0 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC204442 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.91 c1cc(cnc1)\C=C\C(=O)O BC630675 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.91 c1ccc(cc1)COC(=O)N BC219591 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.91 c1ccc(cc1)\C=C\C(=O)Cl BC651782 [0,0,0,0,0,0|1,0,0]=1 4 B11R1.91 c1ccnc(c1)OCC(=O)O BC682036 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.91 c1cnccc1\C=C\C(=O)O BC204449 [0,0,0,0,0,0|1,0,0]=1 6 B10R1.17 c1ccc(cc1)C#CCO BC222107 [1,0,0,0,0,0|0,0,3]=4 7 B10R1.17 c1ccc(cc1)OCCO BC208517 [1,0,0,0,0,0|1,0,2]=4 8 B10R1.17 c1ccc(cc1)\C=C\C#N BC225038 [1,0,0,0,0,0|1,0,1]=3 9 B12R1.21 c1cc(ccc1CCC(=O)O)O BC678073 [0,1,0,0,0,0|0,0,2]=3 10 B12R1.27 COC(=O)\C=C\c1cncnc1 BC650910 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.27 c1ccc(cc1)CNC(=O)CCl BC202236 [0,1,0,0,0,0|2,0,1]=4 12 B12R1.27 c1ccc(cc1)COC(=O)CN BC218219 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.43 C=C(Cc1ccccc1)C(=O)O BC220589 [0,1,0,0,0,0|0,0,1]=2 14 B12R1.43 c1ccc(cc1)CC(C(=O)O)O BC224313 [0,1,0,0,0,0|0,0,2]=3 15 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)Cl BC636160 [0,1,0,0,0,0|0,0,2]=3 16 B12R1.43 c1cnccc1C[C@H](C(=O)O)N BC225171 [0,1,0,0,0,0|1,0,2]=4 17 B12R1.107 c1ccc(cc1)C(CC(=O)O)O BC224119 [0,1,0,0,0,0|0,0,2]=3 18 B12R1.125 Cc1ccccc1CCC(=O)O BC684657 [0,1,0,0,0,0|0,0,2]=3 19 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br BC687835 [0,1,0,0,0,0|0,0,2]=3 20 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl BC684352 [0,1,0,0,0,0|0,0,2]=3 21 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O BC687795 [0,1,0,0,0,0|0,0,2]=3 22 B12R1.226 c1cc(cc(c1)F)\C=C\C(=O)O BC202172 [0,1,0,0,0,0|0,0,0]=1 23 B12R1.226 c1cc(cc(c1)N)CCC(=O)O BC204347 [0,1,0,0,0,0|0,0,2]=3 24 B12R1.226 c1cc(cc(c1)O)CCC(=O)O BC687786 [0,1,0,0,0,0|0,0,2]=3 25 B12R1.226 c1cc(cc(c1)O)\C=C\C(=O)O BC210626 [0,1,0,0,0,0|0,0,0]=1 26 B12R2.24 Cc1cc2ccccc2cn1 BC225244 [0,0,0,1,0,0|3,0,0]=4 27 B12R2.24 Cc1ccc2ccccc2c1 BC208431 [0,0,0,1,0,0|2,0,0]=3 28 B12R2.24 Cc1ccc2cccnc2n1 BC250423 [0,0,0,1,0,0|3,0,0]=4 29 B12R2.24 Cc1ccc2ccncc2c1 BC679500 [0,0,0,1,0,0|3,0,0]=4 30 B12R2.24 Cc1ccc2cnccc2c1 BC679499 [0,0,0,1,0,0|3,0,0]=4 31 B12R2.24 c1cc(cc2c1ccnc2)Br BC679497 [0,0,0,1,0,0|3,0,0]=4 32 B12R2.24 c1cc(cc2c1ccnc2)Cl BC653667 [0,0,0,1,0,0|3,0,0]=4 33 B12R2.24 c1cc(cc2c1ccnc2)N BC653642 [0,0,0,1,0,0|3,0,0]=4 34 B12R2.24 c1cc(cc2c1ccnc2)O BC652998 [0,0,0,1,0,0|2,0,0]=3 35 B12R2.24 c1cc(nc2c1ccnc2)Br BC681966 [0,0,0,1,0,0|3,0,0]=4 36 B12R2.24 c1cc2c(ccc(n2)N)nc1 BC223637 [0,0,0,1,0,0|3,0,0]=4 37 B12R2.24 c1cc2cc(ccc2nc1)Br BC228637 [0,0,0,1,0,0|3,0,0]=4 38 B12R2.24 c1cc2cc(ccc2nc1)Cl BC667556 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.24 c1cc2ccc(cc2nc1)Br BC228636 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.24 c1cc2ccc(cc2nc1)N BC228639 [0,0,0,1,0,0|3,0,0]=4 41 B12R2.24 c1cc2ccc(cc2nc1)O BC224179 [0,0,0,1,0,0|2,0,0]=3 42 B12R2.24 c1cc2cnccc2cc1N BC677940 [0,0,0,1,0,0|3,0,0]=4 43 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 BC681993 [0,0,0,1,0,0|2,0,0]=3 44 B12R2.24 c1ccc2c(c1)ccc(=O)[nH]2 BC211913 [0,0,0,1,0,0|1,0,0]=2 45 B12R2.24 c1ccc2c(c1)ccc(n2)N BC205864 [0,0,0,1,0,0|2,0,0]=3 46 B12R2.24 c1ccc2c(c1)ncc(n2)Br BC208014 [0,0,0,1,0,0|3,0,0]=4 47 B12R2.24 c1ccc2c(c1)ncc(n2)N BC682114 [0,0,0,1,0,0|3,0,0]=4 48 B12R2.24 c1ccc2cc(ccc2c1)Br BC228013 [0,0,0,1,0,0|2,0,0]=3 49 B12R2.24 c1ccc2cc(ccc2c1)Cl BC205581 [0,0,0,1,0,0|2,0,0]=3 50 B12R2.24 c1ccc2cc(ccc2c1)O BC676809 [0,0,0,1,0,0|1,0,0]=2 51 B12R2.24 c1ccc2cnc(cc2c1)Br BC679495 [0,0,0,1,0,0|3,0,0]=4 52 B12R2.3190 c1ccc2c(c1)CC2C(=O)O BC225119 [0,0,0,1,0,0|0,0,2]=3 53 B10R1.18 CC(=O)Cc1ccccc1 BC250367 [0,0,0,0,1,0|1,0,1]=3 54 B10R1.18 c1c(cncn1)CC(=O)O BC228079 [0,0,0,0,1,0|2,0,1]=4 55 B10R1.18 c1cc(cnc1)CC(=O)O BC228147 [0,0,0,0,1,0|1,0,1]=3 56 B10R1.18 c1ccc(cc1)C=C(Br)Br BC600066 [0,0,0,0,1,0|2,0,0]=3 57 B10R1.18 c1ccnc(c1)CC(=O)O BC210696 [0,0,0,0,1,0|1,0,1]=3 58 B10R1.18 c1ccnc(c1)CC(=O)O BC653678 [0,0,0,0,1,0|1,0,1]=3 59 B10R1.18 c1cnccc1CC(=O)O BC220630 [0,0,0,0,1,0|1,0,1]=3 60 B12R1.252 c1ccc(cc1)CCCC(=O)O BC678065 [0,0,0,0,0,1|0,0,2]=3 61 B12R1.252 c1ccc(cc1)COCC(=O)O BC216347 [0,0,0,0,0,1|0,0,2]=3 62 B12R1.252 c1ccnc(c1)CCCC(=O)O BC677038 [0,0,0,0,0,1|1,0,2]=4 63 B9R1.8 c1ccc(cc1)CC=O BC250050 [2,0,0,0,0,0|0,0,1]=3 64 B9R1.8 c1ccc(cc1)CCO BC213746 [2,0,0,0,0,0|0,0,2]=4 65 