0 B11R1.91 C=C(C)OCC1=CC=CC=C1 2607-1-1T [0,0,0,0,0,0|3,0,0]=3 1 B11R1.91 CC(=N)NCC1=CC=CC=N1 3H41-H-02 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.91 CC(=N)NCC1=CC=CN=C1 3H41-H-01 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.91 CC(=O)C#CC1=CC=CC=C1 2617-1-1J [0,0,0,0,0,0|1,0,2]=3 4 B11R1.91 CC(=O)CSC1=CC=CC=C1 6666-1-X8 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.91 CC(=O)NCC1=CC=CC=C1 4648-1-4F [0,0,0,0,0,0|2,0,0]=2 6 B11R1.91 CC(=O)NCC1=CC=CN=C1 4H48-1-0X [0,0,0,0,0,0|3,0,0]=3 7 B11R1.91 CC(=O)NNC1=CC=CC=C1 4639-1-03 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.91 CC(=O)OCC1=CC=CC=C1 2623-1-4E [0,0,0,0,0,0|2,0,0]=2 9 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 2617-1-0Z [0,0,0,0,0,0|1,0,2]=3 10 B11R1.91 CC(=O)\C=C\C1=CC=C[NH+]=C1 4H33-5-15 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.91 CC(C)CCC1=CC=CC=C1 1700-1-38 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.91 CC(Cl)COC1=CC=CC=C1 2607-5-24 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.91 CC(F)COC1=CC=CC=C1 2607-3-0C [0,0,0,0,0,0|3,0,1]=4 14 B11R1.91 CC(O)C#CC1=CC=CC=C1 2902-1-01 [0,0,0,0,0,0|1,0,3]=4 15 B11R1.91 C[C@@H](O)CCC1=CC=CC=C1 2602-1-R1 [0,0,0,0,0,0|1,0,1]=2 16 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 2602-1-S1 [0,0,0,0,0,0|1,0,1]=2 17 B11R1.91 N=C(N)CCC1=CC=CC=C1 3641-5-04 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.91 N=C(N)NCC1=CC=CC=C1 4641-1-00 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.91 NC(=O)C#CC1=CC=CC=C1 4948-1-03 [0,0,0,0,0,0|1,0,2]=3 20 B11R1.91 NC(=O)CCC1=CC=CC=C1 4648-1-2Y [0,0,0,0,0,0|1,0,0]=1 21 B11R1.91 NC(=O)CSC1=CC=CC=C1 8666-1-0K [0,0,0,0,0,0|2,0,0]=2 22 B11R1.91 NC(=O)NCC1=CC=CC=C1 4653-1-07 [0,0,0,0,0,0|2,0,0]=2 23 B11R1.91 NC(=O)NCC1=CC=CN=C1 4H53-1-21 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.91 NC(=S)COC1=CC=CC=C1 8667-1-01 [0,0,0,0,0,0|2,1,0]=3 25 B11R1.91 NC(=S)CSC1=CC=CC=C1 7667-1-17 [0,0,0,0,0,0|2,1,0]=3 26 B11R1.91 NC(=S)NNC1=CC=CC=C1 7667-1-19 [0,0,0,0,0,0|3,1,0]=4 27 B11R1.91 NC(N)=NCC1=CC=CC=C1 4741-1-05 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 2616-5-0J [0,0,0,0,0,0|1,0,2]=3 29 B11R1.91 O=C(O)C#CC1=CC=CC=C1 2621-1-1S [0,0,0,0,0,0|0,0,2]=2 30 B11R1.91 O=C(O)CCC1=CC=CC=N1 4H21-1-KE [0,0,0,0,0,0|1,0,0]=1 31 B11R1.91 O=C(O)CNC1=CC=CC=C1 4657-1-0D [0,0,0,0,0,0|1,0,0]=1 32 B11R1.91 O=C(O)COC1=CC=CN=C1 4H22-3-00 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.91 O=C(O)COC1=CC=CN=C1 4H58-1-117 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.91 O=C(O)CSC1=CC=CC=C1 6666-1-1S [0,0,0,0,0,0|1,0,0]=1 35 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 2921-1-X0 [0,0,0,0,0,0|0,0,2]=2 36 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 4954-1-79 [0,0,0,0,0,0|1,0,3]=4 37 B10R1.17 BrCCSC1=CC=CC=C1 6666-9-05 [1,0,0,0,0,0|2,0,1]=4 38 B10R1.17 C#CCCC1=CC=CC=C1 1900-1-0F [1,0,0,0,0,0|1,0,1]=3 39 B10R1.17 C#CCOC1=CC=CC=C1 2907-1-X4 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.17 C=CCCC1=CC=CC=C1 1900-1-43 [1,0,0,0,0,0|1,0,0]=2 41 B10R1.17 C=CCNC1=CC=CC=C1 3631-1-0V [1,0,0,0,0,0|2,0,0]=3 42 B10R1.17 C=CCNC1=CN=CC=C1 3H31-1-BZ [1,0,0,0,0,0|3,0,0]=4 43 B10R1.17 C=CCOC1=CC=CC=C1 2607-1-0K [1,0,0,0,0,0|2,0,0]=3 44 B10R1.17 C=COCC1=CC=CC=C1 2907-1-01 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.17 CCCCC1=CC=CN=C1 3H32-1-JE [1,0,0,0,0,0|2,0,1]=4 46 B10R1.17 CCCC[N+]1=CC=CC=C1 3H33-5-1Z [1,0,0,0,0,0|2,0,1]=4 47 B10R1.17 CCCC[N+]1=CC=CC=C1 7H60-3-29 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.17 CCCC[N+]1=CC=CC=C1 7H73-3-01 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.17 CCCNC1=CC=CC=C1 3631-1-0M [1,0,0,0,0,0|2,0,1]=4 50 B10R1.17 CCCOC1=CC=CC=C1 2607-1-1S [1,0,0,0,0,0|2,0,1]=4 51 B10R1.17 CNCCC1=CC=CN=C1 3H31-5-64 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.17 CNCCC1=CC=NC=C1 3H31-1-17 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.17 CNCCC1=CC=NC=C1 3H31-5-93 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.17 COCCC1=CC=CC=C1 2607-1-0N [1,0,0,0,0,0|2,0,0]=3 55 B10R1.17 COCCC1=NC=CC=C1 4H07-1-6R [1,0,0,0,0,0|3,0,0]=4 56 B10R1.17 ClCCOC1=CC=CC=C1 2607-5-00 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.17 ClCOCC1=CC=CC=C1 2607-5-2Q [1,0,0,0,0,0|2,0,1]=4 58 B10R1.17 FCCNC1=CC=CC=C1 3631-3-0A [1,0,0,0,0,0|2,0,1]=4 59 B10R1.17 N#CCCC1=CC=CC=C1 3637-1-0U [1,0,0,0,0,0|1,0,1]=3 60 B10R1.17 N#CCOC1=CC=CC=C1 4637-1-T5 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.17 N#CSCC1=CC=CC=C1 7668-1-M3 [1,0,0,0,0,0|2,0,1]=4 62 B10R1.17 NCCCC1=CC=CN=C1 3H30-1-FT [1,0,0,0,0,0|2,0,1]=4 63 B10R1.17 NCCSC1=CC=CC=C1 7H66-1-0L [1,0,0,0,0,0|2,0,1]=4 64 B10R1.17 O=C=NCC1=CC=CC=C1 4649-1-X4 [1,0,0,0,0,0|1,0,1]=3 65 B10R1.17 O=CCCC1=CC=CC=C1 2615-1-0W [1,0,0,0,0,0|0,0,0]=1 66 B10R1.17 O=CCCC1=CC=CN=C1 4H15-1-1S [1,0,0,0,0,0|1,0,0]=2 67 B10R1.17 O=COCC1=CC=CC=C1 2615-1-0P [1,0,0,0,0,0|1,0,0]=2 68 B10R1.17 O=C\C=C\C1=CC=CC=C1 2915-1-02 [1,0,0,0,0,0|0,0,2]=3 69 B10R1.17 O=C\C=C\C1=CC=CC=C1 2915-1-0A [1,0,0,0,0,0|0,0,2]=3 70 B10R1.17 OCCCC1=CC=CC=C1 2601-1-0D [1,0,0,0,0,0|0,0,1]=2 71 B10R1.17 OCCCC1=CC=CC=N1 4H01-5-2G [1,0,0,0,0,0|1,0,1]=3 72 B10R1.17 OCCCC1=CC=NC=C1 4H01-1-74 [1,0,0,0,0,0|1,0,1]=3 73 B10R1.17 OCCNC1=CC=CC=C1 4631-1-05 [1,0,0,0,0,0|1,0,1]=3 74 B10R1.17 OCCSC1=CC=CC=C1 6666-1-03 [1,0,0,0,0,0|1,0,1]=3 75 B10R1.17 OCCSC1=CC=CC=N1 8H66-1-80 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.17 SCCCC1=CC=NC=C1 7H61-1-03 [1,0,0,0,0,0|1,1,1]=4 77 B10R1.17 SCCCC1=CN=CC=C1 7H61-1-02 [1,0,0,0,0,0|1,1,1]=4 78 B10R1.17 SCCCC1=NC=CC=C1 7H61-1-01 [1,0,0,0,0,0|1,1,1]=4 79 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 3637-1-0A [1,0,0,0,0,0|2,0,0]=3 80 B10R1.17 [C-]#[N+]CCC1=CC=NC=C1 3H37-1-AX [1,0,0,0,0,0|3,0,0]=4 81 B10R1.17 [O-]CCNC1=CC=CC=C1 4656-1-7K [1,0,0,0,0,0|1,0,2]=4 82 B12R1.21 C=C(Br)CCC1=CC=C(Br)C=C1 1900-9-13 [0,1,0,0,0,0|2,0,0]=3 83 B12R1.21 C=C(Br)CCC1=CC=C(C)C=C1 1900-9-07 [0,1,0,0,0,0|2,0,0]=3 84 B12R1.21 C=C(Br)CCC1=CC=C(Cl)C=C1 1900-D-01 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.21 C=C(C)CCC1=CC=C(Br)C=C1 1900-9-02 [0,1,0,0,0,0|2,0,0]=3 86 B12R1.21 C=C(C)CCC1=CC=C(C)C=C1 1900-1-11 [0,1,0,0,0,0|2,0,0]=3 87 B12R1.21 C=C(C)CCC1=CC=C(Cl)C=C1 1900-5-09 [0,1,0,0,0,0|2,0,0]=3 88 B12R1.21 C=C(Cl)CCC1=CC=C(Br)C=C1 1900-D-07 [0,1,0,0,0,0|2,0,0]=3 89 B12R1.21 C=C(Cl)CCC1=CC=C(C)C=C1 1900-5-19 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.21 C=C(Cl)CCC1=CC=C(Cl)C=C1 1900-5-25 [0,1,0,0,0,0|2,0,0]=3 91 B12R1.21 CC(=O)CCC1=CC=C(F)C=C1 2717-3-29 [0,1,0,0,0,0|1,0,0]=2 92 B12R1.21 CC(=O)COC1=CC=C(F)C=C1 2617-3-3B [0,1,0,0,0,0|2,0,0]=3 93 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 4748-3-19 [0,1,0,0,0,0|2,0,0]=3 94 B12R1.21 CC(=O)NNC1=CC=C(Br)C=C1 4648-9-48 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.21 CC(=O)OCC1=CC=C(C)C=C1 2723-1-17 [0,1,0,0,0,0|2,0,0]=3 96 B12R1.21 CC(=O)OCC1=CN=C(Cl)C=C1 4H23-5-4M [0,1,0,0,0,0|3,0,0]=4 97 B12R1.21 CC(=O)\C=C\C1=CC=C(C)C=C1 2917-1-0M [0,1,0,0,0,0|1,0,2]=4 98 B12R1.21 CC(=O)\C=C\C1=CC=C(Cl)C=C1 2917-5-19 [0,1,0,0,0,0|1,0,2]=4 99 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 2917-3-X3 [0,1,0,0,0,0|1,0,2]=4 100 B12R1.21 CC1=CC=C(CNC(N)=O)C=C1 4H53-1-0X [0,1,0,0,0,0|2,0,0]=3 101 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 2721-1-3P [0,1,0,0,0,0|1,0,0]=2 102 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 4756-5-X4 [0,1,0,0,0,0|3,0,0]=4 103 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 4641-5-01 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 4641-3-01 [0,1,0,0,0,0|3,0,0]=4 105 B12R1.21 N=C(N)COC1=CC=C(F)C=C1 4641-7-01 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.21 NC(=O)C#CC1=CC=C(Cl)C=C1 4648-5-3G [0,1,0,0,0,0|1,0,2]=4 107 B12R1.21 NC(=O)COC1=CC=C(F)C=C1 4648-3-89 [0,1,0,0,0,0|2,0,0]=3 108 B12R1.21 NC(=O)NCC1=CC=C(Cl)C=C1 4653-5-0C [0,1,0,0,0,0|2,0,0]=3 109 B12R1.21 NC1=CC=C(CCC(=O)O)C=N1 4H56-1-JE [0,1,0,0,0,0|1,0,0]=2 110 B12R1.21 NC1=CC=C(SCC(=O)O)C=C1 8666-1-05 [0,1,0,0,0,0|1,0,0]=2 111 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 4957-1-03 [0,1,0,0,0,0|0,0,2]=3 112 B12R1.21 O=C(Cl)COC1=CC=C(Cl)C=C1 2616-5-27 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 2621-5-0X [0,1,0,0,0,0|0,0,2]=3 114 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 4657-5-0P [0,1,0,0,0,0|1,0,0]=2 115 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 2621-9-29 [0,1,0,0,0,0|1,0,0]=2 116 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 2621-H-11 [0,1,0,0,0,0|1,0,0]=2 117 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 2629-1-X4 [0,1,0,0,0,0|1,0,0]=2 118 B12R1.21 