0 B12R1.258 CC(=O)C1=CC(=CC=C1)B(O)O Z1162448672 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.258 CC(=O)C1=CC(=CC=C1)C(=O)O Z1203161684 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.258 CC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z57127467 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.258 CC(=O)C1=CC(=CN=C1)C(=O)O Z1255382323 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.258 CC(C)C1=CC(=CC=C1)C(=O)O Z1171158000 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.258 CC(C)C1=NC(=CC=C1)C(=O)O Z1255449261 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.258 CN(C)C1=CC(=CC=C1)C(=O)O Z104476962 [0,0,0,0,0,0|4,0,0]=4 7 B12R1.258 CS(=O)C1=CC(=CC=C1)C(=O)O Z1198340914 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.258 N=C(N)C1=CC=CC(=N1)C(=N)N Z5012228048 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.258 N=C(N)C1=NC=CC(=C1)C(=O)O Z1737940646 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.258 NC(=O)C1=CC(=CC=C1)B(O)O Z1255365365 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.258 NC(=O)C1=CC(=CC=C1)C(=O)O Z295886826 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.258 NC(=O)C1=CC(=CC=C1)C(=S)N Z295387652 [0,0,0,0,0,0|3,1,0]=4 13 B12R1.258 NC(=O)C1=CC(=CN=C1)C(=O)O Z451348038 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.258 NC(=O)C1=CC=CC(=C1)C(=O)N Z275156916 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.258 NC(=O)C1=NC(=CC=C1)C(=O)O Z431949148 [0,0,0,0,0,0|1,0,0]=1 16 B12R1.258 NC(=O)C1=NC(=CC=C1)C(F)F Z1726038396 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.258 NC(=O)C1=NC=CC(=C1)C(=O)O Z1255448641 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.258 NC(=S)C1=CC(=CC=C1)C(=O)O Z404889430 [0,0,0,0,0,0|2,1,0]=3 19 B12R1.258 O=C(O)C1=CC(=CC=C1)C(F)F Z1117882789 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.258 O=C(O)C1=CC(=CC=C1)[N+](=O)[O-] Z57127479 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.258 O=C(O)C1=CC(=CN=C1)[N+](=O)[O-] Z1201622689 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.258 O=C(O)C1=CC(=NC=C1)C(=O)O Z1236003425 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.258 O=C(O)C1=CC=CC(=C1)B(O)O Z1203161777 [0,0,0,0,0,0|2,0,1]=3 24 B12R1.258 O=C(O)C1=CC=CC(=C1)C(=O)O Z104475158 [0,0,0,0,0,0|1,0,0]=1 25 B12R1.258 O=C(O)C1=CC=CC(=N1)C(=O)O Z57202012 [0,0,0,0,0,0|0,0,0]=0 26 B12R1.258 O=C(O)C1=CN=CC(=C1)C(=O)O Z275127642 [0,0,0,0,0,0|2,0,0]=2 27 B12R1.258 O=C(O)C1=NC(=CC=C1)C(F)F Z1255460752 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.266 C#CC1=CC=CC(=C1)C(=O)O Z1198169474 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.266 CC(=O)C1=CC(=CC=C1)CO Z1255384632 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.266 CCC1=NC(=CC=C1)C(=O)O Z1741980295 [1,0,0,0,0,0|1,0,1]=3 31 B11R1.266 COC1=CC(=CC=C1)C(=O)O Z57127526 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.266 COC1=NC(=CC=C1)C(=O)O Z969095262 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.266 COC1=NC(=CC=N1)C(=O)O Z1255500631 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.266 COC1=NC(=CN=C1)C(=O)O Z1198152489 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.266 CSC1=CC(=CC=C1)C(=O)O Z1201631828 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.266 CSC1=NC(=CC=C1)C(=O)O Z24821871 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.266 CSC1=NC(=CC=N1)C(=O)O Z1198233185 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.266 CSC1=NC(=CN=C1)C(=O)O Z1278639333 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.266 CSC1=NC(=NC=C1)C(=O)O Z1255401962 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.266 C[C@@H](O)C1=CC(=CC=C1)C=O Z1511906513 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.266 N#CC1=CC=CC(=C1)C(=O)O Z56921155 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.266 N#CC1=CC=CC(=N1)C(=O)O Z1170309368 [1,0,0,0,0,0|1,0,1]=3 43 B11R1.266 NC(=O)C1=CC(=CC=C1)C=O Z1065725946 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.266 