0 B9R1.35 C1CC(=O)C=C1C(=O)O BC675996 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.35 C1[C@H](C=C[C@@H]1N)C(=O)O BC638831 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.35 CC(=O)c1cc(cs1)Cl BC226225 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 Cc1[nH]cc(n1)C(=O)O BC679140 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 Cc1cc(no1)C(=O)O BC650587 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.35 Cc1cc(on1)C(=O)O BC645510 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.35 Cc1ccc(o1)C(=O)C BC218741 [0,0,0,0,0,0|2,1,0]=3 7 B9R1.35 Cc1ccc(s1)C(=O)O BC213236 [0,0,0,0,0,0|1,0,0]=1 8 B9R1.35 Cc1cnc(s1)C(=O)O BC675563 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.35 Cc1csc(n1)C(=O)O BC675561 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 Cc1nc(co1)C(=O)O BC203608 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.35 Cc1ncc(s1)C(=O)O BC681903 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.35 Cn1cc(nc1)C(=O)O BC219620 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.35 Cn1cnc(n1)C(=O)O BC256926 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.35 c1(nc([nH]n1)N)C(=O)O BC215681 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 c1c([nH]c(n1)Cl)[N+](=O)[O-] BC220691 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.35 c1c(csc1C(=O)O)Br BC676028 [0,0,0,0,0,0|2,1,0]=3 17 B9R1.35 c1c(sc(n1)N)[N+](=O)[O-] BC684467 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.35 c1cc(sc1C(=O)O)Cl BC219931 [0,0,0,0,0,0|0,0,0]=0 19 B8R1.1 Cc1cc(sc1)C=O BC645199 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.1 Cc1csc(n1)C=O BC203023 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.1 Cc1ncc(s1)C=O BC650857 [1,0,0,0,0,0|2,0,0]=3 22 B8R1.1 c1c(coc1C=O)Br BC645867 [1,0,0,0,0,0|2,1,0]=4 23 B8R1.1 c1c(csc1C=O)Br BC678555 [1,0,0,0,0,0|2,1,0]=4 24 B8R1.1 c1c(sc(n1)Cl)CCl BC209499 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.1 c1c(sc(n1)Cl)CN BC201455 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.1 c1c(sc(n1)N)C=O BC220680 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.1 c1c(sc(n1)N)CO BC658236 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.1 c1cc(sc1C#N)Br BC651951 [1,0,0,0,0,0|1,1,1]=4 29 B8R1.7 B(c1ccco1)(O)O BC210622 [1,0,0,0,0,0|1,1,1]=4 30 B8R1.7 B(c1cccs1)(O)O BC210702 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.7 C1C=CCC1C(=O)O BC226569 [1,0,0,0,0,0|1,0,2]=4 32 B8R1.7 C1C=C[C@H](N1)C(=O)O BC676801 [1,0,0,0,0,0|1,0,2]=4 33 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.7 c1c(nco1)C(=O)O BC677324 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.7 c1c(scn1)C(=O)O BC677323 [1,0,0,0,0,0|1,0,0]=2 36 B8R1.7 c1c[nH]nc1C(=O)O BC203654 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.7 