0 B10R1.18 CC(=O)NC1=CN=CN=C1 F18145 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.18 NC(=O)CC1=CN=CN=C1 FD7229 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.18 [2H]C([2H])=CC1=CC=CC=C1 D99670 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.8 CCCC1=CC=CN=C1 O11051 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.8 CNNC1=CC=CC=C1 C77159 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.8 FCCC1=CC=CC=C1 75534 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.8 IC#CC1=CC=CC=C1 N11813 [1,0,0,0,0,0|2,0,1]=4 18 B9R1.8 NCCC1=CC=CC=C1 T71816 [1,0,0,0,0,0|2,0,1]=4 19 B9R1.8 NCCC1=CC=CC=C1 T72591 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N11494 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.20 CC(=O)O[C@@H]1C=CC(=O)CO1 W10954 [0,1,0,0,0,0|1,0,2]=4 22 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.20 CC1=CN=C(CC(=O)[O-])C=C1 R10046 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.20 FC1=CC=C(OC(=S)Cl)C=C1 T72468 [0,1,0,0,0,0|1,1,0]=3 28 B11R1.20 FC1=CC=C(OC(F)F)C=C1 F17627 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.20 N=C(N)NC1=CC=C(Cl)C=C1 28377 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 C16184 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.20 NC(=O)NC1=CC=C(N)C=C1 51818 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 63680 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 T71089 [0,1,0,0,0,0|1,0,0]=2 35 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N15518 [0,1,0,0,0,0|1,0,0]=2 36 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [0,1,0,0,0,0|1,0,2]=4 37 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [0,1,0,0,0,0|1,0,2]=4 38 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [0,1,0,0,0,0|1,0,2]=4 39 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [0,1,0,0,0,0|1,0,2]=4 40 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 F13376 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [0,1,0,0,0,0|1,0,2]=4 42 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 AT10021 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 F15634 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.36 N[C@@H](C(=O)O)C1=CN=CC=C1 AT21867 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.36 N[C@@H](C(=O)O)C1=NC=CC=C1 AC3554 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.36 [2H]C([2H])=C([2H])C1=CC=CC=C1 D99675 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,1,0,0,0,0|1,1,0]=3 49 B11R1.40 COC(=O)CC1=CN=CN=C1 AT13806 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,1,0,0,0,0|1,0,1]=3 51 B11R1.40 Cl\C=C(\Cl)OC1=CC=CC=C1 W12901 [0,1,0,0,0,0|1,0,1]=3 52 B11R1.40 N#CC(=O)CC1=CC=CC=C1 AC5929 [0,1,0,0,0,0|1,0,1]=3 53 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.40 NNC(=O)CC1=NC=CC=C1 AT10923 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.40 O=C(CCl)NC1=CN=CC=C1 C78463 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.40 O\N=C(/Cl)CC1=CC=CC=C1 AC6652 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.86 CC(=O)NC1=C(Br)C=CC=N1 F18386 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.86 CC(=O)NC1=C(C)N=CC=C1 F14250 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 D71943 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.86 CC(=O)NC1=C(N)C=CN=C1 C16214 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.86 CC(=O)NC1=NN=CC=C1C AC7622 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 F13222 [0,1,0,0,0,0|0,0,0]=1 66 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 81280 [0,1,0,0,0,0|1,1,0]=3 67 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.86 CC(C)OC1=C(I)C=CC=N1 76901 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.86 FC(F)OC1=C(Cl)C=CC=C1 F19093 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.86 FC1=C(OC(F)F)C=CC=C1 F18842 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.86 NC(=O)CC1=NC=CC=C1O D87092 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [0,1,0,0,0,0|1,0,0]=2 80 B11R1.157 CC(=O)NC1=CC=CC(Cl)=N1 F17978 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.157 CC(=O)NC1=NC(N)=NC=C1 CS2583 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.157 CC(=O)NC1=NC=CC(Cl)=N1 AC6062 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 AC7585 