NC(=O)C1=CC(=CC=C1)CO Z431951860 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.266 NC(=O)C1=NC(=CC=C1)CS Z1262674407 [1,0,0,0,0,0|1,1,1]=4 46 B11R1.266 NCC1=CC(=CC=C1)C(=O)O Z1262691668 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.266 NNC1=CC(=CC=C1)C(=O)O Z815264094 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.266 O=C(O)C1=CC(=CC=C1)CBr Z57980664 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.266 O=C(O)C1=CC(=CC=C1)CCl Z57834460 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.266 O=C(O)C1=CC(=CC=C1)CS Z228024598 [1,0,0,0,0,0|1,1,1]=4 51 B11R1.266 O=C(O)C1=CC(=NC=C1)CO Z2856164825 [1,0,0,0,0,0|2,0,1]=4 52 B11R1.266 O=C(O)C1=CC=CC(=C1)CO Z385458084 [1,0,0,0,0,0|1,0,1]=3 53 B11R1.266 O=C(O)C1=CN=CC(=C1)CO Z4748876044 [1,0,0,0,0,0|2,0,1]=4 54 B11R1.266 O=CC1=CC(=NC=C1)C(=O)O Z4202384577 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.266 O=CC1=CC=CC(=C1)B(O)O Z1160902377 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.266 O=CC1=CC=CC(=C1)C(=O)O Z1065768480 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.266 O=CC1=CC=CC(=C1)[N+](=O)[O-] Z57127514 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.266 O=CC1=CC=CC(=N1)C(=O)O Z1198307200 [1,0,0,0,0,0|0,0,0]=1 59 B11R1.266 O=CC1=CC=CC(=N1)C(F)F Z1255434345 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.266 O=CC1=CN=CC(=C1)C(=O)O Z2902338030 [1,0,0,0,0,0|2,0,0]=3 61 B13R1.13 CC(=O)C1=C(C=CC(=C1)C(=O)O)C Z1551959921 [0,1,0,0,0,0|2,0,0]=3 62 B13R1.13 CC(=O)C1=C(C=CC(=C1)C(=O)O)O Z316120698 [0,1,0,0,0,0|2,0,0]=3 63 B13R1.13 CC(=O)C1=C(N=CC(=C1)C(=O)O)C Z4443117191 [0,1,0,0,0,0|3,0,0]=4 64 B13R1.13 CC(=O)C1=CC(=C(C=C1)Br)C(=O)O Z2181909319 [0,1,0,0,0,0|2,0,0]=3 65 B13R1.13 CC(=O)C1=CC(=C(C=C1)O)C(=O)C Z1263715077 [0,1,0,0,0,0|3,0,0]=4 66 B13R1.13 CC1=C(C=C(C=C1)C(=O)N)C(=O)O Z1262539310 [0,1,0,0,0,0|2,0,0]=3 67 B13R1.13 CC1=C(C=C(C=C1)C(=O)O)C(=O)O Z1198235663 [0,1,0,0,0,0|1,0,0]=2 68 B13R1.13 CC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-] Z57127401 [0,1,0,0,0,0|2,0,1]=4 69 B13R1.13 CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O Z147641998 [0,1,0,0,0,0|2,0,1]=4 70 B13R1.13 NC(=O)C1=C(C=CC(=C1)C(=O)O)O Z1255381713 [0,1,0,0,0,0|2,0,0]=3 71 B13R1.13 NC1=C(C=C(C=C1)C(=O)O)C(=O)O Z1198150607 [0,1,0,0,0,0|1,0,0]=2 72 B13R1.13 NC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-] Z56886382 [0,1,0,0,0,0|2,0,1]=4 73 B13R1.13 NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O Z57124408 [0,1,0,0,0,0|2,0,1]=4 74 B13R1.13 O=C(O)C1=C(C=CC(=C1)B(O)O)Cl Z1269145164 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.13 O=C(O)C1=C(C=CC(=C1)B(O)O)F Z1201622087 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.13 O=C(O)C1=C(C=CC(=C1)[N+](=O)[O-])Br Z277540502 [0,1,0,0,0,0|2,0,1]=4 77 B13R1.13 O=C(O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl Z57914127 [0,1,0,0,0,0|2,0,1]=4 78 B13R1.13 O=C(O)C1=C(C=CC(=C1)[N+](=O)[O-])F Z235361915 [0,1,0,0,0,0|2,0,1]=4 79 B13R1.13 O=C(O)C1=C(C=CC(=C1)[N+](=O)[O-])I Z239685228 [0,1,0,0,0,0|2,0,1]=4 80 B13R1.13 O=C(O)C1=C(C=CC(=C1)[N+](=O)[O-])O Z276119910 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.13 O=C(O)C1=CC(=C(C=C1)Br)[N+](=O)[O-] Z55993015 [0,1,0,0,0,0|2,0,1]=4 82 B13R1.13 O=C(O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-] Z104472896 [0,1,0,0,0,0|2,0,1]=4 83 B13R1.13 O=C(O)C1=CC(=C(C=C1)F)C(=O)O Z1198167253 [0,1,0,0,0,0|1,0,0]=2 84 B13R1.13 O=C(O)C1=CC(=C(C=C1)F)[N+](=O)[O-] Z89284934 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.13 O=C(O)C1=CC(=C(C=C1)I)[N+](=O)[O-] Z424800200 [0,1,0,0,0,0|2,0,1]=4 86 B13R1.13 O=C(O)C1=CC(=C(C=C1)O)C(=O)O Z104503646 [0,1,0,0,0,0|1,0,0]=2 87 B13R1.13 O=C(O)C1=CC(=C(C=C1)O)[N+](=O)[O-] Z385458396 [0,1,0,0,0,0|2,0,1]=4 88 B13R1.13 O=C(O)C1=CNC(=O)C(=C1)C(=O)O Z599609114 [0,1,0,0,0,0|2,0,0]=3 89 B13R1.13 O=C(O)C1=NC(=C(C=C1)F)C(F)F Z1726132721 [0,1,0,0,0,0|2,0,1]=4 90 B13R1.126 CC1=CC(=CC(=C1)C(=O)N)C(=O)O Z1509757748 [0,1,0,0,0,0|2,0,0]=3 91 B13R1.126 CC1=CC(=CC(=C1)C(=O)O)C(=O)O Z1255485636 [0,1,0,0,0,0|1,0,0]=2 92 B13R1.126 CC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-] Z424800694 [0,1,0,0,0,0|2,0,1]=4 93 B13R1.126 NC(=O)C1=CC(=CC(=C1)C(=O)N)N Z56922062 [0,1,0,0,0,0|3,0,0]=4 94 B13R1.126 NC(=O)C1=CC(=CC(=C1)F)C(=O)O Z1862022840 [0,1,0,0,0,0|2,0,0]=3 95 B13R1.126 NC(=O)C1=CC(=CC(=C1)N)C(=O)O Z1079174558 [0,1,0,0,0,0|2,0,0]=3 96 B13R1.126 NC1=CC(=CC(=C1)C(=O)O)C(=O)O Z56755834 [0,1,0,0,0,0|1,0,0]=2 97 B13R1.126 NC1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-] Z276142568 [0,1,0,0,0,0|2,0,1]=4 98 B13R1.126 O=C(O)C1=CC(=CC(=C1)Br)[N+](=O)[O-] Z424800604 [0,1,0,0,0,0|2,0,1]=4 99 B13R1.126 O=C(O)C1=CC(=CC(=C1)C(=O)O)O Z104477544 [0,1,0,0,0,0|1,0,0]=2 100 B13R1.126 O=C(O)C1=CC(=CC(=C1)O)[N+](=O)[O-] Z1095353936 [0,1,0,0,0,0|2,0,1]=4 101 B13R1.126 O=C(O)C1=CC(=CC(=N1)C(=O)O)O Z2900188067 [0,1,0,0,0,0|0,0,0]=1 102 B13R1.126 O=C(O)C1=CC(=NC(=N1)O)C(=O)O Z1262515462 [0,1,0,0,0,0|3,0,0]=4 103 B13R1.126 O=C1C=C(OC(=C1)C(=O)O)C(=O)O Z1238543360 [0,1,0,0,0,0|1,0,0]=2 104 B13R1.345 CC(C)(C)C1=NC(=CC=C1)C(=O)O Z1255491592 [0,1,0,0,0,0|2,0,1]=4 105 B13R1.345 CS(=O)(=O)C1=CC(=CC=C1)C(=O)O Z56989684 [0,1,0,0,0,0|2,0,1]=4 106 B13R1.345 CS(=O)(=O)C1=NC(=CC=N1)C(=O)O Z1269203522 [0,1,0,0,0,0|2,0,1]=4 107 B13R1.345 CS(=O)(=O)C1=NC(=CN=C1)C(=O)O Z2027914971 [0,1,0,0,0,0|2,0,1]=4 108 B13R1.345 NS(=O)(=O)C1=CC(=CC=C1)C(=O)O Z53021522 [0,1,0,0,0,0|2,0,1]=4 109 B13R1.345 O=C(O)C1=CC(=CC=C1)S(=O)(=O)Cl Z56855113 [0,1,0,0,0,0|2,0,1]=4 110 B13R1.345 O=C(O)C1=CC(=CC=C1)S(=O)(=O)F Z198240992 [0,1,0,0,0,0|2,0,1]=4 111 B13R1.345 O=C(O)C1=NC(=CC=C1)C(F)(F)F Z1201621669 [0,1,0,0,0,0|2,0,1]=4 112 B13R1.543 CNC(=O)C1=CC(=CC=C1)C(=O)O Z425331720 [0,1,0,0,0,0|2,0,0]=3 113 B13R1.543 COC(=O)C1=CC(=CC=C1)B(O)O Z1203162066 [0,1,0,0,0,0|2,0,1]=4 114 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=N)N Z2574923569 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=O)N Z326029350 [0,1,0,0,0,0|2,0,0]=3 116 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=O)O Z425331302 [0,1,0,0,0,0|1,0,0]=2 117 B13R1.543 COC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z19668576 [0,1,0,0,0,0|2,0,1]=4 118 B13R1.543 COC(=O)C1=CC(=CN=C1)C(=O)C Z1255447215 [0,1,0,0,0,0|3,0,0]=4 119 B13R1.543 COC(=O)C1=CC(=CN=C1)C(=O)O Z451334748 [0,1,0,0,0,0|2,0,0]=3 120 B13R1.543 COC(=O)C1=CC(=NC=C1)C(=O)O Z1198159155 [0,1,0,0,0,0|2,0,0]=3 121 B13R1.543 COC(=O)C1=NC(=CC=C1)C(=O)C Z1198181830 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.543 COC(=O)C1=NC(=CC=C1)C(=O)O Z425797000 [0,1,0,0,0,0|0,0,0]=1 123 B13R1.543 COC(=O)C1=NC=CC(=C1)C(=O)O Z1255450491 [0,1,0,0,0,0|2,0,0]=3 124 B13R1.543 O=C(O)C1=NC(=CC=C1)C(=O)CCl Z1255494496 [0,1,0,0,0,0|1,0,0]=2 125 B13R1.543 O=C(O)C1=NC=CC(=C1)C(=O)NO Z3037820843 [0,1,0,0,0,0|2,0,0]=3 126 B13R1.3801 CC1=C(C=CC=C1C(=O)O)[N+](=O)[O-] Z104478182 [0,1,0,0,0,0|2,0,1]=4 127 B13R1.3801 CC1=C(C=NC=C1C(=O)O)C(=O)O Z3016429736 [0,1,0,0,0,0|2,0,0]=3 128 B13R1.3801 CC1=C(N=CC=C1C(=O)O)C(=O)O Z1262530014 [0,1,0,0,0,0|2,0,0]=3 129 B13R1.3801 CC1=C(N=CN=C1C(=O)O)C(=O)O Z2510946256 [0,1,0,0,0,0|3,0,0]=4 130 B13R1.3801 NC1=C(C=CC=C1C(=O)O)C(=O)O Z1201620627 [0,1,0,0,0,0|1,0,0]=2 131 B13R1.3801 NC1=C(C=CC=C1C(=O)O)[N+](=O)[O-] Z1065585446 [0,1,0,0,0,0|2,0,1]=4 132 B13R1.3801 O=C(O)C1=C(C(=CC=C1)[N+](=O)[O-])O Z1255465064 [0,1,0,0,0,0|2,0,1]=4 133 B13R1.3801 O=C(O)C1=CC=CC(=C1O)C(=O)O Z1198158096 [0,1,0,0,0,0|1,0,0]=2 134 B13R1.3801 O=C(O)C1=NC=NC(=C1Br)C(=O)O Z5619646850 [0,1,0,0,0,0|3,0,0]=4 135 B13R2.429 O=C(O)C1=NC(=CC=C1)C2CC2 Z1255504608 [0,0,0,1,0,0|2,0,1]=4 136 B11R1.175 CC(=O)C1=CC(=CS1)C(=O)O Z835833262 [0,0,0,0,1,0|3,0,0]=4 137 B11R1.175 CC(=O)C1=CC=C(N1)C(=O)O Z1198219139 [0,0,0,0,1,0|1,0,1]=3 138 B11R1.175 CC(=O)C1=CC=C(O1)C(=O)O Z1255368340 [0,0,0,0,1,0|2,0,0]=3 139 B11R1.175 CC(=O)C1=CC=C(S1)C(=O)O Z104378254 [0,0,0,0,1,0|2,0,0]=3 140 B11R1.175 CC(=O)C1=CNC(=C1)C(=O)O Z104510032 [0,0,0,0,1,0|3,0,0]=4 141 B11R1.175 CC(=O)C1=CSC(=C1)C(=O)O Z1123806397 [0,0,0,0,1,0|3,0,0]=4 142 B11R1.175 CC(=O)C1=NC=C(S1)C(=O)O Z1255464189 [0,0,0,0,1,0|3,0,0]=4 143 B11R1.175 NC(=O)C1=CC(=CN1)C(=O)O Z425450736 [0,0,0,0,1,0|3,0,0]=4 144 B11R1.175 NC(=O)C1=CC(=CO1)C(=O)O Z1665222130 [0,0,0,0,1,0|3,0,0]=4 145 B11R1.175 NC(=O)C1=CC=C(N1)C(=O)N Z2235409303 [0,0,0,0,1,0|2,0,1]=4 146 B11R1.175 NC(=O)C1=CC=C(N1)C(=O)O Z2234185672 [0,0,0,0,1,0|1,0,1]=3 147 B11R1.175 NC(=O)C1=CC=C(O1)C(=O)O Z1255459596 [0,0,0,0,1,0|2,0,0]=3 148 B11R1.175 NC(=O)C1=CC=C(S1)C(=O)O Z57475041 [0,0,0,0,1,0|2,0,0]=3 149 B11R1.175 NC(=O)C1=CNC(=C1)C(=O)O Z1267866248 [0,0,0,0,1,0|3,0,0]=4 150 B11R1.175 NC(=O)C1=COC(=C1)C(=O)O Z1222331032 [0,0,0,0,1,0|3,0,0]=4 151 B11R1.175 NC(=O)C1=CSC(=C1)C(=O)O Z802827864 [0,0,0,0,1,0|3,0,0]=4 152 B11R1.175 NC(=O)C1=NC(=CS1)C(=O)O Z1723583605 [0,0,0,0,1,0|2,0,0]=3 153 B11R1.175 NC(=O)C1=NC=C(S1)C(=O)O Z2935741173 [0,0,0,0,1,0|3,0,0]=4 154 B11R1.175 O=C(O)C1=CC(=NN1)C(=O)O Z1198147218 [0,0,0,0,1,0|3,0,0]=4 155 B11R1.175 O=C(O)C1=CC=C(N1)C(=O)O Z1198267259 [0,0,0,0,1,0|0,0,1]=2 156 B11R1.175 O=C(O)C1=CC=C(N1)[N+](=O)[O-] Z324590208 [0,0,0,0,1,0|1,0,2]=4 157 B11R1.175 O=C(O)C1=CC=C(O1)C(=O)O Z1255427253 [0,0,0,0,1,0|1,0,0]=2 158 B11R1.175 O=C(O)C1=CC=C(O1)[N+](=O)[O-] Z56926611 [0,0,0,0,1,0|2,0,1]=4 159 B11R1.175 O=C(O)C1=CC=C(S1)C(=O)O Z56855146 [0,0,0,0,1,0|1,0,0]=2 160 B11R1.175 O=C(O)C1=CC=C(S1)[N+](=O)[O-] Z56839660 [0,0,0,0,1,0|2,0,1]=4 161 B11R1.175 O=C(O)C1=CSC(=C1)C(=O)O Z992892588 [0,0,0,0,1,0|2,0,0]=3 162 B11R1.178 CC(=O)C1=C(SC=C1)C(=O)O Z1198158862 [0,0,0,0,1,0|2,0,0]=3 163 B11R1.178 NC(=O)C1=CSC=C1C(=O)O Z2122267359 [0,0,0,0,1,0|2,0,0]=3 164 B11R1.178 O=C(O)C1=C(CCC1)C(=O)O Z1255487192 [0,0,0,0,1,0|0,0,3]=4 165 B11R1.178 O=C(O)C1=C(NC=N1)C(=O)O Z57290953 [0,0,0,0,1,0|2,0,0]=3 166 B11R1.178 O=C(O)C1=C(SC=C1)C(=O)O Z877960192 [0,0,0,0,1,0|1,0,0]=2 167 B11R1.178 O=C(O)C1=CNC=C1C(=O)O Z815303066 [0,0,0,0,1,0|1,0,0]=2 168 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(=O)C Z30816194 [0,0,0,0,0,1|3,0,0]=4 169 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(=O)N Z29177113 [0,0,0,0,0,1|3,0,0]=4 170 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(=O)O Z57647063 [0,0,0,0,0,1|2,0,0]=3 171 B13R1.587 CC(=O)NC1=NC(=CC=C1)C(=O)O Z223026202 [0,0,0,0,0,1|1,0,0]=2 172 B13R1.587 CC(=O)OC1=CC(=CC=C1)C(=O)O Z336079448 [0,0,0,0,0,1|2,0,0]=3 173 B13R1.587 CC(C)OC1=NC(=CC=C1)C(=O)O Z969095408 [0,0,0,0,0,1|2,0,1]=4 174 B13R1.587 CS(=O)CC1=CC(=CC=C1)C(=O)O Z168796498 [0,0,0,0,0,1|3,0,0]=4 175 B13R1.587 NC(=O)C1=CC(=CC=C1)CC(=O)O Z1262559652 [0,0,0,0,0,1|2,0,0]=3 176 B13R1.587 NC(=O)NC1=CC(=CC=C1)C(=O)N Z101185716 [0,0,0,0,0,1|3,0,0]=4 177 B13R1.587 NC(=O)NC1=CC(=CC=C1)C(=O)O Z90122506 [0,0,0,0,0,1|2,0,0]=3 178 B13R1.587 O=C(O)C1=NC(=CC=C1)OC(F)F Z1889708486 [0,0,0,0,0,1|2,0,1]=4 179 B13R1.587 O=C(O)CC1=CC(=CC=C1)[N+](=O)[O-] Z285184614 [0,0,0,0,0,1|2,0,1]=4 180 B10R1.113 CC(=O)C1=NC(=CC=C1)Br Z1269164937 [2,0,0,0,0,0|2,0,0]=4 181 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl Z1198173097 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.113 CC(=O)C1=NC(=CC=C1)F Z1198219245 [2,0,0,0,0,0|2,0,0]=4 183 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [2,0,0,0,0,0|1,0,1]=4 184 B10R1.113 CC1=NC(=CC=C1)C(=O)N Z287485516 [2,0,0,0,0,0|1,0,1]=4 185 B10R1.113 CC1=NC(=CC=C1)C(=O)O Z278017928 [2,0,0,0,0,0|0,0,1]=3 186 B10R1.113 CC1=NC(=CC=N1)C(=O)O Z489806966 [2,0,0,0,0,0|1,0,1]=4 187 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [2,0,0,0,0,0|2,0,0]=4 188 B10R1.113 NC(=O)C1=NC(=CC=C1)Br Z1116315117 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.113 NC(=O)C1=NC(=CC=C1)Cl Z969100498 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.113 NC(=O)C1=NC(=CC=C1)N Z969101552 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.113 NC1=NC(=CC=C1)C(=O)O Z220336222 [2,0,0,0,0,0|1,0,0]=3 193 B10R1.113 NC1=NC(=CN=C1)C(=O)O Z1198277982 