0 B10R1.61 B(c1c(cccn1)C)(O)O BC225233 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.61 B(c1c(cccn1)F)(O)O BC638939 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.61 B(c1ccc[nH]c1=O)(O)O BC600160 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.61 B(c1ccccc1C)(O)O BC210677 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.61 B(c1cccnc1Cl)(O)O BC221865 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.61 B(c1cccnc1F)(O)O BC200360 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.61 B(c1ccncc1F)(O)O BC221864 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.61 B(c1cnccc1C)(O)O BC684701 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.61 CC(=O)c1c(cccn1)F BC227063 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 CC(=O)c1ccccc1Br BC213650 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC(=O)c1ccccc1Cl BC683160 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.61 CC(=O)c1ccccc1F BC227587 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.61 CC(=O)c1cccnc1Cl BC204454 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.61 CC(=O)c1cccnc1N BC200176 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.61 CC(C)c1ccccc1Br BC213522 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.61 CC(C)c1ccccc1N BC222401 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.61 Cc1c(cccn1)C(=O)C BC650807 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.61 Cc1c(cccn1)C(=O)O BC227078 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.61 Cc1c(nccn1)C(=O)C BC210170 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.61 Cc1ccccc1C(=O)Cl BC686297 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.61 Cc1ccccc1C(=O)O BC675262 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.61 Cc1cccnc1C(=O)O BC207538 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.61 Cc1cccnc1[N+](=O)[O-] BC219555 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.61 Cc1cnccc1C(=O)O BC222643 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.61 c1c[nH]cc(c1=O)[N+](=O)[O-] BC201018 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.61 c1cc(c(nc1)C(=O)N)N BC653727 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 c1cc(c(nc1)C(=O)O)Br BC201446 [0,0,0,0,0,0|2,0,0]=2 27 B10R1.61 c1cc(c(nc1)C(=O)O)Cl BC678013 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.61 c1cc(c(nc1)C(=O)O)F BC226669 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.61 c1cc(c(nc1)C(=O)O)N BC220957 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.61 c1cc(c(nc1)C(=O)O)O BC210633 [0,0,0,0,0,0|1,0,0]=1 31 B10R1.61 c1cc(c(nc1)Cl)C(=O)Cl BC206498 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.61 c1cc(c(nc1)Cl)C(=O)O BC227088 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.61 c1cc(c(nc1)F)C(=O)O BC214598 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])Cl BC201213 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])F BC226634 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.61 c1ccc(c(c1)C(=N)N)O BC224168 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.61 c1ccc(c(c1)C(=O)O)O BC221968 [0,0,0,0,0,0|0,0,0]=0 38 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl BC203433 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F BC675797 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])S BC206397 [0,0,0,0,0,0|1,1,1]=3 41 B10R1.61 c1cnc(c(n1)C(=O)O)Cl BC686579 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.61 c1cnc(c(n1)C(=O)O)N BC205346 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.61 c1cnc(c(n1)C(=O)O)O BC205347 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.61 c1cncc(c1Br)C(=O)O BC226654 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.61 c1cncc(c1C(=O)O)N BC208031 [0,0,0,0,0,0|2,0,0]=2 46 B10R1.61 c1cncc(c1F)C(=O)O BC677128 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.61 c1cncc(c1F)[N+](=O)[O-] BC228940 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.61 c1cncc(c1N)C(=O)N BC227114 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.61 c1cncc(c1N)C(=O)O BC208030 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.61 c1cncc(c1N)[N+](=O)[O-] BC202649 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.61 c1cncc(c1O)C(=O)O BC222453 [0,0,0,0,0,0|1,0,0]=1 52 B9R1.6 B(c1ccccc1)(O)O BC207007 [1,0,0,0,0,0|1,0,1]=3 53 B9R1.6 B(c1ccccn1)(O)O BC210694 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.6 B(c1cccnc1)(O)O BC210695 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.6 B(c1ccncc1)(O)O BC208313 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.6 CC(=O)c1ccccc1 BC206207 [1,0,0,0,0,0|1,0,0]=2 57 B9R1.6 CC(=O)c1cccnc1 BC207736 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.6 CC(=O)c1ccncc1 BC204635 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.6 CC(=O)c1cncnc1 BC653324 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.6 CN(c1ccccc1)N BC677890 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.6 C[C@@H](c1ccccc1)N BC676690 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.6 C[C@H](c1ccccc1)N BC226220 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.6 c1c(cncn1)C(=O)O BC227972 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.6 c1c(cncn1)C(=O)O BC674875 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.6 c1cc(cnc1)C(=O)Cl BC650712 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.6 c1cc(cnc1)C(=O)N BC676662 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.6 c1cc(cnc1)C(=O)[O-] BC220349 [1,0,0,0,0,0|1,0,1]=3 68 B9R1.6 c1ccc(cc1)C(=N)N BC228100 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.6 c1ccc(cc1)P(Cl)Cl BC226377 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.6 c1ccnc(c1)C(=O)[O-] BC220351 [1,0,0,0,0,0|1,0,1]=3 71 B9R1.6 c1cnc(cn1)C(=O)Cl BC223499 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.6 c1cnc(cn1)C(=O)O BC676806 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.6 c1cnc(nc1)C(=O)O BC228091 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.6 c1cnccc1C(=N)N BC223492 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.6 c1cncnc1C(=O)O BC201449 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.6 c1cnncc1C(=O)O BC201463 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.15 C#Cc1ccccc1Br BC215310 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.15 CCc1ccccc1Br BC675847 [1,0,0,0,0,0|2,0,1]=4 79 B9R1.15 CNc1ccccc1F BC206749 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.15 Cc1c(cccn1)C=O BC656201 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.15 Cc1ccccc1C#C BC251006 [1,0,0,0,0,0|2,0,1]=4 82 B9R1.15 Cc1ccccc1C#N BC675264 [1,0,0,0,0,0|2,0,1]=4 83 B9R1.15 Cc1cccnc1C=O BC207525 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.15 c1cc(c(nc1)C=O)Br BC227128 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.15 c1cc(c(nc1)C=O)F BC200347 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.15 c1cc(c(nc1)C=O)O BC222334 [1,0,0,0,0,0|1,0,0]=2 87 B9R1.15 c1cc(c(nc1)Cl)C=O BC225225 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.15 c1cc(c(nc1)F)C=O BC208207 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.15 c1cc(c(nc1)N)C=O BC208204 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.15 c1cc(c(nc1)N)CO BC208411 [1,0,0,0,0,0|2,0,1]=4 91 B9R1.15 c1ccc(c(c1)C#N)I BC211028 [1,0,0,0,0,0|2,0,1]=4 92 B9R1.15 c1ccc(c(c1)C#N)N BC227634 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.15 c1ccc(c(c1)C#N)O BC211029 [1,0,0,0,0,0|1,0,1]=3 94 B9R1.15 c1ccc(c(c1)C=O)Br BC227689 [1,0,0,0,0,0|1,0,0]=2 95 B9R1.15 c1ccc(c(c1)CBr)Cl BC226691 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.15 c1ccc(c(c1)CBr)F BC675325 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.15 c1ccc(c(c1)CN)I BC227344 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.15 c1ccc(c(c1)CO)Br BC211129 [1,0,0,0,0,0|1,0,1]=3 99 B9R1.15 c1ccc(c(c1)NN)Br BC685827 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.15 c1cnc(c(n1)C=O)Cl BC670991 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.15 c1cncc(c1Br)C=O BC227127 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 c1cncc(c1C=O)Br BC225219 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.15 c1cncc(c1C=O)N BC208028 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.15 c1cncc(c1CO)Cl BC256219 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.15 c1cncc(c1Cl)CO BC679667 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.15 c1cncc(c1N)C=O BC208029 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.15 c1cncc(c1N)CO BC208026 [1,0,0,0,0,0|2,0,1]=4 108 B11R1.53 B(c1ccccc1CBr)(O)O BC221886 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.53 B(c1ccccc1CC)(O)O BC685300 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.53 B(c1ccccc1OC)(O)O BC210656 [0,1,0,0,0,0|1,0,1]=3 111 B11R1.53 B(c1cnccc1OC)(O)O BC222054 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.53 COc1ccncc1[N+](=O)[O-] BC228951 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.53 c1ccc(c(c1)C(=O)O)NN BC215554 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.53 c1ccc(c(c1)CBr)C(=O)O BC207323 [0,1,0,0,0,0|1,0,0]=2 115 B11R1.53 c1ccc(c(c1)CCl)C(=O)O BC211063 [0,1,0,0,0,0|1,0,0]=2 116 B11R1.53 c1ccc(c(c1)NN)[N+](=O)[O-] BC213411 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.53 c1ccc(c(c1)[N+](=O)[O-])SCl BC215815 [0,1,0,0,0,0|1,1,1]=4 118 B11R1.87 c1ccc(c(c1)C(F)(F)F)O BC207157 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.87 c1ccc(c(c1)S(=O)(=O)Cl)Br BC205190 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.87 c1ccc(c(c1)S(=O)(=O)Cl)I BC228116 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.156 B(c1c(cccc1C)C)(O)O BC210577 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.156 B(c1c(cccc1F)F)(O)O BC210333 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.156 CC(=O)c1c(cccc1Cl)F BC247111 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.156 Cc1c(c(ncn1)C)C(=O)O BC221848 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.156 Cc1cccc(c1C(=O)O)C BC227495 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.156 Cc1cccc(c1C(=O)O)F BC220222 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.156 Cc1cccc(c1C(=O)O)N BC203569 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.156 Cc1cccc(c1[N+](=O)[O-])O BC203683 [0,1,0,0,0,0|1,0,1]=3 129 B11R1.156 Cc1ccnc(c1C(=O)O)C BC200557 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.156 Cc1ccnc(c1[N+](=O)[O-])O BC216430 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.156 c1cc(c(c(c1)Br)C(=O)Cl)F BC227423 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F BC220215 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N BC651950 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.156 c1cc(c(c(c1)Cl)N(=O)=O)F BC201439 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.156 c1cc(c(c(c1)Cl)[N+](=O)[O-])Cl BC210747 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N BC215415 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O BC208246 [0,1,0,0,0,0|0,0,0]=1 138 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])F BC675882 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])N BC684607 [0,1,0,0,0,0|2,0,1]=4 140 B11R1.156 c1cnc(c(c1N)[N+](=O)[O-])O BC228849 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.159 B(c1cccc(c1Cl)F)(O)O BC226756 [0,1,0,0,0,0|2,0,1]=4 142 B11R1.159 B(c1cccc(c1F)F)(O)O BC210331 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.159 CC(=O)c1cccc(c1F)Br BC227617 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.159 CC(=O)c1cccc(c1O)N BC216503 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.159 Cc1c(cccc1F)C(=O)O BC206740 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.159 Cc1c(cccc1O)C(=O)O BC201893 [0,1,0,0,0,0|1,0,0]=2 147 B11R1.159 Cc1cccc(c1Br)C(=O)O BC202429 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.159 Cc1cccc(c1Br)[N+](=O)[O-] BC675977 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.159 Cc1cccc(c1C)C(=O)Cl BC646247 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.159 Cc1cccc(c1Cl)N(=O)=O BC677799 [0,1,0,0,0,0|2,0,1]=4 151 B11R1.159 Cc1cccc(c1F)C(=O)O BC220220 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.159 Cc1cccc(c1F)[N+](=O)[O-] BC206792 [0,1,0,0,0,0|2,0,1]=4 153 B11R1.159 Cc1cccc(c1N)C(=O)C BC649905 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.159 Cc1cccc(c1N)C(=O)O BC210202 [0,1,0,0,0,0|1,0,0]=2 155 B11R1.159 c1cc(c(c(c1)Br)F)[N+](=O)[O-] BC675869 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O BC201159 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O BC666464 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O BC206796 [0,1,0,0,0,0|1,0,0]=2 159 B11R1.159 c1cc(c(c(c1)Cl)N)[N+](=O)[O-] BC203698 