0,0,0,1|1,1,0]=4 7664 B12R1.438 CSc1cccc(SC(C)=O)c1 Amb26455710 [1,0,0,0,0,1|1,1,0]=4 7665 B12R1.438 N#Cc1cccc(CC(=O)O)c1 Amb2696502 [1,0,0,0,0,1|2,0,0]=4 7666 B12R1.438 NCc1cccc(CC(=O)O)c1 Amb25309107 [1,0,0,0,0,1|2,0,0]=4 7667 B12R1.438 O=C(O)Cc1cccc(CBr)c1 Amb21962543 [1,0,0,0,0,1|2,0,0]=4 7668 B12R1.438 O=C(O)Cc1cccc(CCl)c1 Amb8387737 [1,0,0,0,0,1|2,0,0]=4 7669 B12R1.438 O=C(O)Cc1cccc(CF)c1 Amb27646709 [1,0,0,0,0,1|2,0,0]=4 7670 B12R1.438 O=Cc1cccc(CC(=O)O)c1 Amb22750419 [1,0,0,0,0,1|2,0,0]=4 7671 B12R1.1891 COC1=CC=C(C(=O)O)CC=C1 Amb2615438 [1,0,0,0,0,1|0,0,1]=3 7672 B12R1.1891 COC1=NC=C(C(C)=O)C=CC1 Amb25214052 [1,0,0,0,0,1|1,0,1]=4 7673 B12R1.1891 COC1=NC=CC(C(C)=O)=CC1 Amb25983154 [1,0,0,0,0,1|2,0,0]=4 7674 B12R1.1905 COC1=CC(=O)C=CC(N=O)=C1 Amb28253909 [1,0,0,0,0,1|1,0,1]=4 7675 B12R1.57 CCc1cc(Br)ccc1C(=O)O Amb19892514 [0,0,0,0,1,1|2,0,0]=4 7676 B12R1.57 CCc1cc(C)ccc1C(=O)O Amb27663411 [0,0,0,0,1,1|2,0,0]=4 7677 B12R1.57 CCc1cc(Cl)ccc1C(=O)O Amb18649030 [0,0,0,0,1,1|2,0,0]=4 7678 B12R1.57 CCc1cc(F)ccc1C(=O)O Amb24461341 [0,0,0,0,1,1|2,0,0]=4 7679 B12R1.57 CCc1cc(N)ccc1C(=O)O Amb25108500 [0,0,0,0,1,1|2,0,0]=4 7680 B12R1.57 CCc1cc(O)ccc1C(=O)O Amb18556004 [0,0,0,0,1,1|1,0,0]=3 7681 B12R1.57 CCc1cc(O)ccc1C(C)=O Amb18556009 [0,0,0,0,1,1|2,0,0]=4 7682 B12R1.57 CCc1cc(S)ccc1C(=O)O Amb27196448 [0,0,0,0,1,1|1,1,0]=4 7683 B12R1.57 CCc1nc(Cl)ccc1C(=O)O Amb28066662 [0,0,0,0,1,1|2,0,0]=4 7684 B12R1.57 CCc1nc(O)ccc1C(=O)O Amb27231562 [0,0,0,0,1,1|1,0,0]=3 7685 B12R1.57 CCc1nc(O)ncc1C(=O)O Amb18826773 [0,0,0,0,1,1|2,0,0]=4 7686 B12R1.57 CNc1cc(Br)ccc1C(=O)O Amb18135188 [0,0,0,0,1,1|2,0,0]=4 7687 B12R1.57 CNc1cc(C)ccc1C(=O)O Amb18287044 [0,0,0,0,1,1|2,0,0]=4 7688 B12R1.57 CNc1cc(Cl)ccc1C(=O)O Amb18288632 [0,0,0,0,1,1|2,0,0]=4 7689 B12R1.57 CNc1cc(F)ccc1C(=O)O Amb13884838 [0,0,0,0,1,1|2,0,0]=4 7690 B12R1.57 CNc1cc(I)ccc1C(=O)O Amb24467947 [0,0,0,0,1,1|2,0,0]=4 7691 B12R1.57 CNc1cc(N)ccc1C(=O)O Amb27425324 [0,0,0,0,1,1|2,0,0]=4 7692 B12R1.57 CNc1nc(C)ccc1C(=O)O Amb7969797 [0,0,0,0,1,1|2,0,0]=4 7693 B12R1.57 COC1=CC(=O)NC=C1C(=O)O Amb27613178 [0,0,0,0,1,1|1,0,1]=4 7694 B12R1.57 COc1cc(Br)ccc1C(=O)Cl Amb21985084 [0,0,0,0,1,1|2,0,0]=4 7695 B12R1.57 COc1cc(Br)ccc1C(=O)O Amb9025521 [0,0,0,0,1,1|1,0,0]=3 7696 B12R1.57 COc1cc(Br)ccc1C(C)=O Amb21964820 [0,0,0,0,1,1|2,0,0]=4 7697 B12R1.57 COc1cc(Br)ccc1C(N)=O Amb13951976 [0,0,0,0,1,1|2,0,0]=4 7698 B12R1.57 COc1cc(Br)cnc1C(=O)O Amb13889806 [0,0,0,0,1,1|2,0,0]=4 7699 B12R1.57 COc1cc(Br)ncc1C(=O)O Amb23403564 [0,0,0,0,1,1|2,0,0]=4 7700 B12R1.57 COc1cc(C)ccc1C(=O)Cl Amb6760018 [0,0,0,0,1,1|2,0,0]=4 7701 B12R1.57 COc1cc(C)ccc1C(=O)O Amb2689139 [0,0,0,0,1,1|1,0,0]=3 7702 B12R1.57 COc1cc(C)ccc1C(C)=O Amb463308 [0,0,0,0,1,1|2,0,0]=4 7703 B12R1.57 COc1cc(C)ccc1C(N)=O Amb6760019 [0,0,0,0,1,1|2,0,0]=4 7704 B12R1.57 COc1cc(C)cnc1C(=O)O Amb23437557 [0,0,0,0,1,1|2,0,0]=4 7705 B12R1.57 COc1cc(C)ncc1C(=O)O Amb24460757 [0,0,0,0,1,1|2,0,0]=4 7706 B12R1.57 COc1cc(Cl)ccc1C(=O)Cl Amb18956365 [0,0,0,0,1,1|2,0,0]=4 7707 B12R1.57 COc1cc(Cl)ccc1C(=O)O Amb3939974 [0,0,0,0,1,1|1,0,0]=3 7708 B12R1.57 COc1cc(Cl)ccc1C(=O)[O-] Amb33513202 [0,0,0,0,1,1|1,0,1]=4 7709 B12R1.57 COc1cc(Cl)ccc1C(C)=O Amb25126598 [0,0,0,0,1,1|2,0,0]=4 7710 B12R1.57 COc1cc(Cl)ccc1C(N)=O Amb19069937 [0,0,0,0,1,1|2,0,0]=4 7711 B12R1.57 COc1cc(Cl)cnc1C(=O)O Amb27250534 [0,0,0,0,1,1|2,0,0]=4 7712 B12R1.57 COc1cc(Cl)ncc1C(=O)O Amb10975656 [0,0,0,0,1,1|2,0,0]=4 7713 B12R1.57 COc1cc(F)ccc1C(=O)Cl Amb19888079 [0,0,0,0,1,1|2,0,0]=4 7714 B12R1.57 COc1cc(F)ccc1C(=O)O Amb1229369 [0,0,0,0,1,1|1,0,0]=3 7715 B12R1.57 COc1cc(F)ccc1C(C)=O Amb535716 [0,0,0,0,1,1|2,0,0]=4 7716 B12R1.57 COc1cc(F)cnc1C(=O)O Amb25751206 [0,0,0,0,1,1|2,0,0]=4 7717 B12R1.57 COc1cc(F)ncc1C(=O)O Amb27480359 [0,0,0,0,1,1|2,0,0]=4 7718 B12R1.57 COc1cc(I)ccc1C(=O)Cl Amb21985087 [0,0,0,0,1,1|2,0,0]=4 7719 B12R1.57 COc1cc(I)ccc1C(=O)O Amb6298280 [0,0,0,0,1,1|1,0,0]=3 