B11R1.1 c1cc(ccc1\C=C\CO)Br BC600228 [1,1,0,0,0,0|0,0,1]=3 66 B11R1.17 c1ccc(c(c1)\C=C\C=O)F BC245599 [1,1,0,0,0,0|0,0,0]=2 67 B11R1.28 c1ccc(cc1)COCC=O BC269066 [1,1,0,0,0,0|0,0,2]=4 68 B11R1.20 CC(=O)Cc1ccc(cc1)O BC211152 [0,1,0,0,1,0|1,0,1]=4 69 B11R1.20 CC(=O)Nc1ccc(cc1)O BC204766 [0,1,0,0,1,0|2,0,0]=4 70 B11R1.20 CC(=O)Nc1ccc(cc1)S BC210348 [0,1,0,0,1,0|2,0,0]=4 71 B11R1.20 c1cc(ccc1CC(=O)O)Br BC203407 [0,1,0,0,1,0|0,0,1]=3 72 B11R1.20 c1cc(ccc1CC(=O)O)O BC228201 [0,1,0,0,1,0|0,0,1]=3 73 B11R1.36 C=C(c1ccccc1)C(=O)O BC653116 [0,1,0,0,1,0|0,0,0]=2 74 B11R1.36 c1ccc(cc1)C(=O)C(=O)O BC215722 [0,1,0,0,1,0|0,0,0]=2 75 B11R1.36 c1ccc(cc1)C(C(=O)N)N BC216078 [0,1,0,0,1,0|1,0,1]=4 76 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC204233 [0,1,0,0,1,0|0,0,1]=3 77 B11R1.36 c1ccc(cc1)C(C(=O)O)O BC250758 [0,1,0,0,1,0|0,0,1]=3 78 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N BC675296 [0,1,0,0,1,0|0,0,1]=3 79 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)O BC677633 [0,1,0,0,1,0|0,0,1]=3 80 B11R1.86 CC(=O)Cc1ccccc1Br BC202120 [0,1,0,0,1,0|1,0,1]=4 81 B11R1.86 c1ccc(c(c1)CC(=O)Cl)F BC204059 [0,1,0,0,1,0|1,0,1]=4 82 B11R1.86 c1ccc(c(c1)CC(=O)O)Br BC210254 [0,1,0,0,1,0|0,0,1]=3 83 B11R1.86 c1ccc(c(c1)CC(=O)O)Cl BC675213 [0,1,0,0,1,0|0,0,1]=3 84 B11R1.157 c1c(cncc1Br)CC(=O)O BC670873 [0,1,0,0,1,0|1,0,1]=4 85 B11R1.157 c1cc(cc(c1)Br)CC(=O)O BC210255 [0,1,0,0,1,0|0,0,1]=3 86 B11R1.157 c1cc(cc(c1)Cl)CC(=O)O BC226914 [0,1,0,0,1,0|0,0,1]=3 87 B11R1.157 c1cc(cc(c1)I)CC(=O)O BC227537 [0,1,0,0,1,0|0,0,1]=3 88 B11R1.157 c1cc(cc(c1)N)CC(=O)O BC676470 [0,1,0,0,1,0|0,0,1]=3 89 B13R1.149 c1cc(cc(c1)Br)CCCC(=O)O BC653536 [0,1,0,0,0,1|0,0,2]=4 90 B13R1.149 c1cc(cc(c1)Cl)CCCC(=O)O BC657170 [0,1,0,0,0,1|0,0,2]=4 91 B13R1.149 c1cc(cc(c1)F)CCCC(=O)O BC657172 [0,1,0,0,0,1|0,0,2]=4 92 B13R1.158 c1ccc(c(c1)CCCC(=O)O)Cl BC657171 [0,1,0,0,0,1|0,0,2]=4 93 B13R1.158 c1ccc(c(c1)CCCC(=O)O)F BC657173 [0,1,0,0,0,1|0,0,2]=4 94 B13R1.348 c1ccc(cc1)NC(=O)CC(=O)O BC216422 [0,1,0,0,0,1|0,0,1]=3 95 B13R1.351 c1ccc(cc1)CCC(=O)C(=O)O BC216574 [0,1,0,0,0,1|0,0,1]=3 96 B13R1.513 c1cc(ccc1CCCC(=O)O)Cl BC653948 [0,1,0,0,0,1|0,0,2]=4 97 B13R1.513 c1cc(ccc1CCCC(=O)O)F BC675965 [0,1,0,0,0,1|0,0,2]=4 