c1cc([nH]c1)C(=O)O BC220697 [1,0,0,0,0,0|1,0,0]=2 38 B8R1.7 c1cc(oc1)C(=O)Cl BC226346 [1,0,0,0,0,0|1,1,0]=3 39 B8R1.7 c1cnsc1C(=O)O BC202175 [1,0,0,0,0,0|1,0,0]=2 40 B8R1.7 c1cocc1C(=O)Cl BC650563 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.7 c1conc1C(=O)O BC207645 [1,0,0,0,0,0|2,0,0]=3 42 B8R1.7 c1csc(n1)C(=O)O BC651955 [1,0,0,0,0,0|1,0,0]=2 43 B8R1.7 c1cscc1C(=O)Cl BC681079 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.7 c1cscc1C(=O)O BC213229 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.14 COC(=O)c1cc(cs1)N BC672043 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.14 COC(=O)c1ccc(s1)N BC645938 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.14 COC(=O)c1cnc(s1)Br BC219624 [0,1,0,0,0,0|1,1,0]=3 48 B10R1.14 COC(=O)c1cnc(s1)N BC684872 [0,1,0,0,0,0|2,0,0]=3 49 B10R1.14 COC(=O)c1csc(n1)N BC216589 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.14 Cc1nc(co1)C(=O)OC BC203607 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.31 CCc1ccc(o1)C(=O)C BC296380 [0,1,0,0,0,0|2,1,0]=4 52 B10R1.31 c1c(csc1C(=O)O)C#N BC645474 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.31 c1cc(sc1C=O)C(=O)O BC685955 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.55 c1cc(sc1S(=O)(=O)Cl)Br BC215393 [0,1,0,0,0,0|1,1,1]=4 55 B10R1.55 c1cc(sc1S(=O)(=O)Cl)Cl BC210425 [0,1,0,0,0,0|1,0,1]=3 56 B10R1.13 B(c1ccc(cc1)Cl)(O)O BC677573 [0,0,0,0,0,1|2,0,1]=4 57 B10R1.13 CC(=O)c1ccc(cc1)Br BC227589 [0,0,0,0,0,1|2,1,0]=4 58 B10R1.13 CC(=O)c1ccc(cc1)Cl BC676864 [0,0,0,0,0,1|2,0,0]=3 59 B10R1.13 CC(=O)c1ccc(cc1)F BC204121 [0,0,0,0,0,1|2,1,0]=4 60 B10R1.13 CC(=O)c1ccc(cc1)O BC675526 [0,0,0,0,0,1|3,0,0]=4 61 B10R1.13 CC(=O)c1ccc(cn1)Br BC655306 [0,0,0,0,0,1|2,1,0]=4 62 B10R1.13 CC(=O)c1ccc(nc1)Br BC225222 [0,0,0,0,0,1|2,1,0]=4 63 B10R1.13 CC(=O)c1ccc(nc1)Cl BC200352 [0,0,0,0,0,1|2,0,0]=3 64 B10R1.13 Cc1ccc(cc1)C(=O)O BC675261 [0,0,0,0,0,1|2,0,0]=3 65 B10R1.13 Cc1ccc(cn1)C(=O)C BC678853 [0,0,0,0,0,1|3,0,0]=4 66 B10R1.13 Cc1ccc(cn1)C(=O)O BC227043 [0,0,0,0,0,1|2,0,0]=3 67 B10R1.13 Cc1ccc(nc1)C(=O)O BC207540 [0,0,0,0,0,1|2,0,0]=3 68 B10R1.13 Cc1cnc(cn1)C(=O)O BC675245 [0,0,0,0,0,1|3,0,0]=4 69 B10R1.13 Cc1ncc(cn1)C(=O)O BC228072 [0,0,0,0,0,1|3,0,0]=4 70 B10R1.13 c1c(cnc(n1)C(=O)O)Br BC222390 [0,0,0,0,0,1|2,1,0]=4 71 B10R1.13 c1c(ncc(n1)Cl)C(=O)O BC220986 [0,0,0,0,0,1|2,0,0]=3 72 B10R1.13 c1c(ncc(n1)O)C(=O)O BC220987 [0,0,0,0,0,1|3,0,0]=4 73 B10R1.13 c1cc(ccc1C(=O)N)O BC219028 [0,0,0,0,0,1|3,0,0]=4 74 B10R1.13 c1cc(ccc1C(=O)O)I BC210636 [0,0,0,0,0,1|1,1,0]=3 75 B10R1.13 c1cc(ccc1C(=O)O)N BC227499 [0,0,0,0,0,1|2,0,0]=3 76 B10R1.13 c1cc(ccc1C(=O)O)O BC228180 [0,0,0,0,0,1|2,0,0]=3 77 B10R1.13 c1cc(ncc1Br)C(=O)O BC213733 [0,0,0,0,0,1|1,1,0]=3 78 