7720 B12R1.57 COc1cc(I)ccc1C(N)=O Amb21985086 [0,0,0,0,1,1|2,0,0]=4 7721 B12R1.57 COc1cc(N)ccc1C(=O)O Amb2410964 [0,0,0,0,1,1|1,0,0]=3 7722 B12R1.57 COc1cc(N)ccc1C(C)=O Amb21964662 [0,0,0,0,1,1|2,0,0]=4 7723 B12R1.57 COc1cc(N)ccc1C(N)=O Amb25109715 [0,0,0,0,1,1|2,0,0]=4 7724 B12R1.57 COc1cc(N)cnc1C(=O)O Amb27861467 [0,0,0,0,1,1|2,0,0]=4 7725 B12R1.57 COc1cc(N)ncc1C(=O)O Amb27175521 [0,0,0,0,1,1|2,0,0]=4 7726 B12R1.57 COc1cc(O)ccc1B(O)O Amb22756418 [0,0,0,0,1,1|1,0,1]=4 7727 B12R1.57 COc1cc(O)ccc1C(=N)N Amb26373821 [0,0,0,0,1,1|2,0,0]=4 7728 B12R1.57 COc1cc(O)ccc1C(=O)Cl Amb28054843 [0,0,0,0,1,1|1,0,0]=3 7729 B12R1.57 COc1cc(O)ccc1C(=O)O Amb2698053 [0,0,0,0,1,1|0,0,0]=2 7730 B12R1.57 COc1cc(O)ccc1C(C)=O Amb8439736 [0,0,0,0,1,1|1,0,0]=3 7731 B12R1.57 COc1cc(O)ccc1C(N)=O Amb26023042 [0,0,0,0,1,1|1,0,0]=3 7732 B12R1.57 COc1cc(O)ccc1C(N)=S Amb27216650 [0,0,0,0,1,1|1,1,0]=4 7733 B12R1.57 COc1cc(O)ccc1N(=O)=O Amb20621526 [0,0,0,0,1,1|1,0,1]=4 7734 B12R1.57 COc1cc(O)ccc1[C@@H](C)O Amb33313144 [0,0,0,0,1,1|1,0,1]=4 7735 B12R1.57 COc1cc(O)ccc1[C@H](C)O Amb33313143 [0,0,0,0,1,1|1,0,1]=4 7736 B12R1.57 COc1cc(O)ccc1[N+](=O)[O-] Amb13884839 [0,0,0,0,1,1|1,0,1]=4 7737 B12R1.57 COc1nc(Br)ccc1C(=O)O Amb22234823 [0,0,0,0,1,1|1,0,0]=3 7738 B12R1.57 COc1nc(Br)ccc1C(C)=O Amb22495287 [0,0,0,0,1,1|2,0,0]=4 7739 B12R1.57 COc1nc(Br)ccc1C(N)=O Amb22495295 [0,0,0,0,1,1|2,0,0]=4 7740 B12R1.57 COc1nc(C)ccc1C(=O)O Amb9753506 [0,0,0,0,1,1|1,0,0]=3 7741 B12R1.57 COc1nc(C)ccc1C(C)=O Amb27836852 [0,0,0,0,1,1|2,0,0]=4 7742 B12R1.57 COc1nc(C)ccc1S(=O)O Amb32992455 [0,0,0,0,1,1|2,0,0]=4 7743 B12R1.57 COc1nc(C)cnc1C(=O)O Amb26386944 [0,0,0,0,1,1|2,0,0]=4 7744 B12R1.57 COc1nc(C)ncc1C(=O)O Amb18646860 [0,0,0,0,1,1|2,0,0]=4 7745 B12R1.57 COc1nc(Cl)ccc1C(=O)Cl Amb26575356 [0,0,0,0,1,1|2,0,0]=4 7746 B12R1.57 COc1nc(Cl)ccc1C(=O)O Amb21856444 [0,0,0,0,1,1|1,0,0]=3 7747 B12R1.57 COc1nc(Cl)ccc1C(C)=O Amb26879789 [0,0,0,0,1,1|2,0,0]=4 7748 B12R1.57 