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [2,0,0,0,0,0|1,0,0]=3 199 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [2,0,0,0,0,0|1,1,0]=4 200 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [2,0,0,0,0,0|2,0,0]=4 201 B10R1.113 O=C(O)C1=NC(=CC=C1)Br Z415628156 [2,0,0,0,0,0|1,0,0]=3 202 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [2,0,0,0,0,0|1,0,0]=3 203 B10R1.113 O=C(O)C1=NC(=CC=C1)F Z1203162000 [2,0,0,0,0,0|1,0,0]=3 204 B10R1.113 O=C(O)C1=NC(=CC=N1)Br Z1269120600 [2,0,0,0,0,0|2,0,0]=4 205 B10R1.113 O=C(O)C1=NC(=CC=N1)Cl Z1198272423 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.113 O=C(O)C1=NC(=CN=C1)Br Z1269117178 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.113 O=C(O)C1=NC(=CN=C1)Cl Z1198155331 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.113 O=C(O)C1=NC(=CN=C1)F Z1551922856 [2,0,0,0,0,0|2,0,0]=4 209 B10R1.113 O=C(O)C1=NC(=NC=C1)Br Z1429420892 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.113 O=C(O)C1=NC(=NC=C1)Cl Z1201623752 [2,0,0,0,0,0|2,0,0]=4 211 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.113 O=C1C=C(C=CN1)C(=O)O Z1416200909 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.113 O=C1C=CC=C(N1)C(=O)O Z359371306 [2,0,0,0,0,0|0,0,1]=3 214 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.113 O=C1C=NC=C(N1)C(=O)O Z1821397992 [2,0,0,0,0,0|1,0,1]=4 216 B10R1.172 C#CC1=CC=CC(=N1)C=O Z1198314570 [2,0,0,0,0,0|1,0,1]=4 217 B10R1.172 CCC1=NC(=CC=C1)C=O Z1255375781 [2,0,0,0,0,0|1,0,1]=4 218 B10R1.172 COC1=NC(=CC=C1)C=O Z1160906077 [2,0,0,0,0,0|2,0,0]=4 219 B10R1.172 O=CC1=CC=CC(=N1)CO Z1255379968 [2,0,0,0,0,0|0,0,1]=3 220 B12R1.11 CC1=CC(=CC(=C1)C=O)C(=O)O Z1262528438 [1,1,0,0,0,0|1,0,0]=3 221 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)Br Z1551960208 [1,1,0,0,0,0|1,0,0]=3 222 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)Cl Z1262556297 [1,1,0,0,0,0|1,0,0]=3 223 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)O Z1255441210 [1,1,0,0,0,0|1,0,0]=3 224 B12R1.56 CC(=O)C1=CC(=C(C=C1)Br)C=O Z3325945410 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)C=O Z1262560013 [1,1,0,0,0,0|1,0,0]=3 226 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)CO Z1262538882 [1,1,0,0,0,0|1,0,1]=4 227 B12R1.56 N#CC1=C(C=CC(=N1)C(=O)O)Cl Z1255449319 [1,1,0,0,0,0|1,0,1]=4 228 B12R1.56 NC1=C(C=C(C=N1)C(=O)O)C=O Z3023980685 [1,1,0,0,0,0|2,0,0]=4 229 B12R1.56 O=C(O)C1=CC(=C(C=C1)O)CO Z1262519174 [1,1,0,0,0,0|1,0,1]=4 230 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)Br Z1486034958 [1,1,0,0,0,0|1,0,0]=3 231 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)Cl Z1649775095 [1,1,0,0,0,0|1,0,0]=3 232 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)F Z1198168885 [1,1,0,0,0,0|1,0,0]=3 233 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)O Z1255434815 [1,1,0,0,0,0|1,0,0]=3 234 B12R1.279 COCC1=CC(=CC=C1)C(=O)O Z90122375 [1,1,0,0,0,0|1,0,1]=4 235 B12R1.279 NCCC1=NC(=CC=C1)C(=O)O Z1813090259 [1,1,0,0,0,0|1,0,1]=4 236 B12R1.435 C#CC1=CC=CC(=N1)C(=O)OC Z1255393713 [1,1,0,0,0,0|1,0,1]=4 237 B12R1.435 CNC(=O)C1=CC(=CC=C1)C=O Z1068186274 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.435 COC(=O)C1=CC(=CC=C1)C=O Z1255415803 [1,1,0,0,0,0|1,0,0]=3 239 B12R1.435 COC(=O)C1=CC(=CC=C1)CO Z431953134 [1,1,0,0,0,0|1,0,1]=4 240 B12R1.435 COC(=O)C1=CC(=CN=C1)C=O Z1198311040 [1,1,0,0,0,0|2,0,0]=4 241 B12R1.435 COC(=O)C1=NC(=CC=C1)C#N Z1198172059 [1,1,0,0,0,0|1,0,1]=4 242 B12R1.435 COC(=O)C1=NC(=CC=C1)C=O Z1198172060 [1,1,0,0,0,0|0,0,0]=2 243 B12R1.435 COC(=O)C1=NC(=CC=C1)OC Z1255489919 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.435 COC(=O)C1=NC(=CC=C1)SC Z1618110328 [1,1,0,0,0,0|2,0,0]=4 245 B12R1.435 COC(=O)C1=NC(=NC=C1)C=O Z1813082341 [1,1,0,0,0,0|1,0,0]=3 246 B12R1.435 COC(=O)C1=NC=CC(=C1)C=O Z1255467085 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.440 CC1=C(C=CC=C1CO)C(=O)O Z1486035448 [1,1,0,0,0,0|1,0,1]=4 248 B12R1.440 NC(=O)C1=C(C(=CC=C1)C=O)F Z2511824780 