0 B10R1.58 B(c1cc(c(s1)C)Br)(O)O AB55299 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.58 B(c1cc(n(c1)C)Cl)(O)O MB18101 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.58 Cc1cc(nn1C)C(=O)O AB03175 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.58 Cc1nc(nn1C)C(=O)O AB84872 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.58 Cn1c(cc(n1)C(=O)O)N PB19094 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.58 Cn1c(cc(n1)C(=O)O)O AB62568 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.58 c1c(c(sc1C(=O)N)Br)Br AB06057 [0,0,0,0,0,0|2,1,0]=3 7 B9R1.23 Cc1cc(sc1Br)C=O PB24914 [1,0,0,0,0,0|0,1,0]=2 8 B9R1.23 Cc1cc(sc1C)CN AB72614 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.35 B(c1cc(co1)C)(O)O AB08042 [1,0,0,0,0,0|1,1,1]=4 10 B9R1.35 B(c1cc(cs1)Br)(O)O AB13406 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.35 B(c1cc(cs1)C)(O)O AB08861 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.35 B(c1cc(cs1)Cl)(O)O AB13521 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.35 B(c1cc(cs1)F)(O)O AB73949 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.35 B(c1ccc(s1)Br)(O)O AB10878 [1,0,0,0,0,0|1,1,1]=4 15 B9R1.35 B(c1ccc(s1)C)(O)O PB21738 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.35 B(c1ccc(s1)Cl)(O)O AB05338 [1,0,0,0,0,0|1,0,1]=3 17 B9R1.35 C1=C(N=CC1N)C(=O)O AB43641 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.35 C1=NC(=NC1C(=O)O)Cl AB57013 [1,0,0,0,0,0|2,0,1]=4 19 B9R1.35 C1=NC(=O)N=C1C(=O)O AB09197 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.35 C1C=C(N=C1Br)C(=O)O MB19809 [1,0,0,0,0,0|1,1,1]=4 21 B9R1.35 C1CC(=O)C=C1C(=O)O CB11482 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.35 CC(=O)C1=NC=C(C1)Cl AB52884 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.35 CC(=O)c1cc(cs1)Cl PB13009 [1,0,0,0,0,0|2,0,0]=3 24 B9R1.35 CC(=O)c1cc(sc1)Cl PB18443 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.35 CC(=O)c1ccc(o1)Br AB25597 [1,0,0,0,0,0|1,2,0]=4 26 B9R1.35 CC(=O)c1ccc(s1)Br PB24550 [1,0,0,0,0,0|1,1,0]=3 27 B9R1.35 CC(=O)c1ccc(s1)Cl PB11578 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.35 CC(=O)c1cnc(s1)Br AB69536 [1,0,0,0,0,0|2,1,0]=4 29 B9R1.35 CC(=O)c1cnc(s1)N AB07075 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.35 CC(=O)c1coc(n1)Cl AB77007 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.35 CC(=O)c1nc(cs1)Br AB59795 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.35 CC(=O)c1ncc(s1)Br PB19039 [1,0,0,0,0,0|2,1,0]=4 33 B9R1.35 CC(=O)c1ncc(s1)Cl PB35653 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.35 CC1=NC(=NC1)C(=O)O AB53262 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.35 CC1=NN=C(C1)C(=O)O PB13019 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.35 Cc1[nH]c(cn1)C(=O)O AB05025 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.35 Cc1[nH]c(nn1)C(=O)O AB12749 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.35 Cc1[nH]c(nn1)C(=O)O AB57423 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.35 Cc1cc(cs1)C(=O)O PB14265 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.35 Cc1cc(no1)C(=O)O CB10494 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.35 Cc1cc(sc1)C(=O)O PB14117 [1,0,0,0,0,0|0,0,0]=1 42 B9R1.35 Cc1ccc(s1)C(=O)C AB01148 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.35 Cc1ccc(s1)C(=O)O AB00425 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.35 Cc1cnc(o1)C(=O)O AB53258 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.35 Cc1cnc(s1)C(=O)O AB43204 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.35 Cc1coc(n1)C(=O)O PB31618 [1,0,0,0,0,0|1,1,0]=3 47 B9R1.35 Cc1csc(n1)C(=O)C AB32246 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.35 Cc1csc(n1)C(=O)O PB26270 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.35 Cc1nc(co1)C(=O)O AB05124 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.35 Cc1nc(cs1)C(=O)O AB14027 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.35 Cc1nc(no1)C(=O)O AB44082 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.35 Cc1nc(on1)C(=O)O AB55970 [1,0,0,0,0,0|2,1,0]=4 53 B9R1.35 Cc1ncc(s1)C(=O)O PB12949 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.35 Cc1nnc(s1)C(=O)O AB65141 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.35 Cn1cc(cn1)C(=O)O PB27447 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.35 Cn1cc(nc1)C(=O)O PB21172 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.35 Cn1cc(nn1)C(=O)O AB48246 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.35 Cn1ccc(n1)C(=O)O PB29090 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.35 c1([nH]c(nn1)Cl)C(=O)O MB09048 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.35 c1c(coc1Br)C(=O)O AB45895 [1,0,0,0,0,0|2,1,0]=4 61 B9R1.35 c1c(coc1C(=O)N)Br AB65725 [1,0,0,0,0,0|2,1,0]=4 62 B9R1.35 c1c(coc1C(=O)O)Br AB03318 [1,0,0,0,0,0|1,1,0]=3 63 B9R1.35 c1c(csc1Br)C(=O)O PB20302 [1,0,0,0,0,0|2,1,0]=4 64 B9R1.35 c1c(csc1C(=O)N)Br AB53759 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.35 c1c(csc1C(=O)O)Br PB29256 [1,0,0,0,0,0|1,0,0]=2 66 B9R1.35 c1c(csc1C(=O)O)Cl PB25964 [1,0,0,0,0,0|1,0,0]=2 67 B9R1.35 c1c(csc1Cl)C(=O)N AB09992 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.35 