O=C(O)CSC1=CC=C(F)C=C1 6666-3-X2 [0,1,0,0,0,0|1,0,0]=2 119 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 2921-9-X2 [0,1,0,0,0,0|0,0,2]=3 120 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 2921-H-00 [0,1,0,0,0,0|0,0,2]=3 121 B12R1.21 O=C(O)\C=C\C1=NC=C(F)C=C1 4H21-7-0L [0,1,0,0,0,0|1,0,2]=4 122 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 2923-1-28 [0,1,0,0,0,0|2,0,0]=3 123 B12R1.27 C#CC(O)CCC1=CC=CC=C1 2902-1-00 [0,1,0,0,0,0|1,0,1]=3 124 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 4948-1-00 [0,1,0,0,0,0|2,0,0]=3 125 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 2624-1-02 [0,1,0,0,0,0|2,0,0]=3 126 B12R1.27 CC(\C=C\C1=CC=CC=C1)=N/O 4947-1-04 [0,1,0,0,0,0|1,0,2]=4 127 B12R1.27 COC(=O)CCC1=CC=NC=C1 4H23-1-HZ [0,1,0,0,0,0|1,0,0]=2 128 B12R1.27 COC(=O)CCC1=CN=CN=C1 4H23-1-29 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.27 COC(=O)CSC1=CC=CC=C1 6666-1-25 [0,1,0,0,0,0|1,0,0]=2 130 B12R1.27 COC(=O)\C=C\C1=CN=CC=C1 4H24-1-00 [0,1,0,0,0,0|1,0,2]=4 131 B12R1.27 N#CC(=O)\C=C\C1=CC=CC=C1 4646-1-X0 [0,1,0,0,0,0|1,0,2]=4 132 B12R1.27 NCC(=O)OCC1=CC=CC=C1 4658-1-6S [0,1,0,0,0,0|2,0,0]=3 133 B12R1.27 NCC(O)COC1=CC=CC=C1 4656-5-0P [0,1,0,0,0,0|2,0,1]=4 134 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 2617-9-0P [0,1,0,0,0,0|1,0,0]=2 135 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 2623-9-X0 [0,1,0,0,0,0|2,0,0]=3 136 B12R1.27 O=C(CCl)COC1=CC=CC=C1 2617-5-38 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 2623-5-0V [0,1,0,0,0,0|2,0,0]=3 138 B12R1.27 O=C(CO)OCC1=CC=CC=C1 2629-1-2N [0,1,0,0,0,0|1,0,0]=2 139 B12R1.43 CC(=O)C(C)OC1=CC=CC=C1 2617-1-0H [0,1,0,0,0,0|2,0,0]=3 140 B12R1.43 CC(=O)N(C)CC1=CC=CN=C1 4H48-1-94 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O 2621-1-W4 [0,1,0,0,0,0|1,0,0]=2 142 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O 2621-1-S0 [0,1,0,0,0,0|1,0,0]=2 143 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)Cl 2916-5-03 [0,1,0,0,0,0|1,0,2]=4 144 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 2621-1-2H [0,1,0,0,0,0|0,0,2]=3 145 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 4648-5-R0 [0,1,0,0,0,0|1,0,0]=2 146 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O 4657-1-1E [0,1,0,0,0,0|0,0,0]=1 147 B12R1.43 NC(CC1=CC=CC=N1)C(=O)O 4H57-5-X1 [0,1,0,0,0,0|1,0,0]=2 148 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O 4H57-1-08 [0,1,0,0,0,0|1,0,0]=2 149 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 4757-1-S0 [0,1,0,0,0,0|0,0,0]=1 150 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O 4H57-1-X0 [0,1,0,0,0,0|1,0,0]=2 151 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O 4H57-1-W8 [0,1,0,0,0,0|1,0,0]=2 152 B12R1.43 O=C(O)C(=O)CC1=CC=NC=C1 4H29-1-5F [0,1,0,0,0,0|1,0,1]=3 153 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 4657-1-33 [0,1,0,0,0,0|1,0,1]=3 154 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 2629-1-2L [0,1,0,0,0,0|0,0,0]=1 155 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 2621-9-S1 [0,1,0,0,0,0|0,0,0]=1 156 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 2629-1-S2 [0,1,0,0,0,0|0,0,0]=1 157 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 2629-1-R2 [0,1,0,0,0,0|0,0,0]=1 158 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 2921-3-X2 [0,1,0,0,0,0|0,0,2]=3 159 B12R1.43 [C@H](N)(CC1=CC=CC=N1)C(=O)O 4H57-1-Y5 [0,1,0,0,0,0|1,0,0]=2 160 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 4648-1-4Y [0,1,0,0,0,0|2,0,0]=3 161 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 2623-1-2B [0,1,0,0,0,0|2,0,0]=3 162 B12R1.107 C\C(=C/C(=O)O)C1=CC=CC=C1 2921-1-25 [0,1,0,0,0,0|0,0,2]=3 163 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 4H57-1-92 [0,1,0,0,0,0|1,0,0]=2 164 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 4657-1-S5 [0,1,0,0,0,0|0,0,0]=1 165 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 4630-1-R0 [0,1,0,0,0,0|0,0,0]=1 166 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 2629-1-3V [0,1,0,0,0,0|0,0,0]=1 167 B12R1.107 O=C(O)\C=C(/Br)C1=CC=CC=C1 2921-9-X1 [0,1,0,0,0,0|0,0,2]=3 168 B12R1.125 C=C(Br)CCC1=CC=CC=C1C 1900-9-11 [0,1,0,0,0,0|2,0,0]=3 169 B12R1.125 C=C(Br)CCC1=CC=CC=C1Cl 1900-D-05 [0,1,0,0,0,0|2,0,0]=3 170 B12R1.125 C=C(C)CCC1=CC=CC=C1Br 1900-9-17 [0,1,0,0,0,0|2,0,0]=3 171 B12R1.125 C=C(C)CCC1=CC=CC=C1C 1900-1-19 [0,1,0,0,0,0|2,0,0]=3 172 B12R1.125 C=C(C)CCC1=CC=CC=C1Cl 1900-5-13 [0,1,0,0,0,0|2,0,0]=3 173 B12R1.125 C=C(Cl)CCC1=C(Cl)C=CC=C1 1900-5-29 [0,1,0,0,0,0|2,0,0]=3 174 B12R1.125 C=C(Cl)CCC1=CC=CC=C1C 1900-5-23 [0,1,0,0,0,0|2,0,0]=3 175 B12R1.125 CC(=O)\C=C\C1=CC=CC=C1F 2621-3-6M [0,1,0,0,0,0|1,0,2]=4 176 B12R1.125 CC1=CC=CC=C1CSC(=N)N 7767-5-15 [0,1,0,0,0,0|3,0,0]=4 177 B12R1.125 CC1=CC=CC=C1OCC(=O)O 2721-1-3N [0,1,0,0,0,0|1,0,0]=2 178 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O 2921-1-32 [0,1,0,0,0,0|0,0,2]=3 179 B12R1.125 NC(=O)NCC1=C(Cl)C=CC=C1 4653-5-0E [0,1,0,0,0,0|2,0,0]=3 180 B12R1.125 NC(=S)COC1=CC=CC=C1Cl 8667-5-07 [0,1,0,0,0,0|2,1,0]=4 181 B12R1.125 O=C(Cl)CCC1=CC=CC=C1F 2716-7-X6 [0,1,0,0,0,0|1,0,0]=2 182 B12R1.125 O=C(O)CCC1=CC=CC=C1I 2721-H-06 [0,1,0,0,0,0|0,0,0]=1 183 B12R1.125 O=C(O)CCC1=CC=CN=C1F 4H21-3-7L [0,1,0,0,0,0|1,0,0]=2 184 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 4657-3-0E [0,1,0,0,0,0|1,0,0]=2 185 B12R1.125 O=C(O)CNC1=CC=CC=C1Cl 4658-5-0T [0,1,0,0,0,0|1,0,0]=2 186 B12R1.125 O=C(O)COC1=CC=CC=C1F 2621-3-0C [0,1,0,0,0,0|1,0,0]=2 187 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 G311-A-48 [0,1,0,0,0,0|0,0,2]=3 188 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br 2921-9-02 [0,1,0,0,0,0|0,0,2]=3 189 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl 2921-5-02 [0,1,0,0,0,0|0,0,2]=3 190 B12R1.226 C=C(Br)CCC1=CC=CC(Br)=C1 1900-9-15 [0,1,0,0,0,0|2,0,0]=3 191 B12R1.226 C=C(Br)CCC1=CC=CC(C)=C1 1900-9-09 [0,1,0,0,0,0|2,0,0]=3 192 B12R1.226 C=C(Br)CCC1=CC=CC(Cl)=C1 1900-D-03 [0,1,0,0,0,0|2,0,0]=3 193 B12R1.226 C=C(C)CCC1=CC=CC(Br)=C1 1900-9-05 [0,1,0,0,0,0|2,0,0]=3 194 B12R1.226 C=C(C)CCC1=CC=CC(C)=C1 1900-1-15 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.226 C=C(C)CCC1=CC=CC(Cl)=C1 1900-5-11 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.226 C=C(Cl)CCC1=CC=CC(Br)=C1 1900-D-09 [0,1,0,0,0,0|2,0,0]=3 197 B12R1.226 C=C(Cl)CCC1=CC=CC(C)=C1 1900-5-21 [0,1,0,0,0,0|2,0,0]=3 198 B12R1.226 C=C(Cl)CCC1=CC=CC(Cl)=C1 1900-5-27 [0,1,0,0,0,0|2,0,0]=3 199 B12R1.226 CC(=O)CCC1=CC=CC(Br)=C1 2617-9-0B [0,1,0,0,0,0|1,0,0]=2 200 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 2721-1-3M [0,1,0,0,0,0|1,0,0]=2 201 B12R1.226 N=C(N)NCC1=CC=CC(I)=C1 8764-H-01 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.226 N=C(N)NCC1=CC=CC(I)=C1 8764-H-10 [0,1,0,0,0,0|3,0,0]=4 203 B12R1.226 N=C([NH3+])NCC1=CC=CC(Br)=C1 8764-9-09 [0,1,0,0,0,0|3,0,0]=4 204 B12R1.226 NC(=O)COC1=CC=CC(Cl)=C1 4648-5-66 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.226 NC(=O)NNC1=CC=CC(F)=C1 4653-3-05 [0,1,0,0,0,0|3,0,0]=4 206 B12R1.226 NC(=S)COC1=CC=CC(Cl)=C1 8667-5-08 [0,1,0,0,0,0|2,1,0]=4 207 B12R1.226 N\C([NH3+])=N/CC1=CC=CC(Br)=C1 8741-9-01 [0,1,0,0,0,0|3,0,0]=4 208 B12R1.226 O=C(Cl)\C=C\C1=CC(F)=CC=C1 2616-7-0B [0,1,0,0,0,0|1,0,2]=4 209 B12R1.226 O=C(O)CNC1=CC(F)=CC=C1 4657-3-13 [0,1,0,0,0,0|1,0,0]=2 210 B12R1.226 O=C(O)CNC1=NC(Cl)=CN=C1 4F57-5-00 [0,1,0,0,0,0|3,0,0]=4 211 B12R1.226 O=C(O)COC1=CC=CC(Cl)=C1 2621-5-33 [0,1,0,0,0,0|1,0,0]=2 212 B12R1.226 O=C(O)\C=C\C1=CC(I)=CC=C1 2621-H-0A [0,1,0,0,0,0|0,0,2]=3 213 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 2929-1-09 [0,1,0,0,0,0|0,0,2]=3 214 B12R1.226 O=C(O)\C=C\C1=CN=CC(Br)=C1 4H58-9-1U [0,1,0,0,0,0|1,0,2]=4 215 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 2602-1-04 [0,1,0,0,0,0|1,0,1]=3 216 B12R1.891 CS(=O)(=O)SCC1=CC=CC=C1 6764-1-06 [0,1,0,0,0,0|2,0,1]=4 217 B12R1.891 FC(F)(F)CCC1=CC=CC=C1 1700-3-X7 [0,1,0,0,0,0|2,0,1]=4 218 B12R1.891 F[B-](F)(F)CCC1=CC=CC=C1 5660-3-03 [0,1,0,0,0,0|3,0,0]=4 219 B12R1.891 NS(=O)(=O)CCC1=CC=NC=C1 8H69-1-1R [0,1,0,0,0,0|2,0,1]=4 220 B12R1.891 O=P(O)(O)CCC1=CC=CC=C1 6777-1-03 [0,1,0,0,0,0|1,0,0]=2 221 B12R1.891 O=S(=O)(O)CCC1=NC=CC=C1 8H64-1-0H [0,1,0,0,0,0|2,0,0]=3 222 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4H48-1-GG [0,0,0,1,0,0|1,0,0]=2 223 B12R2.24 CC1CCC2=CC=CC=C2N1 3H31-1-CU [0,0,0,1,0,0|2,0,1]=4 224 B12R2.24 CC1CNC2=CC=CC=C2O1 4H44-1-40 [0,0,0,1,0,0|2,0,1]=4 225 B12R2.24 NC1CCC2=CC=CC=C2C1 3633-5-02 [0,0,0,1,0,0|2,0,1]=4 226 B12R2.24 O=C1CC2=CC=CC=C2CN1 4H48-1-5E [0,0,0,1,0,0|2,0,0]=3 227 B12R2.24 O=C1CC2=CC=CC=C2CO1 2625-1-04 [0,0,0,1,0,0|2,0,0]=3 228 B12R2.24 O=C1CCC2=CC=CC=C2O1 2625-1-03 [0,0,0,1,0,0|0,0,0]=1 229 