0 B9R1.35 C1CC(=O)C=C1C(=O)O BC675996 [1,0,0,0,0,0|2,0,1]=4 1 B9R1.35 CC(=O)c1cc(cs1)Cl BC226225 [1,0,0,0,0,0|2,0,0]=3 2 B9R1.35 Cc1[nH]cc(n1)C(=O)O BC679140 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.35 Cc1cc(no1)C(=O)Cl BC684298 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.35 Cc1cc(no1)C(=O)O BC650587 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.35 Cc1cc(on1)C(=O)O BC645510 [1,0,0,0,0,0|1,1,0]=3 6 B9R1.35 Cc1ccc(o1)C(=O)C BC218741 [1,0,0,0,0,0|2,1,0]=4 7 B9R1.35 Cc1ccc(s1)C(=O)O BC213236 [1,0,0,0,0,0|1,0,0]=2 8 B9R1.35 Cc1cnc(s1)C(=O)O BC675563 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.35 Cc1csc(n1)C(=O)O BC675561 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.35 Cc1nc(co1)C(=O)O BC203608 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.35 Cc1ncc(s1)C(=O)O BC681903 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.35 Cn1cc(nc1)C(=O)O BC219620 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.35 Cn1cnc(n1)C(=O)O BC256926 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.35 c1c(csc1C(=O)O)Br BC676028 [1,0,0,0,0,0|1,0,0]=2 15 B9R1.35 c1cc(sc1C(=O)O)Cl BC219931 [1,0,0,0,0,0|0,0,0]=1 16 B11R1.79 c1c(c(sc1S(=O)(=O)N)Cl)Cl BC210540 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.226 COC(=O)c1cc(c(s1)N)N BC249479 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl BC200288 [0,0,0,0,0,1|3,0,0]=4 19 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl BC677102 [0,0,0,0,0,1|3,0,0]=4 20 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC298265 [0,0,0,0,0,1|1,1,0]=3 21 B11R1.21 Cc1cc(ncc1Br)C(=O)O BC672119 [0,0,0,0,0,1|1,1,0]=3 22 B11R1.21 Cc1ccc(cc1Br)C(=O)O BC203701 [0,0,0,0,0,1|1,1,0]=3 23 B11R1.21 Cc1ccc(cc1C)C(=O)O BC215410 [0,0,0,0,0,1|2,0,0]=3 24 B11R1.21 Cc1ccc(cc1I)C(=O)Cl BC261034 [0,0,0,0,0,1|2,1,0]=4 25 B11R1.21 Cc1ccc(cc1I)C(=O)O BC207738 [0,0,0,0,0,1|1,1,0]=3 26 B11R1.21 Cc1ccc(cc1N)C(=O)O BC201386 [0,0,0,0,0,1|2,0,0]=3 27 B11R1.21 Cc1ccc(cc1O)C(=O)O BC676273 [0,0,0,0,0,1|2,0,0]=3 28 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O BC200650 [0,0,0,0,0,1|3,0,0]=4 29 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O BC220525 [0,0,0,0,0,1|3,0,0]=4 30 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O BC215634 [0,0,0,0,0,1|2,0,0]=3 31 B11R1.21 c1cc(c(cc1C(=O)O)Cl)F BC227458 [0,0,0,0,0,1|2,0,0]=3 32 B11R1.21 c1cc(c(cc1C(=O)O)F)N BC227466 [0,0,0,0,0,1|2,1,0]=4 33 B11R1.21 c1cc(c(cc1C(=O)O)I)Cl BC683731 [0,0,0,0,0,1|2,0,0]=3 34 B11R1.21 c1cc(c(cc1C(=O)O)N)N BC210311 [0,0,0,0,0,1|3,0,0]=4 35 B11R1.21 c1cc(c(cc1C(=O)O)N)O BC226975 [0,0,0,0,0,1|3,0,0]=4 36 B11R1.21 c1cc(c(cc1C(=O)O)O)Cl BC225280 [0,0,0,0,0,1|2,0,0]=3 37 B11R1.21 c1cc(c(cc1C(=O)O)O)N BC225276 [0,0,0,0,0,1|3,0,0]=4 38 B11R1.21 c1cc(nc(c1F)Br)C(=O)O BC297809 [0,0,0,0,0,1|2,1,0]=4 39 B11R1.21 c1cc(nc(c1F)F)C(=O)O BC214611 [0,0,0,0,0,1|2,1,0]=4 40 B11R1.74 Cc1cc(cc(c1)C(=O)Cl)C BC209254 [0,0,0,0,0,1|3,0,0]=4 41 B11R1.74 Cc1cc(cc(c1)Cl)[N+](=O)[O-] BC653641 [0,0,0,0,0,1|2,0,1]=4 42 B11R1.74 Cc1cc(cc(c1)N)C(=O)O BC676237 [0,0,0,0,0,1|2,0,0]=3 43 B11R1.74 Cc1cc(cc(c1)O)C(=O)O BC203205 [0,0,0,0,0,1|2,0,0]=3 44 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O BC645727 [0,0,0,0,0,1|2,0,0]=3 45 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)Cl BC227418 [0,0,0,0,0,1|3,0,0]=4 46 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O BC676216 [0,0,0,0,0,1|2,0,0]=3 47 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O BC227462 [0,0,0,0,0,1|2,0,0]=3 48 B11R1.74 c1c(cc(cc1O)Br)C(=O)O BC600169 [0,0,0,0,0,1|2,1,0]=4 49 B11R1.74 c1c(cc(cc1O)O)C(=O)O BC676294 [0,0,0,0,0,1|3,0,0]=4 50 B11R1.74 c1c(cc(nc1C(=O)O)Cl)Cl BC678015 [0,0,0,0,0,1|2,0,0]=3 51 B11R1.74 c1c(cc(nc1Cl)Cl)C(=O)O BC207976 [0,0,0,0,0,1|2,0,0]=3 52 B11R1.74 c1c(cc(nc1F)F)C(=O)O BC657180 [0,0,0,0,0,1|2,1,0]=4 53 B11R1.74 c1c(cc(nc1O)O)C(=O)O BC201884 [0,0,0,0,0,1|3,0,0]=4 54 B8R1.1 Cc1cc(sc1)C=O BC645199 [2,0,0,0,0,0|0,0,0]=2 55 B8R1.1 Cc1csc(n1)C=O BC203023 [2,0,0,0,0,0|1,0,0]=3 56 B8R1.1 Cc1ncc(s1)C=O BC650857 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.1 c1c(coc1C=O)Br BC645867 [2,0,0,0,0,0|1,1,0]=4 58 B8R1.1 c1c(csc1C=O)Br BC678555 [2,0,0,0,0,0|1,0,0]=3 59 B8R1.1 c1c(sc(n1)N)C=O BC220680 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.7 B(c1cccs1)(O)O BC210702 [2,0,0,0,0,0|1,0,1]=4 61 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.7 c1c(nco1)C(=O)O BC677324 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.7 c1c(scn1)C(=O)O BC677323 [2,0,0,0,0,0|1,0,0]=3 64 B8R1.7 c1c[nH]nc1C(=O)O BC203654 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.7 c1cc([nH]c1)C(=O)O BC220697 [2,0,0,0,0,0|1,0,0]=3 66 B8R1.7 c1cc(oc1)C(=O)Cl BC226346 [2,0,0,0,0,0|1,1,0]=4 67 B8R1.7 c1cnsc1C(=O)O BC202175 [2,0,0,0,0,0|1,0,0]=3 68 B8R1.7 c1conc1C(=O)O BC207645 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.7 c1csc(n1)C(=O)O BC651955 [2,0,0,0,0,0|1,0,0]=3 70 B8R1.7 c1cscc1C(=O)O BC213229 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.14 COC(=O)c1cc(cs1)N BC672043 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.14 COC(=O)c1ccc(s1)N BC645938 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.14 