0 B12R1.261 CC(=O)C1=C(C=CC=C1)C(=O)C MCULE-8127457015 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.261 CC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-5017248906 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.261 CC(=O)C1=C(C=CC=N1)C(=O)O MCULE-6515097923 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.261 CC(=O)C1=CC=CC=C1B(O)O MCULE-2733113900 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)Cl MCULE-1765251115 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O MCULE-7363003448 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.261 CC(=O)C1=CC=CN=C1C(=O)O MCULE-8161361642 [0,0,0,0,0,0|1,0,0]=1 7 B12R1.261 CC(=O)C1=CC=CN=C1N(C)C MCULE-7702011839 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.261 CC(=O)C1=NC=CC=C1N(=O)=O MCULE-5350244842 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.261 CC(C)C1=C(C=CC=C1)C(=O)O MCULE-6483894536 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.261 CC(C)C1=C(C=NC=N1)C(=O)O MCULE-9021698895 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-8650746123 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-9609008723 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)O MCULE-1846110939 [0,0,0,0,0,0|2,0,1]=3 14 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)[O-] MCULE-3438709652 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-4355771481 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-5122962105 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.261 CN(C)C1=C(C=CC=N1)C(=O)Cl MCULE-6771812024 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.261 CN(C)C1=C(C=CC=N1)C(=O)O MCULE-9511648365 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.261 CN(C)C1=C(N=CC=C1)C(=O)O MCULE-5933352694 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.261 CN(C)C1=C(N=CC=C1)C(=O)O MCULE-9528047463 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.261 CN(C)C1=NC=CC=C1C(=O)O MCULE-3019368809 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.261 CS(=O)C1=C(C=CC=C1)C(=O)O MCULE-3173889444 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-6849862508 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9842865976 [0,0,0,0,0,0|3,0,1]=4 25 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-1164292262 [0,0,0,0,0,0|3,0,1]=4 26 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7958697940 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.261 N=C(N)C1=C(C=CC=C1)C(=O)O MCULE-9719518377 [0,0,0,0,0,0|3,0,0]=3 28 B12R1.261 N=C(N)C1=CC=CC=C1C(=O)O MCULE-9966971962 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.261 NC(=O)C1=C(C=CC=C1)C(=O)N MCULE-9121420422 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.261 NC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-3155069269 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.261 NC(=O)C1=C(C=CC=N1)C(=O)O MCULE-1406870021 [0,0,0,0,0,0|1,0,0]=1 32 B12R1.261 NC(=O)C1=C(C=NC=C1)C(=O)N MCULE-6214710169 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.261 NC(=O)C1=C(N=CC=C1)C(=O)N MCULE-9477991075 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.261 NC(=O)C1=C(N=CC=C1)C(=O)O MCULE-3923055422 [0,0,0,0,0,0|1,0,0]=1 35 B12R1.261 NC(=O)C1=C(N=CC=C1)C(F)F MCULE-9676139411 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.261 NC(=O)C1=C(N=CC=C1)N(=O)=O MCULE-2691042508 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.261 NC(=O)C1=C(N=CC=N1)C(=O)N MCULE-8252591791 [0,0,0,0,0,0|3,0,0]=3 38 B12R1.261 NC(=O)C1=C(N=CC=N1)C(=O)O MCULE-1532166101 [0,0,0,0,0,0|2,0,0]=2 39 B12R1.261 NC(=O)C1=CC=CC=C1B(O)O MCULE-7189761074 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O MCULE-4970133228 [0,0,0,0,0,0|2,0,0]=2 41 B12R1.261 NC(=O)C1=CC=NC=C1C(=O)O MCULE-7389852342 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.261 NC(=O)C1=CC=NN=C1C(=O)N MCULE-1725466286 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.261 NC(=O)C1=NC=CC=C1B(O)O MCULE-3702640321 [0,0,0,0,0,0|2,0,1]=3 44 B12R1.261 NC(=O)C1=NC=CC=C1N(=O)=O MCULE-5283800337 [0,0,0,0,0,0|2,0,1]=3 45 B12R1.261 O=C(Cl)C1=C(C=CC=C1)N(=O)=O MCULE-1428213268 [0,0,0,0,0,0|3,0,1]=4 46 B12R1.261 O=C(Cl)C1=CC=CC=C1C(=O)Cl MCULE-7523310459 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.261 O=C(O)C1=C(C=CC=C1)S(=O)O MCULE-4903524306 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.261 O=C(O)C1=C(C=CN=C1)N(=O)=O MCULE-7751395680 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.261 O=C(O)C1=C(C=NC=C1)B(O)O MCULE-9901761074 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.261 O=C(O)C1=C(C=NC=C1)C(=O)O MCULE-9167973257 [0,0,0,0,0,0|2,0,0]=2 51 B12R1.261 O=C(O)C1=C(C=NN=C1)C(=O)O MCULE-3596451426 [0,0,0,0,0,0|3,0,0]=3 52 B12R1.261 O=C(O)C1=C(CCC=C1)C(=O)O MCULE-7979676732 [0,0,0,0,0,0|1,0,1]=2 53 B12R1.261 O=C(O)C1=C(CCCC1)C(=O)O MCULE-2633452606 [0,0,0,0,0,0|1,0,3]=4 54 B12R1.261 O=C(O)C1=C(N=CC=C1)C(F)F MCULE-8785164573 [0,0,0,0,0,0|2,0,1]=3 55 B12R1.261 O=C(O)C1=C(N=CC=C1)N(=O)=O MCULE-8440821375 [0,0,0,0,0,0|1,0,1]=2 56 B12R1.261 O=C(O)C1=C(N=CN=C1)C(F)F MCULE-9407226118 [0,0,0,0,0,0|3,0,1]=4 57 B12R1.261 O=C(O)C1=C(N=NC=C1)C(=O)O MCULE-8079413518 [0,0,0,0,0,0|1,0,0]=1 58 B12R1.261 O=C(O)C1=CC=CC=C1B(O)O MCULE-2654185147 [0,0,0,0,0,0|2,0,1]=3 59 B12R1.261 O=C(O)C1=CC=CC=C1C(=O)O MCULE-4747891013 [0,0,0,0,0,0|1,0,0]=1 60 B12R1.261 O=C(O)C1=CC=CC=C1C(F)F MCULE-2495932834 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O MCULE-6964235236 [0,0,0,0,0,0|2,0,1]=3 62 B12R1.261 O=C(O)C1=CC=CC=C1N(=O)=O MCULE-3357987129 [0,0,0,0,0,0|2,0,1]=3 63 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O MCULE-7041185901 [0,0,0,0,0,0|0,0,0]=0 64 B12R1.261 O=C(O)C1=CC=NC=C1N(=O)=O MCULE-6986359806 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.261 O=C(O)C1=NC=CC=C1C(F)F MCULE-5429671750 [0,0,0,0,0,0|2,0,1]=3 66 B12R1.261 O=C(O)C1=NC=CC=C1N(=O)=O MCULE-8730357238 [0,0,0,0,0,0|1,0,1]=2 67 B12R1.261 O=C(O)C1=NC=CN=C1C(=O)O MCULE-9800236497 [0,0,0,0,0,0|1,0,0]=1 68 B12R1.261 O=C(O)C1=NC=CN=C1C(F)F MCULE-7461490460 [0,0,0,0,0,0|3,0,1]=4 69 B12R1.261 O=C(O)C1C=CC=CC1C(=O)O MCULE-4363481692 [0,0,0,0,0,0|1,0,2]=3 70 B12R1.261 O=C(O)C1CC=CCC1C(=O)O MCULE-8208403883 [0,0,0,0,0,0|1,0,3]=4 71 B12R1.261 O=C(O)[C@@H]1CC=CC[C@H]1C(=O)O MCULE-3658680121 [0,0,0,0,0,0|1,0,3]=4 72 B12R1.261 O=C(O)[C@@H]1CC=CC[C@H]1C(=O)O MCULE-5277132939 [0,0,0,0,0,0|1,0,3]=4 73 B12R1.261 O=C(O)[C@H]1CC=CC[C@H]1C(=O)O MCULE-7062667000 [0,0,0,0,0,0|1,0,3]=4 74 B12R1.261 O=C([O-])C1=C(C=CC=C1)C(=O)O MCULE-1944452251 [0,0,0,0,0,0|1,0,1]=2 75 B12R1.261 O=C([O-])C1=CC=CC=C1B(O)O MCULE-2281945209 [0,0,0,0,0,0|2,0,2]=4 76 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O MCULE-6292903963 [0,0,0,0,0,0|1,0,1]=2 77 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O MCULE-7154530233 [0,0,0,0,0,0|1,0,1]=2 78 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)[O-] MCULE-4658064312 [0,0,0,0,0,0|1,0,2]=3 79 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)[O-] MCULE-5372933453 [0,0,0,0,0,0|1,0,2]=3 80 B12R1.261 O=C([O-])C1=CC=CC=C1N(=O)=O MCULE-7211229453 [0,0,0,0,0,0|2,0,2]=4 81 B11R1.53 C#CC1=CC=CC=C1C(=O)O MCULE-2225406631 [1,0,0,0,0,0|2,0,1]=4 82 B11R1.53 C=CC1=CC=CC=C1C(=O)C MCULE-2023411900 [1,0,0,0,0,0|3,0,0]=4 83 B11R1.53 C=CC1=CC=CC=C1C(=O)O MCULE-7536191019 [1,0,0,0,0,0|2,0,0]=3 84 B11R1.53 C=CC1=NC=CC=C1N(=O)=O MCULE-6142672032 [1,0,0,0,0,0|2,0,1]=4 85 B11R1.53 CC(=O)C1=C(C=CC=N1)C#N MCULE-4339250003 [1,0,0,0,0,0|2,0,1]=4 86 B11R1.53 CC(=O)C1=CC=CC=C1C=O MCULE-5332635055 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.53 CCC1=C(C=CC=N1)C(=O)O MCULE-1816858431 [1,0,0,0,0,0|1,0,1]=3 88 B11R1.53 CCC1=C(C=NC=N1)C(=O)O MCULE-6327334228 [1,0,0,0,0,0|2,0,1]=4 89 B11R1.53 CCC1=CC=CC=C1C(=O)O MCULE-5345503463 [1,0,0,0,0,0|2,0,1]=4 90 B11R1.53 CCC1=CC=CN=C1C(=O)C MCULE-4052051937 [1,0,0,0,0,0|2,0,1]=4 91 B11R1.53 CN(C)C1=NC=CC=C1C=O MCULE-4056838558 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.53 CNC1=CC=CC=C1C(=O)O MCULE-5834002880 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.53 CNC1=NC=CC=C1C(=O)N MCULE-8361270214 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.53 CNC1=NC=CC=C1C(=O)O MCULE-6289599546 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.53 COC1=C(C=CC=C1)C(=O)O MCULE-8358316345 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.53 COC1=C(C=CC=N1)C(=O)N MCULE-8383485590 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.53 COC1=C(N=CN=C1)C(=O)O MCULE-7636183898 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.53 COC1=CC=CN=C1C(=O)C MCULE-2218351239 [1,0,0,0,0,0|3,0,0]=4 99 B11R1.53 COC1=CC=CN=C1C(=O)N MCULE-9799144918 [1,0,0,0,0,0|3,0,0]=4 100 B11R1.53 COC1=CC=CN=C1C(=O)O MCULE-9430488708 [1,0,0,0,0,0|2,0,0]=3 101 B11R1.53 COC1=NC=CC=C1C(=O)C MCULE-9886056329 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.53 COC1=NC=CC=C1C(=O)Cl MCULE-6530682787 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.53 COC1=NC=CC=C1C(=O)O MCULE-5244916926 [1,0,0,0,0,0|2,0,0]=3 104 B11R1.53 COC1=NC=CN=C1C(=O)O MCULE-1977337866 [1,0,0,0,0,0|3,0,0]=4 105 B11R1.53 COC1=NC=NC=C1C(=O)O MCULE-3719522518 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.53 COC1=NN=CC=C1C(=O)O MCULE-1739742173 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.53 CSC1=C(C=CC=C1)C(=O)O MCULE-9467769240 [1,0,0,0,0,0|3,0,0]=4 108 B11R1.53 CSC1=C(C=CC=N1)C(=O)Cl MCULE-3334120611 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.53 CSC1=C(N=CC=C1)C(=O)O MCULE-7916550623 [1,0,0,0,0,0|2,0,0]=3 110 B11R1.53 CSC1=C(N=CC=N1)C(=O)O MCULE-3453041755 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.53 CSC1=NC=CC=C1C(=O)N MCULE-1123850413 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.53 CSC1=NC=CC=C1C(=O)O MCULE-6789292284 [1,0,0,0,0,0|2,0,0]=3 113 B11R1.53 N#CC1=C(C=CC=C1)C(=O)O MCULE-8028564477 [1,0,0,0,0,0|2,0,1]=4 114 