0 B12R1.128 CC(C)(C)C1=C(N)C=CC(Br)=C1 36519 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.128 CC(C)(C)C1=C(O)C=CC(Br)=C1 33681 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.128 CC(C)(C)C1=C(O)C=CC(O)=C1 14585 [0,0,0,0,0,0|0,0,0]=0 3 B12R1.128 CC(C)(C)C1=CC(=O)C=CC1=O 14593 [0,0,0,0,0,0|0,0,2]=2 4 B12R1.128 CC(C)(N)C1=C(Br)C=CC(F)=C1 34629 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.128 CC1=CC(C(C)(C)C)=C(N)C=C1 27682 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.128 CC1=CC(C(C)(C)C)=C(O)C=C1 35418 [0,0,0,0,0,0|1,0,0]=1 7 B12R1.128 NC1=C(C(F)(F)F)C=C(O)C=C1 4551 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.128 O=S(=O)([O-])C1=C(O)C=CC(O)=C1 29410 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.128 OC1=C(C(F)(F)F)C=C(Br)C=C1 18454 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.128 OC1=C(C(F)(F)F)C=C(Cl)C=C1 28369 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.128 OC1=C(C(F)(F)F)C=C(F)C=C1 4146 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.128 OC1=CC(C(F)(F)F)=C(Br)C=C1 2111 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.128 OC1=CC(C(F)(F)F)=C(Cl)C=C1 2863 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.128 OC1=CC(C(F)(F)F)=C(F)C=C1 4147 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 20188 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 18555 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.87 CC(C)(O)C1=CC=CN=C1F 21047 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 27429 [1,0,0,0,0,0|1,0,0]=2 19 B11R1.87 C[Si](C)(C)C1=NC=CC=C1F 5144 [1,0,0,0,0,0|2,1,0]=4 20 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 10389 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.155 CC(C)(C)C1=CC(Cl)=NC=C1 36542 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 4314 [1,0,0,0,0,0|1,0,0]=2 23 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 4364 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.155 CC(C)(O)C1=CC(Br)=CC=C1 25421 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.155 OC1=CC(C(F)(F)F)=CC=C1 5441 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 29152 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 3913 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 16936 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 3353 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 3356 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 17597 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 3377 [1,0,0,0,0,0|1,0,1]=3 33 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 34492 [1,0,0,0,0,0|1,0,0]=2 34 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 27613 [1,0,0,0,0,0|1,0,0]=2 35 B11R1.167 CC(C)N1C=C(Br)C=CC1=O 34479 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.167 CC(O)C1=C(F)C=CC(Br)=C1 20348 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.167 CC1=C(C(C)C)C=C(Br)C=C1 34618 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 14414 [1,0,0,0,0,0|2,0,1]=4 39 B13R1.98 