COc1nc(Cl)ccc1C(N)=O Amb26564245 [0,0,0,0,1,1|2,0,0]=4 7749 B12R1.57 COc1nc(Cl)ncc1C(=O)O Amb23403677 [0,0,0,0,1,1|2,0,0]=4 7750 B12R1.57 COc1nc(N)ccc1C(=O)O Amb27815009 [0,0,0,0,1,1|1,0,0]=3 7751 B12R1.57 COc1nc(O)ccc1C(=O)O Amb28384782 [0,0,0,0,1,1|0,0,0]=2 7752 B12R1.57 CSc1cc(Br)ccc1C(=O)O Amb33552355 [0,0,0,0,1,1|1,1,0]=4 7753 B12R1.57 CSc1cc(C)ccc1C(=O)O Amb18287072 [0,0,0,0,1,1|1,1,0]=4 7754 B12R1.57 CSc1cc(Cl)ccc1C(=O)O Amb18967542 [0,0,0,0,1,1|1,1,0]=4 7755 B12R1.57 CSc1cc(F)ccc1C(=O)O Amb2371920 [0,0,0,0,1,1|1,1,0]=4 7756 B12R1.57 CSc1cc(N)ccc1C(=O)O Amb26643441 [0,0,0,0,1,1|1,1,0]=4 7757 B12R1.57 CSc1cc(O)ccc1C(=O)O Amb27637612 [0,0,0,0,1,1|0,1,0]=3 7758 B12R1.57 CSc1nc(Cl)ccc1C(=O)O Amb20623736 [0,0,0,0,1,1|1,1,0]=4 7759 B12R1.57 CSc1nc(O)ncc1C(=O)O Amb27849068 [0,0,0,0,1,1|1,1,0]=4 7760 B12R1.57 N#Cc1cc(O)ccc1C(=O)O Amb27607099 [0,0,0,0,1,1|2,0,0]=4 7761 B12R1.57 N#Cc1nc(O)ccc1C(=O)O Amb28384738 [0,0,0,0,1,1|2,0,0]=4 7762 B12R1.57 O=C(O)c1ccc(O)cc1CO Amb18646839 [0,0,0,0,1,1|2,0,0]=4 7763 B12R1.87 C#Cc1c(C(=O)O)ccnc1O Amb27217638 [0,0,0,0,1,1|1,0,1]=4 7764 B12R1.87 CCC1=C(C(=O)O)C=CNC1=O Amb18827342 [0,0,0,0,1,1|1,0,1]=4 7765 B12R1.87 CCc1c(Br)cccc1C(=O)O Amb22270208 [0,0,0,0,1,1|2,0,0]=4 7766 B12R1.87 CCc1c(Cl)cccc1C(=O)O Amb18649027 [0,0,0,0,1,1|2,0,0]=4 7767 B12R1.87 CCc1c(F)cccc1C(=O)O Amb28133319 [0,0,0,0,1,1|2,0,0]=4 7768 B12R1.87 CCc1c(I)cccc1C(=O)O Amb27642515 [0,0,0,0,1,1|2,0,0]=4 7769 B12R1.87 CCc1c(N)cccc1C(=O)O Amb27974520 [0,0,0,0,1,1|2,0,0]=4 7770 B12R1.87 CCc1c(N)ccnc1C(=O)O Amb27186205 [0,0,0,0,1,1|2,0,0]=4 7771 B12R1.87 CCc1c(O)cccc1C(N)=O Amb27770181 [0,0,0,0,1,1|2,0,0]=4 7772 B12R1.87 CCc1c(O)cncc1C(=O)O Amb27756283 [0,0,0,0,1,1|1,0,0]=3 7773 B12R1.87 CCc1c(O)cncc1C(C)=O Amb27770751 [0,0,0,0,1,1|2,0,0]=4 7774 B12R1.87 CCc1c(S)cccc1C(=O)O Amb27481234 [0,0,0,0,1,1|1,1,0]=4 7775 B12R1.87 CNc1c(C)cccc1C(=O)O Amb2788093 [0,0,0,0,1,1|2,0,0]=4 7776 B12R1.87 CNc1c(F)cccc1C(=O)O