B10R1.13 c1cc(ncc1C(=O)O)F BC214606 [0,0,0,0,0,1|1,1,0]=3 79 B10R1.13 c1cc(ncc1C(=O)O)N BC213736 [0,0,0,0,0,1|2,0,0]=3 80 B10R1.13 c1cc(ncc1C(=O)O)O BC215635 [0,0,0,0,0,1|2,0,0]=3 81 B10R1.13 c1cc(ncc1Cl)C(=O)O BC224603 [0,0,0,0,0,1|1,0,0]=2 82 B10R1.13 c1cc(ncc1F)C(=O)O BC224604 [0,0,0,0,0,1|1,1,0]=3 83 B10R1.13 c1cc(ncc1N)C(=O)N BC228144 [0,0,0,0,0,1|3,0,0]=4 84 B10R1.13 c1cc(ncc1N)C(=O)O BC210785 [0,0,0,0,0,1|2,0,0]=3 85 B10R1.13 c1cc(ncc1O)C(=O)O BC224042 [0,0,0,0,0,1|2,0,0]=3 86 B10R1.13 c1cc(nnc1C(=O)O)Cl BC686205 [0,0,0,0,0,1|1,0,0]=2 87 B10R1.113 B(c1cc(cnc1)Cl)(O)O BC226855 [0,0,0,0,0,1|2,0,1]=4 88 B10R1.113 B(c1cccc(c1)Cl)(O)O BC205354 [0,0,0,0,0,1|2,0,1]=4 89 B10R1.113 B(c1cccc(n1)Cl)(O)O BC656274 [0,0,0,0,0,1|2,0,1]=4 90 B10R1.113 B(c1ccnc(c1)Cl)(O)O BC652193 [0,0,0,0,0,1|2,0,1]=4 91 B10R1.113 CC(=O)c1cc(cnc1)Br BC200353 [0,0,0,0,0,1|2,1,0]=4 92 B10R1.113 CC(=O)c1cccc(c1)Br BC217580 [0,0,0,0,0,1|2,1,0]=4 93 B10R1.113 CC(=O)c1cccc(n1)Br BC225218 [0,0,0,0,0,1|2,1,0]=4 94 B10R1.113 Cc1cc(cnc1)C(=O)O BC212576 [0,0,0,0,0,1|2,0,0]=3 95 B10R1.113 Cc1cccc(n1)C(=O)O BC210679 [0,0,0,0,0,1|2,0,0]=3 96 B10R1.113 Cc1ccnc(c1)C(=O)C BC217946 [0,0,0,0,0,1|3,0,0]=4 97 B10R1.113 Cc1nccc(n1)C(=O)O BC684779 [0,0,0,0,0,1|2,0,0]=3 98 B10R1.113 c1c(cncc1Br)C(=O)O BC213725 [0,0,0,0,0,1|1,1,0]=3 99 B10R1.113 c1c(cncc1F)C(=O)O BC228161 [0,0,0,0,0,1|1,1,0]=3 100 B10R1.113 c1c(cncc1N)C(=O)O BC207804 [0,0,0,0,0,1|2,0,0]=3 101 B10R1.113 c1c(cncc1O)C(=O)O BC206883 [0,0,0,0,0,1|2,0,0]=3 102 B10R1.113 c1c(nc(cn1)Cl)C(=O)O BC686580 [0,0,0,0,0,1|1,0,0]=2 103 B10R1.113 c1c(ncnc1Cl)C(=O)O BC652478 [0,0,0,0,0,1|2,0,0]=3 104 B10R1.113 c1c(ncnc1O)C(=O)O BC202213 [0,0,0,0,0,1|3,0,0]=4 105 B10R1.113 c1cc(cc(c1)Cl)C(=O)O BC225403 [0,0,0,0,0,1|1,0,0]=2 106 B10R1.113 c1cc(cc(c1)O)C(=O)O BC676293 [0,0,0,0,0,1|2,0,0]=3 107 B10R1.113 c1cc(nc(c1)Br)C(=O)O BC207990 [0,0,0,0,0,1|1,1,0]=3 108 B10R1.113 c1cc(nc(c1)Cl)C(=O)O BC213732 [0,0,0,0,0,1|1,0,0]=2 109 B10R1.113 c1cc(nc(c1)N)C(=O)O BC220442 [0,0,0,0,0,1|2,0,0]=3 110 B10R1.113 c1cnc(cc1Br)C(=O)O BC208210 [0,0,0,0,0,1|1,1,0]=3 111 B10R1.113 c1cnc(cc1C(=O)O)Br BC207062 [0,0,0,0,0,1|1,1,0]=3 112 B10R1.113 c1cnc(cc1C(=O)O)Cl BC209274 [0,0,0,0,0,1|1,0,0]=2 113 B10R1.113 c1cnc(cc1C(=O)O)N BC220337 [0,0,0,0,0,1|2,0,0]=3 114 B10R1.113 c1cnc(cc1Cl)C(=O)O BC202385 [0,0,0,0,0,1|1,0,0]=2 115 B10R1.113 c1cnc(cc1N)C(=O)O BC651732 [0,0,0,0,0,1|2,0,0]=3 116 B10R1.113 c1cnc(cc1[N+](=O)[O-])Cl BC204589 [0,0,0,0,0,1|2,0,1]=4 117 B10R1.113 c1cnc(nc1C(=O)O)Cl BC266406 [0,0,0,0,0,1|1,0,0]=2 118 B7R1.1 CCc1cccs1 BC210545 [2,0,0,0,0,0|1,0,1]=4 119 B7R1.1 c1c(nc[nH]1)C=O BC207063 [2,0,0,0,0,0|2,0,0]=4 120 B7R1.1 c1c(scn1)C=O BC678913 [2,0,0,0,0,0|1,0,0]=3 121 B7R1.1 c1c(scn1)CO BC200640 [2,0,0,0,0,0|1,0,1]=4 122 B7R1.1 c1c[nH]nc1C=O BC207627 [2,0,0,0,0,0|2,0,0]=4 123 B7R1.1 c1cc([nH]c1)C=O BC210794 [2,0,0,0,0,0|1,0,0]=3 124 B7R1.1 c1cc(sc1)C#N BC205596 [2,0,0,0,0,0|1,0,1]=4 125 B7R1.1 c1cc(sc1)C=O BC225721 [2,0,0,0,0,0|0,0,0]=2 126 B7R1.1 c1cnc([nH]1)C=O BC219962 [2,0,0,0,0,0|2,0,0]=4 127 B7R1.1 c1cnsc1C=O BC677321 [2,0,0,0,0,0|1,0,0]=3 128 B7R1.1 c1conc1C=O BC201897 [2,0,0,0,0,0|2,0,0]=4 129 B7R1.1 c1csc(n1)CO BC676000 [2,0,0,0,0,0|1,0,1]=4 130 B7R1.1 c1cscc1C=O BC676777 [2,0,0,0,0,0|2,0,0]=4 131 B7R1.2 C1=CC(=O)OC1=O BC200750 [2,0,0,0,0,0|1,1,0]=4 132 B7R1.2 c1c(sc(n1)N)Cl BC244531 [2,0,0,0,0,0|2,0,0]=4 133 B7R1.2 c1cc(sc1Br)Br BC689401 [2,0,0,0,0,0|1,1,0]=4 134 B9R1.21 CSc1ccc(s1)C=O BC684303 [1,1,0,0,0,0|1,0,0]=3 135 B9R1.21 c1cc(oc1C=O)C=O BC212150 [1,1,0,0,0,0|1,1,0]=4 136 B9R1.21 c1cc(oc1CO)C=O BC219476 [1,1,0,0,0,0|1,1,0]=4 137 B9R1.21 c1cc(sc1C=O)C=O BC219793 [1,1,0,0,0,0|1,0,0]=3 138 B9R1.22 Cc1cc([nH]c1C=O)C BC227861 [1,1,0,0,0,0|2,0,0]=4 139 B9R1.11 COC(=O)c1c[nH]cn1 BC220005 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.11 COC(=O)c1cc[nH]n1 BC224095 [1,1,0,0,0,0|2,0,0]=4 141 B9R1.11 COC(=O)c1ccco1 BC218745 [1,1,0,0,0,0|0,1,0]=3 142 B9R1.41 Cc1c(nco1)C(=O)O BC650836 [1,1,0,0,0,0|2,0,0]=4 143 B9R1.41 Cc1c(ncs1)C(=O)O BC652152 [1,1,0,0,0,0|2,0,0]=4 144 B9R1.41 Cc1c(ocn1)C(=O)O BC689523 [1,1,0,0,0,0|1,1,0]=4 145 B9R1.41 Cc1c(scn1)C(=O)O BC679074 [1,1,0,0,0,0|1,0,0]=3 146 B9R1.41 Cn1c(ccn1)C(=O)O BC649926 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.41 Cn1cncc1C(=O)O BC220093 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.41 c1csc(c1Br)[N+](=O)[O-] BC210038 [1,1,0,0,0,0|1,0,1]=4 149 B9R1.41 c1csc(c1C(=O)O)F BC655882 [1,1,0,0,0,0|2,0,0]=4 150 B9R1.41 c1csc(c1N)C(=O)O BC288632 [1,1,0,0,0,0|0,0,0]=2 151 B11R1.3 C=Cc1ccc(cc1)C(=O)O BC685896 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.3 CCc1ccc(cc1)C(=O)O BC250059 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.3 CNc1ccc(cc1)C(=O)O BC214404 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.3 COc1ccc(cn1)C(=O)O BC681662 [0,1,0,0,0,1|2,0,0]=4 155 B11R1.3 COc1ccc(nc1)C(=O)O BC650815 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.3 c1cc(ccc1C#N)C(=O)O BC225817 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.3 c1cc(ccc1C(=O)O)NN BC685866 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.3 c1cc(ccc1C=O)C(=O)O BC203124 [0,1,0,0,0,1|2,0,0]=4 159 B11R1.3 c1cc(ccc1CBr)C(=O)O BC211697 [0,1,0,0,0,1|1,1,0]=4 160 B11R1.3 c1cc(ccc1CN)C(=O)O BC219606 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.3 c1cc(ccc1CO)C(=O)O BC215027 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl BC200288 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl BC677102 