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O BC220217 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.159 c1cc(c(c(c1)F)Cl)N(=O)=O BC221733 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O BC227455 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.159 c1cc(c(c(c1)F)F)[N+](=O)[O-] BC675787 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O BC227465 [0,1,0,0,0,0|1,0,0]=2 165 B11R1.159 c1cc(c(c(c1)F)I)[N+](=O)[O-] BC675790 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O BC206752 [0,1,0,0,0,0|1,0,0]=2 167 B11R1.159 c1cc(c(c(c1)F)N)N(=O)=O BC221732 [0,1,0,0,0,0|2,0,1]=4 168 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O BC676253 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.159 c1cc(c(c(c1)N)N)C(=O)N BC212233 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O BC225268 [0,1,0,0,0,0|1,0,0]=2 171 B11R1.159 c1cc(c(c(c1)[N+](=O)[O-])N)N BC213373 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.159 c1cc(n(c(=O)c1)O)C(=O)O BC281774 [0,1,0,0,0,0|1,0,0]=2 173 B11R1.159 c1cnc(c(c1C(=O)O)Cl)F BC214602 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.166 B(c1ccc(cc1C)O)(O)O BC678791 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.166 B(c1ccc(cc1Cl)O)(O)O BC210282 [0,1,0,0,0,0|2,0,1]=4 176 B11R1.166 B(c1ccc(cc1F)Cl)(O)O BC250589 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.166 B(c1ccc(cc1F)F)(O)O BC208385 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.166 CC(=O)c1ccc(cc1Br)Br BC220380 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.166 CC(=O)c1ccc(cc1Br)Cl BC652621 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.166 CC(=O)c1ccc(cc1Br)O BC210243 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.166 CC(=O)c1ccc(cc1Cl)Br BC200637 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.166 CC(=O)c1ccc(cc1Cl)N BC296971 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.166 CC(=O)c1ccc(cc1Cl)O BC209150 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.166 CC(=O)c1ccc(cc1Cl)O BC215805 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.166 CC(=O)c1ccc(cc1F)Br BC658892 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.166 CC(=O)c1ccc(cc1F)Cl BC686320 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.166 CC(=O)c1ccc(cc1F)F BC200226 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.166 CC(=O)c1ccc(cc1F)O BC208072 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.166 CC(=O)c1ccc(cc1O)O BC676988 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.166 Cc1c(ccc(n1)F)C(=O)O BC219214 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.166 Cc1cc(c(cn1)C(=O)O)O BC216112 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.166 Cc1cc(ccc1C(=O)O)Cl BC227504 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F BC206757 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.166 Cc1cc(ncc1C(=O)O)N BC228733 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O BC676276 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] BC678588 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.166 Cc1ccc(c(c1)F)C(=O)O BC225677 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] BC206758 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.166 Cc1ccc(c(c1)N)C(=O)N BC217679 [0,1,0,0,0,0|2,0,0]=3 200 B11R1.166 Cc1ccc(c(c1)N)C(=O)O BC225271 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.166 Cc1ccc(c(c1)O)C(=O)N BC202384 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.166 Cc1ccc(c(n1)O)[N+](=O)[O-] BC208730 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl BC201303 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.166 c1c(cnc(c1Cl)C(=O)O)Cl BC220335 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O BC676270 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.166 c1cc(c(cc1Br)F)C(=O)O BC206179 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.166 c1cc(c(cc1Br)N)C(=O)O BC227467 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O BC210276 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N BC620183 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.166 c1cc(c(cc1F)Br)C(=O)O BC206177 [0,1,0,0,0,0|1,0,0]=2 211 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] BC652333 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] BC226757 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.166 c1cc(c(cc1F)N)C(=O)O BC204309 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] BC206751 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.166 c1cc(c(cc1F)O)C(=O)O BC201515 [0,1,0,0,0,0|0,0,0]=1 216 B11R1.166 c1cc(c(cc1N)F)C(=O)O BC210195 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.166 c1cc(c(cc1N)O)C(=O)O BC205364 [0,1,0,0,0,0|0,0,0]=1 218 B11R1.166 c1cc(c(cc1O)Cl)C(=O)O BC219622 [0,1,0,0,0,0|1,0,0]=2 219 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] BC204313 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl BC218961 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.167 B(c1cc(ccc1O)Cl)(O)O BC670614 [0,1,0,0,0,0|1,0,1]=3 222 B11R1.167 B(c1cc(ccc1O)F)(O)O BC210598 [0,1,0,0,0,0|1,0,1]=3 223 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl BC681076 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.167 CC(=O)c1cc(ccc1Cl)F BC226693 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.167 CC(=O)c1cc(ccc1I)F BC220376 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.167 CC(=O)c1cc(ccc1O)Br BC209997 [0,1,0,0,0,0|1,0,0]=2 227 B11R1.167 Cc1ccc(c(c1)C(=O)N)N BC210204 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br BC676166 [0,1,0,0,0,0|1,0,0]=2 229 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl BC207064 [0,1,0,0,0,0|1,0,0]=2 230 B11R1.167 Cc1ccc(c(c1)C(=O)O)F BC220223 [0,1,0,0,0,0|1,0,0]=2 231 B11R1.167 Cc1ccc(c(c1)C(=O)O)I BC676196 [0,1,0,0,0,0|1,0,0]=2 232 B11R1.167 Cc1ccc(cc1C(=O)O)Br BC222446 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.167 Cc1ccc(cc1C(=O)O)I BC219784 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.167 Cc1ccc(cc1C(=O)O)N BC202438 [0,1,0,0,0,0|1,0,0]=2 235 B11R1.167 Cc1ccc(cc1C(=O)O)O BC202426 [0,1,0,0,0,0|1,0,0]=2 236 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])Br BC206992 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])N BC685798 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br BC686534 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.167 