0 B9R1.6 B(c1ccccc1)(O)O BC207007 [0,0,0,0,0,0|1,0,1]=2 1 B9R1.6 B(c1ccccn1)(O)O BC210694 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.6 B(c1cccnc1)(O)O BC210695 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.6 B(c1ccncc1)(O)O BC208313 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.6 B(c1cncnc1)(O)O BC682432 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.6 B(c1ncccn1)(O)O BC270429 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 C1CC(CC=C1)C(=O)O BC646428 [0,0,0,0,0,0|0,0,4]=4 7 B9R1.6 C1CCC(=CC1)C(=O)O BC215574 [0,0,0,0,0,0|0,0,4]=4 8 B9R1.6 CC(=O)c1ccccc1 BC206207 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.6 CC(=O)c1cccnc1 BC207736 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 CC(=O)c1ccncc1 BC204635 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 CC(=O)c1cncnc1 BC653324 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 CN(C)c1ccncc1 BC206167 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.6 CN(c1ccccc1)N BC677890 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.6 C[C@@H](c1ccccc1)N BC676690 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.6 C[C@H](c1ccccc1)N BC226220 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.6 c1c(cncn1)C(=O)O BC227972 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 c1c(cncn1)C(=O)O BC674875 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 c1cc(cnc1)C(=O)Cl BC650712 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.6 c1cc(cnc1)C(=O)N BC676662 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 c1cc(cnc1)C(=O)[O-] BC220349 [0,0,0,0,0,0|1,0,1]=2 21 B9R1.6 c1ccc(cc1)C(=N)N BC228100 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 c1ccc(cc1)P(Cl)Cl BC226377 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.6 c1ccnc(c1)C(=O)[O-] BC220351 [0,0,0,0,0,0|1,0,1]=2 24 B9R1.6 c1cnc(cn1)C(=O)Cl BC223499 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 c1cnc(cn1)C(=O)O BC676806 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.6 c1cnc(nc1)C(=O)O BC228091 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.6 c1cnccc1C(=N)N BC223492 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.6 c1cncnc1C(=O)O BC201449 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.6 c1cnncc1C(=O)O BC201463 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.2 C#Cc1ccccn1 BC225212 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.2 C#Cc1ccncc1 BC677907 [1,0,0,0,0,0|2,0,1]=4 32 B8R1.2 C=Cc1cccnc1 BC675972 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 CCc1cccnc1 BC223674 [1,0,0,0,0,0|2,0,1]=4 34 B8R1.2 COc1cccnc1 BC653137 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 [C-]#[N+]c1ccccc1 BC297263 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 c1c(cncn1)C=O BC200327 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 c1c(cncn1)CO BC228080 [1,0,0,0,0,0|2,0,1]=4 38 B8R1.2 c1cc(cnc1)C=O BC221128 [1,0,0,0,0,0|1,0,0]=2 39 B8R1.2 c1cc(cnc1)CBr BC258182 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.2 c1cc(cnc1)CBr BC281217 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 c1cc(cnc1)CCl BC204269 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.2 c1cc(cnc1)CN BC205833 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.2 c1cc(cnc1)CO BC209311 [1,0,0,0,0,0|1,0,1]=3 44 B8R1.2 c1cc(cnc1)NN BC231979 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 c1cc(cnc1)NN BC686688 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 c1cc(cnc1)NN BC686691 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.2 c1cc(nnc1)C=O BC667339 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.2 c1ccc(cc1)CBr BC220250 [1,0,0,0,0,0|1,0,1]=3 49 B8R1.2 c1ccc(cc1)CCl BC210975 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.2 c1ccc(cc1)CO BC222892 [1,0,0,0,0,0|0,0,1]=2 51 B8R1.2 c1ccc(cc1)N=O BC684726 [1,0,0,0,0,0|1,0,0]=2 52 B8R1.2 c1ccc(cc1)[Mg]Br BC653680 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.2 c1ccnc(c1)CCl BC213218 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 c1ccnc(c1)CCl BC227992 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.2 c1cnc(cn1)C=O BC681558 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.2 c1cnc(nc1)C=O BC228094 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.2 c1cncnc1C=O BC652156 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.2 c1cncnc1CO BC228082 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.13 B(c1ccc(cc1)Br)(O)O BC685826 [0,1,0,0,0,0|1,0,1]=3 60 B10R1.13 B(c1ccc(cc1)C)(O)O BC210678 [0,1,0,0,0,0|1,0,1]=3 61 B10R1.13 B(c1ccc(cc1)Cl)(O)O BC677573 [0,1,0,0,0,0|1,0,1]=3 62 B10R1.13 B(c1ccc(cc1)F)(O)O BC227618 [0,1,0,0,0,0|1,0,1]=3 63 B10R1.13 B(c1ccc(cn1)C)(O)O BC210680 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.13 B(c1ccc(nc1)Br)(O)O BC200364 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.13 B(c1ccc(nc1)C)(O)O BC656202 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.13 B(c1ccc(nc1)F)(O)O BC200359 [0,1,0,0,0,0|2,0,1]=4 67 B10R1.13 B(c1ccc(nc1)N)(O)O BC686183 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.13 CC(=O)c1ccc(cc1)Br BC227589 [0,1,0,0,0,0|1,0,0]=2 69 B10R1.13 CC(=O)c1ccc(cc1)Cl BC676864 [0,1,0,0,0,0|1,0,0]=2 70 B10R1.13 CC(=O)c1ccc(cc1)F BC204121 [0,1,0,0,0,0|1,0,0]=2 71 B10R1.13 CC(=O)c1ccc(cc1)O BC675526 [0,1,0,0,0,0|1,0,0]=2 72 B10R1.13 CC(=O)c1ccc(cn1)Br BC655306 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.13 CC(=O)c1ccc(nc1)Br BC225222 [0,1,0,0,0,0|2,0,0]=3 74 B10R1.13 CC(=O)c1ccc(nc1)Cl BC200352 [0,1,0,0,0,0|2,0,0]=3 75 B10R1.13 CC(C)c1ccc(cc1)Br BC213524 [0,1,0,0,0,0|2,0,1]=4 76 B10R1.13 CC(c1ccc(cc1)Br)N BC204235 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.13 C[C@@H](c1ccc(cc1)Br)N BC216482 [0,1,0,0,0,0|2,0,1]=4 78 B10R1.13 C[C@H](c1ccc(cc1)Br)N BC678930 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.13 Cc1ccc(cc1)C(=O)O BC675261 [0,1,0,0,0,0|0,0,0]=1 80 B10R1.13 Cc1ccc(cc1)C(C)C BC677632 [0,1,0,0,0,0|2,0,1]=4 81 B10R1.13 Cc1ccc(cc1)N(C)C BC206482 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.13 Cc1ccc(cn1)C(=O)C BC678853 [0,1,0,0,0,0|2,0,0]=3 83 B10R1.13 Cc1ccc(cn1)C(=O)O BC227043 [0,1,0,0,0,0|1,0,0]=2 84 B10R1.13 Cc1ccc(cn1)C(C)O BC681105 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] BC207742 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 Cc1ccc(nc1)C(=O)O BC207540 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.13 Cc1cnc(cn1)C(=O)O BC675245 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.13 Cc1ncc(cn1)C(=O)O BC228072 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.13 c1c(cnc(n1)C(=O)O)Br BC222390 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.13 c1c(ncc(=O)[nH]1)C(=O)[O-] BC208272 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.13 c1c(ncc(n1)Cl)C(=O)O BC220986 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.13 c1c(ncc(n1)O)C(=O)O BC220987 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.13 