0 B11R1.40 CC[C@H](N)CC1=CC=CC=C1 74053 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.40 CNC(=S)NC1=CC=CC=C1 T72207 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.40 C[C@H](C=O)CC1=CC=CC=C1 F16111 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.40 N#CC(=O)CC1=CC=CC=C1 AC5929 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.40 N#C[C@@H](F)SC1=CC=CC=C1 D90673 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14383 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14384 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 N14385 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.40 NNC(=O)CC1=NC=CC=C1 AT10923 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 C78372 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.40 O\N=C(/Cl)CC1=CC=CC=C1 AC6652 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 CCCCC1=CC=CN=N1 O10974 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.17 CNCCC1=CC=CN=C1 C73747 [1,0,0,0,0,0|1,0,0]=2 13 B10R1.17 CNCCC1=CC=NC=C1 AR1715 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.17 CNNCC1=NC=CC=C1 30190 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.17 FCCNC1=CC=CC=C1 D77931 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [1,0,0,0,0,0|1,0,0]=2 17 B10R1.17 NOCCC1=CC=CC=C1 C10179 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.17 OCCCC1=CN=CC=C1 AC5531 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.17 SCCCC1=CN=CC=C1 F18019 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.17 SCCCC1=NC=CC=C1 F18728 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [1,0,0,0,0,0|1,0,0]=2 25 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [1,0,0,0,0,0|1,0,0]=2 27 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [1,0,0,0,0,0|1,0,0]=2 28 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [1,0,0,0,0,0|1,0,0]=2 29 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [1,0,0,0,0,0|1,0,1]=3 31 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [1,0,0,0,0,0|3,0,0]=4 32 B12R1.32 C#CCN(C)CC1=CC=CC=C1 T72610 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.32 CON[C@@H](C)CC1=CC=CC=C1 D79919 [0,1,0,0,0,0|0,0,0]=1 34 B12R1.34 CCC(=O)[C@H](C)C1=CC=CC=C1 F30714 [0,1,0,0,0,0|2,0,1]=4 35 B12R1.34 CC[C@H](C)C(=O)C1=CC=CC=C1 N13974 [0,1,0,0,0,0|1,0,1]=3 36 B12R1.34 CNC(=O)[C@H](O)C1=CC=CC=C1 E72123 [0,1,0,0,0,0|1,0,1]=3 37 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 N12667 [0,1,0,0,0,0|2,0,1]=4 38 B12R1.34 C[C@@H](C(=O)NN)C1=CC=CC=C1 AC8780 [0,1,0,0,0,0|2,0,1]=4 39 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 23172 [0,1,0,0,0,0|3,0,0]=4 40 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 AT23147 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.43 N[C@H]([13CH2]C1=CC=CC=C1)C(=O)O D99537 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.43 [15NH2][C@@H](CC1=CC=CC=C1)C(=O)O 41399 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.49 CC1=CC=C(C[C@H](N)CO)C=C1 C78159 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.49 CC1=CC=C(C[C@H](N)CO)C=C1 C78527 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.49 CCC(=O)CC1=CC=C(Cl)C=C1 N12627 [0,1,0,0,0,0|2,0,1]=4 46 B12R1.49 CCC(=O)CC1=CC=C(I)C=C1 85181 [0,1,0,0,0,0|2,0,1]=4 47 B12R1.49 CC[C@H](N)CC1=CC=C(C)C=C1 N12825 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.49 CC[C@H](N)CC1=CC=C(Cl)C=C1 N14547 [0,1,0,0,0,0|2,0,0]=3 49 B12R1.49 CC[C@H](N)CC1=CC=C(F)C=C1 N14543 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.49 CC[C@H](N)CC1=CC=C(I)C=C1 85182 [0,1,0,0,0,0|2,0,0]=3 51 B12R1.49 CN[C@@H](C)CC1=CC=C(F)C=C1 N12809 [0,1,0,0,0,0|0,0,0]=1 52 B12R1.49 C[C@@H](CN)OC1=CC=C(Cl)C=C1 C77969 [0,1,0,0,0,0|3,0,0]=4 53 B12R1.49 C[C@H](C=O)CC1=CC=C(Cl)C=C1 C76805 [0,1,0,0,0,0|2,0,0]=3 54 B12R1.49 NC1=CC=C(C[C@H](N)CO)C=C1 Y11240 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.49 N[C@H](CO)CC1=CC=C(Br)C=C1 