c1c(c(cnc1Cl)N)C(=O)O BC227048 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.167 c1c(c(nnc1Cl)Cl)C(=O)O BC201462 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl BC219210 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.167 c1c(cnc(c1C(=O)O)Cl)F BC219207 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.167 c1c(cnc(c1C(=O)O)F)Cl BC219211 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.167 c1c(cnc(c1C(=O)O)F)F BC214613 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.167 c1c(cnc(c1C(=O)O)N)Cl BC228739 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.167 c1c(cnc(c1C(=O)O)O)Br BC209271 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.167 c1c(cnc(c1C(=O)O)O)F BC219212 [0,1,0,0,0,0|1,0,0]=2 248 B11R1.167 c1c(cnc(c1[N+](=O)[O-])O)Br BC219147 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.167 c1c(cnc(c1[N+](=O)[O-])O)F BC219173 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.167 c1c(nc(c(n1)N)C(=O)O)Br BC655671 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.167 c1cc(c(cc1Br)C(=O)O)Br BC201121 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl BC226435 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.167 c1cc(c(cc1Br)C(=O)O)F BC206180 [0,1,0,0,0,0|1,0,0]=2 254 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])O BC216413 [0,1,0,0,0,0|1,0,1]=3 255 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])Br BC204516 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])F BC206795 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.167 c1cc(c(cc1F)C(=O)O)Br BC206178 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.167 c1cc(c(cc1I)C(=O)O)I BC676267 [0,1,0,0,0,0|1,0,0]=2 259 B11R1.167 c1cc(c(cc1O)C(=O)O)F BC227490 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.167 c1cc(c(cc1O)C(=O)O)N BC214917 [0,1,0,0,0,0|1,0,0]=2 261 B11R1.167 c1cc(c(cc1O)C(=O)[O-])O BC215928 [0,1,0,0,0,0|0,0,1]=2 262 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])Br BC671117 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])F BC677985 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])I BC689299 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.167 c1cc(nc(c1Cl)C(=O)O)Cl BC210323 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.222 COC(=O)c1c(cccn1)Br BC273693 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.222 COC(=O)c1c(cccn1)O BC224094 [0,1,0,0,0,0|1,0,0]=2 268 B11R1.222 COC(=O)c1c(nccn1)N BC210667 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.222 COC(=O)c1cccnc1F BC219216 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.222 COC(=O)c1cnccc1O BC224041 [0,1,0,0,0,0|1,0,0]=2 271 B11R1.222 COC(=O)c1cncnc1O BC223812 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.222 Cc1c(cccn1)C(=O)OC BC225552 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.222 c1ccc(c(c1)C(=O)CN)Br BC201182 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl BC201181 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.222 c1ccc(c(c1)C(=O)CN)F BC201180 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl BC225151 [0,1,0,0,0,0|2,0,0]=3 277 B11R2.1 CC1=CCc2c1cccc2 BC600789 [0,0,0,1,0,0|3,0,0]=4 278 B11R2.1 c1ccc2c(c1)C=CC2=O BC264695 [0,0,0,1,0,0|2,0,0]=3 279 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [0,0,0,1,0,0|2,0,0]=3 280 B11R2.1 c1ccc2c(c1)c(=O)[nH]s2 BC210059 [0,0,0,1,0,0|1,1,0]=3 281 B11R2.1 c1ccc2c(c1)c(c[nH]2)Br BC220142 [0,0,0,1,0,0|3,0,0]=4 282 B11R2.1 c1ccc2c(c1)c(c[nH]2)Cl BC678897 [0,0,0,1,0,0|3,0,0]=4 283 B11R2.1 c1ccc2c(c1)c(c[nH]2)O BC676558 [0,0,0,1,0,0|2,0,0]=3 284 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br BC203656 [0,0,0,1,0,0|3,0,0]=4 285 B11R2.1 c1ccc2c(c1)c(n[nH]2)I BC205463 [0,0,0,1,0,0|3,0,0]=4 286 B11R2.1 c1ccc2c(c1)c(ns2)Cl BC207416 [0,0,0,1,0,0|2,1,0]=4 287 B11R2.1 c1ccc2c(c1)c(ns2)N BC221828 [0,0,0,1,0,0|2,1,0]=4 288 B11R2.1 c1ccc2c(c1)nnn2O BC204387 [0,0,0,1,0,0|3,0,0]=4 289 B11R2.1 c1ccc2c(c1)nnn2O BC675286 [0,0,0,1,0,0|3,0,0]=4 290 B9R1.41 Cc1c(nco1)C(=O)O BC650836 [0,0,0,0,1,0|3,0,0]=4 291 B9R1.41 Cc1c(ncs1)C(=O)O BC652152 [0,0,0,0,1,0|3,0,0]=4 292 B9R1.41 Cc1c(ocn1)C(=O)O BC689523 [0,0,0,0,1,0|3,0,0]=4 293 B9R1.41 Cc1c(scn1)C(=O)O BC679074 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.41 Cn1c(ccn1)C(=O)O BC649926 [0,0,0,0,1,0|3,0,0]=4 295 B9R1.41 Cn1cncc1C(=O)O BC220093 [0,0,0,0,1,0|3,0,0]=4 296 B9R1.41 c1[nH]c(c(n1)C(=O)N)O BC676738 [0,0,0,0,1,0|3,0,0]=4 297 B9R1.41 c1csc(c1C(=O)O)F BC655882 [0,0,0,0,1,0|2,0,0]=3 298 B9R1.41 c1csc(c1N)C(=O)O BC288632 [0,0,0,0,1,0|2,0,0]=3 299 B11R1.86 CC(=O)Cc1ccccc1Br BC202120 [0,0,0,0,0,1|2,0,0]=3 300 B11R1.86 c1ccc(c(c1)CC(=O)Cl)F BC204059 [0,0,0,0,0,1|2,0,0]=3 301 B11R1.86 c1ccc(c(c1)CC(=O)O)Br BC210254 [0,0,0,0,0,1|1,0,0]=2 302 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl BC675213 [0,0,0,0,0,1|1,0,0]=2 303 B8R1.2 C=Cc1cccnc1 BC675972 [2,0,0,0,0,0|2,0,0]=4 304 B8R1.2 [C-]#[N+]c1ccccc1 BC297263 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.2 c1c(cncn1)C=O BC200327 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.2 c1cc(cnc1)C=O BC221128 [2,0,0,0,0,0|1,0,0]=3 307 B8R1.2 c1cc(cnc1)CO BC209311 [2,0,0,0,0,0|1,0,1]=4 308 B8R1.2 c1cc(nnc1)C=O BC667339 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.2 c1ccc(cc1)CBr BC220250 [2,0,0,0,0,0|1,0,1]=4 310 B8R1.2 c1ccc(cc1)CCl BC210975 [2,0,0,0,0,0|1,0,1]=4 311 B8R1.2 c1ccc(cc1)CO BC222892 [2,0,0,0,0,0|0,0,1]=3 312 B8R1.2 c1ccc(cc1)N=O BC684726 [2,0,0,0,0,0|1,0,0]=3 313 B8R1.2 c1ccc(cc1)[Mg]Br BC653680 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.2 c1cnc(cn1)C=O BC681558 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.2 c1cnc(nc1)C=O BC228094 [2,0,0,0,0,0|2,0,0]=4 316 B8R1.2 c1cncnc1C=O BC652156 [2,0,0,0,0,0|2,0,0]=4 317 B8R1.5 Cc1c(cccn1)O BC225229 [2,0,0,0,0,0|1,0,1]=4 318 B8R1.5 Cc1cccnc1O BC225228 [2,0,0,0,0,0|1,0,1]=4 319 B8R1.5 Cc1ccncc1O BC656328 [2,0,0,0,0,0|1,0,1]=4 320 B8R1.5 c1c(c(=O)nc[nH]1)O BC655988 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.5 c1cc(c(nc1)Br)O BC206638 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.5 c1cc(c(nc1)Cl)O BC206637 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.5 c1cc(c(nc1)F)O BC677131 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.5 c1cc(c(nc1)I)O BC206480 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.5 c1cc(c(nc1)N)O BC227987 