c1cc(ccc1C(=N)N)N BC213772 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 c1cc(ccc1C(=N)N)O BC223815 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.13 c1cc(ccc1C(=O)N)O BC219028 [0,1,0,0,0,0|1,0,0]=2 96 B10R1.13 c1cc(ccc1C(=O)O)I BC210636 [0,1,0,0,0,0|0,0,0]=1 97 B10R1.13 c1cc(ccc1C(=O)O)N BC227499 [0,1,0,0,0,0|0,0,0]=1 98 B10R1.13 c1cc(ccc1C(=O)O)O BC228180 [0,1,0,0,0,0|0,0,0]=1 99 B10R1.13 c1cc(ccc1F)S(=O)[O-] BC200582 [0,1,0,0,0,0|1,0,1]=3 100 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] BC203717 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.13 c1cc(ncc1Br)C(=O)O BC213733 [0,1,0,0,0,0|1,0,0]=2 102 B10R1.13 c1cc(ncc1C(=O)O)F BC214606 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.13 c1cc(ncc1C(=O)O)N BC213736 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.13 c1cc(ncc1C(=O)O)O BC215635 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.13 c1cc(ncc1Cl)C(=O)O BC224603 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 c1cc(ncc1F)C(=O)O BC224604 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.13 c1cc(ncc1N)C(=O)N BC228144 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.13 c1cc(ncc1N)C(=O)O BC210785 [0,1,0,0,0,0|1,0,0]=2 109 B10R1.13 c1cc(ncc1O)C(=O)O BC224042 [0,1,0,0,0,0|1,0,0]=2 110 B10R1.13 c1cc(ncc1[N+](=O)[O-])N BC227290 [0,1,0,0,0,0|2,0,1]=4 111 B10R1.13 c1cc(nnc1C(=O)O)Cl BC686205 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.15 C#CC(c1ccccc1)O BC218343 [0,1,0,0,0,0|1,0,1]=3 113 B10R1.15 CC[C@H](c1ccccc1)N BC201033 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.15 COC(=O)c1ccncc1 BC205546 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.15 COC(=O)c1cnccn1 BC205804 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.15 COC(=O)c1ncccn1 BC228090 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.15 c1ccc(cc1)C(=O)CN BC222358 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.15 c1ccc(cc1)C(C#N)Br BC620262 [0,1,0,0,0,0|2,0,1]=4 119 B10R1.15 c1ccc(cc1)C(CCl)O BC651818 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.15 c1ccc(cc1)[C@H](CO)N BC204938 [0,1,0,0,0,0|1,0,1]=3 121 B10R1.15 c1ccnc(c1)C(=O)CBr BC684167 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.15 c1cnc(cn1)C(=O)NN BC201465 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.15 c1cnccc1C(=O)CBr BC677150 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.15 c1cnccc1C(=O)NN BC204682 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.28 CC(C)(c1ccccc1)S BC210351 [0,1,0,0,0,0|1,1,1]=4 126 B10R1.28 c1cc(cnc1)S(=O)(=O)Cl BC257486 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.28 c1cc(cnc1)S(=O)(=O)O BC226070 [0,1,0,0,0,0|2,0,0]=3 128 B10R1.28 c1ccc(cc1)C(F)(F)F BC204263 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.28 c1ccc(cc1)S(=O)(=O)Cl BC204660 [0,1,0,0,0,0|1,0,1]=3 130 B10R1.28 c1ccnc(c1)S(=O)(=O)O BC219768 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.61 B(c1c(cccn1)C)(O)O BC225233 [0,1,0,0,0,0|2,0,1]=4 132 B10R1.61 B(c1c(cccn1)F)(O)O BC638939 [0,1,0,0,0,0|2,0,1]=4 133 B10R1.61 B(c1ccc[nH]c1=O)(O)O BC600160 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.61 B(c1ccccc1C)(O)O BC210677 [0,1,0,0,0,0|1,0,1]=3 135 B10R1.61 B(c1cccnc1Cl)(O)O BC221865 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.61 B(c1cccnc1F)(O)O BC200360 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.61 B(c1ccncc1F)(O)O BC221864 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.61 B(c1cnccc1C)(O)O BC684701 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.61 CC(=O)c1c(cccn1)F BC227063 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.61 CC(=O)c1ccccc1Br BC213650 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.61 CC(=O)c1ccccc1Cl BC683160 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.61 CC(=O)c1ccccc1F BC227587 [0,1,0,0,0,0|1,0,0]=2 143 B10R1.61 CC(=O)c1cccnc1Cl BC204454 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.61 CC(=O)c1cccnc1N BC200176 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.61 CC(C)c1ccccc1Br BC213522 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.61 CC(C)c1ccccc1N BC222401 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.61 Cc1c(cccn1)C(=O)C BC650807 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.61 Cc1c(cccn1)C(=O)O BC227078 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.61 Cc1c(nccn1)C(=O)C BC210170 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.61 Cc1ccccc1C(=O)Cl BC686297 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.61 Cc1ccccc1C(=O)O BC675262 [0,1,0,0,0,0|0,0,0]=1 152 B10R1.61 Cc1cccnc1C(=O)O BC207538 [0,1,0,0,0,0|1,0,0]=2 153 B10R1.61 Cc1cccnc1[N+](=O)[O-] BC219555 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.61 Cc1cnccc1C(=O)O BC222643 [0,1,0,0,0,0|1,0,0]=2 155 B10R1.61 c1c[nH]cc(c1=O)[N+](=O)[O-] BC201018 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.61 c1cc(c(nc1)C(=O)N)N BC653727 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.61 c1cc(c(nc1)C(=O)O)Br BC201446 [0,1,0,0,0,0|1,0,0]=2 158 B10R1.61 c1cc(c(nc1)C(=O)O)Cl BC678013 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.61 c1cc(c(nc1)C(=O)O)F BC226669 [0,1,0,0,0,0|1,0,0]=2 160 B10R1.61 c1cc(c(nc1)C(=O)O)N BC220957 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.61 c1cc(c(nc1)C(=O)O)O BC210633 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.61 c1cc(c(nc1)Cl)C(=O)Cl BC206498 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.61 c1cc(c(nc1)Cl)C(=O)O BC227088 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.61 c1cc(c(nc1)F)C(=O)O BC214598 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])Cl BC201213 [0,1,0,0,0,0|2,0,1]=4 166 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])F BC226634 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.61 c1ccc(c(c1)C(=N)N)O BC224168 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.61 c1ccc(c(c1)C(=O)O)O BC221968 [0,1,0,0,0,0|0,0,0]=1 169 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Cl BC203433 [0,1,0,0,0,0|1,0,1]=3 170 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F BC675797 [0,1,0,0,0,0|1,0,1]=3 171 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])S BC206397 [0,1,0,0,0,0|1,0,1]=3 172 B10R1.61 c1cnc(c(n1)C(=O)O)Cl BC686579 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.61 c1cnc(c(n1)C(=O)O)N BC205346 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.61 c1cnc(c(n1)C(=O)O)O BC205347 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.61 c1cncc(c1Br)C(=O)O BC226654 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.61 c1cncc(c1C(=O)O)N BC208031 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.61 c1cncc(c1F)C(=O)O BC677128 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.61 c1cncc(c1F)[N+](=O)[O-] BC228940 [0,1,0,0,0,0|2,0,1]=4 179 B10R1.61 c1cncc(c1N)C(=O)N BC227114 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.61 