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC298265 [0,1,0,0,0,1|1,1,0]=4 165 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC672119 [0,1,0,0,0,1|1,1,0]=4 166 B11R1.21 Cc1ccc(cc1Br)C(=O)O BC203701 [0,1,0,0,0,1|2,0,0]=4 167 B11R1.21 Cc1ccc(cc1C)C(=O)O BC215410 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.21 Cc1ccc(cc1I)C(=O)O BC207738 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.21 Cc1ccc(cc1N)C(=O)O BC201386 [0,1,0,0,0,1|2,0,0]=4 170 B11R1.21 Cc1ccc(cc1O)C(=O)O BC676273 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O BC215634 [0,1,0,0,0,1|1,0,0]=3 172 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F BC227458 [0,1,0,0,0,1|1,1,0]=4 173 B11R1.21 c1cc(c(cc1C(=O)O)F)N BC227466 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl BC683731 [0,1,0,0,0,1|1,0,0]=3 175 B11R1.21 c1cc(c(cc1C(=O)O)N)N BC210311 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.21 c1cc(c(cc1C(=O)O)N)O BC226975 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.21 c1cc(c(cc1C(=O)O)O)Cl BC225280 [0,1,0,0,0,1|1,0,0]=3 178 B11R1.21 c1cc(c(cc1C(=O)O)O)N BC225276 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.21 c1cc(nc(c1F)Br)C(=O)O BC297809 [0,1,0,0,0,1|1,1,0]=4 180 B11R1.21 c1cc(nc(c1F)F)C(=O)O BC214611 [0,1,0,0,0,1|1,1,0]=4 181 B11R1.22 COC(=O)c1ccc(cc1)Br BC215377 [0,1,0,0,0,1|1,1,0]=4 182 B11R1.22 COC(=O)c1ccc(cc1)I BC213654 [0,1,0,0,0,1|1,1,0]=4 183 B11R1.22 COC(=O)c1ccc(cc1)[O-] BC209217 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.22 COC(=O)c1ccc(cn1)Br BC219158 [0,1,0,0,0,1|1,1,0]=4 185 B11R1.22 COC(=O)c1ccc(cn1)O BC224006 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.22 COC(=O)c1ccc(nc1)Br BC219205 [0,1,0,0,0,1|1,1,0]=4 187 B11R1.22 COC(=O)c1ccc(nc1)Cl BC219222 [0,1,0,0,0,1|1,0,0]=3 188 B11R1.22 COC(=O)c1ccc(nc1)F BC219217 [0,1,0,0,0,1|1,1,0]=4 189 B11R1.22 COC(=O)c1ccc(nc1)N BC227076 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.22 COC(=O)c1cnc(cn1)Cl BC208084 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.22 Cc1ccc(cn1)C(=O)OC BC207925 [0,1,0,0,0,1|2,0,0]=4 192 B11R1.22 c1cc(ccc1C(=O)CN)Cl BC201170 [0,1,0,0,0,1|2,0,0]=4 193 B11R1.166 CC(=O)c1ccc(cc1Br)Cl BC652621 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.166 CC(=O)c1ccc(cc1F)Cl BC686320 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.166 Cc1c(ccc(n1)F)C(=O)O BC219214 [0,1,0,0,0,1|1,1,0]=4 196 B11R1.166 Cc1cc(c(cn1)C(=O)O)O BC216112 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.166 Cc1cc(ccc1C(=O)O)Cl BC227504 [0,1,0,0,0,1|1,0,0]=3 198 B11R1.166 Cc1cc(ncc1C(=O)O)N BC228733 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O BC676276 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.166 Cc1ccc(c(c1)F)C(=O)O BC225677 