CC(C)(C)C1=C(O)C=CC(C#N)=C1 35176 [0,1,0,0,0,0|1,0,0]=2 40 B13R1.98 CC(C)(C)C1=C(O)C=CC(C=O)=C1 28100 [0,1,0,0,0,0|0,0,1]=2 41 B13R1.2815 CC1=CC(C)=C(O)C(C(C)(C)C)=C1 17486 [0,1,0,0,0,0|1,0,0]=2 42 B13R1.3090 COC1=C(C(C)(C)C)C=C(O)C=C1 24156 [0,1,0,0,0,0|0,0,0]=1 43 B13R1.3090 COC1=C(C(F)(F)F)C=C(O)C=C1 33438 [0,1,0,0,0,0|3,0,0]=4 44 B13R2.10533 NC1(C2=C(Br)C=CC(F)=C2)CC1 34630 [0,0,0,1,0,0|3,0,0]=4 45 B11R1.496 CC(C)(C)C1=C(O)COC1=O 19205 [0,0,0,0,1,0|1,0,2]=4 46 B11R1.496 CC1=CNC(C)=C1C(C)(C)C 23986 [0,0,0,0,1,0|3,0,0]=4 47 B10R1.28 CC(C)(C)C1=CC=CC=C1 36004 [2,0,0,0,0,0|0,0,0]=2 48 B10R1.28 CC(C)(N)C1=CC=CC=C1 19654 [2,0,0,0,0,0|1,0,0]=3 49 B10R1.28 CC(C)(O)C1=CC=NC=C1 16172 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.28 CC(C)(O)C1=NC=CC=C1 34335 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.28 CC(C)(S)C1=CC=CC=C1 6849 [2,0,0,0,0,0|1,0,0]=3 52 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 10814 [2,0,0,0,0,0|1,1,0]=4 53 B10R1.61 CC(=O)C1=C(O)C=CC=C1 23010 [2,0,0,0,0,0|1,0,1]=4 54 B10R1.61 CC(C)C1=C(Br)C=CC=C1 16461 [2,0,0,0,0,0|1,0,0]=3 55 B10R1.61 CC(C)C1=C(Cl)C=NC=C1 6618 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.61 CC(C)C1=C(I)C=CC=C1 12584 [2,0,0,0,0,0|1,0,0]=3 57 B10R1.61 CC(C)C1=C(O)C=CN=C1 35264 [2,0,0,0,0,0|1,0,0]=3 58 B10R1.61 CC(C)C1=C(S)C=CC=C1 6880 [2,0,0,0,0,0|0,1,0]=3 59 B10R1.61 CC(C)C1=CC=CN=C1Cl 6145 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.61 CC(C)C1=NC=CC=C1Br 32481 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.61 CN(C)C1=C(Br)C=CC=C1 3759 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 5269 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.61 CN(C)C1=C(F)C=CC=C1 5243 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 24734 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 23367 [2,0,0,0,0,0|1,0,0]=3 66 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 5686 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 3980 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 24769 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 24731 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 15728 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 5682 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 5670 [2,0,0,0,0,0|2,0,0]=4 73 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 24768 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.113 CC(=O)C1=CC(O)=CC=C1 3284 [2,0,0,0,0,0|1,0,1]=4 75 B10R1.113 CC(C)C1=CC=CC(Br)=N1 28919 [2,0,0,0,0,0|2,0,0]=4 76 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 10559 [2,0,0,0,0,0|2,0,0]=4 77 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 33540 [2,0,0,0,0,0|2,0,0]=4 78 B10R1.113 CC(C)c1cccc(Br)c1 27489 [2,0,0,0,0,0|1,0,0]=3 79 B10R1.113 CC(N)C1=CC(F)=CC=C1 24339 [2,0,0,0,0,0|2,0,0]=4 80 B10R1.113 CC(O)C1=CC(F)=CC=C1 28823 [2,0,0,0,0,0|2,0,0]=4 81 B10R1.113 CN(C)C1=CC(Br)=CC=C1 3760 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.113 CN(C)C1=CC(Cl)=CC=C1 3637 