0 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 W10347 [0,0,0,0,0,0|1,0,2]=3 1 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 W18306 [0,0,0,0,0,0|0,0,2]=2 2 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 31802 [0,0,0,0,0,0|1,0,2]=3 3 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 28444 [0,0,0,0,0,0|0,0,2]=2 4 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 28613 [0,0,0,0,0,0|1,0,1]=2 5 B13R1.42 CCOC(=O)COC1=CC=CC=C1 11858 [0,0,0,0,0,0|1,0,1]=2 6 B13R1.42 CCOC(=O)COC1=CC=NC=C1 D81443 [0,0,0,0,0,0|2,0,1]=3 7 B13R1.42 CCOC(=O)CSC1=CC=CC=C1 D92068 [0,0,0,0,0,0|1,0,1]=2 8 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 AC8020 [0,0,0,0,0,0|0,0,0]=0 9 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 74900 [0,0,0,0,0,0|1,0,0]=1 10 B13R1.42 CCOC(=O)\C=C\C1=CN=CC=C1 W11611 [0,0,0,0,0,0|1,0,0]=1 11 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 W11610 [0,0,0,0,0,0|1,0,0]=1 12 B13R1.42 CNCC(=O)OCC1=CC=CC=C1 D74105 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 A11515 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 53642 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 30664 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.27 COC(=O)C#CC1=CC=CC=C1 D70333 [1,0,0,0,0,0|0,0,2]=3 17 B12R1.27 COC(=O)CCC1=CC=CC=C1 AC8659 [1,0,0,0,0,0|0,0,2]=3 18 B12R1.27 COC(=O)CCC1=CN=CC=C1 D94758 [1,0,0,0,0,0|1,0,2]=4 19 B12R1.27 COC(=O)COC1=CC=CC=C1 D70332 [1,0,0,0,0,0|1,0,1]=3 20 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 P16737 [1,0,0,0,0,0|0,0,0]=1 21 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 AT14565 [1,0,0,0,0,0|1,0,0]=2 22 B12R1.27 NCC(=O)NCC1=CC=CC=C1 D97353 [1,0,0,0,0,0|2,0,1]=4 23 B12R1.27 NCC(=O)NCC1=CC=CC=C1 F21128 [1,0,0,0,0,0|2,0,1]=4 24 B12R1.27 NCC(=O)OCC1=CC=CC=C1 20050 [1,0,0,0,0,0|2,0,1]=4 25 B12R1.27 NCC(=O)OCC1=CC=CC=C1 FD21614 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.27 NCC(=O)OCC1=CC=CC=C1 FD21621 [1,0,0,0,0,0|2,0,1]=4 27 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 P19617 [1,0,0,0,0,0|2,0,1]=4 28 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 S11886 [1,0,0,0,0,0|2,0,1]=4 29 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 76813 [1,0,0,0,0,0|2,0,1]=4 30 B12R1.27 O=C(CO)OCC1=CC=CC=C1 AB8174 [1,0,0,0,0,0|2,0,1]=4 31 B12R1.27 O=C(CS)OCC1=CC=CC=C1 D96019 [1,0,0,0,0,0|2,0,1]=4 32 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 S12382 [0,1,0,0,0,0|0,0,1]=2 33 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 33005 [0,1,0,0,0,0|1,0,1]=3 34 B14R1.29 CCOC(=O)CC(=O)C1=CN=CC=C1 AB9304 [0,1,0,0,0,0|1,0,1]=3 35 B14R1.29 CCOC(=O)CC(=O)C1=NC=CC=C1 AB9303 [0,1,0,0,0,0|1,0,1]=3 36 B14R1.29 CCOC(=O)CC(=O)C1=NC=CC=N1 D94275 [0,1,0,0,0,0|2,0,1]=4 37 B14R1.29 CCOC(=O)CC(=O)C1=NC=NC=C1 C16150 [0,1,0,0,0,0|2,0,1]=4 38 B14R1.29 CCOC(=O)C[C@H](N)C1=CC=CC=C1 N12630 [0,1,0,0,0,0|0,0,2]=3 39 B14R1.29 CCOC(=O)C[C@H](N)C1=CN=CC=C1 56246 [0,1,0,0,0,0|1,0,2]=4 40 B14R1.29 CCOC(=O)C[C@H](O)C1=CC=CC=C1 29433 [0,1,0,0,0,0|0,0,2]=3 41 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 76553 [0,1,0,0,0,0|0,0,0]=1 42 B14R1.32 CCOC(=O)CCC1=CC(N)=CC=C1 53008 [0,1,0,0,0,0|0,0,2]=3 43 B14R1.32 CCOC(=O)CCC1=CC(O)=CC=C1 W10554 [0,1,0,0,0,0|0,0,2]=3 44 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(Br)=C1 AB7157 [0,1,0,0,0,0|0,0,0]=1 45 B14R1.60 CCOC(=O)C(=O)NC1=CC=CC=C1 W18674 [0,1,0,0,0,0|1,0,0]=2 46 B14R1.60 CCOC(=O)C(=O)NC1=CN=CC=C1 W18313 [0,1,0,0,0,0|2,0,0]=3 47 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 75095 [0,1,0,0,0,0|0,0,2]=3 48 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 F10840 [0,1,0,0,0,0|0,0,2]=3 49 B14R1.60 CCOC(=O)[C@@H](N)CC1=NC=CC=C1 83256 [0,1,0,0,0,0|1,0,2]=4 50 B14R1.156 C=CCOC(=O)COC1=CC=CC=C1 A50642 [0,1,0,0,0,0|1,0,2]=4 51 B14R1.156 C=CCOC(=O)\C=C\C1=CC=CC=C1 C10689 [0,1,0,0,0,0|0,0,1]=2 52 B14R1.156 COCNC(=O)OCC1=CC=CC=C1 W17375 [0,1,0,0,0,0|2,0,1]=4 53 B14R1.156 NCCCC(=O)OCC1=CC=CC=C1 D94846 [0,1,0,0,0,0|2,0,1]=4 54 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 35642 [0,1,0,0,0,0|2,0,1]=4 55 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 A10163 [0,1,0,0,0,0|2,0,1]=4 56 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 Y10434 [0,1,0,0,0,0|2,0,1]=4 57 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 AB3064 [0,1,0,0,0,0|2,0,1]=4 58 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 57128 [0,1,0,0,0,0|2,0,1]=4 59 B14R1.502 CCOC(=O)C#CC1=CC=C(Cl)C=C1 83539 [0,1,0,0,0,0|0,0,2]=3 60 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 AB3728 [0,1,0,0,0,0|0,0,2]=3 61 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 AB7212 [0,1,0,0,0,0|0,0,2]=3 62 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 30223 [0,1,0,0,0,0|0,0,2]=3 63 B14R1.502 CCOC(=O)CNC1=CC=C(Cl)C=C1 71210 [0,1,0,0,0,0|1,0,1]=3 64 B14R1.502 CCOC(=O)COC1=CC=C(C)C=C1 D78583 [0,1,0,0,0,0|1,0,1]=3 65 B14R1.502 CCOC(=O)CSC1=CC=C(Cl)C=C1 D85786 [0,1,0,0,0,0|1,0,1]=3 66 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 AB7158 [0,1,0,0,0,0|0,0,0]=1 67 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 A12244 [0,1,0,0,0,0|0,0,0]=1 68 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Cl)C=C1 35676 [0,1,0,0,0,0|0,0,0]=1 69 B14R1.502 CCOC(=O)\C=C\C1=CC=C(F)C=C1 AB7211 [0,1,0,0,0,0|0,0,0]=1 70 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 55083 [0,1,0,0,0,0|0,0,0]=1 71 B14R1.502 CCOC(=O)\C=C\C1=CC=C(O)C=C1 Y10121 [0,1,0,0,0,0|0,0,0]=1 72 B14R1.502 CCOC(=O)\C=C\C1=NC=C(C)C=C1 W11643 [0,1,0,0,0,0|1,0,0]=2 73 B14R1.502 [N-]=[N+]=NC(=O)\C=C\C1=CC=C(Br)C=C1 D84593 [0,1,0,0,0,0|3,0,0]=4 74 B14R1.598 CCOC(=O)CCC1=C(Br)C=CC=C1 29956 [0,1,0,0,0,0|0,0,2]=3 75 B14R1.598 CCOC(=O)COC1=C(Br)C=CC=C1 W13466 [0,1,0,0,0,0|1,0,1]=3 76 B14R1.598 CCOC(=O)\C=C\C1=C(Br)C=CC=C1 72111 [0,1,0,0,0,0|0,0,0]=1 77 B14R1.598 CCOC(=O)\C=C\C1=C(F)C=CC=C1 W18861 [0,1,0,0,0,0|0,0,0]=1 78 B14R1.818 CC(C)CC(=O)OCC1=CC=CC=C1 D95343 [0,1,0,0,0,0|2,0,1]=4 79 B14R2.21 O=C1CCC[C@H](C2=CC=CC=C2)C1 53410 [0,0,0,1,0,0|1,0,2]=4 80 B14R2.30 O=C1CCCN1CC2=CC=CC=C2 F14838 [0,0,0,1,0,0|2,0,1]=4 81 B14R2.30 O=C1OCC\C1=C/C2=CC=CC=C2 D83493 [0,0,0,1,0,0|0,0,0]=1 82 B14R2.112 CNCC1=CC2=CC=CC=C2C=C1 F16331 [0,0,0,1,0,0|3,0,0]=4 83 B14R2.112 OCCC1=CC2=CC=CC=C2C=C1 D81979 [0,0,0,1,0,0|3,0,0]=4 84 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 83285 [0,0,0,1,0,0|3,0,0]=4 85 B14R2.203 CC[N+]1=C(C)C=CC2=CC=CC=C21 D90450 [0,0,0,1,0,0|2,0,0]=3 86 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 29001 [0,0,0,1,0,0|2,0,1]=4 87 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 31189 [0,0,0,1,0,0|2,0,1]=4 88 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 C10691 [0,0,0,1,0,0|1,0,1]=3 89 B14R2.2899 O=C(OCC1=CC=CC=C1)C2CC2 D84412 [0,0,0,1,0,0|2,0,1]=4 90 B12R1.32 CCCC(=O)CC1=CC=CC=C1 F19922 [0,0,0,0,1,0|1,0,1]=3 91 B12R1.32 CCNC(=O)OC1=CC=CC=C1 D92920 [0,0,0,0,1,0|2,0,0]=3 92 B12R1.32 CCOC(=O)CC1=CC=CC=C1 D77783 [0,0,0,0,1,0|0,0,1]=2 93 B12R1.32 CCOC(=O)CC1=CC=NC=C1 W12171 [0,0,0,0,1,0|1,0,1]=3 94 B12R1.32 CCOC(=O)CC1=CN=CC=C1 TD8046 [0,0,0,0,1,0|1,0,1]=3 95 B12R1.32 CCOC(=O)CC1=NC=CC=C1 28493 [0,0,0,0,1,0|1,0,1]=3 96 B12R1.32 CCOC(=O)CC1=NC=CC=N1 24984 [0,0,0,0,1,0|2,0,1]=4 97 B12R1.32 CCOC(=O)CC1=NC=CN=C1 50113 [0,0,0,0,1,0|2,0,1]=4 98 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 57872 [0,0,0,0,1,0|3,0,0]=4 99 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 D84185 [0,0,0,0,1,0|3,0,0]=4 100 B12R1.51 CCOC(=O)\C=C\C1=CSC=N1 W11644 [0,0,0,0,1,0|2,0,0]=3 101 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 AR3071 [0,0,0,0,0,1|0,0,2]=3 102 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SC3891 [0,0,0,0,0,1|1,0,2]=4 103 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 26430 [0,0,0,0,0,1|0,0,2]=3 104 