C78517 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 AT10694 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 C78160 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.49 N[C@H](CO)CC1=CC=C(I)C=C1 85183 [0,1,0,0,0,0|3,0,0]=4 59 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 C78266 [0,1,0,0,0,0|3,0,0]=4 60 B12R1.50 CC1=CC=CC(C[C@H](N)CO)=C1 C78461 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.50 CCC(=O)CC1=CC=CC(Br)=C1 N14158 [0,1,0,0,0,0|2,0,1]=4 62 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 N14137 [0,1,0,0,0,0|2,0,1]=4 63 B12R1.50 CC[C@H](N)CC1=CC(C)=CC=C1 N14536 [0,1,0,0,0,0|2,0,0]=3 64 B12R1.50 CC[C@H](N)CC1=CC=CC(Br)=C1 N14532 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.50 CC[C@H](N)CC1=CC=CC(Cl)=C1 N14527 [0,1,0,0,0,0|2,0,0]=3 66 B12R1.50 CC[C@H](N)CC1=CC=CC(F)=C1 N14524 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.50 CNC(=O)CC1=CC(N)=CC=C1 N10567 [0,1,0,0,0,0|1,0,1]=3 68 B12R1.50 CN[C@@H](C)CC1=CC=CC(F)=C1 N12793 [0,1,0,0,0,0|0,0,0]=1 69 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78100 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.50 N[C@H](CO)CC1=CC=CC(Br)=C1 C78242 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 Y11238 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.50 N[C@H](CO)CC1=CC=CC(F)=C1 N11307 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 N12975 [0,1,0,0,0,0|0,0,0]=1 74 B12R1.118 NC[C@@H](CO)CC1=CC=CC=C1 C76076 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.118 NC[C@@H](CO)CC1=CC=NC=C1 C90589 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 C78603 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 N11149 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.371 CC1=C(O[C@@H](C)CN)C=CC=C1 F50684 [0,1,0,0,0,0|3,0,0]=4 79 B12R1.371 CCC(=O)CC1=C(Br)C=CC=C1 N12602 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.371 CCC(=O)CC1=C(C)C=CC=C1 N14163 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.371 CCC(=O)CC1=C(Cl)C=CC=C1 N14147 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.371 CC[C@H](N)CC1=C(Br)C=CC=C1 N14510 [0,1,0,0,0,0|2,0,0]=3 83 B12R1.371 CC[C@H](N)CC1=C(C)C=CC=C1 N14512 [0,1,0,0,0,0|2,0,0]=3 84 B12R1.371 CC[C@H](N)CC1=C(Cl)C=CC=C1 N14502 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.371 CC[C@H](N)CC1=C(F)C=CC=C1 N14507 [0,1,0,0,0,0|2,0,0]=3 86 B12R1.371 NC[C@@H](N)CC1=C(F)C=CC=C1 N14640 [0,1,0,0,0,0|3,0,0]=4 87 B12R1.371 N[C@H](CO)CC1=C(Br)C=CC=C1 C77829 [0,1,0,0,0,0|3,0,0]=4 88 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11299 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11304 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.371 N[C@H](CO)CC1=C(F)C=CC=C1 N11418 [0,1,0,0,0,0|3,0,0]=4 91 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 AC7141 [0,0,0,1,0,0|1,0,2]=4 92 B12R2.18 CN1C(I)=CC2=C1C=CC=C2 Y10946 [0,0,0,1,0,0|1,0,2]=4 93 B12R2.18 CN1C(N)=CC2=C1C=CC=C2 64263 [0,0,0,1,0,0|1,0,2]=4 94 B12R2.18 N[C@H]1CC2=C(C=CC=C2)C1=O 66097 [0,0,0,1,0,0|3,0,0]=4 95 B12R2.24 Br[C@H]1CCC2=C(C=CC=C2)C1 F13406 [0,0,0,1,0,0|2,0,0]=3 96 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [0,0,0,1,0,0|0,0,2]=3 97 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)C1 F50994 [0,0,0,1,0,0|2,0,0]=3 98 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 12711 [0,0,0,1,0,0|0,0,0]=1 99 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 C74526 [0,0,0,1,0,0|0,0,0]=1 100 B12R2.24 C[C@H]1CSC2=C(C=CC=C2)N1 W10084 [0,0,0,1,0,0|3,0,0]=4 101 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 F20762 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F13193 [0,0,0,1,0,0|2,0,0]=3 103 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18883 [0,0,0,1,0,0|2,0,0]=3 104 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18889 [0,0,0,1,0,0|2,0,0]=3 105 B12R2.24 O=C1CC2=C(C=NC=C2)CN1 86461 [0,0,0,1,0,0|2,0,1]=4 106 B12R2.24 