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.166 Cc1ccc(c(c1)N)C(=O)O BC225271 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl BC201303 [0,1,0,0,0,1|1,0,0]=3 203 B11R1.166 c1c(cnc(c1Cl)C(=O)O)Cl BC220335 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O BC676270 [0,1,0,0,0,1|1,1,0]=4 205 B11R1.166 c1cc(c(cc1Br)F)C(=O)O BC206179 [0,1,0,0,0,1|1,1,0]=4 206 B11R1.166 c1cc(c(cc1Br)N)C(=O)O BC227467 [0,1,0,0,0,1|1,1,0]=4 207 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O BC210276 [0,1,0,0,0,1|1,0,0]=3 208 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N BC620183 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.166 c1cc(c(cc1F)Br)C(=O)O BC206177 [0,1,0,0,0,1|1,1,0]=4 210 B11R1.166 c1cc(c(cc1F)N)C(=O)O BC204309 [0,1,0,0,0,1|1,1,0]=4 211 B11R1.166 c1cc(c(cc1F)O)C(=O)O BC201515 [0,1,0,0,0,1|1,1,0]=4 212 B11R1.166 c1cc(c(cc1N)F)C(=O)O BC210195 [0,1,0,0,0,1|2,0,0]=4 213 B11R1.166 c1cc(c(cc1N)O)C(=O)O BC205364 [0,1,0,0,0,1|2,0,0]=4 214 B11R1.166 c1cc(c(cc1O)Cl)C(=O)O BC219622 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl BC218961 [0,1,0,0,0,1|1,0,0]=3 216 B11R1.23 CCC(=O)c1cccc(c1)Cl BC226916 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.23 COC(=O)c1cc(ccn1)N BC208664 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.23 COC(=O)c1cc(cnc1)Br BC207471 [0,1,0,0,0,1|1,1,0]=4 219 B11R1.23 COC(=O)c1cccc(c1)O BC220614 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.23 COC(=O)c1cccc(n1)Br BC207501 [0,1,0,0,0,1|1,1,0]=4 221 B11R1.23 COC(=O)c1cccc(n1)Cl BC226662 [0,1,0,0,0,1|1,0,0]=3 222 B11R1.23 COC(=O)c1ccnc(c1)N BC201210 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.23 Cc1cccc(c1)C(=O)OC BC219811 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.23 c1cc(cc(c1)Cl)C(=O)CCl BC219638 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.74 Cc1cc(cc(c1)N)C(=O)O BC676237 [0,1,0,0,0,1|2,0,0]=4 226 B11R1.74 Cc1cc(cc(c1)O)C(=O)O BC203205 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O BC645727 [0,1,0,0,0,1|1,0,0]=3 228 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)Cl BC227418 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O BC676216 [0,1,0,0,0,1|1,0,0]=3 230 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O BC227462 [0,1,0,0,0,1|1,0,0]=3 231 B11R1.74 c1c(cc(cc1O)Br)C(=O)O BC600169 [0,1,0,0,0,1|1,1,0]=4 232 B11R1.74 c1c(cc(cc1O)O)C(=O)O BC676294 [0,1,0,0,0,1|2,0,0]=4 233 B11R1.74 c1c(cc(nc1C(=O)O)Cl)Cl BC678015 [0,1,0,0,0,1|1,0,0]=3 234 B11R1.74 c1c(cc(nc1Cl)Cl)C(=O)O BC207976 [0,1,0,0,0,1|1,0,0]=3 235 B11R1.74 c1c(cc(nc1F)F)C(=O)O BC657180 [0,1,0,0,0,1|1,1,0]=4 236 B11R1.74 c1c(cc(nc1O)O)C(=O)O BC201884 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.159 Cc1c(cccc1F)C(=O)O BC206740 [0,1,0,0,0,1|1,1,0]=4 238 