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 26460 [0,0,0,0,0,1|0,0,2]=3 105 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 30644 [0,0,0,0,0,1|0,0,2]=3 106 B14R1.520 CCOC(=O)NCCC1=CC=CC=C1 25121 [0,0,0,0,0,1|0,0,2]=3 107 B14R1.520 CCOC(=O)NOCC1=CC=CC=C1 W12967 [0,0,0,0,0,1|1,0,1]=3 108 B11R1.28 CCO\C=N\C1=CC=CC=C1 H11958 [2,0,0,0,0,0|1,0,0]=3 109 B11R1.28 CNC\C=C\C1=CC=CC=C1 A11412 [2,0,0,0,0,0|1,0,1]=4 110 B11R1.91 CC(=O)CCC1=CC=CC=C1 P17497 [2,0,0,0,0,0|0,0,2]=4 111 B11R1.91 CC(=O)COC1=CC=CC=C1 34157 [2,0,0,0,0,0|1,0,1]=4 112 B11R1.91 CC(=O)NCC1=CC=CC=C1 D70359 [2,0,0,0,0,0|1,0,1]=4 113 B11R1.91 CC(=O)NNC1=CC=CC=C1 F11205 [2,0,0,0,0,0|2,0,0]=4 114 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 D70186 [2,0,0,0,0,0|0,0,0]=2 115 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 D70528 [2,0,0,0,0,0|0,0,0]=2 116 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 29382 [2,0,0,0,0,0|1,0,0]=3 117 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 AC7815 [2,0,0,0,0,0|1,0,0]=3 118 B11R1.91 O=C(O)C#CC1=CC=CC=C1 33950 [2,0,0,0,0,0|0,0,2]=4 119 B11R1.91 O=C(O)CCC1=CC=CC=C1 65006 [2,0,0,0,0,0|0,0,2]=4 120 B11R1.91 O=C(O)CNC1=CC=CC=C1 29550 [2,0,0,0,0,0|1,0,1]=4 121 B11R1.91 O=C(O)COC1=CC=CC=C1 D70383 [2,0,0,0,0,0|1,0,1]=4 122 B11R1.91 O=C(O)CSC1=CC=CC=C1 D70930 [2,0,0,0,0,0|1,0,1]=4 123 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 D70605 [2,0,0,0,0,0|0,0,0]=2 124 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 A10227 [2,0,0,0,0,0|1,0,0]=3 125 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 65474 [2,0,0,0,0,0|1,0,0]=3 126 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 28919 [2,0,0,0,0,0|1,0,0]=3 127 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 C90173 [2,0,0,0,0,0|1,0,0]=3 128 B11R1.91 O=C([O-])C=CC1=CC=CC=C1 D82494 [2,0,0,0,0,0|0,0,1]=3 129 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 77768 [2,0,0,0,0,0|1,0,1]=4 130 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 D72576 [2,0,0,0,0,0|1,0,1]=4 131 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 66480 [2,0,0,0,0,0|1,0,1]=4 132 B13R1.337 CC(=O)OC\C=C\C1=CC=CC=C1 AC7842 [1,1,0,0,0,0|0,0,2]=4 133 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 BL009552 [1,1,0,0,0,0|0,0,1]=3 134 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 29190 [1,1,0,0,0,0|1,0,1]=4 135 B13R1.11 COC(=O)CC(=O)C1=CN=CC=C1 AB9779 [1,1,0,0,0,0|1,0,1]=4 136 B13R1.11 COC(=O)CC(=O)C1=NC=CC=C1 AB9778 [1,1,0,0,0,0|1,0,1]=4 137 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 75006 [1,1,0,0,0,0|0,0,2]=4 138 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 36030 [1,1,0,0,0,0|0,0,2]=4 139 B13R1.14 COC(=O)CCC1=CC=C(Cl)C=C1 AB7500 [1,1,0,0,0,0|0,0,2]=4 140 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 AB7531 [1,1,0,0,0,0|0,0,2]=4 141 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 N12285 [1,1,0,0,0,0|0,0,2]=4 142 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 35778 [1,1,0,0,0,0|0,0,2]=4 143 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 68784 [1,1,0,0,0,0|1,0,1]=4 144 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 AC8692 [1,1,0,0,0,0|0,0,0]=2 145 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 F14966 [1,1,0,0,0,0|0,0,0]=2 146 B13R1.14 COC(=O)\C=C\C1=CC=C(C)C=C1 H11404 [1,1,0,0,0,0|0,0,0]=2 147 B13R1.14 COC(=O)\C=C\C1=CC=C(Cl)C=C1 35678 [1,1,0,0,0,0|0,0,0]=2 148 B13R1.14 COC(=O)\C=C\C1=CC=C(F)C=C1 W11678 [1,1,0,0,0,0|0,0,0]=2 149 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 35803 [1,1,0,0,0,0|0,0,0]=2 150 B13R1.15 CCC(=O)NCC1=CC=CC(Br)=C1 71745 [1,1,0,0,0,0|1,0,1]=4 151 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 AB7481 [1,1,0,0,0,0|0,0,2]=4 152 B13R1.15 COC(=O)CCC1=CC=CC(Cl)=C1 AB7499 [1,1,0,0,0,0|0,0,2]=4 153 B13R1.15 COC(=O)\C=C\C1=CC(N)=CC=C1 W17760 [1,1,0,0,0,0|0,0,0]=2 154 B13R1.15 COC(=O)\C=C\C1=CC=CC(Br)=C1 AB7476 [1,1,0,0,0,0|0,0,0]=2 