0 B12R2.612 Cc1ccc2c(c1)CCC2=O H66814 [0,0,0,0,0,0|3,0,1]=4 1 B12R2.612 c1cc2c(cc1Br)CCC2=O B25707 [0,0,0,0,0,0|2,1,1]=4 2 B12R2.612 c1cc2c(cc1Br)CNC2=O H52358 [0,0,0,0,0,0|1,1,2]=4 3 B12R2.612 c1cc2c(cc1Br)COC2=O H33891 [0,0,0,0,0,0|2,1,1]=4 4 B12R2.612 c1cc2c(cc1Br)[nH]nc2N H34095 [0,0,0,0,0,0|2,1,0]=3 5 B12R2.612 c1cc2c(cc1Cl)CCC2=O A18308 [0,0,0,0,0,0|2,0,1]=3 6 B12R2.612 c1cc2c(cc1Cl)no[n+]2[O-] A14261 [0,0,0,0,0,0|3,0,1]=4 7 B12R2.612 c1cc2c(cc1F)CCC2=O L10949 [0,0,0,0,0,0|2,1,1]=4 8 B12R2.612 c1cc2c(cc1N)CCC2=O H66425 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.612 c1cc2c(cc1N)COC2=O H66457 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.612 c1cc2c(cc1N)[nH]nc2Cl H61445 [0,0,0,0,0,0|3,0,0]=3 11 B12R2.612 c1cc2c(cc1O)OCC2=O L10951 [0,0,0,0,0,0|2,0,1]=3 12 B11R2.1 B1(c2ccccc2CO1)O L15192 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 Cc1c2cccnc2[nH]n1 H61397 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 Cc1c[nH]c2c1cccc2 L03890 [1,0,0,0,0,0|3,0,0]=4 15 B11R2.1 Cc1csc2c1cccc2 A15772 [1,0,0,0,0,0|2,1,0]=4 16 B11R2.1 Cn1c2ccccc2nn1 L00297 [1,0,0,0,0,0|3,0,0]=4 17 B11R2.1 c1cc2c(c(co2)Br)nc1 H33652 [1,0,0,0,0,0|3,0,0]=4 18 B11R2.1 c1ccc2c(c1)C(=O)CO2 A10202 [1,0,0,0,0,0|1,0,1]=3 19 B11R2.1 c1ccc2c(c1)C(=O)N=N2 L05860 [1,0,0,0,0,0|1,0,1]=3 20 B11R2.1 c1ccc2c(c1)CCC2=O A11056 [1,0,0,0,0,0|2,0,1]=4 21 B11R2.1 c1ccc2c(c1)CCC2O B24536 [1,0,0,0,0,0|2,0,1]=4 22 B11R2.1 c1ccc2c(c1)COC2=O A15516 [1,0,0,0,0,0|2,0,1]=4 23 B11R2.1 c1ccc2c(c1)c(=O)[nH]o2 H50899 [1,0,0,0,0,0|0,0,2]=3 24 B11R2.1 c1ccc2c(c1)c(=O)[nH]s2 H60492 [1,0,0,0,0,0|0,1,2]=4 25 B11R2.1 c1ccc2c(c1)c(c[nH]2)I H66490 [1,0,0,0,0,0|3,0,0]=4 26 B11R2.1 c1ccc2c(c1)c(cs2)Br H32948 [1,0,0,0,0,0|2,1,0]=4 27 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br H37775 [1,0,0,0,0,0|2,0,0]=3 28 B11R2.1 c1ccc2c(c1)c(n[nH]2)N H33435 [1,0,0,0,0,0|2,0,0]=3 29 B11R2.1 c1ccc2c(c1)c(ns2)Cl L17791 [1,0,0,0,0,0|1,1,0]=3 30 B11R2.1 c1ccn2c(c1)nnc2N H58980 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.1 c1ccn2c(c1)nnc2S H32694 [1,0,0,0,0,0|2,1,0]=4 32 B11R2.36 Cc1ccc2c(c1)cn[nH]2 H31828 [1,0,0,0,0,0|3,0,0]=4 33 B11R2.36 Cc1ccc2c(c1)nn[nH]2 A10615 [1,0,0,0,0,0|3,0,0]=4 34 B11R2.36 Cc1ccc2cc[nH]c2c1 L17509 [1,0,0,0,0,0|3,0,0]=4 35 B11R2.36 c1cc(cc2c1cc[nH]2)Br