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.5 c1cc(c(nc1)O)F BC202279 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.5 c1cc(c(nc1)O)N BC202198 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.5 c1cc(c(nc1)O)O BC209278 [2,0,0,0,0,0|1,0,0]=3 329 B8R1.5 c1ccc(c(c1)N)Br BC677892 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.5 c1ccc(c(c1)N)I BC213646 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.5 c1ccc(c(c1)N)S BC250051 [2,0,0,0,0,0|1,1,0]=4 332 B8R1.5 c1ccc(c(c1)O)I BC213644 [2,0,0,0,0,0|1,0,0]=3 333 B8R1.5 c1ccc(c(c1)O)O BC205707 [2,0,0,0,0,0|0,0,0]=2 334 B8R1.5 c1cncc(c1Br)O BC228930 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.5 c1cncc(c1I)O BC212690 [2,0,0,0,0,0|2,0,0]=4 336 B8R1.5 c1cncc(c1N)O BC228924 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.5 c1cncc(c1O)N BC201447 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.5 c1cncc(c1O)O BC678752 [2,0,0,0,0,0|1,0,0]=3 339 B10R1.13 B(c1ccc(cc1)Br)(O)O BC685826 [1,1,0,0,0,0|1,0,1]=4 340 B10R1.13 B(c1ccc(cc1)C)(O)O BC210678 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.13 B(c1ccc(cc1)Cl)(O)O BC677573 [1,1,0,0,0,0|1,0,1]=4 342 B10R1.13 B(c1ccc(cc1)F)(O)O BC227618 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.13 CC(=O)c1ccc(cc1)Br BC227589 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.13 CC(=O)c1ccc(cc1)Cl BC676864 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.13 CC(=O)c1ccc(cc1)F BC204121 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.13 CC(=O)c1ccc(cc1)O BC675526 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.13 CC(=O)c1ccc(cn1)Br BC655306 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.13 CC(=O)c1ccc(nc1)Br BC225222 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.13 CC(=O)c1ccc(nc1)Cl BC200352 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.13 Cc1ccc(cc1)C(=O)O BC675261 [1,1,0,0,0,0|0,0,0]=2 351 B10R1.13 Cc1ccc(cn1)C(=O)C BC678853 [1,1,0,0,0,0|2,0,0]=4 352 B10R1.13 Cc1ccc(cn1)C(=O)O BC227043 [1,1,0,0,0,0|1,0,0]=3 353 B10R1.13 Cc1ccc(nc1)C(=O)O BC207540 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.13 Cc1cnc(cn1)C(=O)O BC675245 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.13 Cc1ncc(cn1)C(=O)O BC228072 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.13 c1c(cnc(n1)C(=O)O)Br BC222390 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.13 c1c(ncc(n1)Cl)C(=O)O BC220986 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.13 c1c(ncc(n1)O)C(=O)O BC220987 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.13 c1cc(ccc1C(=N)N)N BC213772 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.13 c1cc(ccc1C(=N)N)O BC223815 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.13 c1cc(ccc1C(=O)N)O BC219028 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.13 c1cc(ccc1C(=O)O)I BC210636 [1,1,0,0,0,0|0,0,0]=2 363 B10R1.13 c1cc(ccc1C(=O)O)N BC227499 [1,1,0,0,0,0|0,0,0]=2 364 B10R1.13 c1cc(ccc1C(=O)O)O BC228180 [1,1,0,0,0,0|0,0,0]=2 365 B10R1.13 c1cc(ccc1F)S(=O)[O-] BC200582 [1,1,0,0,0,0|1,0,1]=4 366 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] BC203717 [1,1,0,0,0,0|1,0,1]=4 367 B10R1.13 c1cc(ncc1Br)C(=O)O BC213733 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.13 c1cc(ncc1C(=O)O)F BC214606 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.13 c1cc(ncc1C(=O)O)N BC213736 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.13 c1cc(ncc1C(=O)O)O BC215635 [1,1,0,0,0,0|1,0,0]=3 371 B10R1.13 c1cc(ncc1Cl)C(=O)O BC224603 [1,1,0,0,0,0|1,0,0]=3 372 B10R1.13 c1cc(ncc1F)C(=O)O BC224604 [1,1,0,0,0,0|1,0,0]=3 373 B10R1.13 c1cc(ncc1N)C(=O)N BC228144 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.13 c1cc(ncc1N)C(=O)O BC210785 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.13 c1cc(ncc1O)C(=O)O BC224042 [1,1,0,0,0,0|1,0,0]=3 376 B10R1.13 c1cc(nnc1C(=O)O)Cl BC686205 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.15 C#CC(c1ccccc1)O BC218343 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.15 COC(=O)c1ccncc1 BC205546 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.15 COC(=O)c1cnccn1 BC205804 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.15 COC(=O)c1ncccn1 BC228090 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.15 c1ccc(cc1)C(=O)CN BC222358 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.15 c1ccc(cc1)C(CCl)O BC651818 [1,1,0,0,0,0|1,0,1]=4 383 B10R1.15 c1ccc(cc1)[C@H](CO)N BC204938 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.15 c1ccnc(c1)C(=O)CBr BC684167 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.15 c1cnccc1C(=O)CBr BC677150 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.15 c1cnccc1C(=O)NN BC204682 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.28 c1cc(cnc1)S(=O)(=O)O BC226070 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.28 c1ccc(cc1)S(=O)(=O)Cl BC204660 [1,1,0,0,0,0|1,0,1]=4 389 B10R1.28 c1ccnc(c1)S(=O)(=O)O BC219768 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.113 B(c1cccc(c1)C)(O)O BC219834 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.113 B(c1cccc(c1)Cl)(O)O BC205354 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.113 CC(=O)c1cc(cnc1)Br BC200353 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.113 CC(=O)c1cccc(c1)Br BC217580 [1,1,0,0,0,0|1,0,0]=3 394 B10R1.113 CC(=O)c1cccc(n1)Br BC225218 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.113 C[n+]1cccc(c1)C(=O)N BC229164 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.113 Cc1cc(cnc1)C(=O)O BC212576 [1,1,0,0,0,0|1,0,0]=3 397 B10R1.113 Cc1cccc(n1)C(=O)O BC210679 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.113 Cc1ccnc(c1)C(=O)C BC217946 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.113 Cc1nccc(n1)C(=O)O BC684779 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.113 c1c(cncc1Br)C(=O)O BC213725 [1,1,0,0,0,0|1,0,0]=3 401 B10R1.113 c1c(cncc1F)C(=O)O BC228161 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.113 c1c(cncc1N)C(=O)O BC207804 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.113 c1c(cncc1O)C(=O)O BC206883 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.113 c1c(nc(cn1)Cl)C(=O)O BC686580 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.113 c1c(ncnc1Cl)C(=O)O BC652478 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.113 c1c(ncnc1O)C(=O)O BC202213 