B11R1.159 Cc1c(cccc1O)C(=O)O BC201893 [0,1,0,0,0,1|2,0,0]=4 239 B11R1.159 Cc1cccc(c1Br)C(=O)O BC202429 [0,1,0,0,0,1|2,0,0]=4 240 B11R1.159 Cc1cccc(c1F)C(=O)O BC220220 [0,1,0,0,0,1|2,0,0]=4 241 B11R1.159 Cc1cccc(c1N)C(=O)O BC210202 [0,1,0,0,0,1|2,0,0]=4 242 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O BC201159 [0,1,0,0,0,1|1,1,0]=4 243 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O BC666464 [0,1,0,0,0,1|1,0,0]=3 244 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O BC206796 [0,1,0,0,0,1|1,0,0]=3 245 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O BC220217 [0,1,0,0,0,1|1,1,0]=4 246 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O BC227455 [0,1,0,0,0,1|1,1,0]=4 247 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O BC227465 [0,1,0,0,0,1|1,1,0]=4 248 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O BC206752 [0,1,0,0,0,1|1,1,0]=4 249 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O BC676253 [0,1,0,0,0,1|2,0,0]=4 250 B11R1.159 c1cc(c(c(c1)N)N)C(=O)O BC225268 [0,1,0,0,0,1|2,0,0]=4 251 B11R1.159 c1cc(n(c(=O)c1)O)C(=O)O BC281774 [0,1,0,0,0,1|2,0,0]=4 252 B11R1.159 c1cnc(c(c1C(=O)O)Cl)F BC214602 [0,1,0,0,0,1|1,1,0]=4 253 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl BC681076 [0,1,0,0,0,1|2,0,0]=4 254 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br BC676166 [0,1,0,0,0,1|2,0,0]=4 255 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl BC207064 [0,1,0,0,0,1|2,0,0]=4 256 B11R1.167 Cc1ccc(c(c1)C(=O)O)F BC220223 [0,1,0,0,0,1|2,0,0]=4 257 B11R1.167 Cc1ccc(c(c1)C(=O)O)I BC676196 [0,1,0,0,0,1|2,0,0]=4 258 B11R1.167 Cc1ccc(cc1C(=O)O)Br BC222446 [0,1,0,0,0,1|1,1,0]=4 259 B11R1.167 Cc1ccc(cc1C(=O)O)I BC219784 [0,1,0,0,0,1|1,1,0]=4 260 B11R1.167 Cc1ccc(cc1C(=O)O)N BC202438 [0,1,0,0,0,1|2,0,0]=4 261 B11R1.167 Cc1ccc(cc1C(=O)O)O BC202426 [0,1,0,0,0,1|2,0,0]=4 262 B11R1.167 Cc1ncc(c(n1)C(=O)O)Br BC686534 [0,1,0,0,0,1|2,0,0]=4 263 B11R1.167 c1c(c(cnc1Cl)N)C(=O)O BC227048 [0,1,0,0,0,1|1,0,0]=3 264 B11R1.167 c1c(c(nnc1Cl)Cl)C(=O)O BC201462 [0,1,0,0,0,1|2,0,0]=4 265 B11R1.167 c1c(cnc(c1C(=O)O)Cl)Cl BC219210 [0,1,0,0,0,1|1,0,0]=3 266 B11R1.167 c1c(cnc(c1C(=O)O)Cl)F BC219207 [0,1,0,0,0,1|1,1,0]=4 267 B11R1.167 c1c(cnc(c1C(=O)O)F)Cl BC219211 [0,1,0,0,0,1|1,0,0]=3 268 B11R1.167 c1c(cnc(c1C(=O)O)F)F BC214613 [0,1,0,0,0,1|1,1,0]=4 269 B11R1.167 c1c(cnc(c1C(=O)O)N)Cl BC228739 [0,1,0,0,0,1|1,0,0]=3 270 B11R1.167 c1c(cnc(c1C(=O)O)O)Br BC209271 [0,1,0,0,0,1|1,1,0]=4 271 B11R1.167 c1c(cnc(c1C(=O)O)O)F BC219212 [0,1,0,0,0,1|1,1,0]=4 272 B11R1.167 c1c(nc(c(n1)N)C(=O)O)Br BC655671 [0,1,0,0,0,1|1,1,0]=4 273 B11R1.167 c1cc(c(cc1Br)C(=O)O)Br BC201121 [0,1,0,0,0,1|1,1,0]=4 274 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl BC226435 [0,1,0,0,0,1|1,1,0]=4 