0 B12R1.652 CC1=NC=C(CO)C(CO)=C1O HR146777 [0,0,0,0,0,0|0,0,0]=0 1 B12R1.652 COC1=C(CO)C=CC(C)=C1Cl HR155822 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.652 Cc1ncc(CO)c(C=O)c1O HR138316 [0,0,0,0,0,0|0,0,2]=2 3 B12R1.652 Cc1ncc(CO)c(CN)c1O HR125540 [0,0,0,0,0,0|1,0,0]=1 4 B12R1.652 Cc1ncc(CO)c(CO)c1O HR128005 [0,0,0,0,0,0|0,0,0]=0 5 B11R1.37 CCC1=C(CO)C=CC(Br)=C1 HR153898 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.37 CCC1=CN=C(C)C=C1C#N HR114901 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.37 COC1=C(CO)C=C(C)C=C1 HR153818 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.37 COC1=C(CO)C=CC(C)=C1 HR155619 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.37 COC1=CN=C(F)C=C1CO HR155533 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.72 CC1=CC=C(Br)C(CO)=C1Cl HR154280 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.72 CC1=CC=C(Br)C(CO)=C1F HR154362 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.72 CC1=CC=C(C)C(C=O)=C1O HR147829 [1,0,0,0,0,0|1,0,2]=4 13 B11R1.72 CC1=CC=C(F)C(CO)=C1Br HR154767 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.72 CC1=CC=C(F)C(CO)=C1Cl HR153831 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.72 CC1=CN=C(C)C(O)=C1C=O HR119161 [1,0,0,0,0,0|0,0,2]=3 16 B11R1.278 CC1=C(Br)C=CC(CO)=C1C HR154240 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.278 CC1=C(CO)C=CC(Br)=C1Cl HR156315 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.278 CC1=C(CO)C=CC(Cl)=C1F HR155474 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.278 CC1=C(CO)C=CC(F)=C1F HR154822 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.278 CC1=C(Cl)C(C)=C(CO)C=C1 HR155878 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.278 CC1=C(Cl)C(Cl)=C(CO)C=C1 HR154862 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.278 CC1=C(Cl)C=CC(CO)=C1C HR156263 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.278 CC1=C(F)C(C)=C(CO)C=C1 HR155536 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.278 CC1=CN=C(CO)C(C)=C1Cl HR139073 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.278 Cc1ncc(CO)c(C)c1O HR126721 [1,0,0,0,0,0|0,0,0]=1 26 B13R2.5180 CC1=C(Cl)C2=C(C=C1)B(O)OC2 HR155913 [0,0,0,1,0,0|3,0,0]=4 27 B10R1.20 CCC1=C(CO)C=CC=C1 HR154385 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.20 OCC1=CC=CC=C1CO HR137010 [2,0,0,0,0,0|1,0,0]=3 29 B10R1.20 OCC1=CC=CN=C1CO HR122041 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.25 CC1=C(CO)C=CC(Br)=C1 HR154114 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 HR153843 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.25 CC1=C(CO)C=CC(F)=C1 HR154266 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.25 CC1=C(CO)C=CC(O)=C1 HR155965 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.25 CC1=C(CO)C=NC(Br)=C1 HR152828 [2,0,0,0,0,0|1,0,0]=3 35 B10R1.25 CC1=C(CO)C=NC(Cl)=C1 HR152793 [2,0,0,0,0,0|1,0,0]=3 36 B10R1.25 CC1=CC(Br)=C(CO)C=C1 HR154556 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.25 CC1=CC(C)=C(CBr)C=C1 HR147219 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.25 CC1=CC(C)=C(CCl)C=C1 HR106485 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.25 CC1=CC(C)=C(CN)C=C1 HR117933 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.25 CC1=CC(C)=C(CO)C=C1 HR144903 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.25 CC1=CC(C)=NC=C1C#N HR121514 [2,0,0,0,0,0|1,0,1]=4 42 B10R1.25 CC1=CC(Cl)=C(CO)C=C1 HR154134 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.25 CC1=CC(F)=C(CO)C=C1 HR154338 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.25 CC1=CC(F)=NC=C1CO HR152868 [2,0,0,0,0,0|1,0,0]=3 45 B10R1.25 CC1=CC(O)=C(CO)C=C1 HR155927 [2,0,0,0,0,0|1,0,0]=3 46 B10R1.25 CC1=CN=C(CO)C(C)=C1 HR115848 [2,0,0,0,0,0|2,0,0]=4 47 B10R1.25 CC1=NC=C(CO)C(C)=N1 HR117224 [2,0,0,0,0,0|1,0,0]=3 48 B10R1.25 CC1=NC=C(CO)C(N)=N1 HR114666 [2,0,0,0,0,0|2,0,0]=4 49 B10R1.30 CC1=C(CO)C=C(Br)C=C1 HR154200 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.30 CC1=C(CO)C=C(F)C=C1 HR153829 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.30 CC1=C(CO)C=C(O)C=C1 HR154005 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.30 CC1=CC(CCl)=C(C)C=C1 HR124550 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.30 CC1=CC(CN)=C(C)C=C1 HR7405 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.30 CC1=CC(CO)=C(Br)C=C1 HR154326 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.30 