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.157 CC(C)OC1=CC(Br)=CN=C1 F19749 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.157 CC(C)OC1=NC=CC(N)=C1 AT18134 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 AC5601 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [0,1,0,0,0,0|2,0,1]=4 94 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.157 FC(F)OC1=CC=CC(Cl)=C1 F19087 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C12447 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.157 N=C(N)NC1=CC=CC(F)=C1 C16183 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.157 N=C(N)NC1=CC=CC(O)=C1 S11159 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 F19865 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.157 NC1=CC=CC(CC(=O)O)=N1 S12253 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 N10485 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 Y10709 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 AT23257 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 AC4724 [0,1,0,0,0,0|2,0,1]=4 106 B11R1.509 C[Si](C)(C)SC1=CC=CC=C1 D76934 [0,1,0,0,0,0|1,2,0]=4 107 B11R1.509 [2H]C([2H])([2H])OC1=CC=CC=C1 D99695 [0,1,0,0,0,0|2,0,1]=4 108 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [0,0,0,1,0,0|2,0,1]=4 109 B11R2.10 CC1=NC2=C(C=NC=C2)O1 A11329 [0,0,0,1,0,0|2,0,0]=3 110 B11R2.10 CC1=NC2=CC=CN=C2N1 F19908 [0,0,0,1,0,0|3,0,0]=4 111 B11R2.10 CC1=NC2=CC=CN=C2S1 75584 [0,0,0,1,0,0|2,1,0]=4 112 B11R2.10 CC1=NN2C=CC=CC2=N1 C90954 [0,0,0,1,0,0|3,0,0]=4 113 B11R2.10 ClC1=CC2=C(C=CC=C2)O1 AC6512 [0,0,0,1,0,0|1,0,1]=3 114 B11R2.10 ClC1=NC2=C(C=CC=N2)O1 C74663 [0,0,0,1,0,0|3,0,0]=4 115 B11R2.10 ClC1=NC2=C(C=CN=C2)O1 C72870 [0,0,0,1,0,0|3,0,0]=4 116 B11R2.10 FC1=NC2=C(C=CC=C2)S1 T71604 [0,0,0,1,0,0|2,1,0]=4 117 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [0,0,0,1,0,0|2,0,0]=3 118 B11R2.10 NC1=CC2=C(C=CC=C2)N1 79767 [0,0,0,1,0,0|2,0,1]=4 119 B11R2.10 NC1=CC2=C(C=CC=C2)N1 F13373 [0,0,0,1,0,0|2,0,1]=4 120 B11R2.10 O=C1C=C2C=CC=CN2N1 W16687 [0,0,0,1,0,0|2,0,1]=4 121 B11R2.10 O=C1CC2=C(C=CC=C2)S1 A51238 [0,0,0,1,0,0|0,1,0]=2 122 B11R2.10 O=C1CC2=C(C=NC=C2)N1 61718 [0,0,0,1,0,0|2,0,0]=3 123 B11R2.10 O=C1NC2=C(C=CC=N2)S1 C72885 [0,0,0,1,0,0|2,1,0]=4 124 B11R2.10 O=C1NC2=CC=CN=C2S1 F13119 [0,0,0,1,0,0|2,1,0]=4 125 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [0,0,0,0,1,0|2,0,1]=4 126 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [0,0,0,0,1,0|2,0,1]=4 127 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [0,0,0,0,1,0|2,0,1]=4 128 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [0,0,0,0,1,0|2,0,1]=4 129 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [0,0,0,0,1,0|3,0,0]=4 130 B9R1.6 NC(=O)C1=NC=CC=N1 C11052 [0,0,0,0,1,0|3,0,0]=4 131 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [0,0,0,0,1,0|2,0,0]=3 132 B9R1.6 O=C([O-])C1=NC=CC=C1 T71798 [0,0,0,0,1,0|2,0,0]=3 133 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [0,0,0,0,1,0|1,0,0]=2 134 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [0,0,0,0,1,0|1,0,1]=3 135 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [0,0,0,0,1,0|3,0,0]=4 136 B9R1.13 CC(=O)CC1=CSC=C1 66590 [0,0,0,0,1,0|2,0,0]=3 137 B9R1.13 CC(=O)CN1C=CC=N1 AT23998 [0,0,0,0,1,0|3,0,0]=4 138 B9R1.13 CC(=O)NC1=CNN=C1 AT23103 [0,0,0,0,1,0|3,0,0]=4 139 B9R1.13 NC(=O)CC1=CC=CN1 72456 [0,0,0,0,1,0|3,0,0]=4 140 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [0,0,0,0,0,1|2,0,0]=3 141 B11R1.91 CC(=O)COC1=NC=CC=C1 AC9007 [0,0,0,0,0,1|1,0,0]=2 142 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [0,0,0,0,0,1|1,0,1]=3 143 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [0,0,0,0,0,1|1,0,1]=3 144 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [0,0,0,0,0,1|1,1,1]=4 145 B11R1.91 N=C(N)NCC1=CC=CC=C1 S12114 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.91 NC(=O)CCC1=NC=CC=C1 AC6900 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.91 NC(N)=NCC1=CC=CC=C1 H10078 [0,0,0,0,0,1|3,0,0]=4 148 B11R1.91 O=C(O)CSC1=NC=CC=C1 AT20604 [0,0,0,0,0,1|2,1,0]=4 149 B8R1.2 C=CC1=CC=CN=C1 71366 [2,0,0,0,0,0|1,0,1]=4 150 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|1,0,1]=4 151 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|1,0,0]=3 