c1c(csc1Cl)C(=O)O PB17106 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.35 c1c(csc1F)C(=O)O PB18609 [1,0,0,0,0,0|2,1,0]=4 70 B9R1.35 c1c(nc(o1)Br)C(=O)O PB14959 [1,0,0,0,0,0|2,1,0]=4 71 B9R1.35 c1c(nc(o1)C(=O)O)Br AB59761 [1,0,0,0,0,0|2,1,0]=4 72 B9R1.35 c1c(nc(o1)Cl)C(=O)O PB20528 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.35 c1c(nc(o1)N)C(=O)O PB31410 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.35 c1c(nc(s1)Br)C(=O)O AB20482 [1,0,0,0,0,0|2,1,0]=4 75 B9R1.35 c1c(nc(s1)C(=O)N)Br AB65719 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.35 c1c(nc(s1)C(=O)O)Br PB32743 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.35 c1c(nc(s1)Cl)C(=O)O CB11341 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.35 c1c(nc(s1)N)C(=O)O AB07466 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.35 c1c(onc1Br)C(=O)O AB32047 [1,0,0,0,0,0|2,1,0]=4 80 B9R1.35 c1c(sc(n1)Br)C(=O)N MB08396 [1,0,0,0,0,0|2,1,0]=4 81 B9R1.35 c1c(sc(n1)Br)C(=O)O PB12322 [1,0,0,0,0,0|1,1,0]=3 82 B9R1.35 c1c(sc(n1)C(=O)N)Br MB14267 [1,0,0,0,0,0|2,1,0]=4 83 B9R1.35 c1c(sc(n1)C(=O)O)Br PB31583 [1,0,0,0,0,0|1,1,0]=3 84 B9R1.35 c1c(sc(n1)C(=O)O)Cl PB26550 [1,0,0,0,0,0|1,0,0]=2 85 B9R1.35 c1c(sc(n1)C(=O)O)N PB33442 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.35 c1c(sc(n1)C(=O)O)N PB37974 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.35 c1c(sc(n1)N)C(=O)O AB23200 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.35 c1cc(sc1C(=O)Cl)Cl AB01959 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.35 c1cc(sc1C(=O)O)Br PB21666 [1,0,0,0,0,0|0,1,0]=2 90 B9R1.35 c1cc(sc1C(=O)O)Cl PB12047 [1,0,0,0,0,0|0,0,0]=1 91 B9R1.35 c1cc(sc1C(=O)O)F PB22097 [1,0,0,0,0,0|0,1,0]=2 92 B9R1.35 c1cc(sc1C(=O)O)N MB07244 [1,0,0,0,0,0|1,0,0]=2 93 B11R1.48 CCc1cc(nn1C)C(=O)O AB19578 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.48 Cn1cc(nc1OC)C(=O)O AB66833 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.21 B(c1cc(c(nc1)C)Cl)(O)O AB74638 [0,0,0,0,0,1|2,0,1]=4 96 B11R1.21 B(c1cc(c(nc1)Cl)C)(O)O AB14149 [0,0,0,0,0,1|2,0,1]=4 97 B11R1.21 B(c1ccc(c(c1)C)Cl)(O)O AB12318 [0,0,0,0,0,1|2,0,1]=4 98 B11R1.21 B(c1ccc(c(c1)Cl)C)(O)O AB17244 [0,0,0,0,0,1|2,0,1]=4 99 B11R1.21 CC(=O)c1cc(c(cn1)Cl)Cl AB73180 [0,0,0,0,0,1|3,0,0]=4 100 B11R1.21 CC(=O)c1cc(c(cn1)Cl)F AB82986 [0,0,0,0,0,1|3,0,0]=4 101 B11R1.21 CC(=O)c1cc(c(cn1)Cl)N AB83914 [0,0,0,0,0,1|3,0,0]=4 102 B11R1.21 CC(=O)c1cc(c(cn1)Cl)O AB75003 [0,0,0,0,0,1|3,0,0]=4 103 B11R1.21 CC(=O)c1cc(c(cn1)F)Cl AB83156 [0,0,0,0,0,1|3,0,0]=4 104 B11R1.21 CC(=O)c1cc(c(cn1)N)Cl AB83892 [0,0,0,0,0,1|3,0,0]=4 105 B11R1.21 CC(=O)c1cc(c(cn1)O)Cl AB75001 [0,0,0,0,0,1|3,0,0]=4 106 B11R1.21 CC(=O)c1cc(c(nc1)Cl)Cl AB60291 [0,0,0,0,0,1|3,0,0]=4 107 B11R1.21 CC(=O)c1cc(c(nc1)Cl)F AB74574 [0,0,0,0,0,1|3,0,0]=4 108 B11R1.21 CC(=O)c1cc(c(nc1)Cl)N AB83970 [0,0,0,0,0,1|3,0,0]=4 109 B11R1.21 CC(=O)c1cc(c(nc1)Cl)O AB74793 [0,0,0,0,0,1|3,0,0]=4 110 B11R1.21 CC(=O)c1cc(c(nc1)F)Cl AB75049 [0,0,0,0,0,1|3,0,0]=4 111 B11R1.21 CC(=O)c1cc(c(nc1)N)Cl AB74572 [0,0,0,0,0,1|3,0,0]=4 112 B11R1.21 CC(=O)c1cc(c(nc1)O)Cl AB84068 [0,0,0,0,0,1|3,0,0]=4 113 B11R1.21 CC(=O)c1ccc(c(n1)Cl)F AB75031 [0,0,0,0,0,1|3,0,0]=4 114 B11R1.21 CC(=O)c1ccc(c(n1)Cl)N AB51559 [0,0,0,0,0,1|3,0,0]=4 115 B11R1.21 CC(=O)c1ccc(c(n1)Cl)O AB74855 [0,0,0,0,0,1|3,0,0]=4 116 B11R1.21 Cc1c(cc(cn1)C(=O)C)Cl AB74646 [0,0,0,0,0,1|2,0,0]=3 117 B11R1.21 Cc1c(cc(cn1)C(=O)C)F AB83026 [0,0,0,0,0,1|2,1,0]=4 118 B11R1.21 Cc1c(cc(cn1)C(=O)O)Br AB74944 [0,0,0,0,0,1|1,1,0]=3 119 B11R1.21 Cc1c(cc(cn1)C(=O)O)Cl AB74644 [0,0,0,0,0,1|1,0,0]=2 120 B11R1.21 Cc1c(cc(cn1)C(=O)O)F AB71562 [0,0,0,0,0,1|1,1,0]=3 121 B11R1.21 Cc1c(cc(cn1)C(=O)O)N PB30351 [0,0,0,0,0,1|2,0,0]=3 122 B11R1.21 Cc1c(cc(cn1)C(=O)O)O AB74651 [0,0,0,0,0,1|2,0,0]=3 123 B11R1.21 Cc1c(ccc(n1)C(=O)C)Cl AB83319 [0,0,0,0,0,1|3,0,0]=4 124 B11R1.21 Cc1c(ccc(n1)C(=O)O)Cl AB74921 [0,0,0,0,0,1|2,0,0]=3 125 B11R1.21 Cc1c(ccc(n1)C(=O)O)F AB62793 [0,0,0,0,0,1|2,1,0]=4 126 B11R1.21 Cc1c(nc(cn1)C(=O)C)C AB21776 [0,0,0,0,0,1|3,0,0]=4 127 B11R1.21 Cc1c(nc(cn1)C(=O)O)C AB13799 [0,0,0,0,0,1|2,0,0]=3 128 B11R1.21 Cc1c(ncc(n1)C(=O)O)Cl AB71835 [0,0,0,0,0,1|2,0,0]=3 129 B11R1.21 Cc1c(ncc(n1)C(=O)O)F AB85697 [0,0,0,0,0,1|2,1,0]=4 130 B11R1.21 Cc1cc(ccc1O)C(=O)N MB23357 [0,0,0,0,0,1|3,0,0]=4 131 B11R1.21 Cc1cc(cnc1Br)C(=O)O AB62965 [0,0,0,0,0,1|1,1,0]=3 132 B11R1.21 Cc1cc(cnc1C)C(=O)C AB75410 [0,0,0,0,0,1|3,0,0]=4 133 B11R1.21 Cc1cc(cnc1C)C(=O)O AB66691 [0,0,0,0,0,1|2,0,0]=3 134 B11R1.21 Cc1cc(cnc1Cl)C(=O)C AB75129 [0,0,0,0,0,1|2,0,0]=3 135 B11R1.21 Cc1cc(cnc1Cl)C(=O)O AB71754 [0,0,0,0,0,1|1,0,0]=2 136 B11R1.21 Cc1cc(cnc1Cl)[N+](=O)[O-] PB25986 [0,0,0,0,0,1|2,0,1]=4 137 B11R1.21 Cc1cc(cnc1F)C(=O)C AB75174 [0,0,0,0,0,1|2,1,0]=4 138 B11R1.21 Cc1cc(cnc1F)C(=O)O AB42633 [0,0,0,0,0,1|1,1,0]=3 139 B11R1.21 Cc1cc(ncc1Br)C(=O)O AB41173 [0,0,0,0,0,1|1,1,0]=3 140 B11R1.21 Cc1cc(ncc1C)C(=O)C AB74626 [0,0,0,0,0,1|3,0,0]=4 141 B11R1.21 Cc1cc(ncc1C)C(=O)O AB64943 [0,0,0,0,0,1|2,0,0]=3 142 B11R1.21 Cc1cc(ncc1Cl)C(=O)C AB75107 [0,0,0,0,0,1|2,0,0]=3 143 B11R1.21 Cc1cc(ncc1Cl)C(=O)O AB41176 [0,0,0,0,0,1|1,0,0]=2 144 B11R1.21 Cc1cc(ncc1F)C(=O)O AB74791 [0,0,0,0,0,1|1,1,0]=3 145 B11R1.21 Cc1ccc(cc1O)C(=O)N AB63532 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.21 Cc1ccc(nc1C)C(=O)C AB74623 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.21 Cc1ccc(nc1C)C(=O)O AB62927 [0,0,0,0,0,1|2,0,0]=3 148 B11R1.21 Cc1ccc(nc1Cl)C(=O)C AB75095 [0,0,0,0,0,1|2,0,0]=3 149 B11R1.21 Cc1ccc(nc1Cl)C(=O)O AB66617 [0,0,0,0,0,1|1,0,0]=2 150 B11R1.21 Cc1ccc(nc1F)C(=O)C AB75167 [0,0,0,0,0,1|2,1,0]=4 151 B11R1.21 Cc1ccc(nc1F)C(=O)O AB72844 [0,0,0,0,0,1|1,1,0]=3 152 B11R1.21 Cc1cnc(c[n+]1[O-])C(=O)O MB01535 [0,0,0,0,0,1|3,0,0]=4 153 B11R1.21 Cc1cnc(cc1Br)C(=O)O AB70164 [0,0,0,0,0,1|1,1,0]=3 154 B11R1.21 Cc1cnc(cc1Cl)C(=O)C AB83277 [0,0,0,0,0,1|2,0,0]=3 155 B11R1.21 Cc1cnc(cc1Cl)C(=O)O AB65446 [0,0,0,0,0,1|1,0,0]=2 156 B11R1.21 Cc1cnc(cc1F)C(=O)C AB82953 [0,0,0,0,0,1|2,1,0]=4 157 B11R1.21 Cc1cnc(cc1F)C(=O)O AB74895 [0,0,0,0,0,1|1,1,0]=3 158 B11R1.21 Cn1cc(ccc1=O)C(=O)O PB21634 [0,0,0,0,0,1|3,0,0]=4 159 B11R1.21 Cn1ccc(cc1=O)C(=O)O PB32349 [0,0,0,0,0,1|3,0,0]=4 160 B11R1.21 c1c(c(cnc1C(=O)O)Br)Cl AB67645 [0,0,0,0,0,1|2,0,0]=3 161 B11R1.21 c1c(c(cnc1C(=O)O)Br)N PB21081 [0,0,0,0,0,1|2,1,0]=4 162 B11R1.21 c1c(c(cnc1C(=O)O)Cl)Cl AB63131 [0,0,0,0,0,1|2,0,0]=3 163 B11R1.21 c1c(c(cnc1C(=O)O)Cl)F AB74911 [0,0,0,0,0,1|2,0,0]=3 164 B11R1.21 c1c(c(cnc1C(=O)O)Cl)N AB75270 [0,0,0,0,0,1|2,0,0]=3 165 B11R1.21 c1c(c(cnc1C(=O)O)Cl)O AB74886 [0,0,0,0,0,1|2,0,0]=3 166 B11R1.21 c1c(c(cnc1C(=O)O)F)Cl AB67663 [0,0,0,0,0,1|2,0,0]=3 167 B11R1.21 c1c(c(cnc1C(=O)O)F)F AB73187 [0,0,0,0,0,1|2,1,0]=4 168 B11R1.21 c1c(c(cnc1C(=O)O)N)Cl AB67747 [0,0,0,0,0,1|2,0,0]=3 169 B11R1.21 c1c(c(cnc1C(=O)O)N)F AB73539 [0,0,0,0,0,1|2,1,0]=4 170 B11R1.21 c1c(c(cnc1C(=O)O)O)Cl AB67787 [0,0,0,0,0,1|2,0,0]=3 171 B11R1.21 c1c(cnc(c1Br)Cl)C(=O)O AB10529 [0,0,0,0,0,1|2,0,0]=3 172 B11R1.21 c1c(cnc(c1Cl)Cl)C(=O)O PB29008 [0,0,0,0,0,1|2,0,0]=3 173 B11R1.21 c1c(cnc(c1Cl)F)C(=O)O AB15015 [0,0,0,0,0,1|2,0,0]=3 174 B11R1.21 c1c(cnc(c1Cl)N)C(=O)O AB63730 [0,0,0,0,0,1|2,0,0]=3 175 B11R1.21 c1c(cnc(c1Cl)O)C(=O)O AB02225 [0,0,0,0,0,1|2,0,0]=3 176 B11R1.21 c1c(cnc(c1F)Br)C(=O)O AB62700 [0,0,0,0,0,1|2,1,0]=4 177 B11R1.21 c1c(cnc(c1F)Cl)C(=O)O AB64027 [0,0,0,0,0,1|2,0,0]=3 178 B11R1.21 c1c(cnc(c1F)F)C(=O)O PB14646 [0,0,0,0,0,1|2,1,0]=4 179 B11R1.21 c1c(cnc(c1N)Cl)C(=O)O AB75265 [0,0,0,0,0,1|2,0,0]=3 180 B11R1.21 c1c(cnc(c1N)N)C(=O)O AB60261 [0,0,0,0,0,1|3,0,0]=4 181 B11R1.21 c1c(cnc(c1O)Cl)C(=O)O AB72035 [0,0,0,0,0,1|2,0,0]=3 182 B11R1.21 c1c(nc(c(n1)N)Br)C(=O)O PB26120 [0,0,0,0,0,1|2,1,0]=4 183 B11R1.21 c1c(nc(c(n1)N)I)C(=O)O PB37460 [0,0,0,0,0,1|2,1,0]=4 184 B11R1.21 c1cc(c(cc1C(=O)N)Cl)O MB09407 [0,0,0,0,0,1|3,0,0]=4 185 B11R1.21 c1cc(c(cc1C(=O)N)O)Cl MB27786 [0,0,0,0,0,1|3,0,0]=4 186 B11R1.21 c1cc(c(cc1C(=O)O)Br)F AB01920 [0,0,0,0,0,1|2,1,0]=4 187 B11R1.21 c1cc(c(cc1C(=O)O)F)Br AB06858 [0,0,0,0,0,1|2,1,0]=4 188 B11R1.21 c1cc(c(cc1C(=O)O)F)O AB03853 [0,0,0,0,0,1|2,1,0]=4 189 B11R1.21 c1cc(c(cc1C(=O)O)N)F AB25439 [0,0,0,0,0,1|2,1,0]=4 190 B11R1.21 c1cc(c(cc1C(=O)O)O)Cl AB04116 [0,0,0,0,0,1|2,0,0]=3 191 B11R1.21 c1cc(c(cc1C(=O)O)O)F AB05533 [0,0,0,0,0,1|2,1,0]=4 192 B11R1.21 c1cc(c(cc1C(=O)O)O)I AB10648 [0,0,0,0,0,1|2,1,0]=4 193 B11R1.21 c1cc(nc(c1Cl)F)C(=O)O AB49341 [0,0,0,0,0,1|2,1,0]=4 194 B11R1.21 c1cc(nc(c1Cl)N)C(=O)O AB74552 [0,0,0,0,0,1|3,0,0]=4 195 B11R1.21 c1cc(nc(c1F)Cl)C(=O)O AB66795 [0,0,0,0,0,1|2,0,0]=3 196 B11R1.21 c1cc(nc(c1F)F)C(=O)O AB49344 [0,0,0,0,0,1|2,1,0]=4 197 B11R1.21 c1cc(nc(c1N)Cl)C(=O)O AB75268 [0,0,0,0,0,1|2,0,0]=3 198 B11R1.21 c1cc(nc(c1O)Cl)C(=O)O AB64506 [0,0,0,0,0,1|2,0,0]=3 199 B11R1.74 B(c1cc(cc(c1)Cl)C)(O)O AB49144 [0,0,0,0,0,1|2,0,1]=4 200 B11R1.74 B(c1cc(nc(c1)Cl)C)(O)O AB66964 [0,0,0,0,0,1|2,0,1]=4 201 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl AB68467 [0,0,0,0,0,1|3,0,0]=4 202 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl AB02007 [0,0,0,0,0,1|3,0,0]=4 203 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F AB20622 [0,0,0,0,0,1|3,0,0]=4 204 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O AB66008 [0,0,0,0,0,1|3,0,0]=4 205 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl AB77751 [0,0,0,0,0,1|3,0,0]=4 206 B11R1.74 CC(=O)c1cc(cc(n1)Cl)Br AB68228 [0,0,0,0,0,1|3,0,0]=4 207 B11R1.74 CC(=O)c1cc(cc(n1)Cl)Cl AB62521 [0,0,0,0,0,1|3,0,0]=4 208 B11R1.74 CC(=O)c1cc(cc(n1)Cl)F AB79774 [0,0,0,0,0,1|3,0,0]=4 209 B11R1.74 CC(=O)c1cc(cc(n1)Cl)I AB79638 [0,0,0,0,0,1|3,0,0]=4 210 B11R1.74 CC(=O)c1cc(cc(n1)Cl)O AB74857 [0,0,0,0,0,1|3,0,0]=4 211 B11R1.74 CC(=O)c1cc(nc(c1)Br)Cl AB79921 [0,0,0,0,0,1|3,0,0]=4 212 B11R1.74 CC(=O)c1cc(nc(c1)Cl)Cl AB64667 [0,0,0,0,0,1|3,0,0]=4 213 B11R1.74 CC(=O)c1cc(nc(c1)Cl)F AB79904 [0,0,0,0,0,1|3,0,0]=4 214 B11R1.74 CC(=O)c1cc(nc(c1)Cl)N AB74571 [0,0,0,0,0,1|3,0,0]=4 215 B11R1.74 CC(=O)c1cc(nc(c1)Cl)O AB79929 [0,0,0,0,0,1|3,0,0]=4 216 B11R1.74 CC(=O)c1cc(nc(c1)I)Cl AB79922 [0,0,0,0,0,1|3,0,0]=4 217 B11R1.74 CC(=O)c1cc(nc(n1)Cl)Cl AB76961 [0,0,0,0,0,1|3,0,0]=4 218 B11R1.74 Cc1cc(cc(c1)Br)C(=O)C AB76200 [0,0,0,0,0,1|2,1,0]=4 219 B11R1.74 Cc1cc(cc(c1)Br)C(=O)O AB12648 [0,0,0,0,0,1|1,1,0]=3 220 B11R1.74 Cc1cc(cc(c1)C(=O)C)C AB08165 [0,0,0,0,0,1|3,0,0]=4 221 B11R1.74 Cc1cc(cc(c1)C(=O)O)C AB00235 [0,0,0,0,0,1|2,0,0]=3 222 B11R1.74 Cc1cc(cc(c1)Cl)C(=O)C AB64283 [0,0,0,0,0,1|2,0,0]=3 223 B11R1.74 Cc1cc(cc(c1)Cl)C(=O)O AB62676 [0,0,0,0,0,1|1,0,0]=2 224 B11R1.74 Cc1cc(cc(c1)F)C(=O)C AB20635 [0,0,0,0,0,1|2,1,0]=4 225 B11R1.74 Cc1cc(cc(c1)F)C(=O)O AB13316 [0,0,0,0,0,1|1,1,0]=3 226 B11R1.74 Cc1cc(cc(c1)I)C(=O)C AB71471 [0,0,0,0,0,1|2,1,0]=4 227 B11R1.74 Cc1cc(cc(c1)I)C(=O)O AB62677 [0,0,0,0,0,1|1,1,0]=3 228 B11R1.74 Cc1cc(cc(c1)N)C(=O)O AB04836 [0,0,0,0,0,1|2,0,0]=3 229 B11R1.74 Cc1cc(cc(c1)O)C(=O)C AB16910 [0,0,0,0,0,1|3,0,0]=4 230 B11R1.74 Cc1cc(cc(c1)O)C(=O)N MB23370 [0,0,0,0,0,1|3,0,0]=4 231 B11R1.74 Cc1cc(cc(c1)O)C(=O)O AB52735 [0,0,0,0,0,1|2,0,0]=3 232 B11R1.74 Cc1cc(cc(n1)Br)C(=O)C AB79932 [0,0,0,0,0,1|2,1,0]=4 233 B11R1.74 Cc1cc(cc(n1)Br)C(=O)O AB66859 [0,0,0,0,0,1|1,1,0]=3 234 B11R1.74 Cc1cc(cc(n1)C(=O)C)Cl AB66887 [0,0,0,0,0,1|3,0,0]=4 235 B11R1.74 Cc1cc(cc(n1)C(=O)O)Br AB40781 [0,0,0,0,0,1|2,1,0]=4 236 B11R1.74 Cc1cc(cc(n1)C(=O)O)Cl AB40799 [0,0,0,0,0,1|2,0,0]=3 237 B11R1.74 Cc1cc(cc(n1)C(=O)O)F AB66868 [0,0,0,0,0,1|2,1,0]=4 238 B11R1.74 Cc1cc(cc(n1)C(=O)O)I AB79386 [0,0,0,0,0,1|2,1,0]=4 239 B11R1.74 Cc1cc(cc(n1)C(=O)O)N AB66550 [0,0,0,0,0,1|3,0,0]=4 240 B11R1.74 Cc1cc(cc(n1)C(=O)O)O AB74941 [0,0,0,0,0,1|3,0,0]=4 241 B11R1.74 Cc1cc(cc(n1)C)C(=O)C AB31118 [0,0,0,0,0,1|3,0,0]=4 242 B11R1.74 Cc1cc(cc(n1)C)C(=O)O AB15854 [0,0,0,0,0,1|2,0,0]=3 243 B11R1.74 Cc1cc(cc(n1)Cl)C(=O)C AB66888 [0,0,0,0,0,1|2,0,0]=3 244 B11R1.74 Cc1cc(cc(n1)Cl)C(=O)O PB14103 [0,0,0,0,0,1|1,0,0]=2 245 B11R1.74 Cc1cc(cc(n1)F)C(=O)C AB79910 [0,0,0,0,0,1|2,1,0]=4 246 B11R1.74 Cc1cc(cc(n1)F)C(=O)O AB66869 [0,0,0,0,0,1|1,1,0]=3 247 B11R1.74 Cc1cc(cc(n1)I)C(=O)C AB79945 [0,0,0,0,0,1|2,1,0]=4 248 B11R1.74 Cc1cc(cc(n1)I)C(=O)O AB79514 [0,0,0,0,0,1|1,1,0]=3 249 B11R1.74 Cc1cc(cc(n1)N)C(=O)O PB20783 [0,0,0,0,0,1|2,0,0]=3 250 B11R1.74 Cc1cc(cc(n1)O)C(=O)C AB79988 [0,0,0,0,0,1|3,0,0]=4 251 B11R1.74 Cc1cc(cc(n1)O)C(=O)O AB12186 [0,0,0,0,0,1|2,0,0]=3 252 B11R1.74 Cc1cc(nc(c1)Br)C(=O)C AB79653 [0,0,0,0,0,1|2,1,0]=4 253 B11R1.74 Cc1cc(nc(c1)Br)C(=O)O AB67817 [0,0,0,0,0,1|1,1,0]=3 254 B11R1.74 Cc1cc(nc(c1)C(=O)C)C AB31120 [0,0,0,0,0,1|3,0,0]=4 255 B11R1.74 Cc1cc(nc(c1)C(=O)O)C AB17859 [0,0,0,0,0,1|2,0,0]=3 256 B11R1.74 Cc1cc(nc(c1)Cl)C(=O)C AB75104 [0,0,0,0,0,1|2,0,0]=3 257 B11R1.74 Cc1cc(nc(c1)Cl)C(=O)O AB52811 [0,0,0,0,0,1|1,0,0]=2 258 B11R1.74 Cc1cc(nc(c1)F)C(=O)C AB79620 [0,0,0,0,0,1|2,1,0]=4 259 B11R1.74 Cc1cc(nc(c1)F)C(=O)O AB67821 [0,0,0,0,0,1|1,1,0]=3 260 B11R1.74 Cc1cc(nc(c1)I)C(=O)C AB79670 [0,0,0,0,0,1|2,1,0]=4 261 B11R1.74 Cc1cc(nc(c1)I)C(=O)O AB79260 [0,0,0,0,0,1|1,1,0]=3 262 B11R1.74 Cc1cc(nc(c1)N)C(=O)O AB67823 [0,0,0,0,0,1|2,0,0]=3 263 B11R1.74 Cc1cc(nc(c1)O)C(=O)C AB79873 [0,0,0,0,0,1|3,0,0]=4 264 B11R1.74 Cc1cc(nc(c1)O)C(=O)O AB13099 [0,0,0,0,0,1|2,0,0]=3 265 B11R1.74 Cc1cc(nc(n1)Cl)C(=O)O AB07382 [0,0,0,0,0,1|1,0,0]=2 266 B11R1.74 c1c(cc(cc1Br)Br)C(=O)O AB02139 [0,0,0,0,0,1|2,1,0]=4 267 B11R1.74 c1c(cc(cc1Br)I)C(=O)O AB04625 [0,0,0,0,0,1|2,1,0]=4 268 B11R1.74 c1c(cc(cc1Cl)Br)C(=O)O AB29578 [0,0,0,0,0,1|2,0,0]=3 269 B11R1.74 c1c(cc(cc1Cl)Cl)C(=O)O AB00229 [0,0,0,0,0,1|2,0,0]=3 270 B11R1.74 c1c(cc(cc1Cl)I)C(=O)O AB06860 [0,0,0,0,0,1|2,0,0]=3 271 B11R1.74 c1c(cc(cc1F)Br)C(=O)O AB09246 [0,0,0,0,0,1|2,1,0]=4 272 B11R1.74 c1c(cc(cc1F)Cl)C(=O)O AB07872 [0,0,0,0,0,1|2,0,0]=3 273 B11R1.74 c1c(cc(cc1F)F)C(=O)O AB01033 [0,0,0,0,0,1|2,1,0]=4 274 B11R1.74 c1c(cc(cc1F)I)C(=O)O AB20696 [0,0,0,0,0,1|2,1,0]=4 275 B11R1.74 c1c(cc(cc1I)I)C(=O)O AB06171 [0,0,0,0,0,1|2,1,0]=4 276 B11R1.74 c1c(cc(cc1N)Br)C(=O)O AB04992 [0,0,0,0,0,1|2,1,0]=4 277 B11R1.74 c1c(cc(cc1N)Cl)C(=O)O AB11542 [0,0,0,0,0,1|2,0,0]=3 278 B11R1.74 c1c(cc(cc1N)F)C(=O)O AB42533 [0,0,0,0,0,1|2,1,0]=4 279 B11R1.74 c1c(cc(cc1N)I)C(=O)O AB02789 [0,0,0,0,0,1|2,1,0]=4 280 B11R1.74 c1c(cc(cc1N)N)C(=O)O AB00898 [0,0,0,0,0,1|3,0,0]=4 281 B11R1.74 c1c(cc(cc1N)O)C(=O)O AB29674 [0,0,0,0,0,1|3,0,0]=4 282 B11R1.74 c1c(cc(cc1O)Br)C(=O)O AB29744 [0,0,0,0,0,1|2,1,0]=4 283 B11R1.74 c1c(cc(cc1O)Cl)C(=O)O AB18080 [0,0,0,0,0,1|2,0,0]=3 284 B11R1.74 c1c(cc(cc1O)F)C(=O)O AB64637 [0,0,0,0,0,1|2,1,0]=4 285 B11R1.74 c1c(cc(cc1O)I)C(=O)O AB02791 [0,0,0,0,0,1|2,1,0]=4 286 B11R1.74 c1c(cc(cc1O)O)C(=O)O AB00234 [0,0,0,0,0,1|3,0,0]=4 287 B11R1.74 c1c(cc(nc1Br)Br)C(=O)O PB18991 [0,0,0,0,0,1|2,1,0]=4 288 B11R1.74 c1c(cc(nc1Br)I)C(=O)O AB79501 [0,0,0,0,0,1|2,1,0]=4 289 B11R1.74 c1c(cc(nc1C(=O)O)Br)Br AB68240 [0,0,0,0,0,1|2,1,0]=4 290 B11R1.74 c1c(cc(nc1C(=O)O)Br)Cl AB67261 [0,0,0,0,0,1|2,1,0]=4 291 B11R1.74 c1c(cc(nc1C(=O)O)Br)F AB68040 [0,0,0,0,0,1|2,1,0]=4 292 B11R1.74 c1c(cc(nc1C(=O)O)Br)I AB79249 [0,0,0,0,0,1|2,1,0]=4 293 B11R1.74 c1c(cc(nc1C(=O)O)Br)N AB67264 [0,0,0,0,0,1|2,1,0]=4 294 B11R1.74 c1c(cc(nc1C(=O)O)Br)O AB79257 [0,0,0,0,0,1|2,1,0]=4 295 B11R1.74 c1c(cc(nc1C(=O)O)Cl)Br AB67958 [0,0,0,0,0,1|2,0,0]=3 296 B11R1.74 c1c(cc(nc1C(=O)O)Cl)Cl AB55079 [0,0,0,0,0,1|2,0,0]=3 297 B11R1.74 c1c(cc(nc1C(=O)O)Cl)F AB68036 [0,0,0,0,0,1|2,0,0]=3 298 B11R1.74 c1c(cc(nc1C(=O)O)Cl)I AB79242 [0,0,0,0,0,1|2,0,0]=3 299 B11R1.74 c1c(cc(nc1C(=O)O)Cl)N AB67311 [0,0,0,0,0,1|2,0,0]=3 300 B11R1.74 c1c(cc(nc1C(=O)O)Cl)O AB68127 [0,0,0,0,0,1|2,0,0]=3 301 B11R1.74 