c1cncc(c1N)C(=O)O BC208030 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.61 c1cncc(c1N)[N+](=O)[O-] BC202649 [0,1,0,0,0,0|2,0,1]=4 182 B10R1.61 c1cncc(c1O)C(=O)O BC222453 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.113 B(c1cc(cnc1)Br)(O)O BC200363 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.113 B(c1cc(cnc1)C)(O)O BC210681 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.113 B(c1cc(cnc1)Cl)(O)O BC226855 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.113 B(c1cc(cnc1)F)(O)O BC659551 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.113 B(c1cccc(c1)C)(O)O BC219834 [0,1,0,0,0,0|1,0,1]=3 188 B10R1.113 B(c1cccc(c1)Cl)(O)O BC205354 [0,1,0,0,0,0|1,0,1]=3 189 B10R1.113 B(c1cccc(n1)C)(O)O BC225235 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.113 B(c1cccc(n1)Cl)(O)O BC656274 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.113 B(c1ccnc(c1)C)(O)O BC677119 [0,1,0,0,0,0|2,0,1]=4 192 B10R1.113 B(c1ccnc(c1)Cl)(O)O BC652193 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.113 B(c1ccnc(c1)F)(O)O BC226848 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.113 B(c1ccnc(c1)N)(O)O BC659589 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.113 CC(=O)c1cc(cnc1)Br BC200353 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.113 CC(=O)c1cccc(c1)Br BC217580 [0,1,0,0,0,0|1,0,0]=2 197 B10R1.113 CC(=O)c1cccc(n1)Br BC225218 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.113 CC(C)c1cccc(c1)N BC202334 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.113 C[n+]1cccc(c1)C(=O)N BC229164 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.113 Cc1cc(ccn1)N(=O)=O BC201961 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.113 Cc1cc(cnc1)C(=O)O BC212576 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.113 Cc1cccc(n1)C(=O)O BC210679 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.113 Cc1cccc(n1)[N+](=O)[O-] BC681540 [0,1,0,0,0,0|2,0,1]=4 204 B10R1.113 Cc1ccnc(c1)C(=O)C BC217946 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.113 Cc1nccc(n1)C(=O)O BC684779 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.113 c1c(cncc1Br)C(=O)O BC213725 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.113 c1c(cncc1F)C(=O)O BC228161 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.113 c1c(cncc1N)C(=O)O BC207804 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.113 c1c(cncc1O)C(=O)O BC206883 [0,1,0,0,0,0|1,0,0]=2 210 B10R1.113 c1c(nc(cn1)Cl)C(=O)O BC686580 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.113 c1c(ncnc1Cl)C(=O)O BC652478 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.113 c1c(ncnc1O)C(=O)O BC202213 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.113 c1cc(cc(c1)Br)[N+](=O)[O-] BC228014 [0,1,0,0,0,0|1,0,1]=3 214 B10R1.113 c1cc(cc(c1)Cl)C(=O)O BC225403 [0,1,0,0,0,0|0,0,0]=1 215 B10R1.113 c1cc(cc(c1)O)C(=O)O BC676293 [0,1,0,0,0,0|0,0,0]=1 216 B10R1.113 c1cc(nc(c1)Br)C(=O)O BC207990 [0,1,0,0,0,0|1,0,0]=2 217 B10R1.113 c1cc(nc(c1)Cl)C(=O)O BC213732 [0,1,0,0,0,0|1,0,0]=2 218 B10R1.113 c1cc(nc(c1)N)C(=O)O BC220442 [0,1,0,0,0,0|1,0,0]=2 219 B10R1.113 c1cnc(cc1Br)C(=O)O BC208210 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.113 c1cnc(cc1C(=O)O)Br BC207062 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.113 c1cnc(cc1C(=O)O)Cl BC209274 [0,1,0,0,0,0|1,0,0]=2 222 B10R1.113 c1cnc(cc1C(=O)O)N BC220337 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.113 c1cnc(cc1Cl)C(=O)O BC202385 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.113 c1cnc(cc1N)C(=O)O BC651732 [0,1,0,0,0,0|1,0,0]=2 225 B10R1.113 c1cnc(cc1[N+](=O)[O-])Cl BC204589 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.113 c1cnc(nc1C(=O)O)Cl BC266406 [0,1,0,0,0,0|2,0,0]=3 227 B10R2.320 c1ccc2c(c1)CC2=O BC225121 [0,0,0,1,0,0|1,0,0]=2 228 B8R1.7 B(c1ccco1)(O)O BC210622 [0,0,0,0,1,0|2,0,1]=4 229 B8R1.7 B(c1cccs1)(O)O BC210702 [0,0,0,0,1,0|2,0,1]=4 230 B8R1.7 B(c1ccoc1)(O)O BC203366 [0,0,0,0,1,0|2,0,1]=4 231 B8R1.7 B(c1ccsc1)(O)O BC210703 [0,0,0,0,1,0|2,0,1]=4 232 B8R1.7 C1C=CCC1C(=O)O BC226569 [0,0,0,0,1,0|0,0,3]=4 233 B8R1.7 C1C=C[C@H](N1)C(=O)O BC676801 [0,0,0,0,1,0|1,0,2]=4 234 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [0,0,0,0,1,0|2,0,0]=3 235 B8R1.7 c1c(nco1)C(=O)O BC677324 [0,0,0,0,1,0|2,0,0]=3 236 B8R1.7 c1c(scn1)C(=O)O BC677323 [0,0,0,0,1,0|2,0,0]=3 237 B8R1.7 c1c[nH]nc1C(=O)O BC203654 [0,0,0,0,1,0|2,0,0]=3 238 B8R1.7 c1cc([nH]c1)C(=O)O BC220697 [0,0,0,0,1,0|1,0,0]=2 239 B8R1.7 c1cc(oc1)C(=O)Cl BC226346 [0,0,0,0,1,0|2,0,0]=3 240 B8R1.7 c1cnsc1C(=O)O BC202175 [0,0,0,0,1,0|2,0,0]=3 241 B8R1.7 c1cocc1C(=O)Cl BC650563 [0,0,0,0,1,0|2,0,0]=3 242 B8R1.7 c1conc1C(=O)O BC207645 [0,0,0,0,1,0|2,0,0]=3 243 B8R1.7 c1csc(n1)C(=O)O BC651955 [0,0,0,0,1,0|2,0,0]=3 244 B8R1.7 c1cscc1C(=O)Cl BC681079 [0,0,0,0,1,0|2,0,0]=3 245 B8R1.7 c1cscc1C(=O)O BC213229 [0,0,0,0,1,0|1,0,0]=2 246 B10R1.18 CC(=O)Cc1ccccc1 BC250367 [0,0,0,0,0,1|1,0,0]=2 247 B10R1.18 CC(C)Nc1ccccc1 BC208321 [0,0,0,0,0,1|2,0,1]=4 248 B10R1.18 c1c(cncn1)CC(=O)O BC228079 [0,0,0,0,0,1|2,0,0]=3 249 B10R1.18 c1cc(cnc1)CC(=O)O BC228147 [0,0,0,0,0,1|1,0,0]=2 250 B10R1.18 c1ccc(cc1)C=C(Br)Br BC600066 [0,0,0,0,0,1|2,0,0]=3 251 B10R1.18 c1ccnc(c1)CC(=O)O BC210696 [0,0,0,0,0,1|1,0,0]=2 252 B10R1.18 c1ccnc(c1)CC(=O)O BC653678 [0,0,0,0,0,1|1,0,0]=2 253 B10R1.18 c1cnccc1CC(=O)O BC220630 [0,0,0,0,0,1|1,0,0]=2 254 B7R0.1 CC\C=C\C=C\C=O BC218794 [1,0,1,0,0,0|0,0,2]=4 255 B7R1.3 Cc1cccnc1 BC228007 [2,0,0,0,0,0|1,0,1]=4 256 B7R1.3 c1c(cncn1)O BC228081 [2,0,0,0,0,0|2,0,0]=4 257 B7R1.3 c1c[nH]c(=O)nc1 BC215238 [2,0,0,0,0,0|2,0,0]=4 258 B7R1.3 c1cc(=O)[nH]nc1 BC225809 [2,0,0,0,0,0|2,0,0]=4 259 B7R1.3 c1cc(cnc1)Cl BC209276 [2,0,0,0,0,0|2,0,0]=4 260 B7R1.3 c1cc(cnc1)I BC225230 [2,0,0,0,0,0|2,0,0]=4 261 B7R1.3 c1cc(cnc1)S BC244412 [2,0,0,0,0,0|1,1,0]=4 262 B7R1.3 c1cc[n+](cc1)[O-] BC227085 [2,0,0,0,0,0|1,0,1]=4 263 B7R1.3 c1ccnc(c1)Cl BC653330 [2,0,0,0,0,0|2,0,0]=4 264 B7R1.3 c1cnc(nc1)O BC209309 [2,0,0,0,0,0|2,0,0]=4 265 B7R1.3 c1cnc[nH]c1=O BC209585 [2,0,0,0,0,0|2,0,0]=4 266 B7R1.3 c1cnccc1Br BC204910 [2,0,0,0,0,0|2,0,0]=4 267 B7R1.3 c1cnccc1F BC219199 [2,0,0,0,0,0|2,0,0]=4 268 B7R1.3 c1cnccc1F BC227092 [2,0,0,0,0,0|2,0,0]=4 269 B7R1.3 c1cnccc1I BC206126 [2,0,0,0,0,0|2,0,0]=4 270 B7R1.3 c1cnccc1N BC227053 [2,0,0,0,0,0|2,0,0]=4 271 B7R1.3 c1cncnc1O BC228083 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.1 C#Cc1ccc(cc1)F BC215301 [1,1,0,0,0,0|1,0,1]=4 273 B9R1.1 C#Cc1ccc(cc1)O BC671095 [1,1,0,0,0,0|1,0,1]=4 274 B9R1.1 C=Cc1ccc(cc1)F BC227580 [1,1,0,0,0,0|1,0,0]=3 275 B9R1.1 CNc1ccc(cc1)N BC220840 [1,1,0,0,0,0|2,0,0]=4 276 B9R1.1 COc1ccc(cc1)Br BC676620 [1,1,0,0,0,0|2,0,0]=4 277 B9R1.1 COc1ccc(cc1)N BC206279 [1,1,0,0,0,0|2,0,0]=4 278 B9R1.1 Cc1ccc(cc1)C#C BC213353 [1,1,0,0,0,0|1,0,1]=4 279 B9R1.1 Cc1ccc(cc1)C#N BC676397 [1,1,0,0,0,0|1,0,1]=4 280 B9R1.1 Cc1ccc(cc1)C=O BC211019 [1,1,0,0,0,0|0,0,0]=2 281 B9R1.1 Cc1ccc(cc1)CBr