152 B10R1.1 CCOC1=NC=C(O)C=C1 D75011 [1,1,0,0,0,0|1,0,1]=4 153 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.1 O=CNC1=CC=C(F)C=C1 F21300 [1,1,0,0,0,0|1,0,0]=3 157 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [1,1,0,0,0,0|1,0,0]=3 158 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [1,1,0,0,0,0|1,0,1]=4 159 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [1,1,0,0,0,0|1,0,1]=4 160 B10R1.4 CCOC1=C(C)C=CN=C1 AC4346 [1,1,0,0,0,0|1,0,1]=4 161 B10R1.4 CCOC1=C(F)C=CC=N1 F53248 [1,1,0,0,0,0|1,0,1]=4 162 B10R1.4 CCOC1=CC=CN=C1Cl W17868 [1,1,0,0,0,0|1,0,1]=4 163 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [1,1,0,0,0,0|0,1,1]=4 164 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [1,1,0,0,0,0|0,1,1]=4 165 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [1,1,0,0,0,0|1,0,0]=3 167 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [1,1,0,0,0,0|1,0,1]=4 169 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [1,1,0,0,0,0|1,0,1]=4 170 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [1,1,0,0,0,0|1,0,1]=4 171 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [1,1,0,0,0,0|0,0,1]=3 172 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [1,1,0,0,0,0|0,1,1]=4 173 B10R1.10 COCC1=CC(N)=CC=C1 30379 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [1,1,0,0,0,0|1,0,0]=3 176 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [1,1,0,0,0,0|1,0,1]=4 177 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [1,1,0,0,0,0|1,0,0]=3 180 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [1,1,0,0,0,0|1,0,0]=3 181 B10R1.17 FCCNC1=CC=CC=C1 D77931 [1,1,0,0,0,0|1,0,1]=4 182 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [1,1,0,0,0,0|0,0,0]=2 185 B10R1.17 O=CNCC1=NC=CC=C1 AC6369 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.17 O=C\C=C\C1=CC=NC=C1 T72403 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.17 OCCOC1=NC=CC=C1 C90307 [1,1,0,0,0,0|1,0,1]=4 188 B10R1.17 OC\C=C\C1=CC=NC=C1 AC1120 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [0,1,0,0,1,0|2,0,0]=4 190 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [0,1,0,0,1,0|2,0,0]=4 191 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [0,1,0,0,1,0|2,0,0]=4 192 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [0,1,0,0,1,0|2,0,0]=4 193 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [0,1,0,0,1,0|2,0,0]=4 194 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [0,1,0,0,1,0|1,0,1]=4 195 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [0,1,0,0,1,0|1,0,1]=4 196 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 I11569 [0,1,0,0,1,0|2,0,0]=4 197 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [0,1,0,0,1,0|1,0,1]=4 198 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [0,1,0,0,1,0|1,0,1]=4 199 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [0,1,0,0,1,0|0,0,2]=4 200 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [0,1,0,0,1,0|1,0,0]=3 201 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [0,1,0,0,1,0|1,0,0]=3 202 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [0,1,0,0,1,0|1,0,0]=3 203 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [0,1,0,0,1,0|1,0,0]=3 204 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [0,1,0,0,1,0|1,0,0]=3 205 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [0,1,0,0,1,0|0,0,0]=2 206 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [0,1,0,0,1,0|1,0,0]=3 207 B10R1.61 CC(=O)C1=NC=CN=C1N P10974 [0,1,0,0,1,0|2,0,0]=4 208 B10R1.61 CC(=O)C1=NC=NC=C1C O10307 [0,1,0,0,1,0|2,0,0]=4 209 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,1,0,0,1,0|1,0,1]=4 210 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [0,1,0,0,1,0|1,0,0]=3 211 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [0,1,0,0,1,0|1,0,1]=4 212 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [0,1,0,0,1,0|1,0,1]=4 213 B10R1.61 N=C(N)C1=C(F)C=CC=C1 W10322 [0,1,0,0,1,0|2,0,0]=4 214 B10R1.61 NC(=O)C1=C(F)C=NC=C1 55531 [0,1,0,0,1,0|2,0,0]=4 215 B10R1.61 NC(=O)C1=C(O)N=CC=C1 D74336 [0,1,0,0,1,0|2,0,0]=4 216 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 78917 [0,1,0,0,1,0|2,0,0]=4 217 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [0,1,0,0,1,0|1,0,0]=3 218 