155 B13R1.15 COC(=O)\C=C\C1=CC=CC(Cl)=C1 20665 [1,1,0,0,0,0|0,0,0]=2 156 B13R1.15 COC(=O)\C=C\C1=NC(C)=CC=C1 W12463 [1,1,0,0,0,0|1,0,0]=3 157 B13R1.135 COC(=O)[C@@H](Cl)CC1=CC=CC=C1 AC2389 [1,1,0,0,0,0|0,0,2]=4 158 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 28520 [1,1,0,0,0,0|0,0,2]=4 159 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 30761 [1,1,0,0,0,0|0,0,2]=4 160 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 73273 [1,1,0,0,0,0|0,0,2]=4 161 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 23790 [1,1,0,0,0,0|0,0,2]=4 162 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 FD1247 [1,1,0,0,0,0|0,0,2]=4 163 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 FD1253 [1,1,0,0,0,0|0,0,2]=4 164 B13R1.351 CC(C)C(=O)OCC1=CC=CC=C1 D91147 [1,1,0,0,0,0|1,0,1]=4 165 B13R1.351 C[C@H](N)C(=O)NCC1=CC=CC=C1 D82265 [1,1,0,0,0,0|1,0,1]=4 166 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 FD21013 [1,1,0,0,0,0|1,0,1]=4 167 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 FD21014 [1,1,0,0,0,0|1,0,1]=4 168 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 FD21015 [1,1,0,0,0,0|1,0,1]=4 169 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 F17734 [1,1,0,0,0,0|1,0,1]=4 170 B13R1.528 COC(=O)CCC1=C(Br)C=CC=C1 AB3933 [1,1,0,0,0,0|0,0,2]=4 171 B13R1.528 COC(=O)CCC1=C(F)C=CC=C1 AB9717 [1,1,0,0,0,0|0,0,2]=4 172 B13R1.528 COC(=O)\C=C\C1=C(Cl)C=CC=C1 AR3005 [1,1,0,0,0,0|0,0,0]=2 173 B13R1.528 COC(=O)\C=C\C1=C(F)C=CC=C1 D84598 [1,1,0,0,0,0|0,0,0]=2 174 B13R1.19 CCCC(=O)NC1=CC=C(O)C=C1 D86519 [0,1,0,0,1,0|2,0,0]=4 175 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 AB3726 [0,1,0,0,1,0|0,0,1]=3 176 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 35772 [0,1,0,0,1,0|0,0,1]=3 177 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 O11742 [0,1,0,0,1,0|0,0,1]=3 178 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 AR2996 [0,1,0,0,1,0|0,0,1]=3 179 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 AC2275 [0,1,0,0,1,0|0,0,1]=3 180 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 L10030 [0,1,0,0,1,0|0,0,1]=3 181 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 20521 [0,1,0,0,1,0|0,0,1]=3 182 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 61900 [0,1,0,0,1,0|1,0,1]=4 183 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 37597 [0,1,0,0,1,0|1,0,1]=4 184 B13R1.20 CCOC(=O)CC1=CC(C)=CC=C1 A50732 [0,1,0,0,1,0|0,0,1]=3 185 B13R1.20 CCOC(=O)CC1=CC(O)=CC=C1 C11283 [0,1,0,0,1,0|0,0,1]=3 186 B13R1.20 CCOC(=O)CC1=CC=CC(Br)=C1 AB3725 [0,1,0,0,1,0|0,0,1]=3 187 B13R1.20 CCOC(=O)CC1=CC=CC(Cl)=C1 60913 [0,1,0,0,1,0|0,0,1]=3 188 B13R1.20 CCOC(=O)CC1=CC=CC(Cl)=N1 F14053 [0,1,0,0,1,0|1,0,1]=4 189 B13R1.20 CCOC(=O)CC1=CC=CC(F)=C1 AB7209 [0,1,0,0,1,0|0,0,1]=3 190 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 72057 [0,1,0,0,1,0|1,0,1]=4 191 B13R1.20 CCOC(=O)NC1=CC(Br)=CN=C1 N10248 [0,1,0,0,1,0|2,0,0]=4 192 B13R1.20 CCOC(=O)NC1=CC(O)=CC=C1 T72868 [0,1,0,0,1,0|1,0,0]=3 193 B13R1.47 C=C(C(=O)OCC)C1=CC=CC=C1 65828 [0,1,0,0,1,0|0,0,0]=2 194 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 28913 [0,1,0,0,1,0|0,0,0]=2 195 B13R1.47 CCOC(=O)C(=O)C1=NC=CC=C1 P10388 [0,1,0,0,1,0|1,0,0]=3 196 B13R1.47 CCOC(=O)[C@H](Br)C1=CC=CC=C1 F52714 [0,1,0,0,1,0|0,0,1]=3 197 B13R1.47 CCOC(=O)[C@H](Cl)C1=CC=CC=C1 D81904 [0,1,0,0,1,0|0,0,1]=3 198 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 75097 [0,1,0,0,1,0|0,0,1]=3 199 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 75098 [0,1,0,0,1,0|0,0,1]=3 200 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 D84366 [0,1,0,0,1,0|0,0,1]=3 201 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 D84612 [0,1,0,0,1,0|0,0,1]=3 202 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 28694 [0,1,0,0,1,0|0,0,1]=3 203 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 31175 [0,1,0,0,1,0|0,0,1]=3 