B12R2.24 O=C1CCC2=CC=CN=C2N1 4H17-1-86 [0,0,0,1,0,0|2,0,0]=3 230 B12R2.24 O=C1CNC2=CC=CC=C2N1 4H48-1-04G [0,0,0,1,0,0|2,0,0]=3 231 B12R2.24 O=C1CNC2=CC=CC=C2O1 4H31-1-0W [0,0,0,1,0,0|1,0,0]=2 232 B12R2.24 O=C1COC2=CC=CC=C2N1 4H48-1-PM [0,0,0,1,0,0|2,0,0]=3 233 B12R2.24 O=C1CSC2=CC=CC=C2C1 6H17-1-0C [0,0,0,1,0,0|2,0,0]=3 234 B12R2.24 O=C1CSC2=CC=CC=C2N1 8H70-1-Z5 [0,0,0,1,0,0|2,0,0]=3 235 B12R2.24 O=C1NC2=CC=CC=C2CO1 4H56-1-06H [0,0,0,1,0,0|2,0,0]=3 236 B12R2.24 OC1=NC2=CC=CC=C2N=C1 4H01-1-2A [0,0,0,1,0,0|2,0,1]=4 237 B12R2.24 OC1CNC2=C(C=CC=C2)C1 4H01-1-61 [0,0,0,1,0,0|2,0,1]=4 238 B12R2.24 S=C1COC2=CC=CC=C2N1 8H67-1-24 [0,0,0,1,0,0|2,1,0]=4 239 B12R2.24 SC1=NC2=C(C=CC=C2)CS1 7H61-1-0K [0,0,0,1,0,0|2,1,0]=4 240 B12R2.92 ClC1(Cl)CC1C2=CC=CC=C2 1700-5-32 [0,0,0,1,0,0|2,0,1]=4 241 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 2609-1-05 [0,0,0,1,0,0|2,0,1]=4 242 B12R2.2403 O=S1(=O)NCC2=CC=CC=C21 8H70-1-8Z [0,0,0,1,0,0|2,0,1]=4 243 B10R1.18 CC(=O)CC1=CC=CC=N1 4H17-1-3W [0,0,0,0,1,0|2,0,0]=3 244 B10R1.18 CC(=O)CC1=CC=CN=C1 4H17-1-3P [0,0,0,0,1,0|2,0,0]=3 245 B10R1.18 CC(=O)CC1=CN=NC=C1 4H17-1-07 [0,0,0,0,1,0|3,0,0]=4 246 B10R1.18 CC(=O)NC1=CC=CC=C1 4648-1-5B [0,0,0,0,1,0|2,0,0]=3 247 B10R1.18 CC(=O)NC1=CC=CN=C1 4H48-1-N8 [0,0,0,0,1,0|3,0,0]=4 248 B10R1.18 CC(=O)NC1=NC=CC=C1 4H48-1-09F [0,0,0,0,1,0|3,0,0]=4 249 B10R1.18 CC(=O)OC1=CC=CN=C1 4H23-1-LG [0,0,0,0,1,0|3,0,0]=4 250 B10R1.18 CC(=O)SC1=CC=CC=C1 6666-1-0N [0,0,0,0,1,0|2,0,0]=3 251 B10R1.18 CC(=S)NC1=CC=CC=C1 7667-1-25 [0,0,0,0,1,0|2,1,0]=4 252 B10R1.18 CC(Br)CC1=CC=CC=C1 1700-9-75 [0,0,0,0,1,0|2,0,1]=4 253 B10R1.18 CC(C)=CC1=CC=CC=C1 1900-1-30 [0,0,0,0,1,0|2,0,1]=4 254 B10R1.18 CC(O)CC1=CC=CC=C1 2702-1-04 [0,0,0,0,1,0|1,0,1]=3 255 B10R1.18 FC(Br)CC1=CC=CC=C1 1700-B-61 [0,0,0,0,1,0|2,0,1]=4 256 B10R1.18 FC(F)=CC1=CC=CC=C1 1900-3-54 [0,0,0,0,1,0|2,0,1]=4 257 B10R1.18 FC(F)CC1=CC=CC=C1 1700-3-Y8 [0,0,0,0,1,0|2,0,1]=4 258 B10R1.18 NC(=O)NC1=CC=CC=C1 4653-1-01 [0,0,0,0,1,0|2,0,0]=3 259 B10R1.18 NC(=S)NC1=CC=CC=C1 7667-1-24 [0,0,0,0,1,0|2,1,0]=4 260 B10R1.18 O=C(O)CC1=CC=NC=C1 4H58-1-108 [0,0,0,0,1,0|1,0,0]=2 261 B10R1.18 O=C(O)CC1=CN=CC=N1 4H21-1-CM [0,0,0,0,1,0|2,0,0]=3 262 B10R1.18 O=C(O)CC1=CN=CN=C1 4H21-1-0B [0,0,0,0,1,0|2,0,0]=3 263 B10R1.18 O=C(O)CC1=NC=CC=N1 4H21-1-FN [0,0,0,0,1,0|2,0,0]=3 264 B10R1.18 O=C([O-])CC1=CC=CC=C1 2722-1-40 [0,0,0,0,1,0|0,0,1]=2 265 B10R1.18 OB(O)CC1=CC=CC=C1 6660-1-X7 [0,0,0,0,1,0|1,0,1]=3 266 B10R1.18 S=C(Cl)OC1=CC=CC=C1 6667-5-01 [0,0,0,0,1,0|2,1,0]=4 267 B10R1.66 CC(=O)CSC1=CC=CS1 6H66-1-09 [0,0,0,0,1,0|3,0,0]=4 268 B10R1.66 CC(=O)OC=C1C=CC=C1 2623-1-0Q [0,0,0,0,1,0|2,0,1]=4 269 B10R1.66 CC(=O)OCC1=CC=CO1 2H23-1-16 [0,0,0,0,1,0|3,0,0]=4 270 B10R1.66 NC(=O)NCC1=CC=CO1 4H53-1-20 [0,0,0,0,1,0|3,0,0]=4 271 B10R1.66 O=C(O)CCC1=CC=CO1 2H21-1-X6 [0,0,0,0,1,0|1,0,0]=2 272 B10R1.66 O=C(O)CCC1=CNC=N1 4H21-1-J6 [0,0,0,0,1,0|2,0,0]=3 273 B10R1.66 O=C(O)CCC1=CSC=C1 6H21-1-0G [0,0,0,0,1,0|1,0,0]=2 274 B10R1.66 O=C(O)CCC1=NC=CS1 8H21-1-0H [0,0,0,0,1,0|2,0,0]=3 275 B10R1.66 O=C(O)CCN1C=CC=C1 4H21-1-HA [0,0,0,0,1,0|1,0,0]=2 276 B10R1.66 O=C(O)CCN1C=CC=N1 4H21-1-GX [0,0,0,0,1,0|2,0,0]=3 277 B10R1.66 O=C(O)CCN1C=CN=C1 4H21-1-J7 [0,0,0,0,1,0|2,0,0]=3 278 B10R1.66 O=C(O)CCN1C=NC=N1 4H21-1-W8 [0,0,0,0,1,0|3,0,0]=4 279 B10R1.66 O=C(O)\C=C/C1=CSC=C1 6H21-1-Y3 [0,0,0,0,1,0|1,0,2]=4 280 B10R1.66 O=C(O)\C=C\C1=CC=CN1 4H56-1-KN [0,0,0,0,1,0|1,0,2]=4 281 B10R1.66 O=C(O)\C=C\C1=COC=C1 2H21-1-38 [0,0,0,0,1,0|1,0,2]=4 282 B12R1.252 CC(=O)NCCC1=CC=CC=C1 4748-1-31 [0,0,0,0,0,1|1,0,0]=2 283 B12R1.252 CC(=O)\C=C\NC1=CC=CC=C1 4656-1-1A [0,0,0,0,0,1|1,0,2]=4 284 B12R1.252 CC(=O)\C=N\NC1=CC=CC=C1 4639-1-E0 [0,0,0,0,0,1|2,0,1]=4 285 B12R1.252 CC(C)CNCC1=CC=CC=C1 3631-1-0U [0,0,0,0,0,1|2,0,1]=4 286 B12R1.252 CC(F)CSCC1=CC=CC=C1 5666-3-0B [0,0,0,0,0,1|2,0,1]=4 287 B12R1.252 CN(C)CCOC1=CC=CC=C1 4656-1-9L [0,0,0,0,0,1|3,0,0]=4 288 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 2607-1-R4 [0,0,0,0,0,1|1,0,1]=3 289 B12R1.252 FC(F)CSCC1=CC=CC=C1 5666-3-03 [0,0,0,0,0,1|2,0,1]=4 290 B12R1.252 N=C(N)NCCC1=CC=CC=C1 3641-5-00 [0,0,0,0,0,1|2,0,0]=3 291 B12R1.252 NC(=O)COCC1=CC=CC=C1 4H48-1-06L [0,0,0,0,0,1|1,0,0]=2 292 B12R1.252 NC(=O)NOCC1=CC=CC=C1 4653-1-09 [0,0,0,0,0,1|2,0,0]=3 293 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 2616-5-0L [0,0,0,0,0,1|1,0,0]=2 294 B12R1.252 O=C(Cl)CCOC1=CC=CC=C1 2616-5-21 [0,0,0,0,0,1|1,0,0]=2 295 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 2616-5-0K [0,0,0,0,0,1|1,0,0]=2 296 B12R1.252 O=C(O)CCNC1=CC=CC=C1 4631-1-0D [0,0,0,0,0,1|0,0,0]=1 297 B12R1.252 O=C(O)CCSC1=CC=CC=C1 6666-1-04 [0,0,0,0,0,1|0,0,0]=1 298 B12R1.252 O=C(O)CNCC1=CC=CC=C1 4757-1-17 [0,0,0,0,0,1|0,0,0]=1 299 B12R1.252 OB(O)CCCC1=CC=CC=C1 6660-1-1L [0,0,0,0,0,1|1,0,1]=3 300 B9R1.8 BrCCC1=NC=CC=C1 3H32-9-AQ [2,0,0,0,0,0|2,0,0]=4 301 B9R1.8 Br[Mg]CC1=CC=CC=C1 9712-9-00 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.8 Br[Mg]CC1=CC=CC=C1 9712-9-00T [2,0,0,0,0,0|2,0,0]=4 303 B9R1.8 C=CCC1=CC=CC=C1 1900-1-51 [2,0,0,0,0,0|0,0,1]=3 304 B9R1.8 CCCC1=CC=CC=N1 3H32-1-CG [2,0,0,0,0,0|1,0,1]=4 305 B9R1.8 CCNC1=CC=CC=C1 3631-1-04 [2,0,0,0,0,0|1,0,1]=4 306 B9R1.8 COCC1=CC=CC=C1 2707-1-27 [2,0,0,0,0,0|1,0,1]=4 307 B9R1.8 ClCSC1=CC=CC=C1 5666-5-01 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.8 Cl[Mg]CC1=CC=CC=C1 9712-5-00 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.8 NCCC1=CC=CC=N1 3H30-1-7M [2,0,0,0,0,0|2,0,0]=4 310 B9R1.8 NNCC1=CC=CC=C1 3639-5-08 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.8 NNCC1=CC=CC=C1 3739-5-X3 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.8 NOCC1=CC=CC=C1 4647-1-X2 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.8 O=C=NC1=CC=CC=C1 4649-1-X9 [2,0,0,0,0,0|1,0,1]=4 314 B9R1.8 O=CCC1=CC=CC=C1 2615-1-0X [2,0,0,0,0,0|0,0,0]=2 315 B9R1.8 O=CCC1=CC=CN=C1 4H15-1-2Z [2,0,0,0,0,0|1,0,0]=3 316 B9R1.8 O=CCC1=CC=NC=C1 4H15-1-3A [2,0,0,0,0,0|1,0,0]=3 317 B9R1.8 O=CNC1=NC=CC=C1 4H48-1-09N [2,0,0,0,0,0|2,0,0]=4 318 B9R1.8 O=S=NC1=CC=CC=C1 8668-1-0B [2,0,0,0,0,0|2,0,0]=4 319 B9R1.8 OCCC1=CC=CN=C1 4H01-1-Y3 [2,0,0,0,0,0|1,0,0]=3 320 B9R1.8 OCCC1=CC=NC=N1 4H01-1-22 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.8 OCCC1=CN=CC=N1 4H56-1-0AT [2,0,0,0,0,0|2,0,0]=4 322 B9R1.8 OCCC1=NC=CC=C1 4H01-1-23 [2,0,0,0,0,0|1,0,0]=3 323 B9R1.8 SCCC1=CC=CN=C1 7H61-1-05 [2,0,0,0,0,0|1,1,0]=4 324 B9R1.8 SCCC1=CC=NC=C1 7H60-1-X3 [2,0,0,0,0,0|1,1,0]=4 325 B9R1.8 SCCC1=CC=NC=C1 7H61-5-25 [2,0,0,0,0,0|1,1,0]=4 326 B9R1.8 SCCC1=NC=CC=C1 7H61-1-04 [2,0,0,0,0,0|1,1,0]=4 327 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 3637-1-17 [2,0,0,0,0,0|1,0,1]=4 328 B11R0.148 C\C=C\C=C\C=C\C=C\C(=O)O 2321-1-00 [0,1,1,0,0,0|0,0,2]=4 329 B11R1.1 BrCCCC1=CC=C(Br)C=C1 1700-9-0F [1,1,0,0,0,0|1,0,1]=4 330 B11R1.1 C=CCCC1=CC=C(C)C=C1 1900-1-13 [1,1,0,0,0,0|1,0,0]=3 331 B11R1.1 C=CCOC1=CC=C(C)C=C1 2707-1-0Z [1,1,0,0,0,0|2,0,0]=4 332 B11R1.1 CC1=CC=C(OCCO)C=C1 2707-1-0U [1,1,0,0,0,0|1,0,1]=4 333 B11R1.1 CC1=CC=C(\C=C\C=O)C=C1 2715-1-0U [1,1,0,0,0,0|0,0,2]=4 334 B11R1.1 CCCCC1=CC=C(Cl)C=C1 1700-5-Y6 [1,1,0,0,0,0|1,0,1]=4 335 B11R1.1 CCCCC1=CC=C(I)C=C1 1700-H-17 [1,1,0,0,0,0|1,0,1]=4 336 B11R1.1 CCCCC1=CC=C(N)C=C1 3730-1-00 [1,1,0,0,0,0|1,0,1]=4 337 B11R1.1 CCCCC1=CC=C(O)C=C1 2701-1-17 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.1 CNCCC1=CC=C(F)C=C1 3731-3-03 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.1 CNCCC1=CC=C(O)C=C1 4631-1-0W [1,1,0,0,0,0|2,0,0]=4 340 B11R1.1 COCCC1=CC=C(O)C=C1 2607-1-1D [1,1,0,0,0,0|2,0,0]=4 341 B11R1.1 ClCCCC1=CC=C(Cl)C=C1 1700-5-00 [1,1,0,0,0,0|1,0,1]=4 342 B11R1.1 NC1=CC=C(NCCO)C=C1 4631-5-03 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.1 NCCCC1=CC=C(Cl)C=C1 3630-5-0E [1,1,0,0,0,0|1,0,1]=4 344 B11R1.1 NCCCC1=CC=C(O)C=C1 4656-1-2H [1,1,0,0,0,0|1,0,1]=4 345 B11R1.1 O=C=NCC1=CC=C(F)C=C1 4649-3-05 [1,1,0,0,0,0|1,0,1]=4 346 B11R1.1 O=CCCC1=CC=C(F)C=C1 2615-3-0A [1,1,0,0,0,0|0,0,0]=2 347 B11R1.1 O=C\C=C\C1=CC=C(Cl)C=C1 2615-5-0Q [1,1,0,0,0,0|0,0,2]=4 348 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 2615-3-1P [1,1,0,0,0,0|0,0,2]=4 349 B11R1.1 OCCCC1=CC=C(F)C=C1 2601-3-0M [1,1,0,0,0,0|0,0,1]=3 350 B11R1.1 OCCCC1=CC=C(O)C=C1 2604-1-0F [1,1,0,0,0,0|0,0,1]=3 351 B11R1.1 OCCOC1=CC=C(F)C=C1 2607-3-1N [1,1,0,0,0,0|1,0,1]=4 352 B11R1.16 C#CCC(N)C1=CC=CC=C1 3930-5-02 [1,1,0,0,0,0|1,0,1]=4 353 B11R1.16 CC(N=C=O)C1=CC=CC=C1 4649-1-0F [1,1,0,0,0,0|1,0,1]=4 354 B11R1.16 CC(NC=O)C1=CC=NC=C1 4H48-1-3K [1,1,0,0,0,0|2,0,0]=4 355 B11R1.16 CCCC(O)C1=CC=CC=C1 2602-1-0G [1,1,0,0,0,0|1,0,1]=4 356 B11R1.16 CNCC(O)C1=CC=CC=C1 4631-1-08 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 