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [0,1,0,0,1,0|1,0,0]=3 219 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [0,1,0,0,1,0|1,0,0]=3 220 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [0,1,0,0,1,0|1,0,0]=3 221 B10R1.113 CC(=O)C1=CC(Cl)=NC=N1 91059 [0,1,0,0,1,0|2,0,0]=4 222 B10R1.113 CC(=O)C1=CN=NC(C)=C1 E71800 [0,1,0,0,1,0|2,0,0]=4 223 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [0,1,0,0,1,0|1,0,0]=3 224 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [0,1,0,0,1,0|1,0,1]=4 225 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [0,1,0,0,1,0|1,0,1]=4 226 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [0,1,0,0,1,0|1,0,1]=4 227 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [0,1,0,0,1,0|1,0,1]=4 228 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [0,1,0,0,1,0|1,0,1]=4 229 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [0,1,0,0,1,0|1,0,1]=4 230 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [0,1,0,0,1,0|0,0,2]=4 231 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [0,1,0,0,1,0|0,0,2]=4 232 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [0,1,0,0,1,0|1,0,0]=3 233 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [0,1,0,0,1,0|1,0,0]=3 234 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [0,1,0,0,1,0|1,1,0]=4 235 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 D84548 [0,1,0,0,1,0|2,0,0]=4 236 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AC3399 [0,1,0,0,1,0|2,0,0]=4 237 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [0,1,0,0,1,0|1,0,0]=3 238 B10R1.113 O=[N+]([O-])C1=CC=CC(S)=C1 AT20860 [0,1,0,0,1,0|2,0,0]=4 239 B10R1.23 CC(=O)C(=O)C1=CC=CS1 H11148 [0,1,0,0,1,0|2,0,0]=4 240 B10R1.27 COC(=O)CC1=CC=CN1 AB10301 [0,1,0,0,1,0|2,0,0]=4 241 B10R1.54 CC(=O)NC1=CC=C(Br)S1 27544 [0,1,0,0,1,0|2,0,0]=4 242 B12R1.21 CC(=O)CSC1=CC=C(Br)C=C1 21292 [0,1,0,0,0,1|0,1,0]=3 243 B12R1.21 CC(=O)NCC1=CN=C(Cl)C=C1 F12000 [0,1,0,0,0,1|2,0,0]=4 244 B12R1.21 CC1=CC=C(C#CC(=O)O)C=C1 D77831 [0,1,0,0,0,1|2,0,0]=4 245 B12R1.21 CC1=CC=C(OC[C@H](C)N)C=C1 C78123 [0,1,0,0,0,1|1,0,1]=4 246 B12R1.21 CC1=CC=C(\C=C\C(N)=O)C=C1 H11524 [0,1,0,0,0,1|2,0,0]=4 247 B12R1.21 C[C@H](N)COC1=CC=C(Br)C=C1 C78409 [0,1,0,0,0,1|1,0,1]=4 248 B12R1.21 C[C@H](N)COC1=CC=C(F)C=C1 C77796 [0,1,0,0,0,1|1,0,1]=4 249 B12R1.21 NC(=O)COC1=CC=C(Br)C=C1 88302 [0,1,0,0,0,1|1,0,0]=3 250 B12R1.21 O=C(O)C#CC1=CC=C(Br)C=C1 T70657 [0,1,0,0,0,1|2,0,0]=4 251 B12R1.21 O=C(O)CSC1=CC=C(O)C=C1 AT20930 [0,1,0,0,0,1|1,1,0]=4 252 B12R1.27 C#CC(=O)CCC1=CC=CC=C1 W16385 [0,1,0,0,0,1|1,0,1]=4 253 B12R1.27 COC(=O)C#CC1=CC=NC=C1 AC6823 [0,1,0,0,0,1|2,0,0]=4 254 B12R1.27 C[C@@H](C=O)OCC1=CC=CC=C1 C10570 [0,1,0,0,0,1|0,0,1]=3 255 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 AT22580 [0,1,0,0,0,1|0,0,2]=4 256 B12R1.43 C[C@H](N)C(=O)OC1=CC=CC=C1 F52322 [0,1,0,0,0,1|1,0,1]=4 257 B12R1.43 N[C@H]([13CH2]C1=CC=CC=C1)C(=O)O D99537 [0,1,0,0,0,1|2,0,0]=4 258 B12R1.43 [15NH2][C@@H](CC1=CC=CC=C1)C(=O)O 41399 [0,1,0,0,0,1|2,0,0]=4 259 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 F50499 [0,1,0,0,0,1|2,0,0]=4 260 B12R1.107 C[C@H](NC(N)=O)C1=CC=CC=C1 C11665 [0,1,0,0,0,1|2,0,0]=4 261 B12R1.125 CC(=O)SCC1=C(Cl)C=CC=C1 W11173 [0,1,0,0,0,1|0,1,0]=3 262 B12R1.125 CC(C)OCC1=C(Br)C=CC=C1 N10193 [0,1,0,0,0,1|1,0,1]=4 263 B12R1.125 NC1=C(CCC(=O)O)C=CC=C1 F52868 [0,1,0,0,0,1|2,0,0]=4 264 B12R1.125 O=C(O)CNC1=C(Br)C=CC=C1 CL8802 [0,1,0,0,0,1|2,0,0]=4 265 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 61030 [0,1,0,0,0,1|2,0,0]=4 266 B12R1.125 O=C(O)CSC1=C(Br)C=CC=C1 AT20945 [0,1,0,0,0,1|1,1,0]=4 267 B12R1.125 O=C(O)CSC1=C(O)C=CC=C1 AT20931 [0,1,0,0,0,1|1,1,0]=4 268 B12R1.226 CC(=O)NNC1=CC=CC(Cl)=C1 C14571 [0,1,0,0,0,1|1,0,0]=3 269 B12R1.226 CC(C)OCC1=CC(N)=CC=C1 F20261 [0,1,0,0,0,1|1,0,1]=4 270 B12R1.226 CC1=CC=CC(OC[C@H](C)N)=C1 F50497 [0,1,0,0,0,1|1,0,1]=4 271 B12R1.226 CC1=CC=CC(SCC(=O)O)=C1 AT20929 [0,1,0,0,0,1|1,1,0]=4 272 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 F20007 [0,1,0,0,0,1|2,0,0]=4 273 B12R1.226 NC(=O)CCC1=CC=CC(Cl)=C1 D87293 [0,1,0,0,0,1|2,0,0]=4 274 B12R1.891 CS(=O)(=O)OCC1=NC=CC=C1 92886 [0,1,0,0,0,1|2,0,0]=4 275 B12R1.4 NNC1=CC=C(CC(N)=O)C=C1 F30826 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.19 