204 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 N10371 [0,1,0,0,1,0|0,0,1]=3 205 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 D71255 [0,1,0,0,1,0|1,0,1]=4 206 B13R1.470 CCOC(=O)CC1=C(Br)C=CC=C1 AR3395 [0,1,0,0,1,0|0,0,1]=3 207 B13R1.470 CCOC(=O)CC1=C(C)C=CC=C1 A50731 [0,1,0,0,1,0|0,0,1]=3 208 B13R1.470 CCOC(=O)CC1=C(Cl)C=CC=C1 AR3392 [0,1,0,0,1,0|0,0,1]=3 209 B13R1.470 CCOC(=O)CC1=C(F)C=CC=C1 AB7208 [0,1,0,0,1,0|0,0,1]=3 210 B13R1.470 CCOC(=O)CC1=C(I)C=CC=C1 W17295 [0,1,0,0,1,0|0,0,1]=3 211 B13R1.470 CCOC(=O)CC1=C(O)C=CC=C1 S10848 [0,1,0,0,1,0|0,0,1]=3 212 B13R1.33 CCOC(=O)CC(=O)C1=CC=CO1 29650 [0,1,0,0,1,0|1,0,1]=4 213 B13R1.33 CCOC(=O)CC(=O)C1=CC=CS1 60882 [0,1,0,0,1,0|1,0,1]=4 214 B15R1.11 CCOC(=O)CCCC1=CC=C(Br)C=C1 24945 [0,1,0,0,0,1|0,0,2]=4 215 B15R1.89 CCOC(=O)CNC(=O)C1=CC=CC=C1 20537 [0,1,0,0,0,1|0,0,1]=3 216 B15R1.89 CCOC(=O)CN[C@@H](C)C1=CC=CC=C1 31297 [0,1,0,0,0,1|0,0,2]=4 217 B15R1.89 CCOC(=O)CN[C@@H](C)C1=CC=CC=C1 32584 [0,1,0,0,0,1|0,0,2]=4 218 B15R1.89 CCOC(=O)\C=C\C(=O)C1=CC=CC=C1 D88769 [0,1,0,0,0,1|0,0,0]=2 219 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 AC8658 [0,1,0,0,0,1|0,0,1]=3 220 B15R1.826 CCOC(=O)C(=O)NCC1=CC=CC=C1 71160 [0,1,0,0,0,1|0,0,1]=3 221 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 60854 [0,1,0,0,0,1|0,0,2]=4 222 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 60862 [0,1,0,0,0,1|0,0,2]=4 223 B15R1.826 CCOC(=O)[C@@H](O)CCC1=CC=CC=C1 26200 [0,1,0,0,0,1|0,0,2]=4 224 B15R1.826 CCOC(=O)\C(Cl)=N\NC1=CC=CC=C1 D72472 [0,1,0,0,0,1|1,0,0]=3 225 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)C=C1 AB2833 [0,2,0,0,0,0|0,0,1]=3 226 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 S10631 [0,2,0,0,0,0|0,0,1]=3 227 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1 82561 [0,2,0,0,0,0|0,0,1]=3 228 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(F)C=C1 68785 [0,2,0,0,0,0|0,0,1]=3 229 B15R1.24 CCOC(=O)CC(=O)C1=CC(C)=CC=C1 S11906 [0,2,0,0,0,0|0,0,1]=3 230 B15R1.24 CCOC(=O)CC(=O)C1=CC(O)=CC=C1 32670 [0,2,0,0,0,0|0,0,1]=3 231 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(Br)=C1 AB2832 [0,2,0,0,0,0|0,0,1]=3 232 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(Cl)=C1 AB2835 [0,2,0,0,0,0|0,0,1]=3 233 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(F)=C1 AB2843 [0,2,0,0,0,0|0,0,1]=3 234 B15R1.24 CCOC(=O)C[C@H](N)C1=CC(O)=CC=C1 32076 [0,2,0,0,0,0|0,0,2]=4 235 B15R1.24 CCOC(=O)C[C@H](N)C1=CC=CC(Cl)=C1 N12408 [0,2,0,0,0,0|0,0,2]=4 236 B15R1.578 CCOC(=O)C(Br)C(Br)C1=CC=CC=C1 H10565 [0,2,0,0,0,0|0,0,2]=4 237 B15R1.807 CCOC(=O)CS(=O)(=O)C1=CC=CC=C1 78732 [0,2,0,0,0,0|1,0,1]=4 238 B15R1.3722 CCOC(=O)CC(=O)C1=C(Br)C=CC=C1 AB2831 [0,2,0,0,0,0|0,0,1]=3 239 B15R1.3722 CCOC(=O)CC(=O)C1=C(C)C=CC=C1 S10683 [0,2,0,0,0,0|0,0,1]=3 240 B15R1.3722 CCOC(=O)CC(=O)C1=C(Cl)C=CC=C1 AB2834 [0,2,0,0,0,0|0,0,1]=3 241 B15R1.3722 CCOC(=O)CC(=O)C1=C(F)C=CC=C1 AB2842 [0,2,0,0,0,0|0,0,1]=3 242 B15R1.3722 CCOC(=O)CC(=O)C1=C(F)C=CC=N1 D83500 [0,2,0,0,0,0|1,0,1]=4 243 B15R1.10389 CCOC(=O)CCC1=CC(OC)=CC=C1 D86271 [0,2,0,0,0,0|0,0,2]=4 244 B15R1.10389 CCOC(=O)\C=C\C1=CN=CC(OC)=C1 W15815 [0,2,0,0,0,0|1,0,0]=3 245 B15R1.10390 CCOC(=O)CCC1=CC(F)=C(F)C=C1 79546 [0,2,0,0,0,0|0,0,2]=4 246 B15R1.10390 CCOC(=O)NNC1=CC(Cl)=C(Cl)C=C1 T71705 [0,2,0,0,0,0|2,0,0]=4 247 B15R1.10390 CCOC(=O)\C=C\C1=CC(O)=C(O)C=C1 35741 [0,2,0,0,0,0|0,0,0]=2 248 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(C)C=C1 D83174 [0,2,0,0,0,0|1,0,0]=3 249 B15R1.48 CCOC(=O)C(=O)NC1=NC=C(Cl)C=C1 12801 [0,2,0,0,0,0|2,0,0]=4 250 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(Cl)C=C1 D94743 [0,2,0,0,0,0|0,0,2]=4 251 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(F)C=C1 Y11700 [0,2,0,0,0,0|0,0,2]=4 252 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 F14553 [0,2,0,0,0,0|0,0,2]=4 253 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 