c1c(cc(nc1C(=O)O)F)Br AB72835 [0,0,0,0,0,1|2,1,0]=4 302 B11R1.74 c1c(cc(nc1C(=O)O)F)Cl AB74912 [0,0,0,0,0,1|2,1,0]=4 303 B11R1.74 c1c(cc(nc1C(=O)O)F)F AB49324 [0,0,0,0,0,1|2,1,0]=4 304 B11R1.74 c1c(cc(nc1C(=O)O)F)I AB79224 [0,0,0,0,0,1|2,1,0]=4 305 B11R1.74 c1c(cc(nc1C(=O)O)F)N AB79232 [0,0,0,0,0,1|2,1,0]=4 306 B11R1.74 c1c(cc(nc1C(=O)O)F)O AB79240 [0,0,0,0,0,1|2,1,0]=4 307 B11R1.74 c1c(cc(nc1C(=O)O)I)Br AB79372 [0,0,0,0,0,1|2,1,0]=4 308 B11R1.74 c1c(cc(nc1C(=O)O)I)Cl AB79366 [0,0,0,0,0,1|2,1,0]=4 309 B11R1.74 c1c(cc(nc1C(=O)O)I)F AB79347 [0,0,0,0,0,1|2,1,0]=4 310 B11R1.74 c1c(cc(nc1C(=O)O)I)N AB79262 [0,0,0,0,0,1|2,1,0]=4 311 B11R1.74 c1c(cc(nc1C(=O)O)I)O AB79273 [0,0,0,0,0,1|2,1,0]=4 312 B11R1.74 c1c(cc(nc1C(=O)O)N)Br AB71729 [0,0,0,0,0,1|3,0,0]=4 313 B11R1.74 c1c(cc(nc1C(=O)O)N)Cl AB67977 [0,0,0,0,0,1|3,0,0]=4 314 B11R1.74 c1c(cc(nc1C(=O)O)N)F AB79355 [0,0,0,0,0,1|3,0,0]=4 315 B11R1.74 c1c(cc(nc1C(=O)O)N)I AB79390 [0,0,0,0,0,1|3,0,0]=4 316 B11R1.74 c1c(cc(nc1C(=O)O)N)N AB79332 [0,0,0,0,0,1|3,0,0]=4 317 B11R1.74 c1c(cc(nc1C(=O)O)N)O AB79330 [0,0,0,0,0,1|3,0,0]=4 318 B11R1.74 c1c(cc(nc1C(=O)O)O)Br AB79382 [0,0,0,0,0,1|3,0,0]=4 319 B11R1.74 c1c(cc(nc1C(=O)O)O)F AB79365 [0,0,0,0,0,1|3,0,0]=4 320 B11R1.74 c1c(cc(nc1C(=O)O)O)I AB79403 [0,0,0,0,0,1|3,0,0]=4 321 B11R1.74 c1c(cc(nc1C(=O)O)O)N AB79465 [0,0,0,0,0,1|3,0,0]=4 322 B11R1.74 c1c(cc(nc1C(=O)O)O)O AB76498 [0,0,0,0,0,1|3,0,0]=4 323 B11R1.74 c1c(cc(nc1Cl)Br)C(=O)O AB66787 [0,0,0,0,0,1|2,0,0]=3 324 B11R1.74 c1c(cc(nc1Cl)Cl)C(=O)O AB05154 [0,0,0,0,0,1|2,0,0]=3 325 B11R1.74 c1c(cc(nc1Cl)I)C(=O)O AB79494 [0,0,0,0,0,1|2,0,0]=3 326 B11R1.74 c1c(cc(nc1F)Br)C(=O)O AB66790 [0,0,0,0,0,1|2,1,0]=4 327 B11R1.74 c1c(cc(nc1F)Cl)C(=O)O AB66798 [0,0,0,0,0,1|2,0,0]=3 328 B11R1.74 c1c(cc(nc1N)Br)C(=O)O AB67265 [0,0,0,0,0,1|2,1,0]=4 329 B11R1.74 c1c(cc(nc1N)F)C(=O)O AB79483 [0,0,0,0,0,1|2,1,0]=4 330 B11R1.74 c1c(cc(nc1N)I)C(=O)O AB79517 [0,0,0,0,0,1|2,1,0]=4 331 B11R1.74 c1c(cc(nc1N)N)C(=O)O AB66375 [0,0,0,0,0,1|3,0,0]=4 332 B11R1.74 c1c(cc(nc1N)O)C(=O)O AB76516 [0,0,0,0,0,1|3,0,0]=4 333 B11R1.74 c1c(cc(nc1O)Br)C(=O)O AB79511 [0,0,0,0,0,1|2,1,0]=4 334 B11R1.74 c1c(cc(nc1O)Cl)C(=O)O AB41973 [0,0,0,0,0,1|2,0,0]=3 335 B11R1.74 c1c(cc(nc1O)F)C(=O)O AB71296 [0,0,0,0,0,1|2,1,0]=4 336 B11R1.74 c1c(cc(nc1O)I)C(=O)O AB79531 [0,0,0,0,0,1|2,1,0]=4 337 B11R1.74 c1c(cc(nc1O)O)C(=O)O AB00673 [0,0,0,0,0,1|3,0,0]=4 338 B11R1.74 c1c(nc(nc1Cl)Cl)C(=O)Cl AB45257 [0,0,0,0,0,1|3,0,0]=4 339 B11R1.74 c1c(nc(nc1Cl)Cl)C(=O)O AB12755 [0,0,0,0,0,1|2,0,0]=3 340 B8R1.1 CC1=CN=C(C1)C=O AB43814 [2,0,0,0,0,0|1,0,1]=4 341 B8R1.1 Cc1cc(on1)C=O CB11269 [2,0,0,0,0,0|1,1,0]=4 342 B8R1.1 Cc1cc(sc1)CCl AB72607 [2,0,0,0,0,0|1,0,1]=4 343 B8R1.1 Cc1cc(sc1)CN AB25763 [2,0,0,0,0,0|1,0,1]=4 344 B8R1.1 Cc1ccc(s1)C=O AB00417 [2,0,0,0,0,0|1,0,0]=3 345 B8R1.1 Cc1cnc(s1)C=O AB43202 [2,0,0,0,0,0|2,0,0]=4 346 B8R1.1 Cc1coc(n1)C=O PB28183 [2,0,0,0,0,0|1,1,0]=4 347 B8R1.1 Cc1csc(n1)C=O PB14084 [2,0,0,0,0,0|1,0,0]=3 348 B8R1.1 Cc1csc(n1)CO AB44110 [2,0,0,0,0,0|1,0,1]=4 349 B8R1.1 Cc1ncc(s1)C=O CB11336 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.1 Cn1cc(nc1)C=O PB24797 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.1 c1c(csc1C=O)Br PB24526 [2,0,0,0,0,0|1,0,0]=3 352 B8R1.1 c1c(csc1C=O)Cl PB20572 [2,0,0,0,0,0|1,0,0]=3 353 B8R1.1 c1c(csc1CO)Br PB12803 [2,0,0,0,0,0|1,0,1]=4 354 B8R1.1 c1c(csc1CO)Cl PB24317 [2,0,0,0,0,0|1,0,1]=4 355 B8R1.1 c1c(csc1Cl)C=O PB18241 [2,0,0,0,0,0|2,0,0]=4 356 B8R1.1 c1c(nc(o1)Cl)C=O AB68328 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.1 c1c(sc(n1)Br)C=O AB16053 [2,0,0,0,0,0|1,1,0]=4 358 B8R1.1 c1c(sc(n1)C=O)Br PB22294 [2,0,0,0,0,0|1,1,0]=4 359 B8R1.1 c1c(sc(n1)C=O)Cl PB22169 [2,0,0,0,0,0|1,0,0]=3 360 B8R1.1 c1c(sc(n1)CO)Cl PB36635 [2,0,0,0,0,0|1,0,1]=4 361 B8R1.1 c1c(sc(n1)Cl)C=O PB14244 [2,0,0,0,0,0|1,0,0]=3 362 B8R1.1 c1c(sc(n1)N)C=O AB11362 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.1 c1cc(sc1C#N)Cl PB17611 [2,0,0,0,0,0|1,0,1]=4 364 B8R1.1 c1cc(sc1C=O)Br PB32069 [2,0,0,0,0,0|0,1,0]=3 365 B8R1.1 c1cc(sc1C=O)Cl PB17085 [2,0,0,0,0,0|0,0,0]=2 366 B8R1.1 c1cc(sc1CCl)Cl AB00990 [2,0,0,0,0,0|1,0,1]=4 367 B8R1.1 c1cc(sc1CN)Cl PB22134 [2,0,0,0,0,0|1,0,1]=4 368 B8R1.1 c1cc(sc1CO)Br PB23435 [2,0,0,0,0,0|0,1,1]=4 369 B8R1.1 c1cc(sc1CO)Cl PB23436 [2,0,0,0,0,0|0,0,1]=3 370 B8R1.1 c1cc(sc1CO)F PB31763 [2,0,0,0,0,0|0,1,1]=4 371 B8R1.7 B(c1cccs1)(O)O AB04002 [2,0,0,0,0,0|1,0,1]=4 372 B8R1.7 c1c(nco1)C(=O)O PB14470 [2,0,0,0,0,0|2,0,0]=4 373 B8R1.7 c1c(ncs1)C(=O)O AB06561 [2,0,0,0,0,0|2,0,0]=4 374 B8R1.7 c1c(ocn1)C(=O)O AB19293 [2,0,0,0,0,0|1,1,0]=4 375 B8R1.7 c1c(scn1)C(=O)O AB15430 [2,0,0,0,0,0|1,0,0]=3 376 B8R1.7 c1cnsc1C(=O)O AB32452 [2,0,0,0,0,0|1,0,0]=3 377 B8R1.7 c1coc(n1)C(=O)O AB19305 [2,0,0,0,0,0|1,1,0]=4 378 B8R1.7 c1cocc1C(=O)O PB30525 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.7 c1conc1C(=O)O PB26232 [2,0,0,0,0,0|2,0,0]=4 380 B8R1.7 c1csc(n1)C(=O)O AB10888 [2,0,0,0,0,0|1,0,0]=3 381 B8R1.7 c1cscc1C(=O)O PB18386 [2,0,0,0,0,0|2,0,0]=4 382 B8R1.7 c1csnc1C(=O)O PB34433 [2,0,0,0,0,0|2,0,0]=4 383 B10R1.34 Cc1c(sc(c1Br)Br)C=O AB10018 [1,1,0,0,0,0|1,1,0]=4 384 B10R1.14 COC(=O)c1cc(cs1)Br PB18709 