CC(=O)NC1=CC(F)=C(C)C=C1 E72199 [0,2,0,0,0,0|1,0,0]=3 277 B12R1.19 CC(=O)NC1=CC(I)=C(C)C=C1 AC7468 [0,2,0,0,0,0|1,0,0]=3 278 B12R1.19 CC(=O)NC1=NC(C)=C(F)C=C1 36635 [0,2,0,0,0,0|2,0,0]=4 279 B12R1.19 CC(=O)NC1=NC(F)=C(I)C=C1 C16589 [0,2,0,0,0,0|2,0,0]=4 280 B12R1.19 CC(=O)OC1=CC(Br)=C(F)C=C1 C11086 [0,2,0,0,0,0|0,0,0]=2 281 B12R1.19 CC1=C(Cl)C=CC(CC(=O)O)=C1 D96291 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.19 CC1=C(F)C=CC(OC(=O)Cl)=C1 FD10709 [0,2,0,0,0,0|1,0,0]=3 283 B12R1.20 CC(=O)C(=O)C1=CC=C(Br)C=C1 H11214 [0,2,0,0,0,0|1,0,0]=3 284 B12R1.20 CC(=O)C(=O)C1=CC=C(C)C=C1 H11218 [0,2,0,0,0,0|1,0,0]=3 285 B12R1.20 CC(=O)[C@H](N)C1=CC=C(Br)C=C1 N15666 [0,2,0,0,0,0|1,0,0]=3 286 B12R1.20 CC(=O)[C@H](N)C1=CC=C(C)C=C1 N15700 [0,2,0,0,0,0|1,0,0]=3 287 B12R1.20 CC(=O)[C@H](N)C1=CC=C(Cl)C=C1 N15653 [0,2,0,0,0,0|1,0,0]=3 288 B12R1.20 CC(=O)[C@H](N)C1=CC=C(F)C=C1 N15652 [0,2,0,0,0,0|1,0,0]=3 289 B12R1.20 CC(=O)[C@H](N)C1=CC=C(N)C=C1 N16145 [0,2,0,0,0,0|1,0,0]=3 290 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 Y11713 [0,2,0,0,0,0|2,0,0]=4 291 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(N)C=C1 AC1408 [0,2,0,0,0,0|2,0,0]=4 292 B12R1.20 C[C@@H](C(N)=O)C1=CC=C(Br)C=C1 AC1413 [0,2,0,0,0,0|2,0,0]=4 293 B12R1.20 NC(=O)[C@H](N)C1=CC=C(F)C=C1 C77553 [0,2,0,0,0,0|2,0,0]=4 294 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 N10974 [0,2,0,0,0,0|2,0,0]=4 295 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 AC7645 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.20 O=C(O)[C@H](F)C1=CC=C(Br)C=C1 98573 [0,2,0,0,0,0|2,0,0]=4 297 B12R1.20 O=C(O)[C@H](F)C1=CC=C(Cl)C=C1 98571 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.20 O=C(O)[C@H](F)C1=CC=C(F)C=C1 98569 [0,2,0,0,0,0|2,0,0]=4 299 B12R1.49 C=CC(=O)NC1=CC=C(C)C=C1 N11698 [0,2,0,0,0,0|1,0,1]=4 300 B12R1.49 CCC(=O)CC1=CC=C(Cl)C=C1 N12627 [0,2,0,0,0,0|1,0,0]=3 301 B12R1.49 CCC(=O)CC1=CC=C(I)C=C1 85181 [0,2,0,0,0,0|1,0,0]=3 302 B12R1.49 COC(=O)CC1=CN=C(N)C=C1 D71900 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.49 COC(=O)CC1=NC=C(Cl)C=C1 93630 [0,2,0,0,0,0|2,0,0]=4 304 B12R1.49 C[C@@H](CN)OC1=CC=C(Cl)C=C1 C77969 [0,2,0,0,0,0|1,0,1]=4 305 B12R1.49 C[C@H](C=O)CC1=CC=C(Cl)C=C1 C76805 [0,2,0,0,0,0|1,0,1]=4 306 B12R1.49 C\C(=C/C1=CC=C(F)C=C1)CO F53074 [0,2,0,0,0,0|1,0,1]=4 307 B12R1.49 N#CC(=O)CC1=CC=C(Cl)C=C1 83342 [0,2,0,0,0,0|1,0,1]=4 308 B12R1.49 NCC(=O)CC1=CC=C(F)C=C1 D87535 [0,2,0,0,0,0|1,0,0]=3 309 B12R1.49 NCC(=O)NC1=CC=C(F)C=C1 F21123 [0,2,0,0,0,0|1,0,0]=3 310 B12R1.49 NNC(=O)NC1=CC=C(Br)C=C1 W12874 [0,2,0,0,0,0|2,0,0]=4 311 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 C78062 [0,2,0,0,0,0|1,0,0]=3 312 B12R1.106 CC1=CC=C(C[S@@](C)(=N)=O)C=C1 E72404 [0,2,0,0,0,0|2,0,0]=4 313 B12R1.106 CS(=O)(=O)CC1=CC=C(N)C=C1 AC8675 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.106 CS(=O)(=O)NC1=CC=C(Cl)C=C1 D87371 [0,2,0,0,0,0|2,0,0]=4 315 B12R1.106 CS(=O)(=O)OC1=CC=C(F)C=C1 76122 [0,2,0,0,0,0|1,0,0]=3 316 B12R1.106 CS(=O)(=O)OC1=CC=C(S)C=C1 F16829 [0,2,0,0,0,0|1,0,0]=3 317 B12R1.106 CS(C)(=O)=NC1=CC=C(O)C=C1 AT18480 [0,2,0,0,0,0|2,0,0]=4 318 B12R1.106 C[S@](=N)(=O)CC1=CC=C(Br)C=C1 E72408 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.106 O=P(Cl)(Cl)OC1=CC=C(Br)C=C1 F17179 [0,2,0,0,0,0|2,0,0]=4 320 B12R1.233 C=C(C)OC1=C(C)C=C(Cl)C=C1 H11070 [0,2,0,0,0,0|1,0,0]=3 321 B12R1.233 CC(=O)CC1=C(Cl)C=C(F)C=C1 F30166 [0,2,0,0,0,0|1,0,0]=3 322 B12R1.233 CC(=O)CC1=C(F)C=C(Cl)C=C1 96498 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.233 CC(=O)NC1=C(C)C=C(Br)C=C1 C13349 [0,2,0,0,0,0|1,0,0]=3 324 B12R1.233 CC(=O)NC1=C(C)C=C(C)N=C1 F17997 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.233 CC(=O)NC1=C(I)C=C(F)C=C1 AT19905 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.233 CC(=O)NC1=CC=C(Cl)N=C1I F51674 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.233 CC(=O)NC1=CN=C(Br)C=C1C F18384 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.233 CC(=O)NC1=CN=C(Cl)C=C1C D87663 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.233 CC(=O)OC1=C(F)C=C(Br)C=C1 AT14688 [0,2,0,0,0,0|0,0,0]=2 330 B12R1.233 CC(C)OC1=C(Br)C=C(Cl)C=C1 C91609 [0,2,0,0,0,0|1,0,1]=4 331 B12R1.34 CCC(=O)[C@H](C)C1=CC=CC=C1 F30714 [0,2,0,0,0,0|1,0,0]=3 