4656-1-S7 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.16 COC[C@H](N)C1=CC=CC=C1 4656-1-R7 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.16 NC(CCO)C1=CC=CC=C1 4756-1-0D [1,1,0,0,0,0|0,0,1]=3 360 B11R1.16 NCCC(O)C1=CC=CC=C1 4630-1-27 [1,1,0,0,0,0|1,0,1]=4 361 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 4656-1-SL [1,1,0,0,0,0|0,0,1]=3 362 B11R1.16 OC(CCCl)C1=CC=CC=C1 2602-5-02 [1,1,0,0,0,0|1,0,1]=4 363 B11R1.16 OCC[C@@H](O)C1=CC=CC=C1 2604-1-R2 [1,1,0,0,0,0|0,0,1]=3 364 B11R1.17 BrCCCC1=CC=CC=C1Br 1700-9-0G [1,1,0,0,0,0|1,0,1]=4 365 B11R1.17 C=CCCC1=CC=CC=C1Br 1900-9-19 [1,1,0,0,0,0|1,0,0]=3 366 B11R1.17 C=CCCC1=CC=CC=C1C 1900-1-21 [1,1,0,0,0,0|1,0,0]=3 367 B11R1.17 C=CCCC1=CC=CC=C1Cl 1900-5-08 [1,1,0,0,0,0|1,0,0]=3 368 B11R1.17 C=CCOC1=CC=CC=C1O 2607-1-0Y [1,1,0,0,0,0|2,0,0]=4 369 B11R1.17 CC1=C(NCCO)C=CC=C1 4756-1-2U [1,1,0,0,0,0|1,0,1]=4 370 B11R1.17 CCCCC1=CC=CC=C1N 3730-1-0P [1,1,0,0,0,0|1,0,1]=4 371 B11R1.17 NC1=CC=CC=C1NCCO 4631-1-04 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.17 O=C=NCC1=CC=CC=C1F 4649-3-X5 [1,1,0,0,0,0|1,0,1]=4 373 B11R1.17 O=CCCC1=C(O)C=CC=C1 2615-1-85 [1,1,0,0,0,0|0,0,0]=2 374 B11R1.17 O=CCCC1=CC=CC=C1F 2615-3-1L [1,1,0,0,0,0|0,0,0]=2 375 B11R1.17 OCCCC1=C(Cl)C=CC=C1 2601-5-0Q [1,1,0,0,0,0|0,0,1]=3 376 B11R1.17 OCCCC1=CC=CC=C1F 2601-3-0P [1,1,0,0,0,0|0,0,1]=3 377 B11R1.17 OCCOC1=CC=CC=C1O 2607-1-13 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.24 C=CCCC1=CC=CC(C)=C1 1900-1-17 [1,1,0,0,0,0|1,0,0]=3 379 B11R1.24 CC1=CC=CC(OCCO)=C1 2707-1-1W [1,1,0,0,0,0|1,0,1]=4 380 B11R1.24 N#CCCC1=CC(F)=CC=C1 3737-3-X8 [1,1,0,0,0,0|1,0,1]=4 381 B11R1.24 OCCCC1=CC(O)=CC=C1 2604-1-0S [1,1,0,0,0,0|0,0,1]=3 382 B11R1.24 OCCCC1=CC=CC(Cl)=C1 2601-5-0N [1,1,0,0,0,0|0,0,1]=3 383 B11R1.24 OCCOC1=CC=CC(O)=C1 2604-1-16 [1,1,0,0,0,0|1,0,1]=4 384 B11R1.28 BrCCOCC1=CC=CC=C1 2607-9-0K [1,1,0,0,0,0|1,0,1]=4 385 B11R1.28 BrCCSCC1=CC=CC=C1 5666-9-00 [1,1,0,0,0,0|1,0,1]=4 386 B11R1.28 C=CCNCC1=CC=CC=C1 3631-1-0A [1,1,0,0,0,0|1,0,0]=3 387 B11R1.28 C=CCOCC1=CC=CC=C1 2907-1-17 [1,1,0,0,0,0|1,0,0]=3 388 B11R1.28 CCCCCC1=CC=CC=C1 1700-1-25 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.28 CCCNCC1=CC=CC=C1 3631-1-0J [1,1,0,0,0,0|1,0,1]=4 390 B11R1.28 CNCCCC1=CC=CC=C1 3731-1-X1 [1,1,0,0,0,0|1,0,1]=4 391 B11R1.28 CNCCOC1=CC=CC=C1 4656-5-00 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.28 ClCCCOC1=CC=CC=C1 2607-5-0T [1,1,0,0,0,0|1,0,1]=4 393 B11R1.28 ClCCOCC1=CC=CC=C1 2607-5-1C [1,1,0,0,0,0|1,0,1]=4 394 B11R1.28 ClCCSCC1=CC=CC=C1 5666-5-0B [1,1,0,0,0,0|1,0,1]=4 395 B11R1.28 FCCCOC1=CC=CC=C1 2607-3-1A [1,1,0,0,0,0|1,0,1]=4 396 B11R1.28 N#CCCOC1=CC=CC=C1 4637-1-3E [1,1,0,0,0,0|1,0,1]=4 397 B11R1.28 N#CCNCC1=CC=CC=C1 3637-1-0K [1,1,0,0,0,0|1,0,1]=4 398 B11R1.28 NCCCCC1=CC=CC=C1 3730-1-48 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.28 NCCCOC1=CC=CC=C1 4656-5-2X [1,1,0,0,0,0|1,0,1]=4 400 B11R1.28 NCCNCC1=CC=CC=C1 3731-1-00 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.28 NCCOCC1=CC=CC=C1 4756-1-0P [1,1,0,0,0,0|1,0,1]=4 402 B11R1.28 NOCCOC1=CC=CC=C1 4647-5-08 [1,1,0,0,0,0|1,0,1]=4 403 B11R1.28 NOCOCC1=CC=CC=C1 4656-1-4L [1,1,0,0,0,0|1,0,1]=4 404 B11R1.28 O=CCOCC1=CC=CC=C1 2615-1-08 [1,1,0,0,0,0|0,0,0]=2 405 B11R1.28 O=C\C=N\NC1=CC=CC=C1 4639-1-04 [1,1,0,0,0,0|1,0,1]=4 406 B11R1.28 OCCCCC1=CC=CN=C1 4H01-1-B4 [1,1,0,0,0,0|1,0,1]=4 407 B11R1.28 OCCCCC1=CC=NC=C1 4H01-1-9W [1,1,0,0,0,0|1,0,1]=4 408 B11R1.28 OCCCNC1=CC=CC=C1 4656-1-A2 [1,1,0,0,0,0|0,0,1]=3 409 B11R1.28 OCCCOC1=CC=CC=C1 4607-1-01 [1,1,0,0,0,0|0,0,1]=3 410 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 3930-5-01 [1,1,0,0,0,0|1,0,0]=3 411 B11R1.40 CC(CO)OC1=CC=CC=C1 2607-1-2Q [1,1,0,0,0,0|1,0,1]=4 412 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 2915-1-00 [1,1,0,0,0,0|0,0,2]=4 413 B11R1.40 N#CC(Cl)CC1=CC=CC=C1 3637-5-0H [1,1,0,0,0,0|1,0,1]=4 414 B11R1.40 N#CC(N)CC1=CC=CC=C1 3737-1-23 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.40 N#CC(N)CC1=CC=CC=C1 3737-5-08 [1,1,0,0,0,0|1,0,1]=4 416 B11R1.40 N#C[C@@H](N)CC1=CC=CC=C1 3737-1-27 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.40 N#C[C@@H](N)CC1=CC=CC=C1 3737-5-07 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.40 N#C[C@H](N)CC1=CC=CC=C1 3737-1-22 [1,1,0,0,0,0|1,0,1]=4 419 B11R1.40 N#C[C@H](N)CC1=CC=CC=C1 4737-3-05 [1,1,0,0,0,0|1,0,1]=4 420 B11R1.40 NCC(O)CC1=CC=CC=C1 4656-1-2F [1,1,0,0,0,0|1,0,1]=4 421 B11R1.40 NCC(O)CC1=CC=CC=C1 4756-5-22 [1,1,0,0,0,0|1,0,1]=4 422 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 4656-1-X5 [1,1,0,0,0,0|0,0,1]=3 423 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 2915-9-01 [1,1,0,0,0,0|0,0,2]=4 424 B11R1.20 C=C(Br)CC1=CC=C(Br)C=C1 1900-9-14 [0,1,0,0,1,0|2,0,0]=4 425 B11R1.20 C=C(Br)CC1=CC=C(C)C=C1 1900-9-08 [0,1,0,0,1,0|2,0,0]=4 426 B11R1.20 C=C(Br)CC1=CC=C(Cl)C=C1 1900-D-X0 [0,1,0,0,1,0|2,0,0]=4 427 B11R1.20 C=C(C)CC1=CC=C(Br)C=C1 1900-9-20 [0,1,0,0,1,0|2,0,0]=4 428 B11R1.20 C=C(C)CC1=CC=C(C)C=C1 1900-1-12 [0,1,0,0,1,0|2,0,0]=4 429 B11R1.20 C=C(C)CC1=CC=C(Cl)C=C1 1900-5-10 [0,1,0,0,1,0|2,0,0]=4 430 B11R1.20 C=C(Cl)CC1=CC=C(Br)C=C1 1900-D-08 [0,1,0,0,1,0|2,0,0]=4 431 B11R1.20 C=C(Cl)CC1=CC=C(C)C=C1 1900-5-20 [0,1,0,0,1,0|2,0,0]=4 432 B11R1.20 C=C(Cl)CC1=CC=C(Cl)C=C1 1900-5-26 [0,1,0,0,1,0|2,0,0]=4 433 B11R1.20 CC(=O)CC1=CN=C(Cl)C=C1 4H17-5-02 [0,1,0,0,1,0|2,0,0]=4 434 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 4448-1-04 [0,1,0,0,1,0|2,0,0]=4 435 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 4748-1-30 [0,1,0,0,1,0|2,0,0]=4 436 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 4648-1-47 [0,1,0,0,1,0|2,0,0]=4 437 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 2623-9-X3 [0,1,0,0,1,0|2,0,0]=4 438 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 2623-1-4L [0,1,0,0,1,0|2,0,0]=4 439 B11R1.20 CC1=CC=C(CC(=O)O)N=C1 4H21-1-JM [0,1,0,0,1,0|1,0,0]=3 440 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 4H21-1-MN [0,1,0,0,1,0|1,0,0]=3 441 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 4642-5-00 [0,1,0,0,1,0|2,0,0]=4 442 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 3641-3-X1 [0,1,0,0,1,0|2,0,0]=4 443 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 7667-9-00 [0,1,0,0,1,0|1,1,0]=4 444 B11R1.20 NC(=S)CC1=CC=C(F)C=C1 7667-3-0B [0,1,0,0,1,0|1,1,0]=4 445 B11R1.20 O=C(Cl)CC1=CC=C(Cl)C=C1 2616-5-0H [0,1,0,0,1,0|1,0,0]=3 446 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 2623-D-08 [0,1,0,0,1,0|2,0,0]=4 447 B11R1.20 O=C(Cl)OC1=CC=C(F)C=C1 2616-7-X7 [0,1,0,0,1,0|2,0,0]=4 448 B11R1.20 O=C(O)CC1=CC=C(Br)C=N1 4H21-9-X4 [0,1,0,0,1,0|1,0,0]=3 449 B11R1.20 O=C(O)CC1=CC=C(Cl)C=N1 4H21-5-3X [0,1,0,0,1,0|1,0,0]=3 450 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 6661-1-0A [0,1,0,0,1,0|0,0,0]=2 451 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 4H21-9-12 [0,1,0,0,1,0|2,0,0]=4 452 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 4H58-3-A8 [0,1,0,0,1,0|2,0,0]=4 453 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 2618-1-0B [0,1,0,0,1,0|1,0,1]=4 454 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 4656-5-U8 [0,1,0,0,1,0|1,0,0]=3 455 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 2720-1-07 [0,1,0,0,1,0|1,0,0]=3 456 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 4H48-1-036 [0,1,0,0,1,0|2,0,0]=4 457 B11R1.36 CC(=O)N(Cl)C1=CC=CC=C1 4648-5-2D [0,1,0,0,1,0|2,0,0]=4 458 B11R1.36 CC(=O)N(O)C1=CC=CC=C1 4648-1-1Q [0,1,0,0,1,0|2,0,0]=4 459 B11R1.36 CC(=O)[C@@H](O)C1=CC=CC=C1 2720-1-06 [0,1,0,0,1,0|1,0,0]=3 460 B11R1.36 CC(=O)[C@H](O)C1=CC=CC=C1 2720-1-05 [0,1,0,0,1,0|1,0,0]=3 461 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 4656-5-01 [0,1,0,0,1,0|2,0,0]=4 462 B11R1.36 NC(C(=O)Cl)C1=CC=CC=C1 4630-5-0D [0,1,0,0,1,0|1,0,0]=3 463 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 4657-1-0Y [0,1,0,0,1,0|0,0,0]=2 464 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 4H57-1-1G [0,1,0,0,1,0|1,0,0]=3 465 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 4H57-1-94 [0,1,0,0,1,0|1,0,0]=3 466 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 4657-1-R2 [0,1,0,0,1,0|0,0,0]=2 467 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 2629-1-T3 [0,1,0,0,1,0|0,0,1]=3 468 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 2621-9-28 [0,1,0,0,1,0|0,0,0]=2 469 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 2621-5-0R [0,1,0,0,1,0|0,0,0]=2 470 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 2721-3-X6 [0,1,0,0,1,0|0,0,0]=2 471 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 2729-1-27 [0,1,0,0,1,0|0,0,0]=2 472 B11R1.86 C=C(Br)CC1=C(C)C=CC=C1 