275 B11R1.167 c1cc(c(cc1Br)C(=O)O)F BC206180 [0,1,0,0,0,1|1,1,0]=4 276 B11R1.167 c1cc(c(cc1F)C(=O)O)Br BC206178 [0,1,0,0,0,1|1,1,0]=4 277 B11R1.167 c1cc(c(cc1I)C(=O)O)I BC676267 [0,1,0,0,0,1|1,1,0]=4 278 B11R1.167 c1cc(c(cc1O)C(=O)O)F BC227490 [0,1,0,0,0,1|2,0,0]=4 279 B11R1.167 c1cc(c(cc1O)C(=O)O)N BC214917 [0,1,0,0,0,1|2,0,0]=4 280 B11R1.167 c1cc(nc(c1Cl)C(=O)O)Cl BC210323 [0,1,0,0,0,1|1,0,0]=3 281 B11R1.266 COc1ccnc(c1)C(=O)O BC645914 [0,1,0,0,0,1|2,0,0]=4 282 B11R1.266 c1c(cncc1C(=O)O)C#N BC207474 [0,1,0,0,0,1|2,0,0]=4 283 B11R1.266 c1cc(cc(c1)C(=O)O)C#N BC675645 [0,1,0,0,0,1|2,0,0]=4 284 B11R1.266 c1cc(cc(c1)C(=O)O)C=O BC211730 [0,1,0,0,0,1|2,0,0]=4 285 B11R1.266 c1cc(cc(c1)C(=O)O)CN BC211732 [0,1,0,0,0,1|2,0,0]=4 286 B11R1.266 c1cc(cc(c1)C(=O)O)CO BC211729 [0,1,0,0,0,1|2,0,0]=4 287 B11R1.15 CCOC(=O)c1cnc(s1)Br BC201204 [0,2,0,0,0,0|1,1,0]=4 288 B11R1.15 CCOC(=O)c1cnc(s1)N BC677003 [0,2,0,0,0,0|2,0,0]=4 289 B11R1.226 COC(=O)c1cc(c(s1)N)N BC249479 [0,2,0,0,0,0|1,0,0]=3 290 B11R1.175 c1cc(sc1C(=O)O)[N+](=O)[O-] BC201529 [0,2,0,0,0,0|1,0,0]=3 291 B11R1.79 c1c(c(sc1S(=O)(=O)N)Cl)Cl BC210540 [0,2,0,0,0,0|1,0,1]=4 292 B9R1.69 Cc1ccc(cc1O)Cl BC683431 [0,0,1,1,0,0|2,0,0]=4 293 B9R1.69 c1cc(c(cc1Cl)Cl)S BC646085 [0,0,1,1,0,0|2,0,0]=4 294 B9R1.2 Cc1cccc(n1)C=O BC202245 [1,0,0,0,0,1|2,0,0]=4 295 B9R1.2 Cc1nccc(n1)C=O BC200464 [1,0,0,0,0,1|2,0,0]=4 296 B9R1.2 c1c(cncc1F)C=O BC227139 [1,0,0,0,0,1|1,1,0]=4 297 B9R1.2 c1cc(cc(c1)Br)C=O BC211001 [1,0,0,0,0,1|1,1,0]=4 298 B9R1.2 c1cc(cc(c1)Cl)C=O BC227688 [1,0,0,0,0,1|1,0,0]=3 299 B9R1.2 c1cc(cc(c1)O)C=O BC226069 [1,0,0,0,0,1|2,0,0]=4 300 B9R1.2 c1cc(nc(c1)Cl)C=O BC200574 [1,0,0,0,0,1|1,0,0]=3 301 B9R1.2 c1cc(nc(c1)Cl)CO BC208690 [1,0,0,0,0,1|1,0,1]=4 302 B9R1.2 c1cnc(cc1C=O)Br BC207461 [1,0,0,0,0,1|1,1,0]=4 303 B9R1.2 c1cnc(cc1C=O)Cl BC222332 [1,0,0,0,0,1|1,0,0]=3 304 B9R1.2 c1cnc(cc1C=O)O BC229040 [1,0,0,0,0,1|2,0,0]=4 305 B9R1.2 c1cnc(cc1CO)Cl BC208450 [1,0,0,0,0,1|1,0,1]=4 306 B9R1.13 c1c(nc[nH]1)CC(=O)O BC224082 [1,0,0,0,0,1|2,0,0]=4 307 B9R1.13 c1cc(sc1)CC(=O)Cl BC684363 [1,0,0,0,0,1|1,0,0]=3 308 B9R1.13 c1cc(sc1)CC(=O)O BC201507 [1,0,0,0,0,1|0,0,0]=2 309 B9R1.13 c1cnc([nH]1)CC(=O)O BC237657 [1,0,0,0,0,1|2,0,0]=4 310 B9R1.13 c1cnn(c1)CC(=O)O BC620120 [1,0,0,0,0,1|2,0,0]=4 311 B11R1.20 c1cc(ccc1CC(=O)O)Br BC203407 [0,0,0,0,0,2|1,1,0]=4 312 B11R1.20 c1cc(ccc1CC(=O)O)O BC228201 [0,0,0,0,0,2|2,0,0]=4 313 B11R1.157 c1c(cncc1Br)CC(=O)O BC670873 [0,0,0,0,0,2|1,1,0]=4 314 B11R1.157 c1cc(cc(c1)Br)CC(=O)O BC210255 [0,0,0,0,0,2|1,1,0]=4 315 B11R1.157 c1cc(cc(c1)Cl)CC(=O)O BC226914 [0,0,0,0,0,2|1,0,0]=3 316 B11R1.157 c1cc(cc(c1)I)CC(=O)O BC227537 [0,0,0,0,0,2|1,1,0]=4 317 B11R1.157 c1cc(cc(c1)N)CC(=O)O BC676470 [0,0,0,0,0,2|2,0,0]=4