F14570 [0,2,0,0,0,0|0,0,2]=4 254 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 H10794 [0,2,0,0,0,0|0,0,2]=4 255 B15R1.48 CCOC(=O)[C@H](C)OC1=CC=C(O)C=C1 I11073 [0,2,0,0,0,0|1,0,1]=4 256 B15R1.640 CCOC(=O)[C@@H](C#N)CC1=CC=CC=C1 20559 [0,2,0,0,0,0|0,0,2]=4 257 B15R1.640 CCOC(=O)[C@H](CN)CC1=CC=CC=C1 59352 [0,2,0,0,0,0|0,0,2]=4 258 B15R1.640 CCOC(=O)\C(C#N)=C/C1=CC=CC=C1 61556 [0,2,0,0,0,0|0,0,0]=2 259 B15R1.640 CCOC(=O)\C(C#N)=C\C1=CC=CC=C1 H11338 [0,2,0,0,0,0|0,0,0]=2 260 B15R1.640 CCOC(=O)\C(C#N)=C\C1=CN=CC=C1 AC7727 [0,2,0,0,0,0|1,0,0]=3 261 B15R1.3960 CCOC(=O)C(=O)NC1=C(F)C=CC=C1 W18468 [0,2,0,0,0,0|1,0,0]=3 262 B15R1.78 CCCCOC(=O)\C=C\C1=CC=CC=C1 D82012 [0,2,0,0,0,0|0,0,0]=2 263 B15R1.5919 CC(C)COC(=O)\C=C\C1=CC=CC=C1 AC7839 [0,2,0,0,0,0|0,0,0]=2 264 B15R1.793 CCOC(=O)CCC1=CC=C(OC)C=C1 F52655 [0,2,0,0,0,0|0,0,2]=4 265 B15R1.793 CCOC(=O)COC1=CC=C(C#N)C=C1 D78579 [0,2,0,0,0,0|1,0,1]=4 266 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 20345 [0,2,0,0,0,0|0,0,0]=2 267 B15R1.768 CCOC(=O)CNC1=C(C#N)C=CC=C1 30631 [0,2,0,0,0,0|1,0,1]=4 268 B15R1.768 CCOC(=O)COC1=C(OC)C=CC=C1 74789 [0,2,0,0,0,0|1,0,1]=4 269 B15R1.768 CCOC(=O)\C=C\C1=C(OC)C=CC=C1 W11624 [0,2,0,0,0,0|0,0,0]=2 270 B15R1.3465 CC(C)(C)OC(=O)NCC1=CC=CC=C1 20715 [0,2,0,0,0,0|1,0,1]=4 271 B15R1.3465 CC(C)(C)OC(=O)NNC1=CC=CC=C1 AB2716 [0,2,0,0,0,0|2,0,0]=4 272 B15R1.3983 CCOC(\C=C\C1=CC=CC=C1)OCC O10067 [0,2,0,0,0,0|0,0,2]=4 273 B13R1.464 C=CC1=C(C(=O)OCC)C=CC=C1 F14518 [0,0,1,1,0,0|0,0,0]=2 274 B13R1.464 CCOC(=O)C1=C(C#N)C=CC=C1 TD1357 [0,0,1,1,0,0|1,0,1]=4 275 B13R1.464 CCOC(=O)C1=C(NC)C=CC=C1 24588 [0,0,1,1,0,0|1,0,1]=4 276 B13R1.464 CCOC(=O)C1=C(OC)C=CC=C1 H10032 [0,0,1,1,0,0|1,0,1]=4 277 B13R1.460 CCOC(=O)C1=CC(C#N)=CC=C1 C74269 [0,0,1,1,0,0|1,0,1]=4 278 B13R1.460 CCOC(=O)C1=CC(NN)=CC=C1 20718 [0,0,1,1,0,0|2,0,0]=4 279 B13R1.460 CCOC(=O)C1=CC(NN)=CC=C1 29899 [0,0,1,1,0,0|2,0,0]=4 280 B13R1.460 CCOC(=O)C1=CC(OC)=CC=C1 S10900 [0,0,1,1,0,0|1,0,1]=4 281 B13R1.460 CCOC(=O)C1=CC=CC(CCl)=C1 CK2004 [0,0,1,1,0,0|1,0,1]=4 282 B13R1.460 CCOC(=O)C1=NC(C=O)=CC=C1 61288 [0,0,1,1,0,0|2,0,0]=4 283 B13R1.446 CCOC(=O)C1=C(Br)C=CC(F)=C1 31781 [0,0,1,1,0,0|2,0,0]=4 284 B13R1.446 CCOC(=O)C1=C(Br)C=CC(I)=C1 34985 [0,0,1,1,0,0|2,0,0]=4 285 B13R1.446 CCOC(=O)C1=C(C)C=CC(Cl)=C1 C10584 [0,0,1,1,0,0|1,0,1]=4 286 B13R1.446 CCOC(=O)C1=C(C)C=CC(F)=C1 98184 [0,0,1,1,0,0|1,0,1]=4 287 B13R1.446 CCOC(=O)C1=C(C)C=CC(I)=C1 87916 [0,0,1,1,0,0|1,0,1]=4 288 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 N10376 [0,0,1,1,0,0|2,0,0]=4 289 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Cl)=C1 35048 [0,0,1,1,0,0|2,0,0]=4 290 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(N)=C1 20575 [0,0,1,1,0,0|2,0,0]=4 291 B13R1.446 CCOC(=O)C1=C(F)C=CC(Br)=C1 C13671 [0,0,1,1,0,0|2,0,0]=4 292 B13R1.446 CCOC(=O)C1=C(F)C=CC(C)=C1 31696 [0,0,1,1,0,0|1,0,1]=4 293 B13R1.446 CCOC(=O)C1=C(F)C=CC(F)=C1 AC6662 [0,0,1,1,0,0|2,0,0]=4 294 B13R1.446 CCOC(=O)C1=C(F)C=CC(N)=C1 AB2829 [0,0,1,1,0,0|2,0,0]=4 295 B13R1.446 CCOC(=O)C1=C(I)C=CC(Cl)=C1 C71067 [0,0,1,1,0,0|2,0,0]=4 296 B13R1.446 CCOC(=O)C1=C(N)C=CC(Br)=C1 20695 [0,0,1,1,0,0|2,0,0]=4 297 B13R1.446 CCOC(=O)C1=C(N)C=CC(C)=C1 23448 [0,0,1,1,0,0|1,0,1]=4 298 B13R1.446 CCOC(=O)C1=C(N)C=CC(I)=C1 D94744 [0,0,1,1,0,0|2,0,0]=4 299 B13R2.3 C1=CC=C(C2=CCCCC2)C=C1 F13284 [1,0,0,1,0,0|1,0,1]=4 300 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 49522 [1,0,0,1,0,0|1,0,1]=4 301 B13R2.3 C1=CC=C(C2=CCNCC2)C=C1 82911 [1,0,0,1,0,0|1,0,1]=4 302 B13R2.3 C1=CC=C(C2=CCOCC2)C=C1 38038 [1,0,0,1,0,0|0,0,1]=3 303 B13R2.15 CN1N=CC=C1C2=CC=CC=C2 O10429 [1,0,0,1,0,0|2,0,0]=4 304 B13R2.1613 BrCC1=CC=CC2=CC=CC=C21 O10319 [1,0,0,1,0,0|2,0,0]=4 305 B13R2.1613 CCC1=CC=CC2=CC=CC=C21 F16030 [1,0,0,1,0,0|1,0,0]=3 306 B13R2.1613 CC[N+]1=CC=CC2=CC=CC=C21 D81711 [1,0,0,1,0,0|1,0,0]=3 307 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 