332 B12R1.34 CNC(=O)[C@H](O)C1=CC=CC=C1 E72123 [0,2,0,0,0,0|1,0,0]=3 333 B12R1.34 COC(=O)[C@H](C)C1=CN=CC=C1 P11935 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 N12667 [0,2,0,0,0,0|1,0,0]=3 335 B12R1.34 COC(=O)[C@H](N)C1=NC=CC=C1 O11860 [0,2,0,0,0,0|2,0,0]=4 336 B12R1.34 C[C@@H](C(=O)NN)C1=CC=CC=C1 AC8780 [0,2,0,0,0,0|2,0,0]=4 337 B12R1.124 CC(=O)N(C)C1=C(Br)C=CC=C1 F53216 [0,2,0,0,0,0|1,0,0]=3 338 B12R1.124 CC(=O)[C@H](N)C1=C(Br)C=CC=C1 N15545 [0,2,0,0,0,0|1,0,0]=3 339 B12R1.124 CC(=O)[C@H](N)C1=C(C)C=CC=C1 N15524 [0,2,0,0,0,0|1,0,0]=3 340 B12R1.124 CC(=O)[C@H](N)C1=C(Cl)C=CC=C1 N15542 [0,2,0,0,0,0|1,0,0]=3 341 B12R1.124 CC(=O)[C@H](N)C1=C(F)C=CC=C1 N15536 [0,2,0,0,0,0|1,0,0]=3 342 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 N12290 [0,2,0,0,0,0|2,0,0]=4 343 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 N12294 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 A50300 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 D84116 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.124 O=C(O)[C@H](F)C1=C(F)C=CC=C1 98563 [0,2,0,0,0,0|2,0,0]=4 347 B12R1.225 CC(=O)[C@H](N)C1=CC(N)=CC=C1 N16146 [0,2,0,0,0,0|1,0,0]=3 348 B12R1.225 CC(=O)[C@H](N)C1=CC=CC(Br)=C1 N15613 [0,2,0,0,0,0|1,0,0]=3 349 B12R1.225 CC(=O)[C@H](N)C1=CC=CC(Cl)=C1 N15638 [0,2,0,0,0,0|1,0,0]=3 350 B12R1.225 CC(=O)[C@H](N)C1=CC=CC(F)=C1 N15639 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.225 CC1=CC=CC([C@@H](F)C(=O)O)=C1 98550 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.225 CC1=CC=CC([C@@H](N)C(=O)O)=C1 N12267 [0,2,0,0,0,0|2,0,0]=4 353 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Br)=C1 N10973 [0,2,0,0,0,0|2,0,0]=4 354 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 AC3213 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 AC7657 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 Y11689 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.225 O=C(O)[C@H](F)C1=CC=CC(Br)=C1 98544 [0,2,0,0,0,0|2,0,0]=4 358 B12R1.225 O=C(O)[C@H](F)C1=CC=CC(F)=C1 98545 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.225 O=C(O)[C@H](O)C1=CC(O)=CC=C1 A12143 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(I)=C1 C90764 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.253 CC(=O)C(C)(C)C1=CC=CC=C1 AT22669 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 41030 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.478 CC[C@@H](C(=O)O)C1=CC=CC=C1 91032 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 86645 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 A50497 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 F15100 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.32 CCOC(=O)CC1=CC=NC=C1 31557 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.32 CCOC(=O)NC1=CN=CC=C1 F14111 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.32 CCOC(=O)OC1=NC=CC=C1 F18008 [0,2,0,0,0,0|1,0,0]=3 370 B12R1.32 NCCC(=O)NC1=CC=CC=C1 F21144 [0,2,0,0,0,0|1,0,0]=3 371 B12R1.50 C=CC(=O)NC1=CC=CC(Cl)=C1 N11715 [0,2,0,0,0,0|1,0,1]=4 372 B12R1.50 CCC(=O)CC1=CC=CC(Br)=C1 N14158 [0,2,0,0,0,0|1,0,0]=3 373 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 N14137 [0,2,0,0,0,0|1,0,0]=3 374 B12R1.50 CCC(=O)NC1=NC=CC(Br)=C1 W12878 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.50 CNC(=O)CC1=CC(N)=CC=C1 N10567 [0,2,0,0,0,0|1,0,0]=3 376 B12R1.50 CNC(=O)NC1=NC=CC(F)=C1 96549 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.50 COC(=O)CC1=CC(C)=NC=C1 D87645 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.50 COC(=O)CC1=CC(Cl)=NC=C1 D71961 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.50 COC(=O)CC1=CC=CC(Br)=N1 AT23263 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.50 COC(=O)CC1=NC=CC(Cl)=C1 AT23282 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.194 C=CS(=O)(=O)OC1=CC=CC=C1 S10559 [0,2,0,0,0,0|1,0,1]=4 382 B12R1.371 C=CC(=O)NC1=C(Cl)C=CC=C1 N11716 [0,2,0,0,0,0|1,0,1]=4 383 B12R1.371 CC1=C(O[C@@H](C)CN)C=CC=C1 F50684 [0,2,0,0,0,0|1,0,1]=4 384 B12R1.371 CCC(=O)CC1=C(Br)C=CC=C1 N12602 [0,2,0,0,0,0|1,0,0]=3 385 B12R1.371 CCC(=O)CC1=C(C)C=CC=C1 N14163 [0,2,0,0,0,0|1,0,0]=3 386 B12R1.371 CCC(=O)CC1=C(Cl)C=CC=C1 N14147 [0,2,0,0,0,0|1,0,0]=3 387 B12R1.371 COC(=O)CC1=C(N)C=NC=C1 