B11R1.53 N#CC1=C(C=CC=N1)C(=O)O MCULE-3876490764 [1,0,0,0,0,0|1,0,1]=3 115 B11R1.53 N#CC1=CC=CN=C1C(=O)O MCULE-1136247414 [1,0,0,0,0,0|1,0,1]=3 116 B11R1.53 NC(=O)C1=C(C=CC=C1)C=O MCULE-1125511731 [1,0,0,0,0,0|2,0,0]=3 117 B11R1.53 NC(=O)C1=C(C=CC=C1)CO MCULE-6667845071 [1,0,0,0,0,0|2,0,1]=4 118 B11R1.53 NC(=O)C1=C(C=CC=N1)C=O MCULE-2464669711 [1,0,0,0,0,0|1,0,0]=2 119 B11R1.53 NC(=O)C1=C(N=CC=C1)CO MCULE-4149391731 [1,0,0,0,0,0|1,0,1]=3 120 B11R1.53 NC(=O)C1=CC=CN=C1CBr MCULE-9723491420 [1,0,0,0,0,0|2,0,1]=4 121 B11R1.53 NC(=O)C1=NC=CN=C1CO MCULE-3289781899 [1,0,0,0,0,0|2,0,1]=4 122 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-6336117316 [1,0,0,0,0,0|1,0,1]=3 123 B11R1.53 NCC1=C(C=CC=N1)C(=O)O MCULE-8956287762 [1,0,0,0,0,0|1,0,1]=3 124 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-3951040853 [1,0,0,0,0,0|2,0,1]=4 125 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-7214993753 [1,0,0,0,0,0|2,0,1]=4 126 B11R1.53 NNC1=C(C=CC=C1)C(=O)O MCULE-6710058167 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.53 NNC1=C(C=CC=N1)C(=O)O MCULE-3923715583 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.53 NNC1=CC=CC=C1C(=O)O MCULE-9681705772 [1,0,0,0,0,0|3,0,0]=4 129 B11R1.53 NNC1=NC=CC=C1C(=O)O MCULE-7721411154 [1,0,0,0,0,0|2,0,0]=3 130 B11R1.53 O=C(O)C1=C(C=CC=C1)CBr MCULE-3916838805 [1,0,0,0,0,0|2,0,1]=4 131 B11R1.53 O=C(O)C1=C(C=CC=C1)CCl MCULE-9961828053 [1,0,0,0,0,0|2,0,1]=4 132 B11R1.53 O=C(O)C1=C(C=CC=C1)CO MCULE-4795775601 [1,0,0,0,0,0|1,0,1]=3 133 B11R1.53 O=C(O)C1=C(C=CC=C1)NO MCULE-6356954782 [1,0,0,0,0,0|2,0,0]=3 134 B11R1.53 O=C(O)C1=C(C=CC=C1)OI MCULE-3097266245 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.53 O=C(O)C1=C(N=CC=C1)CO MCULE-1065539051 [1,0,0,0,0,0|0,0,1]=2 136 B11R1.53 O=C(O)C1=CN=CC=C1CO MCULE-7496519749 [1,0,0,0,0,0|2,0,1]=4 137 B11R1.53 O=CC1=C(C=CC=C1)B(O)O MCULE-7288006724 [1,0,0,0,0,0|2,0,1]=4 138 B11R1.53 O=CC1=C(C=CC=C1)C(=O)Cl MCULE-3471711409 [1,0,0,0,0,0|2,0,0]=3 139 B11R1.53 O=CC1=C(C=CC=N1)C(=O)O MCULE-5630434791 [1,0,0,0,0,0|0,0,0]=1 140 B11R1.53 O=CC1=C(N=CC=C1)C(=O)O MCULE-6919546171 [1,0,0,0,0,0|0,0,0]=1 141 B11R1.53 O=CC1=C(N=CC=C1)C(F)F MCULE-5635112725 [1,0,0,0,0,0|2,0,1]=4 142 B11R1.53 O=CC1=C(N=CC=C1)N(=O)=O MCULE-1833337330 [1,0,0,0,0,0|1,0,1]=3 143 B11R1.53 O=CC1=CC=CC=C1C(=O)O MCULE-7642820980 [1,0,0,0,0,0|1,0,0]=2 144 B11R1.53 O=CC1=CC=CC=C1N(=O)=O MCULE-1037843730 [1,0,0,0,0,0|2,0,1]=4 145 B11R1.53 O=CC1=CC=CN=C1B(O)O MCULE-8937604621 [1,0,0,0,0,0|1,0,1]=3 146 B11R1.53 O=CC1=CC=NC=C1C(=O)O MCULE-7629200205 [1,0,0,0,0,0|2,0,0]=3 147 B11R1.53 O=CC1=NC=CC=C1B(O)O MCULE-5677686427 [1,0,0,0,0,0|1,0,1]=3 148 B11R1.53 O=CC1=NC=CC=C1C(F)F MCULE-4756998675 [1,0,0,0,0,0|2,0,1]=4 149 B11R1.53 O=CC1=NC=CC=C1N(=O)=O MCULE-1646230043 [1,0,0,0,0,0|1,0,1]=3 150 B11R1.53 O=N(=O)C1=C(N=CC=C1)NO MCULE-3826241277 [1,0,0,0,0,0|2,0,1]=4 151 B11R1.53 O=N(=O)C1=CC=CN=C1CO MCULE-7701521081 [1,0,0,0,0,0|1,0,2]=4 152 B11R1.53 O=N(=O)C1=NC=CC=C1CO MCULE-1104083716 [1,0,0,0,0,0|1,0,2]=4 153 B11R1.53 O=NC1=CC=CC=C1C(=O)O MCULE-4180896401 [1,0,0,0,0,0|2,0,0]=3 154 B11R1.53 O=[IH2]C1=C(C=CC=C1)C(=O)O MCULE-9514632532 [1,0,0,0,0,0|2,0,0]=3 155 B13R1.165 CC(=O)C1=CC(=CN=C1C(=O)O)Cl MCULE-1949685492 [0,1,0,0,0,0|1,0,0]=2 156 B13R1.165 CC(=O)C1=NC=C(C=C1N(=O)=O)Br MCULE-1106315244 [0,1,0,0,0,0|2,0,1]=4 157 B13R1.165 CC(=O)C1=NC=C(C=C1N(=O)=O)C MCULE-2514160241 [0,1,0,0,0,0|2,0,1]=4 158 B13R1.165 CC(=O)C1=NC=C(C=C1N(=O)=O)F MCULE-7799235473 [0,1,0,0,0,0|2,0,1]=4 159 B13R1.165 CC(C)C1=NC(=CC=C1C(=O)O)O MCULE-8415073791 [0,1,0,0,0,0|2,0,1]=4 160 B13R1.165 CC1=CC(=C(N=C1)C(=O)O)C(=O)O MCULE-2462642756 [0,1,0,0,0,0|0,0,0]=1 161 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)B(O)O MCULE-2624096584 [0,1,0,0,0,0|2,0,1]=4 162 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)C(=O)O MCULE-6306537858 [0,1,0,0,0,0|1,0,0]=2 163 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)N(=O)=O MCULE-4320923819 [0,1,0,0,0,0|2,0,1]=4 164 B13R1.165 CC1=CC=C(C(=C1)N(=O)=O)C(=O)O MCULE-1221585993 [0,1,0,0,0,0|2,0,1]=4 165 B13R1.165 CC1=CC=C(C(=N1)C(=O)N)N(=O)=O MCULE-7612255531 [0,1,0,0,0,0|2,0,1]=4 166 B13R1.165 CC1=CC=C(C(=N1)C(=O)O)C(=O)O MCULE-6013186120 [0,1,0,0,0,0|0,0,0]=1 167 B13R1.165 CC1=CN=C(C(=N1)C(=O)O)C(=O)O MCULE-5205260254 [0,1,0,0,0,0|1,0,0]=2 168 B13R1.165 CC1=NC(=C(C=C1)C(=O)O)C(C)C MCULE-1184888800 [0,1,0,0,0,0|2,0,1]=4 169 B13R1.165 CC1=NC(=C(C=C1)N(=O)=O)C(=O)O MCULE-7491611479 [0,1,0,0,0,0|1,0,1]=3 170 B13R1.165 CN(C)C1=C(C=C(C=N1)Br)C(=O)O MCULE-6329282669 [0,1,0,0,0,0|3,0,0]=4 171 B13R1.165 CN(C)C1=NC=C(C=C1C(=O)O)Br MCULE-3805689366 [0,1,0,0,0,0|3,0,0]=4 172 B13R1.165 NC(=O)C1=C(C=C(C=C1)Br)C(=O)N MCULE-6842624312 [0,1,0,0,0,0|3,0,0]=4 173 B13R1.165 NC(=O)C1=C(C=C(C=C1)Cl)C(=O)N MCULE-2277696054 [0,1,0,0,0,0|3,0,0]=4 174 B13R1.165 NC(=O)C1=CC=C(C=C1C(=O)O)F MCULE-3292757970 [0,1,0,0,0,0|2,0,0]=3 175 B13R1.165 NC(=O)C1=NC(=CC=C1N(=O)=O)Cl MCULE-2265311839 [0,1,0,0,0,0|2,0,1]=4 176 B13R1.165 NC(=O)C1=NC=C(C=C1N(=O)=O)Br MCULE-9546827613 [0,1,0,0,0,0|2,0,1]=4 177 B13R1.165 NC(=O)C1=NC=C(C=C1N(=O)=O)Cl MCULE-7953876095 [0,1,0,0,0,0|2,0,1]=4 178 B13R1.165 NC(=O)C1=NC=C(N=C1C(=O)O)O MCULE-1803093218 [0,1,0,0,0,0|2,0,0]=3 179 B13R1.165 NC1=CC(=C(C=C1)C(=O)O)C(=O)O MCULE-2601095976 [0,1,0,0,0,0|1,0,0]=2 180 B13R1.165 NC1=CC(=C(C=C1)N(=O)=O)C(=O)O MCULE-8637395916 [0,1,0,0,0,0|2,0,1]=4 181 B13R1.165 NC1=CC=C(C(=C1)N(=O)=O)C(=O)O MCULE-4820209497 [0,1,0,0,0,0|2,0,1]=4 182 B13R1.165 NC1=CN=C(C(=C1)C(=O)O)C(=O)O MCULE-1799747072 [0,1,0,0,0,0|0,0,0]=1 183 B13R1.165 O=C(O)C1=C(C=C(C=C1)Br)N(=O)=O MCULE-3413134490 [0,1,0,0,0,0|2,0,1]=4 184 B13R1.165 O=C(O)C1=C(C=C(C=C1)Cl)N(=O)=O MCULE-3376104850 [0,1,0,0,0,0|2,0,1]=4 185 B13R1.165 O=C(O)C1=C(C=C(C=C1)F)B(O)O MCULE-8978858798 [0,1,0,0,0,0|2,0,1]=4 186 B13R1.165 O=C(O)C1=C(C=C(C=C1)F)C(=O)O MCULE-7412243131 [0,1,0,0,0,0|1,0,0]=2 187 B13R1.165 O=C(O)C1=C(C=C(C=C1)F)N(=O)=O MCULE-6016048250 [0,1,0,0,0,0|2,0,1]=4 188 B13R1.165 O=C(O)C1=C(C=C(C=C1)O)N(=O)=O MCULE-4948179476 [0,1,0,0,0,0|2,0,1]=4 189 B13R1.165 O=C(O)C1=C(C=C(C=N1)Br)C(F)F MCULE-2651550408 [0,1,0,0,0,0|2,0,1]=4 190 B13R1.165 O=C(O)C1=C(C=C(N=C1)Cl)C(=O)O MCULE-7218761342 [0,1,0,0,0,0|2,0,0]=3 191 B13R1.165 O=C(O)C1=C(C=CC(=C1)Cl)B(O)O MCULE-1426656606 [0,1,0,0,0,0|2,0,1]=4 192 B13R1.165 O=C(O)C1=C(C=CC(=C1)Cl)N(=O)=O MCULE-7767195023 [0,1,0,0,0,0|2,0,1]=4 193 B13R1.165 O=C(O)C1=C(C=CC(=C1)F)N(=O)=O MCULE-5787126169 [0,1,0,0,0,0|2,0,1]=4 194 B13R1.165 O=C(O)C1=C(C=CC(=C1)I)N(=O)=O MCULE-5162803243 [0,1,0,0,0,0|2,0,1]=4 195 B13R1.165 O=C(O)C1=C(C=CC(=C1)S)N(=O)=O MCULE-1522173034 [0,1,0,0,0,0|2,0,1]=4 196 B13R1.165 O=C(O)C1=C(N=C(C=C1)Cl)C(F)F MCULE-7689070362 [0,1,0,0,0,0|2,0,1]=4 197 B13R1.165 O=C(O)C1=CC(=CC=C1B(O)O)F MCULE-9854707295 [0,1,0,0,0,0|2,0,1]=4 198 B13R1.165 O=C(O)C1=CC(=CC=C1N(=O)=O)Br MCULE-3596729548 [0,1,0,0,0,0|2,0,1]=4 199 B13R1.165 O=C(O)C1=CC(=CC=C1N(=O)=O)O MCULE-4152972626 [0,1,0,0,0,0|2,0,1]=4 200 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)Br MCULE-9616265983 [0,1,0,0,0,0|0,0,0]=1 201 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)Cl MCULE-8518393821 [0,1,0,0,0,0|0,0,0]=1 202 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)F MCULE-1579389970 [0,1,0,0,0,0|0,0,0]=1 203 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)F MCULE-6502636799 [0,1,0,0,0,0|0,0,0]=1 204 B13R1.165 O=C(O)C1=CC(=CN=C1C(F)F)Cl MCULE-3992051253 [0,1,0,0,0,0|2,0,1]=4 205 B13R1.165 O=C(O)C1=CC=C(C=C1B(O)O)Cl MCULE-2432688230 [0,1,0,0,0,0|2,0,1]=4 206 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)Br MCULE-2688694133 [0,1,0,0,0,0|1,0,0]=2 207 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)Cl MCULE-5893378263 [0,1,0,0,0,0|1,0,0]=2 208 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)I MCULE-8511341128 [0,1,0,0,0,0|1,0,0]=2 209 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)O MCULE-6366909615 [0,1,0,0,0,0|1,0,0]=2 210 B13R1.165 O=C(O)C1=CC=C(C=C1N(=O)=O)I MCULE-4950523074 [0,1,0,0,0,0|2,0,1]=4 211 B13R1.165 O=C(O)C1=CC=C(N=C1C(=O)O)Cl MCULE-3110253642 [0,1,0,0,0,0|0,0,0]=1 212 B13R1.165 O=C(O)C1=CC=C(N=C1C(F)F)Br MCULE-6643398088 [0,1,0,0,0,0|2,0,1]=4 213 B13R1.165 O=C(O)C1=NC(=CC=C1N(=O)=O)Cl MCULE-9123379029 [0,1,0,0,0,0|1,0,1]=3 214 B13R1.165 O=C(O)C1=NC=C(C=C1N(=O)=O)Br MCULE-4990437471 [0,1,0,0,0,0|1,0,1]=3 215 B13R1.165 O=C(O)C1=NC=C(C=C1N(=O)=O)Cl MCULE-2025818820 [0,1,0,0,0,0|1,0,1]=3 216 B13R1.165 O=C(O)C1=NC=C(N=C1C(=O)O)Cl MCULE-2183563279 [0,1,0,0,0,0|1,0,0]=2 217 B13R1.165 O=C(O)C1=NC=C(N=C1C(=O)O)O MCULE-7231122060 [0,1,0,0,0,0|1,0,0]=2 218 B13R1.165 O=C([O-])C1=C(C=C(C=N1)Br)C(=O)O MCULE-3775547550 [0,1,0,0,0,0|0,0,1]=2 219 B13R1.165 O=C([O-])C1=CC(=CC=C1C(=O)O)Cl MCULE-3930710419 [0,1,0,0,0,0|1,0,1]=3 220 B13R1.295 CC1=C(C(=CC=C1)C(=O)O)C(=O)O MCULE-4941517810 [0,1,0,0,0,0|1,0,0]=2 221 B13R1.295 CC1=C(C(=CC=C1)C(=O)O)N(=O)=O MCULE-7346938921 [0,1,0,0,0,0|2,0,1]=4 222 B13R1.295 CC1=C(C(=CC=C1)N(=O)=O)C(=O)O MCULE-1416023209 [0,1,0,0,0,0|2,0,1]=4 223 B13R1.295 CC1=C(C(=NC=C1)C(=O)O)C(=O)O MCULE-7548204158 [0,1,0,0,0,0|0,0,0]=1 224 B13R1.295 NC(=O)C1=C(C(=CC=C1)F)C(=O)N MCULE-1919487170 [0,1,0,0,0,0|3,0,0]=4 225 B13R1.295 NC1=C(C(=CC=C1)C(=O)O)C(=O)O MCULE-1472462304 [0,1,0,0,0,0|1,0,0]=2 226 B13R1.295 NC1=C(C(=CC=C1)C(=O)O)N(=O)=O MCULE-4267842294 [0,1,0,0,0,0|2,0,1]=4 227 B13R1.295 NC1=C(C(=CC=C1)N(=O)=O)C(=O)O MCULE-8408819089 [0,1,0,0,0,0|2,0,1]=4 228 B13R1.295 NC1=CC=CC(=C1C(=O)O)C(=O)O MCULE-3815428212 [0,1,0,0,0,0|1,0,0]=2 229 B13R1.295 O=C(Cl)C1=CC=CC(=C1C(=O)Cl)Br MCULE-2408157606 [0,1,0,0,0,0|3,0,0]=4 230 B13R1.295 O=C(O)C1=C(C(=CC=C1)Br)C(=O)O MCULE-2987291944 [0,1,0,0,0,0|1,0,0]=2 231 B13R1.295 O=C(O)C1=C(C(=CC=C1)Br)N(=O)=O MCULE-5575271565 [0,1,0,0,0,0|2,0,1]=4 232 B13R1.295 O=C(O)C1=C(C(=CC=C1)Cl)N(=O)=O MCULE-8112793088 [0,1,0,0,0,0|2,0,1]=4 