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.14 COC(=O)c1cc(cs1)Cl PB24460 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.14 COC(=O)c1cc(sc1)Cl PB30437 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.14 COC(=O)c1ccc(s1)Br PB24794 [1,1,0,0,0,0|0,1,0]=3 388 B10R1.14 COC(=O)c1ccc(s1)Cl MB03690 [1,1,0,0,0,0|0,0,0]=2 389 B10R1.14 COC(=O)c1cnc(s1)Br AB16048 [1,1,0,0,0,0|1,1,0]=4 390 B10R1.14 COC(=O)c1cnc(s1)N AB16042 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.14 COC(=O)c1csc(n1)Cl AB26609 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.14 COC(=O)c1nc(cs1)Br MB09382 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.14 COC(=O)c1ncc(s1)Br MB14341 [1,1,0,0,0,0|1,1,0]=4 394 B10R1.14 COC(=O)c1ncc(s1)N PB39132 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.14 Cc1ccc(s1)C(=O)OC AB23205 [1,1,0,0,0,0|1,0,0]=3 396 B10R1.14 Cc1cnc(o1)C(=O)OC AB53495 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.14 Cc1cnc(s1)C(=O)OC AB10517 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.14 Cc1csc(n1)C(=O)OC AB44701 [1,1,0,0,0,0|1,0,0]=3 399 B10R1.14 c1cc(sc1C(=O)C=O)Br AB48670 [1,1,0,0,0,0|0,1,1]=4 400 B10R1.31 CCc1cc(no1)C(=O)O AB22807 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.31 COc1cc(on1)C(=O)O AB31988 [1,1,0,0,0,0|1,1,0]=4 402 B10R1.31 COc1ncc(s1)C(=O)O AB50992 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.31 c1cc(sc1C#N)C(=O)N AB65695 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.31 c1cc(sc1C=O)C(=O)N AB65691 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.55 c1cc(sc1S(=O)(=O)Cl)Cl PB20881 [1,1,0,0,0,0|1,0,1]=4 406 B10R1.59 Cc1cc(c(o1)C)C(=O)O AB03078 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.59 Cc1cc(c(s1)N)C(=O)O AB22303 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.59 Cc1cc(n(n1)C)C(=O)O PB14132 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.59 Cc1cc(sc1C(=O)O)Br CB11471 [1,1,0,0,0,0|0,1,0]=3 410 B10R1.59 Cn1cc(cc1C(=O)O)N AB42940 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.59 c1c(c(sc1Br)C(=O)N)N AB65687 [1,1,0,0,0,0|1,1,0]=4 412 B10R1.59 c1c(c(sc1Cl)Cl)C(=O)O PB12074 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.59 c1c(cn(c1C(=O)O)N)Br MB14547 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.194 CC1=C(C(=NC1)C(=O)O)C PB17071 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.194 Cc1c(csc1C(=O)Cl)Br AB13922 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.194 Cc1c(csc1C(=O)N)Br AB65689 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.194 Cc1cnc(n1C)C(=O)O AB70178 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.194 Cn1c(cnc1Cl)C(=O)O AB56929 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.194 c1c(c(c(s1)C(=O)O)N)Br AB65684 [1,1,0,0,0,0|1,0,0]=3 420 B12R1.48 CC(=O)c1cc(c(nc1)OC)Cl AB70286 [0,1,0,0,0,1|2,0,0]=4 421 B12R1.48 CCc1ccc(cc1O)C(=O)O MB06270 [0,1,0,0,0,1|2,0,0]=4 422 B12R1.48 CNc1ccc(cc1O)C(=O)O MB29392 [0,1,0,0,0,1|2,0,0]=4 423 B12R1.48 COc1c(cc(cn1)C(=O)O)Br AB64029 [0,1,0,0,0,1|1,1,0]=4 424 B12R1.48 COc1c(cc(cn1)C(=O)O)Cl AB20982 [0,1,0,0,0,1|1,0,0]=3 425 B12R1.48 COc1c(cc(cn1)C(=O)O)F AB62787 [0,1,0,0,0,1|1,1,0]=4 426 B12R1.48 COc1c(cc(cn1)C(=O)O)N AB84951 [0,1,0,0,0,1|2,0,0]=4 427 B12R1.48 COc1c(cc(cn1)C(=O)O)O AB74794 [0,1,0,0,0,1|2,0,0]=4 428 B12R1.48 COc1ccc(cc1Br)C(=O)O AB01268 [0,1,0,0,0,1|1,1,0]=4 429 B12R1.48 COc1ccc(nc1Br)C(=O)O AB25432 [0,1,0,0,0,1|1,1,0]=4 430 B12R1.48 COc1cnc(cc1Cl)C(=O)O AB67547 [0,1,0,0,0,1|1,0,0]=3 431 B12R1.48 CSc1ccc(cc1O)C(=O)O MB30298 [0,1,0,0,0,1|2,0,0]=4 432 B12R1.48 Cc1cc(cnc1OC)C(=O)O AB70810 [0,1,0,0,0,1|2,0,0]=4 433 B12R1.48 c1cc(c(cc1C(=O)O)O)CN MB25917 [0,1,0,0,0,1|2,0,0]=4 434 B12R1.56 CCc1cc(ccc1O)C(=O)O MB09659 [0,1,0,0,0,1|2,0,0]=4 435 B12R1.56 CNc1cc(ccc1O)C(=O)O MB14732 [0,1,0,0,0,1|2,0,0]=4 436 B12R1.56 COc1cc(ccc1Br)C(=O)O AB44930 [0,1,0,0,0,1|1,1,0]=4 437 B12R1.56 COc1cc(cnc1Cl)C(=O)O AB66372 [0,1,0,0,0,1|1,0,0]=3 438 B12R1.56 c1cc(c(cc1C(=O)O)CN)O MB02933 [0,1,0,0,0,1|2,0,0]=4 439 B12R1.232 Cc1c(nc(c(n1)C(=O)O)Cl)C AB63393 [0,1,0,0,0,1|2,0,0]=4 440 B12R1.232 Cc1c(nc(c(n1)C(=O)O)N)C AB06540 [0,1,0,0,0,1|2,0,0]=4 441 B12R1.367 COC(=O)c1cc(c(nc1)Cl)N AB11451 [0,1,0,0,0,1|2,0,0]=4 442 B12R1.367 COC(=O)c1cc(c(nc1)N)Cl AB66518 [0,1,0,0,0,1|2,0,0]=4 443 B12R1.367 COC(=O)c1ccc(c(c1)N)Cl AB15542 [0,1,0,0,0,1|2,0,0]=4 444 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl AB64117 [0,1,0,0,0,1|2,0,0]=4 445 B12R1.367 Cc1cc(ccc1Cl)C(=O)C=O AB45361 [0,1,0,0,0,1|1,0,1]=4 446 B12R1.367 Cc1cc(cnc1N)C(=O)OC AB66393 [0,1,0,0,0,1|2,0,0]=4 447 B12R1.367 Cc1cc(ncc1Br)C(=O)OC AB41177 [0,1,0,0,0,1|1,1,0]=4 448 B12R1.367 Cc1cc(ncc1Cl)C(=O)OC AB72092 [0,1,0,0,0,1|1,0,0]=3 449 B12R1.367 Cc1cc(ncc1N)C(=O)OC PB11380 [0,1,0,0,0,1|2,0,0]=4 450 B12R1.367 Cc1ccc(cc1F)C(=O)OC AB23209 [0,1,0,0,0,1|1,1,0]=4 451 B12R1.367 Cc1ccc(cc1O)C(=O)OC AB04849 [0,1,0,0,0,1|2,0,0]=4 452 B12R1.367 Cc1ccc(nc1N)C(=O)OC AB73564 [0,1,0,0,0,1|2,0,0]=4 453 B12R1.367 Cc1cnc(cc1N)C(=O)OC AB73592 [0,1,0,0,0,1|2,0,0]=4 454 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CB10793 [0,1,0,0,0,1|2,0,0]=4 455 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Cl AB31744 [0,1,0,0,0,1|2,0,0]=4 456 B12R1.1005 