BC200614 [1,1,0,0,0,0|1,0,1]=4 282 B9R1.1 Cc1ccc(cc1)CN BC211128 [1,1,0,0,0,0|1,0,1]=4 283 B9R1.1 Cc1ccc(cc1)NN BC213413 [1,1,0,0,0,0|2,0,0]=4 284 B9R1.1 Cc1ccc(cc1)NN BC216063 [1,1,0,0,0,0|2,0,0]=4 285 B9R1.1 Cc1ccc(cn1)C=C BC219567 [1,1,0,0,0,0|2,0,0]=4 286 B9R1.1 Cc1ccc(nc1)C=C BC211746 [1,1,0,0,0,0|2,0,0]=4 287 B9R1.1 Cc1ccc(nc1)C=O BC207526 [1,1,0,0,0,0|1,0,0]=3 288 B9R1.1 Cc1ncc(cn1)C=O BC228073 [1,1,0,0,0,0|2,0,0]=4 289 B9R1.1 c1cc(ccc1C#N)N BC226364 [1,1,0,0,0,0|1,0,1]=4 290 B9R1.1 c1cc(ccc1C=O)Br BC213531 [1,1,0,0,0,0|0,0,0]=2 291 B9R1.1 c1cc(ccc1C=O)N BC204291 [1,1,0,0,0,0|0,0,0]=2 292 B9R1.1 c1cc(ccc1C=O)O BC227835 [1,1,0,0,0,0|0,0,0]=2 293 B9R1.1 c1cc(ccc1CBr)Cl BC202439 [1,1,0,0,0,0|1,0,1]=4 294 B9R1.1 c1cc(ccc1CCl)Cl BC678529 [1,1,0,0,0,0|1,0,1]=4 295 B9R1.1 c1cc(ccc1CN)N BC676433 [1,1,0,0,0,0|1,0,1]=4 296 B9R1.1 c1cc(ccc1CN)O BC210625 [1,1,0,0,0,0|1,0,1]=4 297 B9R1.1 c1cc(ccc1CO)I BC220492 [1,1,0,0,0,0|0,0,1]=3 298 B9R1.1 c1cc(ccc1CO)O BC227836 [1,1,0,0,0,0|0,0,1]=3 299 B9R1.1 c1cc(ccc1NN)Br BC213412 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.1 c1cc(ccc1NN)Cl BC675025 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.1 c1cc(ccc1NN)F BC206790 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.1 c1cc(ncc1Br)C=O BC225554 [1,1,0,0,0,0|1,0,0]=3 303 B9R1.1 c1cc(ncc1Br)CO BC219783 [1,1,0,0,0,0|1,0,1]=4 304 B9R1.1 c1cc(ncc1C=O)Cl BC226370 [1,1,0,0,0,0|1,0,0]=3 305 B9R1.1 c1cc(ncc1C=O)F BC225548 [1,1,0,0,0,0|1,0,0]=3 306 B9R1.1 c1cc(ncc1C=O)N BC262229 [1,1,0,0,0,0|1,0,0]=3 307 B9R1.1 c1cc(ncc1C=O)O BC650796 [1,1,0,0,0,0|1,0,0]=3 308 B9R1.1 c1cc(ncc1CO)F BC221862 [1,1,0,0,0,0|1,0,1]=4 309 B9R1.1 c1cc(ncc1CO)O BC228000 [1,1,0,0,0,0|1,0,1]=4 310 B9R1.2 C#Cc1cccc(c1)F BC215302 [1,1,0,0,0,0|1,0,1]=4 311 B9R1.2 C#Cc1cccc(c1)N BC677915 [1,1,0,0,0,0|1,0,1]=4 312 B9R1.2 CCc1cccc(c1)Br BC675848 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.2 CCc1cccc(c1)N BC219618 [1,1,0,0,0,0|1,0,1]=4 314 B9R1.2 COc1cccc(c1)Br BC208526 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.2 CSc1cccc(c1)I BC210370 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 Cc1cccc(c1)C#C BC221826 [1,1,0,0,0,0|1,0,1]=4 317 B9R1.2 Cc1cccc(n1)C=O BC202245 [1,1,0,0,0,0|1,0,0]=3 318 B9R1.2 Cc1cccc(n1)CO BC225232 [1,1,0,0,0,0|1,0,1]=4 319 B9R1.2 Cc1nccc(n1)C=O BC200464 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.2 c1c(cncc1Br)CO BC207465 [1,1,0,0,0,0|1,0,1]=4 321 B9R1.2 c1c(cncc1F)C=O BC227139 [1,1,0,0,0,0|1,0,0]=3 322 B9R1.2 c1cc(cc(c1)Br)C=O BC211001 [1,1,0,0,0,0|0,0,0]=2 323 B9R1.2 c1cc(cc(c1)Cl)C#N BC209644 [1,1,0,0,0,0|1,0,1]=4 324 B9R1.2 c1cc(cc(c1)Cl)C=O BC227688 [1,1,0,0,0,0|0,0,0]=2 325 B9R1.2 c1cc(cc(c1)Cl)NN BC213414 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.2 c1cc(cc(c1)F)CCl BC675428 [1,1,0,0,0,0|1,0,1]=4 327 B9R1.2 c1cc(cc(c1)O)C=O BC226069 [1,1,0,0,0,0|0,0,0]=2 328 B9R1.2 c1cc(nc(c1)Br)CO BC208400 [1,1,0,0,0,0|1,0,1]=4 329 B9R1.2 c1cc(nc(c1)Cl)C=O BC200574 [1,1,0,0,0,0|1,0,0]=3 330 B9R1.2 c1cc(nc(c1)Cl)CO BC208690 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.2 c1cnc(cc1Br)CO BC222259 [1,1,0,0,0,0|1,0,1]=4 332 B9R1.2 c1cnc(cc1C=O)Br BC207461 [1,1,0,0,0,0|1,0,0]=3 333 B9R1.2 c1cnc(cc1C=O)Cl BC222332 [1,1,0,0,0,0|1,0,0]=3 334 B9R1.2 c1cnc(cc1C=O)O BC229040 [1,1,0,0,0,0|1,0,0]=3 335 B9R1.2 c1cnc(cc1CO)Br BC207432 [1,1,0,0,0,0|1,0,1]=4 336 B9R1.2 c1cnc(cc1CO)Cl BC208450 [1,1,0,0,0,0|1,0,1]=4 337 B9R1.2 c1cnc(cc1CO)N BC228974 [1,1,0,0,0,0|1,0,1]=4 338 B9R1.8 c1ccc(cc1)CC=O BC250050 [1,1,0,0,0,0|0,0,0]=2 339 B9R1.8 c1ccc(cc1)CCBr BC203736 [1,1,0,0,0,0|1,0,1]=4 340 B9R1.8 c1ccc(cc1)CCO BC213746 [1,1,0,0,0,0|0,0,1]=3 341 B9R1.8 c1ccc(cc1)CNN BC652179 [1,1,0,0,0,0|1,0,1]=4 342 B9R1.8 c1ccc(cc1)CNN BC676720 [1,1,0,0,0,0|1,0,1]=4 343 B9R1.8 c1cnccc1CCO BC201212 [1,1,0,0,0,0|1,0,1]=4 344 B9R1.15 C#Cc1ccccc1Br BC215310 [1,1,0,0,0,0|1,0,1]=4 345 B9R1.15 CCc1ccccc1Br BC675847 [1,1,0,0,0,0|1,0,1]=4 346 B9R1.15 CNc1ccccc1F BC206749 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.15 Cc1c(cccn1)C=O BC656201 [1,1,0,0,0,0|1,0,0]=3 348 B9R1.15 Cc1ccccc1C#C BC251006 [1,1,0,0,0,0|1,0,1]=4 349 B9R1.15 Cc1ccccc1C#N BC675264 [1,1,0,0,0,0|1,0,1]=4 350 B9R1.15 Cc1cccnc1C=O BC207525 [1,1,0,0,0,0|1,0,0]=3 351 B9R1.15 c1cc(c(nc1)C=O)Br BC227128 [1,1,0,0,0,0|1,0,0]=3 352 B9R1.15 c1cc(c(nc1)C=O)F BC200347 [1,1,0,0,0,0|1,0,0]=3 353 B9R1.15 c1cc(c(nc1)C=O)O BC222334 [1,1,0,0,0,0|1,0,0]=3 354 B9R1.15 c1cc(c(nc1)Cl)C=O BC225225 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.15 c1cc(c(nc1)F)C=O BC208207 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.15 c1cc(c(nc1)N)C=O BC208204 [1,1,0,0,0,0|1,0,0]=3 357 B9R1.15 c1cc(c(nc1)N)CO BC208411 [1,1,0,0,0,0|1,0,1]=4 358 B9R1.15 c1ccc(c(c1)C#N)I BC211028 [1,1,0,0,0,0|1,0,1]=4 359 B9R1.15 c1ccc(c(c1)C#N)N BC227634 [1,1,0,0,0,0|1,0,1]=4 360 B9R1.15 c1ccc(c(c1)C#N)O BC211029 [1,1,0,0,0,0|1,0,1]=4 361 B9R1.15 c1ccc(c(c1)C=O)Br BC227689 [1,1,0,0,0,0|0,0,0]=2 362 B9R1.15 c1ccc(c(c1)CBr)Cl BC226691 [1,1,0,0,0,0|1,0,1]=4 363 B9R1.15 c1ccc(c(c1)CBr)F BC675325 [1,1,0,0,0,0|1,0,1]=4 364 B9R1.15 c1ccc(c(c1)CN)I BC227344 [1,1,0,0,0,0|1,0,1]=4 365 B9R1.15 c1ccc(c(c1)CO)Br BC211129 [1,1,0,0,0,0|0,0,1]=3 366 B9R1.15 c1ccc(c(c1)NN)Br BC685827 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.15 c1cnc(c(n1)C=O)Cl BC670991 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.15 c1cncc(c1Br)C=O BC227127 [1,1,0,0,0,0|1,0,0]=3 369 B9R1.15 c1cncc(c1C=O)Br BC225219 [1,1,0,0,0,0|1,0,0]=3 370 B9R1.15 c1cncc(c1C=O)N BC208028 [1,1,0,0,0,0|1,0,0]=3 371 B9R1.15 c1cncc(c1CO)Cl BC256219 [1,1,0,0,0,0|1,0,1]=4 372 B9R1.15 c1cncc(c1Cl)CO BC679667 [1,1,0,0,0,0|1,0,1]=4 373 B9R1.15 c1cncc(c1N)C=O BC208029 [1,1,0,0,0,0|1,0,0]=3 374 B9R1.15 c1cncc(c1N)CO BC208026 [1,1,0,0,0,0|1,0,1]=4 375 B9R1.11 COC(=O)c1c[nH]cn1 BC220005 [0,1,0,0,1,0|2,0,0]=4 376 B9R1.11 COC(=O)c1cc[nH]n1 BC224095 [0,1,0,0,1,0|2,0,0]=4 377 B9R1.11 COC(=O)c1ccco1 BC218745 [0,1,0,0,1,0|1,0,0]=3 378 B9R1.35 C1CC(=O)C=C1C(=O)O BC675996 [0,1,0,0,1,0|0,0,2]=4 379 B9R1.35 CC(=O)c1cc(cs1)Cl BC226225 [0,1,0,0,1,0|2,0,0]=4 380 B9R1.35 Cc1[nH]cc(n1)C(=O)O BC679140 [0,1,0,0,1,0|2,0,0]=4 381 B9R1.35 Cc1cc(no1)C(=O)O BC650587 [0,1,0,0,1,0|2,0,0]=4 382 B9R1.35 Cc1cc(on1)C(=O)O BC645510 [0,1,0,0,1,0|2,0,0]=4 383 B9R1.35 Cc1ccc(o1)C(=O)C BC218741 [0,1,0,0,1,0|2,0,0]=4 384 B9R1.35 Cc1ccc(s1)C(=O)O BC213236 [0,1,0,0,1,0|1,0,0]=3 385 B9R1.35 Cc1cnc(s1)C(=O)O BC675563 [0,1,0,0,1,0|2,0,0]=4 386 B9R1.35 Cc1csc(n1)C(=O)O BC675561 [0,1,0,0,1,0|2,0,0]=4 387 B9R1.35 Cc1nc(co1)C(=O)O BC203608 [0,1,0,0,1,0|2,0,0]=4 388 B9R1.35 Cc1ncc(s1)C(=O)O BC681903 [0,1,0,0,1,0|2,0,0]=4 389 B9R1.35 Cn1cc(nc1)C(=O)O BC219620 [0,1,0,0,1,0|2,0,0]=4 390 B9R1.35 c1c(csc1C(=O)O)Br BC676028 [0,1,0,0,1,0|1,0,0]=3 391 B9R1.35 c1cc(sc1C(=O)O)Cl BC219931 [0,1,0,0,1,0|1,0,0]=3 392 B9R1.41 Cc1c(nco1)C(=O)O BC650836 [0,1,0,0,1,0|2,0,0]=4 393 B9R1.41 Cc1c(ncs1)C(=O)O BC652152 [0,1,0,0,1,0|2,0,0]=4 394 B9R1.41 Cc1c(ocn1)C(=O)O BC689523 [0,1,0,0,1,0|2,0,0]=4 395 B9R1.41 Cc1c(scn1)C(=O)O BC679074 [0,1,0,0,1,0|2,0,0]=4 396 B9R1.41 Cn1c(ccn1)C(=O)O BC649926 [0,1,0,0,1,0|2,0,0]=4 397 B9R1.41 Cn1cncc1C(=O)O BC220093 [0,1,0,0,1,0|2,0,0]=4 398 B9R1.41 c1csc(c1C(=O)O)F BC655882 [0,1,0,0,1,0|1,0,0]=3 399 B9R1.41 c1csc(c1N)C(=O)O BC288632 [0,1,0,0,1,0|1,0,0]=3 400 B11R1.20 CC(=O)Cc1ccc(cc1)O BC211152 [0,1,0,0,0,1|1,0,0]=3 401 B11R1.20 CC(=O)Nc1ccc(cc1)O BC204766 [0,1,0,0,0,1|1,0,0]=3 402 B11R1.20 CC(=O)Nc1ccc(cc1)S BC210348 [0,1,0,0,0,1|1,0,0]=3 403 B11R1.20 c1cc(ccc1CC(=O)O)Br BC203407 [0,1,0,0,0,1|0,0,0]=2 404 B11R1.20 c1cc(ccc1CC(=O)O)O BC228201 [0,1,0,0,0,1|0,0,0]=2 405 B11R1.36 C=C(c1ccccc1)C(=O)O BC653116 [0,1,0,0,0,1|0,0,0]=2 406 B11R1.36 c1ccc(cc1)C(=O)C(=O)O BC215722 [0,1,0,0,0,1|0,0,0]=2 407 B11R1.36 c1ccc(cc1)C(C(=O)N)N BC216078 [0,1,0,0,0,1|1,0,0]=3 408 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC204233 [0,1,0,0,0,1|0,0,0]=2 409 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC250758 [0,1,0,0,0,1|0,0,0]=2 410 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N BC675296 [0,1,0,0,0,1|0,0,0]=2 411 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)O BC677633 [0,1,0,0,0,1|0,0,0]=2 412 B11R1.40 c1ccc(cc1)OC(=O)CBr BC200214 [0,1,0,0,0,1|1,0,0]=3 413 B11R1.86 CC(=O)Cc1ccccc1Br BC202120 [0,1,0,0,0,1|1,0,0]=3 414 B11R1.86 c1ccc(c(c1)CC(=O)Cl)F BC204059 [0,1,0,0,0,1|1,0,0]=3 415 B11R1.86 c1ccc(c(c1)CC(=O)O)Br BC210254 [0,1,0,0,0,1|0,0,0]=2 416 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl BC675213 [0,1,0,0,0,1|0,0,0]=2 417 B11R1.157 c1c(cncc1Br)CC(=O)O BC670873 [0,1,0,0,0,1|1,0,0]=3 418 B11R1.157 c1cc(cc(c1)Br)CC(=O)O BC210255 [0,1,0,0,0,1|0,0,0]=2 419 B11R1.157 c1cc(cc(c1)Cl)CC(=O)O BC226914 [0,1,0,0,0,1|0,0,0]=2 420 B11R1.157 c1cc(cc(c1)I)CC(=O)O BC227537 [0,1,0,0,0,1|0,0,0]=2 421 B11R1.157 c1cc(cc(c1)N)CC(=O)O BC676470 [0,1,0,0,0,1|0,0,0]=2 422 B11R1.509 CC(C)(Cc1ccccc1)O BC677508 [0,1,0,0,0,1|1,0,1]=4 423 B11R1.3 B(c1ccc(cc1)C#N)(O)O BC205356 [0,2,0,0,0,0|1,0,1]=4 424 B11R1.3 B(c1ccc(cc1)C=O)(O)O BC226078 [0,2,0,0,0,0|1,0,1]=4 425 B11R1.3 B(c1ccc(cc1)CBr)(O)O BC221884 [0,2,0,0,0,0|1,0,1]=4 426 B11R1.3 B(c1ccc(cc1)CO)(O)O BC200406 [0,2,0,0,0,0|1,0,1]=4 427 B11R1.3 B(c1ccc(cc1)OC)(O)O BC298193 [0,2,0,0,0,0|1,0,1]=4 428 B11R1.3 C=Cc1ccc(cc1)C(=O)O BC685896 [0,2,0,0,0,0|0,0,0]=2 429 B11R1.3 CCc1ccc(cc1)C(=O)O BC250059 [0,2,0,0,0,0|0,0,0]=2 430 B11R1.3 CNc1ccc(cc1)C(=O)O BC214404 [0,2,0,0,0,0|0,0,0]=2 431 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] BC646117 [0,2,0,0,0,0|1,0,1]=4 432 B11R1.3 COc1ccc(cn1)C(=O)O BC681662 [0,2,0,0,0,0|1,0,0]=3 433 B11R1.3 COc1ccc(nc1)C(=O)O BC650815 [0,2,0,0,0,0|1,0,0]=3 434 B11R1.3 c1cc(ccc1C#N)C(=O)Cl BC224844 [0,2,0,0,0,0|1,0,0]=3 435 B11R1.3 c1cc(ccc1C#N)C(=O)O BC225817 [0,2,0,0,0,0|0,0,0]=2 436 B11R1.3 c1cc(ccc1C(=O)O)NN BC685866 [0,2,0,0,0,0|0,0,0]=2 437 B11R1.3 c1cc(ccc1C=O)C(=O)O BC203124 [0,2,0,0,0,0|0,0,0]=2 438 B11R1.3 c1cc(ccc1C=O)[N+](=O)[O-] BC226826 [0,2,0,0,0,0|1,0,1]=4 439 B11R1.3 c1cc(ccc1CBr)C(=O)O BC211697 [0,2,0,0,0,0|0,0,0]=2 440 B11R1.3 c1cc(ccc1CBr)[N+](=O)[O-] BC228029 [0,2,0,0,0,0|1,0,1]=4 441 B11R1.3 c1cc(ccc1CN)C(=O)O BC219606 [0,2,0,0,0,0|0,0,0]=2 442 B11R1.3 c1cc(ccc1CO)C(=O)O BC215027 [0,2,0,0,0,0|0,0,0]=2 443 B11R1.19 CS(=O)(=O)c1ccc(cc1)N BC213367 [0,2,0,0,0,0|1,0,1]=4 444 B11R1.19 CS(=O)(=O)c1ccc(cc1)O BC214463 [0,2,0,0,0,0|1,0,1]=4 445 B11R1.19 Cc1ccc(cc1)S(=O)(=O)Cl BC650741 [0,2,0,0,0,0|1,0,1]=4 446 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O BC203776 [0,2,0,0,0,0|1,0,0]=3 447 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O BC204518 [0,2,0,0,0,0|1,0,0]=3 448 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O BC244540 [0,2,0,0,0,0|1,0,0]=3 449 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] BC228060 [0,2,0,0,0,0|1,0,1]=4 450 B11R1.19 Cc1ccc(cn1)S(=O)(=O)O BC677035 [0,2,0,0,0,0|2,0,0]=4 451 B11R1.19 c1cc(ccc1F)S(=O)(=O)Cl BC203563 [0,2,0,0,0,0|1,0,1]=4 452 B11R1.19 c1cc(ccc1N)S(=O)(=O)O BC204845 [0,2,0,0,0,0|1,0,0]=3 453 B11R1.19 c1cc(ccc1N)[As](=O)(O)O BC203993 [0,2,0,0,0,0|1,0,0]=3 454 B11R1.19 c1cc(ccc1O)S(=O)(=O)Cl BC224737 [0,2,0,0,0,0|1,0,1]=4 455 B11R1.19 c1cc(ccc1O)S(=O)(=O)O BC652607 [0,2,0,0,0,0|1,0,0]=3 456 B11R1.19 c1cc(ccc1S(=O)(=O)Cl)Br BC213345 [0,2,0,0,0,0|1,0,1]=4 457 B11R1.21 B(c1ccc(c(c1)C)O)(O)O BC684739 [0,2,0,0,0,0|1,0,1]=4 458 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br BC675515 [0,2,0,0,0,0|1,0,0]=3 459 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl BC200288 [0,2,0,0,0,0|1,0,0]=3 460 B11R1.21 CC(=O)c1ccc(c(c1)Br)F BC210238 [0,2,0,0,0,0|1,0,0]=3 461 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl BC677102 [0,2,0,0,0,0|1,0,0]=3 462 B11R1.21 CC(=O)c1ccc(c(c1)F)Br BC219905 [0,2,0,0,0,0|1,0,0]=3 463 B11R1.21 CC(=O)c1ccc(c(c1)F)F BC201362 [0,2,0,0,0,0|1,0,0]=3 464 B11R1.21 CC(=O)c1ccc(c(c1)F)O BC227598 [0,2,0,0,0,0|1,0,0]=3 465 B11R1.21 CC(=O)c1ccc(c(c1)N)F BC209409 [0,2,0,0,0,0|1,0,0]=3 466 B11R1.21 CC(=O)c1ccc(c(c1)O)O BC220893 [0,2,0,0,0,0|1,0,0]=3 467 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC298265 [0,2,0,0,0,0|1,0,0]=3 468 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC672119 [0,2,0,0,0,0|1,0,0]=3 469 B11R1.21 Cc1ccc(cc1Br)C(=O)O BC203701 [0,2,0,0,0,0|0,0,0]=2 470 B11R1.21 Cc1ccc(cc1C)C(=O)O BC215410 [0,2,0,0,0,0|0,0,0]=2 471 B11R1.21 Cc1ccc(cc1I)C(=O)Cl BC261034 [0,2,0,0,0,0|1,0,0]=3 472 B11R1.21 Cc1ccc(cc1I)C(=O)O BC207738 [0,2,0,0,0,0|0,0,0]=2 473 B11R1.21 Cc1ccc(cc1N)C(=O)O BC201386 [0,2,0,0,0,0|0,0,0]=2 474 B11R1.21 Cc1ccc(cc1O)C(=O)O BC676273 [0,2,0,0,0,0|0,0,0]=2 475 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O BC200650 [0,2,0,0,0,0|2,0,0]=4 476 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O BC220525 [0,2,0,0,0,0|2,0,0]=4 477 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O BC215634 [0,2,0,0,0,0|1,0,0]=3 478 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F BC227458 [0,2,0,0,0,0|0,0,0]=2 479 B11R1.21 c1cc(c(cc1C(=O)O)F)N BC227466 [0,2,0,0,0,0|0,0,0]=2 480 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl BC683731 [0,2,0,0,0,0|0,0,0]=2 481 B11R1.21 c1cc(c(cc1C(=O)O)N)N BC210311 [0,2,0,0,0,0|0,0,0]=2 482 B11R1.21 c1cc(c(cc1C(=O)O)N)O BC226975 [0,2,0,0,0,0|0,0,0]=2 483 B11R1.21 c1cc(c(cc1C(=O)O)O)Cl BC225280 [0,2,0,0,0,0|0,0,0]=2 484 B11R1.21 c1cc(c(cc1C(=O)O)O)N BC225276 [0,2,0,0,0,0|0,0,0]=2 485 B11R1.21 c1cc(c(cc1N(=O)=O)Cl)F BC207139 [0,2,0,0,0,0|1,0,1]=4 486 B11R1.21 c1cc(c(cc1N(=O)=O)N)F BC207144 [0,2,0,0,0,0|1,0,1]=4 487 B11R1.21 c1cc(c(cc1N(=O)=O)O)N BC225947 [0,2,0,0,0,0|1,0,1]=4 488 B11R1.21 c1cc(c(cc1[N+](=O)[O-])F)N BC677934 [0,2,0,0,0,0|1,0,1]=4 489 B11R1.21 c1cc(c(cc1[N+](=O)[O-])I)O BC214353 [0,2,0,0,0,0|1,0,1]=4 490 B11R1.21 c1cc(c(cc1[N+](=O)[O-])N)Br BC227786 [0,2,0,0,0,0|1,0,1]=4 491 B11R1.21 c1cc(c(cc1[N+](=O)[O-])O)F BC679701 [0,2,0,0,0,0|1,0,1]=4 