98 B13R1.513 c1cc(ccc1CCCC(=O)O)N BC677241 [0,1,0,0,0,1|0,0,2]=4 99 B13R1.3 COc1ccc(cc1)\C=C\C(=O)Cl BC222508 [0,2,0,0,0,0|1,0,0]=3 100 B13R1.3 COc1ccc(cc1)\C=C\C(=O)Cl BC600137 [0,2,0,0,0,0|1,0,0]=3 101 B13R1.3 c1cc(ccc1C#N)NCC(=O)O BC224366 [0,2,0,0,0,0|1,0,1]=4 102 B13R1.3 c1cc(ccc1CCC(=O)O)C#N BC687788 [0,2,0,0,0,0|0,0,2]=4 103 B13R1.14 COC(=O)CCc1ccc(cc1)O BC210671 [0,2,0,0,0,0|0,0,2]=4 104 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)O BC675189 [0,2,0,0,0,0|0,0,2]=4 105 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)O)O BC678252 [0,2,0,0,0,0|0,0,2]=4 106 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)Br BC213761 [0,2,0,0,0,0|0,0,2]=4 107 B13R1.164 c1cc(c(cc1Cl)Cl)OCC(=O)O BC678782 [0,2,0,0,0,0|1,0,1]=4 108 B13R1.135 COC(=O)C(=C)Cc1ccccc1 BC214990 [0,2,0,0,0,0|0,0,1]=3 109 B13R1.148 CC(C(=O)O)Oc1cccc(c1)Cl BC209322 [0,2,0,0,0,0|1,0,1]=4 110 B13R1.148 c1cc(cc(c1)O)CC(C(=O)O)N BC215052 [0,2,0,0,0,0|0,0,2]=4 111 B13R1.148 c1cc(cc(c1)O)C[C@@H](C(=O)O)N BC227224 [0,2,0,0,0,0|0,0,2]=4 112 B13R1.148 c1cc(cc(c1)O)C[C@H](C(=O)O)N BC227225 [0,2,0,0,0,0|0,0,2]=4 113 B13R1.152 CC(C(=O)C)C(=O)c1ccccc1 BC221441 [0,2,0,0,0,0|1,0,1]=4 114 B13R1.202 c1ccc(c(c1)C[C@@H](C(=O)O)N)Cl BC227232 [0,2,0,0,0,0|0,0,2]=4 115 B13R1.713 c1ccc(cc1)C(CC(=O)O)CN BC215605 [0,2,0,0,0,0|0,0,2]=4 116 B13R1.3787 Cc1cccc(c1OCC(=O)O)C BC678564 [0,2,0,0,0,0|1,0,1]=4 117 B13R1.643 c1cc(cc(c1)C#N)CCC(=O)O BC687787 [0,2,0,0,0,0|0,0,2]=4 118 B11R1.53 c1ccc(c(c1)C(=O)O)NN BC215554 [0,0,1,1,0,0|2,0,0]=4 119 B11R1.53 c1ccc(c(c1)CBr)C(=O)O BC207323 [0,0,1,1,0,0|1,0,1]=4 120 B11R1.53 c1ccc(c(c1)CCl)C(=O)O BC211063 [0,0,1,1,0,0|1,0,1]=4 121 B11R1.266 B(c1cccc(c1)C=C)(O)O BC686049 [0,0,1,1,0,0|1,0,1]=4 122 B11R1.266 c1cc(cc(c1)C(=O)O)C#N BC675645 [0,0,1,1,0,0|1,0,1]=4 123 B11R1.266 c1cc(cc(c1)C(=O)O)C=O BC211730 [0,0,1,1,0,0|1,0,0]=3 124 B11R1.266 c1cc(cc(c1)C(=O)O)CN BC211732 [0,0,1,1,0,0|1,0,1]=4 125 B11R1.266 c1cc(cc(c1)C(=O)O)CO BC211729 [0,0,1,1,0,0|1,0,1]=4 126 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br BC676166 [0,0,1,1,0,0|1,0,1]=4 127 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl BC207064 [0,0,1,1,0,0|1,0,1]=4 128 B11R1.167 Cc1ccc(c(c1)C(=O)O)F