F17906 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.75 CC(C)OC1=C(CN)C=CC=C1 S10925 [0,2,0,0,0,0|1,0,1]=4 389 B12R1.75 COC1=C(CC(=O)Cl)C=CC=C1 F11411 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.75 COC1=C(NC(C)=S)C=CC=C1 81285 [0,2,0,0,0,0|1,1,0]=4 391 B12R1.75 COC1=CC=CN=C1CC(C)=O F31310 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.127 CC(=O)NC1=C(Br)C=CC(C)=C1 75470 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.127 CC(C)OC1=C(N)C=CC(Br)=C1 53627 [0,2,0,0,0,0|1,0,1]=4 394 B12R1.127 CC(C)OC1=C(N)C=CC(Cl)=C1 95905 [0,2,0,0,0,0|1,0,1]=4 395 B12R1.127 CC1=CC(CC(=O)O)=C(Cl)C=C1 D96279 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.127 NC(=O)CC1=C(Br)C=CC(Cl)=C1 AT11065 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.127 NC(=O)CC1=C(F)C=CC(Br)=C1 92705 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.127 NC1=CC(CC(=O)O)=C(Cl)C=C1 C90866 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.127 O=C(O)CC1=C(O)C=CC(O)=C1 T70932 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.151 C[S@](=N)(=O)CC1=C(F)C=CC=C1 E71970 [0,2,0,0,0,0|2,0,0]=4 401 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 F12500 [0,2,0,0,0,0|1,0,0]=3 402 B12R1.224 CC(=O)NC1=CC=CC(Br)=C1C F18030 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.224 CC(=O)OC1=CN=CC(F)=C1C AC4174 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.224 CC(C)OC1=C(F)C(O)=CC=C1 AT21292 [0,2,0,0,0,0|1,0,1]=4 405 B12R1.224 CC1=C(Br)C=CC=C1CC(=O)O CL9370 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.224 CC1=C(Cl)C=CC=C1CC(=O)O C90794 [0,2,0,0,0,0|2,0,0]=4 407 B12R1.224 NC(=O)CC1=CC=CC(Br)=C1F 92646 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.224 O=C(O)CC1=C(O)C(O)=CC=C1 C78025 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.224 O=C(O)CC1=CC=CC(Br)=C1O 97767 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.1009 CC(=O)CC1=C(Cl)C=CC=C1Cl T71476 [0,2,0,0,0,0|1,0,0]=3 411 B12R1.101 CC(=O)CC1=CC(F)=CC(F)=C1 N14189 [0,2,0,0,0,0|1,0,0]=3 412 B12R1.101 CC(=O)OC1=CC(Br)=CC(Br)=C1 C10439 [0,2,0,0,0,0|0,0,0]=2 413 B12R1.101 CC(=O)OC1=CC(Br)=CC(F)=C1 W13834 [0,2,0,0,0,0|0,0,0]=2 414 B12R1.119 CS(=O)(=O)NC1=CC=CC(Cl)=C1 D87370 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.119 CS(C)(=O)=NC1=CC(O)=CC=C1 AT18481 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.119 C[S@](=N)(=O)CC1=CC(F)=CC=C1 E71969 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.119 C[S@](=N)(=O)CC1=CC=CC(Br)=C1 E72409 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.438 C#CC1=CC=CC(NC(C)=O)=N1 C78582 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.438 CC(=O)NC1=CC(C=O)=CC=C1 A11079 [0,2,0,0,0,0|1,0,0]=3 420 B12R1.438 CC(=O)NC1=CC(CO)=CC=C1 D85913 [0,2,0,0,0,0|1,0,0]=3 421 B12R1.438 COC1=CC=CC(NC(C)=S)=C1 81291 [0,2,0,0,0,0|1,1,0]=4 422 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [1,0,0,1,0,0|0,1,1]=4 423 B10R2.7 C1=CC2=C(C=CO2)C=N1 D74565 [1,0,0,1,0,0|1,0,1]=4 424 B12R2.22 O=C1CC(C2=CN=CC=C2)C1 F53801 [0,0,0,1,0,1|2,0,0]=4 425 B12R2.22 O=C1C[C@@H](C2=CC=CC=C2)N1 76187 [0,0,0,1,0,1|1,0,0]=3 426 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [0,0,0,1,0,1|2,0,0]=4 427 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 F20762 [0,0,0,1,0,1|1,0,1]=4 428 B12R2.24 O=C1CC2=C(C=NC=C2)CN1 86461 [0,0,0,1,0,1|2,0,0]=4 429 B12R2.24 O=C1COC2=C(C=CC=C2)C1 F53084 [0,0,0,1,0,1|0,0,0]=2 430 B12R2.24 O=C1N=CC2=C(C=CC=C2)N1 F15801 [0,0,0,1,0,1|2,0,0]=4 431 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 AC3815 [0,0,0,1,0,1|1,0,0]=3 432 B12R2.24 O=C1NC2=C(C=CC=N2)CO1 AC7037 [0,0,0,1,0,1|2,0,0]=4 433 B12R2.24 O=C1NC2=C(C=CN=C2)CO1 AC5095 [0,0,0,1,0,1|2,0,0]=4 434 B12R2.294 FC1=CC=C(OC2CC2)C=C1 AT21306 [0,1,0,1,0,0|1,0,1]=4 435 B12R2.294 NC1=CC=C(OC2CC2)C=C1 AT11984 [0,1,0,1,0,0|1,0,1]=4 436 B12R2.606 CC1=CC2=C(C=C(Br)C=C2)S1 82307 [0,1,0,1,0,0|1,1,0]=4 437 B12R2.606 CC1=CC2=C(C=C1)N=C(C)O2 AC6304 [0,1,0,1,0,0|1,0,0]=3 438 B12R2.606 CC1=CC2=C(C=C1)NC(=O)O2 AC5672 [0,1,0,1,0,0|1,0,0]=3 439 B12R2.606 CC1=CC2=C(C=C1)SC(=O)N2 O11473 [0,1,0,1,0,0|1,1,0]=4 440 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)O1 D78665 [0,1,0,1,0,0|1,0,0]=3 441 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 AC5757 [0,1,0,1,0,0|1,0,0]=3 442 B12R2.606 CC1=NC2=C(C=C(F)C=C2)O1 AC5868 [0,1,0,1,0,0|1,0,0]=3 443 B12R2.606 CC1=NC2=C(C=C(O)C=C2)O1 A12583 [0,1,0,1,0,0|1,0,0]=3 444 B12R2.606 CC1=NC2=C(C=C(O)C=C2)S1 75571 [0,1,0,1,0,0|1,1,0]=4 445 B12R2.606 FC1=CC2=C(C=C1)N=C(Cl)O2 26691 [0,1,0,1,0,0|2,0,0]=4 446 B12R2.606 NC1=CC2=C(C=C1)OC(N)=N2 AC6531 [0,1,0,1,0,0|2,0,0]=4 447 B12R2.606 NC1=CC2=C(C=C1)OC(S)=N2 AC5706 [0,1,0,1,0,0|1,1,0]=4 448 B12R2.606 O=C1CC2=C(N=CC(O)=C2)N1 P18372 [0,1,0,1,0,0|2,0,0]=4 449 B12R2.606 O=C1CC2=CN=C(Br)C=C2N1 F53787 [0,1,0,1,0,0|2,0,0]=4 450 B12R2.606 O=C1CC2=NC=C(I)C=C2N1 F18536 [0,1,0,1,0,0|2,0,0]=4 451 B12R2.606 O=C1NC2=C(C=CC(F)=C2)S1 C14119 [0,1,0,1,0,0|1,1,0]=4 452 B12R2.606 O=C1NC2=CC(Br)=CN=C2O1 AC2140 [0,1,0,1,0,0|2,0,0]=4 453 B12R2.606 O=C1NC2=CC(Cl)=CN=C2O1 AC3978 [0,1,0,1,0,0|2,0,0]=4 454 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 D77666 [0,1,0,1,0,0|1,0,0]=3 455 B12R2.18 BrC1=C(Br)C2=C(C=CC=C2)O1 95276 [0,1,0,1,0,0|1,0,1]=4 456 B12R2.18 CN1C(=O)NC2=C1C=CC=N2 D72038 [0,1,0,1,0,0|2,0,0]=4 457 B12R2.18 CN1C(=O)NC2=C1C=NC=C2 D72037 [0,1,0,1,0,0|2,0,0]=4 458 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 AC7141 [0,1,0,1,0,0|2,0,0]=4 459 B12R2.18 CN1C(I)=CC2=C1C=CC=C2 Y10946 [0,1,0,1,0,0|2,0,0]=4 460 B12R2.18 CN1C(N)=CC2=C1C=CC=C2 64263 [0,1,0,1,0,0|2,0,0]=4 461 B12R2.18 O=C1OC2=C(C=CC=C2)C1=O AC2209 [0,1,0,1,0,0|0,0,1]=3 462 B12R2.27 O=CC1CC1C2=CC=CC=C2 F52095 [0,1,0,1,0,0|1,0,1]=4 463 B12R2.32 BrCC1=CC2=C(C=CC=C2)O1 AC6096 [0,1,0,1,0,0|1,0,0]=3 464 B12R2.32 ClCC1=CC2=C(C=CC=C2)O1 AC6009 [0,1,0,1,0,0|1,0,0]=3 465 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 AC1020 [0,1,0,1,0,0|2,0,0]=4 466 B12R2.32 NCC1=NC2=C(C=CC=C2)O1 20190 [0,1,0,1,0,0|1,0,0]=3 467 B12R2.32 O=CC1=NC2=C(C=CC=C2)O1 C16106 [0,1,0,1,0,0|1,0,0]=3 468 B12R2.95 O=P1(Cl)OC2=C(C=CC=C2)O1 73936 [0,1,0,1,0,0|2,0,0]=4 469 B12R2.202 CC1=CC2=C(C=CC=C2C)N1 C14038 [0,1,0,1,0,0|2,0,0]=4 470 B12R2.202 CC1=CC2=C(Cl)C=CC=C2N1 24210 [0,1,0,1,0,0|2,0,0]=4 471 B12R2.202 CC1=CC2=CC=CC(Br)=C2N1 AT16060 [0,1,0,1,0,0|2,0,0]=4 472 B12R2.202 CC1=CC2=CC=CC(Br)=C2O1 76396 [0,1,0,1,0,0|1,0,0]=3 473 B12R2.202 CC1=CC2=CC=CC(N)=C2N1 P20352 [0,1,0,1,0,0|2,0,0]=4 474 B12R2.202 CC1=CC=CC2=C1N=C(C)S2 F15163 [0,1,0,1,0,0|1,1,0]=4 475 B12R2.202 CC1=CC=CC2=C1N=C(Cl)O2 AC2652 [0,1,0,1,0,0|2,0,0]=4 476 B12R2.202 CC1=CC=CC2=C1N=C(N)O2 AC7423 [0,1,0,1,0,0|2,0,0]=4 477 B12R2.202 CC1=CC=CC2=C1N=C(S)O2 AC7364 [0,1,0,1,0,0|1,1,0]=4 478 B12R2.202 CC1=CC=CC2=C1NC(=O)O2 AC6817 [0,1,0,1,0,0|1,0,0]=3 479 B12R2.202 CC1=NC2=CC=CC(Cl)=C2O1 AC3595 [0,1,0,1,0,0|1,0,0]=3 480 B12R2.202 CC1=NC2=CC=CC(F)=C2O1 AC3582 [0,1,0,1,0,0|1,0,0]=3 481 B12R2.202 FC1=CC=CC2=C1N=C(S)O2 F51108 [0,1,0,1,0,0|1,1,0]=4 482 B12R2.202 NC1=CC=CC2=C1CC(=O)C2 53595 [0,1,0,1,0,0|1,0,0]=3 483 B12R2.202 NC1=CC=CC2=C1N=C(N)O2 AC4477 [0,1,0,1,0,0|2,0,0]=4 484 B12R2.202 NC1=CC=CC2=C1N=C(S)O2 AC4524 [0,1,0,1,0,0|1,1,0]=4 485 B12R2.202 NC1=CC=CC2=C1NC(=O)O2 C16414 [0,1,0,1,0,0|1,0,0]=3 486 B12R2.202 NC1=NC2=C(F)C=CC=C2O1 AC4839 [0,1,0,1,0,0|2,0,0]=4 487 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 AC6529 [0,1,0,1,0,0|2,0,0]=4 488 B12R2.202 NC1=NC2=CC=CC(F)=C2O1 P12618 [0,1,0,1,0,0|2,0,0]=4 489 B12R2.202 NC1=NC=CC2=C1NC(=O)C2 F12565 [0,1,0,1,0,0|2,0,0]=4 490 B12R2.202 O=C1CC2=CC=CC(I)=C2N1 D76870 [0,1,0,1,0,0|1,0,0]=3 491 B12R2.202 O=C1NC2=C(Br)C=CC=C2O1 C92124 [0,1,0,1,0,0|1,0,0]=3 492 B12R2.202 O=C1NC2=CC=CC(Br)=C2N1 AT12815 [0,1,0,1,0,0|2,0,0]=4 493 B12R2.202 O=C1NC2=CC=CC(Cl)=C2O1 AC6894 [0,1,0,1,0,0|1,0,0]=3 494 B12R2.225 FC1=C(OC2CC2)C=CC=C1 AT21296 [0,1,0,1,0,0|1,0,1]=4 495 B12R2.225 IC1=C(OC2CC2)C=CC=C1 F53780 [0,1,0,1,0,0|1,0,1]=4 496 B8R1.8 O=CCC1=CC=CS1 O10539 [1,0,0,0,1,0|2,0,0]=4 497 B8R1.7 CC(=O)C1=CN=CO1 F19037 [0,0,0,0,2,0|2,0,0]=4 498 B8R1.7 CC(=O)C1=COC=N1 AT18593 [0,0,0,0,2,0|2,0,0]=4 499 B8R1.7 CC(=O)C1=CSN=C1 AT21129 [0,0,0,0,2,0|2,0,0]=4 500 B12R1.252 CC(=O)CCCC1=CN=CC=C1 F53170 [0,0,0,0,0,2|2,0,0]=4 501 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92726 [0,0,0,0,0,2|1,0,1]=4 502 B12R1.252 C[C@H](Br)COCC1=CC=CC=C1 C92727 [0,0,0,0,0,2|1,0,1]=4 503 B12R1.252 NC(=O)CNCC1=CC=CC=C1 F52328 [0,0,0,0,0,2|2,0,0]=4 504 B12R1.252 O=C(O)CC#CC1=CC=CC=C1 AT25408 [0,0,0,0,0,2|2,0,0]=4