233 B13R1.295 O=C(O)C1=C(C(=CC=C1)F)N(=O)=O MCULE-4365988818 [0,1,0,0,0,0|2,0,1]=4 234 B13R1.295 O=C(O)C1=C(C(=CN=C1)Br)C(=O)O MCULE-5100761753 [0,1,0,0,0,0|2,0,0]=3 235 B13R1.295 O=C(O)C1=C(C(=CN=C1)Cl)C(=O)O MCULE-1787829775 [0,1,0,0,0,0|2,0,0]=3 236 B13R1.295 O=C(O)C1=C(C(=NC=C1)Cl)C(=O)O MCULE-4328818101 [0,1,0,0,0,0|2,0,0]=3 237 B13R1.295 O=C(O)C1=C(C=CC=C1B(O)O)F MCULE-3402463259 [0,1,0,0,0,0|2,0,1]=4 238 B13R1.295 O=C(O)C1=C(C=CC=C1Cl)B(O)O MCULE-6520480866 [0,1,0,0,0,0|2,0,1]=4 239 B13R1.295 O=C(O)C1=C(C=CC=C1Cl)N(=O)=O MCULE-5155184712 [0,1,0,0,0,0|2,0,1]=4 240 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)Br MCULE-4666580066 [0,1,0,0,0,0|2,0,1]=4 241 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)F MCULE-9324018001 [0,1,0,0,0,0|2,0,1]=4 242 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)I MCULE-6043813960 [0,1,0,0,0,0|2,0,1]=4 243 B13R1.295 O=C(O)C1=C(C=CC=C1O)N(=O)=O MCULE-6942651523 [0,1,0,0,0,0|2,0,1]=4 244 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)Cl MCULE-9559389453 [0,1,0,0,0,0|1,0,0]=2 245 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)F MCULE-7732883800 [0,1,0,0,0,0|1,0,0]=2 246 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)I MCULE-5657824424 [0,1,0,0,0,0|1,0,0]=2 247 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)O MCULE-2125757137 [0,1,0,0,0,0|1,0,0]=2 248 B13R1.295 O=C(O)C1=CC=CC(=C1N(=O)=O)O MCULE-1899116810 [0,1,0,0,0,0|2,0,1]=4 249 B13R1.295 O=C(O)C1=NC=CC(=C1C(=O)O)Cl MCULE-4255560340 [0,1,0,0,0,0|0,0,0]=1 250 B13R1.349 CC(C)(C)C1=C(C=CC=N1)C(=O)O MCULE-1949325040 [0,1,0,0,0,0|2,0,1]=4 251 B13R1.349 CP(=O)(C)C1=C(C=CC=C1)C(=O)O MCULE-8561135633 [0,1,0,0,0,0|3,0,0]=4 252 B13R1.349 CS(=O)(=O)C1=C(C=CC=C1)C(=O)O MCULE-6380177013 [0,1,0,0,0,0|2,0,1]=4 253 B13R1.349 CS(=O)(=O)C1=C(N=CC=C1)C(=O)O MCULE-7522706696 [0,1,0,0,0,0|1,0,1]=3 254 B13R1.349 NS(=O)(=O)C1=CC=CC=C1C(=O)O MCULE-2793669822 [0,1,0,0,0,0|2,0,1]=4 255 B13R1.349 O=C(O)C1=C(C=CC=C1)S(=O)(=O)Cl MCULE-6209736734 [0,1,0,0,0,0|2,0,1]=4 256 B13R1.349 O=C(O)C1=C(C=CC=C1)S(=O)(=O)O MCULE-3721052746 [0,1,0,0,0,0|2,0,0]=3 257 B13R1.349 O=C(O)C1=C(C=CC=N1)C(F)(F)F MCULE-1252398765 [0,1,0,0,0,0|2,0,1]=4 258 B13R1.349 O=C(O)C1=C(N=CC=C1)C(F)(F)F MCULE-7617078057 [0,1,0,0,0,0|2,0,1]=4 259 B13R1.349 O=C([O-])C1=CC=CC=C1S(=O)(=O)O MCULE-3282855595 [0,1,0,0,0,0|2,0,1]=4 260 B13R1.547 CC(=NO)C1=C(C=CC=C1)C(=O)O MCULE-4038806816 [0,1,0,0,0,0|2,0,0]=3 261 B13R1.547 CCC(=O)C1=CC=CC=C1C(=O)O MCULE-8857715556 [0,1,0,0,0,0|2,0,0]=3 262 B13R1.547 CCS(=O)C1=C(C=CC=C1)C(=O)O MCULE-9408058966 [0,1,0,0,0,0|3,0,0]=4 263 B13R1.547 CNC(=O)C1=NC=CC=C1N(=O)=O MCULE-6992646339 [0,1,0,0,0,0|2,0,1]=4 264 B13R1.547 CNC(=O)C1=NC=CN=C1C(=O)O MCULE-4975160498 [0,1,0,0,0,0|2,0,0]=3 265 B13R1.547 COC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-4421008798 [0,1,0,0,0,0|2,0,1]=4 266 B13R1.547 COC(=O)C1=C(C=CC=C1)S(=O)C MCULE-4096864674 [0,1,0,0,0,0|3,0,0]=4 267 B13R1.547 COC(=O)C1=C(C=CC=N1)C(=O)O MCULE-6502575594 [0,1,0,0,0,0|0,0,0]=1 268 B13R1.547 COC(=O)C1=C(C=CN=C1)C(=O)O MCULE-5190481841 [0,1,0,0,0,0|2,0,0]=3 269 B13R1.547 COC(=O)C1=C(C=NC=C1)C(=O)O MCULE-8310141411 [0,1,0,0,0,0|2,0,0]=3 270 B13R1.547 COC(=O)C1=C(N=CC=C1)C(=O)C MCULE-2431708307 [0,1,0,0,0,0|1,0,0]=2 271 B13R1.547 COC(=O)C1=C(N=CC=C1)C(F)F MCULE-8216174297 [0,1,0,0,0,0|2,0,1]=4 272 B13R1.547 COC(=O)C1=C(N=CC=C1)N(=O)=O MCULE-1842202114 [0,1,0,0,0,0|1,0,1]=3 273 B13R1.547 COC(=O)C1=CC=CC=C1B(O)O MCULE-7662214031 [0,1,0,0,0,0|2,0,1]=4 274 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)C MCULE-6297416373 [0,1,0,0,0,0|2,0,0]=3 275 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)Cl MCULE-9936711468 [0,1,0,0,0,0|2,0,0]=3 276 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)N MCULE-9145284532 [0,1,0,0,0,0|2,0,0]=3 277 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)O MCULE-2559625268 [0,1,0,0,0,0|1,0,0]=2 278 B13R1.547 COC(=O)C1=CC=CN=C1B(O)O MCULE-8092082855 [0,1,0,0,0,0|1,0,1]=3 279 B13R1.547 COC(=O)C1=CC=CN=C1C(=O)O MCULE-4488787192 [0,1,0,0,0,0|0,0,0]=1 280 B13R1.547 COC(=O)C1=NC=CC=C1C(=O)N MCULE-3333569633 [0,1,0,0,0,0|1,0,0]=2 281 B13R1.547 COC(=O)C1=NC=CC=C1C(Br)Br MCULE-5456393329 [0,1,0,0,0,0|2,0,1]=4 282 B13R1.547 COC(=O)C1=NC=CC=C1N(=O)=O MCULE-6813155695 [0,1,0,0,0,0|1,0,1]=3 283 B13R1.547 COC(=O)C1=NC=CN=C1C(=O)O MCULE-2446278182 [0,1,0,0,0,0|1,0,0]=2 284 B13R1.547 N[C@@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-1955749189 [0,1,0,0,0,0|2,0,1]=4 285 B13R1.547 N[C@@H](CO)C1=CC=CC=C1C(=O)O MCULE-5022798616 [0,1,0,0,0,0|2,0,1]=4 286 B13R1.547 N[C@H](CO)C1=C(C=CC=C1)C(=O)O MCULE-8482127173 [0,1,0,0,0,0|2,0,1]=4 287 B13R1.547 N[C@H](CO)C1=CC=CC=C1C(=O)O MCULE-6982607666 [0,1,0,0,0,0|2,0,1]=4 288 B13R1.547 O=C(CO)C1=C(C=CC=C1)N(=O)=O MCULE-4645124163 [0,1,0,0,0,0|2,0,1]=4 289 B13R1.547 O=C(O)C1=C(C=CC=C1)C(=O)OO MCULE-6120306346 [0,1,0,0,0,0|1,0,0]=2 290 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)CBr MCULE-4728185281 [0,1,0,0,0,0|2,0,0]=3 291 B13R2.371 C=C1COC(=O)C2=CC=CC=C12 MCULE-8866219753 [0,0,0,1,0,0|3,0,0]=4 292 B13R2.371 CC1=CC=C(C2=NC=CC=C12)O MCULE-1998544820 [0,0,0,1,0,0|3,0,0]=4 293 B13R2.371 CC1=NOC(=O)C2=C1C=CC=C2 MCULE-2388408846 [0,0,0,1,0,0|3,0,0]=4 294 B13R2.371 NC1=C2C=CC=NC2=C(C=C1)O MCULE-7585667439 [0,0,0,1,0,0|3,0,0]=4 295 B13R2.371 NC1=C2N=CC=CC2=C(C=C1)O MCULE-1711277180 [0,0,0,1,0,0|3,0,0]=4 296 B13R2.371 NC1=C2N=CC=CC2=C(C=C1)O MCULE-5922680434 [0,0,0,1,0,0|3,0,0]=4 297 B13R2.371 NC1=CC=C(C2=C1C=CC=N2)O MCULE-6291447142 [0,0,0,1,0,0|3,0,0]=4 298 B13R2.371 NC1=CC=C(C2=C1C=CC=N2)O MCULE-6557944103 [0,0,0,1,0,0|3,0,0]=4 299 B13R2.371 NC1=CC=C(C2=C1C=CC=N2)O MCULE-8256885056 [0,0,0,1,0,0|3,0,0]=4 300 B13R2.371 O=C1C=CC(=O)C2=C1C=CC=N2 MCULE-3047877971 [0,0,0,1,0,0|2,0,0]=3 301 B13R2.371 O=C1C=CC(=O)C2=CC=CC=C12 MCULE-4996549760 [0,0,0,1,0,0|3,0,0]=4 302 B13R2.371 O=C1CCC(=O)C2=C1C=CC=N2 MCULE-7714280079 [0,0,0,1,0,0|2,0,0]=3 303 B13R2.371 O=C1CNC(=O)C2=C1C=CC=C2 MCULE-3073541529 [0,0,0,1,0,0|3,0,0]=4 304 B13R2.371 O=C1COC(=O)C2=C1C=CC=C2 MCULE-9148401423 [0,0,0,1,0,0|2,0,0]=3 305 B13R2.371 O=C1N=NC(=O)C2=C1C=CC=C2 MCULE-4266121017 [0,0,0,1,0,0|3,0,0]=4 306 B13R2.371 O=C1NC=C(C2=C1C=CC=C2)O MCULE-7115915922 [0,0,0,1,0,0|3,0,0]=4 307 B13R2.371 O=C1NC=C(C2=C1C=CC=N2)Br MCULE-4035901820 [0,0,0,1,0,0|3,0,0]=4 308 B13R2.371 O=C1NC=C(C2=C1N=CC=C2)I MCULE-1579718403 [0,0,0,1,0,0|3,0,0]=4 309 B13R2.371 O=C1NN=C(C2=CC=CN=C12)Cl MCULE-4980645742 [0,0,0,1,0,0|3,0,0]=4 310 B13R2.371 O=C1NN=C(C2=NC=CC=C12)Cl MCULE-8807696589 [0,0,0,1,0,0|3,0,0]=4 311 B13R2.371 OC1=C2C=CC=CC2=C(C=C1)O MCULE-1542999250 [0,0,0,1,0,0|3,0,0]=4 312 B13R2.371 OC1=C2C=CC=NC2=C(C=C1)Br MCULE-9845949798 [0,0,0,1,0,0|3,0,0]=4 313 B13R2.371 OC1=C2C=CC=NC2=C(C=C1)Cl MCULE-5078799907 [0,0,0,1,0,0|3,0,0]=4 314 B13R2.371 OC1=C2C=CC=NC2=C(C=C1)Cl MCULE-9593530854 [0,0,0,1,0,0|3,0,0]=4 315 B13R2.371 OC1=C2N=CC=CC2=C(C=C1)F MCULE-3526187253 [0,0,0,1,0,0|3,0,0]=4 316 B13R2.371 OC1=C2N=CC=CC2=C(C=C1)I MCULE-1483677037 [0,0,0,1,0,0|3,0,0]=4 317 B13R2.371 OC1=CC=C(C2=C1N=CC=C2)F MCULE-4943747618 [0,0,0,1,0,0|3,0,0]=4 318 B13R2.371 OC1=CC=C(C2=CC=CN=C12)Br MCULE-8348547756 [0,0,0,1,0,0|3,0,0]=4 319 B13R2.371 OC1=CC=C(C2=CC=CN=C12)Cl MCULE-2202432462 [0,0,0,1,0,0|3,0,0]=4 320 B13R2.371 OC1=CN=C(C2=C1N=CC=C2)Cl MCULE-3912883165 [0,0,0,1,0,0|3,0,0]=4 321 B13R2.371 OC1=NC=C(C2=CC=CN=C12)Br MCULE-7569811153 [0,0,0,1,0,0|3,0,0]=4 322 B13R2.371 OC1=NC=C(C2=CC=CN=C12)Cl MCULE-1971614393 [0,0,0,1,0,0|3,0,0]=4 323 B13R2.371 OC1=NN=C(C2=C1C=CC=C2)O MCULE-2682724274 [0,0,0,1,0,0|3,0,0]=4 324 B13R2.371 OC1=NN=C(C2=NC=CC=C12)O MCULE-4307690750 [0,0,0,1,0,0|2,0,0]=3 325 B13R2.371 OC1=NN=C(C2=NC=CN=C12)O MCULE-8218732721 [0,0,0,1,0,0|3,0,0]=4 326 B13R2.5514 O=C(O)C1=C(N=CC=C1)C2CC2 MCULE-9693069433 [0,0,0,1,0,0|2,0,1]=4 327 B13R2.5514 O=C(O)C1=NC=CC=C1C2CC2 MCULE-6914517117 [0,0,0,1,0,0|2,0,1]=4 328 B13R2.12159 CC1(OC(=O)C2=CC=CN=C12)O MCULE-4535220572 [0,0,0,1,0,0|1,0,1]=3 329 B13R2.12159 O=C1CS(=O)(=O)C2=NC=CC=C12 MCULE-3671725936 [0,0,0,1,0,0|2,0,1]=4 330 B13R2.12159 O=C1NS(=O)(=O)C2=C1C=CC=N2 MCULE-7834049461 [0,0,0,1,0,0|2,0,1]=4 331 B13R2.12159 O=C1OI(=O)(C2=CC=CC=C12)O MCULE-1032859726 [0,0,0,1,0,0|2,0,0]=3 332 B13R2.12159 O=C1OS(=O)(=O)C2=C1C=CC=C2 MCULE-3338526108 [0,0,0,1,0,0|2,0,1]=4 333 B11R1.178 CC(=O)C1=C(N=CS1)C(=O)O MCULE-4154247064 [0,0,0,0,1,0|2,0,0]=3 334 B11R1.178 CC(=O)C1=C(SC=C1)C(=O)O MCULE-7282562865 [0,0,0,0,1,0|2,0,0]=3 335 B11R1.178 NC(=O)C1=C(N=CN1)C(=O)O MCULE-6089389048 [0,0,0,0,1,0|2,0,0]=3 336 B11R1.178 NC(=O)C1=C(NC=N1)C(=O)N MCULE-6473905049 [0,0,0,0,1,0|3,0,0]=4 337 B11R1.178 NC(=O)C1=NNC=C1C(=O)O MCULE-6301926658 [0,0,0,0,1,0|2,0,0]=3 338 B11R1.178 O=C(Cl)C1=C(NC=N1)C(=O)Cl MCULE-8515991344 [0,0,0,0,1,0|3,0,0]=4 339 B11R1.178 O=C(Cl)C1=CSC=C1C(=O)Cl MCULE-5426792958 [0,0,0,0,1,0|3,0,0]=4 340 B11R1.178 O=C(O)C1=C(C=CO1)B(O)O MCULE-7551124670 [0,0,0,0,1,0|2,0,1]=4 341 B11R1.178 O=C(O)C1=C(C=CS1)B(O)O MCULE-7292007423 [0,0,0,0,1,0|2,0,1]=4 342 B11R1.178 O=C(O)C1=C(C=CS1)N(=O)=O MCULE-8933740153 [0,0,0,0,1,0|2,0,1]=4 343 B11R1.178 O=C(O)C1=C(C=CS1)S(=O)O MCULE-8261798776 [0,0,0,0,1,0|2,0,0]=3 344 B11R1.178 O=C(O)C1=C(CCC1)C(=O)O MCULE-7488890401 [0,0,0,0,1,0|0,0,3]=4 345 B11R1.178 O=C(O)C1=C(N=CN1)N(=O)=O MCULE-2317117276 [0,0,0,0,1,0|2,0,1]=4 346 B11R1.178 O=C(O)C1=C(NC=C1)C(=O)O MCULE-1373109441 [0,0,0,0,1,0|0,0,1]=2 347 B11R1.178 O=C(O)C1=C(NC=N1)C(=O)O MCULE-1931399717 [0,0,0,0,1,0|1,0,0]=2 348 B11R1.178 O=C(O)C1=C(NN=N1)C(=O)O MCULE-1381188517 [0,0,0,0,1,0|2,0,0]=3 349 B11R1.178 O=C(O)C1=C(OC=C1)B(O)O MCULE-1203218429 [0,0,0,0,1,0|2,0,1]=4 350 B11R1.178 O=C(O)C1=C(OC=C1)C(=O)O MCULE-4306167384 [0,0,0,0,1,0|1,0,0]=2 351 B11R1.178 O=C(O)C1=C(SC=C1)B(O)O MCULE-8582760647 [0,0,0,0,1,0|2,0,1]=4 352 B11R1.178 O=C(O)C1=C(SC=C1)C(=O)O MCULE-3080958558 [0,0,0,0,1,0|1,0,0]=2 353 B11R1.178 O=C(O)C1=C(SC=N1)C(=O)O MCULE-5518715016 [0,0,0,0,1,0|1,0,0]=2 354 B11R1.178 O=C(O)C1=C(SN=C1)C(=O)O MCULE-4283603236 [0,0,0,0,1,0|2,0,0]=3 355 B11R1.178 O=C(O)C1=CNC=C1C(=O)O MCULE-7616358531 [0,0,0,0,1,0|1,0,0]=2 356 B11R1.178 O=C(O)C1=CNN=C1C(=O)O MCULE-9652609197 [0,0,0,0,1,0|1,0,0]=2 357 B11R1.178 O=C(O)C1=CNN=C1N(=O)=O MCULE-8778176006 [0,0,0,0,1,0|2,0,1]=4 358 B11R1.178 O=C(O)C1=COC=C1C(=O)O MCULE-1360937496 [0,0,0,0,1,0|1,0,0]=2 359 B11R1.178 O=C(O)C1=CSC=C1C(=O)O MCULE-6540962743 [0,0,0,0,1,0|1,0,0]=2 360 B11R1.178 O=C(O)C1=NNC=C1N(=O)=O MCULE-8243923729 [0,0,0,0,1,0|2,0,1]=4 361 B11R1.178 O=C(O)C1=NON=C1C(=O)O MCULE-8665624488 [0,0,0,0,1,0|2,0,0]=3 362 B11R1.178 O=C(O)C1=NSN=C1C(=O)O MCULE-7013023117 [0,0,0,0,1,0|2,0,0]=3 363 B11R1.178 O=C([O-])C1=NSN=C1C(=O)O MCULE-1219828166 [0,0,0,0,1,0|2,0,1]=4 364 B13R1.589 C=C(Br)CC1=C(C=CC=C1)C(=O)O MCULE-2523429493 [0,0,0,0,0,1|3,0,0]=4 365 B13R1.589 C=C(C)CC1=C(C=CC=C1)C(=O)O MCULE-9204819801 [0,0,0,0,0,1|3,0,0]=4 366 B13R1.589 C=C(Cl)CC1=C(C=CC=C1)C(=O)O MCULE-9654249889 [0,0,0,0,0,1|3,0,0]=4 367 B13R1.589 CC(=O)CC1=CC=CC=C1C(=O)O MCULE-9138117669 [0,0,0,0,0,1|2,0,0]=3 368 B13R1.589 CC(=O)NC1=C(C=CC=C1)C(=O)C MCULE-7612602253 [0,0,0,0,0,1|3,0,0]=4 369 B13R1.589 CC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-5393805902 [0,0,0,0,0,1|3,0,0]=4 370 B13R1.589 CC(=O)NC1=C(C=CN=C1)C(=O)O MCULE-5829506832 [0,0,0,0,0,1|3,0,0]=4 371 B13R1.589 CC(=O)NC1=C(N=CC=C1)C(=O)O MCULE-3149748082 [0,0,0,0,0,1|1,0,0]=2 372 B13R1.589 CC(=O)NC1=CC=CC=C1C(=O)O MCULE-5493843354 [0,0,0,0,0,1|2,0,0]=3 373 B13R1.589 CC(=O)NC1=CC=NC=C1C(=O)O MCULE-5591664806 [0,0,0,0,0,1|3,0,0]=4 374 B13R1.589 CC(=O)NC1=NC=CC=C1C(=O)O MCULE-7404386447 [0,0,0,0,0,1|1,0,0]=2 375 B13R1.589 CC(=O)NC1=NC=CC=C1N(=O)=O MCULE-2560461962 [0,0,0,0,0,1|2,0,1]=4 376 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)C MCULE-4610880324 [0,0,0,0,0,1|3,0,0]=4 377 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)Cl MCULE-4612770101 [0,0,0,0,0,1|3,0,0]=4 378 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)O MCULE-3199019536 [0,0,0,0,0,1|2,0,0]=3 379 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)N MCULE-7791245774 [0,0,0,0,0,1|3,0,0]=4 380 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)[O-] MCULE-1298755950 [0,0,0,0,0,1|2,0,1]=4 381 B13R1.589 CC(=O)SC1=CC=CC=C1C(=O)O MCULE-5814875567 [0,0,0,0,0,1|2,0,0]=3 382 B13R1.589 CC(C)C1=CC=CN=C1CC(=O)O MCULE-4080131657 [0,0,0,0,0,1|2,0,1]=4 383 B13R1.589 CC(C)C1=CC=CN=C1CC(=O)O MCULE-5901624153 [0,0,0,0,0,1|2,0,1]=4 384 B13R1.589 CC(C)NC1=C(C=CC=N1)C(=O)O MCULE-3244169290 [0,0,0,0,0,1|2,0,1]=4 385 B13R1.589 CC(C)OC1=C(N=CC=C1)C(=O)O MCULE-7672788869 [0,0,0,0,0,1|2,0,1]=4 386 B13R1.589 CC(C)OC1=NC=CC=C1C(=O)O MCULE-9770301427 [0,0,0,0,0,1|2,0,1]=4 387 B13R1.589 CS(=O)C1=C(C=CC=C1)CC(=O)O MCULE-9403002843 [0,0,0,0,0,1|3,0,0]=4 388 B13R1.589 NC(=O)C1=C(C=CC=C1)CC(=O)O MCULE-9735756944 [0,0,0,0,0,1|2,0,0]=3 389 B13R1.589 NC(=O)CC1=CC=CC=C1C(=O)O MCULE-9127524097 [0,0,0,0,0,1|2,0,0]=3 390 B13R1.589 NC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-1350021651 [0,0,0,0,0,1|2,0,0]=3 391 B13R1.589 O=C(O)C1=C(C=CC=N1)OC(F)F MCULE-7353523700 [0,0,0,0,0,1|2,0,1]=4 392 B13R1.589 O=C(O)C1=C(N=CC=C1)SC(F)F MCULE-9433258443 [0,0,0,0,0,1|2,0,1]=4 393 B13R1.589 O=C(O)C1=CC=CN=C1OC(F)F MCULE-8281497188 [0,0,0,0,0,1|2,0,1]=4 394 B13R1.589 O=C(O)CC1=C(C=CC=C1)C(=O)O MCULE-3233814444 [0,0,0,0,0,1|1,0,0]=2 395 B13R1.589 O=C(O)CC1=C(N=CC=C1)C(=O)O MCULE-2816559837 [0,0,0,0,0,1|0,0,0]=1 396 B13R1.589 O=C(O)CC1=CC=CC=C1B(O)O MCULE-2580240403 [0,0,0,0,0,1|2,0,1]=4 397 B13R1.589 O=C(O)CC1=CC=CC=C1N(=O)=O MCULE-3522722427 [0,0,0,0,0,1|2,0,1]=4 398 B13R1.589 O=C(O)CC1=NC=CC=C1C(F)F MCULE-2682456571 [0,0,0,0,0,1|2,0,1]=4 399 B13R1.589 O=C(O)CC1=NC=CC=C1C(F)F MCULE-5239814014 [0,0,0,0,0,1|2,0,1]=4 400 B13R1.589 O=C(O)CC1=NC=CC=C1N(=O)=O MCULE-5083126449 [0,0,0,0,0,1|1,0,1]=3 401 B13R1.589 O=C(O)OC1=C(N=CC=C1)C(=O)O MCULE-1338511880 [0,0,0,0,0,1|0,0,0]=1 402 B10R1.20 C=CC1=C(C=CC=N1)C=O MCULE-4909391621 [2,0,0,0,0,0|1,0,0]=3 403 B10R1.20 C=CC1=CC=CC=C1C=O MCULE-7860754839 [2,0,0,0,0,0|2,0,0]=4 404 B10R1.20 CNC1=C(C=CC=N1)C=O MCULE-5474788764 [2,0,0,0,0,0|2,0,0]=4 405 B10R1.20 CNC1=NC=CC=C1C=O MCULE-6728805541 [2,0,0,0,0,0|2,0,0]=4 406 B10R1.20 COC1=C(N=CC=C1)C=O MCULE-1019662262 [2,0,0,0,0,0|2,0,0]=4 407 B10R1.20 COC1=NC=CC=C1C=O MCULE-2464593857 [2,0,0,0,0,0|2,0,0]=4 408 B10R1.20 CSC1=CC=CN=C1C=O MCULE-6878491140 [2,0,0,0,0,0|2,0,0]=4 409 B10R1.20 CSC1=NC=CC=C1C=O MCULE-5746525561 [2,0,0,0,0,0|2,0,0]=4 410 B10R1.20 N#CC1=C(N=CC=C1)C=O MCULE-2236464163 [2,0,0,0,0,0|1,0,1]=4 411 B10R1.20 N#CC1=NC=CC=C1C=O MCULE-9749517277 [2,0,0,0,0,0|1,0,1]=4 412 B10R1.20 O=CC1=CC=CC=C1C=O MCULE-5731001647 [2,0,0,0,0,0|1,0,0]=3 413 B10R1.20 O=CC1=CC=CC=C1CO MCULE-9613292492 [2,0,0,0,0,0|1,0,1]=4 414 B10R1.20 OCC1=CC=CN=C1CO MCULE-2512576107 [2,0,0,0,0,0|0,0,2]=4 415 B10R1.20 OCC1=CC=CN=C1CO MCULE-8479301385 [2,0,0,0,0,0|0,0,2]=4 416 B10R1.61 CC(=O)C1=C(C=CC=C1)O MCULE-6901537094 [2,0,0,0,0,0|2,0,0]=4 417 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl MCULE-8683539263 [2,0,0,0,0,0|2,0,0]=4 418 B10R1.61 CC(=O)C1=C(N=CC=C1)N MCULE-3588289826 [2,0,0,0,0,0|2,0,0]=4 419 B10R1.61 CC(=O)C1=CC=CN=C1Br MCULE-7197475093 [2,0,0,0,0,0|2,0,0]=4 420 B10R1.61 CC(=O)C1=CC=CN=C1C MCULE-6054213950 [2,0,0,0,0,0|1,0,1]=4 421 B10R1.61 CC(=O)C1=CC=CN=C1F MCULE-5772803066 [2,0,0,0,0,0|2,0,0]=4 422 B10R1.61 CC(=O)C1=CC=CNC1=O MCULE-8332051237 [2,0,0,0,0,0|1,0,1]=4 423 B10R1.61 CC(=O)C1=NC=CC=C1Br MCULE-2966393485 [2,0,0,0,0,0|2,0,0]=4 424 B10R1.61 CC(=O)C1=NC=CC=C1C MCULE-7445442229 [2,0,0,0,0,0|1,0,1]=4 425 B10R1.61 CC(=O)C1=NC=CC=C1Cl MCULE-9803438152 [2,0,0,0,0,0|2,0,0]=4 426 B10R1.61 CC(=O)C1=NC=CC=C1F MCULE-7028111083 [2,0,0,0,0,0|2,0,0]=4 427 B10R1.61 CC(=O)C1=NC=CC=C1I MCULE-4894338986 [2,0,0,0,0,0|2,0,0]=4 428 B10R1.61 CC(=O)C1=NC=CC=C1N MCULE-6340439391 [2,0,0,0,0,0|2,0,0]=4 429 B10R1.61 CC(=O)C1=NC=CC=C1N MCULE-8318657374 [2,0,0,0,0,0|2,0,0]=4 430 B10R1.61 CC(=O)C1=NC=CC=C1O MCULE-2705814075 [2,0,0,0,0,0|1,0,0]=3 431 B10R1.61 CC1=C(C=CC=C1)C(=O)O MCULE-8662697935 [2,0,0,0,0,0|1,0,1]=4 432 B10R1.61 CC1=C(C=CC=N1)C(=O)N MCULE-6050643158 [2,0,0,0,0,0|1,0,1]=4 433 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1358504120 [2,0,0,0,0,0|0,0,1]=3 434 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1760335656 [2,0,0,0,0,0|0,0,1]=3 435 B10R1.61 CC1=C(C=CN=N1)C(=O)O MCULE-8713969384 [2,0,0,0,0,0|1,0,1]=4 436 B10R1.61 CC1=C(C=NC=N1)C(=O)O MCULE-3074138717 [2,0,0,0,0,0|1,0,1]=4 437 B10R1.61 CC1=C(N=CC=C1)C(=O)O MCULE-8081940811 [2,0,0,0,0,0|0,0,1]=3 438 B10R1.61 CC1=C(N=CC=C1)S(=O)O MCULE-9862077500 [2,0,0,0,0,0|1,0,1]=4 439 B10R1.61 CC1=C(N=CC=N1)C(=O)O MCULE-3068762074 [2,0,0,0,0,0|1,0,1]=4 440 B10R1.61 CC1=CC=CN=C1C(=O)Cl MCULE-1705570381 [2,0,0,0,0,0|1,0,1]=4 441 B10R1.61 CC1=CC=CN=C1C(=O)N MCULE-6395290096 [2,0,0,0,0,0|1,0,1]=4 442 B10R1.61 CC1=CC=CN=C1C(=O)O MCULE-6679892229 [2,0,0,0,0,0|0,0,1]=3 443 B10R1.61 CC1=CC=NN=C1C(=O)O MCULE-6501091471 [2,0,0,0,0,0|1,0,1]=4 444 B10R1.61 CC1=CN=CN=C1C(=O)O MCULE-3791670846 [2,0,0,0,0,0|1,0,1]=4 445 B10R1.61 CC1=NC=CC=C1C(=O)Cl MCULE-5422613457 [2,0,0,0,0,0|1,0,1]=4 446 B10R1.61 N=C(N)C1=C(N=CC=C1)O MCULE-5091680971 [2,0,0,0,0,0|2,0,0]=4 447 B10R1.61 N=C(N)C1=C(N=CC=C1)O MCULE-9847098958 [2,0,0,0,0,0|2,0,0]=4 448 B10R1.61 NC(=O)C1=C(C=CC=C1)O MCULE-5482995635 [2,0,0,0,0,0|2,0,0]=4 449 B10R1.61 NC(=O)C1=C(C=CC=N1)Br MCULE-5589271808 [2,0,0,0,0,0|2,0,0]=4 450 B10R1.61 NC(=O)C1=C(C=CC=N1)N MCULE-3973998454 [2,0,0,0,0,0|2,0,0]=4 451 B10R1.61 NC(=O)C1=C(C=CC=N1)O MCULE-3212155538 [2,0,0,0,0,0|1,0,0]=3 452 B10R1.61 NC(=O)C1=C(N=CC=C1)Br MCULE-5384308853 [2,0,0,0,0,0|2,0,0]=4 453 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl MCULE-4022706398 [2,0,0,0,0,0|2,0,0]=4 454 B10R1.61 NC(=O)C1=C(N=CC=C1)N MCULE-1431156151 [2,0,0,0,0,0|2,0,0]=4 455 B10R1.61 NC(=O)C1=C(N=CC=C1)S MCULE-9849545949 [2,0,0,0,0,0|1,1,0]=4 456 B10R1.61 NC(=O)C1=CC=CN=C1F MCULE-8064629807 [2,0,0,0,0,0|2,0,0]=4 457 B10R1.61 NC(=O)C1=CC=CNC1=O MCULE-5159050018 [2,0,0,0,0,0|1,0,1]=4 458 B10R1.61 NC(=O)C1=CNC=NC1=O MCULE-7799177075 [2,0,0,0,0,0|2,0,0]=4 459 B10R1.61 NC(=O)C1=NC=CC=C1Cl MCULE-4072576423 [2,0,0,0,0,0|2,0,0]=4 460 B10R1.61 NC(=O)C1=NC=CC=C1F MCULE-2859882052 [2,0,0,0,0,0|2,0,0]=4 461 B10R1.61 NC(=O)C1=NC=CN=C1O MCULE-7149774620 [2,0,0,0,0,0|2,0,0]=4 462 B10R1.61 NC1=C(C=CC=C1)C(=O)O MCULE-8970106555 [2,0,0,0,0,0|2,0,0]=4 463 B10R1.61 NC1=C(C=CN=N1)C(=O)O MCULE-4311909541 [2,0,0,0,0,0|2,0,0]=4 464 B10R1.61 NC1=C(C=NC=N1)C(=O)O MCULE-9960106839 [2,0,0,0,0,0|2,0,0]=4 465 B10R1.61 NC1=C(N=CC=N1)C(=O)O MCULE-3463289297 [2,0,0,0,0,0|2,0,0]=4 466 B10R1.61 NC1=CC=CN=C1C(=O)O MCULE-2356810587 [2,0,0,0,0,0|1,0,0]=3 467 B10R1.61 NC1=CC=CN=C1C(=O)O MCULE-9991303306 [2,0,0,0,0,0|1,0,0]=3 468 B10R1.61 NC1=CC=NN=C1C(=O)O MCULE-6542067746 [2,0,0,0,0,0|2,0,0]=4 469 B10R1.61 NC1=CC=NN=C1C(=O)O MCULE-8539591838 [2,0,0,0,0,0|2,0,0]=4 470 B10R1.61 NC1=CN=CN=C1C(=O)O MCULE-2578476872 [2,0,0,0,0,0|2,0,0]=4 471 B10R1.61 NC1=NC=CC=C1C(=O)Cl MCULE-3679071580 [2,0,0,0,0,0|2,0,0]=4 472 B10R1.61 NC1=NC=CC=C1C(=O)O MCULE-3175833110 [2,0,0,0,0,0|1,0,0]=3 473 B10R1.61 O=C(Cl)C1=C(C=CC=N1)Cl MCULE-5692822736 [2,0,0,0,0,0|2,0,0]=4 474 B10R1.61 O=C(Cl)C1=CC=CC=C1O MCULE-4010403743 [2,0,0,0,0,0|2,0,0]=4 475 B10R1.61 O=C(Cl)C1=CC=CN=C1Br MCULE-5088816790 [2,0,0,0,0,0|2,0,0]=4 476 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl MCULE-5603349813 [2,0,0,0,0,0|2,0,0]=4 477 B10R1.61 O=C(Cl)C1=CC=CN=C1F MCULE-4604425450 [2,0,0,0,0,0|2,0,0]=4 478 B10R1.61 O=C(Cl)C1=CC=CN=C1S MCULE-1062479064 [2,0,0,0,0,0|1,1,0]=4 479 B10R1.61 O=C(Cl)C1=NC=CC=C1F MCULE-5482208669 [2,0,0,0,0,0|2,0,0]=4 480 B10R1.61 O=C(Cl)C1=NC=CC=C1O MCULE-3590462423 [2,0,0,0,0,0|1,0,0]=3 481 B10R1.61 O=C(Cl)C1=NC=CN=C1O MCULE-6753341779 [2,0,0,0,0,0|2,0,0]=4 482 B10R1.61 O=C(O)C1=C(C=CC=C1)Br MCULE-3239222085 [2,0,0,0,0,0|2,0,0]=4 483 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl MCULE-1696137032 [2,0,0,0,0,0|2,0,0]=4 484 B10R1.61 O=C(O)C1=C(C=CC=C1)O MCULE-4238157211 [2,0,0,0,0,0|1,0,0]=3 485 B10R1.61 O=C(O)C1=C(C=CC=C1)S MCULE-8297385152 [2,0,0,0,0,0|1,1,0]=4 486 B10R1.61 O=C(O)C1=C(C=CC=N1)Br MCULE-4344174693 [2,0,0,0,0,0|1,0,0]=3 487 B10R1.61 O=C(O)C1=C(C=CC=N1)I MCULE-3545834696 [2,0,0,0,0,0|1,0,0]=3 488 B10R1.61 O=C(O)C1=C(C=CC=N1)O MCULE-7115836080 [2,0,0,0,0,0|0,0,0]=2 489 B10R1.61 O=C(O)C1=C(C=CC=N1)S MCULE-4203077129 [2,0,0,0,0,0|0,1,0]=3 490 B10R1.61 O=C(O)C1=C(C=CN=C1)O MCULE-9587370315 [2,0,0,0,0,0|2,0,0]=4 491 B10R1.61 O=C(O)C1=C(C=NC=C1)O MCULE-6913534695 [2,0,0,0,0,0|2,0,0]=4 492 B10R1.61 O=C(O)C1=C(C=NC=N1)Cl MCULE-4284259761 [2,0,0,0,0,0|2,0,0]=4 493 B10R1.61 O=C(O)C1=C(C=NC=N1)F MCULE-2197612040 [2,0,0,0,0,0|2,0,0]=4 494 B10R1.61 O=C(O)C1=C(N=CC=C1)Cl MCULE-9186493058 [2,0,0,0,0,0|1,0,0]=3 495 B10R1.61 O=C(O)C1=C(N=CC=C1)I MCULE-4031419128 [2,0,0,0,0,0|1,0,0]=3 496 B10R1.61 O=C(O)C1=C(N=CC=N1)S MCULE-7646133165 [2,0,0,0,0,0|1,1,0]=4 497 B10R1.61 O=C(O)C1=C(N=NC=C1)Cl MCULE-1589091595 [2,0,0,0,0,0|2,0,0]=4 498 B10R1.61 O=C(O)C1=C(N=NC=C1)S MCULE-3462080597 [2,0,0,0,0,0|1,1,0]=4 499 B10R1.61 O=C(O)C1=CC=CC=C1F MCULE-2885931404 [2,0,0,0,0,0|2,0,0]=4 500 B10R1.61 O=C(O)C1=CC=CC=C1I MCULE-5987010449 [2,0,0,0,0,0|2,0,0]=4 501 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8407868694 [2,0,0,0,0,0|1,0,0]=3 502 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8756695354 [2,0,0,0,0,0|1,0,0]=3 503 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-9332636114 [2,0,0,0,0,0|1,0,0]=3 504 B10R1.61 O=C(O)C1=CC=CN=C1Br MCULE-2307647512 [2,0,0,0,0,0|1,0,0]=3 505 B10R1.61 O=C(O)C1=CC=CN=C1F MCULE-8936365151 [2,0,0,0,0,0|1,0,0]=3 506 B10R1.61 O=C(O)C1=CC=CN=C1O MCULE-3119679537 [2,0,0,0,0,0|0,0,0]=2 507 B10R1.61 O=C(O)C1=CC=CN=C1S MCULE-9687940814 [2,0,0,0,0,0|0,1,0]=3 508 B10R1.61 O=C(O)C1=CC=COC1=O MCULE-7272938902 [2,0,0,0,0,0|1,0,0]=3 509 B10R1.61 O=C(O)C1=CC=NNC1=O MCULE-5812037295 [2,0,0,0,0,0|1,0,1]=4 510 B10R1.61 O=C(O)C1=CN=CN=C1Cl MCULE-1324066589 [2,0,0,0,0,0|2,0,0]=4 511 B10R1.61 O=C(O)C1=CNC=NC1=O MCULE-7526187020 [2,0,0,0,0,0|1,0,0]=3 512 B10R1.61 O=C(O)C1=NC=CC=C1Br MCULE-3606808833 [2,0,0,0,0,0|1,0,0]=3 513 B10R1.61 O=C(O)C1=NC=CC=C1Cl MCULE-2890401948 [2,0,0,0,0,0|1,0,0]=3 514 B10R1.61 O=C(O)C1=NC=CC=C1F MCULE-4259510995 [2,0,0,0,0,0|1,0,0]=3 515 B10R1.61 O=C(O)C1=NC=CC=C1F MCULE-9291944516 [2,0,0,0,0,0|1,0,0]=3 516 B10R1.61 O=C(O)C1=NC=CC=C1S MCULE-7486731745 [2,0,0,0,0,0|0,1,0]=3 517 B10R1.61 O=C(O)C1=NC=CN=C1Br MCULE-9422637464 [2,0,0,0,0,0|2,0,0]=4 518 B10R1.61 O=C(O)C1=NC=CN=C1Cl MCULE-4997590987 [2,0,0,0,0,0|2,0,0]=4 519 B10R1.61 O=C(O)C1=NC=CN=C1F MCULE-4103589228 [2,0,0,0,0,0|2,0,0]=4 520 B10R1.61 O=C(O)C1=NC=CN=C1I MCULE-3852096378 [2,0,0,0,0,0|2,0,0]=4 521 B10R1.61 O=C(O)C1=NC=CN=C1O MCULE-1082436349 [2,0,0,0,0,0|1,0,0]=3 522 B10R1.61 O=C(O)C1=NC=NC=C1Br MCULE-1151611735 [2,0,0,0,0,0|2,0,0]=4 523 B10R1.61 O=C(O)C1C=CC=NC1=O MCULE-4953790271 [2,0,0,0,0,0|0,0,1]=3 524 B10R1.61 O=C([O-])C1=C(C=CC=C1)O MCULE-8473693653 [2,0,0,0,0,0|1,0,1]=4 525 B10R1.61 O=C([O-])C1=C(C=CC=N1)Br MCULE-8398767154 [2,0,0,0,0,0|1,0,1]=4 526 B10R1.61 O=C([O-])C1=C(N=CC=C1)O MCULE-9169400221 [2,0,0,0,0,0|0,0,1]=3 527 B10R1.61 O=C([O-])C1=CC=CC=C1O MCULE-9355450041 [2,0,0,0,0,0|1,0,1]=4 528 B10R1.61 O=C([O-])C1=NC=CC=C1F MCULE-2449674662 [2,0,0,0,0,0|1,0,1]=4 529 B10R1.61 O=N(=O)C1=C(C=CC=N1)O MCULE-5540914346 [2,0,0,0,0,0|1,0,1]=4 530 B10R1.61 O=P(O)C1=C(C=CC=C1)O MCULE-9956328914 [2,0,0,0,0,0|2,0,0]=4 531 B10R1.61 OB(O)C1=NC=CC=C1O MCULE-3825680664 [2,0,0,0,0,0|1,0,1]=4 532 B10R1.61 OC(=S)C1=CC=CC=C1O MCULE-2639793618 [2,0,0,0,0,0|1,1,0]=4 533 B10R1.61 [NH-]C(=O)C1=NC=CNC1=O MCULE-1904711334 [2,0,0,0,0,0|2,0,0]=4 534 B10R1.61 [NH-]C(=O)C1=NC=CNC1=O MCULE-3826493918 [2,0,0,0,0,0|2,0,0]=4 535 B12R1.46 CC1=CC(=C(C=C1)C=O)C(=O)O MCULE-4742028324 [1,1,0,0,0,0|1,0,0]=3 536 B12R1.46 CC1=CC=C(C(=C1)C(=O)O)[IH2]=O MCULE-8633357510 [1,1,0,0,0,0|2,0,0]=4 537 B12R1.46 CCC1=C(C=C(C=N1)F)C(=O)O MCULE-6335971415 [1,1,0,0,0,0|1,0,1]=4 538 B12R1.46 CCC1=C(N=C(C=C1)C)C(=O)O MCULE-9098168312 [1,1,0,0,0,0|1,0,1]=4 539 B12R1.46 CNC1=C(C=C(C=N1)Br)C(=O)O MCULE-5000714367 [1,1,0,0,0,0|2,0,0]=4 540 B12R1.46 COC1=C(C=C(C=N1)Br)C(=O)O MCULE-9085133579 [1,1,0,0,0,0|2,0,0]=4 541 B12R1.46 COC1=C(C=C(C=N1)C)C(=O)O MCULE-5914666642 [1,1,0,0,0,0|2,0,0]=4 542 B12R1.46 COC1=C(C=C(C=N1)F)C(=O)O MCULE-7377468924 [1,1,0,0,0,0|2,0,0]=4 543 B12R1.46 COC1=C(N=C(C=C1)C)C(=O)O MCULE-5016701848 [1,1,0,0,0,0|2,0,0]=4 544 B12R1.46 COC1=CC=C(N=C1C(=O)O)Br MCULE-4791058326 [1,1,0,0,0,0|2,0,0]=4 545 B12R1.46 COC1=CC=C(N=C1C(=O)O)Cl MCULE-2845926342 [1,1,0,0,0,0|2,0,0]=4 546 B12R1.46 COC1=CC=C(N=C1C(=O)O)F MCULE-4282671903 [1,1,0,0,0,0|2,0,0]=4 547 B12R1.46 COC1=NC=C(C=C1C(=O)O)Cl MCULE-4928848108 [1,1,0,0,0,0|2,0,0]=4 548 B12R1.46 COC1=NC=C(C=C1C(=O)O)I MCULE-4794551178 [1,1,0,0,0,0|2,0,0]=4 549 B12R1.46 CSC1=C(C=C(C=N1)Br)C(=O)O MCULE-3958272627 [1,1,0,0,0,0|2,0,0]=4 550 B12R1.46 CSC1=NC=C(C=C1C(=O)O)C MCULE-8662461377 [1,1,0,0,0,0|2,0,0]=4 551 B12R1.46 N#CC1=NC=C(C=C1C(=O)O)Br MCULE-8940449118 [1,1,0,0,0,0|1,0,1]=4 552 B12R1.46 O=CC1=C(C=C(C=C1)Br)C(=O)O MCULE-3347116643 [1,1,0,0,0,0|1,0,0]=3 553 B12R1.46 O=CC1=C(C=C(C=C1)Cl)C(=O)O MCULE-4708405428 [1,1,0,0,0,0|1,0,0]=3 554 B12R1.46 O=CC1=C(C=C(C=C1)F)C(=O)O MCULE-2641944721 [1,1,0,0,0,0|1,0,0]=3 555 B12R1.46 O=CC1=CC=C(C=C1C(=O)O)I MCULE-3106354171 [1,1,0,0,0,0|1,0,0]=3 556 B12R1.46 O=CC1=NC=C(C=C1N(=O)=O)Br MCULE-9582727629 [1,1,0,0,0,0|1,0,1]=4 557 B12R1.46 O=CC1=NC=C(C=C1N(=O)=O)Cl MCULE-5191445077 [1,1,0,0,0,0|1,0,1]=4 558 B12R1.46 O=CC1=NC=C(C=C1N(=O)=O)F MCULE-8669171247 [1,1,0,0,0,0|1,0,1]=4 559 B12R1.57 CC1=CC(=C(C=C1)C(=O)O)C=O MCULE-4105101262 [1,1,0,0,0,0|1,0,0]=3 560 B12R1.57 CCC1=NC(=CC=C1C(=O)O)O MCULE-7208282012 [1,1,0,0,0,0|1,0,1]=4 561 B12R1.57 CNC1=C(C=CC(=N1)C)C(=O)O MCULE-2885362377 [1,1,0,0,0,0|2,0,0]=4 562 B12R1.57 CNC1=CC(=CN=C1C(=O)O)Br MCULE-6684883632 [1,1,0,0,0,0|2,0,0]=4 563 B12R1.57 COC1=C(C=CC(=N1)Br)C(=O)O MCULE-6186668121 [1,1,0,0,0,0|2,0,0]=4 564 B12R1.57 COC1=C(C=CC(=N1)Cl)C(=O)O MCULE-1184343947 [1,1,0,0,0,0|2,0,0]=4 565 B12R1.57 COC1=C(C=CC(=N1)N)C(=O)O MCULE-4554710198 [1,1,0,0,0,0|2,0,0]=4 566 B12R1.57 COC1=C(N=CC(=C1)C)C(=O)O MCULE-3599113060 [1,1,0,0,0,0|2,0,0]=4 567 B12R1.57 COC1=CC(=CN=C1C(=O)O)Br MCULE-3246292606 [1,1,0,0,0,0|2,0,0]=4 568 B12R1.57 COC1=CC(=CN=C1C(=O)O)Cl MCULE-9219962991 [1,1,0,0,0,0|2,0,0]=4 569 B12R1.57 COC1=CC(=CN=C1C(=O)O)F MCULE-8374611776 [1,1,0,0,0,0|2,0,0]=4 570 B12R1.57 COC1=NC(=CC=C1C(=O)O)C MCULE-8590059507 [1,1,0,0,0,0|2,0,0]=4 571 B12R1.57 COC1=NC(=CC=C1C(=O)O)F MCULE-8285518224 [1,1,0,0,0,0|2,0,0]=4 572 B12R1.57 CSC1=C(C=CC(=N1)Cl)C(=O)O MCULE-8705661856 [1,1,0,0,0,0|2,0,0]=4 573 B12R1.57 CSC1=CC(=CN=C1C(=O)O)C MCULE-2224342945 [1,1,0,0,0,0|2,0,0]=4 574 B12R1.57 CSC1=CC(=CN=C1C(=O)O)Cl MCULE-9651451926 [1,1,0,0,0,0|2,0,0]=4 575 B12R1.57 CSC1=CC(=CN=C1C(=O)O)F MCULE-9599031858 [1,1,0,0,0,0|2,0,0]=4 576 B12R1.57 N#CC1=C(N=CC(=C1)Cl)C(=O)O MCULE-6714741850 [1,1,0,0,0,0|1,0,1]=4 577 B12R1.57 NNC1=C(C=CC(=N1)Cl)C(=O)O MCULE-5986859821 [1,1,0,0,0,0|2,0,0]=4 578 B12R1.57 O=C(O)C1=CC=C(C=C1CO)Br MCULE-9519472092 [1,1,0,0,0,0|1,0,1]=4 579 B12R1.57 O=C(O)C1=CC=C(C=C1CO)Cl MCULE-9448085619 [1,1,0,0,0,0|1,0,1]=4 580 B12R1.57 O=C(O)C1=CC=C(C=C1CO)F MCULE-8530587736 [1,1,0,0,0,0|1,0,1]=4 581 B12R1.57 O=CC1=C(C=CC(=C1)Br)C(=O)O MCULE-5884992981 [1,1,0,0,0,0|1,0,0]=3 582 B12R1.57 O=CC1=C(C=CC(=C1)F)C(=O)O MCULE-9943376771 [1,1,0,0,0,0|1,0,0]=3 583 B12R1.57 O=CC1=C(N=CC(=C1)Br)N(=O)=O MCULE-2809669785 [1,1,0,0,0,0|1,0,1]=4 584 B12R1.57 O=CC1=CC(=CC=C1C(=O)O)Cl MCULE-9457881409 [1,1,0,0,0,0|1,0,0]=3 585 B12R1.57 O=CC1=CC(=NC=C1C(=O)O)Cl MCULE-5551993774 [1,1,0,0,0,0|2,0,0]=4 586 B12R1.76 CS(=O)(=O)C1=C(C=CC=N1)C=O MCULE-4502821401 [1,1,0,0,0,0|1,0,1]=4 587 B12R1.76 O=CC1=CC=CC=C1S(=O)(=O)O MCULE-1597117155 [1,1,0,0,0,0|2,0,0]=4 588 B12R1.77 C#CC1=CC=CN=C1C(=O)OC MCULE-7262076088 [1,1,0,0,0,0|1,0,1]=4 589 B12R1.77 C=CC1=C(C=CC=N1)C(=O)OC MCULE-5825613119 [1,1,0,0,0,0|1,0,0]=3 590 B12R1.77 C=CC1=CC=CC=C1C(=O)OC MCULE-2124839346 [1,1,0,0,0,0|2,0,0]=4 591 B12R1.77 CCC1=C(C=CC=N1)C(=O)OC MCULE-3615366338 [1,1,0,0,0,0|1,0,1]=4 592 B12R1.77 COC(=O)C1=C(C=CC=C1)C=O MCULE-4277651382 [1,1,0,0,0,0|1,0,0]=3 593 B12R1.77 COC(=O)C1=C(C=CC=C1)CO MCULE-7459998371 [1,1,0,0,0,0|1,0,1]=4 594 B12R1.77 COC(=O)C1=C(C=CC=N1)SC MCULE-1529751141 [1,1,0,0,0,0|2,0,0]=4 595 B12R1.77 COC(=O)C1=C(C=NC=C1)C=O MCULE-3892465555 [1,1,0,0,0,0|2,0,0]=4 596 B12R1.77 COC(=O)C1=C(N=CC=C1)C#N MCULE-1640963443 [1,1,0,0,0,0|1,0,1]=4 597 B12R1.77 COC(=O)C1=C(N=CC=C1)C=O MCULE-6761679023 [1,1,0,0,0,0|0,0,0]=2 598 B12R1.77 COC(=O)C1=C(N=CC=C1)CBr MCULE-9130853256 [1,1,0,0,0,0|1,0,1]=4 599 B12R1.77 COC(=O)C1=C(N=CC=C1)CCl MCULE-1415087139 [1,1,0,0,0,0|1,0,1]=4 600 B12R1.77 COC(=O)C1=C(N=CC=C1)CCl MCULE-4859988125 [1,1,0,0,0,0|1,0,1]=4 601 B12R1.77 COC(=O)C1=C(N=CC=C1)CN MCULE-1251185432 [1,1,0,0,0,0|1,0,1]=4 602 B12R1.77 COC(=O)C1=C(N=CC=C1)CN MCULE-1559259902 [1,1,0,0,0,0|1,0,1]=4 603 B12R1.77 COC(=O)C1=C(N=CC=C1)CO MCULE-3559996513 [1,1,0,0,0,0|0,0,1]=3 604 B12R1.77 COC(=O)C1=C(N=CC=C1)NN MCULE-4929199957 [1,1,0,0,0,0|2,0,0]=4 605 B12R1.77 COC(=O)C1=C(N=CC=C1)OC MCULE-9074964532 [1,1,0,0,0,0|2,0,0]=4 606 B12R1.77 COC(=O)C1=CC=CN=C1SC MCULE-2216789823 [1,1,0,0,0,0|2,0,0]=4 607 B12R1.77 COC(=O)C1=CN=CC=C1C=O MCULE-7283835837 [1,1,0,0,0,0|2,0,0]=4 608 B12R1.77 COC(=O)C1=NC=CC=C1C#N MCULE-4603438475 [1,1,0,0,0,0|1,0,1]=4 609 B12R1.77 COC(=O)C1=NC=CC=C1C=O MCULE-4706732407 [1,1,0,0,0,0|0,0,0]=2 