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] BC228014 [1,1,0,0,0,0|1,0,1]=4 408 B10R1.113 c1cc(cc(c1)Cl)C(=O)O BC225403 [1,1,0,0,0,0|0,0,0]=2 409 B10R1.113 c1cc(cc(c1)O)C(=O)O BC676293 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.113 c1cc(nc(c1)Br)C(=O)O BC207990 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.113 c1cc(nc(c1)Cl)C(=O)O BC213732 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.113 c1cc(nc(c1)N)C(=O)O BC220442 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.113 c1cnc(cc1Br)C(=O)O BC208210 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.113 c1cnc(cc1C(=O)O)Br BC207062 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.113 c1cnc(cc1C(=O)O)Cl BC209274 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.113 c1cnc(cc1C(=O)O)N BC220337 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.113 c1cnc(cc1Cl)C(=O)O BC202385 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.113 c1cnc(cc1N)C(=O)O BC651732 [1,1,0,0,0,0|1,0,0]=3 419 B10R1.113 c1cnc(nc1C(=O)O)Cl BC266406 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.2 Cc1cccc(c1F)C=O BC201155 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.2 c1cc(c(c(c1)Br)O)C=O BC651712 [1,1,0,0,0,0|0,0,0]=2 422 B10R1.2 c1cc(c(c(c1)Cl)Cl)C=O BC201116 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.2 c1cc(c(c(c1)F)Br)CO BC250320 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.2 c1cc(c(c(c1)F)Cl)C=O BC675904 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.2 c1cc(c(c(c1)F)O)C=O BC215402 [1,1,0,0,0,0|0,0,0]=2 426 B10R1.2 c1cc(c(c(c1)O)O)C#N BC211982 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.2 c1cc(c(c(c1)O)O)C=O BC213342 [1,1,0,0,0,0|0,0,0]=2 428 B10R1.4 c1ccc(c(c1)CCO)N BC202238 [1,1,0,0,0,0|1,0,1]=4 429 B10R1.4 c1ccc(c(c1)N=C=O)Cl BC210104 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.20 COc1ccccc1CCl BC250917 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.20 COc1cccnc1C=O BC208209 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.20 c1cc(c(nc1)CN)C=O BC207494 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.25 C=Cc1ccc(cc1F)F BC227581 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.25 CCc1ccc(cc1O)O BC201065 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.25 COc1ccc(cc1O)Br BC678376 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.25 Cc1cc(ccc1C=O)F BC211665 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.25 Cc1cc(ccc1C=O)O BC215465 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.25 Cc1ccc(c(c1)Br)C=O BC675522 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.25 Cc1ccc(c(c1)Cl)C=O BC658832 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.25 Cc1ccc(c(c1)F)C=O BC211664 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.25 c1cc(c(cc1Br)Cl)C=O BC227733 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.25 c1cc(c(cc1Br)F)C=O BC227694 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.25 c1cc(c(cc1Br)O)C=O BC675928 [1,1,0,0,0,0|0,0,0]=2 444 B10R1.25 c1cc(c(cc1Cl)Br)C=O BC658860 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.25 c1cc(c(cc1Cl)F)CO BC226999 [1,1,0,0,0,0|1,0,1]=4 446 B10R1.25 c1cc(c(cc1Cl)O)C=O BC676335 [1,1,0,0,0,0|0,0,0]=2 447 B10R1.25 c1cc(c(cc1F)O)C=O BC215403 [1,1,0,0,0,0|0,0,0]=2 448 B10R1.25 c1cc(c(cc1N)O)C#N BC236841 [1,1,0,0,0,0|1,0,1]=4 449 B10R1.25 c1cc(c(cc1O)Cl)C=O BC676095 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.25 c1cc(c(cc1O)O)C=O BC676081 [1,1,0,0,0,0|0,0,0]=2 451 B10R1.25 c1cc(nc(c1C=O)Cl)Cl BC227133 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.30 C=Cc1cc(ccc1F)F BC227583 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.30 COc1cc(ccc1O)O BC222291 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.30 Cc1ccc(cc1C=O)Br BC652501 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.30 c1c(cnc(c1C=O)F)Cl BC219160 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.30 c1c(cnc(c1C=O)N)Br BC645798 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.30 c1cc(c(cc1Br)C#N)O BC227674 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.30 c1cc(c(cc1Br)C=O)Cl BC679792 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.30 c1cc(c(cc1Br)C=O)F BC207196 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.30 c1cc(c(cc1Br)CO)F BC226996 [1,1,0,0,0,0|1,0,1]=4 461 B10R1.30 c1cc(c(cc1Cl)C=O)N BC676094 [1,1,0,0,0,0|1,0,0]=3 462 B10R1.30 c1cc(c(cc1F)C=O)Cl BC211666 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.30 c1cc(c(cc1F)C=O)I BC676078 [1,1,0,0,0,0|1,0,0]=3 464 B10R1.30 c1cc(c(cc1F)C=O)O BC215404 [1,1,0,0,0,0|0,0,0]=2 465 B10R1.30 c1cc(c(cc1I)CO)Cl BC600271 [1,1,0,0,0,0|1,0,1]=4 466 B10R1.30 c1cc(c(cc1O)C=O)Br BC226695 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.30 c1cc(c(cc1O)C=O)F BC227713 [1,1,0,0,0,0|1,0,0]=3 468 B10R1.245 C=Cc1c(cccc1F)F BC652145 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.245 Cc1cccc(c1CO)C BC207403 [1,1,0,0,0,0|1,0,1]=4 470 B10R1.245 c1cc(c(c(c1)Br)C=O)F BC675903 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.245 c1cc(c(c(c1)Cl)C=O)Cl BC676083 [1,1,0,0,0,0|1,0,0]=3 472 B10R1.245 c1cc(c(c(c1)F)C=O)O BC227715 [1,1,0,0,0,0|0,0,0]=2 473 B10R1.245 c1cnc(c(c1I)C=O)Cl BC226663 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.192 c1(c(nsc1S)O)C(=O)O BC207771 [0,1,0,0,1,0|2,0,0]=4 475 B12R1.75 COc1ccccc1CC(=O)O BC651642 [0,1,0,0,0,1|0,0,0]=2 476 B12R1.75 c1ccc(c(c1)CC(=O)O)CCl BC201437 [0,1,0,0,0,1|1,0,0]=3 477 B12R1.75 c1ccc(c(c1)CC(=O)O)CN BC225203 [0,1,0,0,0,1|1,0,0]=3 478 B12R1.124 c1ccc(c(c1)C(=O)C(=O)O)Cl BC206411 [0,1,0,0,0,1|1,0,0]=3 479 B12R1.124 c1ccc(c(c1)C(C(=O)O)Br)Cl BC210231 [0,1,0,0,0,1|1,0,0]=3 480 B12R1.124 c1ccc(c(c1)C(C(=O)O)N)Cl BC203687 [0,1,0,0,0,1|1,0,0]=3 481 B12R1.124 c1ccc(c(c1)C(C(=O)O)O)Cl BC202424 [0,1,0,0,0,1|1,0,0]=3 482 B12R1.127 c1cc(c(cc1Br)CC(=O)O)F BC206445 [0,1,0,0,0,1|1,0,0]=3 483 B12R1.224 c1cc(c(c(c1)F)F)CC(=O)O BC205418 [0,1,0,0,0,1|1,0,0]=3 484 B12R1.233 Cc1cc(ccc1CC(=O)O)F BC676492 [0,1,0,0,0,1|1,0,0]=3 485 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O BC219231 [0,1,0,0,0,1|1,0,0]=3 486 B12R1.233 c1cc(c(cc1Cl)Br)CC(=O)O BC219230 [0,1,0,0,0,1|1,0,0]=3 487 B12R1.233 c1cc(c(cc1Cl)Cl)CC(=O)O BC678373 [0,1,0,0,0,1|1,0,0]=3 488 B12R1.233 c1cc(c(cc1F)Br)CC(=O)O BC219229 [0,1,0,0,0,1|1,0,0]=3 489 B12R1.233 c1cc(c(cc1N)F)CC(=O)O