1900-9-12 [0,1,0,0,1,0|2,0,0]=4 473 B11R1.86 C=C(Br)CC1=CC=CC=C1Cl 1900-D-06 [0,1,0,0,1,0|2,0,0]=4 474 B11R1.86 C=C(C)CC1=CC=CC=C1Br 1900-9-18 [0,1,0,0,1,0|2,0,0]=4 475 B11R1.86 C=C(C)CC1=CC=CC=C1C 1900-1-20 [0,1,0,0,1,0|2,0,0]=4 476 B11R1.86 C=C(C)CC1=CC=CC=C1Cl 1900-5-14 [0,1,0,0,1,0|2,0,0]=4 477 B11R1.86 C=C(Cl)CC1=CC=CC=C1C 1900-5-24 [0,1,0,0,1,0|2,0,0]=4 478 B11R1.86 C=C(Cl)CC1=CC=CC=C1Cl 1900-5-30 [0,1,0,0,1,0|2,0,0]=4 479 B11R1.86 CC(=O)CC1=CC=CC=C1C 2717-1-0P [0,1,0,0,1,0|1,0,0]=3 480 B11R1.86 CC(=O)CC1=CC=CC=C1Cl 2717-5-X5 [0,1,0,0,1,0|1,0,0]=3 481 B11R1.86 CC(=O)CC1=CC=CC=C1F 2717-3-X3 [0,1,0,0,1,0|1,0,0]=3 482 B11R1.86 CC(=O)NC1=CC=CC=C1O 4648-1-59 [0,1,0,0,1,0|2,0,0]=4 483 B11R1.86 CC(=O)OC1=C(I)C=CC=C1 2623-H-0D [0,1,0,0,1,0|2,0,0]=4 484 B11R1.86 CC(=O)OC1=CC=CC=C1C 2723-1-0X [0,1,0,0,1,0|2,0,0]=4 485 B11R1.86 CC(=O)OC1=CC=CC=C1Cl 2623-5-48 [0,1,0,0,1,0|2,0,0]=4 486 B11R1.86 CC1=CC=CC=C1CC(=O)Cl 2716-5-14 [0,1,0,0,1,0|1,0,0]=3 487 B11R1.86 CC1=CC=CC=C1NC(N)=O 4753-1-06 [0,1,0,0,1,0|2,0,0]=4 488 B11R1.86 NC(=O)CC1=CC=CC=C1Cl 4648-5-1T [0,1,0,0,1,0|1,0,0]=3 489 B11R1.86 NC(=O)NC1=C(F)C=CC=C1 4653-3-X3 [0,1,0,0,1,0|2,0,0]=4 490 B11R1.86 NC(=O)NC1=CC=CC=C1Br 4653-9-02 [0,1,0,0,1,0|2,0,0]=4 491 B11R1.86 NC(=S)CC1=C(Cl)C=CC=C1 7669-5-01 [0,1,0,0,1,0|1,1,0]=4 492 B11R1.86 NC(=S)CC1=C(F)C=CC=C1 7667-3-0C [0,1,0,0,1,0|1,1,0]=4 493 B11R1.86 NC(=S)CC1=CC=CC=C1Br 7667-9-09 [0,1,0,0,1,0|1,1,0]=4 494 B11R1.86 NC1=C(CC(=O)O)N=CC=C1 4H57-1-12 [0,1,0,0,1,0|1,0,0]=3 495 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 2716-7-X5 [0,1,0,0,1,0|1,0,0]=3 496 B11R1.86 O=C(Cl)CC1=CC=CC=C1Cl 2616-5-0P [0,1,0,0,1,0|1,0,0]=3 497 B11R1.86 O=C(Cl)CC1=CC=CC=C1I 2616-M-01 [0,1,0,0,1,0|1,0,0]=3 498 B11R1.86 O=C(O)CC1=CC=CN=C1Cl 4H21-5-0A [0,1,0,0,1,0|1,0,0]=3 499 B11R1.86 O=C(O)CC1=NC=CC=C1Br 4H58-9-1A [0,1,0,0,1,0|1,0,0]=3 500 B11R1.86 O=C(O)CC1=NC=CC=C1F 4H21-3-0L [0,1,0,0,1,0|1,0,0]=3 501 B11R1.86 O=C(O)CC1=NC=CC=C1O 4H29-1-0Z [0,1,0,0,1,0|1,0,0]=3 502 B11R1.86 O=[N+]([O-])CC1=CC=CC=C1Cl 4654-5-0P [0,1,0,0,1,0|1,0,1]=4 503 B11R1.157 C=C(Br)CC1=CC(Br)=CC=C1 1900-9-16 [0,1,0,0,1,0|2,0,0]=4 504 B11R1.157 C=C(Br)CC1=CC(Cl)=CC=C1 1900-D-04 [0,1,0,0,1,0|2,0,0]=4 505 B11R1.157 C=C(Br)CC1=CC(F)=CC=C1 1900-B-11 [0,1,0,0,1,0|2,0,0]=4 506 B11R1.157 C=C(Br)CC1=CC=CC(C)=C1 1900-9-10 [0,1,0,0,1,0|2,0,0]=4 507 B11R1.157 C=C(C)CC1=CC(C)=CC=C1 1900-1-16 [0,1,0,0,1,0|2,0,0]=4 508 B11R1.157 C=C(C)CC1=CC(Cl)=CC=C1 1900-5-12 [0,1,0,0,1,0|2,0,0]=4 509 B11R1.157 C=C(C)CC1=CC=CC(Br)=C1 1900-9-06 [0,1,0,0,1,0|2,0,0]=4 510 B11R1.157 C=C(Cl)CC1=CC=CC(Br)=C1 1900-D-10 [0,1,0,0,1,0|2,0,0]=4 511 B11R1.157 C=C(Cl)CC1=CC=CC(C)=C1 1900-5-22 [0,1,0,0,1,0|2,0,0]=4 512 B11R1.157 C=C(Cl)CC1=CC=CC(Cl)=C1 1900-5-28 [0,1,0,0,1,0|2,0,0]=4 513 B11R1.157 CC(=O)NC1=CC=CC(C)=C1 4748-1-20 [0,1,0,0,1,0|2,0,0]=4 514 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 4648-5-00 [0,1,0,0,1,0|2,0,0]=4 515 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 4648-1-Y1 [0,1,0,0,1,0|2,0,0]=4 516 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 4648-5-23 [0,1,0,0,1,0|2,0,0]=4 517 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 2723-1-1G [0,1,0,0,1,0|2,0,0]=4 518 B11R1.157 CC1=CC=CC(C[N+](=O)[O-])=C1 4754-1-0Q [0,1,0,0,1,0|1,0,1]=4 519 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 4648-9-56 [0,1,0,0,1,0|1,0,0]=3 520 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 4648-5-1R [0,1,0,0,1,0|1,0,0]=3 521 B11R1.157 NC(=O)CC1=CC=CC(F)=C1 4648-3-0S [0,1,0,0,1,0|1,0,0]=3 522 B11R1.157 NC(=O)NC1=CC=CC(Br)=C1 4653-9-00 [0,1,0,0,1,0|2,0,0]=4 523 B11R1.157 NC1=CC=CC(CC(=O)O)=N1 4H56-1-AM [0,1,0,0,1,0|1,0,0]=3 524 B11R1.157 O=C(Cl)CC1=CC=CC(Br)=C1 2616-D-02 [0,1,0,0,1,0|1,0,0]=3 525 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 4H21-9-0E [0,1,0,0,1,0|1,0,0]=3 526 B11R1.157 O=C(O)CC1=CC=CC(Br)=N1 4H21-9-1D [0,1,0,0,1,0|1,0,0]=3 527 B11R1.157 O=C(O)CC1=CC=NC(Br)=C1 4721-9-01 [0,1,0,0,1,0|1,0,0]=3 528 B11R1.157 O=C(O)CC1=CN=CC(Cl)=N1 4H21-5-3G [0,1,0,0,1,0|2,0,0]=4 529 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 4H21-5-05 [0,1,0,0,1,0|1,0,0]=3 530 B11R1.157 O=[N+]([O-])CC1=CC=CC(F)=C1 4654-3-6G [0,1,0,0,1,0|1,0,1]=4 531 B11R1.509 CC(C)(O)CC1=CC=CC=C1 2602-1-03 [0,1,0,0,1,0|1,0,1]=4 532 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 8H69-1-8H [0,1,0,0,1,0|1,0,1]=4 533 B11R1.509 O=P(O)(O)CC1=CC=CC=C1 6777-1-06 [0,1,0,0,1,0|1,0,0]=3 534 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 6675-1-09 [0,1,0,0,1,0|2,0,0]=4 535 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O 4H57-1-48 [0,1,0,0,1,0|1,0,0]=3 536 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O 8H57-1-12 [0,1,0,0,1,0|1,0,0]=3 537 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O 8H57-1-14 [0,1,0,0,1,0|1,0,0]=3 538 B11R1.35 N[C@@H](CC1=CSC=N1)C(=O)O 8H57-1-17 [0,1,0,0,1,0|2,0,0]=4 539 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O 8H57-1-13 [0,1,0,0,1,0|1,0,0]=3 540 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O 8H57-1-15 [0,1,0,0,1,0|1,0,0]=3 541 B11R1.35 N[C@H](CC1=CSC=N1)C(=O)O 8H57-1-18 [0,1,0,0,1,0|2,0,0]=4 542 B11R1.75 CC1=NN(CCC(=O)O)C=C1 4H21-1-MD [0,1,0,0,1,0|2,0,0]=4 543 B11R1.75 CN1C=C(CCC(=O)O)C=N1 4H21-1-KM [0,1,0,0,1,0|2,0,0]=4 544 B11R1.75 CN1C=CC(CCC(=O)O)=N1 4H21-1-6E [0,1,0,0,1,0|2,0,0]=4 545 B11R1.75 O=C(O)CCN1C=C(Cl)C=N1 4H21-5-3V [0,1,0,0,1,0|2,0,0]=4 546 B11R1.77 NC(CC(=O)O)C1=CC=CO1 4H57-1-38 [0,1,0,0,1,0|1,0,0]=3 547 B11R1.90 CC1=CC=NN1CCC(=O)O 4H21-1-MC [0,1,0,0,1,0|2,0,0]=4 548 B11R1.90 CN1C=CN=C1CCC(=O)O 4H21-1-33 [0,1,0,0,1,0|2,0,0]=4 549 B13R1.45 CC(=O)COC(=O)C1=CC=CC=C1 2623-1-4Q [0,1,0,0,0,1|1,0,1]=4 550 B13R1.45 CC(=O)NCC(=O)C1=CC=CC=C1 4648-1-4U [0,1,0,0,0,1|1,0,1]=4 551 B13R1.45 CC(=O)OCC(=O)C1=CC=CC=C1 2629-1-0K [0,1,0,0,0,1|1,0,1]=4 552 B13R1.45 N[C@H](CCC(=O)O)C1=CC=CC=C1 4757-1-15 [0,1,0,0,0,1|0,0,0]=2 553 B13R1.45 O=C(O)CNC(=O)C1=CC=CN=C1 4H58-1-3N [0,1,0,0,0,1|1,0,1]=4 554 B13R1.45 O=C(O)CSC(=S)C1=CC=CC=C1 6667-1-02 [0,1,0,0,0,1|0,0,1]=3 555 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 2929-1-17 [0,1,0,0,0,1|0,0,2]=4 556 B13R1.149 CC1=CC=CC(OCCC(=O)O)=C1 2721-1-3X [0,1,0,0,0,1|0,0,0]=2 557 B13R1.149 O=C(O)CCNC1=CC=CC(F)=C1 4657-3-63 [0,1,0,0,0,1|0,0,0]=2 558 B13R1.158 CC1=CC=CC=C1OCCC(=O)O 2721-1-1X [0,1,0,0,0,1|0,0,0]=2 559 B13R1.158 O=C(O)CCNC1=CC=CC=C1Cl 4657-5-X9 [0,1,0,0,0,1|0,0,0]=2 560 B13R1.158 O=C(O)CCOC1=CC=CC=C1Cl 2621-5-43 [0,1,0,0,0,1|0,0,0]=2 561 B13R1.158 O=C(O)C\C=C\C1=C(F)C=CC=C1 2921-3-0B [0,1,0,0,0,1|0,0,1]=3 562 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 4H48-1-035 [0,1,0,0,0,1|1,0,1]=4 563 B13R1.348 CC(=O)OC(C)CC1=CC=CC=C1 2623-1-4U [0,1,0,0,0,1|1,0,0]=3 564 B13R1.348 C\C(=C/C1=CC=CC=C1)CC(N)=O 4648-1-5Y [0,1,0,0,0,1|1,0,1]=4 565 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 4632-1-0B [0,1,0,0,0,1|0,0,0]=2 566 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O 8666-1-S3 [0,1,0,0,0,1|0,0,0]=2 567 B13R1.351 O=C(O)C(=O)\C=C\C1=CC=CC=C1 2929-1-28 [0,1,0,0,0,1|0,0,2]=4 568 B13R1.351 O=C(O)[C@@H](O)CCC1=CC=CC=C1 2629-1-S8 [0,1,0,0,0,1|0,0,0]=2 569 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 4648-1-1R [0,1,0,0,0,1|1,0,0]=3 570 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 2721-1-2V [0,1,0,0,0,1|0,0,0]=2 571 B13R1.513 NC1=CC=C(CCCC(=O)O)C=C1 4757-1-Y4 [0,1,0,0,0,1|0,0,0]=2 572 B13R1.513 O=C(Cl)CCCC1=CC=C(F)C=C1 2716-7-17 [0,1,0,0,0,1|1,0,0]=3 573 B13R1.513 O=C(O)CCCC1=CC=C(F)C=C1 2721-3-10 [0,1,0,0,0,1|0,0,0]=2 574 B13R1.513 O=C(O)CCCC1=CC=C(O)C=C1 2621-1-2Q [0,1,0,0,0,1|0,0,0]=2 575 B13R1.513 O=C(O)CCNC1=CC=C(Cl)N=N1 4H57-5-07 [0,1,0,0,0,1|2,0,0]=4 576 B13R1.513 O=C(O)CCNC1=CC=C(F)C=C1 4657-3-64 [0,1,0,0,0,1|0,0,0]=2 577 B13R1.513 O=C(O)CCOC1=CC=C(Br)C=C1 2621-9-0A [0,1,0,0,0,1|0,0,0]=2 578 B13R1.718 CCC(=O)COCC1=CC=CC=C1 2717-1-15 [0,1,0,0,0,1|1,0,0]=3 579 B13R1.718 COC(=O)CCCC1=CC=CC=C1 2623-1-0S [0,1,0,0,0,1|0,0,0]=2 580 B13R1.718 COC(=O)CCNC1=CC=CC=C1 4658-1-77 [0,1,0,0,0,1|0,0,0]=2 581 B13R1.718 COC(=O)COCC1=CC=CC=C1 2623-1-2U [0,1,0,0,0,1|0,0,0]=2 582 B13R1.718 COC(=O)CSCC1=CC=CN=C1 8H66-1-16 [0,1,0,0,0,1|1,0,0]=3 583 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 4656-5-53 [0,1,0,0,0,1|1,0,1]=4 584 B13R1.718 N[C@@H](CO)COCC1=CC=CC=C1 4756-1-0F [0,1,0,0,0,1|1,0,1]=4 585 B13R1.718 N[C@H](CO)COCC1=CC=CC=C1 4656-5-52 [0,1,0,0,0,1|1,0,1]=4 586 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 4748-5-X2 [0,1,0,0,0,1|1,0,0]=3 587 B13R1.718 OC(CCl)CNCC1=CC=CC=C1 4756-5-39 [0,1,0,0,0,1|1,0,1]=4 588 B13R1.718 OC[C@@H](O)COCC1=CC=CC=C1 2607-1-R0 [0,1,0,0,0,1|0,0,2]=4 589 B13R1.718 