610 B12R1.77 COC(=O)C1=NC=CC=C1CBr MCULE-2721284665 [1,1,0,0,0,0|1,0,1]=4 611 B12R1.77 COC(=O)C1=NC=CC=C1CCl MCULE-1645954379 [1,1,0,0,0,0|1,0,1]=4 612 B12R1.77 COC(=O)C1=NC=CC=C1CN MCULE-2436813475 [1,1,0,0,0,0|1,0,1]=4 613 B12R1.77 COC(=O)C1=NC=CC=C1CN MCULE-3092074396 [1,1,0,0,0,0|1,0,1]=4 614 B12R1.77 COC(=O)C1=NC=CC=C1OC MCULE-5328722829 [1,1,0,0,0,0|2,0,0]=4 615 B12R1.87 COC1=C(C=CN=C1C(=O)O)Cl MCULE-1657664191 [1,1,0,0,0,0|2,0,0]=4 616 B12R1.87 O=CC1=C(C=CC=C1Br)C(=O)O MCULE-7676407680 [1,1,0,0,0,0|1,0,0]=3 617 B12R1.87 O=CC1=C(C=CC=C1C(=O)[O-])Br MCULE-2876522370 [1,1,0,0,0,0|1,0,1]=4 618 B12R1.87 O=CC1=C(C=CC=C1Cl)C(=O)O MCULE-8210248539 [1,1,0,0,0,0|1,0,0]=3 619 B12R1.87 O=CC1=C(C=CC=C1F)C(=O)O MCULE-7730871850 [1,1,0,0,0,0|1,0,0]=3 620 B12R1.87 O=CC1=C(C=CC=C1O)C(=O)O MCULE-3802946118 [1,1,0,0,0,0|1,0,0]=3 621 B12R1.87 O=CC1=C(C=NC=C1Br)C(=O)O MCULE-3010526551 [1,1,0,0,0,0|2,0,0]=4 622 B12R1.87 O=CC1=C(N=CC=C1C(=O)O)Cl MCULE-8577021438 [1,1,0,0,0,0|2,0,0]=4 623 B12R1.283 C=CCC1=CC=CC=C1C(=O)O MCULE-1091378974 [1,1,0,0,0,0|2,0,0]=4 624 B12R1.283 CC(=O)C1=CC=CC=C1NC=O MCULE-7637587581 [1,1,0,0,0,0|2,0,0]=4 625 B12R1.283 CCCC1=CC=CN=C1C(=O)O MCULE-7682254205 [1,1,0,0,0,0|1,0,1]=4 626 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-2828865660 [1,1,0,0,0,0|1,0,1]=4 627 B12R1.283 CCNC1=CC=CN=C1C(=O)O MCULE-5929167420 [1,1,0,0,0,0|1,0,1]=4 628 B12R1.283 CCNC1=NC=CC=C1C(=O)O MCULE-2120786961 [1,1,0,0,0,0|1,0,1]=4 629 B12R1.283 CCOC1=C(N=CC=C1)C(=O)O MCULE-5509609544 [1,1,0,0,0,0|1,0,1]=4 630 B12R1.283 CCOC1=NC=CC=C1C(=O)O MCULE-7005430233 [1,1,0,0,0,0|1,0,1]=4 631 B12R1.283 CCSC1=C(N=CC=C1)C(=O)O MCULE-2281159092 [1,1,0,0,0,0|1,0,1]=4 632 B12R1.283 CCSC1=NC=CC=C1C(=O)O MCULE-1303756734 [1,1,0,0,0,0|1,0,1]=4 633 B12R1.283 COCC1=C(C=CC=C1)C(=O)O MCULE-6800520007 [1,1,0,0,0,0|1,0,1]=4 634 B12R1.283 CSCC1=C(N=CC=C1)C(=O)O MCULE-1965156711 [1,1,0,0,0,0|0,1,1]=4 635 B12R1.283 N#N=NC1=C(N=CC=C1)C(=O)O MCULE-4825018049 [1,1,0,0,0,0|2,0,0]=4 636 B12R1.283 N#N=NC1=C(N=CC=C1)C(=O)O MCULE-8647987936 [1,1,0,0,0,0|2,0,0]=4 637 B12R1.283 O=CNC1=C(C=CC=C1)C(=O)O MCULE-3344929418 [1,1,0,0,0,0|1,0,0]=3 638 B12R1.437 C=CC1=CC=CC(=C1C(=O)O)C MCULE-6517306105 [1,1,0,0,0,0|2,0,0]=4 639 B12R1.437 CC1=C(C(=CC=C1)C=O)C(=O)O MCULE-6904922459 [1,1,0,0,0,0|1,0,0]=3 640 B12R1.437 COC1=C(C(=CC=N1)Br)C(=O)O MCULE-4365016463 [1,1,0,0,0,0|2,0,0]=4 641 B12R1.437 COC1=C(C(=CC=N1)C)C(=O)O MCULE-6488562033 [1,1,0,0,0,0|2,0,0]=4 642 B12R1.437 COC1=C(C(=CC=N1)Cl)C(=O)O MCULE-8094169793 [1,1,0,0,0,0|2,0,0]=4 643 B12R1.437 COC1=C(C(=CC=N1)F)C(=O)O MCULE-6591673217 [1,1,0,0,0,0|2,0,0]=4 644 B12R1.437 COC1=C(C(=CC=N1)I)C(=O)O MCULE-8369942991 [1,1,0,0,0,0|2,0,0]=4 645 B12R1.437 COC1=C(C(=CC=N1)N)C(=O)O MCULE-4877760468 [1,1,0,0,0,0|2,0,0]=4 646 B12R1.437 COC1=C(C(=CC=N1)N)C(=O)O MCULE-9298192212 [1,1,0,0,0,0|2,0,0]=4 647 B12R1.437 O=CC1=C(C(=CC=C1)Cl)C(=O)O MCULE-1835864891 [1,1,0,0,0,0|1,0,0]=3 648 B12R1.437 O=CC1=C(C(=CC=C1)F)C(=O)O MCULE-9055428854 [1,1,0,0,0,0|1,0,0]=3 649 B12R1.437 O=CC1=CC=CC(=C1C(=O)O)Br MCULE-1810968842 [1,1,0,0,0,0|1,0,0]=3 650 B12R1.368 COC(=O)C1=C(C=CS1)C(=O)O MCULE-4957856189 [0,1,0,0,1,0|1,0,0]=3 651 B12R1.368 COC(=O)C1=C(OC=C1)C(=O)O MCULE-1513974625 [0,1,0,0,1,0|1,0,0]=3 652 B12R1.368 COC(=O)C1=CSC=C1C(=O)O MCULE-3120873058 [0,1,0,0,1,0|1,0,0]=3 653 B12R1.368 COC(=O)C1=NNC=C1C(=O)O MCULE-4693060915 [0,1,0,0,1,0|1,0,0]=3 654 B12R1.498 CC1=C(C(=CO1)C(=O)O)C(=O)O MCULE-7315841240 [0,1,0,0,1,0|1,0,0]=3 655 B12R1.498 CC1=C(C(=CS1)C(=O)O)C(=O)O MCULE-1974079828 [0,1,0,0,1,0|1,0,0]=3 656 B12R1.498 CC1=CNC(=C1C(=O)N)C(=O)O MCULE-1369304466 [0,1,0,0,1,0|1,0,1]=4 657 B12R1.498 CC1=CSC(=C1C(=O)O)C(=O)O MCULE-4264906531 [0,1,0,0,1,0|1,0,0]=3 658 B12R1.498 CN1C=CC(=C1C(=O)O)C(=O)O MCULE-9929848460 [0,1,0,0,1,0|0,0,1]=3 659 B12R1.498 CN1C=NC(=C1C(=O)O)C(=O)O MCULE-1000201378 [0,1,0,0,1,0|1,0,0]=3 660 B12R1.498 CN1C=NC(=C1C(=O)O)C(=O)O MCULE-9456505792 [0,1,0,0,1,0|1,0,0]=3 661 B12R1.498 CN1N=CC(=C1C(=O)O)C(=O)O MCULE-7612850762 [0,1,0,0,1,0|1,0,1]=4 662 B12R1.498 CN1N=NC(=C1C(=O)O)C(=O)O MCULE-7187886011 [0,1,0,0,1,0|2,0,0]=4 663 B12R1.850 CC(=O)C1=C(N=C(N1)C)C(=O)O MCULE-8176140170 [0,1,0,0,1,0|2,0,0]=4 664 B12R1.850 CC(=O)C1=CN(N=C1C(=O)O)C MCULE-9309581804 [0,1,0,0,1,0|2,0,0]=4 665 B12R1.850 CC1=CC(=C(S1)C(=O)O)C(=O)O MCULE-4153659286 [0,1,0,0,1,0|1,0,0]=3 666 B12R1.850 CC1=NC(=C(N1)C(=O)O)C(=O)O MCULE-3312564538 [0,1,0,0,1,0|1,0,0]=3 667 B12R1.850 CC1=NC(=C(O1)C(=O)O)C(=O)O MCULE-3686585456 [0,1,0,0,1,0|1,0,0]=3 668 B12R1.850 CN1C=C(C(=N1)C(=O)N)C(=O)O MCULE-1040802955 [0,1,0,0,1,0|2,0,0]=4 669 B12R1.850 CN1C=C(C(=N1)C(=O)O)C(=O)N MCULE-5429081164 [0,1,0,0,1,0|2,0,0]=4 670 B12R1.850 CN1C=C(C(=N1)C(=O)O)C(=O)O MCULE-6364871240 [0,1,0,0,1,0|1,0,0]=3 671 B12R1.850 CN1N=C(C(=N1)C(=O)O)C(=O)O MCULE-3966193831 [0,1,0,0,1,0|2,0,0]=4 672 B12R1.850 NC1=NC(=C(N1)C(=O)O)C(=O)O MCULE-5324365924 [0,1,0,0,1,0|1,0,0]=3 673 B12R1.850 O=C(O)C1=C(NC(=N1)Br)C(=O)O MCULE-6745335074 [0,1,0,0,1,0|1,0,0]=3 674 B12R1.850 O=C(O)C1=C(SC(=C1)Br)C(=O)O MCULE-4299389942 [0,1,0,0,1,0|1,0,0]=3 675 B12R1.850 O=C(O)C1=C(SC(=S)S1)C(=O)O MCULE-4781997888 [0,1,0,0,1,0|2,0,0]=4 676 B14R1.164 CC(=O)NC1=C(C=CC(=C1)Br)C(=O)O MCULE-4494478353 [0,1,0,0,0,1|2,0,0]=4 677 B14R1.164 CC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O MCULE-9008212808 [0,1,0,0,0,1|2,0,0]=4 678 B14R1.164 CC(=O)NC1=C(C=CC(=C1)F)C(=O)O MCULE-1844406156 [0,1,0,0,0,1|2,0,0]=4 679 B14R1.164 CC(=O)NC1=C(N=CC(=C1)Br)C(=O)N MCULE-9236428394 [0,1,0,0,0,1|2,0,0]=4 680 B14R1.164 CC(=O)NC1=CC(=CN=C1C(=O)O)Br MCULE-7438519589 [0,1,0,0,0,1|1,0,0]=3 681 B14R1.164 CC(=O)OC1=C(C=CC(=C1)C)C(=O)O MCULE-5405998716 [0,1,0,0,0,1|2,0,0]=4 682 B14R1.164 CC(=O)OC1=CC(=CC=C1C(=O)O)Br MCULE-3667364091 [0,1,0,0,0,1|2,0,0]=4 683 B14R1.164 CC(=O)OC1=CC(=CC=C1C(=O)O)O MCULE-3035314482 [0,1,0,0,0,1|2,0,0]=4 684 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)Br MCULE-7217904832 [0,1,0,0,0,1|1,0,0]=3 685 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)Cl MCULE-3311524524 [0,1,0,0,0,1|1,0,0]=3 686 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)F MCULE-6609053292 [0,1,0,0,0,1|1,0,0]=3 687 B14R1.429 CC(=O)C1=C(C=CC=C1)[C@@H](O)C(=O)O MCULE-3781863945 [0,1,0,0,0,1|2,0,0]=4 688 B14R1.429 CC(=O)C1=CC=CC=C1C(O)C(=O)O MCULE-8902421170 [0,1,0,0,0,1|2,0,0]=4 689 B14R1.429 CC(=O)C1=CC=CC=C1[C@@H](O)C(=O)O MCULE-5154994448 [0,1,0,0,0,1|2,0,0]=4 690 B14R1.429 CC(=O)C1=CC=CC=C1[C@H](O)C(=O)O MCULE-5555802966 [0,1,0,0,0,1|2,0,0]=4 691 B14R1.429 CC(=O)N(C)C1=C(C=CC=C1)C(=O)O MCULE-6239410092 [0,1,0,0,0,1|2,0,0]=4 692 B14R1.429 CC(C(=O)O)C1=C(C=CC=C1)C(=O)O MCULE-4321520344 [0,1,0,0,0,1|1,0,0]=3 693 B14R1.429 O=C(O)C(=O)C1=CC=CC=C1C(=O)O MCULE-9220630853 [0,1,0,0,0,1|1,0,0]=3 694 B14R1.744 COC(=O)C1=C(C=CC=C1)CC(=O)O MCULE-1517713452 [0,1,0,0,0,1|1,0,0]=3 695 B14R1.744 COC(=O)C1=C(C=CC=C1)OC(=O)C MCULE-6223557049 [0,1,0,0,0,1|2,0,0]=4 696 B14R1.744 COC(=O)C1=CC=CC=C1NC(=O)C MCULE-7121970472 [0,1,0,0,0,1|2,0,0]=4 697 B14R1.815 O=C(O)CC1=CC=CC=C1S(=O)(=O)O MCULE-3967037310 [0,1,0,0,0,1|2,0,0]=4 698 B14R1.3302 CCC(=O)NC1=CC=CC=C1C(=O)O MCULE-4894157635 [0,1,0,0,0,1|2,0,0]=4 699 B14R1.3302 CCC(=O)OC1=CC=CC=C1C(=O)O MCULE-1553940048 [0,1,0,0,0,1|2,0,0]=4 700 B14R1.3302 CNC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-8330757012 [0,1,0,0,0,1|2,0,0]=4 701 B14R1.3302 COC(=O)CC1=C(C=CC=C1)C(=O)O MCULE-2120753780 [0,1,0,0,0,1|1,0,0]=3 702 B14R1.3302 COC(=O)CC1=CC=CC=C1C(=O)C MCULE-6036292868 [0,1,0,0,0,1|2,0,0]=4 703 B14R1.3302 COC(=O)CC1=NC=CC=C1N(=O)=O MCULE-2655469915 [0,1,0,0,0,1|1,0,1]=4 704 B14R1.3302 COC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-2977910621 [0,1,0,0,0,1|2,0,0]=4 705 B14R1.3302 COC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-2166405608 [0,1,0,0,0,1|1,0,0]=3 706 B14R1.3302 O=C(CCl)NC1=C(C=CC=C1)C(=O)O MCULE-5294955455 [0,1,0,0,0,1|2,0,0]=4 707 B14R1.4894 CC(=O)NC1=C(C=CC=C1C(=O)O)O MCULE-4610248055 [0,1,0,0,0,1|2,0,0]=4 708 B14R1.4894 CC(=O)NC1=C(C=CC=C1C)C(=O)O MCULE-7646791165 [0,1,0,0,0,1|2,0,0]=4 709 B14R1.4894 CC(=O)NC1=C(C=CC=C1Cl)C(=O)O MCULE-6680514743 [0,1,0,0,0,1|2,0,0]=4 710 B14R1.4894 CC(=O)NC1=C(C=CC=C1F)C(=O)O MCULE-9358823727 [0,1,0,0,0,1|2,0,0]=4 711 B14R1.4894 CC(=O)OC1=C(C=CC=C1C(=O)O)C MCULE-6533937024 [0,1,0,0,0,1|2,0,0]=4 712 B14R1.4894 CC1=C(C(=CC=C1)C(=O)O)CC(=O)O MCULE-2737686503 [0,1,0,0,0,1|1,0,0]=3 713 B14R1.4894 O=C(O)CC1=C(C=CC=C1C(=O)O)Br MCULE-7151539028 [0,1,0,0,0,1|1,0,0]=3 714 B14R1.4894 O=C(O)CC1=C(C=CC=C1C(=O)O)Cl MCULE-1910607878 [0,1,0,0,0,1|1,0,0]=3 715 B14R1.4894 O=C(O)CC1=C(C=CC=C1C(=O)O)F MCULE-9485941922 [0,1,0,0,0,1|1,0,0]=3 716 B14R1.4926 CC(=O)NC1=C(C(=CC=C1)Cl)C(=O)O MCULE-4584748134 [0,1,0,0,0,1|2,0,0]=4 717 B14R1.4926 CC(=O)NC1=C(C(=CC=C1)F)C(=O)O MCULE-2774923956 [0,1,0,0,0,1|2,0,0]=4 718 B14R1.4926 CC(=O)NC1=CC=CC(=C1C(=O)O)C MCULE-8034024058 [0,1,0,0,0,1|2,0,0]=4 719 B14R1.4926 CC(=O)OC1=C(C(=CC=C1)C)C(=O)O MCULE-6695004571 [0,1,0,0,0,1|2,0,0]=4 720 B14R1.4926 NC(=O)NC1=C(C(=CC=C1)F)C(=O)O MCULE-4816613508 [0,1,0,0,0,1|2,0,0]=4 721 B14R1.4926 O=C(O)CC1=C(C(=CC=C1)O)C(=O)O MCULE-8445047699 [0,1,0,0,0,1|1,0,0]=3 722 B14R1.4926 O=C(O)CC1=CC=CC(=C1C(=O)O)F MCULE-2546967096 [0,1,0,0,0,1|1,0,0]=3 723 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)O MCULE-7964554961 [0,1,0,0,0,1|2,0,0]=4 724 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)F)C(=O)O MCULE-2874482161 [0,1,0,0,0,1|2,0,0]=4 725 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)I)C(=O)O MCULE-3438849269 [0,1,0,0,0,1|2,0,0]=4 726 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)Br MCULE-2116317707 [0,1,0,0,0,1|2,0,0]=4 727 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)C MCULE-5382012989 [0,1,0,0,0,1|2,0,0]=4 728 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)O MCULE-5874430744 [0,1,0,0,0,1|2,0,0]=4 729 B14R1.6074 CC(=O)NC1=CC=C(N=C1C(=O)O)Br MCULE-5399143182 [0,1,0,0,0,1|1,0,0]=3 730 B14R1.6074 CC(=O)OC1=C(C=C(C=C1)Br)C(=O)O MCULE-4103590957 [0,1,0,0,0,1|2,0,0]=4 731 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)Cl MCULE-5240299802 [0,1,0,0,0,1|2,0,0]=4 732 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)O MCULE-4585002140 [0,1,0,0,0,1|2,0,0]=4 733 B14R1.6074 CC(=O)SC1=C(C=C(C=C1)Br)C(=O)O MCULE-9173042927 [0,1,0,0,0,1|2,0,0]=4 734 B14R1.6074 CC1=CC=C(C(=C1)C(=O)O)CC(=O)O MCULE-7627589049 [0,1,0,0,0,1|1,0,0]=3 735 B14R1.6074 CC1=CN=C(C(=C1)N(=O)=O)CC(=O)O MCULE-7575495291 [0,1,0,0,0,1|1,0,1]=4 736 B14R1.6074 NC(=O)NC1=C(C=C(C=C1)Br)C(=O)O MCULE-1250978576 [0,1,0,0,0,1|2,0,0]=4 737 B14R1.6074 NC1=CC=C(C(=C1)C(=O)O)CC(=O)O MCULE-8784666821 [0,1,0,0,0,1|1,0,0]=3 738 B14R1.6074 O=C(O)CC1=C(C=C(C=C1)Br)C(=O)O MCULE-4986008206 [0,1,0,0,0,1|1,0,0]=3 739 B14R1.6074 O=C(O)CC1=CC=C(C=C1C(=O)O)F MCULE-2248916450 [0,1,0,0,0,1|1,0,0]=3 740 B14R1.6312 CS(=O)(=O)CC1=NC=CC=C1C(=O)O MCULE-5869417191 [0,1,0,0,0,1|1,0,1]=4 741 B14R1.6312 O=C(O)C1=C(C=CC=C1)OP(=O)(O)O MCULE-1086101121 [0,1,0,0,0,1|2,0,0]=4 742 B14R1.6312 O=C(O)C1=CC=CC=C1OS(=O)(=O)O MCULE-3023695647 [0,1,0,0,0,1|2,0,0]=4 743 B14R1.104 C#CC1=CC=C(C(=C1)C(=O)O)C(=O)O MCULE-6034336644 [0,2,0,0,0,0|1,0,0]=3 744 B14R1.104 CCC1=CN=C(C(=C1)C(=O)O)C(=O)O MCULE-7437903521 [0,2,0,0,0,0|0,0,0]=2 745 B14R1.104 COC1=CC(=C(C=C1)C(=O)O)C(=O)O MCULE-1044438929 [0,2,0,0,0,0|1,0,0]=3 746 B14R1.104 COC1=CC=C(C(=N1)C(=O)O)N(=O)=O MCULE-6792144435 [0,2,0,0,0,0|1,0,1]=4 747 B14R1.104 CSC1=NC=C(C(=N1)C(=O)O)C(=O)O MCULE-1130769354 [0,2,0,0,0,0|1,0,0]=3 748 B14R1.707 COC(=O)C1=C(C=CC(=C1)Cl)C(=O)C MCULE-1811202290 [0,2,0,0,0,0|2,0,0]=4 749 B14R1.707 COC(=O)C1=C(C=CC(=C1)F)C(=O)O MCULE-9514888465 [0,2,0,0,0,0|1,0,0]=3 750 B14R1.707 COC(=O)C1=CC(=CC=C1C(=O)N)F MCULE-7892236166 [0,2,0,0,0,0|2,0,0]=4 751 B14R1.707 COC(=O)C1=CC(=CC=C1C(=O)O)N MCULE-7013917945 [0,2,0,0,0,0|1,0,0]=3 752 B14R1.707 COC(=O)C1=NC(=CC=C1N(=O)=O)Cl MCULE-5859901100 [0,2,0,0,0,0|1,0,1]=4 753 B14R1.1126 COC(=O)C1=C(C=C(C=C1)F)C(=O)O MCULE-4695400256 [0,2,0,0,0,0|1,0,0]=3 754 B14R1.1126 COC(=O)C1=CC=C(C=C1C(=O)C)Br MCULE-5848090000 [0,2,0,0,0,0|2,0,0]=4 755 B14R1.1126 COC(=O)C1=NC=C(C=C1N(=O)=O)Br MCULE-4983420928 [0,2,0,0,0,0|1,0,1]=4 756 B14R1.1126 COC(=O)C1=NC=C(C=C1N(=O)=O)Cl MCULE-7943746916 [0,2,0,0,0,0|1,0,1]=4 757 B14R1.3146 CC1=CC(=C(C(=N1)N)C(=O)O)C(=O)O MCULE-9103928584 [0,2,0,0,0,0|2,0,0]=4 758 B14R1.3146 CC1=CC(=C(C(=N1)O)C(=O)O)C(=O)O MCULE-7542886807 [0,2,0,0,0,0|2,0,0]=4 759 B14R1.3146 CC1=NC(=C(C(=C1)C(=O)O)C(=O)O)C MCULE-4955919229 [0,2,0,0,0,0|2,0,0]=4 760 B14R1.3146 O=C(O)C1=C(C(=NC(=C1)Cl)Cl)C(=O)O MCULE-9853778058 [0,2,0,0,0,0|2,0,0]=4 761 B14R1.3146 O=C(O)C1=CC(=CC(=C1C(=O)O)Cl)Cl MCULE-4384344278 [0,2,0,0,0,0|1,0,0]=3 762 B14R1.3146 O=C(O)C1=CC(=CC(=C1C(=O)O)F)Br MCULE-4750437357 [0,2,0,0,0,0|1,0,0]=3 763 B14R1.6027 CC1=C(CC(=C(C1)C(=O)O)C(=O)O)C MCULE-2831224780 [0,2,0,0,0,0|1,0,1]=4 764 B14R1.6027 CC1=C(N=C(C(=N1)C(=O)O)C(=O)O)C MCULE-7283264432 [0,2,0,0,0,0|1,0,0]=3 765 B14R1.6027 CC1=CC(=C(C=C1C)C(=O)O)C(=O)O MCULE-6490961170 [0,2,0,0,0,0|1,0,0]=3 766 B14R1.6027 NC(=O)C1=C(C=C(C(=C1)F)F)C(=O)O MCULE-6456075908 [0,2,0,0,0,0|2,0,0]=4 767 B14R1.6027 NC(=O)C1=CC(=C(C=C1C(=O)O)Br)Br MCULE-1365276768 [0,2,0,0,0,0|2,0,0]=4 768 B14R1.6027 NC(=O)C1=CC(=C(C=C1C(=O)O)Cl)Cl MCULE-6619357384 [0,2,0,0,0,0|2,0,0]=4 769 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)Br)Br)C(=O)O MCULE-6277688743 [0,2,0,0,0,0|1,0,0]=3 770 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)F)F)C(=O)O MCULE-3727504979 [0,2,0,0,0,0|1,0,0]=3 771 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)Br)Cl MCULE-5140081638 [0,2,0,0,0,0|1,0,0]=3 772 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)Cl)Cl MCULE-5676741485 [0,2,0,0,0,0|1,0,0]=3 773 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)I)I MCULE-5236084359 [0,2,0,0,0,0|1,0,0]=3 774 B14R1.6027 O=C(O)C1=NC(=C(N=C1C(=O)O)Cl)Cl MCULE-5287171615 [0,2,0,0,0,0|1,0,0]=3 775 B14R1.6044 NC1=CC=C(C(=C1)S(=O)(=O)O)C(=O)O MCULE-8463727628 [0,2,0,0,0,0|2,0,0]=4 776 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)Br)F MCULE-3234449004 [0,2,0,0,0,0|1,0,0]=3 777 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)Cl)Cl MCULE-3153924625 [0,2,0,0,0,0|1,0,0]=3 778 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)F)Br MCULE-4943817004 [0,2,0,0,0,0|1,0,0]=3 779 B14R1.878 COC1=C(C(=CC=C1)C(=O)O)C(=O)O MCULE-9419567098 [0,2,0,0,0,0|1,0,0]=3 780 B14R1.1153 COC(=O)C1=C(C(=CC=C1)Br)C(=O)O MCULE-5025284814 [0,2,0,0,0,0|1,0,0]=3 781 B14R1.1153 COC(=O)C1=C(C(=CC=C1)Cl)C(=O)O MCULE-7057490898 [0,2,0,0,0,0|1,0,0]=3 782 B14R1.1153 COC(=O)C1=C(C(=CC=C1)N)C(=O)O MCULE-3583632522 [0,2,0,0,0,0|1,0,0]=3 783 B14R1.1153 COC(=O)C1=C(C(=CC=C1)N)C(=O)O MCULE-9681757906 [0,2,0,0,0,0|1,0,0]=3 784 B14R1.1164 COC(=O)C1=C(C=CC=C1C(=O)O)Br MCULE-8066597067 [0,2,0,0,0,0|1,0,0]=3 785 B14R1.1164 COC(=O)C1=C(C=CC=C1C(=O)O)Cl MCULE-9828733314 [0,2,0,0,0,0|1,0,0]=3 786 B14R1.1164 COC(=O)C1=C(C=CC=C1C(=O)O)I MCULE-4414187027 [0,2,0,0,0,0|1,0,0]=3 787 B14R1.1164 COC(=O)C1=C(C=CC=C1N)C(=O)O MCULE-2229864990 [0,2,0,0,0,0|1,0,0]=3 788 B14R1.1164 COC(=O)C1=C(C=CC=C1N)C(=O)O MCULE-2470029965 [0,2,0,0,0,0|1,0,0]=3 789 B14R1.1164 COC(=O)C1=C(C=NC=C1C(=O)O)O MCULE-6950736657 [0,2,0,0,0,0|2,0,0]=4 790 B14R1.6046 CC(=O)C1=C(C=CC(=C1C(=O)O)F)F MCULE-5048041249 [0,2,0,0,0,0|2,0,0]=4 791 B14R1.6046 O=C(O)C1=C(C(=CC=C1O)O)C(=O)O MCULE-9084723627 [0,2,0,0,0,0|1,0,0]=3 792 B14R1.6046 O=C(O)C1=C(C=CC(=C1C(=O)O)Br)F MCULE-9156345120 [0,2,0,0,0,0|1,0,0]=3 793 B14R1.6046 O=C(O)C1=C(C=CC(=C1C(=O)O)Cl)Cl MCULE-5648044594 [0,2,0,0,0,0|1,0,0]=3 794 B14R1.6046 O=C(O)C1=C(C=CC(=C1C(=O)O)F)F MCULE-8459020234 [0,2,0,0,0,0|1,0,0]=3 795 B14R1.745 COC(=O)C1=C(C=CC=N1)S(=O)(=O)Cl MCULE-9154267074 [0,2,0,0,0,0|1,0,1]=4 796 B14R1.745 COC(=O)C1=C(N=CC=C1)S(=O)(=O)Cl MCULE-3946115350 [0,2,0,0,0,0|1,0,1]=4 797 B14R1.745 COC(=O)C1=C(N=CC=C1)S(=O)(=O)N MCULE-3998133680 [0,2,0,0,0,0|1,0,1]=4 798 B14R1.745 COC(=O)C1=CC=CC=C1S(=O)(=O)O MCULE-2483846056 [0,2,0,0,0,0|2,0,0]=4 799 B14R1.745 COC(=O)C1=CC=CN=C1S(=O)(=O)C MCULE-4391040096 [0,2,0,0,0,0|1,0,1]=4 800 B14R1.623 CCOC(=O)C1=C(C=CC=C1)C(=O)C MCULE-7822545927 [0,2,0,0,0,0|2,0,0]=4 801 B14R1.623 CCOC(=O)C1=C(N=CC=C1)C(=O)C MCULE-3374145269 [0,2,0,0,0,0|1,0,0]=3 802 B14R1.623 CCOC(=O)C1=CC=CN=C1C(=O)O MCULE-1420682383 [0,2,0,0,0,0|0,0,0]=2 803 B14R1.623 CCOC(=O)C1=NC=CC=C1N(=O)=O MCULE-4168645187 [0,2,0,0,0,0|1,0,1]=4 804 B14R1.623 CN(CCO)C1=C(C=CC=N1)C(=O)O MCULE-4816951331 [0,2,0,0,0,0|2,0,0]=4 805 B14R1.623 O=C(O)C1=CC=CC=C1S(=O)CCO MCULE-2177222526 [0,2,0,0,0,0|2,0,0]=4 806 B14R1.623 O=CNC(=O)C1=CC=CC=C1C(=O)O MCULE-8045595064 [0,2,0,0,0,0|1,0,1]=4 807 B14R1.746 CCC(=O)C1=CC=CC=C1C(=O)OC MCULE-7498309002 [0,2,0,0,0,0|2,0,0]=4 808 B14R1.746 COC(=N)C1=CC=CC=C1C(=O)OC MCULE-3771652840 [0,2,0,0,0,0|2,0,0]=4 809 B14R1.746 COC(=N)C1=CC=CC=C1C(=O)OC MCULE-3987350033 [0,2,0,0,0,0|2,0,0]=4 810 B14R1.746 COC(=O)C1=C(C=CC=C1)C(=O)OC MCULE-5213082728 [0,2,0,0,0,0|1,0,0]=3 811 B14R1.746 COC(=O)C1=C(C=NC=C1)C(=O)OC MCULE-4706513864 [0,2,0,0,0,0|2,0,0]=4 812 B14R1.746 COC(=O)C1=C(C=NC=C1)C(=O)OC MCULE-7984782894 [0,2,0,0,0,0|2,0,0]=4 813 B14R1.746 COC(=O)C1=C(CC=CC1)C(=O)OC MCULE-9708384047 [0,2,0,0,0,0|1,0,1]=4 814 B14R1.746 COC(=O)C1=C(N=CC=C1)C(=O)OC MCULE-1032296924 [0,2,0,0,0,0|0,0,0]=2 815 B14R1.746 COC(=O)C1=C(N=CC=N1)C(=O)OC MCULE-9162181231 [0,2,0,0,0,0|1,0,0]=3 816 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O MCULE-5006038728 [0,0,1,1,0,0|2,0,0]=4 817 B12R1.226 O=C(O)C=CC1=CC(=CC=C1)O MCULE-2569094851 [0,0,1,1,0,0|2,0,0]=4 818 B12R1.226 O=C(O)C=CC1=CC(=CN=C1)F MCULE-9122757719 [0,0,1,1,0,0|2,0,0]=4 819 B12R1.124 O=C(O)C(=O)C1=CC=CN=C1O MCULE-5922854073 [0,0,1,1,0,0|2,0,0]=4 820 B12R2.1081 O=C1COCC2=C1C=CC=N2 MCULE-7174870381 [1,0,0,1,0,0|1,0,1]=4 821 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 MCULE-9454462051 [1,0,0,1,0,0|2,0,0]=4 822 B12R2.1081 O=C1NN=CC2=C1C=CC=N2 MCULE-5842889347 [1,0,0,1,0,0|2,0,0]=4 823 B12R2.1081 O=C1NN=CC2=C1N=CC=C2 MCULE-6004392790 [1,0,0,1,0,0|2,0,0]=4 824 B12R2.1081 O=C1OC=CC2=C1C=CC=C2 MCULE-7136669271 [1,0,0,1,0,0|2,0,0]=4 825 B12R2.1081 OC1=C2C=CC=NC2=CC=C1 MCULE-4644183125 [1,0,0,1,0,0|2,0,0]=4 826 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 MCULE-7753869266 [1,0,0,1,0,0|2,0,0]=4 827 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 MCULE-8402192130 [1,0,0,1,0,0|2,0,0]=4 828 B12R2.1081 OC1=C2N=CC=CC2=CC=N1 MCULE-3274345525 [1,0,0,1,0,0|2,0,0]=4 829 B12R2.1081 OC1=C2N=CC=CC2=CN=C1 MCULE-5326984164 [1,0,0,1,0,0|2,0,0]=4 830 B12R2.1081 OC1=CC=CC2=CC=CN=C12 MCULE-3480638283 [1,0,0,1,0,0|2,0,0]=4 831 B12R2.2028 C=C1OC(=O)C2=C1C=CC=C2 MCULE-8960578123 [1,0,0,1,0,0|2,0,0]=4 832 B12R2.2028 CC1OC(=O)C2=C1N=CC=C2 MCULE-4287188065 [1,0,0,1,0,0|1,0,1]=4 833 B12R2.2028 O=C1CC(=O)C2=CC=CC=C12 MCULE-5655100749 [1,0,0,1,0,0|2,0,0]=4 834 B12R2.2028 O=C1NC(=O)C2=C1C=CC=C2 MCULE-2271536382 [1,0,0,1,0,0|2,0,0]=4 835 B12R2.2028 O=C1NC(=O)C2=C1C=CC=N2 MCULE-2343377944 [1,0,0,1,0,0|1,0,0]=3 836 B12R2.2028 O=C1NC(=O)C2=C1N=CC=N2 MCULE-8402270821 [1,0,0,1,0,0|2,0,0]=4 837 B12R2.2028 O=C1NC(C2=NC=CC=C12)O MCULE-5931915599 [1,0,0,1,0,0|1,0,1]=4 838 B12R2.2028 O=C1OC(=O)C2=C1C=CC=N2 MCULE-6497550013 [1,0,0,1,0,0|0,0,0]=2 839 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 MCULE-5260748273 [1,0,0,1,0,0|1,0,0]=3 840 B12R2.2028 O=C1OC(=O)C2=CN=CC=C12 MCULE-3862451247 [1,0,0,1,0,0|2,0,0]=4 841 B12R2.2028 O=C1OC(=O)C2=NC=CN=C12 MCULE-4569392072 [1,0,0,1,0,0|1,0,0]=3 842 B12R2.2028 O=C1OC(C2=C1C=CC=C2)O MCULE-2316305945 [1,0,0,1,0,0|1,0,1]=4 843 B12R2.2028 O=C1O[IH2](C2=CC=CC=C12)O MCULE-5405765075 [1,0,0,1,0,0|2,0,0]=4 844 B12R2.2028 O=C1SC(=O)C2=CC=CC=C12 