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.440 O=CC1=CC=CC(=C1Cl)C(=O)O Z1649775097 [1,1,0,0,0,0|1,0,0]=3 250 B12R1.440 O=CC1=CC=CC(=C1F)C(=O)O Z1322795747 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.440 O=CC1=CC=CC(=C1O)C(=O)O Z56756601 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.453 CC1=C(C=C(C=C1)C=O)C(=O)O Z1813092023 [1,1,0,0,0,0|1,0,0]=3 253 B12R1.453 COC1=NC(=C(C=C1)C)C(=O)O Z1255390077 [1,1,0,0,0,0|2,0,0]=4 254 B12R1.453 COC1=NC(=C(C=C1)Cl)C(=O)O Z221432352 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.453 COC1=NC(=C(C=C1)F)C(=O)O Z1255447688 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.453 CSC1=NC(=C(C=C1)Cl)C(=O)O Z732206892 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.453 O=C(O)C1=C(C=CC(=C1)CO)Cl Z1262523857 [1,1,0,0,0,0|1,0,1]=4 258 B12R1.453 O=CC1=CC(=C(C=C1)F)C(=O)O Z1201623086 [1,1,0,0,0,0|1,0,0]=3 259 B12R1.453 O=CC1=CC(=C(C=C1)O)C(=O)O Z1255430994 [1,1,0,0,0,0|1,0,0]=3 260 B12R1.111 CC(=O)C1=CC(=C(S1)C(=O)O)Br Z4327564722 [0,1,0,0,1,0|2,0,0]=4 261 B12R1.111 CC1=C(SC(=C1)C(=O)O)C(=O)O Z1262531770 [0,1,0,0,1,0|1,0,0]=3 262 B12R1.111 O=C(O)C1=CC(=C(O1)C(=O)O)Br Z1923114365 [0,1,0,0,1,0|1,0,0]=3 263 B12R1.359 COC(=O)C1=CC(=CN1)C(=O)O Z1255495420 [0,1,0,0,1,0|2,0,0]=4 264 B12R1.359 COC(=O)C1=CC(=CS1)C(=O)O Z3445922281 [0,1,0,0,1,0|2,0,0]=4 265 B12R1.359 COC(=O)C1=CC=C(N1)C(=O)O Z1255380295 [0,1,0,0,1,0|0,0,1]=3 266 B12R1.359 COC(=O)C1=CC=C(O1)C(=O)O Z228584396 [0,1,0,0,1,0|1,0,0]=3 267 B12R1.359 COC(=O)C1=CC=C(S1)C(=O)O Z57191476 [0,1,0,0,1,0|1,0,0]=3 268 B12R1.359 COC(=O)C1=CNC(=C1)C(=O)O Z1516544234 [0,1,0,0,1,0|2,0,0]=4 269 B12R1.359 COC(=O)C1=COC(=C1)C(=O)O Z1262517523 [0,1,0,0,1,0|2,0,0]=4 270 B12R1.359 COC(=O)C1=NC(=CS1)C(=O)O Z2696918727 [0,1,0,0,1,0|1,0,0]=3 271 B12R1.359 COC(=O)C1=NC=C(S1)C(=O)O Z4607151008 [0,1,0,0,1,0|2,0,0]=4 272 B12R1.901 O=C(O)C1=CSC(=C1Br)C(=O)O Z1269147257 [0,1,0,0,1,0|2,0,0]=4 273 B12R1.368 COC(=O)C1=C(C=CN1)C(=O)O Z5593358295 [0,1,0,0,1,0|1,0,0]=3 274 B12R1.368 COC(=O)C1=C(C=CS1)C(=O)O Z1262517519 [0,1,0,0,1,0|1,0,0]=3 275 B12R1.368 COC(=O)C1=C(OC=C1)C(=O)O Z1889706994 [0,1,0,0,1,0|1,0,0]=3 276 B12R1.368 COC(=O)C1=CNN=C1C(=O)O Z1262529404 [0,1,0,0,1,0|2,0,0]=4 277 B12R1.368 COC(=O)C1=COC=C1C(=O)O Z1262511791 [0,1,0,0,1,0|1,0,0]=3 278 B12R1.368 COC(=O)C1=CSC=C1C(=O)O Z1262514542 [0,1,0,0,1,0|1,0,0]=3 279 B12R1.498 CC1=C(C(=NN1)C(=O)O)C(=O)O Z1262517399 [0,1,0,0,1,0|2,0,0]=4 280 B12R1.850 CC1=NC(=C(N1)C(=O)O)C(=O)O Z1198150718 [0,1,0,0,1,0|2,0,0]=4 281 B14R1.424 O=C(O)C1=NC(=CC=C1)CP(=O)(O)O Z1508994352 [0,1,0,0,0,1|1,0,0]=3 282 B14R1.676 CC(=O)NC1=C(C=CC(=C1)C(=O)O)C Z85893057 [0,1,0,0,0,1|2,0,0]=4 283 B14R1.705 CC(=O)NC1=CC(=C(C=C1)C)C(=O)O Z1143322507 [0,1,0,0,0,1|2,0,0]=4 284 B14R1.705 CC(=O)NC1=CC(=C(C=C1)Cl)C(=O)O Z364361266 [0,1,0,0,0,1|2,0,0]=4 285 B14R1.705 CC(=O)NC1=CC(=C(C=C1)F)C(=O)O Z364321922 [0,1,0,0,0,1|2,0,0]=4 286 B14R1.705 CC(=O)NC1=CC(=C(C=C1)N)C(=O)O Z196931010 [0,1,0,0,0,1|2,0,0]=4 287 B14R1.705 CC(=O)NC1=CC(=C(C=C1)O)C(=O)O Z239128440 [0,1,0,0,0,1|2,0,0]=4 288 B14R1.705 CC(=O)NC1=NC(=C(C=C1)Br)C(=O)O Z1269133897 [0,1,0,0,0,1|1,0,0]=3 289 B14R1.705 NC(=O)NC1=CC(=C(C=C1)Cl)C(=O)O Z594281778 [0,1,0,0,0,1|2,0,0]=4 290 B14R1.733 COC(=O)C1=CC(=CC=C1)CC(=O)O Z1198661914 [0,1,0,0,0,1|1,0,0]=3 291 B14R1.733 COC(=O)C1=CC(=CC=C1)NC(=O)C Z18978365 [0,1,0,0,0,1|2,0,0]=4 292 B14R1.733 COC(=O)C1=CC(=CC=C1)NC(=O)N Z28830588 [0,1,0,0,0,1|2,0,0]=4 293 B14R1.3301 C=CC(=O)NC1=CC=CC(=C1)C(=O)O Z316092270 [0,1,0,0,0,1|2,0,0]=4 294 B14R1.3301 CCC(=O)NC1=CC(=CC=C1)C(=O)O Z85877498 [0,1,0,0,0,1|2,0,0]=4 295 B14R1.3301 CNC(=O)NC1=CC(=CC=C1)C(=O)O Z763651538 [0,1,0,0,0,1|2,0,0]=4 296 B14R1.3301 COC(=O)CC1=CC(=CC=C1)C(=O)O Z1262517061 [0,1,0,0,0,1|1,0,0]=3 297 B14R1.3301 COC(=O)NC1=CC(=CC=C1)C(=O)O Z319610480 [0,1,0,0,0,1|1,0,0]=3 298 B14R1.3301 O=C(CCl)NC1=CC=CC(=C1)C(=O)O Z56922085 [0,1,0,0,0,1|2,0,0]=4 299 B14R1.4256 CC(=O)NC1=CC(=CC(=C1)I)C(=O)O Z1603677224 [0,1,0,0,0,1|2,0,0]=4 300 