Amb18962874 [0,0,0,0,1,1|2,0,0]=4 7777 B12R1.87 CNc1c(N)cccc1C(=O)O Amb24341556 [0,0,0,0,1,1|2,0,0]=4 7778 B12R1.87 CNc1c(N)cccc1C(=O)O Amb28468145 [0,0,0,0,1,1|2,0,0]=4 7779 B12R1.87 CNc1c(N)cccc1C(=O)O Amb30584978 [0,0,0,0,1,1|2,0,0]=4 7780 B12R1.87 COC1=C(C(=O)O)NC=CC1=O Amb25269757 [0,0,0,0,1,1|0,0,1]=3 7781 B12R1.87 COc1c(Br)cccc1C(=O)Cl Amb25892866 [0,0,0,0,1,1|2,0,0]=4 7782 B12R1.87 COc1c(Br)cccc1C(=O)O Amb3941257 [0,0,0,0,1,1|1,0,0]=3 7783 B12R1.87 COc1c(Br)cccc1C(C)=O Amb21857574 [0,0,0,0,1,1|2,0,0]=4 7784 B12R1.87 COc1c(Br)cccc1C(N)=O Amb22501156 [0,0,0,0,1,1|2,0,0]=4 7785 B12R1.87 COc1c(Br)cncc1C(=O)O Amb25040060 [0,0,0,0,1,1|1,0,0]=3 7786 B12R1.87 COc1c(C(=O)O)ccnc1Br Amb22737218 [0,0,0,0,1,1|1,0,0]=3 7787 B12R1.87 COc1c(C(=O)O)ccnc1C Amb18827339 [0,0,0,0,1,1|1,0,0]=3 7788 B12R1.87 COc1c(C(=O)O)ccnc1Cl Amb27472882 [0,0,0,0,1,1|1,0,0]=3 7789 B12R1.87 COc1c(C(=O)O)ccnc1F Amb25736212 [0,0,0,0,1,1|1,0,0]=3 7790 B12R1.87 COc1c(C(C)=O)ccnc1Cl Amb27862457 [0,0,0,0,1,1|2,0,0]=4 7791 B12R1.87 COc1c(C(N)=O)ccnc1C Amb32671529 [0,0,0,0,1,1|2,0,0]=4 7792 B12R1.87 COc1c(C)cccc1C(=O)Cl Amb534944 [0,0,0,0,1,1|2,0,0]=4 7793 B12R1.87 COc1c(C)cccc1C(=O)O Amb6367958 [0,0,0,0,1,1|1,0,0]=3 7794 B12R1.87 COc1c(C)cccc1C(C)=O Amb17232470 [0,0,0,0,1,1|2,0,0]=4 7795 B12R1.87 COc1c(C)cccc1C(N)=O Amb10788675 [0,0,0,0,1,1|2,0,0]=4 7796 B12R1.87 COc1c(C)ccnc1C(=O)O Amb24602368 [0,0,0,0,1,1|1,0,0]=3 7797 B12R1.87 COc1c(C)cncc1C(=O)O Amb25046102 [0,0,0,0,1,1|1,0,0]=3 7798 B12R1.87 COc1c(C)cncc1S(=O)O Amb32992452 [0,0,0,0,1,1|2,0,0]=4 7799 B12R1.87 COc1c(C)ncnc1C(=O)O Amb35673329 [0,0,0,0,1,1|2,0,0]=4 7800 B12R1.87 COc1c(Cl)cccc1C(=O)Cl Amb25883431 [0,0,0,0,1,1|2,0,0]=4 7801 B12R1.87 COc1c(Cl)cccc1C(=O)O Amb18649465 [0,0,0,0,1,1|1,0,0]=3 7802 B12R1.87 COc1c(Cl)cccc1C(C)=O Amb1102404 [0,0,0,0,1,1|2,0,0]=4 7803 B12R1.87 COc1c(Cl)cccc1C(N)=O Amb22501159 [0,0,0,0,1,1|2,0,0]=4 7804 B12R1.87 COc1c(Cl)ccnc1C(=O)O Amb22011775 [0,0,0,0,1,1|1,0,0]=3 7805 B12R1.87 COc1c(F)cccc1C(=O)Cl Amb22043691 [0,0,0,0,1,1|2,0,0]=4 7806 B12R1.87 COc1c(F)cccc1C(=O)O Amb2688150 [0,0,0,0,1,1|1,0,0]=3 7807 B12R1.87 COc1c(F)cccc1C(N)=O Amb22047591 [0,0,0,0,1,1|2,0,0]=4 7808 B12R1.87 COc1c(F)ccnc1C(=O)O Amb26880061 [0,0,0,0,1,1|1,0,0]=3 7809 B12R1.87 COc1c(F)cncc1C(=O)O Amb27616206 [0,0,0,0,1,1|1,0,0]=3 7810 B12R1.87 COc1c(I)cccc1C(=O)O Amb27263782 [0,0,0,0,1,1|1,0,0]=3 7811 B12R1.87 COc1c(N)cccc1C(=O)Cl Amb28366466 [0,0,0,0,1,1|2,0,0]=4 7812 B12R1.87 COc1c(N)cccc1C(=O)O Amb22169830 [0,0,0,0,1,1|1,0,0]=3 7813 B12R1.87 COc1c(N)cccc1C(C)=O Amb27228927 [0,0,0,0,1,1|2,0,0]=4 7814 B12R1.87 COc1c(N)cccc1C(N)=O Amb26426281 [0,0,0,0,1,1|2,0,0]=4 7815 B12R1.87 COc1c(N)cncc1C(=O)O Amb28323535 [0,0,0,0,1,1|1,0,0]=3 7816 B12R1.87 COc1c(O)cccc1B(O)O Amb21927921 [0,0,0,0,1,1|1,0,1]=4 7817 B12R1.87 COc1c(O)cccc1C(=O)Cl Amb27175626 [0,0,0,0,1,1|1,0,0]=3 7818 B12R1.87 COc1c(O)cccc1C(=O)O Amb6296487 [0,0,0,0,1,1|0,0,0]=2 7819 B12R1.87 COc1c(O)cccc1C(C)=O Amb27149085 [0,0,0,0,1,1|1,0,0]=3 7820 B12R1.87 COc1c(O)cccc1C(N)=O Amb25374074 [0,0,0,0,1,1|1,0,0]=3 7821 B12R1.87 COc1c(O)cccc1[N+](=O)[O-] Amb27175645 [0,0,0,0,1,1|1,0,1]=4 7822 B12R1.87 COc1c(O)cncc1B(O)O Amb27212802 [0,0,0,0,1,1|1,0,1]=4 7823 B12R1.87 COc1c(S)cccc1C(=O)O Amb27221520 [0,0,0,0,1,1|0,1,0]=3 7824 B12R1.87 CSc1c(Br)cccc1C(=O)O Amb28324635 [0,0,0,0,1,1|1,1,0]=4 7825 B12R1.87 CSc1c(F)cccc1C(=O)O Amb33531234 [0,0,0,0,1,1|1,1,0]=4 7826 B12R1.87 CSc1c(I)cccc1C(=O)O Amb27951696 [0,0,0,0,1,1|1,1,0]=4 7827 B12R1.87 N#Cc1c(O)cccc1C(=O)O Amb24532764 [0,0,0,0,1,1|2,0,0]=4 7828 B12R1.87 N#Cc1c(O)cncc1C(=O)O Amb27481741 [0,0,0,0,1,1|2,0,0]=4 7829 B12R1.87 NNc1c(O)cccc1C(=O)O Amb27967912 [0,0,0,0,1,1|2,0,0]=4 7830 B12R1.87 O=C(O)c1cncc(O)c1CO Amb27669055 [0,0,0,0,1,1|2,0,0]=4 7831 B12R1.87 O=Cc1c(O)cccc1C(=O)O Amb25150843 [0,0,0,0,1,1|2,0,0]=4 7832 B14R1.42 CCc1cc(NCC(=O)O)ccc1F Amb35690509 [0,0,0,0,0,2|2,0,0]=4 