O[C@H]1CCC2=C(C=CC=N2)C1 D78688 [0,0,0,1,0,0|3,0,0]=4 107 B12R2.27 BrC[C@@H]1C[C@@H]1C2=CC=CC=C2 55233 [0,0,0,1,0,0|2,0,0]=3 108 B12R2.27 BrC[C@H]1C[C@@H]1C2=CC=CC=C2 55239 [0,0,0,1,0,0|2,0,0]=3 109 B12R2.27 O=CC1CC1C2=CC=CC=C2 F52095 [0,0,0,1,0,0|2,0,0]=3 110 B12R2.27 OCC1CC1C2=NC=CC=C2 91729 [0,0,0,1,0,0|3,0,0]=4 111 B12R2.27 OC[C@H]1C[C@@H]1C2=NC=CC=C2 91718 [0,0,0,1,0,0|3,0,0]=4 112 B12R2.32 CNC1CC2=C(C=CC=C2)C1 D86972 [0,0,0,1,0,0|0,0,0]=1 113 B12R2.94 NC1(CC2=CC=CC=C2)CC1 D74695 [0,0,0,1,0,0|2,0,0]=3 114 B10R1.15 CCN(C)C1=NC=CC=C1 T72928 [0,0,0,0,1,0|3,0,0]=4 115 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [0,0,0,0,1,0|2,0,0]=3 116 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [0,0,0,0,1,0|3,0,0]=4 117 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [0,0,0,0,1,0|0,0,0]=1 118 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [0,0,0,0,1,0|2,0,1]=4 119 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [0,0,0,0,1,0|2,0,0]=3 120 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [0,0,0,0,1,0|1,0,0]=2 122 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [0,0,0,0,1,0|1,0,0]=2 123 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [0,0,0,0,1,0|2,0,0]=3 124 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [0,0,0,0,1,0|2,0,0]=3 125 B12R1.27 C[C@@H](C=O)OCC1=CC=CC=C1 C10570 [0,0,0,0,0,1|2,0,0]=3 126 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 AT22580 [0,0,0,0,0,1|2,0,0]=3 127 B9R1.8 BrCCC1=CN=CC=C1 C77647 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.8 CCCC1=CC=CN=C1 O11051 [2,0,0,0,0,0|1,0,0]=3 129 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [2,0,0,0,0,0|1,0,0]=3 130 B9R1.8 CNCC1=CN=CN=C1 38577 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.8 CNCC1=NC=CC=N1 27199 [2,0,0,0,0,0|2,0,0]=4 132 B9R1.8 CNCC1=NC=CC=N1 72796 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.8 CNCC1=NC=NC=C1 C14477 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.8 CNNC1=CC=CC=C1 C77159 [2,0,0,0,0,0|1,0,0]=3 135 B9R1.8 FCCC1=CC=CC=C1 75534 [2,0,0,0,0,0|1,0,0]=3 136 B9R1.8 NCCC1=CC=CC=C1 T71816 [2,0,0,0,0,0|0,0,0]=2 137 B9R1.8 NCCC1=CC=CC=C1 T72591 [2,0,0,0,0,0|0,0,0]=2 138 B9R1.8 NCCC1=NC=CC=N1 83201 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.8 NCCC1=NC=CC=N1 P10852 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.8 NCCC1=NC=CN=C1 AT22557 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.8 NCCC1=NC=NC=C1 P10950 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.8 NNCC1=NC=CC=C1 P10521 [2,0,0,0,0,0|2,0,0]=4 143 B9R1.8 OCCC1=CC=NC=C1 T72404 [2,0,0,0,0,0|2,0,0]=4 144 B9R1.8 SCCC1=NC=CC=C1 F18309 [2,0,0,0,0,0|2,0,0]=4 145 B11R1.1 CC1=CC=C(CCCN)C=C1 C78299 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.1 CNCCC1=CC=C(Br)C=C1 C78422 [1,1,0,0,0,0|0,0,0]=2 147 B11R1.1 CNCCC1=CC=C(C)C=C1 C78074 [1,1,0,0,0,0|0,0,0]=2 148 B11R1.1 CNCCC1=NC=C(Br)C=N1 AT18381 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.1 COCCC1=CC=C(Br)C=C1 28244 [1,1,0,0,0,0|1,0,0]=3 150 B11R1.1 COCCC1=CC=C(N)C=C1 F11764 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.1 CONCC1=CC=C(Br)C=C1 N11596 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.1 ClC1=CC=C(CCCBr)C=C1 S11935 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.1 N#CCCC1=CC=C(O)C=C1 C15091 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.1 NCCCC1=CC=C(N)C=C1 C78351 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.16 C#CC[C@H](O)C1=CC=CC=C1 W15219 [1,1,0,0,0,0|1,0,1]=4 156 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 N12265 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.16 CNC[C@H](C)C1=CC=CC=C1 C11240 [1,1,0,0,0,0|0,0,0]=2 158 B11R1.16 CNC[C@H](O)C1=CC=CC=C1 C11214 [1,1,0,0,0,0|0,0,0]=2 159 B11R1.16 COC[C@H](N)C1=CC=CC=C1 AC6537 [1,1,0,0,0,0|1,0,0]=3 160 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14729 