492 B11R1.21 c1cc(nc(c1F)Br)C(=O)O BC297809 [0,2,0,0,0,0|1,0,0]=3 493 B11R1.21 c1cc(nc(c1F)F)C(=O)O BC214611 [0,2,0,0,0,0|1,0,0]=3 494 B11R1.22 CC(C=O)c1ccc(cc1)Cl BC681644 [0,2,0,0,0,0|1,0,1]=4 495 B11R1.22 CCC(=O)c1ccc(cc1)N BC210208 [0,2,0,0,0,0|1,0,0]=3 496 B11R1.22 CCC(=O)c1ccc(cc1)O BC227841 [0,2,0,0,0,0|1,0,0]=3 497 B11R1.22 CNC(=O)c1ccc(cc1)Br BC290335 [0,2,0,0,0,0|1,0,0]=3 498 B11R1.22 COC(=O)c1ccc(cc1)Br BC215377 [0,2,0,0,0,0|0,0,0]=2 499 B11R1.22 COC(=O)c1ccc(cc1)I BC213654 [0,2,0,0,0,0|0,0,0]=2 500 B11R1.22 COC(=O)c1ccc(cc1)[O-] BC209217 [0,2,0,0,0,0|0,0,0]=2 501 B11R1.22 COC(=O)c1ccc(cn1)Br BC219158 [0,2,0,0,0,0|1,0,0]=3 502 B11R1.22 COC(=O)c1ccc(cn1)O BC224006 [0,2,0,0,0,0|1,0,0]=3 503 B11R1.22 COC(=O)c1ccc(nc1)Br BC219205 [0,2,0,0,0,0|1,0,0]=3 504 B11R1.22 COC(=O)c1ccc(nc1)Cl BC219222 [0,2,0,0,0,0|1,0,0]=3 505 B11R1.22 COC(=O)c1ccc(nc1)F BC219217 [0,2,0,0,0,0|1,0,0]=3 506 B11R1.22 COC(=O)c1ccc(nc1)N BC227076 [0,2,0,0,0,0|1,0,0]=3 507 B11R1.22 COC(=O)c1cnc(cn1)Cl BC208084 [0,2,0,0,0,0|2,0,0]=4 508 B11R1.22 COC(=O)c1cnc(cn1)O BC219767 [0,2,0,0,0,0|2,0,0]=4 509 B11R1.22 Cc1ccc(cc1)C(=O)CN BC201176 [0,2,0,0,0,0|1,0,0]=3 510 B11R1.22 Cc1ccc(cc1)C(C)C=O BC600219 [0,2,0,0,0,0|1,0,1]=4 511 B11R1.22 Cc1ccc(cn1)C(=O)OC BC207925 [0,2,0,0,0,0|1,0,0]=3 512 B11R1.22 c1cc(ccc1C(=O)CBr)N BC652867 [0,2,0,0,0,0|1,0,0]=3 513 B11R1.22 c1cc(ccc1C(=O)CBr)O BC685303 [0,2,0,0,0,0|1,0,0]=3 514 B11R1.22 c1cc(ccc1C(=O)CN)Br BC201169 [0,2,0,0,0,0|1,0,0]=3 515 B11R1.22 c1cc(ccc1C(=O)CN)Br BC253950 [0,2,0,0,0,0|1,0,0]=3 516 B11R1.22 c1cc(ccc1C(=O)CN)Cl BC201170 [0,2,0,0,0,0|1,0,0]=3 517 B11R1.22 c1cc(ccc1C(=O)CN)F BC201168 [0,2,0,0,0,0|1,0,0]=3 518 B11R1.22 c1cc(ccc1C(=O)CN)F BC201440 [0,2,0,0,0,0|1,0,0]=3 519 B11R1.166 B(c1ccc(cc1C)O)(O)O BC678791 [0,2,0,0,0,0|1,0,1]=4 520 B11R1.166 B(c1ccc(cc1Cl)O)(O)O BC210282 [0,2,0,0,0,0|1,0,1]=4 521 B11R1.166 B(c1ccc(cc1F)Cl)(O)O BC250589 [0,2,0,0,0,0|1,0,1]=4 522 B11R1.166 B(c1ccc(cc1F)F)(O)O BC208385 [0,2,0,0,0,0|1,0,1]=4 523 B11R1.166 CC(=O)c1ccc(cc1Br)Br BC220380 [0,2,0,0,0,0|1,0,0]=3 524 B11R1.166 CC(=O)c1ccc(cc1Br)Cl BC652621 [0,2,0,0,0,0|1,0,0]=3 525 B11R1.166 CC(=O)c1ccc(cc1Br)O BC210243 [0,2,0,0,0,0|1,0,0]=3 526 B11R1.166 CC(=O)c1ccc(cc1Cl)Br BC200637 [0,2,0,0,0,0|1,0,0]=3 527 B11R1.166 CC(=O)c1ccc(cc1Cl)N BC296971 [0,2,0,0,0,0|1,0,0]=3 528 B11R1.166 CC(=O)c1ccc(cc1Cl)O BC209150 [0,2,0,0,0,0|1,0,0]=3 529 B11R1.166 CC(=O)c1ccc(cc1Cl)O BC215805 [0,2,0,0,0,0|1,0,0]=3 530 B11R1.166 CC(=O)c1ccc(cc1F)Br BC658892 [0,2,0,0,0,0|1,0,0]=3 531 B11R1.166 CC(=O)c1ccc(cc1F)Cl BC686320 [0,2,0,0,0,0|1,0,0]=3 532 B11R1.166 CC(=O)c1ccc(cc1F)F BC200226 [0,2,0,0,0,0|1,0,0]=3 533 B11R1.166 CC(=O)c1ccc(cc1F)O BC208072 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.166 CC(=O)c1ccc(cc1O)O BC676988 [0,2,0,0,0,0|1,0,0]=3 535 B11R1.166 Cc1c(ccc(n1)F)C(=O)O BC219214 [0,2,0,0,0,0|1,0,0]=3 536 B11R1.166 Cc1cc(c(cn1)C(=O)O)O BC216112 [0,2,0,0,0,0|1,0,0]=3 537 B11R1.166 Cc1cc(ccc1C(=O)O)Cl BC227504 [0,2,0,0,0,0|0,0,0]=2 538 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F BC206757 [0,2,0,0,0,0|1,0,1]=4 539 B11R1.166 Cc1cc(ncc1C(=O)O)N BC228733 [0,2,0,0,0,0|1,0,0]=3 540 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O BC676276 [0,2,0,0,0,0|0,0,0]=2 541 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] BC678588 [0,2,0,0,0,0|1,0,1]=4 542 B11R1.166 Cc1ccc(c(c1)F)C(=O)O BC225677 [0,2,0,0,0,0|0,0,0]=2 543 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] BC206758 [0,2,0,0,0,0|1,0,1]=4 544 B11R1.166 Cc1ccc(c(c1)N)C(=O)N BC217679 [0,2,0,0,0,0|1,0,0]=3 545 B11R1.166 Cc1ccc(c(c1)N)C(=O)O BC225271 [0,2,0,0,0,0|0,0,0]=2 546 B11R1.166 Cc1ccc(c(c1)O)C(=O)N BC202384 [0,2,0,0,0,0|1,0,0]=3 547 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl BC201303 [0,2,0,0,0,0|1,0,0]=3 548 B11R1.166 c1c(cnc(c1Cl)C(=O)O)Cl BC220335 [0,2,0,0,0,0|1,0,0]=3 549 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O BC676270 [0,2,0,0,0,0|0,0,0]=2 550 B11R1.166 c1cc(c(cc1Br)F)C(=O)O BC206179 [0,2,0,0,0,0|0,0,0]=2 551 B11R1.166 c1cc(c(cc1Br)N)C(=O)O BC227467 [0,2,0,0,0,0|0,0,0]=2 552 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O BC210276 [0,2,0,0,0,0|0,0,0]=2 553 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N BC620183 [0,2,0,0,0,0|1,0,0]=3 554 B11R1.166 c1cc(c(cc1F)Br)C(=O)O BC206177 [0,2,0,0,0,0|0,0,0]=2 555 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] BC652333 [0,2,0,0,0,0|1,0,1]=4 556 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] BC226757 [0,2,0,0,0,0|1,0,1]=4 557 B11R1.166 c1cc(c(cc1F)N)C(=O)O BC204309 [0,2,0,0,0,0|0,0,0]=2 558 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] BC206751 [0,2,0,0,0,0|1,0,1]=4 559 B11R1.166 c1cc(c(cc1F)O)C(=O)O BC201515 [0,2,0,0,0,0|0,0,0]=2 560 B11R1.166 c1cc(c(cc1N)F)C(=O)O BC210195 [0,2,0,0,0,0|0,0,0]=2 561 B11R1.166 c1cc(c(cc1N)O)C(=O)O BC205364 [0,2,0,0,0,0|0,0,0]=2 562 B11R1.166 c1cc(c(cc1O)Cl)C(=O)O BC219622 [0,2,0,0,0,0|0,0,0]=2 563 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] BC204313 [0,2,0,0,0,0|1,0,1]=4 564 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl BC218961 [0,2,0,0,0,0|1,0,0]=3 565 B11R1.12 COC(c1ccccc1)OC BC214177 [0,2,0,0,0,0|0,0,2]=4 566 B11R1.16 CCOC(=O)c1cccnc1 BC226788 [0,2,0,0,0,0|1,0,0]=3 567 B11R1.16 CCOC(=O)c1ccncn1 BC201450 [0,2,0,0,0,0|2,0,0]=4 568 B11R1.16 CCOC(=O)c1ccnnc1 BC201464 [0,2,0,0,0,0|2,0,0]=4 569 B11R1.16 COCC(=O)c1ccccc1 BC644213 [0,2,0,0,0,0|0,0,0]=2 570 B11R1.16 c1ccc(cc1)C(=O)CCBr BC675527 [0,2,0,0,0,0|1,0,0]=3 571 B11R1.16 c1ccc(cc1)C(=O)N=C=S BC685804 [0,2,0,0,0,0|0,1,0]=3 572 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O BC681135 [0,2,0,0,0,0|1,0,1]=4 573 B11R1.16 c1ccc(cc1)[C@H](CCCl)O BC201664 [0,2,0,0,0,0|1,0,1]=4 574 B11R1.16 c1ccc(cc1)[C@H](CCO)N BC202108 [0,2,0,0,0,0|1,0,1]=4 575 B11R1.23 CCC(=O)c1cccc(c1)Cl BC226916 [0,2,0,0,0,0|1,0,0]=3 576 B11R1.23 CCC(=O)c1cccc(c1)N BC210207 [0,2,0,0,0,0|1,0,0]=3 577 B11R1.23 CCC(=O)c1cccc(c1)O BC210632 [0,2,0,0,0,0|1,0,0]=3 578 B11R1.23 COC(=O)c1cc(ccn1)N BC208664 [0,2,0,0,0,0|1,0,0]=3 579 B11R1.23 COC(=O)c1cc(cnc1)Br BC207471 [0,2,0,0,0,0|1,0,0]=3 580 B11R1.23 COC(=O)c1cccc(c1)O BC220614 [0,2,0,0,0,0|0,0,0]=2 581 B11R1.23 COC(=O)c1cccc(n1)Br BC207501 [0,2,0,0,0,0|1,0,0]=3 582 B11R1.23 COC(=O)c1cccc(n1)Cl BC226662 [0,2,0,0,0,0|1,0,0]=3 583 B11R1.23 COC(=O)c1ccnc(c1)N BC201210 [0,2,0,0,0,0|1,0,0]=3 584 B11R1.23 Cc1cccc(c1)C(=O)OC BC219811 [0,2,0,0,0,0|0,0,0]=2 585 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl BC219638 [0,2,0,0,0,0|1,0,0]=3 586 B11R1.23 c1cc(cc(c1)Cl)C(CN)O BC210180 [0,2,0,0,0,0|1,0,1]=4 587 B11R1.222 COC(=O)c1c(cccn1)Br BC273693 [0,2,0,0,0,0|1,0,0]=3 588 B11R1.222 COC(=O)c1c(cccn1)O BC224094 [0,2,0,0,0,0|1,0,0]=3 589 B11R1.222 COC(=O)c1c(nccn1)N BC210667 [0,2,0,0,0,0|2,0,0]=4 590 B11R1.222 COC(=O)c1cccnc1F BC219216 [0,2,0,0,0,0|1,0,0]=3 591 B11R1.222 COC(=O)c1cnccc1O BC224041 [0,2,0,0,0,0|1,0,0]=3 592 