B14R1.6420 CC(C(=O)O)C1=CC(=CC=C1)C(=O)O Z1198274968 [0,1,0,0,0,1|1,0,0]=3 301 B14R1.6420 NC(C(=O)O)C1=CC(=CC=C1)C(=O)O Z1675221010 [0,1,0,0,0,1|1,0,0]=3 302 B14R1.6420 O=C(O)C1=CC=CC(=C1)C(O)C(=O)O Z1262522783 [0,1,0,0,0,1|1,0,0]=3 303 B14R1.12 NC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)O Z56760359 [0,2,0,0,0,0|2,0,0]=4 304 B14R1.680 CS(=O)(=O)C1=NC(=C(C=C1)Cl)C(=O)O Z2009985916 [0,2,0,0,0,0|1,0,1]=4 305 B14R1.680 O=C(O)C1=C(C=CC(=C1)S(=O)(=O)O)O Z104478882 [0,2,0,0,0,0|2,0,0]=4 306 B14R1.706 CCC(=O)C1=C(C=CC(=C1)C(=O)O)F Z1262557083 [0,2,0,0,0,0|2,0,0]=4 307 B14R1.706 COC(=O)C1=C(C=CC(=C1)C(=O)O)Br Z1551930382 [0,2,0,0,0,0|1,0,0]=3 308 B14R1.706 COC(=O)C1=C(C=CC(=C1)C(=O)O)C Z1198161724 [0,2,0,0,0,0|1,0,0]=3 309 B14R1.748 COC(=O)C1=CC(=C(C=C1)C)C(=O)O Z1262513883 [0,2,0,0,0,0|1,0,0]=3 310 B14R1.748 COC(=O)C1=CC(=C(C=C1)O)C(=O)N Z1262631819 [0,2,0,0,0,0|2,0,0]=4 311 B14R1.748 COC(=O)C1=CC(=C(C=C1)O)C(=O)O Z1255401617 [0,2,0,0,0,0|1,0,0]=3 312 B14R1.748 COC(=O)C1=NC=C(C(=C1)C(=O)O)F Z3397602209 [0,2,0,0,0,0|2,0,0]=4 313 B14R1.6035 NC1=C(C=C(C(=C1)O)C(=O)O)C(=O)O Z1262512076 [0,2,0,0,0,0|1,0,0]=3 314 B14R1.14211 NC1=C(C(=CC(=C1)C(=O)O)C(=O)O)O Z3071067028 [0,2,0,0,0,0|1,0,0]=3 315 B14R1.345 COC1=CC(=NC(=C1)C(=O)O)C(=O)O Z1198304336 [0,2,0,0,0,0|0,0,0]=2 316 B14R1.712 COC(=O)C1=CC(=CC(=C1)Br)C(=O)O Z1269157732 [0,2,0,0,0,0|1,0,0]=3 317 B14R1.712 COC(=O)C1=CC(=CC(=C1)C)C(=O)O Z1201623982 [0,2,0,0,0,0|1,0,0]=3 318 B14R1.712 COC(=O)C1=CC(=CC(=C1)Cl)C(=O)N Z1450943720 [0,2,0,0,0,0|2,0,0]=4 319 B14R1.712 COC(=O)C1=CC(=CC(=C1)F)C(=O)O Z1198179705 [0,2,0,0,0,0|1,0,0]=3 320 B14R1.3145 NC1=CC(=C(C(=C1)C(=O)O)O)C(=O)O Z1262539752 [0,2,0,0,0,0|1,0,0]=3 321 B14R1.3145 O=C(O)C1=CC(=CC(=C1O)C(=O)O)Cl Z1269144757 [0,2,0,0,0,0|1,0,0]=3 322 B14R1.735 COC(=O)C1=NC(=CC=C1)S(=O)(=O)F Z2805865765 [0,2,0,0,0,0|1,0,1]=4 323 B14R1.734 COC(=O)C1=CC(=CC=C1)C(=O)CCl Z1518653082 [0,2,0,0,0,0|2,0,0]=4 324 B14R1.734 COC(=O)C1=CC=CC(=N1)C(=O)OC Z25085939 [0,2,0,0,0,0|0,0,0]=2 325 B14R1.734 COC(=O)C1=NC(=CC=C1)C(=O)CCl Z1269220580 [0,2,0,0,0,0|1,0,0]=3 326 B14R1.736 COC(=O)C1=C(C(=CC=C1)C(=O)O)C Z1262534417 [0,2,0,0,0,0|1,0,0]=3 327 B14R1.736 COC(=O)C1=C(C(=CC=C1)C(=O)O)O Z1262515142 [0,2,0,0,0,0|1,0,0]=3 328 B14R1.736 COC(=O)C1=C(C(=CN=C1)C(=O)O)C Z1262530661 [0,2,0,0,0,0|2,0,0]=4 329 B14R2.601 CC(=O)C1=CC2=C(C=C1)OC(=O)N2 Z1486035041 [0,0,0,1,0,1|2,0,0]=4 330 B14R2.601 CC1=NC2=C(O1)C=CC(=C2)C(=O)O Z1198224457 [0,0,0,1,0,1|2,0,0]=4 331 B14R2.601 O=C(O)C1=CC2=C(C=C1)N=C(S2)O Z2582963116 [0,0,0,1,0,1|2,0,0]=4 332 B14R2.601 O=C(O)C1=CC2=C(C=C1)OC(=N2)S Z57478902 [0,0,0,1,0,1|1,1,0]=4 333 B14R2.601 O=C1CC2=C(N1)C=CC(=C2)C(=O)O Z285150648 [0,0,0,1,0,1|2,0,0]=4 334 B14R2.601 O=C1NC2=C(N1)C=C(C=C2)C(=O)O Z234895459 [0,0,0,1,0,1|2,0,0]=4 335 B14R2.601 O=C1NC2=C(N1)N=C(C=C2)C(=O)O Z2004581605 [0,0,0,1,0,1|1,0,0]=3 336 B14R2.601 O=C1NC2=C(O1)C=C(C=C2)C(=O)O Z381350966 [0,0,0,1,0,1|2,0,0]=4 337 B14R2.601 O=C1NC2=C(O1)C=CC(=C2)C(=O)O Z1198175164 [0,0,0,1,0,1|1,0,0]=3 338 B14R2.601 O=C1NC2=C(O1)C=CC(=N2)C(=O)O Z1262531578 [0,0,0,1,0,1|0,0,0]=2 339 B14R2.601 O=C1NC2=C(S1)C=CC(=C2)C(=O)O Z1262528069 [0,0,0,1,0,1|1,1,0]=4 340 B14R2.712 NC1=NC2=C(O1)C(=CC=C2)C(=O)O Z3243595564 [0,0,0,1,0,1|2,0,0]=4 341 B14R2.712 O=C(O)C1=C2OC(=NC2=CC=C1)S Z1255391993 [0,0,0,1,0,1|1,1,0]=4 342 B14R2.712 O=C1CC2=C(C=CC=C2N1)C(=O)O Z1198272458 [0,0,0,1,0,1|2,0,0]=4 343 B14R2.712 O=C1CC2=CC=CC(=C2O1)C(=O)O Z1262521063 [0,0,0,1,0,1|1,0,0]=3 344 B14R2.712 O=C1NC2=C(C=CC=C2O1)C(=O)O Z1198315026 [0,0,0,1,0,1|2,0,0]=4 345 B14R2.712 O=C1NC2=CC=CC(=C2N1)C(=O)O Z2168541831 [0,0,0,1,0,1|2,0,0]=4 346 B14R2.712 O=C1NC2=CC=CC(=C2O1)C(=O)O Z1262521113 [0,0,0,1,0,1|1,0,0]=3 347 B14R2.24358 CC1=COC2=C1C=C(C=C2)C(=O)O Z1198173326 [0,1,0,1,0,0|2,0,0]=4 348 B14R2.24358 O=C(O)C1=CC2=C(C=C1)CNC2=O Z1198221037 [0,1,0,1,0,0|2,0,0]=4 349 B14R2.24358 O=C(O)C1=CC2=C(C=C1)COC2=O Z1262548155 [0,1,0,1,0,0|1,0,0]=3 350 B14R2.24358 O=C(O)C1=CC2=C(C=C1)NNC2=O