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.16 NCC[C@H](N)C1=CC=CC=C1 N14730 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.16 OCC[C@H](O)C1=CC=CC=C1 C80043 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.17 BrCCCC1=C(Br)C=CC=C1 C77748 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.17 CCCOC1=C(N)C=CC=C1 AC7746 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.17 CCNCC1=C(Cl)C=CC=C1 C16114 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.17 CNCCC1=C(C)C=CC=C1 C78447 [1,1,0,0,0,0|0,0,0]=2 167 B11R1.17 CNCCC1=C(Cl)C=CC=C1 C78279 [1,1,0,0,0,0|0,0,0]=2 168 B11R1.17 ClC1=C(CCCBr)C=CC=C1 C78298 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.17 NCCCC1=C(Cl)C=CC=C1 C78000 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.17 NCCCC1=C(F)C=CC=C1 F20045 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.24 BrCCCC1=CC=CC(Br)=C1 C77758 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.24 CC1=CC=CC(CCC=O)=C1 C10532 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 C93515 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.24 CCOCC1=CC=CC(Br)=C1 F17773 [1,1,0,0,0,0|2,0,0]=4 175 B11R1.24 CNCCC1=CC=CC(Br)=C1 C78466 [1,1,0,0,0,0|0,0,0]=2 176 B11R1.24 COCCC1=CC(N)=NC=C1 AT18204 [1,1,0,0,0,0|2,0,0]=4 177 B11R1.24 ClC1=CC=CC(CCCBr)=C1 C78574 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.24 N#CCCC1=CC=CC(F)=C1 97618 [1,1,0,0,0,0|2,0,0]=4 179 B11R1.24 NCCCC1=CC=CC(F)=C1 97619 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.24 NCCCC1=CC=CC(N)=C1 C78147 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.24 NCCCC1=CC=CC(O)=C1 C78310 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.24 O=CCCC1=CC(O)=CC=C1 F19734 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.24 [C-]#[N+]CCC1=CC=CC(F)=C1 50335 [1,1,0,0,0,0|0,0,2]=4 184 B11R1.28 CCCCNC1=CC=NC=C1 F21501 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [1,1,0,0,0,0|0,0,0]=2 186 B11R1.28 NNCCOC1=CC=CC=C1 AC4849 [1,1,0,0,0,0|1,0,0]=3 187 B11R1.28 NOCCOC1=CC=CC=C1 AT21707 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.28 OCCCCC1=CC=NC=C1 31475 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.91 CC(=O)CCC1=CC=NC=C1 AT24518 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12753 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.91 C[C@H](N)COC1=CC=CC=C1 N12763 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.91 C[C@H](N)CSC1=CC=CC=C1 AT26670 [1,1,0,0,0,0|2,0,0]=4 193 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [1,1,0,0,0,0|0,0,0]=2 194 B11R1.20 CN(C)CC1=CN=C(Cl)C=C1 D76265 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.20 CN(C)CC1=CN=C(N)C=C1 N12638 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [1,1,0,0,0,0|0,0,0]=2 197 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [1,1,0,0,0,0|0,0,0]=2 198 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [1,1,0,0,0,0|0,0,0]=2 199 B11R1.36 C=C(C1=CC=CC=C1)C(C)C W11468 [1,1,0,0,0,0|0,0,1]=3 200 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N15518 [1,1,0,0,0,0|1,0,1]=4 201 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 N12821 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.36 CC(C)[C@H](N)C1=CC=CN=C1 74043 [1,1,0,0,0,0|1,0,0]=3 203 B11R1.36 CC(C)[C@H](N)C1=NC=CC=C1 Y10672 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.36 CC(C)[C@H](O)C1=CN=CC=C1 AC2743 [1,1,0,0,0,0|1,0,0]=3 205 B11R1.36 CC(O)C(N)C1=CC=CC=C1 N11175 [1,1,0,0,0,0|1,0,0]=3 206 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Y13368 [1,1,0,0,0,0|1,0,0]=3 207 B11R1.36 CC(O)[C@H](N)C1=CC=CC=C1 N15517 [1,1,0,0,0,0|1,0,0]=3 208 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15522 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.36 C[C@H](N)C(=O)C1=CC=CC=C1 F13376 [1,1,0,0,0,0|0,0,1]=3 210 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 N15519 [1,1,0,0,0,0|1,0,0]=3 211 B11R1.36 N[C@H](C1=CC=CC=C1)C(F)F 