BC220223 [0,0,1,1,0,0|1,0,1]=4 129 B11R1.167 Cc1ccc(c(c1)C(=O)O)I BC676196 [0,0,1,1,0,0|1,0,1]=4 130 B11R1.167 Cc1ccc(cc1C(=O)O)Br BC222446 [0,0,1,1,0,0|1,0,1]=4 131 B11R1.167 Cc1ccc(cc1C(=O)O)I BC219784 [0,0,1,1,0,0|1,0,1]=4 132 B11R1.167 Cc1ccc(cc1C(=O)O)N BC202438 [0,0,1,1,0,0|1,0,1]=4 133 B11R1.167 Cc1ccc(cc1C(=O)O)O BC202426 [0,0,1,1,0,0|1,0,1]=4 134 B11R1.167 c1cc(c(cc1Br)C(=O)O)Br BC201121 [0,0,1,1,0,0|2,0,0]=4 135 B11R1.167 c1cc(c(cc1Br)C(=O)O)Cl BC226435 [0,0,1,1,0,0|2,0,0]=4 136 B11R1.167 c1cc(c(cc1Br)C(=O)O)F BC206180 [0,0,1,1,0,0|2,0,0]=4 137 B11R1.167 c1cc(c(cc1F)C(=O)O)Br BC206178 [0,0,1,1,0,0|2,0,0]=4 138 B11R1.167 c1cc(c(cc1I)C(=O)O)I BC676267 [0,0,1,1,0,0|2,0,0]=4 139 B11R1.167 c1cc(c(cc1O)C(=O)O)F BC227490 [0,0,1,1,0,0|2,0,0]=4 140 B11R1.167 c1cc(c(cc1O)C(=O)O)N BC214917 [0,0,1,1,0,0|2,0,0]=4 141 B11R2.1 CC1=CCc2c1cccc2 BC600789 [1,0,0,1,0,0|1,0,1]=4 142 B11R2.1 CC1C=Cc2c1cccc2 BC600788 [1,0,0,1,0,0|1,0,1]=4 143 B11R2.1 c1ccc2c(c1)C=CC2=O BC264695 [1,0,0,1,0,0|0,0,0]=2 144 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [1,0,0,1,0,0|0,0,2]=4 145 B11R2.1 c1ccc2c(c1)c(=O)[nH]s2 BC210059 [1,0,0,1,0,0|2,0,0]=4 146 B11R2.1 c1ccc2c(c1)c(c[nH]2)Br BC220142 [1,0,0,1,0,0|2,0,0]=4 147 B11R2.1 c1ccc2c(c1)c(c[nH]2)Cl BC678897 [1,0,0,1,0,0|2,0,0]=4 148 B11R2.1 c1ccc2c(c1)c(c[nH]2)O BC676558 [1,0,0,1,0,0|1,0,0]=3 149 B11R2.10 Cc1cc2ccccc2[nH]1 BC200996 [0,0,0,1,1,0|2,0,0]=4 150 B11R2.10 Cc1cc2ccccc2o1 BC600174 [0,0,0,1,1,0|1,0,0]=3 151 B11R2.10 Cc1cc2ccccc2o1 BC600186 [0,0,0,1,1,0|1,0,0]=3 152 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 BC214905 [0,0,0,1,1,0|2,0,0]=4 153 B11R2.10 c1ccc2=NC(=O)N=c2c1 BC219990 [0,0,0,1,1,0|2,0,0]=4 154 B11R2.10 c1ccc2c(c1)CC(=O)C2 BC214987 [0,0,0,1,1,0|1,0,1]=4 155 B11R2.10 c1ccc2c(c1)[nH]c(=O)o2 BC200827 [0,0,0,1,1,0|1,0,0]=3 156 B11R2.10 c1ccn2c(c1)cc(n2)O BC638899 [0,0,0,1,1,0|2,0,0]=4 157 B11R2.36 c1cc(cc2c1cc[nH]2)O BC213327 [0,0,0,1,1,0|2,0,0]=4 158 B11R2.36 c1cc2c(cc[nH]2)cc1O BC201869 [0,0,0,1,1,0|2,0,0]=4 159 B13R2.10 c1ccc(cc1)C2=CC(=O)CC2 BC600255 [0,0,0,1,0,1|1,0,1]=4 160 B13R2.10 c1ccc(cc1)c2csc(n2)Br BC683703 [0,0,0,1,0,1|2,0,0]=4 161 B13R2.10 c1ccc(cc1)c2nnc(o2)N BC253872 [0,0,0,1,0,1|2,0,0]=4 