L17703 [1,0,0,0,0,0|2,1,0]=4 36 B11R2.36 c1cc(cc2c1cc[nH]2)Cl B23650 [1,0,0,0,0,0|2,0,0]=3 37 B11R2.36 c1cc(cc2c1cc[nH]2)F B24633 [1,0,0,0,0,0|2,1,0]=4 38 B11R2.36 c1cc(cc2c1cc[nH]2)N L17793 [1,0,0,0,0,0|3,0,0]=4 39 B11R2.36 c1cc(cc2c1cc[nH]2)O H55951 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.36 c1cc(nc2c1cc[nH]2)Cl H66655 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.36 c1cc2c(cc1Br)OCO2 A17906 [1,0,0,0,0,0|2,1,0]=4 42 B11R2.36 c1cc2c(cc1Br)cn[nH]2 H54673 [1,0,0,0,0,0|2,1,0]=4 43 B11R2.36 c1cc2c(cc1Cl)OCO2 B22534 [1,0,0,0,0,0|2,0,0]=3 44 B11R2.36 c1cc2c(cc1Cl)nco2 H27083 [1,0,0,0,0,0|3,0,0]=4 45 B11R2.36 c1cc2c(cc1Cl)nsn2 A18286 [1,0,0,0,0,0|3,0,0]=4 46 B11R2.36 c1cc2c(cc1F)cn[nH]2 H26033 [1,0,0,0,0,0|2,1,0]=4 47 B11R2.36 c1cc2c(cc1N)OCO2 A12975 [1,0,0,0,0,0|3,0,0]=4 48 B11R2.36 c1cc2c(cc1N)cn[nH]2 L06705 [1,0,0,0,0,0|3,0,0]=4 49 B11R2.36 c1cc2c(cc1N)nn[nH]2 L06660 [1,0,0,0,0,0|3,0,0]=4 50 B11R2.36 c1cc2c(cc1N)ocn2 H34485 [1,0,0,0,0,0|3,0,0]=4 51 B11R2.36 c1cc2c(cc1O)OCO2 A10453 [1,0,0,0,0,0|3,0,0]=4 52 B11R2.36 c1cc2c(cc1[Mg+])OCO2 H54632 [1,0,0,0,0,0|3,0,0]=4 53 B11R2.36 c1cc2c(cc[nH]2)cc1Cl A13592 [1,0,0,0,0,0|3,0,0]=4 54 B11R2.36 c1cc2c(ccs2)cc1Cl H61748 [1,0,0,0,0,0|3,0,0]=4 55 B11R2.36 c1cc2cn[nH]c2cc1Br H32623 [1,0,0,0,0,0|1,1,0]=3 56 B11R2.36 c1cc2cn[nH]c2cc1Cl H37529 [1,0,0,0,0,0|1,0,0]=2 57 B13R2.662 c1cc2c(cc1Cl)[nH]cc2C=O H61911 [0,1,0,0,0,0|2,0,1]=4 58 B13R2.11642 Cc1cc(nc2c1c(no2)N)C H50122 [0,1,0,0,0,0|3,0,0]=4 59 B13R2.11642 c1c(cc(c2c1CCC2=O)Cl)Cl H54007 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.22 CCC(=O)c1ccc(cc1)Cl A11633 [0,0,1,0,0,0|2,0,1]=4 61 B11R1.22 COC(=O)c1ccc(cc1)Cl A10109 [0,0,1,0,0,0|2,0,1]=4 62 B11R1.22 Cc1ccc(cc1)\C(=N\O)\N H51704 [0,0,1,0,0,0|2,0,0]=3 63 B11R1.22 c1cc(ccc1C(=O)CBr)Cl A12607 [0,0,1,0,0,0|2,0,1]=4 64 B11R1.22 c1cc(ccc1C(=O)CCl)Cl A15954 [0,0,1,0,0,0|2,0,1]=4 65 B11R1.22 c1cc(ccc1C(=O)NN)Cl A11911 [0,0,1,0,0,0|1,0,2]=4 66 B11R1.22 c1cc(ccc1\C(=N\O)\N)F H66567 [0,0,1,0,0,0|1,1,0]=3 67 B11R1.22 c1cc(ccc1\C(=N\O)\N)N H51788 [0,0,1,0,0,0|2,0,0]=3 68 B11R1.22 c1cc(ccc1\C(=N\O)\N)O H52148 [0,0,1,0,0,0|2,0,0]=3 69 B11R1.22 c1cc(ncc1N)\C(=N\O)\N H54666 [0,0,1,0,0,0|3,0,0]=4 70 B11R1.22 c1cc(ncc1\C(=N\O)\N)N H51720 [0,0,1,0,0,0|3,0,0]=4 71 B11R1.24 