MCULE-9972581691 [1,0,0,1,0,0|1,1,0]=4 845 B12R2.2028 O=C1[N-]C(=O)C2=C1C=CC=C2 MCULE-5631553583 [1,0,0,1,0,0|2,0,0]=4 846 B14R2.287 O=C1CCC(=O)C2=C(N1)C=CC=N2 MCULE-8997266522 [0,0,0,1,0,1|2,0,0]=4 847 B14R2.712 CC(=O)C1=C2NC(=O)OC2=CC=C1 MCULE-5569761263 [0,0,0,1,0,1|2,0,0]=4 848 B14R2.712 CC1=CC2=C(O1)C=CC=C2C(=O)O MCULE-6705402591 [0,0,0,1,0,1|2,0,0]=4 849 B14R2.712 CC1=NC2=C(O1)C=CC=C2C(=O)O MCULE-2448984783 [0,0,0,1,0,1|2,0,0]=4 850 B14R2.712 NC1=NC2=C(C=CC=C2O1)C(=O)O MCULE-1436545805 [0,0,0,1,0,1|2,0,0]=4 851 B14R2.712 O=C(O)C1=C2C=C(NC2=CC=N1)I MCULE-3976288696 [0,0,0,1,0,1|2,0,0]=4 852 B14R2.712 O=C1C=C2C=CC=C(C2=N1)C(=O)O MCULE-8393292159 [0,0,0,1,0,1|2,0,0]=4 853 B14R2.712 O=C1CC2=C(C=CC=C2O1)C(=O)O MCULE-9681418756 [0,0,0,1,0,1|1,0,0]=3 854 B14R2.712 O=C1CC2=C(N1)C(=CC=C2)C(=O)O MCULE-2056077379 [0,0,0,1,0,1|2,0,0]=4 855 B14R2.712 O=C1CC2=C(N1)C(=NC=C2)C(=O)O MCULE-6022098217 [0,0,0,1,0,1|1,0,0]=3 856 B14R2.712 O=C1CC2=C(N1)C=CC=C2C(=O)O MCULE-8443978622 [0,0,0,1,0,1|2,0,0]=4 857 B14R2.712 O=C1CC2=C(N=CN=C2N1)C(=O)O MCULE-9627202156 [0,0,0,1,0,1|2,0,0]=4 858 B14R2.712 O=C1NC2=C(C=CC=C2O1)C(=O)O MCULE-7054850283 [0,0,0,1,0,1|1,0,0]=3 859 B14R2.712 O=C1NC2=CC=CC(=C2N1)C(=O)O MCULE-2460476872 [0,0,0,1,0,1|2,0,0]=4 860 B14R2.25733 CC(=O)N1CC(=O)C2=CC=CN=C12 MCULE-4349063397 [0,0,0,1,0,1|2,0,0]=4 861 B14R2.25733 O=C1CC(C2=C1C=CC=C2)C(=O)O MCULE-1060322815 [0,0,0,1,0,1|2,0,0]=4 862 B14R2.25733 O=C1NC(C2=CC=CC=C12)C(=O)O MCULE-4829942440 [0,0,0,1,0,1|2,0,0]=4 863 B14R2.25733 O=C1OC(C2=CC=CC=C12)C(=O)O MCULE-1282001061 [0,0,0,1,0,1|1,0,0]=3 864 B14R2.24350 NC1=NOC2=C1C(=CC=C2)C(=O)O MCULE-1758871037 [0,1,0,1,0,0|2,0,0]=4 865 B14R2.24350 O=C(O)C1=C2C(=CNC2=CC=N1)F MCULE-8368408968 [0,1,0,1,0,0|2,0,0]=4 866 B14R2.24350 O=C(O)C1=C2C(=O)CCC2=CC=C1 MCULE-6190511905 [0,1,0,1,0,0|2,0,0]=4 867 B14R2.24350 O=C(O)C1=C2C(=O)NCC2=CC=C1 MCULE-2266705533 [0,1,0,1,0,0|2,0,0]=4 868 B14R2.24350 O=C(O)C1=CC=CC2=C1C(=O)N=C2 MCULE-2060780672 [0,1,0,1,0,0|2,0,0]=4 869 B14R2.24350 O=C(O)C1=CC=CC2=C1C(=O)N=N2 MCULE-5844148733 [0,1,0,1,0,0|2,0,0]=4 870 B14R2.24350 O=C(O)C1=CC=CC2=C1C(=O)NN2 MCULE-7552247363 [0,1,0,1,0,0|2,0,0]=4 871 B14R2.24350 O=C(O)C1=CC=CC2=C1C(=O)ON2 MCULE-4749311252 [0,1,0,1,0,0|1,0,0]=3 872 B14R2.24350 O=C(O)C1=NC=CC2=C1C(=CN2)Br MCULE-3149523028 [0,1,0,1,0,0|2,0,0]=4 873 B14R2.24350 O=C(O)C1=NC=CC2=C1C(=CN2)I MCULE-7567819851 [0,1,0,1,0,0|2,0,0]=4 874 B14R2.30639 O=C(O)C1=C(C2C=CC1C2)C(=O)O MCULE-7592737892 [0,1,0,1,0,0|1,0,1]=4 875 B14R2.30639 O=C(O)C1=C([C@H]2C=C[C@@H]1C2)C(=O)O MCULE-2960162567 [0,1,0,1,0,0|1,0,1]=4 876 B14R2.1131 COC1=C2C=CC=NC2=C(C=C1)O MCULE-7592464484 [0,1,0,1,0,0|2,0,0]=4 877 B14R2.1131 O=CC1=C2C=CC=NC2=C(C=C1)O MCULE-4177872546 [0,1,0,1,0,0|2,0,0]=4 878 B14R2.1131 O=NC1=C2C=CC=NC2=C(C=C1)O MCULE-1827788305 [0,1,0,1,0,0|2,0,0]=4 879 B14R2.1131 O=NC1=C2C=CC=NC2=C(C=C1)O MCULE-4348597510 [0,1,0,1,0,0|2,0,0]=4 880 B14R2.1131 OCC1=C2C=CC=NC2=C(C=C1)O MCULE-5608115375 [0,1,0,1,0,0|2,0,0]=4 881 B14R2.4510 O=C1CCCC(=O)C2=NC=CC=C12 MCULE-7010401754 [0,1,0,1,0,0|2,0,0]=4 882 B14R2.7724 CN1C(=O)OC(=O)C2=CC=CN=C12 MCULE-6658450264 [0,1,0,1,0,0|2,0,0]=4 883 B14R2.7724 CN1NC(=O)C2=C(C1=O)C=CC=N2 MCULE-4996386480 [0,1,0,1,0,0|2,0,0]=4 884 B14R2.7724 O=C1C=C(C(=O)C2=C1C=CC=C2)O MCULE-8698811000 [0,1,0,1,0,0|2,0,0]=4 885 B10R0.17 O=C(O)C(=CC=CBr)C(=O)O MCULE-7337085269 [0,0,1,0,1,0|1,0,0]=3 886 B10R1.39 C=CN1C=CC=C1C(=O)O MCULE-8632612652 [1,0,0,0,1,0|2,0,0]=4 887 B10R1.39 C=CN1N=CC=C1C(=O)O MCULE-5917448333 [1,0,0,0,1,0|2,0,0]=4 888 B10R1.39 O=C(O)C1=C(N=CN1)CO MCULE-4632207762 [1,0,0,0,1,0|1,0,1]=4 889 B10R1.39 O=CC1=C(C=CO1)C(=O)O MCULE-6471557174 [1,0,0,0,1,0|1,0,0]=3 890 B10R1.39 O=CC1=C(C=CS1)C(=O)O MCULE-8929121379 [1,0,0,0,1,0|1,0,0]=3 891 B10R1.39 O=CC1=C(NC=N1)C(=O)O MCULE-2846806296 [1,0,0,0,1,0|1,0,0]=3 892 B10R1.39 O=CC1=C(OC=C1)C(=O)O MCULE-7997599750 [1,0,0,0,1,0|1,0,0]=3 893 B10R1.39 O=CC1=C(SC=C1)C(=O)O MCULE-6585330865 [1,0,0,0,1,0|1,0,0]=3 894 B10R1.39 O=CC1=CNN=C1C(=O)O MCULE-9816954326 [1,0,0,0,1,0|1,0,0]=3 895 B10R1.39 O=CC1=CSC=C1C(=O)O MCULE-6099035678 [1,0,0,0,1,0|1,0,0]=3 896 B12R1.75 CC(=O)NC1=C(C=CC=C1)C=O MCULE-1063993291 [1,0,0,0,0,1|2,0,0]=4 897 B12R1.75 CC(=O)NC1=NC=CC=C1C=O MCULE-6023101811 [1,0,0,0,0,1|1,0,0]=3 898 B12R1.75 CC(=O)OC1=C(C=CC=C1)C=O MCULE-3586473282 [1,0,0,0,0,1|2,0,0]=4 899 B12R1.75 COC1=C(N=CC=C1)CC(=O)O MCULE-1621150813 [1,0,0,0,0,1|2,0,0]=4 900 B12R1.75 COC1=C(N=CC=C1)CC(=O)O MCULE-5451017286 [1,0,0,0,0,1|2,0,0]=4 901 B12R1.75 COC1=NC=CC=C1CC(=O)O MCULE-2547338077 [1,0,0,0,0,1|2,0,0]=4 902 B12R1.75 O=C(O)CC1=CC=CC=C1CO MCULE-2342564386 [1,0,0,0,0,1|1,0,1]=4 903 B12R1.75 O=CC1=CC=CC=C1CC(=O)O MCULE-8210254084 [1,0,0,0,0,1|1,0,0]=3 904 B12R1.258 CC(=O)C1=CC(=CN=C1)C(=O)O MCULE-5398573933 [0,0,0,0,1,1|2,0,0]=4 905 B12R1.258 CC(=O)C1=CC(=NC=C1)C(=O)O MCULE-5140186933 [0,0,0,0,1,1|1,0,0]=3 906 B12R1.258 CC(=O)C1=CC=CC(=C1)C(=O)C MCULE-3792336330 [0,0,0,0,1,1|2,0,0]=4 907 B12R1.258 CC(=O)C1=CC=CC(=C1)C(=O)Cl MCULE-7698235080 [0,0,0,0,1,1|2,0,0]=4 908 B12R1.258 CC(=O)C1=CC=CC(=C1)C(=O)O MCULE-7817168085 [0,0,0,0,1,1|1,0,0]=3 909 B12R1.258 CC(=O)C1=CC=CC(=N1)C(=O)C MCULE-9121297035 [0,0,0,0,1,1|2,0,0]=4 910 B12R1.258 CC(=O)C1=CC=CC(=N1)C(=O)O MCULE-2956010852 [0,0,0,0,1,1|1,0,0]=3 911 B12R1.258 CC(O)C1=CC(=CC=C1)C(=O)O MCULE-5550293922 [0,0,0,0,1,1|1,0,1]=4 912 B12R1.258 CS(=O)C1=CC(=CC=C1)C(=O)O MCULE-6126341449 [0,0,0,0,1,1|2,0,0]=4 913 B12R1.258 N=C(N)C1=CC=CC(=C1)C(=O)O MCULE-1865331482 [0,0,0,0,1,1|2,0,0]=4 914 B12R1.258 N=C(N)C1=CC=CC(=C1)C(=O)O MCULE-6303024252 [0,0,0,0,1,1|2,0,0]=4 915 B12R1.258 NC(=O)C1=CC(=CC=C1)C(=O)O MCULE-4538252947 [0,0,0,0,1,1|1,0,0]=3 916 B12R1.258 NC(=O)C1=CC(=CN=C1)C(=O)O MCULE-1426913150 [0,0,0,0,1,1|2,0,0]=4 917 B12R1.258 NC(=O)C1=CC(=NC=C1)C(=O)O MCULE-8548833994 [0,0,0,0,1,1|1,0,0]=3 918 B12R1.258 NC(=O)C1=CC=CC(=C1)C(=O)N MCULE-8341095175 [0,0,0,0,1,1|2,0,0]=4 919 B12R1.258 NC(=O)C1=CC=CC(=N1)C(=O)N MCULE-9177417596 [0,0,0,0,1,1|2,0,0]=4 920 B12R1.258 NC(=O)C1=NC(=CC=C1)C(=O)O MCULE-9089970259 [0,0,0,0,1,1|1,0,0]=3 921 B12R1.258 NC(=O)C1=NC=CC(=C1)C(=O)O MCULE-9674234146 [0,0,0,0,1,1|1,0,0]=3 922 B12R1.258 NC(=S)C1=CC(=CC=C1)C(=O)O MCULE-2973781485 [0,0,0,0,1,1|1,1,0]=4 923 B12R1.258 O=C(Cl)C1=CC=CC(=C1)C(=O)Cl MCULE-7397251430 [0,0,0,0,1,1|2,0,0]=4 924 B12R1.258 O=C(Cl)C1=CC=CC(=N1)C(=O)Cl MCULE-3091772531 [0,0,0,0,1,1|2,0,0]=4 925 B12R1.258 O=C(O)C1=CC(=CC=C1)N(=O)=O MCULE-6150173112 [0,0,0,0,1,1|1,0,1]=4 926 B12R1.258 O=C(O)C1=CC(=CC=C1)S(=O)O MCULE-2985390716 [0,0,0,0,1,1|1,0,0]=3 927 B12R1.258 O=C(O)C1=CC(=NC=C1)N(=O)=O MCULE-5235542957 [0,0,0,0,1,1|1,0,1]=4 928 B12R1.258 O=C(O)C1=CC(=NC=N1)C(=O)O MCULE-5704979292 [0,0,0,0,1,1|1,0,0]=3 929 B12R1.258 O=C(O)C1=CC=CC(=C1)B(O)O MCULE-9530773126 [0,0,0,0,1,1|1,0,1]=4 930 B12R1.258 O=C(O)C1=CC=CC(=C1)C(=O)O MCULE-2481502954 [0,0,0,0,1,1|0,0,0]=2 931 B12R1.258 O=C(O)C1=CC=CC(=N1)C(=O)O MCULE-1484050836 [0,0,0,0,1,1|0,0,0]=2 932 B12R1.258 O=C(O)C1=CC=CC(=N1)C(=O)O MCULE-5637859455 [0,0,0,0,1,1|0,0,0]=2 933 B12R1.258 O=C(O)C1=CC=NC(=C1)C(=O)O MCULE-5012604214 [0,0,0,0,1,1|0,0,0]=2 934 B12R1.258 O=C(O)C1=CN=CC(=C1)C(=O)O MCULE-9805461276 [0,0,0,0,1,1|1,0,0]=3 935 B12R1.258 O=C(O)C1=CN=CC(=N1)C(=O)O MCULE-9429157843 [0,0,0,0,1,1|1,0,0]=3 936 B12R1.258 O=C(O)C1=NC(=CC=C1)N(=O)=O MCULE-9164924501 [0,0,0,0,1,1|1,0,1]=4 937 B12R1.258 O=C(O)C1=NC(=NC=C1)C(=O)O MCULE-4429935381 [0,0,0,0,1,1|0,0,0]=2 938 B12R1.258 O=C(O)C1=NC=CC(=C1)B(O)O MCULE-7691553044 [0,0,0,0,1,1|1,0,1]=4 939 B12R1.258 O=C(O)C1=NC=CC(=C1)N(=O)=O MCULE-7964850196 [0,0,0,0,1,1|1,0,1]=4 940 B14R1.814 CC(=O)NC1=C(C=CC=C1)CC(=O)O MCULE-7209446397 [0,0,0,0,0,2|2,0,0]=4 941 B14R1.814 CC(=O)NC1=CC=CN=C1NC(=O)C MCULE-1669326131 [0,0,0,0,0,2|2,0,0]=4 942 B14R1.814 CC(=O)NC1=NC=CC=C1OC(=O)C MCULE-3271450366 [0,0,0,0,0,2|2,0,0]=4 943 B14R1.814 O=C(O)CC1=C(C=CC=C1)CC(=O)O MCULE-1066180741 [0,0,0,0,0,2|1,0,0]=3 944 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(=O)O MCULE-3363266465 [0,0,0,0,0,2|2,0,0]=4 945 B14R1.4522 CC(=O)CSC1=C(N=CC=C1)C(=O)O MCULE-6504247839 [0,0,0,0,0,2|1,0,0]=3 946 B14R1.4522 CC(=O)CSC1=CC=CC=C1C(=O)O MCULE-6104140904 [0,0,0,0,0,2|2,0,0]=4 947 B14R1.4522 CC(=O)CSC1=NC=CC=C1C(=O)O MCULE-4657182160 [0,0,0,0,0,2|1,0,0]=3 948 B14R1.4522 NC(=O)C1=C(C=CC=C1)CCC(=O)O MCULE-2466282902 [0,0,0,0,0,2|2,0,0]=4 949 B14R1.4522 NC(=O)C1=C(C=CC=C1)NCC(=O)O MCULE-7889488839 [0,0,0,0,0,2|2,0,0]=4 950 B14R1.4522 NC(=O)C1=CC=CC=C1OCC(=O)O MCULE-5913894164 [0,0,0,0,0,2|2,0,0]=4 951 B14R1.4522 NC(=O)CNC1=CC=CC=C1C(=O)O MCULE-1789700031 [0,0,0,0,0,2|2,0,0]=4 952 B14R1.4522 NC(=O)COC1=C(C=CC=C1)C(=O)O MCULE-2788333356 [0,0,0,0,0,2|2,0,0]=4 953 B14R1.4522 NC(=O)CSC1=C(C=CC=N1)C(=O)O MCULE-3860720061 [0,0,0,0,0,2|1,0,0]=3 954 B14R1.4522 NC(=O)CSC1=CC=CC=C1C(=O)O MCULE-9086395929 [0,0,0,0,0,2|2,0,0]=4 955 B14R1.4522 O=C(O)/C=C/C1=C(C=CC=C1)C(=O)O MCULE-7597048629 [0,0,0,0,0,2|1,0,0]=3 956 B14R1.4522 O=C(O)C=CC1=C(C=CC=C1)C(=O)O MCULE-2584094431 [0,0,0,0,0,2|1,0,0]=3 957 B14R1.4522 O=C(O)CCC1=C(C=CC=C1)C(=O)O MCULE-9938671725 [0,0,0,0,0,2|1,0,0]=3 958 B14R1.4522 O=C(O)CNC1=C(C=CC=N1)C(=O)O MCULE-5242443715 [0,0,0,0,0,2|0,0,0]=2 959 B14R1.4522 O=C(O)CNC1=C(C=CC=N1)N(=O)=O MCULE-2633230858 [0,0,0,0,0,2|1,0,1]=4 960 B14R1.4522 O=C(O)CNC1=CC=CC=C1C(=O)O MCULE-7070341796 [0,0,0,0,0,2|1,0,0]=3 961 B14R1.4522 O=C(O)COC1=C(C=CC=C1)C(=O)O MCULE-9315481619 [0,0,0,0,0,2|1,0,0]=3 962 B14R1.4522 O=C(O)COC1=CC=CN=C1N(=O)=O MCULE-6102238058 [0,0,0,0,0,2|1,0,1]=4 963 B14R1.4522 O=C(O)CSC1=C(C=CC=C1)C(=O)O MCULE-5082048769 [0,0,0,0,0,2|1,0,0]=3 964 B14R1.4522 O=C(O)CSC1=C(C=CC=N1)C(=O)O MCULE-2158207814 [0,0,0,0,0,2|0,0,0]=2 965 B14R1.4522 O=C(O)CSC1=NC=CC=C1N(=O)=O MCULE-7609697207 [0,0,0,0,0,2|1,0,1]=4 966 B14R1.4522 O=C([O-])CNC1=CC=CC=C1C(=O)O MCULE-5192747004 [0,0,0,0,0,2|1,0,1]=4