Z2160914636 [0,1,0,1,0,0|2,0,0]=4 351 B14R2.4 O=C(O)C1=C2CCC(=O)C2=CC=C1 Z3227038450 [0,1,0,1,0,0|2,0,0]=4 352 B14R2.4 O=C(O)C1=C2CNC(=O)C2=CC=C1 Z1255438348 [0,1,0,1,0,0|2,0,0]=4 353 B10R1.31 NC(=O)C1=CC=C(S1)C=O Z1255366081 [1,0,0,0,1,0|2,0,0]=4 354 B10R1.31 O=C(O)C1=CC=C(O1)CO Z385458092 [1,0,0,0,1,0|1,0,1]=4 355 B10R1.31 O=C(O)C1=CC=C(S1)CO Z1134175383 [1,0,0,0,1,0|1,0,1]=4 356 B10R1.31 O=C(O)C1=CSC(=N1)CO Z2241073222 [1,0,0,0,1,0|1,0,1]=4 357 B10R1.31 O=C(O)C1=NN(C=C1)CO Z1198164921 [1,0,0,0,1,0|1,0,1]=4 358 B10R1.31 O=CC1=CC(=CN1)C(=O)O Z1203825503 [1,0,0,0,1,0|2,0,0]=4 359 B10R1.31 O=CC1=CC(=CO1)C(=O)O Z1197921203 [1,0,0,0,1,0|2,0,0]=4 360 B10R1.31 O=CC1=CC(=CS1)C(=O)O Z1198158838 [1,0,0,0,1,0|2,0,0]=4 361 B10R1.31 O=CC1=CC=C(N1)C(=O)O Z1198223703 [1,0,0,0,1,0|0,0,1]=3 362 B10R1.31 O=CC1=CC=C(O1)C(=O)O Z1201617369 [1,0,0,0,1,0|1,0,0]=3 363 B10R1.31 O=CC1=CC=C(S1)C(=O)O Z1201619678 [1,0,0,0,1,0|1,0,0]=3 364 B10R1.31 O=CC1=CNC(=C1)C(=O)O Z1190318813 [1,0,0,0,1,0|2,0,0]=4 365 B10R1.31 O=CC1=CSC(=C1)C(=O)O Z1262525684 [1,0,0,0,1,0|2,0,0]=4 366 B10R1.39 O=CC1=C(C=CO1)C(=O)O Z1205495058 [1,0,0,0,1,0|1,0,0]=3 367 B10R1.39 O=CC1=C(C=CS1)C(=O)O Z1198155319 [1,0,0,0,1,0|1,0,0]=3 368 B10R1.39 O=CC1=C(NC=C1)C(=O)O Z2894612605 [1,0,0,0,1,0|1,0,0]=3 369 B10R1.39 O=CC1=C(NC=N1)C(=O)O Z2936387970 [1,0,0,0,1,0|2,0,0]=4 370 B10R1.39 O=CC1=C(OC=C1)C(=O)O Z2681280636 [1,0,0,0,1,0|1,0,0]=3 371 B10R1.39 O=CC1=C(SC=C1)C(=O)O Z1198309295 [1,0,0,0,1,0|1,0,0]=3 372 B10R1.39 O=CC1=CNN=C1C(=O)O Z1201627948 [1,0,0,0,1,0|2,0,0]=4 373 B10R1.39 O=CC1=CSC=C1C(=O)O Z1198158839 [1,0,0,0,1,0|1,0,0]=3 374 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O Z1238570824 [1,0,0,0,0,1|2,0,0]=4 375 B12R1.438 O=CC1=CC=CC(=C1)CC(=O)O Z1262512246 [1,0,0,0,0,1|1,0,0]=3 376 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)O Z335574216 [0,0,0,0,1,1|2,0,0]=4 377 B12R1.256 CC(=O)C1=CN=C(C=C1)C(=O)O Z4443002849 [0,0,0,0,1,1|1,0,0]=3 378 B12R1.256 CC(=O)C1=NN=C(C=C1)C(=O)O Z4430313618 [0,0,0,0,1,1|1,0,0]=3 379 B12R1.256 NC(=O)C1=CC=C(C=C1)C(=O)O Z147646808 [0,0,0,0,1,1|2,0,0]=4 380 B12R1.256 NC(=O)C1=CN=C(C=C1)C(=O)O Z425333840 [0,0,0,0,1,1|1,0,0]=3 381 B12R1.256 NC(=O)C1=NC=C(C=C1)C(=O)O Z316122632 [0,0,0,0,1,1|1,0,0]=3 382 B12R1.256 NC(=O)C1=NC=C(N=C1)C(=O)O Z1504684907 [0,0,0,0,1,1|2,0,0]=4 383 B12R1.256 O=C(O)C1=CC=C(C=C1)C(=O)O Z57127536 [0,0,0,0,1,1|1,0,0]=3 384 B12R1.256 O=C(O)C1=CN=C(C=C1)C(=O)O Z104474820 [0,0,0,0,1,1|0,0,0]=2 385 B12R1.256 O=C(O)C1=CN=C(C=N1)C(=O)O Z1201621139 [0,0,0,0,1,1|1,0,0]=3 386 B12R1.261 CC(=O)C1=C(C=CC=C1)C(=O)O Z57158791 [0,0,0,0,1,1|1,0,0]=3 387 B12R1.261 N=C(N)C1=C(C=CC=C1)C(=O)O Z3242292796 [0,0,0,0,1,1|2,0,0]=4 388 B12R1.261 NC(=O)C1=C(C=CC=C1)C(=O)N Z104476290 [0,0,0,0,1,1|2,0,0]=4 389 B12R1.261 NC(=O)C1=C(C=CC=N1)C(=O)O Z1142648247 [0,0,0,0,1,1|1,0,0]=3 390 B12R1.261 NC(=O)C1=C(N=CC=N1)C(=O)O Z104493654 [0,0,0,0,1,1|2,0,0]=4 391 B12R1.261 O=C(O)C1=C(C=CC=C1)B(O)O Z1201620947 [0,0,0,0,1,1|1,0,1]=4 392 B12R1.261 O=C(O)C1=C(C=CC=C1)C(=O)O Z57127456 [0,0,0,0,1,1|0,0,0]=2 393 B12R1.261 O=C(O)C1=C(C=CC=C1)[N+](=O)[O-] Z57160141 [0,0,0,0,1,1|1,0,1]=4 394 B12R1.261 O=C(O)C1=C(C=NC=C1)C(=O)O Z1123696308 [0,0,0,0,1,1|0,0,0]=2 395 B12R1.261 O=C(O)C1=C(C=NN=C1)C(=O)O Z1201623771 [0,0,0,0,1,1|1,0,0]=3 396 B12R1.261 O=C(O)C1=C(N=CC=C1)C(=O)O Z57160166 [0,0,0,0,1,1|0,0,0]=2 397 B12R1.261 O=C(O)C1=C(N=CC=N1)C(=O)O Z104492896 [0,0,0,0,1,1|1,0,0]=3 398 B14R1.811 NC(=O)NC1=CC(=CC=C1)CC(=O)O Z1259180502 [0,0,0,0,0,2|2,0,0]=4 399 B14R1.811 O=C(O)CC1=CC=CC(=C1)CC(=O)O Z1255442142 [0,0,0,0,0,2|1,0,0]=3 400 B14R1.6355 CC(=O)C1=CC(=CC=C1)OCC(=O)O Z56921445 [0,0,0,0,0,2|2,0,0]=4 401 B14R1.6355 CC(=O)NCC1=CC(=CC=C1)C(=O)O Z600504462 [0,0,0,0,0,2|2,0,0]=4 402 B14R1.6355 NC(=O)C1=CC(=CC=C1)OCC(=O)O Z295406198 [0,0,0,0,0,2|2,0,0]=4 403 B14R1.6355 NC(=O)COC1=CC(=CC=C1)C(=O)O Z57327766 [0,0,0,0,0,2|2,0,0]=4 404 B14R1.6355 O=C(O)COC1=CC(=CC=C1)C(=O)O Z149152166 [0,0,0,0,0,2|1,0,0]=3