94363 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21493 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.86 CC(C)CC1=NC=CN=C1O 43967 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [1,1,0,0,0,0|1,0,0]=3 215 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.86 CC(C)OC1=C(I)C=CC=N1 76901 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [1,1,0,0,0,0|0,0,0]=2 221 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [1,1,0,0,0,0|0,0,0]=2 222 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [1,1,0,0,0,0|0,0,0]=2 223 B11R1.86 C[C@H](O)CC1=C(Br)C=NC=C1 AT12941 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.157 CC(=O)CC1=CC(C)=CC=C1 N12785 [1,1,0,0,0,0|1,0,1]=4 225 B11R1.157 CC(C)CC1=CC=CC(N)=C1 O11024 [1,1,0,0,0,0|0,0,0]=2 226 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 C77831 [1,1,0,0,0,0|1,0,0]=3 227 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 C78133 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.157 CC(C)NC1=NC=CC(N)=C1 F19784 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.157 CC(C)OC1=CC(Br)=CN=C1 F19749 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.157 CC(C)OC1=NC=CC(N)=C1 AT18134 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.157 CC1=CC=CC(C[C@H](C)N)=C1 N11054 [1,1,0,0,0,0|0,0,0]=2 232 B11R1.157 C[C@H](N)CC1=CC=CC(Br)=C1 E72139 [1,1,0,0,0,0|0,0,0]=2 233 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 83690 [1,1,0,0,0,0|0,0,0]=2 234 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 N11066 [1,1,0,0,0,0|0,0,0]=2 235 B11R1.157 C[C@H](N)CC1=CC=CC(F)=C1 N10878 [1,1,0,0,0,0|0,0,0]=2 236 B11R1.157 C[S@](=O)CC1=CC(N)=CC=C1 AT15220 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.509 CC(C)(Cl)CC1=CC=CC=C1 AC4724 [1,1,0,0,0,0|0,0,0]=2 238 B11R1.509 C[Si](C)(C)SC1=CC=CC=C1 D76934 [1,1,0,0,0,0|1,1,0]=4 239 B11R1.509 [2H]C([2H])([2H])CC1=CC=CC=C1 D99355 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 AT22663 [0,1,0,0,1,0|2,0,0]=4 241 B11R1.7 CC(C)(CBr)C1=CC=CC=C1 D78707 [0,1,0,0,1,0|2,0,0]=4 242 B11R1.7 C[C@@](N)(C#N)C1=CC=CC=C1 AC6143 [0,1,0,0,1,0|2,0,0]=4 243 B11R1.7 C[C@](N)(CO)C1=CC=CC=C1 N12768 [0,1,0,0,1,0|2,0,0]=4 244 B11R1.12 CCC(CC)C1=CC=CC=C1 T71625 [0,1,0,0,1,0|1,0,0]=3 245 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 N12976 [0,1,0,0,1,0|0,0,0]=2 246 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [0,1,0,0,1,0|1,0,0]=3 247 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [0,1,0,0,1,0|2,0,0]=4 248 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [0,1,0,0,1,0|0,0,0]=2 249 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [0,1,0,0,1,0|0,0,0]=2 250 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [0,1,0,0,1,0|1,0,0]=3 251 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [0,1,0,0,1,0|2,0,0]=4 252 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [0,1,0,0,1,0|2,0,0]=4 253 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [0,1,0,0,1,0|2,0,0]=4 254 B11R1.23 CC[C@H](O)C1=CC(C)=CC=C1 N14416 [0,1,0,0,1,0|2,0,0]=4 255 B11R1.23 CC[C@H](O)C1=CC=CC(Br)=C1 N12527 [0,1,0,0,1,0|2,0,0]=4 256 B11R1.23 CC[C@H](O)C1=CC=CC(Cl)=C1 N12311 [0,1,0,0,1,0|2,0,0]=4 257 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 N12243 [0,1,0,0,1,0|0,0,0]=2 258 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,1,0,0,1,0|1,0,0]=3 259 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,1,0,0,1,0|2,0,0]=4 260 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,1,0,0,1,0|2,0,0]=4 261 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,1,0,0,1,0|2,0,0]=4 262 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,1,0,0,1,0|2,0,0]=4 263 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [0,1,0,0,1,0|1,0,1]=4 264 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,1,0,0,1,0|0,0,0]=2 265 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,1,0,0,1,0|0,0,0]=2 