COC(=O)c1cnc(s1)Br BC219624 [1,1,0,0,0,0|1,1,0]=4 74 B10R1.14 COC(=O)c1cnc(s1)N BC684872 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.31 COc1cc(sc1)C(=O)Cl BC676009 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.31 c1c(csc1C(=O)O)C#N BC645474 [1,1,0,0,0,0|0,0,1]=3 77 B10R1.31 c1cc(sc1C=O)C(=O)O BC685955 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.55 c1cc(sc1S(=O)(=O)Cl)Cl BC210425 [1,1,0,0,0,0|1,0,1]=4 79 B12R1.48 CCc1ccc(cc1N)C(=O)O BC201184 [0,1,0,0,0,1|2,0,0]=4 80 B12R1.48 CCc1ccc(cc1O)C(=O)O BC222051 [0,1,0,0,0,1|2,0,0]=4 81 B12R1.48 COc1ccc(cc1N)C(=O)O BC210201 [0,1,0,0,0,1|2,0,0]=4 82 B12R1.48 COc1ccc(cc1O)C(=O)O BC203589 [0,1,0,0,0,1|2,0,0]=4 83 B12R1.56 COc1cc(ccc1N)C(=O)O BC225277 [0,1,0,0,0,1|2,0,0]=4 84 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F BC676282 [0,1,0,0,0,1|1,1,0]=4 85 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O BC220174 [0,1,0,0,0,1|1,1,0]=4 86 B12R1.232 Cc1cc(c(cc1O)C)C(=O)O BC600009 [0,1,0,0,0,1|2,0,0]=4 87 B12R1.232 c1c(c(cc(c1Cl)Cl)F)C(=O)O BC227472 [0,1,0,0,0,1|2,0,0]=4 88 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O BC676485 [0,1,0,0,0,1|2,0,0]=4 89 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O BC220227 [0,1,0,0,0,1|2,0,0]=4 90 B12R1.367 COC(=O)c1ccc(c(c1)N)Cl BC206643 [0,1,0,0,0,1|2,0,0]=4 91 B12R1.367 Cc1cc(ccc1O)C(=O)OC BC205258 [0,1,0,0,0,1|2,0,0]=4 92 B12R1.367 Cc1ccc(cc1I)C(=O)OC BC687190 [0,1,0,0,0,1|1,1,0]=4 93 B12R1.367 Cc1ccc(cc1O)C(=O)OC BC201412 [0,1,0,0,0,1|2,0,0]=4 94 B12R1.1005 Cc1c(cc(cc1F)C(=O)O)N BC676497 [0,1,0,0,0,1|1,1,0]=4 95 B12R1.1005 Cc1c(cc(cc1O)C(=O)O)O BC203422 [0,1,0,0,0,1|2,0,0]=4 96 B12R1.1005 c1c(cc(c(c1Cl)Cl)Cl)C(=O)O BC638985 [0,1,0,0,0,1|2,0,0]=4 97 B12R1.1005 c1c(cc(c(c1Cl)F)Cl)C(=O)O BC676164 [0,1,0,0,0,1|2,0,0]=4 98 B12R1.358 COC(=O)c1cc(nc(c1)Cl)Cl BC207978 [0,1,0,0,0,1|2,0,0]=4 99 B12R1.511 Cc1cc(cc(c1N)C(=O)O)Cl BC213361 [0,1,0,0,0,1|1,0,0]=3 100 B10R1.113 c1cc(cc(c1)Cl)C(=O)O BC225403 [0,0,1,1,0,0|1,0,1]=4 101 B10R1.113 c1cc(nc(c1)Cl)C(=O)O BC213732 [0,0,1,1,0,0|1,0,1]=4 102 B10R1.113 c1cnc(cc1C(=O)O)Cl BC209274 [0,0,1,1,0,0|2,0,0]=4 103 B10R1.113 c1cnc(nc1C(=O)O)Cl BC266406 [0,0,1,1,0,0|2,0,0]=4 104 B10R1.8 Cc1cc(cc(c1)Br)C=O BC658842 [1,0,0,0,0,1|1,1,0]=4 105 B10R1.8 Cc1cc(cc(c1)C=O)C BC219818 [1,0,0,0,0,1|2,0,0]=4 106 B10R1.8 c1c(cc(cc1F)Cl)C=O BC227700 [1,0,0,0,0,1|2,0,0]=4 107 B12R1.19 c1cc(c(cc1CC(=O)O)Cl)Cl BC676800 [0,0,0,0,0,2|2,0,0]=4 108 B12R1.19 c1cc(c(cc1CC(=O)O)Cl)O BC206348 [0,0,0,0,0,2|2,0,0]=4 109 B12R1.101 c1c(cc(cc1F)Cl)CC(=O)O BC676515 [0,0,0,0,0,2|2,0,0]=4