Cc1cccc(c1)OCCO L04984 [0,0,1,0,0,0|2,0,1]=4 72 B11R1.24 c1cc(cc(c1)Cl)OCC#N A15730 [0,0,1,0,0,0|2,0,1]=4 73 B11R1.37 COc1cc(ccc1C=O)Br H55545 [0,0,1,0,0,0|1,1,1]=4 74 B11R1.37 COc1cc(ccc1C=O)F H26091 [0,0,1,0,0,0|1,1,1]=4 75 B11R1.37 COc1cc(ccc1C=O)O A11127 [0,0,1,0,0,0|2,0,1]=4 76 B11R1.37 COc1cc(ccc1CO)Br H27339 [0,0,1,0,0,0|1,1,1]=4 77 B11R1.37 COc1cc(ccc1CO)Cl H27562 [0,0,1,0,0,0|1,0,1]=3 78 B11R1.166 B(c1ccc(cc1C)Cl)(O)O B23688 [0,0,1,0,0,0|3,0,0]=4 79 B11R1.166 B(c1ccc(cc1Cl)Cl)(O)O L01563 [0,0,1,0,0,0|3,0,0]=4 80 B11R1.166 B(c1ccc(cc1F)Cl)(O)O H28872 [0,0,1,0,0,0|3,0,0]=4 81 B11R1.166 B(c1ccc(cc1O)F)(O)O H53304 [0,0,1,0,0,0|2,1,0]=4 82 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl A14428 [0,0,1,0,0,0|2,0,1]=4 83 B11R1.166 CC(=O)c1ccc(cc1O)Br H61137 [0,0,1,0,0,0|1,1,1]=4 84 B11R1.166 CC(=O)c1ccc(cc1O)Cl H27309 [0,0,1,0,0,0|1,0,1]=3 85 B11R1.166 CC(=O)c1ccc(cc1O)F A16030 [0,0,1,0,0,0|1,1,1]=4 86 B11R1.166 CC(=O)c1ccc(cc1O)O A12066 [0,0,1,0,0,0|2,0,1]=4 87 B11R1.166 Cc1cc(c(cn1)C(=O)O)O H66499 [0,0,1,0,0,0|3,0,0]=4 88 B11R1.166 Cc1cc(ccc1C(=O)O)Br L03071 [0,0,1,0,0,0|2,1,0]=4 89 B11R1.166 Cc1cc(ccc1C(=O)O)Cl H27262 [0,0,1,0,0,0|2,0,0]=3 90 B11R1.166 Cc1cc(ccc1C(=O)O)F H26801 [0,0,1,0,0,0|2,1,0]=4 91 B11R1.166 Cc1cc(ccc1C(=O)O)N H31657 [0,0,1,0,0,0|3,0,0]=4 92 B11R1.166 Cc1cc(ccc1C(=O)O)O H60810 [0,0,1,0,0,0|3,0,0]=4 93 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O H60413 [0,0,1,0,0,0|3,0,0]=4 94 B11R1.166 Cc1ccc(c(c1)C)C(=O)O A10589 [0,0,1,0,0,0|3,0,0]=4 95 B11R1.166 Cc1ccc(c(c1)F)C(=O)O H26688 [0,0,1,0,0,0|3,0,0]=4 96 B11R1.166 Cc1ccc(c(c1)O)C(=O)O L03367 [0,0,1,0,0,0|2,0,0]=3 97 B11R1.166 Cc1ccc(c(n1)O)C(=O)O A11842 [0,0,1,0,0,0|3,0,0]=4 98 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl H61381 [0,0,1,0,0,0|3,0,0]=4 99 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O H32008 [0,0,1,0,0,0|2,1,0]=4 100 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O A11527 [0,0,1,0,0,0|2,1,0]=4 101 B11R1.166 c1cc(c(cc1Br)F)C(=O)O B20118 [0,0,1,0,0,0|2,1,0]=4 102 B11R1.166 c1cc(c(cc1Br)N)C(=O)O H55829 [0,0,1,0,0,0|2,1,0]=4 103 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O H59777 [0,0,1,0,0,0|2,0,0]=3 104 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)Cl B20815 [0,0,1,0,0,0|2,0,1]=4 105 