266 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,1,0,0,1,0|0,0,0]=2 267 B13R1.42 CCC[C@H](O)CCC1=CC=CC=C1 F19746 [0,1,0,0,0,1|2,0,0]=4 268 B13R1.254 C#CC(C)(C)OCC1=CC=CC=C1 70201 [0,1,0,0,0,1|1,0,1]=4 269 B13R1.254 CC(C)(CO)NCC1=CC=CC=C1 C14021 [0,1,0,0,0,1|2,0,0]=4 270 B13R1.254 CC(C)(CO)NCC1=CC=CC=C1 Y10251 [0,1,0,0,0,1|2,0,0]=4 271 B13R1.254 CC(C)(CO)OCC1=CC=CC=C1 AC7256 [0,1,0,0,0,1|2,0,0]=4 272 B13R1.351 C[C@H](O)[C@H](C)OCC1=CC=CC=C1 P19299 [0,1,0,0,0,1|1,0,0]=3 273 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O C12171 [0,1,0,0,0,1|2,0,0]=4 274 B13R1.417 CCC(CC)NCC1=CC=CC=C1 79980 [0,1,0,0,0,1|1,0,0]=3 275 B13R1.417 CCN(CC)CCC1=CC=CC=C1 F12469 [0,1,0,0,0,1|2,0,0]=4 276 B13R1.417 CC[C@@H](CO)NCC1=CC=CC=C1 AT20438 [0,1,0,0,0,1|1,0,0]=3 277 B13R1.417 CC[C@@H](CO)NCC1=CC=CC=C1 AT20477 [0,1,0,0,0,1|1,0,0]=3 278 B13R1.417 COC(CNC1=CC=CC=C1)OC H10179 [0,1,0,0,0,1|1,0,0]=3 279 B13R1.528 CNC(=O)CCC1=C(Br)C=CC=C1 W10434 [0,1,0,0,0,1|1,0,1]=4 280 B13R1.528 CNC(=O)COC1=C(Br)C=CC=C1 F13304 [0,1,0,0,0,1|1,0,1]=4 281 B13R1.19 CCC[C@H](N)CC1=CC=C(C)C=C1 N14551 [0,2,0,0,0,0|2,0,0]=4 282 B13R1.19 CCC[C@H](N)CC1=CC=C(Cl)C=C1 N14548 [0,2,0,0,0,0|2,0,0]=4 283 B13R1.19 CCC[C@H](N)CC1=CC=C(F)C=C1 N14544 [0,2,0,0,0,0|2,0,0]=4 284 B13R1.20 CCC[C@H](N)CC1=CC(C)=CC=C1 N14537 [0,2,0,0,0,0|2,0,0]=4 285 B13R1.20 CCC[C@H](N)CC1=CC=CC(Br)=C1 N14533 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.20 CCC[C@H](N)CC1=CC=CC(Cl)=C1 N14528 [0,2,0,0,0,0|2,0,0]=4 287 B13R1.20 CCC[C@H](N)CC1=CC=CC(F)=C1 N14525 [0,2,0,0,0,0|2,0,0]=4 288 B13R1.44 O=C(CC1=CC=CC=C1)NCCO W12293 [0,2,0,0,0,0|1,0,1]=4 289 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 53133 [0,2,0,0,0,0|1,0,0]=3 290 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 AT22332 [0,2,0,0,0,0|1,0,0]=3 291 B13R1.348 CN(C)C[C@@H](N)CC1=CC=CC=C1 C78125 [0,2,0,0,0,0|1,0,0]=3 292 B13R1.470 CCC[C@H](N)CC1=C(Br)C=CC=C1 N14511 [0,2,0,0,0,0|2,0,0]=4 293 B13R1.470 CCC[C@H](N)CC1=C(C)C=CC=C1 N14513 [0,2,0,0,0,0|2,0,0]=4 294 B13R1.470 CCC[C@H](N)CC1=C(Cl)C=CC=C1 N14501 [0,2,0,0,0,0|2,0,0]=4 295 B13R1.470 CCC[C@H](N)CC1=C(F)C=CC=C1 N14506 [0,2,0,0,0,0|2,0,0]=4 296 B13R1.133 CC(C)[C@@H](N)CC1=CC=C(Cl)C=C1 N12824 [0,2,0,0,0,0|2,0,0]=4 297 B13R1.133 CC(C)[C@@H](N)CC1=CC=C(F)C=C1 N12963 [0,2,0,0,0,0|2,0,0]=4 298 B13R1.133 CC1=CC=C(C[C@H](N)C(C)C)C=C1 N14553 [0,2,0,0,0,0|2,0,0]=4 299 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Br)=C1 N14534 [0,2,0,0,0,0|2,0,0]=4 300 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(Cl)=C1 N14530 [0,2,0,0,0,0|2,0,0]=4 301 B13R1.148 CC(C)[C@@H](N)CC1=CC=CC(F)=C1 N14523 [0,2,0,0,0,0|2,0,0]=4 302 B13R1.148 C[C@@H](CC1=CC=CC(Br)=C1)C(=O)O 91423 [0,2,0,0,0,0|2,0,0]=4 303 B13R1.202 CC(C)[C@@H](N)CC1=C(Br)C=CC=C1 N14509 [0,2,0,0,0,0|2,0,0]=4 304 B13R1.202 CC(C)[C@@H](N)CC1=C(Cl)C=CC=C1 N14498 [0,2,0,0,0,0|2,0,0]=4 305 B13R1.202 CC(C)[C@@H](N)CC1=C(F)C=CC=C1 N14504 [0,2,0,0,0,0|2,0,0]=4 306 B13R1.202 CC1=C(C[C@H](N)C(C)C)C=CC=C1 N14515 [0,2,0,0,0,0|2,0,0]=4 307 B13R1.418 CN(C)[C@H](CN)CC1=CC=CC=C1 89711 [0,2,0,0,0,0|0,0,0]=2 308 B13R1.418 CN(C)[C@H](CN)CC1=CC=CC=C1 89712 [0,2,0,0,0,0|0,0,0]=2 309 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O F10940 [0,2,0,0,0,0|0,0,1]=3 310 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O 29553 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.418 O=C(O)[C@H](CO)CC1=CC=CC=C1 87874 [0,2,0,0,0,0|2,0,0]=4 312 B13R1.5 CC[C@H](N)CC1=CC=C(OC)C=C1 N14555 [0,2,0,0,0,0|2,0,0]=4 313 B13R1.145 CCN(CC)CC1=CC=C(Br)C=C1 N10154 [0,2,0,0,0,0|2,0,0]=4 314 B13R1.145 ClC1=CC=C(CC(CBr)CBr)C=C1 F30486 [0,2,0,0,0,0|2,0,0]=4 315 B13R1.145 OCC(CO)CC1=CC=C(Cl)C=C1 F30485 [0,2,0,0,0,0|2,0,0]=4 316 B13R1.2679 CC[C@H](N)CC1=C(F)C=C(F)C=C1 N14564 [0,2,0,0,0,0|2,0,0]=4 317 B13R1.81 CC[C@H](N)CC1=CC=CC(OC)=C1 N14539 [0,2,0,0,0,0|2,0,0]=4 318 B13R1.146 CCN(CC)CC1=CC=CC(Br)=C1 