Cc1cc(nc(c1C)C)C(=O)O AB71658 [0,1,0,0,0,1|2,0,0]=4 457 B12R1.11 CC(=O)c1cc(cc(c1)Cl)CCl AB77540 [0,1,0,0,0,1|2,0,0]=4 458 B12R1.11 CC(=O)c1cc(cc(c1)Cl)OC AB77758 [0,1,0,0,0,1|2,0,0]=4 459 B12R1.11 CC(=O)c1cc(cc(n1)Cl)CCl AB78719 [0,1,0,0,0,1|2,0,0]=4 460 B12R1.11 CC(=O)c1cc(cc(n1)Cl)OC AB74860 [0,1,0,0,0,1|2,0,0]=4 461 B12R1.11 CC(=O)c1cc(nc(c1)Cl)CCl AB78381 [0,1,0,0,0,1|2,0,0]=4 462 B12R1.11 CC(=O)c1cc(nc(c1)Cl)OC AB67054 [0,1,0,0,0,1|2,0,0]=4 463 B12R1.11 CCc1cc(cc(c1)O)C(=O)O MB23684 [0,1,0,0,0,1|2,0,0]=4 464 B12R1.11 COc1cc(cc(c1)Br)C(=O)O AB05500 [0,1,0,0,0,1|1,1,0]=4 465 B12R1.11 COc1cc(cc(c1)Cl)C(=O)O AB08610 [0,1,0,0,0,1|1,0,0]=3 466 B12R1.11 COc1cc(cc(c1)F)C(=O)O AB43741 [0,1,0,0,0,1|1,1,0]=4 467 B12R1.11 COc1cc(cc(c1)I)C(=O)O AB76639 [0,1,0,0,0,1|1,1,0]=4 468 B12R1.11 COc1cc(cc(c1)N)C(=O)O AB42796 [0,1,0,0,0,1|2,0,0]=4 469 B12R1.11 COc1cc(cc(c1)O)C(=O)O AB25434 [0,1,0,0,0,1|2,0,0]=4 470 B12R1.11 COc1cc(cc(n1)Br)C(=O)O AB63173 [0,1,0,0,0,1|1,1,0]=4 471 B12R1.11 COc1cc(cc(n1)C(=O)O)Cl AB67013 [0,1,0,0,0,1|2,0,0]=4 472 B12R1.11 COc1cc(cc(n1)Cl)C(=O)O AB04381 [0,1,0,0,0,1|1,0,0]=3 473 B12R1.11 COc1cc(cc(n1)F)C(=O)O AB67024 [0,1,0,0,0,1|1,1,0]=4 474 B12R1.11 COc1cc(cc(n1)I)C(=O)O AB79520 [0,1,0,0,0,1|1,1,0]=4 475 B12R1.11 COc1cc(cc(n1)N)C(=O)O AB67035 [0,1,0,0,0,1|2,0,0]=4 476 B12R1.11 COc1cc(cc(n1)O)C(=O)O AB79579 [0,1,0,0,0,1|2,0,0]=4 477 B12R1.11 COc1cc(nc(c1)Br)C(=O)O AB67867 [0,1,0,0,0,1|1,1,0]=4 478 B12R1.11 COc1cc(nc(c1)Cl)C(=O)O AB16785 [0,1,0,0,0,1|1,0,0]=3 479 B12R1.11 COc1cc(nc(c1)F)C(=O)O AB67871 [0,1,0,0,0,1|1,1,0]=4 480 B12R1.11 COc1cc(nc(c1)I)C(=O)O AB79265 [0,1,0,0,0,1|1,1,0]=4 481 B12R1.11 COc1cc(nc(c1)N)C(=O)O AB67876 [0,1,0,0,0,1|2,0,0]=4 482 B12R1.11 COc1cc(nc(c1)O)C(=O)O AB79449 [0,1,0,0,0,1|2,0,0]=4 483 B12R1.11 COc1nc(cc(n1)Cl)C(=O)O AB58867 [0,1,0,0,0,1|2,0,0]=4 484 B12R1.11 CSc1cc(cc(c1)O)C(=O)O MB33105 [0,1,0,0,0,1|2,0,0]=4 485 B12R1.11 Cc1cc(cc(c1)C(=O)C)CCl AB77587 [0,1,0,0,0,1|2,0,0]=4 486 B12R1.11 Cc1cc(cc(c1)C(=O)O)C#N AB62673 [0,1,0,0,0,1|2,0,0]=4 487 B12R1.11 Cc1cc(cc(c1)C(=O)O)C=O AB76508 [0,1,0,0,0,1|2,0,0]=4 488 B12R1.11 Cc1cc(cc(c1)OC)C(=O)O AB65530 [0,1,0,0,0,1|2,0,0]=4 489 B12R1.11 Cc1cc(cc(n1)C#N)C(=O)O AB79553 [0,1,0,0,0,1|2,0,0]=4 490 B12R1.11 Cc1cc(cc(n1)C(=O)O)OC AB74942 [0,1,0,0,0,1|2,0,0]=4 491 B12R1.11 Cc1cc(cc(n1)C=O)C(=O)O AB75283 [0,1,0,0,0,1|2,0,0]=4 492 B12R1.11 Cc1cc(cc(n1)CCl)C(=O)C AB78456 [0,1,0,0,0,1|2,0,0]=4 493 B12R1.11 Cc1cc(cc(n1)OC)C(=O)O AB71380 [0,1,0,0,0,1|2,0,0]=4 494 B12R1.11 Cc1cc(nc(c1)C(=O)C)CCl AB78632 [0,1,0,0,0,1|2,0,0]=4 495 B12R1.11 Cc1cc(nc(c1)C(=O)O)C#N AB79421 [0,1,0,0,0,1|2,0,0]=4 496 B12R1.11 Cc1cc(nc(c1)C(=O)O)C=O AB79425 [0,1,0,0,0,1|2,0,0]=4 497 B12R1.11 Cc1cc(nc(c1)OC)C(=O)O AB74943 [0,1,0,0,0,1|2,0,0]=4 498 B12R1.11 c1c(cc(cc1C(=O)O)Cl)C#N AB29579 [0,1,0,0,0,1|1,0,1]=4 499 B12R1.11 c1c(cc(cc1C(=O)O)Cl)C=O AB76525 [0,1,0,0,0,1|1,0,1]=4 500 B12R1.11 c1c(cc(cc1C(=O)O)O)CN MB35663 [0,1,0,0,0,1|2,0,0]=4 501 B12R1.11 c1c(cc(nc1C#N)Cl)C(=O)O AB67391 [0,1,0,0,0,1|1,0,1]=4 502 B12R1.11 c1c(cc(nc1C(=O)O)Cl)C#N AB68134 [0,1,0,0,0,1|1,0,1]=4 503 B12R1.11 c1c(cc(nc1C(=O)O)Cl)C=O AB79245 [0,1,0,0,0,1|1,0,1]=4 504 B12R1.11 c1c(cc(nc1C=O)Cl)C(=O)O AB79497 [0,1,0,0,0,1|1,0,1]=4 505 B12R1.358 Cc1cc(cc(n1)Cl)C(=O)OC AB17061 [0,1,0,0,0,1|1,0,0]=3 506 B12R1.358 Cc1cc(cc(n1)O)C(=O)OC AB66882 [0,1,0,0,0,1|2,0,0]=4 507 B12R1.358 Cc1cc(nc(c1)O)C(=O)OC AB67825 [0,1,0,0,0,1|2,0,0]=4 508 B12R1.358 Cc1cc(nc(n1)Cl)C(=O)OC AB03487 [0,1,0,0,0,1|1,0,0]=3 509 B12R1.511 Cc1cc(c(c(c1)O)C)C(=O)O AB24927 [0,1,0,0,0,1|2,0,0]=4 510 B12R1.511 Cc1cc(cc(c1O)C(=O)O)Cl AB23162 [0,1,0,0,0,1|1,0,0]=3 511 B12R1.511 c1c(cc(c(c1C(=O)O)I)Cl)Cl MB03052 [0,1,0,0,0,1|2,0,0]=4 512 B12R1.511 c1c(cc(c(c1C(=O)O)O)Br)Cl MB01635 [0,1,0,0,0,1|2,0,0]=4 513 B12R1.314 CCOC(=O)c1cc(c(s1)Cl)C CB12034 [0,2,0,0,0,0|0,0,0]=2 514 B12R1.362 COC(=O)c1c(c(c(s1)Cl)Cl)O MB14668 [0,2,0,0,0,0|1,0,0]=3 515 B12R1.362 Cc1c(sc(c1O)C(=O)OC)C MB14689 [0,2,0,0,0,0|1,0,0]=3 516 B10R1.113 Cc1cc(ccn1)C(=O)O AB06393 [0,0,1,1,0,0|2,0,0]=4 517 B10R1.113 Cc1cc(ncn1)C(=O)O PB20450 [0,0,1,1,0,0|2,0,0]=4 518 B10R1.113 Cc1ccnc(c1)C(=O)O AB15851 [0,0,1,1,0,0|2,0,0]=4 519 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AB04138 [0,0,1,1,0,0|1,0,1]=4 520 B10R1.113 c1cnc(cc1C(=O)O)Cl PB12125 [0,0,1,1,0,0|2,0,0]=4 521 B10R1.113 c1cnc(nc1C(=O)O)Cl AB28457 [0,0,1,1,0,0|2,0,0]=4 522 B10R1.8 Cc1cc(cc(c1)Br)C=O AB53369 [1,0,0,0,0,1|1,1,0]=4 523 B10R1.8 Cc1cc(cc(c1)C=O)C AB03134 [1,0,0,0,0,1|2,0,0]=4 524 B10R1.8 Cc1cc(cc(c1)Cl)C=O AB64288 [1,0,0,0,0,1|1,0,0]=3 525 B10R1.8 Cc1cc(cc(c1)F)C=O AB13319 [1,0,0,0,0,1|1,1,0]=4 526 B10R1.8 Cc1cc(cc(c1)I)C=O AB75646 [1,0,0,0,0,1|1,1,0]=4 527 B10R1.8 Cc1cc(cc(c1)O)C=O AB71633 [1,0,0,0,0,1|2,0,0]=4 528 B10R1.8 Cc1cc(cc(n1)Br)C=O AB66852 [1,0,0,0,0,1|1,1,0]=4 529 B10R1.8 Cc1cc(cc(n1)C)C=O AB24839 [1,0,0,0,0,1|2,0,0]=4 530 B10R1.8 Cc1cc(cc(n1)C=O)Cl AB40806 [1,0,0,0,0,1|2,0,0]=4 531 B10R1.8 Cc1cc(cc(n1)Cl)C=O AB24805 [1,0,0,0,0,1|1,0,0]=3 532 B10R1.8 Cc1cc(cc(n1)F)C=O AB70701 [1,0,0,0,0,1|1,1,0]=4 533 B10R1.8 Cc1cc(cc(n1)I)C=O AB79154 [1,0,0,0,0,1|1,1,0]=4 534 B10R1.8 Cc1cc(cc(n1)O)C=O AB71363 [1,0,0,0,0,1|2,0,0]=4 