B11R1.222 COC(=O)c1cncnc1O BC223812 [0,2,0,0,0,0|2,0,0]=4 593 B11R1.222 Cc1c(cccn1)C(=O)OC BC225552 [0,2,0,0,0,0|1,0,0]=3 594 B11R1.222 c1ccc(c(c1)C(=O)CN)Br BC201182 [0,2,0,0,0,0|1,0,0]=3 595 B11R1.222 c1ccc(c(c1)C(=O)CN)Cl BC201181 [0,2,0,0,0,0|1,0,0]=3 596 B11R1.222 c1ccc(c(c1)C(=O)CN)F BC201180 [0,2,0,0,0,0|1,0,0]=3 597 B11R1.222 c1ccc(c(c1)C(=O)NN)Cl BC225151 [0,2,0,0,0,0|1,0,0]=3 598 B11R1.87 c1ccc(c(c1)S(=O)(=O)Cl)Br BC205190 [0,2,0,0,0,0|1,0,1]=4 599 B11R1.87 c1ccc(c(c1)S(=O)(=O)Cl)I BC228116 [0,2,0,0,0,0|1,0,1]=4 600 B11R1.155 CC(C)(c1cccc(c1)Br)O BC206378 [0,2,0,0,0,0|1,0,1]=4 601 B11R1.53 B(c1ccccc1CBr)(O)O BC221886 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.53 B(c1ccccc1CC)(O)O BC685300 [0,2,0,0,0,0|1,0,1]=4 603 B11R1.53 B(c1ccccc1OC)(O)O BC210656 [0,2,0,0,0,0|1,0,1]=4 604 B11R1.53 c1ccc(c(c1)C(=O)O)NN BC215554 [0,2,0,0,0,0|0,0,0]=2 605 B11R1.53 c1ccc(c(c1)CBr)C(=O)O BC207323 [0,2,0,0,0,0|0,0,0]=2 606 B11R1.53 c1ccc(c(c1)CCl)C(=O)O BC211063 [0,2,0,0,0,0|0,0,0]=2 607 B11R1.53 c1ccc(c(c1)NN)[N+](=O)[O-] BC213411 [0,2,0,0,0,0|1,0,1]=4 608 B11R1.53 c1ccc(c(c1)[N+](=O)[O-])SCl BC215815 [0,2,0,0,0,0|1,0,1]=4 609 B11R1.156 B(c1c(cccc1C)C)(O)O BC210577 [0,2,0,0,0,0|1,0,1]=4 610 B11R1.156 B(c1c(cccc1F)F)(O)O BC210333 [0,2,0,0,0,0|1,0,1]=4 611 B11R1.156 CC(=O)c1c(cccc1Cl)F BC247111 [0,2,0,0,0,0|1,0,0]=3 612 B11R1.156 Cc1c(c(ncn1)C)C(=O)O BC221848 [0,2,0,0,0,0|2,0,0]=4 613 B11R1.156 Cc1cccc(c1C(=O)O)C BC227495 [0,2,0,0,0,0|0,0,0]=2 614 B11R1.156 Cc1cccc(c1C(=O)O)F BC220222 [0,2,0,0,0,0|0,0,0]=2 615 B11R1.156 Cc1cccc(c1C(=O)O)N BC203569 [0,2,0,0,0,0|0,0,0]=2 616 B11R1.156 Cc1cccc(c1[N+](=O)[O-])O BC203683 [0,2,0,0,0,0|1,0,1]=4 617 B11R1.156 Cc1ccnc(c1C(=O)O)C BC200557 [0,2,0,0,0,0|1,0,0]=3 618 B11R1.156 c1cc(c(c(c1)Br)C(=O)Cl)F BC227423 [0,2,0,0,0,0|1,0,0]=3 619 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F BC220215 [0,2,0,0,0,0|0,0,0]=2 620 B11R1.156 c1cc(c(c(c1)Cl)C(=O)O)N BC651950 [0,2,0,0,0,0|0,0,0]=2 621 B11R1.156 c1cc(c(c(c1)Cl)N(=O)=O)F BC201439 [0,2,0,0,0,0|1,0,1]=4 622 B11R1.156 c1cc(c(c(c1)Cl)[N+](=O)[O-])Cl BC210747 [0,2,0,0,0,0|1,0,1]=4 623 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N BC215415 [0,2,0,0,0,0|0,0,0]=2 624 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O BC208246 [0,2,0,0,0,0|0,0,0]=2 625 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])F BC675882 [0,2,0,0,0,0|1,0,1]=4 626 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])N BC684607 [0,2,0,0,0,0|1,0,1]=4 627 B11R1.159 B(c1cccc(c1Cl)F)(O)O BC226756 [0,2,0,0,0,0|1,0,1]=4 628 B11R1.159 B(c1cccc(c1F)F)(O)O BC210331 [0,2,0,0,0,0|1,0,1]=4 629 B11R1.159 CC(=O)c1cccc(c1F)Br BC227617 [0,2,0,0,0,0|1,0,0]=3 630 B11R1.159 CC(=O)c1cccc(c1O)N BC216503 [0,2,0,0,0,0|1,0,0]=3 631 B11R1.159 Cc1c(cccc1F)C(=O)O BC206740 [0,2,0,0,0,0|0,0,0]=2 632 B11R1.159 Cc1c(cccc1O)C(=O)O BC201893 [0,2,0,0,0,0|0,0,0]=2 633 B11R1.159 Cc1cccc(c1Br)C(=O)O BC202429 [0,2,0,0,0,0|0,0,0]=2 634 B11R1.159 Cc1cccc(c1Br)[N+](=O)[O-] BC675977 [0,2,0,0,0,0|1,0,1]=4 635 B11R1.159 Cc1cccc(c1C)C(=O)Cl BC646247 [0,2,0,0,0,0|1,0,0]=3 636 B11R1.159 Cc1cccc(c1Cl)N(=O)=O BC677799 [0,2,0,0,0,0|1,0,1]=4 637 B11R1.159 Cc1cccc(c1F)C(=O)O BC220220 [0,2,0,0,0,0|0,0,0]=2 638 B11R1.159 Cc1cccc(c1F)[N+](=O)[O-] BC206792 [0,2,0,0,0,0|1,0,1]=4 639 B11R1.159 Cc1cccc(c1N)C(=O)C BC649905 [0,2,0,0,0,0|1,0,0]=3 640 B11R1.159 Cc1cccc(c1N)C(=O)O BC210202 [0,2,0,0,0,0|0,0,0]=2 641 B11R1.159 c1cc(c(c(c1)Br)F)[N+](=O)[O-] BC675869 [0,2,0,0,0,0|1,0,1]=4 642 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O BC201159 [0,2,0,0,0,0|0,0,0]=2 643 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O BC666464 [0,2,0,0,0,0|0,0,0]=2 644 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O BC206796 [0,2,0,0,0,0|0,0,0]=2 645 B11R1.159 c1cc(c(c(c1)Cl)N)[N+](=O)[O-] BC203698 [0,2,0,0,0,0|1,0,1]=4 646 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O BC220217 [0,2,0,0,0,0|0,0,0]=2 647 B11R1.159 c1cc(c(c(c1)F)Cl)N(=O)=O BC221733 [0,2,0,0,0,0|1,0,1]=4 648 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O BC227455 [0,2,0,0,0,0|0,0,0]=2 649 B11R1.159 c1cc(c(c(c1)F)F)[N+](=O)[O-] BC675787 [0,2,0,0,0,0|1,0,1]=4 650 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O BC227465 [0,2,0,0,0,0|0,0,0]=2 651 B11R1.159 c1cc(c(c(c1)F)I)[N+](=O)[O-] BC675790 [0,2,0,0,0,0|1,0,1]=4 652 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O BC206752 [0,2,0,0,0,0|0,0,0]=2 653 B11R1.159 c1cc(c(c(c1)F)N)N(=O)=O BC221732 [0,2,0,0,0,0|1,0,1]=4 654 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O BC676253 [0,2,0,0,0,0|0,0,0]=2 655 B11R1.159 c1cc(c(c(c1)N)N)C(=O)N BC212233 [0,2,0,0,0,0|1,0,0]=3 656 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O BC225268 [0,2,0,0,0,0|0,0,0]=2 657 B11R1.159 c1cc(c(c(c1)[N+](=O)[O-])N)N BC213373 [0,2,0,0,0,0|1,0,1]=4 658 B11R1.159 c1cc(n(c(=O)c1)O)C(=O)O BC281774 [0,2,0,0,0,0|1,0,0]=3 659 B11R1.159 c1cnc(c(c1C(=O)O)Cl)F BC214602 [0,2,0,0,0,0|1,0,0]=3 660 B11R1.167 B(c1cc(ccc1O)Cl)(O)O BC670614 [0,2,0,0,0,0|1,0,1]=4 661 B11R1.167 B(c1cc(ccc1O)F)(O)O BC210598 [0,2,0,0,0,0|1,0,1]=4 662 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl BC681076 [0,2,0,0,0,0|1,0,0]=3 663 B11R1.167 CC(=O)c1cc(ccc1Cl)F BC226693 [0,2,0,0,0,0|1,0,0]=3 664 B11R1.167 CC(=O)c1cc(ccc1I)F BC220376 [0,2,0,0,0,0|1,0,0]=3 665 B11R1.167 CC(=O)c1cc(ccc1O)Br BC209997 [0,2,0,0,0,0|1,0,0]=3 666 B11R1.167 Cc1ccc(c(c1)C(=O)N)N BC210204 [0,2,0,0,0,0|1,0,0]=3 667 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br BC676166 [0,2,0,0,0,0|0,0,0]=2 668 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl BC207064 [0,2,0,0,0,0|0,0,0]=2 669 B11R1.167 Cc1ccc(c(c1)C(=O)O)F BC220223 [0,2,0,0,0,0|0,0,0]=2 670 B11R1.167 Cc1ccc(c(c1)C(=O)O)I BC676196 [0,2,0,0,0,0|0,0,0]=2 671 B11R1.167 Cc1ccc(cc1C(=O)O)Br BC222446 [0,2,0,0,0,0|0,0,0]=2 672 B11R1.167 Cc1ccc(cc1C(=O)O)I BC219784 [0,2,0,0,0,0|0,0,0]=2 673 B11R1.167 Cc1ccc(cc1C(=O)O)N BC202438 [0,2,0,0,0,0|0,0,0]=2 674 B11R1.167 Cc1ccc(cc1C(=O)O)O BC202426 [0,2,0,0,0,0|0,0,0]=2 675 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])Br BC206992 [0,2,0,0,0,0|1,0,1]=4 676 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])N BC685798 [0,2,0,0,0,0|1,0,1]=4 677 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br BC686534 [0,2,0,0,0,0|2,0,0]=4 678 B11R1.167 c1c(c(cnc1Cl)N)C(=O)O BC227048 [0,2,0,0,0,0|1,0,0]=3 679 B11R1.167 c1c(c(nnc1Cl)Cl)C(=O)O BC201462 [0,2,0,0,0,0|2,0,0]=4 680 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl BC219210 [0,2,0,0,0,0|1,0,0]=3 681 B11R1.167 c1c(cnc(c1C(=O)O)Cl)F BC219207 [0,2,0,0,0,0|1,0,0]=3 682 B11R1.167 c1c(cnc(c1C(=O)O)F)Cl BC219211 [0,2,0,0,0,0|1,0,0]=3 683 B11R1.167 c1c(cnc(c1C(=O)O)F)F BC214613 [0,2,0,0,0,0|1,0,0]=3 684 B11R1.167 c1c(cnc(c1C(=O)O)N)Cl BC228739 [0,2,0,0,0,0|1,0,0]=3 685 B11R1.167 c1c(cnc(c1C(=O)O)O)Br BC209271 [0,2,0,0,0,0|1,0,0]=3 686 B11R1.167 c1c(cnc(c1C(=O)O)O)F BC219212 [0,2,0,0,0,0|1,0,0]=3 