CC1=CC(CO)=C(F)C=C1 HR154735 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.30 CC1=CC(CO)=C(O)C=C1 HR155912 [2,0,0,0,0,0|1,0,0]=3 57 B10R1.30 OCC1=C(O)C=CC(Br)=C1 HR125691 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.30 OCC1=C(O)C=CC(Cl)=C1 HR106697 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.30 OCC1=CC(Br)=NC=C1Br HR152624 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.30 OCC1=CC(Br)=NC=C1Cl HR152840 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.30 OCC1=CC(Cl)=NC=C1Br HR154730 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.30 OCC1=CC(Cl)=NC=C1Cl HR152945 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.30 OCC1=CC(Cl)=NC=C1F HR106167 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.30 OCC1=CC(F)=NC=C1Br HR156081 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.2 CC1=C(CO)C=CC=C1Br HR153738 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.2 CC1=C(CO)C=CC=C1Cl HR153699 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.2 CC1=C(CO)C=CC=C1F HR144724 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.2 CC1=C(CO)C=NC=C1Br HR152568 [2,0,0,0,0,0|1,0,0]=3 69 B10R1.2 CC1=CC=CC(CO)=C1C HR103354 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.2 CC1=CC=CC(CO)=C1F HR154270 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.2 CC1=CC=CC(CO)=C1N HR102512 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.2 CC1=CC=CC(CO)=C1O HR155842 [2,0,0,0,0,0|1,0,0]=3 73 B10R1.2 CC1=NC=CC(C=O)=C1O HR104063 [2,0,0,0,0,0|0,0,2]=4 74 B10R1.2 CCC1=C(O)C(O)=CC=C1 HR31587 [2,0,0,0,0,0|2,0,0]=4 75 B10R1.2 Cc1c(CO)ccnc1F HR156532 [2,0,0,0,0,0|2,0,0]=4 76 B10R1.2 NC1=C(CO)C=NC=C1Br HR33805 [2,0,0,0,0,0|2,0,0]=4 77 B10R1.2 OCC1=C(Br)C(Cl)=NC=C1 HR152989 [2,0,0,0,0,0|2,0,0]=4 78 B10R1.2 OCC1=C(Cl)C(Br)=NC=C1 HR154458 [2,0,0,0,0,0|2,0,0]=4 79 B10R1.2 OCC1=C(Cl)C(Cl)=NC=C1 HR152717 [2,0,0,0,0,0|2,0,0]=4 80 B10R1.2 OCC1=C(Cl)C(F)=NC=C1 HR156536 [2,0,0,0,0,0|2,0,0]=4 81 B10R1.2 OCC1=C(F)C(Cl)=NC=C1 HR153043 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.2 OCC1=CC=CC(Cl)=C1O HR155761 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.2 OCC1=CN=CC(Br)=C1Cl HR153151 [2,0,0,0,0,0|2,0,0]=4 84 B10R1.2 OCC1=CN=CC(Br)=C1Cl HR155747 [2,0,0,0,0,0|2,0,0]=4 85 B10R1.119 CC1=C(C)C(C)=C(C)C=C1 HR113012 [2,0,0,0,0,0|2,0,0]=4 86 B10R1.119 CC1=C(Cl)C(C)=C(O)C=C1 HR155879 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.119 CC1=C(F)C(C)=C(O)C=C1 HR155276 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.119 CC1=C(O)C(C)=C(O)C=C1 HR121858 [2,0,0,0,0,0|1,0,0]=3 89 B10R1.119 CC1=CC=C(C)C(O)=C1C HR138060 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.245 CC1=CC=CC(C)=C1CO HR154441 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.245 CC1=CN=CC(Br)=C1CO HR155721 [2,0,0,0,0,0|1,0,0]=3 92 B10R1.245 CC1=CN=CC(C)=C1CO HR110325 [2,0,0,0,0,0|1,0,0]=3 93 B10R1.245 OCC1=C(Br)C=NC=C1Br HR152905 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.245 OCC1=C(Br)C=NC=C1F HR152985 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.245 OCC1=C(Cl)C=NC=C1Cl HR156541 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.245 OCC1=C(O)C=CC=C1Cl HR156053 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.176 CC1=C(Br)C=C(CO)C=C1 HR154323 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.176 CC1=C(C)C=C(CO)C=C1 HR133520 [2,0,0,0,0,0|2,0,0]=4 99 B10R1.176 CC1=C(Cl)C=C(CO)C=C1 HR154434 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.176 CC1=C(F)C=C(CO)C=C1 HR109168 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.176 CC1=C(F)N=CC(CO)=C1 HR152845 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.176 CC1=CC(CO)=CN=C1Br HR152693 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.176 CC1=CC(CO)=CN=C1Cl HR152680 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 HR118469 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.176 OCC1=CC(O)=C(Cl)C=C1 HR153870 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.176 OCC1=CC(O)=C(F)C=C1 HR154466 [2,0,0,0,0,0|2,0,0]=4 107 B12R1.57 CC1=CC(CO)=C(B(O)O)C=C1 HR151556 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.112 CCOC1=C(CO)C=C(C)C=C1 HR155910 [1,1,0,0,0,0|2,0,0]=4 109 B12R1.741 COC1=C(CO)C(F)=CC=C1C HR155941 [1,1,0,0,0,0|2,0,0]=4 110 B12R2.132 CC1=CC2=C(C=C1)COB2O HR155506 [1,0,0,1,0,0|2,0,0]=4 111 B12R2.315 OCc1cccc2c1CCO2 HR118715 [1,0,0,1,0,0|2,0,0]=4 112 B10R1.256 CC1=NN(C)C(C)=C1CO HR107666 [1,0,0,0,1,0|2,0,0]=4