24060 [1,0,0,1,0,0|2,0,0]=4 308 B13R2.1613 COC1=CC=CC2=CC=CC=C21 O10418 [1,0,0,1,0,0|2,0,0]=4 309 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 E70399 [1,0,0,1,0,0|2,0,0]=4 310 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 H10461 [1,0,0,1,0,0|2,0,0]=4 311 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 S10483 [1,0,0,1,0,0|2,0,0]=4 312 B13R2.1613 OCC1=CC=CC2=CC=CC=C21 F14852 [1,0,0,1,0,0|2,0,0]=4 313 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 AR2465 [1,0,0,1,0,0|2,0,0]=4 314 B13R2.10 O=C1C=C(C2=CC=CC=C2)NO1 D95560 [1,0,0,1,0,0|1,0,0]=3 315 B13R2.10 O=C1CCN(C2=CC=CC=C2)N1 D78316 [1,0,0,1,0,0|2,0,0]=4 316 B13R2.10 O=C1CC[C@@H](C2=CC=CC=C2)O1 D92106 [1,0,0,1,0,0|1,0,1]=4 317 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 65136 [1,0,0,1,0,0|2,0,0]=4 318 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 22501 [1,0,0,1,0,0|1,0,1]=4 319 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 22502 [1,0,0,1,0,0|1,0,1]=4 320 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 71239 [1,0,0,1,0,0|1,0,1]=4 321 B13R2.32 CC1=C(Br)C=CC2=CC=CC=C21 D92938 [1,0,0,1,0,0|1,0,1]=4 322 B13R2.32 CC1=C(O)C=CC2=CC=CC=C21 D83548 [1,0,0,1,0,0|0,0,2]=4 323 B13R2.33 O=C1CCC2=C(C=CC=C2)CC1 83204 [1,0,0,1,0,0|0,0,2]=4 324 B13R2.57 BrCC1=CC2=CC=CC=C2C=C1 73681 [1,0,0,1,0,0|2,0,0]=4 325 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 67273 [1,0,0,1,0,0|2,0,0]=4 326 B13R2.57 CCC1=CC2=CC=CC=C2C=C1 D83899 [1,0,0,1,0,0|1,0,0]=3 327 B13R2.57 CNC1=CC2=CC=CC=C2C=C1 D82022 [1,0,0,1,0,0|2,0,0]=4 328 B13R2.57 CNC1=NC2=CC=CC=C2C=C1 72050 [1,0,0,1,0,0|2,0,0]=4 329 B13R2.57 COC1=CC2=CC=CC=C2C=C1 D71164 [1,0,0,1,0,0|1,0,0]=3 330 B13R2.57 COC1=CC2=CC=CC=C2N=C1 25360 [1,0,0,1,0,0|2,0,0]=4 331 B13R2.57 COC1=CC2=CC=CN=C2C=C1 H10211 [1,0,0,1,0,0|2,0,0]=4 332 B13R2.57 COC1=CC2=CC=NC=C2C=C1 64318 [1,0,0,1,0,0|2,0,0]=4 333 B13R2.57 COC1=CC2=CN=CC=C2C=C1 BL003853 [1,0,0,1,0,0|2,0,0]=4 334 B13R2.57 COC1=CC2=NC=CC=C2C=C1 35998 [1,0,0,1,0,0|2,0,0]=4 335 B13R2.57 ClCC1=CC2=CC=CC=C2C=C1 59497 [1,0,0,1,0,0|2,0,0]=4 336 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 O10516 [1,0,0,1,0,0|2,0,0]=4 337 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 23730 [1,0,0,1,0,0|2,0,0]=4 338 B13R2.57 NCC1=CC2=CC=CC=C2C=C1 35112 [1,0,0,1,0,0|2,0,0]=4 339 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 20216 [1,0,0,1,0,0|2,0,0]=4 340 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 20217 [1,0,0,1,0,0|2,0,0]=4 341 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 62932 [1,0,0,1,0,0|2,0,0]=4 342 B13R2.26 CCOC1=NC2=C(C=CC=C2)N1 F30799 [0,0,0,1,1,0|2,0,0]=4 343 B13R2.135 CCN1C(=O)NC2=C1C=CC=C2 F16478 [0,0,0,1,1,0|2,0,0]=4 344 B13R2.135 CCN1C(C)=CC2=C1C=CC=C2 D84345 [0,0,0,1,1,0|2,0,0]=4 345 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 23936 [0,0,0,1,1,0|2,0,0]=4 346 B13R2.449 CCOC1=CC2=C(C=CN2)C=C1 25312 [0,0,0,1,1,0|2,0,0]=4 347 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 73362 [0,0,0,1,0,1|0,0,2]=4 348 B15R2.73 CCOC(=O)C1=C2C=CC=CN2N=C1 25304 [0,0,0,1,0,1|1,0,0]=3 349 B15R2.73 CCOC(=O)C1=C2N=CC=CN2N=C1 80203 [0,0,0,1,0,1|2,0,0]=4 350 B15R2.73 CCOC(=O)C1=CN=C2C=CC=CN12 30342 [0,0,0,1,0,1|1,0,0]=3 351 B15R2.73 CCOC(=O)C1=CN=C2N=CC=CN12 F14130 [0,0,0,1,0,1|2,0,0]=4 352 B15R2.73 CCOC(=O)C1=CNC2=C1C=CC=C2 33848 [0,0,0,1,0,1|0,0,0]=2 353 B15R2.73 CCOC(=O)C1=NC=C2C=CC=CN21 H10973 [0,0,0,1,0,1|1,0,0]=3 354 B15R2.73 CCOC(=O)C1=NNC2=C1C=CC=C2 26043 [0,0,0,1,0,1|1,0,0]=3 355 B15R2.1342 CCOC(=O)C1OC1C2=CC=CC=C2 D90572 [0,0,0,1,0,1|0,0,2]=4 356 B15R2.1342 CCOC(=O)[C@H]1C[C@@H]1C2=CC=CC=C2 P15489 [0,0,0,1,0,1|0,0,2]=4 357 B15R2.10252 CCOC1=CC2=CC=C(C)N=C2C=C1 H11812 [0,1,0,1,0,0|2,0,0]=4 358 B15R2.10252 CCOC1=CC=C2C=C(Br)C=CC2=C1 D97419 [0,1,0,1,0,0|1,0,0]=3 359 B15R2.32 O=C1OCCN(C2=CC=CC=C2)C1=O W11707 [0,1,0,1,0,0|1,0,0]=3 360 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)N1 