BC218636 [0,1,0,0,0,1|1,0,0]=3 490 B12R1.233 c1cc(c(cc1O)F)CC(=O)O BC676509 [0,1,0,0,0,1|1,0,0]=3 491 B12R1.1009 Cc1cccc(c1OC(=O)O)C BC201471 [0,1,0,0,0,1|1,0,0]=3 492 B12R1.1009 c1cc(c(c(c1)Br)CC(=O)O)Br BC201109 [0,1,0,0,0,1|1,0,0]=3 493 B12R1.46 B(c1cc(ccc1OC)Cl)(O)O BC672227 [0,2,0,0,0,0|1,0,1]=4 494 B12R1.46 COc1c(cc(cn1)F)C(=O)O BC219213 [0,2,0,0,0,0|1,0,0]=3 495 B12R1.46 COc1ccc(cc1C(=O)O)Br BC676168 [0,2,0,0,0,0|0,0,0]=2 496 B12R1.46 COc1ccc(cc1C(=O)O)F BC227488 [0,2,0,0,0,0|0,0,0]=2 497 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Cl BC676576 [0,2,0,0,0,0|1,0,1]=4 498 B12R1.46 COc1ccc(cc1[N+](=O)[O-])N BC205368 [0,2,0,0,0,0|1,0,1]=4 499 B12R1.46 Cc1ccc(c(c1)C(=O)O)OC BC208222 [0,2,0,0,0,0|0,0,0]=2 500 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])OC BC219777 [0,2,0,0,0,0|1,0,1]=4 501 B12R1.57 B(c1ccc(cc1OC)Cl)(O)O BC210287 [0,2,0,0,0,0|1,0,1]=4 502 B12R1.57 COc1cc(ccc1C(=O)O)O BC205210 [0,2,0,0,0,0|0,0,0]=2 503 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F BC686447 [0,2,0,0,0,0|1,0,1]=4 504 B12R1.57 c1cc(c(cc1Cl)NN)C(=O)O BC646048 [0,2,0,0,0,0|1,0,0]=3 505 B12R1.77 COC(=O)c1ccccc1CBr BC204417 [0,2,0,0,0,0|1,0,0]=3 506 B12R1.77 COc1ccccc1C(=O)CBr BC652176 [0,2,0,0,0,0|1,0,0]=3 507 B12R1.87 COc1c(cccc1Br)N(=O)=O BC227844 [0,2,0,0,0,0|1,0,1]=4 508 B12R1.261 B(c1ccccc1C(=O)O)(O)O BC210262 [0,2,0,0,0,0|0,0,0]=2 509 B12R1.261 B(c1ccccc1[N+](=O)[O-])(O)O BC684888 [0,2,0,0,0,0|1,0,1]=4 510 B12R1.261 c1cc(c(nc1)C(=O)O)C(=O)O BC203300 [0,2,0,0,0,0|1,0,0]=3 511 B12R1.261 c1cc(c(nc1)C(=O)O)[N+](=O)[O-] BC670781 [0,2,0,0,0,0|1,0,1]=4 512 B12R1.261 c1cnc(c(n1)C(=O)O)C(=O)O BC654144 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.261 c1cncc(c1C(=O)O)C(=O)O BC212242 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.283 CCOc1ccccc1C(=N)N BC209349 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.437 COc1cccc(c1C(=O)O)N BC676500 [0,2,0,0,0,0|0,0,0]=2 516 B12R1.128 Cc1ccc(c(c1)S(=O)(=O)O)N BC219398 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.128 c1cc(c(cc1O)S(=O)(=O)[O-])O BC203791 [0,2,0,0,0,0|1,0,1]=4 518 B12R1.128 c1cc(c(cc1O)S(=O)(=O)[O-])O BC215905 [0,2,0,0,0,0|1,0,1]=4 519 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)Cl BC209227 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.894 c1cc(c(c(c1Cl)C(=O)O)N)Cl BC291132 [0,2,0,0,0,0|1,0,0]=3 521 B12R1.894 c1cc(c(c(c1Cl)C(=O)O)O)Cl BC204068 [0,2,0,0,0,0|0,0,0]=2 522 B12R1.894 c1cc(c(c(c1F)Cl)C(=O)O)Cl BC211060 [0,2,0,0,0,0|1,0,0]=3 523 B12R1.894 c1cc(c(c(c1N)C(=O)O)F)F BC208124 [0,2,0,0,0,0|1,0,0]=3 524 B12R1.1000 B(c1c(cc(cc1O)Cl)C)(O)O BC620158 [0,2,0,0,0,0|1,0,1]=4 525 B12R1.1000 Cc1cc(cc(c1C(=O)C)O)O BC211153 [0,2,0,0,0,0|1,0,0]=3 526 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)F BC658797 [0,2,0,0,0,0|1,0,0]=3 527 B12R1.1000 c1c(cc(c(c1Cl)C(=O)Cl)Cl)Cl BC652434 [0,2,0,0,0,0|2,0,0]=4 528 B12R1.1000 c1c(cc(c(c1Cl)C(=O)O)Cl)Cl BC678272 [0,2,0,0,0,0|1,0,0]=3 529 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br BC205490 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.1000 c1c(cc(c(c1O)[N+](=O)[O-])F)F BC684698 [0,2,0,0,0,0|1,0,1]=4 531 B12R1.3441 c1cc(c(c(c1)Cl)C(=O)NN)F BC211458 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.24 COC(=O)c1cccc(c1O)F BC676186 [0,2,0,0,0,0|0,0,0]=2 533 B12R1.24 Cc1c(cccc1Br)C(=O)OC BC217097 [0,2,0,0,0,0|1,0,0]=3 534 B12R1.24 Cc1c(cccc1N)C(=O)OC BC203495 [0,2,0,0,0,0|1,0,0]=3 535 B12R1.24 Cc1cccc(c1Br)C(=O)OC BC225093 [0,2,0,0,0,0|1,0,0]=3 536 B12R1.440 CC(=O)c1cccc(c1N)OC BC649903 [0,2,0,0,0,0|2,0,0]=4 537 B12R1.440 COc1cccc(c1N)C(=O)O BC676499 [0,2,0,0,0,0|1,0,0]=3 538 B12R1.511 Cc1cc(cc(c1N)C(=O)O)Cl BC213361 [0,2,0,0,0,0|1,0,0]=3 539 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)Br BC205484 [0,2,0,0,0,0|1,0,0]=3 540 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)N BC205496 [0,2,0,0,0,0|1,0,0]=3 541 B12R1.511 c1c(cc(c(c1C(=O)O)O)Br)Br BC676269 [0,2,0,0,0,0|0,0,0]=2 542 B12R1.893 c1c(c(c(c(n1)F)F)Cl)C(=O)O BC214608 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br BC208153 [0,2,0,0,0,0|1,0,0]=3 544 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)I BC208155 [0,2,0,0,0,0|1,0,0]=3 545 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N BC208251 [0,2,0,0,0,0|1,0,0]=3 546 B12R1.232 CC(=O)c1cc(c(cc1N)Br)F BC649921 [0,2,0,0,0,0|2,0,0]=4 547 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F BC676282 [0,2,0,0,0,0|1,0,0]=3 548 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O BC220174 [0,2,0,0,0,0|0,0,0]=2 549 B12R1.232 Cc1cc(c(cc1O)C)C(=O)O BC600009 [0,2,0,0,0,0|1,0,0]=3 550 B12R1.232 c1c(c(cc(c1Cl)Cl)F)C(=O)O BC227472 [0,2,0,0,0,0|1,0,0]=3 551 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O BC676485 [0,2,0,0,0,0|1,0,0]=3 552 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O BC220227 [0,2,0,0,0,0|1,0,0]=3 553 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O BC676249 [0,2,0,0,0,0|1,0,0]=3 554 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O BC201128 [0,2,0,0,0,0|1,0,0]=3 555 B12R1.452 COc1ccc(c(c1)Cl)C(=O)O BC225273 [0,2,0,0,0,0|1,0,0]=3 556 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl BC227434 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] BC671121 [0,2,0,0,0,0|1,0,1]=4 558 B12R1.452 c1cc(c(cc1C#N)O)[N+](=O)[O-] BC208107 [0,2,0,0,0,0|1,0,1]=4 559 B12R1.1703 COC(=O)c1ccc(cc1N)Br BC676481 [0,2,0,0,0,0|1,0,0]=3 560 B12R1.1703 COC(=O)c1ccc(cc1O)O BC649964 [0,2,0,0,0,0|0,0,0]=2 561 B12R1.1703 COC(=O)c1cnc(cc1Cl)Cl BC677895 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.1703 Cc1cc(ccc1C(=O)OC)N BC676769 [0,2,0,0,0,0|1,0,0]=3 563 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)OC BC204333 [0,2,0,0,0,0|1,0,0]=3 564 B12R1.1703 Cc1ccc(c(c1)O)C(=O)OC BC220828 [0,2,0,0,0,0|0,0,0]=2 565 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CN BC201179 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.1703 c1cc(c(cc1Cl)Cl)\C(=N\O)\N BC256318 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.1703 c1cc(c(cc1F)F)C(=O)CBr BC224376 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.354 COC(=O)c1cc(ccc1I)Br BC689468 [0,2,0,0,0,0|1,0,0]=3 569 B12R1.354 COC(=O)c1cc(ccc1O)I BC688582 [0,2,0,0,0,0|0,0,0]=2 570 B12R1.354 COC(=O)c1cc(ccc1O)N BC222665 [0,2,0,0,0,0|0,0,0]=2 571 B12R1.354 COC(=O)c1cc(cnc1Cl)Br BC679663 