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)N A15915 [0,0,1,0,0,0|1,0,2]=4 106 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O A12372 [0,0,1,0,0,0|2,0,0]=3 107 B11R1.166 c1cc(c(cc1Cl)Cl)C(=S)N H26654 [0,0,1,0,0,0|1,1,1]=4 108 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O B25277 [0,0,1,0,0,0|2,0,0]=3 109 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O A10201 [0,0,1,0,0,0|2,0,0]=3 110 B11R1.166 c1cc(c(cc1Cl)N)C(=S)N H52249 [0,0,1,0,0,0|1,1,1]=4 111 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O B22520 [0,0,1,0,0,0|1,0,0]=2 112 B11R1.166 c1cc(c(cc1F)Br)C(=O)O L19321 [0,0,1,0,0,0|2,1,0]=4 113 B11R1.166 c1cc(c(cc1F)Cl)C(=O)O A14953 [0,0,1,0,0,0|2,1,0]=4 114 B11R1.166 c1cc(c(cc1F)F)C(=O)O A13403 [0,0,1,0,0,0|2,1,0]=4 115 B11R1.166 c1cc(c(cc1F)I)C(=O)O H55531 [0,0,1,0,0,0|2,1,0]=4 116 B11R1.166 c1cc(c(cc1F)N)C(=O)O B21907 [0,0,1,0,0,0|2,1,0]=4 117 B11R1.166 c1cc(c(cc1F)O)C(=O)O B24992 [0,0,1,0,0,0|1,1,0]=3 118 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O A10116 [0,0,1,0,0,0|3,0,0]=4 119 B11R1.166 c1cc(c(cc1N)F)C(=O)O H26146 [0,0,1,0,0,0|3,0,0]=4 120 B11R1.166 c1cc(c(cc1N)O)C(=O)O B23289 [0,0,1,0,0,0|2,0,0]=3 121 B11R1.166 c1cc(c(cc1O)O)C(=O)O A13545 [0,0,1,0,0,0|2,0,0]=3 122 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl L20002 [0,0,1,0,0,0|3,0,0]=4 123 B11R1.166 c1cc(nc(c1C(=O)O)F)Cl H66484 [0,0,1,0,0,0|3,0,0]=4 124 B13R2.3683 c1cc(cc2c1cc(cc2)Br)O A18535 [0,0,0,0,0,1|2,1,0]=4 125 B13R2.3683 c1cc(cc2c1cc(cc2)O)O B21465 [0,0,0,0,0,1|3,0,0]=4 126 B13R2.3683 c1cc2c(cc1Br)OCC(=O)N2 H61082 [0,0,0,0,0,1|1,1,1]=4 127 B13R2.3683 c1cc2c(cc1Cl)SCC(=O)N2 H27157 [0,0,0,0,0,1|1,1,1]=4 128 B13R2.3683 c1cc2c(cc1N)OCC(=O)N2 H31534 [0,0,0,0,0,1|2,0,1]=4 129 B13R2.5179 c1cc2c(cc1Br)CN=NC2=O H65609 [0,0,0,0,0,1|1,1,1]=4 130 B13R2.5179 c1cc2c(cc1F)OCCC2=O H31881 [0,0,0,0,0,1|1,1,1]=4 131 B13R2.5179 c1cc2c(ccnc2cc1Cl)Cl A15985 [0,0,0,0,0,1|3,0,0]=4 132 B13R2.5179 c1cc2c(ccnc2cc1Cl)O L07119 [0,0,0,0,0,1|2,0,0]=3 133 B13R2.5179 c1cc2cc(ccc2c(c1)O)O L15801 [0,0,0,0,0,1|3,0,0]=4 134 B10R1.13 B(c1ccc(cc1)Br)(O)O L01565 [1,0,1,0,0,0|1,1,0]=4 135 B10R1.13 B(c1ccc(cc1)C)(O)O A13347 [1,0,1,0,0,0|2,0,0]=4 136 B10R1.13 B(c1ccc(cc1)Cl)(O)O A15657 [1,0,1,0,0,0|1,0,0]=3 137 B10R1.13 B(c1ccc(cc1)F)(O)O A15991 [1,0,1,0,0,0|1,1,0]=4 138 B10R1.13 B(c1ccc(cc1)I)(O)O H51119 [1,0,1,0,0,0|1,1,0]=4 139 B10R1.13 B(c1ccc(cc1)N)(O)O H27479 [1,0,1,0,0,0|2,0,0]=4 140 B10R1.13 B(c1ccc(cc1)O)(O)O L15594 [1,0,1,0,0,0|2,0,0]=4 141 B10R1.13 B(c1ccc(cn1)Cl)(O)O H52515 [1,0,1,0,0,0|2,0,0]=4 142 B10R1.13 B(c1ccc(nc1)Cl)(O)O L20388 [1,0,1,0,0,0|2,0,0]=4 143 B10R1.13 CC(=C)c1ccc(cc1)Cl A14913 [1,0,1,0,0,0|2,0,0]=4 144 B10R1.13 CC(=O)c1ccc(cc1)Cl A12115 [1,0,1,0,0,0|1,0,1]=4 145 B10R1.13 CC(c1ccc(cc1)Cl)O L05038 [1,0,1,0,0,0|1,0,1]=4 146 B10R1.13 Cc1ccc(cc1)C(=O)O A11506 [1,0,1,0,0,0|1,0,1]=4 147 B10R1.13 c1cc(ccc1C(=N)N)Br H37831 [1,0,1,0,0,0|1,1,0]=4 148 B10R1.13 c1cc(ccc1C(=N)N)Cl A11571 [1,0,1,0,0,0|1,0,0]=3 149 B10R1.13 c1cc(ccc1C(=N)N)F H61570 [1,0,1,0,0,0|1,1,0]=4 150 B10R1.13 c1cc(ccc1C(=N)N)N L14089 [1,0,1,0,0,0|2,0,0]=4 151 B10R1.13 c1cc(ccc1C(=N)N)O H31566 [1,0,1,0,0,0|2,0,0]=4 152 B10R1.13 c1cc(ccc1C(=O)Cl)Cl A16325 [1,0,1,0,0,0|1,0,1]=4 153 B10R1.13 c1cc(ccc1C(=O)N)Cl A13809 [1,0,1,0,0,0|0,0,2]=4 154 B10R1.13 c1cc(ccc1C(=O)O)Br A12518 [1,0,1,0,0,0|0,1,1]=4 155 B10R1.13 c1cc(ccc1C(=O)O)Cl A15135 [1,0,1,0,0,0|0,0,1]=3 156 B10R1.13 c1cc(ccc1C(=O)O)F A14129 [1,0,1,0,0,0|0,1,1]=4 157 B10R1.13 c1cc(ccc1C(=O)O)I A10730 [1,0,1,0,0,0|0,1,1]=4 158 B10R1.13 c1cc(ccc1C(=O)O)N A12673 [1,0,1,0,0,0|1,0,1]=4 159 B10R1.13 c1cc(ccc1C(=O)O)O A13700 [1,0,1,0,0,0|1,0,1]=4 160 B10R1.13 c1cc(ccc1C(=S)N)Cl A12021 [1,0,1,0,0,0|0,1,1]=4 161 B10R1.13 c1cc(ccc1Cl)[Se](=O)O B21186 [1,0,1,0,0,0|1,0,1]=4 162 B10R1.13 c1cc(ncc1C(=O)O)Cl A15620 [1,0,1,0,0,0|1,0,1]=4 163 B10R1.13 c1cc(ncc1Cl)C(=O)O H30923 [1,0,1,0,0,0|1,0,1]=4 164 B10R1.15 C\C(=N/O)\c1ccccc1 A11804 [1,0,1,0,0,0|1,0,0]=3 165 B10R1.15 C\C(=N/O)\c1ccccn1 H52232 [1,0,1,0,0,0|2,0,0]=4 166 B10R1.15 C\C(=N/O)\c1cccnc1 H52154 [1,0,1,0,0,0|2,0,0]=4 167 B10R1.15 C\C(=N/O)\c1ccncc1 H52207 [1,0,1,0,0,0|2,0,0]=4 168 B10R1.15 c1cc(cnc1)\C(=N\O)\N H51749 [1,0,1,0,0,0|2,0,0]=4 169 B10R1.15 c1ccc(cc1)C(=O)CO 42013 [1,0,1,0,0,0|1,0,1]=4 170 B10R1.15 c1ccc(cc1)C(=O)NO A10509 [1,0,1,0,0,0|0,0,2]=4 171 B10R1.15 c1ccc(cc1)C(CO)O L04551 [1,0,1,0,0,0|1,0,1]=4 172 B10R1.15 c1ccc(cc1)[C@@H](CO)O L09836 [1,0,1,0,0,0|1,0,1]=4 173 B10R1.15 c1ccc(cc1)[C@H](CO)O L10494 [1,0,1,0,0,0|1,0,1]=4 174 B10R1.15 c1ccc(cc1)\C(=N\O)\N H26068 [1,0,1,0,0,0|1,0,0]=3 175 B10R1.15 c1ccnc(c1)\C(=N\O)\N H51705 [1,0,1,0,0,0|2,0,0]=4 176 B10R1.15 c1cnccc1\C(=N\O)\N H51722 [1,0,1,0,0,0|2,0,0]=4 177 B10R1.10 c1cc(cc(c1)Br)\C=N\O B25181 [1,0,1,0,0,0|1,1,0]=4 178 B10R1.10 c1cc(cc(c1)Cl)N=C=O L11483 [1,0,1,0,0,0|0,0,2]=4 179 B10R1.10 c1cc(cc(c1)Cl)N=C=S A11999 [1,0,1,0,0,0|0,1,1]=4 180 B10R1.17 C=CCOc1ccccc1 L03359 [1,0,1,0,0,0|2,0,0]=4 181 B10R1.17 c1ccc(cc1)OCCO A10786 [1,0,1,0,0,0|1,0,1]=4 182 B10R1.20 COc1ccccc1C=O A10770 [1,0,1,0,0,0|1,0,1]=4 183 B10R1.20 COc1ccccc1CO A14016 [1,0,1,0,0,0|1,0,1]=4 184 B10R1.25 Cc1cc(ccc1CO)Cl H27554 [1,0,1,0,0,0|1,0,1]=4 185 B10R1.25 Cc1ccc(c(c1)O)C=O H33909 [1,0,1,0,0,0|1,0,1]=4 186 B10R1.25 c1cc(c(cc1Br)O)C=O H54850 [1,0,1,0,0,0|0,1,1]=4 187 B10R1.25 c1cc(c(cc1Cl)Cl)C=O A12525 [1,0,1,0,0,0|1,0,1]=4 188 B10R1.25 c1cc(c(cc1Cl)Cl)CO A13338 [1,0,1,0,0,0|1,0,1]=4 189 B10R1.25 c1cc(c(cc1Cl)F)C=O A16110 [1,0,1,0,0,0|1,0,1]=4 190 B10R1.25 c1cc(c(cc1F)O)C=O H26149 [1,0,1,0,0,0|0,1,1]=4 191 B10R1.25 c1cc(c(cc1O)O)C=O A12868 [1,0,1,0,0,0|1,0,1]=4 192 B10R1.30 COc1cc(ccc1Br)Cl B25512 [1,0,1,0,0,0|2,0,0]=4 193 B10R1.30 COc1cc(ccc1Cl)Cl L13497 [1,0,1,0,0,0|2,0,0]=4 194 B10R1.30 COc1cc(ccc1O)Br L08801 [1,0,1,0,0,0|1,1,0]=4 195 B10R1.30 COc1cc(ccc1O)Cl A14806 [1,0,1,0,0,0|1,0,0]=3 196 B10R1.30 COc1cc(ccc1O)F B22211 [1,0,1,0,0,0|1,1,0]=4 197 B10R1.30 COc1cc(ccc1O)O A12847 [1,0,1,0,0,0|2,0,0]=4 198 B10R1.30 Cc1ccc(c(c1)OC)O A13603 [1,0,1,0,0,0|2,0,0]=4 199 B10R1.30 c1cc(c(cc1Cl)C=O)O A14069 [1,0,1,0,0,0|2,0,0]=4 200 B10R1.30 c1cc(c(cc1Cl)CO)O H32533 [1,0,1,0,0,0|2,0,0]=4 201 B10R1.61 B(c1ccccc1O)(O)O L19400 [1,0,1,0,0,0|2,0,0]=4 202 B10R1.61 CC(=O)c1ccccc1O A12550 [1,0,1,0,0,0|1,0,1]=4 203 B10R1.61 Cc1ccccc1C(=O)O A13856 [1,0,1,0,0,0|2,0,0]=4 204 B10R1.61 c1cc(c(nc1)C(=O)O)O L07489 [1,0,1,0,0,0|2,0,0]=4 205 B10R1.61 c1cc(c(nc1)O)C(=O)O A15986 [1,0,1,0,0,0|2,0,0]=4 206 B10R1.61 c1ccc(c(c1)C(=O)N)O A10797 [1,0,1,0,0,0|0,0,2]=4 207 B10R1.61 c1ccc(c(c1)C(=O)O)Br A13608 [1,0,1,0,0,0|2,0,0]=4 208 B10R1.61 c1ccc(c(c1)C(=O)O)Cl A10832 [1,0,1,0,0,0|2,0,0]=4 209 B10R1.61 c1ccc(c(c1)C(=O)O)F A11015 [1,0,1,0,0,0|2,0,0]=4 210 B10R1.61 c1ccc(c(c1)C(=O)O)I A10563 [1,0,1,0,0,0|2,0,0]=4 211 B10R1.61 c1ccc(c(c1)C(=O)O)N A12715 [1,0,1,0,0,0|2,0,0]=4 212 B10R1.61 c1ccc(c(c1)C(=O)O)O 