N10201 [0,2,0,0,0,0|2,0,0]=4 319 B13R1.335 CCN(CC)CC1=C(Br)C=CC=C1 N10121 [0,2,0,0,0,0|2,0,0]=4 320 B13R1.335 COC(CC1=C(N)C=CC=C1)OC H11772 [0,2,0,0,0,0|1,0,0]=3 321 B13R1.91 CC[C@H](N)CC1=C(OC)C=CC=C1 N14517 [0,2,0,0,0,0|2,0,0]=4 322 B13R1.91 CN[C@@H](C)CC1=C(OC)C=CC=C1 N10866 [0,2,0,0,0,0|0,0,0]=2 323 B13R1.4928 CC[C@H](N)CC1=C(Cl)C=CC=C1Cl N14578 [0,2,0,0,0,0|2,0,0]=4 324 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [1,0,0,1,0,0|2,0,0]=4 325 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [1,0,0,1,0,0|2,0,0]=4 326 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 C14923 [1,0,0,1,0,0|2,0,0]=4 327 B11R2.20 C1=CN=C2CNCCC2=C1 P10652 [1,0,0,1,0,0|1,0,0]=3 328 B11R2.20 C1=NC=C2CCNCC2=N1 P19161 [1,0,0,1,0,0|2,0,0]=4 329 B11R2.239 C1=CC(C2CNC2)=NC=N1 74669 [1,0,0,1,0,0|2,0,0]=4 330 B11R2.239 C1=CC=C(C2CCC2)C=C1 F52090 [1,0,0,1,0,0|1,0,0]=3 331 B11R2.239 C1=CC=C([C@@H]2CCN2)C=C1 A50749 [1,0,0,1,0,0|2,0,0]=4 332 B11R2.239 C1=CN=C(C2CNC2)C=C1 F31095 [1,0,0,1,0,0|1,0,0]=3 333 B11R2.988 NC[C@H]1CC2=C1C=CC=C2 AT20374 [1,0,0,1,0,0|2,0,0]=4 334 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 67862 [1,0,0,1,0,0|2,0,0]=4 335 B11R2.10 N=C1CC2=C(C=CC=C2)N1 30671 [1,0,0,1,0,0|1,0,1]=4 336 B11R2.36 C[C@H]1CC2=C(C=CN2)CN1 96833 [0,0,0,1,1,0|1,0,0]=3 337 B11R2.36 C[C@H]1CC2=C(C=CN2)CN1 96834 [0,0,0,1,1,0|1,0,0]=3 338 B11R2.36 C[C@H]1CN2C=CN=C2CN1 C90717 [0,0,0,1,1,0|2,0,0]=4 339 B11R2.36 C[C@H]1CN2C=CN=C2CN1 C90719 [0,0,0,1,1,0|2,0,0]=4 340 B13R2.10 CC1CNC(C2=CC=CC=C2)C1 AT22579 [0,0,0,1,0,1|2,0,0]=4 341 B13R2.32 CN1C(=O)CNC2=C1C=CC=C2 D76287 [0,0,0,1,0,1|1,0,1]=4 342 B13R2.32 C[C@H]1COC2=C(C=CC=C2)C1=O N13022 [0,0,0,1,0,1|2,0,0]=4 343 B13R2.52 CNC1CC(C2=CC=CN=C2)C1 F53680 [0,0,0,1,0,1|1,0,0]=3 344 B13R2.52 CNC1CC(C2=CC=NC=C2)C1 F53670 [0,0,0,1,0,1|1,0,0]=3 345 B13R2.57 CN[C@@H]1CNC2=C(C=CC=C2)C1 C13061 [0,0,0,1,0,1|0,0,0]=2 346 B13R2.57 NC[C@@H]1COC2=C(C=CC=C2)C1 85682 [0,0,0,1,0,1|2,0,0]=4 347 B13R2.57 NC[C@H]1CC2=C(C=CC=C2)CN1 F13533 [0,0,0,1,0,1|2,0,0]=4 348 B13R2.57 NC[C@H]1CC2=C(C=CC=C2)CO1 AC5741 [0,0,0,1,0,1|2,0,0]=4 349 B13R2.57 NN[C@H]1CCC2=C(C=CC=C2)C1 D87945 [0,0,0,1,0,1|1,0,0]=3 350 B13R2.2383 C1=CC=C(CNC2COC2)C=C1 CS1296 [0,0,0,1,0,1|2,0,0]=4 351 B13R2.3203 CC1(CCC2=CC=CC=C2)N=N1 C92244 [0,0,0,1,0,1|1,0,1]=4 352 B13R2.15 O[C@@H]1CCN[C@@H]1C2=CC=CC=C2 AT11756 [0,1,0,1,0,0|2,0,0]=4 353 B13R2.15 O[C@H]1CNC[C@@H]1C2=CC=CC=C2 AT21595 [0,1,0,1,0,0|1,0,0]=3 354 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 30361 [0,1,0,1,0,0|2,0,0]=4 355 B13R2.64 C1=CC(O[C@H]2CCNC2)=CC=N1 AB10388 [0,1,0,1,0,0|2,0,0]=4 356 B13R2.64 C1=CC=C(CN2C=CCC2)C=C1 C16282 [0,1,0,1,0,0|2,0,0]=4 357 B13R2.64 C1=CC=C(O[C@H]2CCNC2)C=C1 A10132 [0,1,0,1,0,0|1,0,0]=3 358 B13R2.64 C1=CN=C(O[C@H]2CCNC2)C=C1 C77811 [0,1,0,1,0,0|2,0,0]=4 359 B13R2.135 CN[C@@H]1C2=C(C=CC=C2)C[C@@H]1O F50027 [0,1,0,1,0,0|1,0,0]=3 360 B13R2.163 CN1CCNC2=C(C=CC=C2)C1 F53503 [0,1,0,1,0,0|2,0,0]=4 361 B13R2.221 CC1(OC2=CC=CC=C2)CNC1 A50766 [0,1,0,1,0,0|1,0,0]=3 362 B13R2.221 NC1(CC2=CC=CC=C2)CCC1 59756 [0,1,0,1,0,0|1,0,0]=3 363 B13R2.221 NC1(CC2=CC=CC=C2)CCC1 F14473 [0,1,0,1,0,0|1,0,0]=3 364 B13R2.221 OC1(CC2=CC=CC=C2)CNC1 P19290 [0,1,0,1,0,0|1,0,0]=3 365 B13R2.328 N[C@H]1CC2=C(C=CC=C2)N(O)C1 W17569 [0,1,0,1,0,0|2,0,0]=4 366 B13R2.3085 CN1C(=O)[C@@H](N)C2=C1C=CC=C2 W10171 [0,1,0,1,0,0|1,0,1]=4 367 B13R2.8137 N[C@H](C1=CC=CC=C1)C2CCC2 FD10505 [0,1,0,1,0,0|1,0,0]=3 368 B13R2.8137 N[C@H](C1=CC=CC=C1)C2COC2 98585 [0,1,0,1,0,0|2,0,0]=4 369 B13R2.8137 N[C@H](C1=CC=CC=C1)C2COC2 98586 [0,1,0,1,0,0|2,0,0]=4 370 B13R2.8137 O[C@H](C1=CC=CC=C1)C2CCC2 AT10653 [0,1,0,1,0,0|1,0,0]=3 371 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 P18907 [0,1,0,1,0,0|2,0,0]=4 372 B13R2.423 O=[N+]([O-])[C@H]1CC1C2=CC=CC=C2 P14853 [0,1,0,1,0,0|1,0,1]=4 373 B13R2.1069 FC1=CC=C(CC2CNC2)C=C1 P10690 [0,1,0,1,0,0|2,0,0]=4 374 B13R2.3028 CC1=CC2=C(C=C1)C[C@H](C)C2=O