7833 B14R1.42 CCc1cc(OCC(=O)O)ccc1Cl Amb33526694 [0,0,0,0,0,2|2,0,0]=4 7834 B14R1.42 COc1cc(C#CC(=O)O)ccc1Cl Amb27808226 [0,0,0,0,0,2|1,0,0]=3 7835 B14R1.42 COc1cc(C#CC(=O)O)ccc1F Amb27644379 [0,0,0,0,0,2|1,0,0]=3 7836 B14R1.42 COc1cc(C#CC(=O)O)ccc1O Amb27477914 [0,0,0,0,0,2|0,0,0]=2 7837 B14R1.42 COc1cc(CCC(=O)O)ccc1Br Amb33451095 [0,0,0,0,0,2|1,0,0]=3 7838 B14R1.42 COc1cc(CCC(=O)O)ccc1C Amb6356150 [0,0,0,0,0,2|1,0,0]=3 7839 B14R1.42 COc1cc(CCC(=O)O)ccc1Cl Amb20668508 [0,0,0,0,0,2|1,0,0]=3 7840 B14R1.42 COc1cc(CCC(=O)O)ccc1F Amb8496559 [0,0,0,0,0,2|1,0,0]=3 7841 B14R1.42 COc1cc(CCC(=O)O)ccc1N Amb32758703 [0,0,0,0,0,2|1,0,0]=3 7842 B14R1.42 COc1cc(CCC(=O)O)ccc1O Amb1102294 [0,0,0,0,0,2|0,0,0]=2 7843 B14R1.42 COc1cc(CCC(C)=O)ccc1Br Amb33336672 [0,0,0,0,0,2|2,0,0]=4 7844 B14R1.42 COc1cc(CCC(C)=O)ccc1C Amb33419216 [0,0,0,0,0,2|2,0,0]=4 7845 B14R1.42 COc1cc(CCC(C)=O)ccc1Cl Amb33262557 [0,0,0,0,0,2|2,0,0]=4 7846 B14R1.42 COc1cc(CCC(C)=O)ccc1F Amb33312766 [0,0,0,0,0,2|2,0,0]=4 7847 B14R1.42 COc1cc(CCC(C)=O)ccc1O Amb533854 [0,0,0,0,0,2|1,0,0]=3 7848 B14R1.42 COc1cc(CCC(C)O)ccc1O Amb16185809 [0,0,0,0,0,2|1,0,1]=4 7849 B14R1.42 COc1cc(CC[C@@H](C)O)ccc1O Amb33226800 [0,0,0,0,0,2|1,0,1]=4 7850 B14R1.42 COc1cc(CC[C@H](C)O)ccc1O Amb33473984 [0,0,0,0,0,2|1,0,1]=4 7851 B14R1.42 COc1cc(CC[N+](=O)[O-])ccc1O Amb22228865 [0,0,0,0,0,2|1,0,1]=4 7852 B14R1.42 COc1cc(CNC(=N)N)ccc1O Amb24468635 [0,0,0,0,0,2|2,0,0]=4 7853 B14R1.42 COc1cc(CNC(C)=O)ccc1O Amb25725250 [0,0,0,0,0,2|1,0,0]=3 7854 B14R1.42 COc1cc(CNC(N)=O)ccc1O Amb26636638 [0,0,0,0,0,2|1,0,0]=3 7855 B14R1.42 COc1cc(NCC(=O)O)ccc1C Amb35690242 [0,0,0,0,0,2|1,0,0]=3 7856 B14R1.42 COc1cc(NCC(=O)O)ccc1Cl Amb28137471 [0,0,0,0,0,2|1,0,0]=3 7857 B14R1.42 COc1cc(NCC(N)=O)ccc1C Amb35698111 [0,0,0,0,0,2|2,0,0]=4 7858 B14R1.42 COc1cc(OCC(=O)O)ccc1Br Amb5764195 [0,0,0,0,0,2|1,0,0]=3 7859 B14R1.42 COc1cc(OCC(=O)O)ccc1C Amb33419200 [0,0,0,0,0,2|1,0,0]=3 7860 B14R1.42 