OC[C@H](O)COCC1=CC=CC=C1 2607-1-S0 [0,1,0,0,0,1|0,0,2]=4 590 B13R1.3 CCC1=CC=C(\C=C\C(=O)O)C=C1 2921-1-14 [0,2,0,0,0,0|0,0,2]=4 591 B13R1.3 COC1=CC=C(CCC(=O)Cl)C=C1 2616-5-0N [0,2,0,0,0,0|1,0,0]=3 592 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 2717-1-40 [0,2,0,0,0,0|1,0,0]=3 593 B13R1.3 COC1=CC=C(COC(C)=O)C=C1 2623-1-82 [0,2,0,0,0,0|2,0,0]=4 594 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 2621-1-0E [0,2,0,0,0,0|1,0,0]=3 595 B13R1.3 COC1=CC=C(OCC(N)=O)C=C1 4648-1-67 [0,2,0,0,0,0|2,0,0]=4 596 B13R1.3 CSC1=CC=C(OCC(=O)O)C=C1 6666-1-41 [0,2,0,0,0,0|1,0,0]=3 597 B13R1.3 CSC1=CC=C(\C=C\C(=O)O)C=C1 6966-1-X1 [0,2,0,0,0,0|0,0,2]=4 598 B13R1.3 N#CC1=CC=C(CCC(=O)O)C=C1 4637-1-1S [0,2,0,0,0,0|0,0,0]=2 599 B13R1.3 N#CC1=CC=C(OCC(=O)O)C=C1 4637-1-1U [0,2,0,0,0,0|1,0,0]=3 600 B13R1.3 O=CC1=CC=C(\C=C\C(=O)O)C=C1 2921-1-05 [0,2,0,0,0,0|0,0,2]=4 601 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 2623-3-2J [0,2,0,0,0,0|0,0,0]=2 602 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 4658-1-1E [0,2,0,0,0,0|0,0,0]=2 603 B13R1.14 COC(=O)COC1=CC=C(I)C=C1 2623-H-06 [0,2,0,0,0,0|1,0,0]=3 604 B13R1.14 COC(=O)\C=C\C1=CC=C(C)C=C1 2923-1-12 [0,2,0,0,0,0|0,0,2]=4 605 B13R1.14 COC(=O)\C=C\C1=CC=C(N)C=C1 4958-1-03 [0,2,0,0,0,0|0,0,2]=4 606 B13R1.14 NNC(=O)CCC1=CC=C(O)C=C1 4756-1-51 [0,2,0,0,0,0|1,0,0]=3 607 B13R1.14 O=C(CCl)NCC1=CC=C(Cl)C=C1 4648-5-1J [0,2,0,0,0,0|2,0,0]=4 608 B13R1.132 CC(=O)CC(=O)C1=CC=C(Cl)C=C1 2618-5-05 [0,2,0,0,0,0|1,0,1]=4 609 B13R1.132 CC(CC(=O)O)C1=CC=C(F)C=C1 2721-3-97 [0,2,0,0,0,0|0,0,0]=2 610 B13R1.132 CC1=CC=C([C@H](N)CC(=O)O)C=C1 4730-1-R1 [0,2,0,0,0,0|0,0,0]=2 611 B13R1.132 C\C(=C/C(=O)O)C1=CC=C(F)C=C1 2921-3-E1 [0,2,0,0,0,0|0,0,2]=4 612 B13R1.132 NC(CC(=O)O)C1=CC=C(F)C=C1 4657-3-34 [0,2,0,0,0,0|0,0,0]=2 613 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 4657-5-01 [0,2,0,0,0,0|0,0,0]=2 614 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(F)C=C1 4657-3-S1 [0,2,0,0,0,0|0,0,0]=2 615 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 4630-5-R1 [0,2,0,0,0,0|0,0,0]=2 616 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(F)C=C1 4657-3-R1 [0,2,0,0,0,0|0,0,0]=2 617 B13R1.133 CC(CC1=CC=C(F)C=C1)C(=O)O 2721-3-1E [0,2,0,0,0,0|0,0,0]=2 618 B13R1.133 CC(NC1=CC=C(F)C=C1)C(=O)O 4658-3-0D [0,2,0,0,0,0|1,0,0]=3 619 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O 2621-9-0H [0,2,0,0,0,0|1,0,0]=3 620 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O 2621-5-0J [0,2,0,0,0,0|1,0,0]=3 621 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)O 2621-3-6E [0,2,0,0,0,0|1,0,0]=3 622 B13R1.133 CC1=CC=C(CC(N)C(=O)O)C=C1 4757-1-0K [0,2,0,0,0,0|0,0,0]=2 623 B13R1.133 CC1=CC=C(OC(C)C(=O)O)C=C1 2621-1-42 [0,2,0,0,0,0|1,0,0]=3 624 B13R1.133 C[C@@H](OC1=CC=C(O)C=C1)C(=O)O 2621-1-R6 [0,2,0,0,0,0|1,0,0]=3 625 B13R1.133 C\C(=C/C1=CC=C(F)C=C1)C(=O)O 2921-3-E7 [0,2,0,0,0,0|0,0,2]=4 626 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O 4657-9-0E [0,2,0,0,0,0|0,0,0]=2 627 B13R1.133 NC(CC1=CC=C(Cl)C=C1)C(=O)O 4657-5-0C [0,2,0,0,0,0|0,0,0]=2 628 B13R1.133 NC(CC1=CC=C(I)C=C1)C(=O)O 4657-H-09 [0,2,0,0,0,0|0,0,0]=2 629 B13R1.133 NC1=CC=C(C[C@@H](N)C(=O)O)C=C1 4H57-1-47 [0,2,0,0,0,0|0,0,0]=2 630 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 4H57-1-46 [0,2,0,0,0,0|0,0,0]=2 631 B13R1.133 NC1=CC=C(NC(=O)C(=O)O)C=C1 4657-1-42 [0,2,0,0,0,0|1,0,1]=4 632 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O 4657-5-S3 [0,2,0,0,0,0|0,0,0]=2 633 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O 4757-9-01 [0,2,0,0,0,0|0,0,0]=2 634 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O 4657-5-R3 [0,2,0,0,0,0|0,0,0]=2 635 B13R1.133 N[C@H](CC1=CC=C(I)C=C1)C(=O)O 4657-H-R1 [0,2,0,0,0,0|0,0,0]=2 636 B13R1.133 O=C(O)C(=O)CC1=CC=C(Cl)C=C1 2629-5-0C [0,2,0,0,0,0|0,0,1]=3 637 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 2629-1-2P [0,2,0,0,0,0|0,0,1]=3 638 B13R1.133 O=C(O)C(O)CC1=CC=C(Br)C=C1 2629-9-31 [0,2,0,0,0,0|0,0,0]=2 639 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(Br)C=C1 2629-9-R1 [0,2,0,0,0,0|0,0,0]=2 640 B13R1.164 CC1=C(CCC(=O)O)C=CC(F)=C1 2721-3-66 [0,2,0,0,0,0|0,0,0]=2 641 B13R1.164 CC1=CC(C)=C(OCC(=O)O)C=C1 2721-1-4H [0,2,0,0,0,0|1,0,0]=3 642 B13R1.164 CC1=CC=C(CCC(=O)O)C(F)=C1 2721-3-58 [0,2,0,0,0,0|0,0,0]=2 643 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(C)=C1 2921-1-13 [0,2,0,0,0,0|0,0,2]=4 644 B13R1.164 CC1=CC=C(\C=C\C(=O)O)C(F)=C1 2921-3-86 [0,2,0,0,0,0|0,0,2]=4 645 B13R1.164 NC1=CC(Br)=CC=C1\C=C\C(=O)O 4957-9-01 [0,2,0,0,0,0|0,0,2]=4 646 B13R1.164 O=C(O)CCC1=C(Br)C=C(F)C=C1 2621-B-21 [0,2,0,0,0,0|0,0,0]=2 647 B13R1.164 O=C(O)COC1=CC=C(Cl)C=C1Cl 2621-5-34 [0,2,0,0,0,0|1,0,0]=3 648 B13R1.164 O=C(O)COC1=CC=C(F)C=C1F 2621-3-6P [0,2,0,0,0,0|1,0,0]=3 649 B13R1.164 O=C(O)CSC1=CC=C(F)C=C1Cl 6666-7-04 [0,2,0,0,0,0|1,0,0]=3 650 B13R1.164 O=C(O)\C=C\C1=CC=C(O)C=C1O 2929-1-11 [0,2,0,0,0,0|0,0,2]=4 651 B13R1.511 CC1=C(C)C=C(OCC(=O)O)C=C1 2721-1-64 [0,2,0,0,0,0|1,0,0]=3 652 B13R1.511 CC1=CC(CCC(=O)O)=CC=C1F 2721-3-68 [0,2,0,0,0,0|0,0,0]=2 653 B13R1.511 NC1=CC(CCC(=O)O)=CC=C1O 4757-1-48 [0,2,0,0,0,0|0,0,0]=2 654 B13R1.511 O=C(O)CCC1=CC=C(F)C(Br)=C1 2621-B-0G [0,2,0,0,0,0|0,0,0]=2 655 B13R1.511 O=C(O)COC1=CC(F)=C(Cl)C=C1 2621-7-0Q [0,2,0,0,0,0|1,0,0]=3 656 B13R1.511 O=C(O)COC1=CC(F)=C(F)C=C1 2621-3-6N [0,2,0,0,0,0|1,0,0]=3 657 B13R1.511 O=C(O)COC1=CC=C(Cl)C(Cl)=C1 2621-5-0Q [0,2,0,0,0,0|1,0,0]=3 658 B13R1.511 O=C(O)\C=C\C1=CC=C(Br)C(I)=C1 2921-S-00 [0,2,0,0,0,0|0,0,2]=4 659 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 4648-1-3V [0,2,0,0,0,0|1,0,1]=4 660 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 2629-1-3G [0,2,0,0,0,0|0,0,1]=3 661 B13R1.11 COC(=O)CC(=O)C1=CC=CC=N1 4H29-1-4U [0,2,0,0,0,0|1,0,1]=4 662 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 4H29-1-4X [0,2,0,0,0,0|1,0,1]=4 663 B13R1.11 COC(=O)CN(C)C1=CC=CC=N1 4H32-1-0R [0,2,0,0,0,0|2,0,0]=4 664 B13R1.11 COC(=O)CS(=O)C1=CC=CC=C1 6665-1-08 [0,2,0,0,0,0|1,0,0]=3 665 B13R1.11 COC(=O)C[C@@H](N)C1=CC=CC=C1 4656-1-RU [0,2,0,0,0,0|0,0,0]=2 666 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 4658-5-S5 [0,2,0,0,0,0|0,0,0]=2 667 B13R1.11 C[C@@H](NC(=O)CCl)C1=CC=CC=C1 4648-5-R1 [0,2,0,0,0,0|2,0,0]=4 668 B13R1.15 COC(=O)CCC1=CC=CC(F)=C1 2623-3-2G [0,2,0,0,0,0|0,0,0]=2 669 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 2629-1-3P [0,2,0,0,0,0|0,0,0]=2 670 B13R1.15 COC(=O)\C=C\C1=CC(Br)=CC=C1 2623-9-0G [0,2,0,0,0,0|0,0,2]=4 671 B13R1.15 COC(=O)\C=C\C1=CC(C)=CC=C1 2723-1-E0 [0,2,0,0,0,0|0,0,2]=4 672 B13R1.15 COC(=O)\C=C\C1=CC=CC(Cl)=C1 2624-5-01 [0,2,0,0,0,0|0,0,2]=4 673 B13R1.42 C=COC(=O)\C=C\C1=CC=CC=C1 2624-1-03 [0,2,0,0,0,0|0,0,2]=4 674 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 2923-1-04 [0,2,0,0,0,0|0,0,2]=4 675 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 2723-1-24 [0,2,0,0,0,0|0,0,0]=2 676 B13R1.42 CCOC(=O)CCC1=CC=CC=N1 4H23-1-H0 [0,2,0,0,0,0|1,0,0]=3 677 B13R1.42 CCOC(=O)COC1=CC=CC=C1 2623-1-3W [0,2,0,0,0,0|1,0,0]=3 678 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 4648-5-2B [0,2,0,0,0,0|2,0,0]=4 679 B13R1.42 O=C(CCCl)OCC1=CC=CC=C1 2623-5-0X [0,2,0,0,0,0|2,0,0]=4 680 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 2623-3-2K [0,2,0,0,0,0|2,0,0]=4 681 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 2629-1-3E [0,2,0,0,0,0|1,0,0]=3 682 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC 2623-1-2M [0,2,0,0,0,0|0,0,1]=3 683 B13R1.135 COC(=O)C(C)OC1=CC=CC=C1 2623-1-55 [0,2,0,0,0,0|1,0,0]=3 684 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 2623-5-54 [0,2,0,0,0,0|0,0,0]=2 685 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 2629-1-3D [0,2,0,0,0,0|0,0,0]=2 686 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 2629-1-S9 [0,2,0,0,0,0|0,0,0]=2 687 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 2629-1-R9 [0,2,0,0,0,0|0,0,0]=2 688 B13R1.254 C#CC(C)(O)CCC1=CC=CC=C1 2903-1-05 [0,2,0,0,0,0|1,0,1]=4 689 B13R1.254 CCC(C)(O)CCC1=CC=CC=C1 2602-1-05 [0,2,0,0,0,0|1,0,1]=4 690 B13R1.528 COC(=O)CCC1=CC=CC=C1F 2623-3-2H [0,2,0,0,0,0|0,0,0]=2 691 B13R1.528 COC(=O)\C=C\C1=C(F)C=CC=C1 2623-3-E0 [0,2,0,0,0,0|0,0,2]=4 692 B13R1.528 COC(=O)\C=C\C1=C(N)C=CC=C1 4630-1-0V [0,2,0,0,0,0|0,0,2]=4 693 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1Br 2923-9-E0 [0,2,0,0,0,0|0,0,2]=4 694 B13R1.148 CC1=CC=CC(C[C@@H](N)C(=O)O)=C1 4757-1-14 [0,2,0,0,0,0|0,0,0]=2 695 B13R1.148 CC1=CC=CC(C[C@H](N)C(=O)O)=C1 4757-1-19 [0,2,0,0,0,0|0,0,0]=2 696 B13R1.148 NC(CC1=CC=CC(Cl)=C1)C(=O)O 4657-5-0M [0,2,0,0,0,0|0,0,0]=2 697 B13R1.148 NC(CC1=CC=CC(I)=C1)C(=O)O 4657-H-0A [0,2,0,0,0,0|0,0,0]=2 698 B13R1.148 NC(CC1=CC=CC(O)=C1)C(=O)O 4757-1-22 [0,2,0,0,0,0|0,0,0]=2 699 B13R1.148 NC(CC1=CC=CC(S)=C1)C(=O)O 8661-1-07 [0,2,0,0,0,0|0,0,0]=2 700 B13R1.148 NC1=CC(CC(N)C(=O)O)=CC=C1 4657-5-0J [0,2,0,0,0,0|0,0,0]=2 701 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O 4757-5-06 [0,2,0,0,0,0|0,0,0]=2 702 B13R1.148 N[C@@H](CC1=CC=CC(I)=C1)C(=O)O 4657-H-S0 [0,2,0,0,0,0|0,0,0]=2 703 B13R1.148 N[C@@H](CC1=CC=CC(O)=C1)C(=O)O 4657-1-SE [0,2,0,0,0,0|0,0,0]=2 704 B13R1.148 N[C@H](CC1=CC(F)=CC=C1)C(=O)O 4757-3-X1 [0,2,0,0,0,0|0,0,0]=2 705 B13R1.148 N[C@H](CC1=CC=CC(Cl)=C1)C(=O)O 4757-5-07 [0,2,0,0,0,0|0,0,0]=2 706 B13R1.148 N[C@H](CC1=CC=CC(O)=C1)C(=O)O 4657-1-RE [0,2,0,0,0,0|0,0,0]=2 707 B13R1.152 CC(=O)C(C)C(=O)C1=CC=CC=C1 2618-1-0D [0,2,0,0,0,0|1,0,1]=4 708 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 4657-1-1G [0,2,0,0,0,0|0,0,0]=2 709 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)C1=CC=CC=C1 4657-1-75 [0,2,0,0,0,0|0,0,0]=2 710 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O 4657-5-23 [0,2,0,0,0,0|0,0,0]=2 711 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 4657-1-0W [0,2,0,0,0,0|0,0,0]=2 712 B13R1.152 O=C(O)C(Br)C(Br)C1=CC=CC=C1 2621-9-15 [0,2,0,0,0,0|0,0,0]=2 713 B13R1.202 CC(=O)C(C)OC1=C(O)C=CC=C1 2617-1-0L [0,2,0,0,0,0|2,0,0]=4 714 B13R1.202 CC(CC1=CC=CC=C1F)C(=O)O 2721-3-1D [0,2,0,0,0,0|0,0,0]=2 715 B13R1.202 CC(OC1=CC=CC=C1Cl)C(=O)O 2621-5-19 [0,2,0,0,0,0|1,0,0]=3 716 B13R1.202 CC1=CC=CC=C1CC(N)C(=O)O 4757-5-0A [0,2,0,0,0,0|0,0,0]=2 717 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O 4757-1-34 [0,2,0,0,0,0|0,0,0]=2 718 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O 4757-1-33 [0,2,0,0,0,0|0,0,0]=2 719 B13R1.202 C\C(=C/C1=CC=CC=C1F)C(=O)O 2921-3-E6 [0,2,0,0,0,0|0,0,2]=4 720 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O 4657-9-0G [0,2,0,0,0,0|0,0,0]=2 721 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O 4657-5-0N [0,2,0,0,0,0|0,0,0]=2 722 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O 4657-H-0B [0,2,0,0,0,0|0,0,0]=2 723 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O 4757-5-05 [0,2,0,0,0,0|0,0,0]=2 724 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1F 2721-B-14 [0,2,0,0,0,0|0,0,0]=2 725 B13R1.353 N[C@@H](CC1=CC=CC=C1)P(=O)(O)O 8777-1-04 [0,2,0,0,0,0|1,0,0]=3 726 B13R1.353 N[C@H](CC1=CC=CC=C1)P(=O)(O)O 8777-1-03 [0,2,0,0,0,0|1,0,0]=3 727 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O 4657-1-RW [0,2,0,0,0,0|0,0,0]=2 728 B13R1.418 N#CC(CC1=CC=CC=C1)C(=O)O 4637-1-5M [0,2,0,0,0,0|0,0,0]=2 729 B13R1.418 N#C\C(=C/C1=CC=CC=C1)C(=O)O 4637-1-4D [0,2,0,0,0,0|0,0,2]=4 730 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O 4747-9-02 [0,2,0,0,0,0|0,0,0]=2 731 B13R1.418 NO[C@H](CC1=CC=CC=C1)C(=O)O 4747-9-R1 [0,2,0,0,0,0|0,0,0]=2 732 B13R1.147 CC1=CC([C@@H](N)CC(=O)O)=CC=C1 4730-1-S0 [0,2,0,0,0,0|0,0,0]=2 733 B13R1.147 CC1=CC([C@H](N)CC(=O)O)=CC=C1 4730-1-R0 [0,2,0,0,0,0|0,0,0]=2 734 B13R1.147 NC(CC(=O)O)C1=CC=CC(Cl)=C1 4657-5-26 [0,2,0,0,0,0|0,0,0]=2 735 B13R1.147 N[C@H](CC(=O)O)C1=CC=CC(Br)=C1 4630-9-R0 [0,2,0,0,0,0|0,0,0]=2 736 B13R1.147 N[C@H](CC(=O)O)C1=CC=CC(Cl)=C1 4630-5-R0 [0,2,0,0,0,0|0,0,0]=2 737 B13R1.147 N[C@H](CC(=O)O)C1=CC=CC(F)=C1 4630-3-R1 [0,2,0,0,0,0|0,0,0]=2 738 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1F 4657-3-00 [0,2,0,0,0,0|0,0,0]=2 739 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1Br 4632-9-R0 [0,2,0,0,0,0|0,0,0]=2 740 B13R1.347 CC(=O)CC(C)(C)C1=CC=CC=C1 2717-1-48 [0,2,0,0,0,0|1,0,0]=3 741 B13R1.347 CC(C)(CC(=O)O)C1=CC=CC=C1 2721-1-0K [0,2,0,0,0,0|0,0,0]=2 742 B13R1.713 CC(=O)N[C@@H](CO)C1=CC=CC=C1 4648-1-5A [0,2,0,0,0,0|2,0,0]=4 743 B13R1.713 CC(=O)OC(C#N)C1=CC=CC=C1 4637-1-4E [0,2,0,0,0,0|2,0,0]=4 744 B13R1.90 C=C(Br)CCC1=CC=CC=C1C#N 3937-9-X2 [0,2,0,0,0,0|2,0,0]=4 745 B13R1.90 C=C(C)CCC1=CC=CC=C1C#N 3937-1-X0 [0,2,0,0,0,0|2,0,0]=4 746 B13R1.90 C=C(Cl)CCC1=CC=CC=C1C#N 3937-5-X8 [0,2,0,0,0,0|2,0,0]=4 747 B13R1.90 CC(=O)OCC1=CC=CC=C1C#N 4637-1-2G [0,2,0,0,0,0|2,0,0]=4 748 B13R1.90 CCC1=C(\C=C\C(=O)O)C=CC=C1 2721-1-EA [0,2,0,0,0,0|0,0,2]=4 749 B13R1.90 COC1=CC=CC=C1NCC(=O)O 4658-1-6U [0,2,0,0,0,0|1,0,0]=3 750 B13R1.90 COC1=CC=CC=C1OCC(N)=O 4648-1-Z5 [0,2,0,0,0,0|2,0,0]=4 751 B13R1.90 CSC1=CC=CC=C1OCC(=O)O 6666-1-40 [0,2,0,0,0,0|1,0,0]=3 752 B13R1.90 N#CC1=CC=CC=C1OCC(=O)O 4637-1-2B [0,2,0,0,0,0|1,0,0]=3 753 B13R1.90 N#CC1=CC=CC=C1\C=C\C(=O)O 4937-1-04 [0,2,0,0,0,0|0,0,2]=4 754 B13R1.90 O=CC1=CC=CC=C1\C=C\C(=O)O 2921-1-06 [0,2,0,0,0,0|0,0,2]=4 755 B13R1.150 CC1=C(CCC(=O)O)C=CC=C1F 2721-3-60 [0,2,0,0,0,0|0,0,0]=2 756 B13R1.150 CC1=CC=CC(\C=C\C(=O)O)=C1F 2921-3-87 [0,2,0,0,0,0|0,0,2]=4 757 B13R1.150 O=C(O)CCC1=C(F)C(Br)=CC=C1 2621-B-0E [0,2,0,0,0,0|0,0,0]=2 758 B13R1.150 O=C(O)\C=C\C1=CC=CC(Br)=C1F 2921-B-07 [0,2,0,0,0,0|0,0,2]=4 759 B13R1.150 O=C(O)\C=C\C1=CC=CC(Cl)=C1Cl 2921-5-X2 [0,2,0,0,0,0|0,0,2]=4 760 B13R1.150 O=C(O)\C=C\C1=CC=CC(I)=C1Br 2921-S-01 [0,2,0,0,0,0|0,0,2]=4 761 B13R1.157 CC(C)(O)CCC1=CC=CC=C1O 2704-1-18 [0,2,0,0,0,0|1,0,1]=4 762 B13R1.893 CC1=CC(OCC(=O)O)=C(C)C=C1 2721-1-3Z [0,2,0,0,0,0|1,0,0]=3 763 B13R1.893 CC1=CC(OCC(=O)O)=C(F)C=C1 2723-3-0R [0,2,0,0,0,0|1,0,0]=3 764 B13R1.893 CC1=CC=C(F)C(CCC(=O)O)=C1 2721-3-59 [0,2,0,0,0,0|0,0,0]=2 765 B13R1.893 CC1=CC=C(F)C=C1CCC(=O)O 2721-3-69 [0,2,0,0,0,0|0,0,0]=2 766 B13R1.893 O=C(O)CCC1=CC(F)=CC=C1Br 2721-B-07 [0,2,0,0,0,0|0,0,0]=2 767 B13R1.893 O=C(O)COC1=CC(F)=CC=C1F 2621-3-6L [0,2,0,0,0,0|1,0,0]=3 768 B13R1.893 O=C(O)\C=C\C1=CC(Br)=CC=C1Cl 2921-D-00 [0,2,0,0,0,0|0,0,2]=4 769 B13R1.893 O=C(O)\C=C\C1=CC(O)=CC=C1O 2929-1-12 [0,2,0,0,0,0|0,0,2]=4 770 B13R1.3787 CC1=CC=CC(C)=C1OCC(=O)O 2721-1-2X [0,2,0,0,0,0|1,0,0]=3 771 B13R1.3787 CC1=CC=CC(C)=C1\C=C\C(=O)O 2921-1-04 [0,2,0,0,0,0|0,0,2]=4 772 B13R1.3787 CC1=CC=CC(Cl)=C1\C=C\C(=O)O 2921-5-01 [0,2,0,0,0,0|0,0,2]=4 773 B13R1.3787 O=C(O)CCC1=C(F)C=CC=C1F 2621-3-5X [0,2,0,0,0,0|0,0,0]=2 774 B13R1.3787 O=C(O)\C=C\C1=C(Cl)C=CC=C1Cl 2921-5-08 [0,2,0,0,0,0|0,0,2]=4 775 B13R1.3787 O=C(O)\C=C\C1=C(F)C=CC=C1Br 2921-B-08 [0,2,0,0,0,0|0,0,2]=4 776 B13R1.643 N#CC1=CC(OCC(=O)O)=CC=C1 4637-1-1Y [0,2,0,0,0,0|1,0,0]=3 777 B13R1.643 N#CC1=CC(\C=C\C(=O)O)=CC=C1 4937-1-02 [0,2,0,0,0,0|0,0,2]=4 778 B13R1.643 NC(=O)COC1=CC=CC(C=O)=C1 4648-1-6K [0,2,0,0,0,0|2,0,0]=4 779 B13R1.3420 CC1=CC(CCC(=O)O)=CC(F)=C1 2721-3-62 [0,2,0,0,0,0|0,0,0]=2 780 B13R1.3420 O=C(O)COC1=CC(Cl)=CC(Cl)=C1 2621-5-0P [0,2,0,0,0,0|1,0,0]=3 781 B13R1.3420 O=C(O)CSC1=CC(Cl)=NC(Cl)=C1 8H66-5-00 [0,2,0,0,0,0|2,0,0]=4 782 B13R1.3420 O=C(O)\C=C\C1=CC(Br)=CC(F)=C1 2921-B-09 [0,2,0,0,0,0|0,0,2]=4 783 B13R1.3420 O=C(O)\C=C\C1=CC(Cl)=CC(Cl)=C1 2921-5-00 [0,2,0,0,0,0|0,0,2]=4 784 B11R1.57 O=CC1=CC=CN1CC(=O)O 4H21-1-NB [0,0,1,1,0,0|2,0,0]=4 785 B11R1.172 O=C(O)CCCC1=CC=CS1 6H21-1-0F [0,0,1,1,0,0|1,0,1]=4 786 B11R2.1 CN1CCC2=CC=CC=C21 3H32-1-DB [1,0,0,1,0,0|2,0,0]=4 787 B11R2.1 NC1=NCC2=CC=CC=C21 3H30-5-0D [1,0,0,1,0,0|2,0,0]=4 788 B11R2.1 NN1CCC2=CC=CC=C21 3H30-5-U4 [1,0,0,1,0,0|2,0,0]=4 789 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 3730-1-W4 [1,0,0,1,0,0|1,0,1]=4 790 B11R2.1 N[C@H]1CCC2=CC=CC=C21 3730-1-S3 [1,0,0,1,0,0|1,0,1]=4 791 B11R2.1 O=C1C=CC2=CC=CC=C12 2917-1-02 [1,0,0,1,0,0|0,0,2]=4 792 B11R2.1 O=C1CCC2=CC=CN=C12 4H17-1-7Y [1,0,0,1,0,0|1,0,0]=3 793 B11R2.1 O=C1COC2=C1N=CC=C2 4H48-5-2Z [1,0,0,1,0,0|2,0,0]=4 794 B11R2.1 O=C1NCC2=CC=CN=C12 4H48-1-UC [1,0,0,1,0,0|2,0,0]=4 795 B11R2.1 O=C1NNC2=CC=CC=C12 4H56-1-2V [1,0,0,1,0,0|2,0,0]=4 796 B11R2.1 O=C1OCC2=C1C=CN=C2 4H56-1-HF [1,0,0,1,0,0|2,0,0]=4 797 B11R2.1 OC1CCC2=CC=CN=C21 4H02-1-0F [1,0,0,1,0,0|1,0,1]=4 798 B11R2.1 O[C@@H]1CCC2=CC=CC=C21 2602-1-R2 [1,0,0,1,0,0|0,0,1]=3 799 B11R2.1 O[C@H]1CCC2=CC=CC=C21 2602-1-S2 [1,0,0,1,0,0|0,0,1]=3 800 B11R2.4 NC1CC1C2=CC=CC=C2 3630-1-0A [1,0,0,1,0,0|1,0,1]=4 801 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 3630-1-11 [1,0,0,1,0,0|1,0,1]=4 802 B11R2.20 C1=CC=C2CNCCC2=C1 3H31-5-83 [1,0,0,1,0,0|2,0,0]=4 803 B11R2.20 C1=CC=C2OCCCC2=C1 2H07-1-0E [1,0,0,1,0,0|0,0,1]=3 804 B11R2.238 C1=CC=C(C[C@@H]2CN2)C=C1 3634-1-R0 [1,0,0,1,0,0|1,0,1]=4 805 B11R2.238 C1=CC=C(C[C@H]2CN2)C=C1 3634-1-S1 [1,0,0,1,0,0|1,0,1]=4 806 B11R2.239 C1=CC=C(C2CNC2)C=C1 3H31-5-3U [1,0,0,1,0,0|2,0,0]=4 807 B11R2.239 C1=CC=C(C2COC2)C=C1 2H10-1-0W [1,0,0,1,0,0|2,0,0]=4 808 B11R2.988 N#CC1CC2=CC=CC=C21 3637-1-Y2 [1,0,0,1,0,0|1,0,1]=4 809 B11R2.10 BrC1=CC2=CC=CC=C2O1 2H10-9-12 [0,0,0,1,1,0|1,0,1]=4 810 B11R2.10 CC1=CC2=CC=CC=C2O1 2H10-1-0N [0,0,0,1,1,0|1,0,1]=4 811 B11R2.10 CC1=NC2=CC=CC=C2O1 4H32-1-0T [0,0,0,1,1,0|2,0,0]=4 812 B11R2.10 CC1CC2=C(C=CC=C2)O1 2H10-1-0K [0,0,0,1,1,0|1,0,1]=4 813 B11R2.10 O=C1CC2=NC=CC=C2N1 4H48-1-AT [0,0,0,1,1,0|2,0,0]=4 814 B11R2.10 O=C1NC2=NC=CC=C2O1 