162 B13R2.72 B(c1c[nH]c2c1cccc2)(O)O BC682419 [0,0,0,1,0,1|1,0,1]=4 163 B13R2.72 CC(=O)c1c2ccccc2[nH]n1 BC649944 [0,0,0,1,0,1|2,0,0]=4 164 B13R2.72 CC(=O)c1c[nH]c2c1cccc2 BC220886 [0,0,0,1,0,1|1,0,0]=3 165 B13R2.72 c1cc2c(c(c[nH]2)C(=O)O)nc1 BC681974 [0,0,0,1,0,1|1,0,0]=3 166 B13R2.72 c1ccc2c(c1)C(CN2)C(=O)O BC203738 [0,0,0,1,0,1|0,0,2]=4 167 B13R2.72 c1ccc2c(c1)c(c[nH]2)C(=O)O BC203227 [0,0,0,1,0,1|0,0,0]=2 168 B13R2.72 c1ccc2c(c1)c(cs2)C(=O)O BC222299 [0,0,0,1,0,1|0,0,0]=2 169 B13R2.72 c1ccc2c(c1)c(n[nH]2)C(=O)O BC205473 [0,0,0,1,0,1|1,0,0]=3 170 B13R2.72 c1ccn2c(c1)c(cn2)C(=O)O BC209415 [0,0,0,1,0,1|1,0,0]=3 171 B13R2.72 c1cncc2c1[nH]nc2C(=O)O BC681978 [0,0,0,1,0,1|2,0,0]=4 172 B13R2.155 c1cc(cc2c1ccc(=O)[nH]2)O BC210094 [0,1,0,1,0,0|1,0,0]=3 173 B13R2.155 c1cc2c(cc1Br)[nH]c(=O)cn2 BC682141 [0,1,0,1,0,0|2,0,0]=4 174 B13R2.32 c1ccc2c(c1)ccc(c2Br)O BC675519 [0,1,0,1,0,0|1,0,0]=3 175 B13R2.32 c1ccc2c(c1)ccc(c2F)Br BC678239 [0,1,0,1,0,0|2,0,0]=4 176 B13R2.57 C=Cc1ccc2ccccc2c1 BC221101 [0,1,0,1,0,0|2,0,0]=4 177 B13R2.57 COc1ccc2ccccc2n1 BC262285 [0,1,0,1,0,0|1,0,0]=3 178 B13R2.57 COc1ccc2ccncc2c1 BC213978 [0,1,0,1,0,0|2,0,0]=4 179 B13R2.57 c1cc2cc(ccc2nc1)C=O BC223299 [0,1,0,1,0,0|2,0,0]=4 180 B13R2.57 c1cc2cc(ccc2nc1)CO BC222337 [0,1,0,1,0,0|2,0,0]=4 181 B13R2.57 c1cc2ccc(cc2nc1)C=O BC228633 [0,1,0,1,0,0|2,0,0]=4 182 B13R2.57 c1ccc2c(c1)cc(cn2)C=O BC228631 [0,1,0,1,0,0|2,0,0]=4 183 B13R2.57 c1ccc2c(c1)ccc(n2)C=O BC228630 [0,1,0,1,0,0|1,0,0]=3 184 B13R2.57 c1ccc2cc(ccc2c1)C=O BC201281 [0,1,0,1,0,0|1,0,0]=3 185 B13R2.57 c1ccc2cc(ccc2c1)CN BC216805 [0,1,0,1,0,0|2,0,0]=4 186 B13R2.57 c1ccc2cc(ccc2c1)NN BC216595 [0,1,0,1,0,0|2,0,0]=4 187 B13R2.369 c1ccc2cc(c(cc2c1)O)O BC213423 [0,1,0,1,0,0|1,0,0]=3 188 B13R2.435 B(c1cc2ccccc2[nH]1)(O)O BC215335 [0,1,0,1,0,0|1,0,1]=4 189 B13R2.435 CC(=O)c1nc2ccccc2o1 BC210036 [0,1,0,1,0,0|2,0,0]=4 190 B13R2.435 CC(c1cc2ccccc2s1)O BC224959 [0,1,0,1,0,0|1,0,1]=4 191 B13R2.435 c1ccc2c(c1)CC(C2)C(=O)O BC685119 [0,1,0,1,0,0|0,0,2]=4 192 B13R2.435 c1ccc2c(c1)CC(N2)C(=O)O BC204510 [0,1,0,1,0,0|0,0,2]=4 193 B13R2.435 c1ccc2c(c1)C[C@@H](N2)C(=O)O BC210954 [0,1,0,1,0,0|0,0,2]=4 194 B13R2.435 c1ccc2c(c1)[nH]c(n2)C(=O)O BC677979 [0,1,0,1,0,0|1,0,0]=3 