30782 [1,0,1,0,0,0|1,0,0]=3 213 B10R1.61 c1ccc(c(c1)C(=O)O)O A12253 [1,0,1,0,0,0|1,0,0]=3 214 B10R1.61 c1ccc(c(c1)C(=O)O)S A13401 [1,0,1,0,0,0|1,1,0]=4 215 B10R1.61 c1ccc(c(c1)C(=O)[O-])O 18585 [1,0,1,0,0,0|1,0,1]=4 216 B10R1.61 c1ccc(c(c1)C(=O)[O-])O 39356 [1,0,1,0,0,0|1,0,1]=4 217 B10R1.61 c1ccc(c(c1)C(=O)[O-])O 39379 [1,0,1,0,0,0|1,0,1]=4 218 B10R1.61 c1ccc(c(c1)C(=O)[O-])O A17056 [1,0,1,0,0,0|1,0,1]=4 219 B10R1.61 c1cncc(c1C(=O)O)O H63465 [1,0,1,0,0,0|2,0,0]=4 220 B10R1.61 c1cncc(c1O)C(=O)O H32282 [1,0,1,0,0,0|2,0,0]=4 221 B10R2.7 B1Oc2ccccc2O1 H30234 [2,0,0,0,0,0|2,0,0]=4 222 B10R2.7 B1Oc2ccccc2O1 L14998 [2,0,0,0,0,0|2,0,0]=4 223 B10R2.7 c1cc2c(cco2)nc1 H32966 [2,0,0,0,0,0|2,0,0]=4 224 B10R2.7 c1cc2cn[nH]c2nc1 H61710 [2,0,0,0,0,0|2,0,0]=4 225 B10R2.7 c1ccc2c(c1)CC=C2 A12192 [2,0,0,0,0,0|2,0,0]=4 226 B10R2.7 c1ccc2c(c1)CC=C2 L12665 [2,0,0,0,0,0|2,0,0]=4 227 B10R2.7 c1ccc2c(c1)CCO2 A11368 [2,0,0,0,0,0|1,0,1]=4 228 B10R2.7 c1ccc2c(c1)OCO2 A14192 [2,0,0,0,0,0|2,0,0]=4 229 B10R2.7 c1ccc2c(c1)[nH]nn2 A15423 [2,0,0,0,0,0|2,0,0]=4 230 B10R2.7 c1ccc2c(c1)cc[nH]2 A14427 [2,0,0,0,0,0|2,0,0]=4 231 B10R2.7 c1ccc2c(c1)cco2 A15225 [2,0,0,0,0,0|1,0,0]=3 232 B10R2.7 c1ccc2c(c1)ccs2 A12328 [2,0,0,0,0,0|1,1,0]=4 233 B10R2.7 c1ccc2c(c1)cn[nH]2 A11665 [2,0,0,0,0,0|1,0,0]=3 234 B10R2.7 c1ccc2c(c1)cno2 B23400 [2,0,0,0,0,0|0,0,0]=2 235 B10R2.7 c1ccc2c(c1)nco2 A17489 [2,0,0,0,0,0|2,0,0]=4 236 B12R1.5 CCc1ccc(cc1)\C(=N\O)\N H52259 [0,1,1,0,0,0|2,0,0]=4 237 B12R1.5 COc1ccc(cc1)\C(=N\O)\N H52141 [0,1,1,0,0,0|2,0,0]=4 238 B12R1.5 c1cc(ccc1CO)\C(=N\O)\N H52161 [0,1,1,0,0,0|2,0,0]=4 239 B12R1.20 c1cc(ccc1C(C(=O)O)O)Cl B24264 [0,1,1,0,0,0|1,0,1]=4 240 B12R1.367 c1cc(c(cc1\C(=N\O)\N)F)F H54636 [0,1,1,0,0,0|1,1,0]=4 241 B12R1.367 c1cc(c(cc1\C(=N\O)\N)N)N H66495 [0,1,1,0,0,0|2,0,0]=4 242 B12R1.367 c1cc(c(cc1\C(=N\O)\N)O)O H54311 [0,1,1,0,0,0|2,0,0]=4 243 B12R1.1703 c1cc(c(cc1Cl)Cl)\C(=N\O)\N H50674 [0,1,1,0,0,0|1,0,0]=3 244 B12R1.1703 c1cc(c(cc1F)F)\C(=N\O)\N H50664 [0,1,1,0,0,0|1,1,0]=4 245 B12R1.226 Cc1cccc(c1)OCC(=O)O B24869 [0,1,1,0,0,0|2,0,0]=4 246 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O H33266 [0,1,1,0,0,0|2,0,0]=4 247 B12R1.226 c1cc(cc(c1)Cl)OCC(=O)Cl L18427 [0,1,1,0,0,0|1,0,1]=4 248 B12R1.226 c1cc(cc(c1)Cl)OCC(=O)O L00939 [0,1,1,0,0,0|1,0,0]=3 249 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O A13416 [0,1,1,0,0,0|2,0,0]=4 250 B12R1.57 B(c1ccc(cc1OC)Cl)(O)O H52529 [0,1,1,0,0,0|2,0,0]=4 251 B12R1.57 COc1cc(ccc1C(=O)O)Cl B21332 [0,1,1,0,0,0|1,0,0]=3 252 B12R1.57 COc1cc(ccc1C(=O)O)F H26179 [0,1,1,0,0,0|1,1,0]=4 253 B12R1.57 COc1cc(ccc1C(=O)O)N H27419 [0,1,1,0,0,0|2,0,0]=4 254 B12R1.232 c1c(c(cc(c1Br)O)O)C(=O)O A18230 [0,1,1,0,0,0|2,0,0]=4 255 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O B22064 [0,1,1,0,0,0|2,0,0]=4 256 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O H55521 [0,1,1,0,0,0|2,0,0]=4 257 B12R1.452 COc1ccc(c(c1)O)C(=O)O H55345 [0,1,1,0,0,0|2,0,0]=4 258 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Cl H63623 [0,1,1,0,0,0|2,0,0]=4 259 B12R1.893 c1cc(c(c(c1C(=O)O)O)F)F H26088 [0,1,1,0,0,0|1,1,0]=4 260 B12R1.893 c1cc(c(c(c1C(=O)O)O)O)O B20371 [0,1,1,0,0,0|2,0,0]=4 261 B12R1.1000 Cc1cc(cc(c1C(=O)O)O)O H27556 [0,1,1,0,0,0|2,0,0]=4 262 B12R1.1000 c1c(cc(c(c1Cl)C(=O)O)Cl)Cl L14191 [0,1,1,0,0,0|2,0,0]=4 263 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Cl H26556 [0,1,1,0,0,0|2,0,0]=4 264 B12R1.1000 c1c(cc(c(c1O)C(=O)O)O)O B22768 [0,1,1,0,0,0|2,0,0]=4 265 B12R2.1 c1ccc2c(c1)c(c[nH]2)CO L15762 [1,1,0,0,0,0|2,0,0]=4 266 B12R2.132 c1cc2c(cc1Br)c(n[nH]2)N H33351 [1,1,0,0,0,0|2,0,0]=4 267 B12R2.132 c1cc2c(cc1Cl)c(n[nH]2)Cl H33220 [1,1,0,0,0,0|2,0,0]=4 268 B12R2.132 c1cc2c(cc1I)c(n[nH]2)N H34227 [1,1,0,0,0,0|2,0,0]=4 269 B12R2.203 c1cc2c(c(c1)Br)c(n[nH]2)N H33460 [1,1,0,0,0,0|2,0,0]=4 270 B12R2.203 c1cc2c(c(c1)Cl)c(n[nH]2)I H36741 [1,1,0,0,0,0|2,0,0]=4 271 B12R2.203 c1cc2c(c(c1)Cl)c(n[nH]2)N H34143 [1,1,0,0,0,0|2,0,0]=4 272 B12R2.203 c1cc2c(c(c1)F)c(n[nH]2)N H64990 [1,1,0,0,0,0|2,0,0]=4 273 B12R2.2028 Cn1c2ccccc2c(n1)N H34285 [1,1,0,0,0,0|2,0,0]=4 274 B12R2.100 c1c[nH]c2c1cc(c(c2)Cl)F H61351 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.49 Cc1ccc(cc1)C\C(=N\O)\N H66026 [0,0,1,0,0,1|2,0,0]=4 276 B12R1.49 c1cc(ccc1C\C(=N\O)\N)Br H66891 [0,0,1,0,0,1|1,1,0]=4 277 B12R1.49 c1cc(ccc1C\C(=N\O)\N)F H66999 [0,0,1,0,0,1|1,1,0]=4 278 B12R1.49 c1cc(ccc1C\C(=N\O)\N)N H66933 [0,0,1,0,0,1|2,0,0]=4 279 B12R1.233 c1cc(c(cc1Cl)Cl)CC(=O)O A11791 [0,0,1,0,0,1|2,0,0]=4 280 B12R1.233 c1cc(c(cc1Cl)F)CC(=O)O H26512 [0,0,1,0,0,1|2,0,0]=4