4H17-1-2U [0,0,0,1,1,0|2,0,0]=4 815 B11R2.10 OC1=NC2=CC=CC=C2S1 8H01-1-21 [0,0,0,1,1,0|1,1,0]=4 816 B11R2.10 S=C1CC2=CC=CC=C2N1 7H67-1-69 [0,0,0,1,1,0|1,1,0]=4 817 B11R2.10 SC1=NC2=CC=CC=C2O1 8H61-1-44 [0,0,0,1,1,0|1,1,0]=4 818 B11R2.36 O=C1CCC2=C(C=CN2)C1 4H48-1-CV [0,0,0,1,1,0|2,0,0]=4 819 B11R2.36 O=C1CCN2C=CC=C2C1 4H17-1-12 [0,0,0,1,1,0|2,0,0]=4 820 B13R2.10 O=C1CCC(C2=CC=CC=C2)O1 2H25-1-2C [0,0,0,1,0,1|0,0,0]=2 821 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 8H67-1-S2 [0,0,0,1,0,1|1,1,0]=4 822 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 7H67-1-S2 [0,0,0,1,0,1|1,1,0]=4 823 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 8H67-1-R3 [0,0,0,1,0,1|1,1,0]=4 824 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 7H67-1-R1 [0,0,0,1,0,1|1,1,0]=4 825 B13R2.72 O=C(O)C1CCC2=CC=CN=C21 4H21-1-0Q [0,0,0,1,0,1|1,0,0]=3 826 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 4H21-1-KV [0,0,0,1,0,1|0,0,0]=2 827 B13R2.72 O=C(O)C1NCC2=CC=CC=C21 4H21-1-40 [0,0,0,1,0,1|0,0,0]=2 828 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 4H48-1-60 [0,0,0,1,0,1|1,0,0]=3 829 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 2621-1-X5 [0,0,0,1,0,1|0,0,0]=2 830 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 2621-1-X4 [0,0,0,1,0,1|0,0,0]=2 831 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CN=C2 4H21-1-56 [0,0,0,1,0,1|1,0,0]=3 832 B13R2.147 NC1=CC=C([C@H]2C[C@H](O)C2)C=C1 4656-1-2J [0,1,0,1,0,0|1,0,1]=4 833 B13R2.147 O=C1CC(C2=CC=C(Cl)C=C2)C1 2217-5-05 [0,1,0,1,0,0|1,0,0]=3 834 B13R2.147 OC1CC(C2=CC=C(Br)C=C2)C1 2601-9-12 [0,1,0,1,0,0|1,0,1]=4 835 B13R2.155 CC1=CC2=C(C=C1)OCC(=O)N2 4H48-1-CB [0,1,0,1,0,0|2,0,0]=4 836 B13R2.155 NC1=CC2=C(C=C1)NCC(=O)N2 4H48-5-J5 [0,1,0,1,0,0|2,0,0]=4 837 B13R2.155 O=C1C=CC2=CC=C(Cl)C=C2O1 2H25-5-0F [0,1,0,1,0,0|0,0,2]=4 838 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 2H25-1-28 [0,1,0,1,0,0|0,0,2]=4 839 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2C1 2717-5-08 [0,1,0,1,0,0|1,0,0]=3 840 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2N1 4H48-5-GZ [0,1,0,1,0,0|1,0,0]=3 841 B13R2.155 O=C1CCC2=CC=C(F)C=C2C1 2717-3-22 [0,1,0,1,0,0|1,0,0]=3 842 B13R2.155 O=C1CCC2=CC=C(F)C=C2N1 4H48-3-7K [0,1,0,1,0,0|1,0,0]=3 843 B13R2.155 O=C1CCC2=CC=C(O)C=C2C1 2620-1-0S [0,1,0,1,0,0|1,0,0]=3 844 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 4H20-1-27 [0,1,0,1,0,0|1,0,0]=3 845 B13R2.155 O=C1CNC2=C(C=C(Cl)C=C2)N1 4H48-5-HB [0,1,0,1,0,0|2,0,0]=4 846 B13R2.155 O=C1COC2=CC=C(F)C=C2N1 4H48-3-Y4 [0,1,0,1,0,0|2,0,0]=4 847 B13R2.155 O=C1NC2=CC(Br)=CC=C2CO1 4H56-9-9G [0,1,0,1,0,0|2,0,0]=4 848 B13R2.32 CN1C(=O)COC2=C1C=CC=C2 4H48-1-08N [0,1,0,1,0,0|2,0,0]=4 849 B13R2.33 O=C1CCC2=C(C=CC=C2)CN1 4H48-1-8P [0,1,0,1,0,0|1,0,0]=3 850 B13R2.33 O=C1CCC2=CC=CC=C2CC1 2617-1-40 [0,1,0,1,0,0|1,0,0]=3 851 B13R2.33 O=C1CNC2=CC=CC=C2CN1 4H48-1-05P [0,1,0,1,0,0|2,0,0]=4 852 B13R2.57 BrCC1CCC2=CC=CC=C2O1 2H10-9-X7 [0,1,0,1,0,0|1,0,1]=4 853 B13R2.57 N#CC1CCC2=C(C=CC=C2)O1 4H37-1-2A [0,1,0,1,0,0|1,0,1]=4 854 B13R2.57 O=CC1=CC2=CC=CC=C2OC1 2H15-1-15 [0,1,0,1,0,0|2,0,0]=4 855 B13R2.57 O=CC1CCC2=C(C=CC=C2)O1 2H15-1-34 [0,1,0,1,0,0|0,0,1]=3 856 B13R2.57 O=NN1CCC2=C(C=CC=C2)C1 4H50-1-03 [0,1,0,1,0,0|2,0,0]=4 857 B13R2.57 OCC1=CC2=CC=CC=C2OC1 2H01-1-20 [0,1,0,1,0,0|2,0,0]=4 858 B13R2.369 CC1NC2=CC=CC=C2NC1=O 4H48-1-AF [0,1,0,1,0,0|2,0,0]=4 859 B13R2.369 CC1SC2=C(C=CC=C2)NC1=O 8H70-1-5E [0,1,0,1,0,0|2,0,0]=4 860 B13R2.369 CN1CC2=CC=CC=C2NC1=O 4H53-1-0T [0,1,0,1,0,0|2,0,0]=4 861 B13R2.369 NC1=CC2=CC=CC=C2OC1=O 4H30-1-65 [0,1,0,1,0,0|0,0,2]=4 862 B13R2.369 NC1CC2=CC=CC=C2NC1=O 4H48-1-0A [0,1,0,1,0,0|1,0,0]=3 863 B13R2.369 O=C1NC2=C(C=CC=C2)OC1=O 4H48-1-08P [0,1,0,1,0,0|1,0,1]=4 864 B13R2.369 O=C1OC2=CC=CC=C2C=C1Cl 2H17-5-22 [0,1,0,1,0,0|0,0,2]=4 865 B13R2.369 O=C1OC2=CC=CC=C2C=C1O 2H25-1-23 [0,1,0,1,0,0|0,0,2]=4 866 B13R2.435 CC(=O)C1CC2=CC=CC=C2C1 2717-1-33 [0,1,0,1,0,0|1,0,0]=3 867 B13R2.435 O=C(Cl)C1CC2=CC=CC=C2O1 2H16-1-00 [0,1,0,1,0,0|1,0,0]=3 868 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 2621-1-0U [0,1,0,1,0,0|0,0,1]=3 869 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 8H21-1-Z9 [0,1,0,1,0,0|1,0,1]=4 870 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 4H57-1-30 [0,1,0,1,0,0|0,0,0]=2 871 B13R2.435 O=C(O)[C@H]1CC2=CC=CC=C2N1 4H48-1-RA [0,1,0,1,0,0|0,0,0]=2 872 B13R2.328 CN1CC(=O)OC2=CC=CC=C21 4H31-1-0V [0,1,0,1,0,0|1,0,0]=3 873 B13R2.328 O=C1C=C(Cl)C2=CC=CC=C2O1 2H25-5-0T [0,1,0,1,0,0|0,0,2]=4 874 B13R2.328 O=C1NC(=O)C2=CC=CC=C2O1 4H56-1-06Y [0,1,0,1,0,0|1,0,1]=4 875 B13R2.12159 O=S1(=O)CC(O)C2=C1C=CC=C2 6H01-1-0C [0,1,0,1,0,0|1,0,1]=4 876 B13R2.222 CC1(C)CCC2=CC=CC=C2O1 2H10-1-37 [0,1,0,1,0,0|1,0,1]=4 877 B13R2.5179 O=C1CCC2=C(C=CC=C2O)N1 4H20-1-17 [0,1,0,1,0,0|1,0,0]=3 878 B13R2.151 O=C1CC(C2=CC(Br)=CC=C2)C1 2717-9-01 [0,1,0,1,0,0|1,0,0]=3 879 B13R2.162 CC1=CC=CN2CCC(=O)N=C12 4H48-1-080 [0,1,0,1,0,0|2,0,0]=4 880 B13R2.162 NC1=CC=CC2=C1NC(=O)CO2 4H54-1-7W [0,1,0,1,0,0|2,0,0]=4 881 B13R2.162 O=C1CCC2=C(C1)C(O)=CC=C2 2720-1-10 [0,1,0,1,0,0|1,0,0]=3 882 B13R2.162 O=C1CCC2=C(N1)C(Br)=CC=C2 4H48-1-KE [0,1,0,1,0,0|1,0,0]=3 883 B13R2.162 O=C1CCC2=C(N1)C(Cl)=CC=C2 4H48-5-0R [0,1,0,1,0,0|1,0,0]=3 884 B13R2.162 O=C1CCC2=C(N1)C(F)=CC=C2 4H48-3-0R [0,1,0,1,0,0|1,0,0]=3 885 B13R2.162 O=C1COC2=C(N1)C(O)=CC=C2 4H48-1-06V [0,1,0,1,0,0|2,0,0]=4 886 B13R2.162 O=C1COC2=CC=CC(F)=C2N1 4H48-3-9H [0,1,0,1,0,0|2,0,0]=4 887 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 4H48-1-081 [0,1,0,1,0,0|2,0,0]=4 888 B13R2.3683 CC1=CC=C2OC(=O)C=CC2=C1 2H25-1-47 [0,1,0,1,0,0|0,0,2]=4 889 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 4H30-1-2L [0,1,0,1,0,0|2,0,0]=4 890 B13R2.3683 NC1=CC=C2OC(=O)C=CC2=C1 4H58-1-GA [0,1,0,1,0,0|0,0,2]=4 891 B13R2.3683 O=C1C=CC2=CC(Cl)=CC=C2O1 2H25-5-0G [0,1,0,1,0,0|0,0,2]=4 892 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 2H25-1-22 [0,1,0,1,0,0|0,0,2]=4 893 B13R2.3683 O=C1CCC2=CC(Cl)=CC=C2C1 2717-5-07 [0,1,0,1,0,0|1,0,0]=3 894 B13R2.3683 O=C1CCC2=CC(F)=CC=C2C1 2717-3-19 [0,1,0,1,0,0|1,0,0]=3 895 B13R2.3683 O=C1CCC2=CC(O)=CC=C2N1 4H20-1-11 [0,1,0,1,0,0|1,0,0]=3 896 B13R2.3683 O=C1COC2=CC(Br)=CC=C2N1 4H17-9-49 [0,1,0,1,0,0|2,0,0]=4 897 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2N1 4H17-5-3E [0,1,0,1,0,0|2,0,0]=4 898 B13R2.3683 O=C1COC2=CC(F)=CC=C2N1 4H48-3-2F [0,1,0,1,0,0|2,0,0]=4 899 B13R2.3683 O=C1CSC2=C(C=CC(Cl)=C2)N1 8H48-5-0A [0,1,0,1,0,0|2,0,0]=4 900 B13R2.3683 O=C1NC2=CC=C(Br)C=C2CO1 4H48-9-42 [0,1,0,1,0,0|2,0,0]=4 901 B9R1.12 OCCCC1=CC=CS1 6H21-1-0E [1,0,0,0,1,0|1,0,1]=4 902 B9R1.12 OCCCC1=CSC=C1 6H01-1-0J [1,0,0,0,1,0|1,0,1]=4 903 B9R1.12 OCCCN1C=CC=C1 4H01-1-F0 [1,0,0,0,1,0|1,0,1]=4 904 B9R1.6 CC(=O)C1=CC=CC=N1 4H17-1-Z0 [0,0,0,0,2,0|2,0,0]=4 905 B9R1.6 CC(=O)C1=CC=CN=C1 4H17-1-Y1 [0,0,0,0,2,0|2,0,0]=4 906 B9R1.6 CS(=O)C1=CC=CC=C1 6665-1-07 [0,0,0,0,2,0|2,0,0]=4 907 B9R1.6 N=C(N)C1=CC=CC=C1 3641-5-02 [0,0,0,0,2,0|2,0,0]=4 908 B9R1.6 NC(=O)C1=CC=CC=C1 4648-1-48 [0,0,0,0,2,0|1,0,0]=3 909 B9R1.6 NC(=O)C1=CC=C[NH+]=C1 4H48-H-00 [0,0,0,0,2,0|2,0,0]=4 910 B9R1.6 NC(=O)C1=NC=CC=C1 4H48-1-03J [0,0,0,0,2,0|2,0,0]=4 911 B9R1.6 NC(=S)C1=CC=CC=C1 7667-1-21 [0,0,0,0,2,0|1,1,0]=4 912 B9R1.6 O=C(Cl)C1=CC=CC=N1 4H16-5-64 [0,0,0,0,2,0|2,0,0]=4 913 B9R1.6 O=C(F)C1=CC=CC=C1 2616-3-01 [0,0,0,0,2,0|1,0,0]=3 914 B9R1.6 O=C(O)C1=CC=CN=C1 4H56-1-4A [0,0,0,0,2,0|1,0,0]=3 915 B9R1.6 O=C(S)C1=CN=CC=C1 8H61-1-0C [0,0,0,0,2,0|1,1,0]=4 916 B9R1.6 O=S([O-])C1=CC=CC=C1 6663-1-16 [0,0,0,0,2,0|1,0,1]=4 917 B9R1.13 CC(=O)CC1=CC=CS1 6H17-1-43 [0,0,0,0,2,0|2,0,0]=4 918 B9R1.13 NC(=O)CC1=CC=CS1 8H48-1-0H [0,0,0,0,2,0|2,0,0]=4 919 B9R1.13 NC(=O)CC1=CSC=C1 8H48-1-0Z [0,0,0,0,2,0|2,0,0]=4 920 B9R1.13 O=C(O)CC1=CC=CN1 4H21-1-GY [0,0,0,0,2,0|1,0,0]=3 921 B9R1.13 O=C(O)CC1=CC=CO1 2H21-1-0S [0,0,0,0,2,0|1,0,0]=3 922 B9R1.13 O=C(O)CC1=CNC=C1 4H21-1-GG [0,0,0,0,2,0|1,0,0]=3 923 B9R1.13 O=C(O)CC1=COC=C1 2H21-1-40 [0,0,0,0,2,0|1,0,0]=3 924 B9R1.13 O=C(O)CC1=CSC=N1 8H21-1-0R [0,0,0,0,2,0|2,0,0]=4 925 B9R1.13 O=C(O)CC1=CSC=N1 8H70-5-55 [0,0,0,0,2,0|2,0,0]=4 926 B9R1.13 O=C(O)CC1=NC=CS1 8H21-1-0N [0,0,0,0,2,0|2,0,0]=4 927 B9R1.13 O=C(O)CC1=NNC=C1 4H21-1-0Z [0,0,0,0,2,0|2,0,0]=4 928 B9R1.13 O=C(O)CN1C=CC=C1 4H21-1-MW [0,0,0,0,2,0|1,0,0]=3 929 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 2721-1-70 [0,0,0,0,0,2|0,0,0]=2 930 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 2721-1-04 [0,0,0,0,0,2|0,0,0]=2 931 B13R1.337 O=C(O)CS\C=C\C1=CC=CC=C1 6966-1-04 [0,0,0,0,0,2|0,0,1]=3 932 B13R1.337 O=C(O)\C=C\C=C\C1=CC=CC=C1 2921-1-02 [0,0,0,0,0,2|0,0,2]=4 933 B13R1.337 O=C(O)\C=N\OCC1=CC=CC=C1 4747-1-01 [0,0,0,0,0,2|0,0,1]=3