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.113 CN(C)C1=CC(F)=CC=C1 5244 [2,0,0,0,0,0|2,0,0]=4 84 B10R1.113 CN(C)C1=CC(N)=CC=C1 14991 [2,0,0,0,0,0|2,0,0]=4 85 B10R1.113 CN(C)C1=CC=CC(O)=C1 11072 [2,0,0,0,0,0|1,0,0]=3 86 B10R1.113 C[C@@H](N)C1=CC(Cl)=CC=C1 24741 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 24730 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.113 C[C@@H](O)C1=CC(Br)=CC=C1 15565 [2,0,0,0,0,0|2,0,0]=4 89 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 15577 [2,0,0,0,0,0|2,0,0]=4 90 B10R1.113 C[C@@H](O)C1=CC(F)=CC=C1 24771 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 14235 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 24746 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.113 C[C@H](N)C1=CC(Cl)=CC=C1 24735 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 25216 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 24772 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.113 C[C@H](O)C1=CC(Cl)=CC=C1 15576 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 24770 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 2213 [2,0,0,0,0,0|1,0,0]=3 99 B10R1.30 CCC1=C(F)C=CC(O)=C1 27790 [2,0,0,0,0,0|1,0,0]=3 100 B10R1.30 CCC1=C(I)C=CC(Br)=C1 3773 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.30 CCC1=C(N)C=CC(Br)=C1 23174 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.30 CCC1=C(N)C=CC(Br)=C1 3769 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.30 CCC1=NC(C)=CC=C1O 35102 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.30 CNC1=C(O)C=CC(N)=C1 20872 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.30 COC1=C(Br)C=CC(O)=C1 13260 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.30 COC1=C(Cl)C=CC(O)=C1 28110 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.30 COC1=C(F)C=CC(O)=C1 14358 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.30 COC1=C(N)C=CC(O)=C1 18733 [2,0,0,0,0,0|2,0,0]=4 109 B10R1.30 COC1=C(N)C=CC(O)=C1 26950 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.30 COC1=C(O)C=CC(Br)=C1 17271 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.30 COC1=C(O)C=CC(Cl)=C1 3665 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.30 COC1=C(O)C=CC(F)=C1 3880 [2,0,0,0,0,0|2,0,0]=4 113 B10R1.30 COC1=C(O)C=CC(I)=C1 17587 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.30 COC1=C(O)C=CC(N)=C1 14144 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.30 COC1=C(O)C=CC(N)=C1 33372 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.30 O=CC1=C(O)C=CC(O)=C1 2285 [2,0,0,0,0,0|1,0,1]=4 117 B10R1.30 OCC1=CC(Br)=CC=C1O 22564 [2,0,0,0,0,0|2,0,0]=4 118 B12R1.76 CC(C)(C)C1=C(CCl)C=CC=C1 35148 [1,1,0,0,0,0|1,0,0]=3 119 B12R1.126 CC(C)(C)C1=C(Br)C=C(N)C=C1 31844 [1,1,0,0,0,0|1,0,0]=3 120 B12R1.126 CC1=CC(O)=C(C(C)(C)C)C=C1 24316 [1,1,0,0,0,0|0,0,0]=2 121 B12R1.228 CC(C)(C)C1=C(O)C(Cl)=CC=C1 28113 [1,1,0,0,0,0|0,0,0]=2 122 B12R1.228 CC(C)(C)C1=C(O)C(O)=CC=C1 33432 [1,1,0,0,0,0|0,0,0]=2 123 B12R1.228 CC(C)(C)C1=CC=CC(O)=C1F 