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.354 COC(=O)c1cc(cnc1N)Cl BC216973 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.354 COC(=O)c1cc(cnc1N)I BC256321 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.354 COC(=O)c1cc(ncc1Br)Cl BC645915 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.354 Cc1ccc(cc1C(=O)OC)Br BC225096 [0,2,0,0,0,0|1,0,0]=3 576 B12R1.354 Cc1ccc(cc1C(=O)OC)N BC202432 [0,2,0,0,0,0|1,0,0]=3 577 B12R1.354 Cc1ccc(cc1C(=O)OC)O BC245021 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.354 Cc1ccc(nc1C(=O)OC)Cl BC273783 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.354 c1cc(c(cc1F)C(=O)CCl)F BC207308 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.453 COc1ccc(c(c1)C(=O)O)F BC227487 [0,2,0,0,0,0|1,0,0]=3 581 B12R1.453 COc1ccc(c(c1)C(=O)O)N BC210200 [0,2,0,0,0,0|1,0,0]=3 582 B12R1.453 COc1ccc(c(c1)C(=O)O)O BC211020 [0,2,0,0,0,0|0,0,0]=2 583 B12R1.453 Cc1ccc(cc1C(=O)O)OC BC202425 [0,2,0,0,0,0|1,0,0]=3 584 B12R1.453 c1cc(c(cc1C=O)[N+](=O)[O-])O BC225482 [0,2,0,0,0,0|1,0,1]=4 585 B12R1.308 CCOC(=O)c1c(cccn1)N BC681195 [0,2,0,0,0,0|2,0,0]=4 586 B12R1.308 CCOC(=O)c1cnccc1O BC224109 [0,2,0,0,0,0|1,0,0]=3 587 B12R1.308 CCOC(=O)c1cncnc1O BC205004 [0,2,0,0,0,0|2,0,0]=4 588 B10R1.10 c1cc(cc(c1)O)\C=C\Br BC600241 [0,0,1,1,0,0|2,0,0]=4 589 B10R1.18 c1ccnc(c1)CC(=O)O BC210696 [0,0,1,1,0,0|1,0,1]=4 590 B10R1.18 c1ccnc(c1)CC(=O)O BC653678 [0,0,1,1,0,0|1,0,1]=4 591 B10R1.8 c1c(cc(cc1O)O)C=O BC201352 [0,0,1,1,0,0|2,0,0]=4 592 B10R2.320 c1ccc2c(c1)CC2=O BC225121 [1,0,0,1,0,0|1,0,0]=3 593 B10R2.7 c1ccc2c(c1)CC=C2 BC218987 [1,0,0,1,0,0|2,0,0]=4 594 B10R2.7 c1ccc2c(c1)CCO2 BC207982 [1,0,0,1,0,0|1,0,1]=4 595 B10R2.7 c1ccc2c(c1)cn[nH]2 BC226232 [1,0,0,1,0,0|2,0,0]=4 596 B10R2.7 c1ccc2c(c1)nco2 BC200554 [1,0,0,1,0,0|2,0,0]=4 597 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 BC681993 [0,0,0,1,0,1|2,0,0]=4 598 B12R2.24 c1ccc2c(c1)ccc(=O)[nH]2 BC211913 [0,0,0,1,0,1|2,0,0]=4 599 B12R2.24 c1ccc2cc(ccc2c1)O BC676809 [0,0,0,1,0,1|2,0,0]=4 600 B12R2.202 c1cc(c2c(c1)sc(n2)N)O BC677315 [0,0,0,1,0,1|1,1,0]=4 601 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 BC676544 [0,0,0,1,0,1|2,0,0]=4 602 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 BC676530 [0,0,0,1,0,1|2,0,0]=4 603 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 BC206961 [0,0,0,1,0,1|2,0,0]=4 604 B12R2.202 c1cc2c(c(c1)Cl)nc(s2)O BC204014 [0,0,0,1,0,1|1,1,0]=4 605 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 BC218996 [0,0,0,1,0,1|2,0,0]=4 606 B12R2.202 c1cc2c(c(c1)I)CC(=O)N2 BC253972 [0,0,0,1,0,1|2,0,0]=4 607 B12R2.3190 c1ccc2c(c1)CC2C(=O)O BC225119 [0,0,0,1,0,1|1,0,0]=3 608 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 BC208640 [0,1,0,1,0,0|1,0,0]=3 609 B12R2.1081 c1ccc2c(c1)CCNC2=O BC213850 [0,1,0,1,0,0|2,0,0]=4 610 B12R2.1081 c1ccc2c(c1)c(ccn2)O BC201034 [0,1,0,1,0,0|2,0,0]=4 611 B12R2.1081 c1ccc2c(c1)cccc2O BC219532 [0,1,0,1,0,0|2,0,0]=4 612 B12R2.1081 c1ccc2c(c1)ccnc2O BC206114 [0,1,0,1,0,0|2,0,0]=4 613 B12R2.1395 c1cc2c(c(c1)C(=O)O)CC2 BC227819 [0,1,0,1,0,0|1,0,0]=3 614 B12R2.2028 c1ccc2c(c1)C(=O)NC2=O BC226331 [0,1,0,1,0,0|1,0,1]=4 615 B12R2.2028 c1ccc2c(c1)C(=O)[N-]C2=O BC225493 [0,1,0,1,0,0|1,0,1]=4 616 B12R2.2028 c1ccc2c(c1)C(OC2=O)Br BC220361 [0,1,0,1,0,0|1,0,0]=3 617 B12R2.2028 c1ccc2c(c1)C(OC2=O)Cl BC222347 [0,1,0,1,0,0|1,0,0]=3 618 B12R2.2028 c1cncc2c1C(=O)OC2=O BC212241 [0,1,0,1,0,0|1,0,1]=4 619 B12R2.203 Cc1cccc2c1C(=O)CC2 BC688379 [0,1,0,1,0,0|2,0,0]=4 620 B12R2.203 c1cc2c(c(c1)Br)C(=O)CC2 BC652362 [0,1,0,1,0,0|2,0,0]=4 621 B12R2.203 c1cc2c(c(c1)Cl)C(=O)CC2 BC677426 [0,1,0,1,0,0|2,0,0]=4 622 B12R2.203 c1cc2c(c(c1)O)C(=O)CC2 BC687634 [0,1,0,1,0,0|1,0,0]=3 623 B12R2.196 c1cc2c(c(c1)Br)CCC2=O BC677084 [0,1,0,1,0,0|2,0,0]=4 624 B12R2.196 c1cc2c(c(c1)Br)CNC2=O BC682229 [0,1,0,1,0,0|2,0,0]=4 625 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O BC676446 [0,1,0,1,0,0|2,0,0]=4 626 B12R2.196 c1cc2c(c(c1)O)CCC2=O BC687631 [0,1,0,1,0,0|2,0,0]=4 627 B12R2.612 Cc1ccc2c(c1)CCC2=O BC218986 [0,1,0,1,0,0|2,0,0]=4 628 B12R2.612 c1cc2c(cc1Br)CCC2=O BC210245 [0,1,0,1,0,0|2,0,0]=4 629 B12R2.612 c1cc2c(cc1Br)OCC2=O BC649882 [0,1,0,1,0,0|1,0,0]=3 630 B12R2.612 c1cc2c(cc1Cl)CCC2=O BC200429 [0,1,0,1,0,0|2,0,0]=4 631 B12R2.612 c1cc2c(cc1Cl)OCC2=O BC681113 [0,1,0,1,0,0|1,0,0]=3 632 B12R2.612 c1cc2c(cc1F)CCC2=O BC202173 [0,1,0,1,0,0|2,0,0]=4 633 B12R2.612 c1cc2c(cc1N)CCC2=O BC219807 [0,1,0,1,0,0|2,0,0]=4 634 B12R2.612 c1cc2c(cc1O)CCC2=O BC200684 [0,1,0,1,0,0|2,0,0]=4 635 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 BC219907 [0,1,0,1,0,0|2,0,0]=4 636 B12R2.132 c1cc2c(cc1F)C(=O)CC2 BC218979 [0,1,0,1,0,0|2,0,0]=4 637 B12R2.132 c1cc2c(cc1O)C(=O)CC2 BC218980 [0,1,0,1,0,0|2,0,0]=4 638 B12R2.132 c1cc2c(cc1S)C(=O)NC2 BC655032 [0,1,0,1,0,0|2,0,0]=4 639 B12R2.1 c1ccc2c(c1)c(c[nH]2)C=O BC220141 [0,1,0,1,0,0|2,0,0]=4 640 B12R2.1 c1ccc2c(c1)c(c[nH]2)CO BC226969 [0,1,0,1,0,0|2,0,0]=4 641 B12R2.1 c1ccc2c(c1)c(cs2)C=O BC220800 [0,1,0,1,0,0|1,1,0]=4 642 B12R2.1 c1ccc2c(c1)c(n[nH]2)C=O BC205422 [0,1,0,1,0,0|2,0,0]=4 643 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 BC679623 [0,1,0,1,0,0|1,0,1]=4 644 B12R2.18 c1ccc2c(c1)CC(C2=O)Br BC218981 [0,1,0,1,0,0|2,0,0]=4 645 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [1,0,0,0,1,0|2,0,0]=4 646 B8R1.7 c1c(nco1)C(=O)O BC677324 [1,0,0,0,1,0|2,0,0]=4 647 B8R1.7 c1c(scn1)C(=O)O BC677323 [1,0,0,0,1,0|2,0,0]=4 648 B8R1.7 c1c[nH]nc1C(=O)O BC203654 [1,0,0,0,1,0|2,0,0]=4 649 B8R1.7 c1cc([nH]c1)C(=O)O BC220697 [1,0,0,0,1,0|1,0,0]=3 650 B8R1.7 c1cc(oc1)C(=O)Cl BC226346 [1,0,0,0,1,0|2,0,0]=4 651 B8R1.7 c1cnsc1C(=O)O BC202175 [1,0,0,0,1,0|2,0,0]=4 652 B8R1.7 c1cocc1C(=O)Cl BC650563 [1,0,0,0,1,0|2,0,0]=4 653 B8R1.7 c1conc1C(=O)O BC207645 [1,0,0,0,1,0|2,0,0]=4 654 B8R1.7 c1csc(n1)C(=O)O BC651955 [1,0,0,0,1,0|2,0,0]=4 655 B8R1.7 c1cscc1C(=O)Cl BC681079 [1,0,0,0,1,0|2,0,0]=4 656 B8R1.7 c1cscc1C(=O)O BC213229 [1,0,0,0,1,0|1,0,0]=3 657 B8R1.11 Cn1cccc1C=O BC675646 [1,0,0,0,1,0|2,0,0]=4 658 B8R1.11 c1csc(c1Br)C=O BC219795 [1,0,0,0,1,0|2,0,0]=4 659 B8R1.11 c1csc(c1Cl)C=O BC679930 [1,0,0,0,1,0|2,0,0]=4 660 B12R1.125 Cc1ccccc1CCC(=O)O BC684657 [0,0,0,0,0,2|1,0,0]=3 661 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br BC687835 [0,0,0,0,0,2|1,0,0]=3 662 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl BC684352 [0,0,0,0,0,2|1,0,0]=3