33845 [0,1,0,1,0,0|0,0,0]=2 361 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)O1 24072 [0,1,0,1,0,0|0,0,0]=2 362 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)S1 82599 [0,1,0,1,0,0|0,0,0]=2 363 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=N2)N1 54327 [0,1,0,1,0,0|1,0,0]=3 364 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 82837 [0,1,0,1,0,0|1,0,0]=3 365 B15R2.1356 CCOC(=O)C1=CC2=C(C=NC=C2)N1 74366 [0,1,0,1,0,0|1,0,0]=3 366 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2=N1 65803 [0,1,0,1,0,0|1,0,0]=3 367 B15R2.1356 CCOC(=O)C1=CN2C=CC=NC2=N1 25060 [0,1,0,1,0,0|2,0,0]=4 368 B15R2.1356 CCOC(=O)C1=CN2N=CC=CC2=N1 69031 [0,1,0,1,0,0|2,0,0]=4 369 B15R2.1356 CCOC(=O)C1=NC2=C(C=CC=C2)N1 53618 [0,1,0,1,0,0|1,0,0]=3 370 B15R2.1356 CCOC(=O)C1=NC2=C(C=CC=C2)S1 53218 [0,1,0,1,0,0|1,0,0]=3 371 B15R2.1356 CCOC(=O)[C@@H]1CC2=C(C=CC=C2)N1 20755 [0,1,0,1,0,0|0,0,2]=4 372 B15R2.1356 CCOC(=O)[C@@H]1CC2=C(C=CC=C2)N1 49199 [0,1,0,1,0,0|0,0,2]=4 373 B15R2.352 N#CCOC1=CC2=CC=CC=C2C=C1 D95173 [0,1,0,1,0,0|1,0,1]=4 374 B15R2.1282 CCOC1=CC2=C(C=CC(=O)O2)C=C1 D81908 [0,1,0,1,0,0|2,0,0]=4 375 B15R2.1282 CCOC1=CC2=CC(O)=CC=C2C=C1 25991 [0,1,0,1,0,0|1,0,0]=3 376 B15R2.54379 CCOC1=CC=C2C(Cl)=CC=NC2=C1 D82703 [0,1,0,1,0,0|2,0,0]=4 377 B15R2.327 CC1(C)OC(=O)N[C@@H]1C2=CC=CC=C2 CL4555 [0,1,0,1,0,0|1,0,1]=4 378 B11R1.25 COC(=O)\C=C\C1=CC=CS1 W12254 [1,0,0,0,1,0|1,0,0]=3 379 B11R1.40 CCC(=O)CC1=CC=CC=C1 75226 [1,0,0,0,1,0|0,0,1]=3 380 B11R1.40 CCC(=O)OC1=CC=CC=C1 C13913 [1,0,0,0,1,0|1,0,0]=3 381 B11R1.40 COC(=O)CC1=CC=CC=C1 D77850 [1,0,0,0,1,0|0,0,1]=3 382 B11R1.40 COC(=O)CC1=CC=NC=C1 28936 [1,0,0,0,1,0|1,0,1]=4 383 B11R1.40 COC(=O)CC1=CN=CC=C1 AB11862 [1,0,0,0,1,0|1,0,1]=4 384 B11R1.40 COC(=O)CC1=NC=CC=C1 63412 [1,0,0,0,1,0|1,0,1]=4 385 B11R1.40 COC(=O)NC1=CC=CC=C1 D70137 [1,0,0,0,1,0|1,0,0]=3 386 B11R1.40 COC(=O)OC1=CC=CC=C1 D71100 [1,0,0,0,1,0|1,0,0]=3 387 B11R1.40 C\C(=C/C1=CC=CC=C1)CO W13161 [1,0,0,0,1,0|2,0,0]=4 388 B11R1.40 O=C(CBr)NC1=CC=CC=C1 27931 [1,0,0,0,1,0|2,0,0]=4 389 B11R1.40 O=C(CBr)OC1=CC=CC=C1 F14277 [1,0,0,0,1,0|2,0,0]=4 390 B11R1.40 O=C(CCl)NC1=CC=CC=C1 W18660 [1,0,0,0,1,0|2,0,0]=4 391 B11R1.40 O=C(CI)NC1=CC=CC=C1 F53134 [1,0,0,0,1,0|2,0,0]=4 392 B11R1.16 CCCC(=O)C1=CC=NC=C1 O10325 [0,0,0,0,2,0|2,0,0]=4 393 B11R1.16 CCNC(=O)C1=CN=CC=C1 D82018 [0,0,0,0,2,0|2,0,0]=4 394 B11R1.16 CCOC(=N)C1=CC=CC=C1 53592 [0,0,0,0,2,0|1,0,0]=3 395 B11R1.16 CCOC(=N)C1=CC=NC=C1 C75086 [0,0,0,0,2,0|2,0,0]=4 396 B11R1.16 CCOC(=O)C1=CC=CC=C1 20009 [0,0,0,0,2,0|0,0,0]=2 397 B11R1.16 CCOC(=O)C1=CC=NC=C1 D70811 [0,0,0,0,2,0|1,0,0]=3 398 B11R1.16 CCOC(=O)C1=CN=CC=C1 67658 [0,0,0,0,2,0|1,0,0]=3 399 B11R1.16 CCOC(=O)C1=CN=CN=C1 29343 [0,0,0,0,2,0|2,0,0]=4 400 B11R1.16 CCOC(=O)C1=CN=NC=C1 31255 [0,0,0,0,2,0|2,0,0]=4 401 B11R1.16 CCOC(=O)C1=NC=CC=C1 20505 [0,0,0,0,2,0|1,0,0]=3 402 B11R1.16 CCOC(=O)C1=NC=CC=N1 30551 [0,0,0,0,2,0|2,0,0]=4 403 B11R1.16 CCOC(=O)C1=NC=CN=C1 71251 [0,0,0,0,2,0|2,0,0]=4 404 B11R1.16 CCOC(=O)C1=NC=NC=C1 60710 [0,0,0,0,2,0|2,0,0]=4 405 B11R1.16 CCO[P@@H](=O)C1=CC=CC=C1 D70780 [0,0,0,0,2,0|1,0,0]=3 406 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 65122 [0,0,0,0,2,0|1,0,1]=4 407 B11R1.16 O=C(CCCl)C1=CC=CC=C1 20090 [0,0,0,0,2,0|2,0,0]=4 408 B11R1.16 O=C(NCO)C1=CC=CC=C1 D95962 [0,0,0,0,2,0|2,0,0]=4 409 B11R1.16 O=C(OCCl)C1=CC=CC=C1 A51028 [0,0,0,0,2,0|1,0,0]=3 410 B11R1.16 O=C(OCI)C1=CC=CC=C1 W17100 [0,0,0,0,2,0|1,0,0]=3 411 B11R1.30 CCOC(=O)CC1=CC=CS1 D81743 [0,0,0,0,2,0|1,0,1]=4 412 B11R1.30 CCOC(=O)CC1=CSC=C1 A11146 [0,0,0,0,2,0|1,0,1]=4 413 B15R1.778 CCCC(=O)OCC=CC1=CC=CC=C1 D95717 [0,0,0,0,0,2|1,0,0]=3 414 B15R1.778 CCOC(=O)CCCOC1=CC=CC=C1 D92099 [0,0,0,0,0,2|0,0,2]=4 415 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 60927 [0,0,0,0,0,2|0,0,2]=4 416 B15R1.778 CCOC(=O)\C=C\CCC1=CC=CC=C1 D93497 [0,0,0,0,0,2|0,0,0]=2