687 B11R1.167 c1c(nc(c(n1)N)C(=O)O)Br BC655671 [0,2,0,0,0,0|2,0,0]=4 688 B11R1.167 c1cc(c(cc1Br)C(=O)O)Br BC201121 [0,2,0,0,0,0|0,0,0]=2 689 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl BC226435 [0,2,0,0,0,0|0,0,0]=2 690 B11R1.167 c1cc(c(cc1Br)C(=O)O)F BC206180 [0,2,0,0,0,0|0,0,0]=2 691 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])O BC216413 [0,2,0,0,0,0|1,0,1]=4 692 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])Br BC204516 [0,2,0,0,0,0|1,0,1]=4 693 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])F BC206795 [0,2,0,0,0,0|1,0,1]=4 694 B11R1.167 c1cc(c(cc1F)C(=O)O)Br BC206178 [0,2,0,0,0,0|0,0,0]=2 695 B11R1.167 c1cc(c(cc1I)C(=O)O)I BC676267 [0,2,0,0,0,0|0,0,0]=2 696 B11R1.167 c1cc(c(cc1O)C(=O)O)F BC227490 [0,2,0,0,0,0|0,0,0]=2 697 B11R1.167 c1cc(c(cc1O)C(=O)O)N BC214917 [0,2,0,0,0,0|0,0,0]=2 698 B11R1.167 c1cc(c(cc1O)C(=O)[O-])O BC215928 [0,2,0,0,0,0|0,0,1]=3 699 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])Br BC671117 [0,2,0,0,0,0|1,0,1]=4 700 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])F BC677985 [0,2,0,0,0,0|1,0,1]=4 701 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])I BC689299 [0,2,0,0,0,0|1,0,1]=4 702 B11R1.167 c1cc(nc(c1Cl)C(=O)O)Cl BC210323 [0,2,0,0,0,0|1,0,0]=3 703 B11R1.74 B(c1cc(cc(c1)C)C)(O)O BC210578 [0,2,0,0,0,0|1,0,1]=4 704 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br BC201010 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.74 CC(=O)c1cc(cc(c1)O)O BC201351 [0,2,0,0,0,0|1,0,0]=3 706 B11R1.74 Cc1cc(cc(c1)C(=O)Cl)C BC209254 [0,2,0,0,0,0|1,0,0]=3 707 B11R1.74 Cc1cc(cc(c1)Cl)[N+](=O)[O-] BC653641 [0,2,0,0,0,0|1,0,1]=4 708 B11R1.74 Cc1cc(cc(c1)F)[N+](=O)[O-] BC675532 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.74 Cc1cc(cc(c1)N)C(=O)O BC676237 [0,2,0,0,0,0|0,0,0]=2 710 B11R1.74 Cc1cc(cc(c1)O)C(=O)O BC203205 [0,2,0,0,0,0|0,0,0]=2 711 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O BC645727 [0,2,0,0,0,0|0,0,0]=2 712 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)Cl BC227418 [0,2,0,0,0,0|1,0,0]=3 713 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O BC676216 [0,2,0,0,0,0|0,0,0]=2 714 B11R1.74 c1c(cc(cc1F)Br)[N+](=O)[O-] BC226734 [0,2,0,0,0,0|1,0,1]=4 715 B11R1.74 c1c(cc(cc1F)Br)[N+](=O)[O-] BC652336 [0,2,0,0,0,0|1,0,1]=4 716 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O BC227462 [0,2,0,0,0,0|0,0,0]=2 717 B11R1.74 c1c(cc(cc1F)F)[N+](=O)[O-] BC211114 [0,2,0,0,0,0|1,0,1]=4 718 B11R1.74 c1c(cc(cc1O)Br)C(=O)O BC600169 [0,2,0,0,0,0|0,0,0]=2 719 B11R1.74 c1c(cc(cc1O)O)C(=O)O BC676294 [0,2,0,0,0,0|0,0,0]=2 720 B11R1.74 c1c(cc(cc1[N+](=O)[O-])F)N BC686372 [0,2,0,0,0,0|1,0,1]=4 721 B11R1.74 c1c(cc(nc1C(=O)O)Cl)Cl BC678015 [0,2,0,0,0,0|1,0,0]=3 722 B11R1.74 c1c(cc(nc1Cl)Cl)C(=O)O BC207976 [0,2,0,0,0,0|1,0,0]=3 723 B11R1.74 c1c(cc(nc1F)F)C(=O)O BC657180 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.74 c1c(cc(nc1O)O)C(=O)O BC201884 [0,2,0,0,0,0|1,0,0]=3 725 B11R1.266 B(c1cccc(c1)C=C)(O)O BC686049 [0,2,0,0,0,0|1,0,1]=4 726 B11R1.266 B(c1cccc(c1)C=O)(O)O BC210621 [0,2,0,0,0,0|1,0,1]=4 727 B11R1.266 B(c1cccc(c1)CBr)(O)O BC221885 [0,2,0,0,0,0|1,0,1]=4 728 B11R1.266 B(c1cccc(c1)OC)(O)O BC210657 [0,2,0,0,0,0|1,0,1]=4 729 B11R1.266 C#Cc1cccc(c1)N(=O)=O BC204753 [0,2,0,0,0,0|1,0,1]=4 730 B11R1.266 CC(=O)c1cccc(c1)OC BC225925 [0,2,0,0,0,0|1,0,0]=3 731 B11R1.266 COc1ccnc(c1)C(=O)O BC645914 [0,2,0,0,0,0|1,0,0]=3 732 B11R1.266 c1c(cncc1C(=O)N)C#N BC600247 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.266 c1c(cncc1C(=O)O)C#N BC207474 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.266 c1cc(cc(c1)C(=O)O)C#N BC675645 [0,2,0,0,0,0|0,0,0]=2 735 B11R1.266 c1cc(cc(c1)C(=O)O)C=O BC211730 [0,2,0,0,0,0|0,0,0]=2 736 B11R1.266 c1cc(cc(c1)C(=O)O)CN BC211732 [0,2,0,0,0,0|0,0,0]=2 737 B11R1.266 c1cc(cc(c1)C(=O)O)CO BC211729 [0,2,0,0,0,0|0,0,0]=2 738 B11R1.266 c1cc(cc(c1)N(=O)=O)C=O BC226099 [0,2,0,0,0,0|1,0,1]=4 739 B11R1.266 c1cc(cc(c1)[N+](=O)[O-])CCl BC219425 [0,2,0,0,0,0|1,0,1]=4 740 B9R1.13 c1cc(sc1)CC(=O)O BC201507 [0,0,1,1,0,0|1,0,1]=4 741 B9R2.50 c1ccc2c(c1)CC2 BC658499 [1,0,0,1,0,0|1,0,1]=4 742 B11R2.10 Cc1cc2ccccc2[nH]1 BC200996 [0,0,0,1,0,1|2,0,0]=4 743 B11R2.10 Cc1cc2ccccc2o1 BC600174 [0,0,0,1,0,1|1,0,0]=3 744 B11R2.10 Cc1cc2ccccc2o1 BC600186 [0,0,0,1,0,1|1,0,0]=3 745 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 BC214905 [0,0,0,1,0,1|1,0,0]=3 746 B11R2.10 c1cc2c(nc1)CC(=O)N2 BC684571 [0,0,0,1,0,1|2,0,0]=4 747 B11R2.10 c1cc2c(nc1)oc(n2)Cl BC600172 [0,0,0,1,0,1|2,0,0]=4 748 B11R2.10 c1ccc2=NC(=O)N=c2c1 BC219990 [0,0,0,1,0,1|1,0,0]=3 749 B11R2.10 c1ccc2c(c1)CC(=O)C2 BC214987 [0,0,0,1,0,1|1,0,0]=3 750 B11R2.10 c1ccc2c(c1)CC(C2)O BC214988 [0,0,0,1,0,1|1,0,1]=4 751 B11R2.10 c1ccc2c(c1)[nH]c(=O)o2 BC200827 [0,0,0,1,0,1|0,0,0]=2 752 B11R2.10 c1ccc2c(c1)[nH]c(n2)S BC201300 [0,0,0,1,0,1|1,1,0]=4 753 B11R2.10 c1ccc2c(c1)nc(s2)S BC202804 [0,0,0,1,0,1|0,2,0]=4 754 B11R2.10 c1ccn2c(c1)cc(n2)O BC638899 [0,0,0,1,0,1|2,0,0]=4 755 B11R2.1 CC1=CCc2c1cccc2 BC600789 [0,1,0,1,0,0|2,0,0]=4 756 B11R2.1 c1ccc2c(c1)C=CC2=O BC264695 [0,1,0,1,0,0|1,0,0]=3 757 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [0,1,0,1,0,0|1,0,0]=3 758 B11R2.1 c1ccc2c(c1)c(=O)[nH]s2 BC210059 [0,1,0,1,0,0|0,1,0]=3 759 B11R2.1 c1ccc2c(c1)c(c[nH]2)Br BC220142 [0,1,0,1,0,0|2,0,0]=4 760 B11R2.1 c1ccc2c(c1)c(c[nH]2)Cl BC678897 [0,1,0,1,0,0|2,0,0]=4 761 B11R2.1 c1ccc2c(c1)c(c[nH]2)O BC676558 [0,1,0,1,0,0|1,0,0]=3 762 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br BC203656 [0,1,0,1,0,0|2,0,0]=4 763 B11R2.1 c1ccc2c(c1)c(n[nH]2)I BC205463 [0,1,0,1,0,0|2,0,0]=4 764 B11R2.1 c1ccc2c(c1)c(ns2)Cl BC207416 [0,1,0,1,0,0|1,1,0]=4 765 B11R2.1 c1ccc2c(c1)c(ns2)N BC221828 [0,1,0,1,0,0|1,1,0]=4 766 B11R2.1 c1ccc2c(c1)nnn2O BC204387 [0,1,0,1,0,0|2,0,0]=4 767 B11R2.1 c1ccc2c(c1)nnn2O BC675286 [0,1,0,1,0,0|2,0,0]=4 768 B11R2.35 c1cc(cc(c1)Cl)[C@@H]2CO2 BC220567 [0,1,0,1,0,0|1,0,1]=4 769 B7R1.1 c1c(nc[nH]1)C=O BC207063 [1,0,0,0,1,0|2,0,0]=4 770 B7R1.1 c1c(scn1)C=O BC678913 [1,0,0,0,1,0|2,0,0]=4 771 B7R1.1 c1c[nH]nc1C=O BC207627 [1,0,0,0,1,0|2,0,0]=4 772 B7R1.1 c1cc([nH]c1)C=O BC210794 [1,0,0,0,1,0|1,0,0]=3 773 B7R1.1 c1cc(sc1)C=O BC225721 [1,0,0,0,1,0|1,0,0]=3 774 B7R1.1 c1cn(cn1)C=O BC222414 [1,0,0,0,1,0|2,0,0]=4 775 B7R1.1 c1cnc([nH]1)C=O BC219962 [1,0,0,0,1,0|2,0,0]=4 776 B7R1.1 c1cnsc1C=O BC677321 [1,0,0,0,1,0|2,0,0]=4 777 B7R1.1 c1conc1C=O BC201897 [1,0,0,0,1,0|2,0,0]=4 778 B7R1.1 c1cscc1C=O BC676777 [1,0,0,0,1,0|1,0,0]=3 779 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC204442 [0,0,0,0,0,2|1,0,0]=3 780 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC630675 [0,0,0,0,0,2|1,0,0]=3 781 B11R1.91 c1ccc(cc1)COC(=O)N BC219591 [0,0,0,0,0,2|1,0,0]=3 782 B11R1.91 c1ccc(cc1)\C=C\C(=O)Cl BC651782 [0,0,0,0,0,2|1,0,0]=3 783 B11R1.91 c1ccnc(c1)OCC(=O)O BC682036 [0,0,0,0,0,2|1,0,0]=3 784 B11R1.91 c1cnccc1\C=C\C(=O)O BC204449 [0,0,0,0,0,2|1,0,0]=3