195 B13R2.435 c1ccc2c(c1)cc(s2)C(=O)O BC226986 [0,1,0,1,0,0|0,0,0]=2 196 B13R2.328 Cc1cc2ccccc2c(c1)N BC628686 [0,1,0,1,0,0|2,0,0]=4 197 B13R2.328 c1ccc2c(c1)c(cc(n2)Cl)Cl BC646084 [0,1,0,1,0,0|2,0,0]=4 198 B13R2.12159 c1ccc2c(c1)C(=O)OI2(=O)O BC206033 [0,1,0,1,0,0|2,0,0]=4 199 B13R2.5179 Cc1ccc2c(cccc2n1)N BC215778 [0,1,0,1,0,0|2,0,0]=4 200 B13R2.5179 c1cc2c(ccc(n2)O)c(c1)O BC256294 [0,1,0,1,0,0|1,0,0]=3 201 B13R2.5179 c1cc2cc(ccc2c(c1)O)O BC204477 [0,1,0,1,0,0|1,0,0]=3 202 B13R2.162 c1cc2ccc(cc2c(c1)N)O BC204478 [0,1,0,1,0,0|1,0,0]=3 203 B13R2.162 c1cc2ccc(nc2c(c1)O)O BC215774 [0,1,0,1,0,0|1,0,0]=3 204 B13R2.3683 Cc1ccc2c(c1)ccc(=O)o2 BC213745 [0,1,0,1,0,0|0,0,0]=2 205 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)Br BC211915 [0,1,0,1,0,0|1,0,0]=3 206 B13R2.3683 c1cc(=O)[nH]c2c1cc(cc2)O BC205016 [0,1,0,1,0,0|1,0,0]=3 207 B13R2.3683 c1cc(cc2c1cc(cc2)Br)N BC652334 [0,1,0,1,0,0|2,0,0]=4 208 B13R2.3683 c1cc(cc2c1cc(cc2)O)O BC205136 [0,1,0,1,0,0|1,0,0]=3 209 B13R2.3683 c1cc(nc2c1cc(cc2)Br)Cl BC221744 [0,1,0,1,0,0|2,0,0]=4 210 B13R2.3683 c1cc(nc2c1cc(cc2)Cl)Br BC682149 [0,1,0,1,0,0|2,0,0]=4 211 B13R2.3683 c1cc(nc2c1cc(cc2)Cl)Cl BC202862 [0,1,0,1,0,0|2,0,0]=4 212 B13R2.3683 c1cc2c(cc1Cl)ncc(n2)O BC202271 [0,1,0,1,0,0|2,0,0]=4 213 B9R1.6 B(c1ccccc1)(O)O BC207007 [0,0,0,0,2,0|1,0,1]=4 214 B9R1.6 CC(=O)c1ccccc1 BC206207 [0,0,0,0,2,0|1,0,0]=3 215 B9R1.6 CC(=O)c1cccnc1 BC207736 [0,0,0,0,2,0|2,0,0]=4 216 B9R1.6 CC(=O)c1ccncc1 BC204635 [0,0,0,0,2,0|2,0,0]=4 217 B9R1.6 c1c(cncn1)C(=O)O BC227972 [0,0,0,0,2,0|2,0,0]=4 218 B9R1.6 c1c(cncn1)C(=O)O BC674875 [0,0,0,0,2,0|2,0,0]=4 219 B9R1.6 c1cc(cnc1)C(=O)Cl BC650712 [0,0,0,0,2,0|2,0,0]=4 220 B9R1.6 c1cc(cnc1)C(=O)N BC676662 [0,0,0,0,2,0|2,0,0]=4 221 B9R1.6 c1cc(cnc1)C(=O)[O-] BC220349 [0,0,0,0,2,0|1,0,1]=4 222 B9R1.6 c1ccc(cc1)C(=N)N BC228100 [0,0,0,0,2,0|2,0,0]=4 223 B9R1.6 c1ccnc(c1)C(=O)[O-] BC220351 [0,0,0,0,2,0|1,0,1]=4 224 B9R1.6 c1cnc(cn1)C(=O)O BC676806 [0,0,0,0,2,0|2,0,0]=4 225 B9R1.6 c1cnc(nc1)C(=O)O BC228091 [0,0,0,0,2,0|2,0,0]=4 226 B9R1.6 c1cncnc1C(=O)O BC201449 [0,0,0,0,2,0|2,0,0]=4 227 B9R1.6 c1cnncc1C(=O)O BC201463 [0,0,0,0,2,0|2,0,0]=4 228 B9R1.13 c1cc(sc1)CC(=O)O BC201507 [0,0,0,0,2,0|1,0,1]=4