34621 [1,1,0,0,0,0|1,0,0]=3 124 B12R1.1010 CC1=CC=CC(O)=C1C(C)(C)C 35168 [1,1,0,0,0,0|0,0,0]=2 125 B12R1.23 CC(C)(C)C1=CC(Br)=C(Br)C=C1 4370 [1,1,0,0,0,0|1,0,0]=3 126 B12R1.23 CC(C)(C)C1=CC(Br)=C(N)C=C1 28269 [1,1,0,0,0,0|1,0,0]=3 127 B12R1.23 CC(C)(C)C1=CC(Br)=C(O)C=C1 15100 [1,1,0,0,0,0|1,0,0]=3 128 B12R1.23 CC(C)(C)C1=CC(Cl)=C(Cl)C=C1 27674 [1,1,0,0,0,0|1,0,0]=3 129 B12R1.23 CC(C)(C)C1=CC(Cl)=C(N)C=C1 33274 [1,1,0,0,0,0|1,0,0]=3 130 B12R1.23 CC(C)(C)C1=CC(F)=C(Br)C=C1 33255 [1,1,0,0,0,0|1,0,0]=3 131 B12R1.23 CC(C)(C)C1=CC(F)=C(O)C=C1 21344 [1,1,0,0,0,0|1,0,0]=3 132 B12R1.23 CC(C)(C)C1=CC(I)=C(N)C=C1 27662 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.23 CC(C)(C)C1=CC(I)=C(O)C=C1 44743 [1,1,0,0,0,0|1,0,0]=3 134 B12R1.23 CC(C)(C)C1=CC(N)=C(N)C=C1 22919 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.23 CC(C)(C)C1=CC(O)=C(Br)C=C1 27385 [1,1,0,0,0,0|0,0,0]=2 136 B12R1.23 CC(C)(C)C1=CC=C(O)C(O)=C1 14587 [1,1,0,0,0,0|0,0,0]=2 137 B12R1.23 CC1=C(N)C=C(C(C)(C)C)C=C1 27805 [1,1,0,0,0,0|1,0,0]=3 138 B12R1.23 CC1=CC(C(C)(C)C)=CC=C1O 21766 [1,1,0,0,0,0|1,0,0]=3 139 B12R1.102 CC(C)(C)C1=CC(Br)=CC(Br)=C1 28452 [1,1,0,0,0,0|1,0,0]=3 140 B12R1.102 CC(C)(C)C1=CC(Br)=CC(F)=C1 27428 [1,1,0,0,0,0|1,0,0]=3 141 B12R1.102 CC(C)(C)C1=CC(F)=CC(Br)=C1 20977 [1,1,0,0,0,0|1,0,0]=3 142 B12R1.102 CC(C)(C)C1=CC(I)=CC(I)=C1 34639 [1,1,0,0,0,0|1,0,0]=3 143 B12R1.102 CC(C)(C)C1=CC(O)=CC(Br)=C1 34615 [1,1,0,0,0,0|0,0,0]=2 144 B12R1.436 CC(C)(C)C1=CC=CC(CCl)=C1 31899 [1,1,0,0,0,0|1,0,0]=3 145 B12R1.46 CC(C)C1=C(C=O)C=CC(O)=C1 28102 [1,1,0,0,0,0|0,0,1]=3 146 B12R1.46 COC1=C(C(C)C)C=C(C)C=C1 44855 [1,1,0,0,0,0|1,0,0]=3 147 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1Br 19801 [1,1,0,0,0,0|1,0,0]=3 148 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 26394 [1,1,0,0,0,0|1,0,1]=4 149 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 13248 [1,1,0,0,0,0|1,0,1]=4 150 B12R1.453 COC1=CC(C(C)C)=C(O)C=C1 26583 [1,1,0,0,0,0|0,0,0]=2 151 B14R1.12 CC(C)(C)C1=C(O)C=CC(C(=O)O)=C1 27625 [0,2,0,0,0,0|0,0,0]=2 152 B14R1.2285 CC(C)(C)C1=CC(O)=C(C=O)C=C1Cl 26236 [0,2,0,0,0,0|1,0,0]=3 153 B14R1.361 CC(C)(C)C1=C(O)C(C=O)=CC(O)=C1 20438 [0,2,0,0,0,0|0,0,0]=2 154 B12R2.88 NC1(C2=C(F)C=CC=C2)CC1 34486 [1,0,0,1,0,0|2,0,0]=4 155 B12R2.1282 NC1(C2=CC(Br)=CC=C2)CC1 23874 [1,0,0,1,0,0|2,0,0]=4 156 B12R2.132 NC1CCC2=CC=C(O)C=C21 23073 [1,0,0,1,0,0|2,0,0]=4 157 B12R2.132 N[C@@H]1CCc2ccc(O)cc21 23068 [1,0,0,1,0,0|2,0,0]=4 158 B14R2.4507 CC1=CC=C2N=C(C)C(C)(C)C2=C1 2092 [0,1,0,1,0,0|2,0,0]=4 159 B14R2.4507 CC1=NC2=CC=C(Cl)C=C2C1(C)C 9591 [0,1,0,1,0,0|2,0,0]=4 160 B14R2.4536 CC1(C)CCNC2=CC=C(Br)C=C21 17959 [0,1,0,1,0,0|2,0,0]=4 161 B14R2.4536 CC1(C)CCSC2=C1C=C(Br)C=C2 27313 [0,1,0,1,0,0|1,1,0]=4 162 B12R1.119 CC(C)(C)NC1=NC=CC(Br)=C1 32484 [1,0,0,0,0,1|2,0,0]=4 163 B12R1.119 CC(C)(C)OC1=CC=CC(Br)=N1 13469 [1,0,0,0,0,1|2,0,0]=4 164 B12R1.119 CC(C)(C)OC1=CC=CC(Br)=N1 24042 [1,0,0,0,0,1|2,0,0]=4 165 B12R1.127 CC1=CC(CC(C)C)=C(Br)C=C1 35270 [1,0,0,0,0,1|2,0,0]=4