N12932 [0,1,0,1,0,0|2,0,0]=4 375 B13R2.3028 CC1=NC2=C(C=C(Br)C=C2)N1C 51668 [0,1,0,1,0,0|1,0,1]=4 376 B13R2.3683 CN1CCC2=C(C=CC(Br)=C2)C1 98419 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.3683 C[C@H]1CC2=C(C=C(Br)C=C2)CN1 AT22658 [0,1,0,1,0,0|0,0,0]=2 378 B13R2.3683 C[C@H]1CC2=C(C=C(O)C=C2)CN1 96725 [0,1,0,1,0,0|0,0,0]=2 379 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51483 [0,1,0,1,0,0|2,0,0]=4 380 B13R2.3683 C[C@H]1CCC2=C(C=CC(F)=C2)N1 51485 [0,1,0,1,0,0|2,0,0]=4 381 B13R2.54 CCN1CC2=CC=CC(Br)=C2C1 AB10130 [0,1,0,1,0,0|2,0,0]=4 382 B13R2.155 C[C@H]1CC2=C(C=CC(F)=C2)CN1 AT19622 [0,1,0,1,0,0|0,0,0]=2 383 B13R2.155 C[C@H]1CC2=C(C=CC(N)=C2)CN1 F13589 [0,1,0,1,0,0|0,0,0]=2 384 B13R2.155 C[C@H]1CCC2=C(C=C(Br)C=C2)O1 94713 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.155 NC1=CC2=C(C=C1)CC[C@H](O)C2 94668 [0,1,0,1,0,0|2,0,0]=4 386 B13R2.155 O[C@H]1CCC2=C(C=C(Br)C=C2)C1 94667 [0,1,0,1,0,0|2,0,0]=4 387 B13R2.4856 CC1=C2C(=O)[C@@H](C)CC2=CC=C1 N14233 [0,1,0,1,0,0|2,0,0]=4 388 B13R2.4856 CC1=NC2=CC=CC(Cl)=C2N1C 91611 [0,1,0,1,0,0|1,0,1]=4 389 B13R2.4856 C[C@H]1CC2=CC=CC(Br)=C2C1=O N14230 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.4856 C[C@H]1CC2=CC=CC(Cl)=C2C1=O N14229 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.4856 C[C@H]1CC2=CC=CC(F)=C2C1=O N14228 [0,1,0,1,0,0|2,0,0]=4 392 B13R2.5190 CC1=CC2=C(C=C1)C(=O)[C@@H](C)C2 N14232 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.5190 CC1=CC2=C(C=CC(N)=C2)N1C 96065 [0,1,0,1,0,0|0,0,2]=4 394 B13R2.5190 C[C@H]1CC2=C(C=CC(Cl)=C2)C1=O N13213 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.222 CC1(C)CCC2=C(C=CC=C2)N1 AT10904 [0,1,0,1,0,0|2,0,0]=4 396 B13R2.222 CC1(C)CCC2=C(C=CC=C2)N1 C13569 [0,1,0,1,0,0|2,0,0]=4 397 B13R2.222 CC1(C)CCC2=C(C=CC=C2)O1 F30281 [0,1,0,1,0,0|2,0,0]=4 398 B13R2.222 CC1(C)NC2=C(C=CC=C2)CO1 60166 [0,1,0,1,0,0|2,0,0]=4 399 B13R2.4825 CC1=CC=CC2=C1C[C@H](C)C2=O N14231 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.4825 CC1=NC2=C(Br)C=CC=C2N1C D75896 [0,1,0,1,0,0|1,0,1]=4 401 B13R2.4825 C[C@H]1CC2=C(Cl)C=CC=C2C1=O N13055 [0,1,0,1,0,0|2,0,0]=4 402 B13R2.4825 C[C@H]1CC2=C(F)C=CC=C2C1=O N14227 [0,1,0,1,0,0|2,0,0]=4 403 B9R1.12 CNCCC1=CC=CS1 AT16732 [1,0,0,0,1,0|1,0,0]=3 404 B9R1.12 CNCCC1=CN=CN1 D86292 [1,0,0,0,1,0|2,0,0]=4 405 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,0,0,0,1,0|2,0,0]=4 406 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,0,0,0,1,0|1,0,0]=3 407 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,0,0,0,1,0|1,0,0]=3 408 B9R1.6 C[C@H](N)C1=CN=CN=C1 P14618 [1,0,0,0,1,0|2,0,0]=4 409 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,0,0,0,1,0|1,0,0]=3 410 B9R1.6 C[C@H](N)C1=NC=CC=N1 72045 [1,0,0,0,1,0|2,0,0]=4 411 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93141 [1,0,0,0,1,0|2,0,0]=4 412 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93144 [1,0,0,0,1,0|2,0,0]=4 413 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [1,0,0,0,1,0|2,0,0]=4 414 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [1,0,0,0,1,0|2,0,0]=4 415 B9R1.13 C[C@H](N)CC1=COC=C1 89732 [1,0,0,0,1,0|1,0,0]=3 416 B9R1.13 C[C@H](N)CC1=COC=C1 89733 [1,0,0,0,1,0|1,0,0]=3 417 B9R1.13 C[C@H](N)CC1=COC=C1 89734 [1,0,0,0,1,0|1,0,0]=3 418 B9R1.13 C[C@H](N)CC1=CSC=C1 89730 [1,0,0,0,1,0|1,0,0]=3 419 B9R1.13 C[C@H](N)CC1=NNC=C1 I11135 [1,0,0,0,1,0|2,0,0]=4 420 B9R1.13 C[C@H](O)CC1=CC=CO1 W11911 [1,0,0,0,1,0|2,0,0]=4 421 B9R1.13 C[C@H](O)CC1=CSC=C1 58210 [1,0,0,0,1,0|2,0,0]=4 422 B9R1.13 C[C@H](O)CC1=CSC=C1 58214 [1,0,0,0,1,0|2,0,0]=4 423 B9R1.13 C[C@H](O)CC1=CSC=C1 58218 [1,0,0,0,1,0|2,0,0]=4 424 B9R1.11 CN[C@@H](C)C1=CSC=N1 F14265 [0,0,0,0,2,0|2,0,0]=4 425 B9R1.11 CN[C@@H](C)C1=NC=CS1 AT10975 [0,0,0,0,2,0|2,0,0]=4 426 B9R1.11 CN[C@@H](C)C1=NOC=C1 AT10964 [0,0,0,0,2,0|2,0,0]=4 427 B13R1.718 C[C@@H](CO)COCC1=CC=CC=C1 50122 [0,0,0,0,0,2|2,0,0]=4