535 B10R1.8 Cc1cc(nc(c1)Br)C=O AB67811 [1,0,0,0,0,1|1,1,0]=4 536 B10R1.8 Cc1cc(nc(c1)C=O)C AB04218 [1,0,0,0,0,1|2,0,0]=4 537 B10R1.8 Cc1cc(nc(c1)Cl)C=O AB67809 [1,0,0,0,0,1|1,0,0]=3 538 B10R1.8 Cc1cc(nc(c1)F)C=O AB75168 [1,0,0,0,0,1|1,1,0]=4 539 B10R1.8 Cc1cc(nc(c1)I)C=O AB78891 [1,0,0,0,0,1|1,1,0]=4 540 B10R1.8 Cc1cc(nc(c1)O)C=O AB79065 [1,0,0,0,0,1|2,0,0]=4 541 B10R1.8 Cc1cc(nc(n1)C)C=O AB58698 [1,0,0,0,0,1|2,0,0]=4 542 B10R1.8 Cc1cc(nc(n1)N)C=O AB58695 [1,0,0,0,0,1|2,0,0]=4 543 B10R1.8 Cc1cc(nc(n1)O)C=O AB58710 [1,0,0,0,0,1|2,0,0]=4 544 B10R1.8 Cc1nc(cc(n1)Cl)C=O AB58880 [1,0,0,0,0,1|2,0,0]=4 545 B10R1.8 c1c(cc(cc1Cl)Br)C=O AB29574 [1,0,0,0,0,1|2,0,0]=4 546 B10R1.8 c1c(cc(cc1Cl)Cl)C=O AB00316 [1,0,0,0,0,1|2,0,0]=4 547 B10R1.8 c1c(cc(cc1Cl)I)C=O AB65246 [1,0,0,0,0,1|2,0,0]=4 548 B10R1.8 c1c(cc(cc1F)Cl)C=O AB11796 [1,0,0,0,0,1|2,0,0]=4 549 B10R1.8 c1c(cc(cc1O)Cl)C=O AB43616 [1,0,0,0,0,1|2,0,0]=4 550 B10R1.8 c1c(cc(nc1C=O)Cl)Br AB67308 [1,0,0,0,0,1|2,0,0]=4 551 B10R1.8 c1c(cc(nc1C=O)Cl)Cl AB62517 [1,0,0,0,0,1|2,0,0]=4 552 B10R1.8 c1c(cc(nc1C=O)Cl)F AB68025 [1,0,0,0,0,1|2,0,0]=4 553 B10R1.8 c1c(cc(nc1C=O)Cl)I AB78865 [1,0,0,0,0,1|2,0,0]=4 554 B10R1.8 c1c(cc(nc1C=O)Cl)N AB68105 [1,0,0,0,0,1|2,0,0]=4 555 B10R1.8 c1c(cc(nc1C=O)Cl)O AB74846 [1,0,0,0,0,1|2,0,0]=4 556 B10R1.8 c1c(cc(nc1Cl)Br)C=O AB67259 [1,0,0,0,0,1|2,0,0]=4 557 B10R1.8 c1c(cc(nc1Cl)Cl)C=O AB03506 [1,0,0,0,0,1|2,0,0]=4 558 B10R1.8 c1c(cc(nc1Cl)I)C=O AB79128 [1,0,0,0,0,1|2,0,0]=4 559 B10R1.8 c1c(cc(nc1F)Cl)C=O AB70951 [1,0,0,0,0,1|2,0,0]=4 560 B10R1.8 c1c(cc(nc1O)Cl)C=O AB70932 [1,0,0,0,0,1|2,0,0]=4 561 B10R1.8 c1c(nc(nc1Cl)Cl)C=O AB58699 [1,0,0,0,0,1|2,0,0]=4 562 B10R1.54 Cn1cc(nc1)CC(=O)O CB11156 [1,0,0,0,0,1|2,0,0]=4 563 B10R1.54 c1c(nc(s1)CC(=O)O)Cl PB38781 [1,0,0,0,0,1|2,0,0]=4 564 B10R1.54 c1c(sc(n1)CC(=O)O)Cl PB15499 [1,0,0,0,0,1|1,0,0]=3 565 B10R1.54 c1c(sc(n1)N)CC(=O)O PB16173 [1,0,0,0,0,1|2,0,0]=4 566 B12R1.19 Cc1cc(ncc1Br)CC(=O)O AB41182 [0,0,0,0,0,2|1,1,0]=4 567 B12R1.19 Cc1cc(ncc1Cl)CC(=O)O AB41190 [0,0,0,0,0,2|1,0,0]=3 568 B12R1.19 Cc1cc(ncc1Cl)NC(=O)C AB41146 [0,0,0,0,0,2|2,0,0]=4 569 B12R1.19 Cc1ccc(nc1C)CC(=O)O AB74109 [0,0,0,0,0,2|2,0,0]=4 570 B12R1.19 c1c(ncc(c1Cl)Cl)CC(=O)O AB70221 [0,0,0,0,0,2|2,0,0]=4 571 B12R1.19 c1c(ncc(c1Cl)F)CC(=O)O AB74103 [0,0,0,0,0,2|2,0,0]=4 572 B12R1.101 Cc1cc(cc(c1)Br)CC(=O)O AB75546 [0,0,0,0,0,2|1,1,0]=4 573 B12R1.101 Cc1cc(cc(c1)CC(=O)O)C AB03133 [0,0,0,0,0,2|2,0,0]=4 574 B12R1.101 Cc1cc(cc(c1)Cl)CC(=O)O AB55225 [0,0,0,0,0,2|1,0,0]=3 575 B12R1.101 Cc1cc(cc(c1)F)CC(=O)O AB13322 [0,0,0,0,0,2|1,1,0]=4 576 B12R1.101 Cc1cc(cc(c1)I)CC(=O)O AB75650 [0,0,0,0,0,2|1,1,0]=4 577 B12R1.101 Cc1cc(cc(c1)N)CC(=O)O AB75518 [0,0,0,0,0,2|2,0,0]=4 578 B12R1.101 Cc1cc(cc(c1)O)CC(=O)O AB70661 [0,0,0,0,0,2|2,0,0]=4 579 B12R1.101 Cc1cc(cc(n1)Br)CC(=O)O AB71101 [0,0,0,0,0,2|1,1,0]=4 580 B12R1.101 Cc1cc(cc(n1)C)CC(=O)O AB76124 [0,0,0,0,0,2|2,0,0]=4 581 B12R1.101 Cc1cc(cc(n1)CC(=O)O)Cl AB75761 [0,0,0,0,0,2|2,0,0]=4 582 B12R1.101 Cc1cc(cc(n1)Cl)CC(=O)O AB71041 [0,0,0,0,0,2|1,0,0]=3 583 B12R1.101 Cc1cc(cc(n1)F)CC(=O)O AB71351 [0,0,0,0,0,2|1,1,0]=4 584 B12R1.101 Cc1cc(cc(n1)I)CC(=O)O AB81789 [0,0,0,0,0,2|1,1,0]=4 585 B12R1.101 Cc1cc(cc(n1)N)CC(=O)O AB70912 [0,0,0,0,0,2|2,0,0]=4 586 B12R1.101 Cc1cc(cc(n1)O)CC(=O)O AB71368 [0,0,0,0,0,2|2,0,0]=4 587 B12R1.101 Cc1cc(nc(c1)Br)CC(=O)O AB81434 [0,0,0,0,0,2|1,1,0]=4 588 B12R1.101 Cc1cc(nc(c1)CC(=O)O)C AB76514 [0,0,0,0,0,2|2,0,0]=4 589 B12R1.101 Cc1cc(nc(c1)Cl)CC(=O)O AB71044 [0,0,0,0,0,2|1,0,0]=3 590 B12R1.101 Cc1cc(nc(c1)F)CC(=O)O AB81396 [0,0,0,0,0,2|1,1,0]=4 591 B12R1.101 Cc1cc(nc(c1)I)CC(=O)O AB81448 [0,0,0,0,0,2|1,1,0]=4 592 B12R1.101 Cc1cc(nc(c1)N)CC(=O)O AB81682 [0,0,0,0,0,2|2,0,0]=4 593 B12R1.101 Cc1cc(nc(c1)O)CC(=O)O AB81697 [0,0,0,0,0,2|2,0,0]=4 594 B12R1.101 Cc1cc(nc(n1)CC(=O)O)Cl AB59201 [0,0,0,0,0,2|2,0,0]=4 595 B12R1.101 c1c(cc(cc1Cl)Br)CC(=O)O AB75452 [0,0,0,0,0,2|2,0,0]=4 596 B12R1.101 c1c(cc(cc1Cl)Cl)CC(=O)O AB09922 [0,0,0,0,0,2|2,0,0]=4 597 B12R1.101 c1c(cc(cc1Cl)I)CC(=O)O AB75569 [0,0,0,0,0,2|2,0,0]=4 598 B12R1.101 c1c(cc(cc1F)Cl)CC(=O)O AB16023 [0,0,0,0,0,2|2,0,0]=4 599 B12R1.101 c1c(cc(cc1N)Cl)CC(=O)O AB75506 [0,0,0,0,0,2|2,0,0]=4 600 B12R1.101 c1c(cc(cc1O)Cl)CC(=O)O AB75563 [0,0,0,0,0,2|2,0,0]=4 601 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)Br AB81406 [0,0,0,0,0,2|2,0,0]=4 602 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)Cl AB76673 [0,0,0,0,0,2|2,0,0]=4 603 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)F AB81571 [0,0,0,0,0,2|2,0,0]=4 604 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)I AB81409 [0,0,0,0,0,2|2,0,0]=4 605 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)N AB81417 [0,0,0,0,0,2|2,0,0]=4 606 B12R1.101 c1c(cc(nc1CC(=O)O)Cl)O AB81427 [0,0,0,0,0,2|2,0,0]=4 607 B12R1.101 c1c(cc(nc1Cl)Br)CC(=O)O AB71031 [0,0,0,0,0,2|2,0,0]=4 608 B12R1.101 c1c(cc(nc1Cl)Cl)CC(=O)O AB71027 [0,0,0,0,0,2|2,0,0]=4 609 B12R1.101 c1c(cc(nc1Cl)I)CC(=O)O AB81757 [0,0,0,0,0,2|2,0,0]=4 610 B12R1.101 c1c(cc(nc1F)Cl)CC(=O)O AB71035 [0,0,0,0,0,2|2,0,0]=4 611 B12R1.101 c1c(cc(nc1N)Cl)CC(=O)O AB81765 [0,0,0,0,0,2|2,0,0]=4 612 B12R1.101 c1c(cc(nc1O)Cl)CC(=O)O AB71020 [0,0,0,0,0,2|2,0,0]=4