COc1cc(OCC(=O)O)ccc1Cl Amb33256421 [0,0,0,0,0,2|1,0,0]=3 7861 B14R1.42 COc1cc(OCC(=O)O)ccc1F Amb33359202 [0,0,0,0,0,2|1,0,0]=3 7862 B14R1.42 COc1cc(OCC(=O)O)ccc1O Amb32954155 [0,0,0,0,0,2|0,0,0]=2 7863 B14R1.42 COc1cc(\C=C\C(=O)Cl)ccc1O Amb27201432 [0,0,0,0,0,2|1,0,0]=3 7864 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1Br Amb25327504 [0,0,0,0,0,2|1,0,0]=3 7865 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1C Amb22263646 [0,0,0,0,0,2|1,0,0]=3 7866 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1Cl Amb25978659 [0,0,0,0,0,2|1,0,0]=3 7867 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1F Amb33870974 [0,0,0,0,0,2|1,0,0]=3 7868 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1N Amb25945721 [0,0,0,0,0,2|1,0,0]=3 7869 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1O Amb16232173 [0,0,0,0,0,2|0,0,0]=2 7870 B14R1.42 COc1cc(\C=C\C(=O)O)ccc1O Amb8513516 [0,0,0,0,0,2|0,0,0]=2 7871 B14R1.42 COc1cc(\C=C\C(=O)[O-])ccc1O Amb34190953 [0,0,0,0,0,2|0,0,1]=3 7872 B14R1.42 COc1cc(\C=C\C(C)=O)ccc1Br Amb33336668 [0,0,0,0,0,2|2,0,0]=4 7873 B14R1.42 COc1cc(\C=C\C(C)=O)ccc1C Amb33420869 [0,0,0,0,0,2|2,0,0]=4 7874 B14R1.42 COc1cc(\C=C\C(C)=O)ccc1Cl Amb33258774 [0,0,0,0,0,2|2,0,0]=4 7875 B14R1.42 COc1cc(\C=C\C(C)=O)ccc1F Amb33312767 [0,0,0,0,0,2|2,0,0]=4 7876 B14R1.42 COc1cc(\C=C\C(C)=O)ccc1O Amb2389009 [0,0,0,0,0,2|1,0,0]=3 7877 B14R1.42 COc1cc(\C=C\N(=O)=O)ccc1O Amb8392703 [0,0,0,0,0,2|1,0,1]=4 7878 B14R1.42 COc1cc(\C=C\[N+](=O)[O-])ccc1O Amb24061279 [0,0,0,0,0,2|1,0,1]=4 7879 B14R1.42 COc1cc(\C=N\C(N)=O)ccc1O Amb27773802 [0,0,0,0,0,2|1,0,0]=3 7880 B14R1.42 COc1cc(\C=N\S(C)=O)ccc1O Amb35681672 [0,0,0,0,0,2|2,0,0]=4 7881 B14R1.42 COc1nc(NCC(=O)O)ccc1N Amb19082276 [0,0,0,0,0,2|2,0,0]=4 7882 B14R1.42 O=C(O)\C=C\c1ccc(O)c(CO)c1 Amb24117014 [0,0,0,0,0,2|2,0,0]=4 7883 B14R1.42 O=Cc1cc(C#CC(=O)O)ccc1O Amb33076934 [0,0,0,0,0,2|2,0,0]=4 7884 B14R1.42 O=Cc1cc(\C=C\C(=O)O)ccc1O Amb34915524 [0,0,0,0,0,2|2,0,0]=4