0 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 2620-1-57 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 4H21-1-MJ [0,0,0,0,0,0|4,0,0]=4 2 B11R1.3 CNC1=CC=C(C(=O)O)N=N1 4H57-1-0Q [0,0,0,0,0,0|4,0,0]=4 3 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 2607-1-R5 [0,0,0,0,0,0|0,0,2]=2 4 B11R1.3 COC1=NC=C(C(=O)O)C=N1 4H58-1-KN [0,0,0,0,0,0|3,0,0]=3 5 B11R1.3 N#CC1=CC=C(C(=N)N)C=C1 3641-5-09 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.3 O=C(O)C1=CC=C(CBr)N=C1 4H58-9-97 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.3 COC1=CN=C(C=O)N=C1 4H56-1-0A [1,0,0,0,0,0|2,0,0]=3 8 B10R1.3 COC1=CN=C(CCl)C=C1 4H07-5-3M [1,0,0,0,0,0|2,0,1]=4 9 B10R1.3 N#CC1=CC=C(C=O)N=C1 4H37-1-65 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.13 CC(=O)C1=CC=C(Cl)N=N1 4H17-5-2C [1,0,0,0,0,0|3,0,0]=4 11 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 1700-D-15 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 1700-7-30 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.13 CC1=CC=C(C(C)O)C=N1 4H02-1-0E [1,0,0,0,0,0|1,0,2]=4 14 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 6665-5-03 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 2602-5-R0 [1,0,0,0,0,0|1,0,2]=4 16 B10R1.13 N=C(N)C1=CC=C(N)C=C1 3641-5-03 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.13 NC(=O)C1=CN=C(F)C=C1 4H48-3-8L [1,0,0,0,0,0|3,0,0]=4 18 B10R1.13 NC1=CC=C(C(=O)Cl)C=C1 4630-5-0B [1,0,0,0,0,0|2,0,0]=3 19 B10R1.13 O=C(Cl)C1=CC=C(F)C=N1 4H16-7-0B [1,0,0,0,0,0|3,0,0]=4 20 B10R1.13 O=C1C=CC(C(=O)Cl)=CO1 2H16-5-08 [1,0,0,0,0,0|2,0,1]=4 21 B12R1.5 CCC1=CC=C(C(=O)CCl)C=C1 2717-5-0B [0,1,0,0,0,0|1,0,0]=2 22 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 4H58-1-266 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.5 COC1=CC=C(C(=O)CCl)C=N1 4H17-5-1Z [0,1,0,0,0,0|1,0,0]=2 24 B12R1.5 COC1=CC=C(C(N)C#N)C=C1 4637-5-0R [0,1,0,0,0,0|1,0,2]=4 25 B12R1.5 COC1=CC=C(N(C)C=O)C=C1 4648-1-5D [0,1,0,0,0,0|1,0,0]=2 26 B12R1.5 O=C(CBr)C1=CC=C(CF)C=C1 2717-B-0B [0,1,0,0,0,0|2,0,0]=3 27 B12R1.6 COC1=CC=C(C(C)(C)O)C=C1 2607-1-X2 [0,1,0,0,0,0|0,0,2]=3 28 B12R1.48 CC(=O)C1=CC=C(C#N)C(C)=C1 4737-1-1B [0,1,0,0,0,0|2,0,0]=3 29 B12R1.48 COC1=C(Br)C=C(C(=O)Cl)C=C1 2616-D-04 [0,1,0,0,0,0|1,0,0]=2 30 B12R1.48 COC1=C(Br)C=C(N(C)C)C=C1 4656-9-0P [0,1,0,0,0,0|2,0,0]=3 31 B12R1.48 COC1=C(C)C=C(C(N)=O)C=C1 4748-1-1C [0,1,0,0,0,0|1,0,0]=2 32 B12R1.48 COC1=CC=C([N+](=O)[O-])N=C1C 4H54-1-FH [0,1,0,0,0,0|3,0,0]=4 33 B12R1.113 NC(=O)C1=CC=C(CCCl)C=C1 4648-5-1P [0,1,0,0,0,0|2,0,0]=3 34 B12R1.256 CC(=O)C1=CN=C(C(=O)O)C=C1 4H58-1-618 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.256 O=C(O)C1=CC=C(C(=O)Cl)C=C1 2621-5-1B [0,1,0,0,0,0|3,0,0]=4 36 B12R1.452 COC1=CC=C(C(N)=O)C(N)=C1 4648-1-82 [0,1,0,0,0,0|1,0,0]=2 37 B12R1.452 COC1=CN=C(C(=O)O)C(N)=C1 4H30-1-CT [0,1,0,0,0,0|2,0,0]=3 38 B12R1.452 N#CC1=CC=C(C(=O)O)C(O)=C1 4637-1-44 [0,1,0,0,0,0|3,0,0]=4 39 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 2723-9-19 [0,0,0,0,0,1|2,0,0]=3 40 B12R1.4 CC(=O)SC1=CC=C(C=O)C=C1 6666-1-0V [0,0,0,0,0,1|2,0,0]=3 41 B12R1.4 O=C(O)CC1=CC=C(CCl)C=C1 2721-5-31 [0,0,0,0,0,1|3,0,0]=4 42 B9R1.1 COC1=CN=C(O)C=C1 4H07-1-6A [2,0,0,0,0,0|1,0,1]=4 43 B9R1.1 CSC1=CC=C(O)C=N1 8H66-1-AP [2,0,0,0,0,0|2,0,0]=4 44 B9R1.6 CC(=O)C1=CC=CN=N1 4H56-1-030 [2,0,0,0,0,0|2,0,0]=4 45 B11R1.83 CCOC1=CC=C(CBr)C=C1 2707-9-15 [1,1,0,0,0,0|1,0,1]=4 46 B11R1.279 CC1=CC(C=O)=CC=C1C#N 4737-1-0W [1,1,0,0,0,0|2,0,0]=4 47 B11R1.279 CCC1=CC=C(C=O)C(O)=C1 2715-1-57 [1,1,0,0,0,0|1,0,0]=3 48 B11R1.279 COC1=CC(N)=C(OC)N=C1 4H30-1-C2 [1,1,0,0,0,0|2,0,0]=4 49 B11R1.279 COC1=CC=C(C#N)C=C1C 4737-1-0Q [1,1,0,0,0,0|1,0,1]=4 50 B11R1.279 COC1=CC=C(C=O)C(C)=N1 4H15-1-6X [1,1,0,0,0,0|1,0,0]=3 51 B11R1.279 COC1=CC=C(C=O)C(N)=C1 4656-1-0G [1,1,0,0,0,0|0,0,0]=2 52 B11R1.279 COC1=CC=C(C=O)N=C1Br 4H56-9-L2 [1,1,0,0,0,0|1,0,0]=3 53 B11R1.279 COC1=CC=C(CN)C=C1Br 4656-9-50 [1,1,0,0,0,0|1,0,1]=4 54 B11R1.279 COC1=CC=C(CO)C(O)=C1 2607-1-33 [1,1,0,0,0,0|0,0,2]=4 55 B11R1.279 COC1=CC=C(CO)C=C1O 2607-1-24 [1,1,0,0,0,0|0,0,2]=4 56 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 8H32-1-00 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 8H64-1-74 [1,1,0,0,0,0|2,0,0]=4 58 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 6663-H-00 [1,1,0,0,0,0|2,0,0]=4 59 B11R1.19 C[Si](C)(C)C1=CC=C(O)C=C1 6680-1-09 [1,1,0,0,0,0|1,1,0]=4 60 B11R1.21 CC(=O)C1=CC(O)=C(Cl)C=C1 2617-5-1G [1,1,0,0,0,0|1,0,0]=3 61 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 4756-1-1S [1,1,0,0,0,0|0,0,0]=2 62 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 4656-5-2D [1,1,0,0,0,0|1,0,0]=3 63 B11R1.21 CC(=O)C1=CC=C(N)C(I)=C1 4656-H-0A [1,1,0,0,0,0|1,0,0]=3 64 B11R1.21 O=C(O)C1=CN=C(O)C(O)=C1 4H58-1-499 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 4756-5-16 [1,1,0,0,0,0|0,0,0]=2 66 B11R1.22 CC1=CC=C(C(O)CN)C=C1 4756-5-0A [1,1,0,0,0,0|0,0,2]=4 67 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 4756-1-RV [1,1,0,0,0,0|1,0,1]=4 68 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 4648-5-0U [1,1,0,0,0,0|1,0,0]=3 69 B11R1.22 O=C(CCl)C1=CC=C(F)C=N1 4H17-7-0M [1,1,0,0,0,0|2,0,0]=4 70 B11R1.166 CC(=O)C1=C(C)N=C(O)C=C1 4H17-1-4Y [1,1,0,0,0,0|1,0,0]=3 71 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 4656-5-56 [1,1,0,0,0,0|2,0,0]=4 72 B11R1.166 CC1=CC(Br)=C(C(N)=O)C=C1 4748-9-0B [1,1,0,0,0,0|1,0,0]=3 73 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=N1 4H16-5-65 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 4H21-3-71 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.166 NC(=O)C1=CC=C(N)C=C1F 4648-3-65 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.166 NC1=CC=C(C(=O)O)C(Br)=C1 4657-9-15 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.166 O=C(Cl)C1=CC=C(F)C=C1O 2616-7-0C [1,1,0,0,0,0|2,0,0]=4 78 B11R1.166 O=C(Cl)C1=CC=C(O)C=C1Cl 2616-5-0E [1,1,0,0,0,0|1,0,0]=3 79 B11R1.44 CCC1=CC=C(C(=O)OC)S1 6H23-1-0P [0,1,0,0,1,0|2,0,0]=4 80 B11R1.124 CCOC1=CC=C(C(=O)O)S1 6H66-1-0N [0,1,0,0,1,0|2,0,0]=4 81 B13R1.5 C=CC1=CC=C(CC(=O)OC)C=C1 2923-1-33 [0,1,0,0,0,1|1,0,1]=4 82 B13R1.5 COC(=O)CC1=CC=C(OC)N=C1 4H23-1-JS [0,1,0,0,0,1|1,0,0]=3 83 B13R1.36 COC1=CC=C([C@H](O)C(=O)O)C=C1 2629-1-S3 [0,1,0,0,0,1|1,0,0]=3 84 B13R1.585 CC(C)C1=CC=C(CC(=O)Cl)C=C1 2716-5-0B [0,1,0,0,0,1|2,0,0]=4 85 B13R1.585 CN(C)C1=CC=C(CC(=O)Cl)C=C1 4632-5-00 [0,1,0,0,0,1|2,0,0]=4 86 B13R1.95 COC(=O)C1=C(Cl)C=C(OC)C=C1 2623-5-0G [0,2,0,0,0,0|0,0,0]=2 87 B13R1.95 COC(=O)C1=CC=C(C=O)C=C1Br 2623-9-35 [0,2,0,0,0,0|2,0,0]=4 88 B13R1.187 COC1=CC=C(C(C)(O)CN)C=C1 4H56-5-4N [0,2,0,0,0,0|0,0,2]=4 89 B13R1.452 CCCC(=O)C1=CC=C(C#N)C=C1 4637-1-4M [0,2,0,0,0,0|2,0,0]=4 90 B13R1.452 CCOC(=O)C1=CC=C(C=O)C=C1 2623-1-2D [0,2,0,0,0,0|2,0,0]=4 91 B13R1.537 CNC(=O)C1=CC=C(C(=O)O)C=C1 4648-1-79 [0,2,0,0,0,0|2,0,0]=4 92 B13R1.3088 CCC(=O)C1=CC=C(OC)C(Cl)=C1 2617-5-0D [0,2,0,0,0,0|0,0,0]=2 93 B13R1.3088 CCC(=O)C1=CC=C(OC)C(F)=C1 2617-3-69 [0,2,0,0,0,0|0,0,0]=2 94 B13R1.3088 COC(=O)C1=CC(C)=C(C=O)C=C1 2723-1-1K [0,2,0,0,0,0|2,0,0]=4 95 B13R1.3088 COC(=O)C1=CC=C(CO)C(O)=C1 2729-1-32 [0,2,0,0,0,0|2,0,0]=4 96 B13R1.3088 COC(=O)C1=CN=C(OC)C(C)=C1 4H58-1-339 [0,2,0,0,0,0|1,0,0]=3 97 B13R1.3088 COC(=O)C1=CN=C(OC)C(N)=C1 4H58-1-529 [0,2,0,0,0,0|1,0,0]=3 98 B13R1.120 CC(=O)C1=CC=C(C(=O)O)C(C)=C1 2729-1-0X [0,2,0,0,0,0|2,0,0]=4 99 B13R1.120 CC(=O)C1=CC=C(C(=O)O)C=C1O 2629-1-4B [0,2,0,0,0,0|2,0,0]=4 100 B13R1.144 CCOC1=C(C)C=C(C(=O)O)C=N1 4H21-1-MK [0,2,0,0,0,0|2,0,0]=4 101 B13R1.144 CCOC1=C(F)C=C([N+](=O)[O-])C=C1 4654-3-AW [0,2,0,0,0,0|2,0,0]=4 102 B13R1.144 CCOC1=CC=C(C(=O)O)C=C1C 2721-1-2B [0,2,0,0,0,0|1,0,0]=3 103 B13R1.652 COC1=CC(Br)=C(C(=O)O)C=C1O 2629-9-37 [0,2,0,0,0,0|1,0,0]=3 104 B13R1.652 COC1=NC(C)=C(C(C)=O)C=C1I 4H56-H-22 [0,2,0,0,0,0|1,0,0]=3 105 B13R1.3091 CCC1=CC(C(C)=O)=CC=C1CO 2717-1-0U [0,2,0,0,0,0|2,0,0]=4 106 B13R1.3091 COC1=CC=C(C(=O)O)C=C1C#N 4637-1-3H [0,2,0,0,0,0|1,0,0]=3 107 B13R1.3096 COC1=CC=C(C(=O)O)C(O)=C1O 2629-1-2C [0,2,0,0,0,0|1,0,0]=3 108 B13R1.3096 COC1=CC=C([N+](=O)[O-])C(N)=C1Br 4655-9-0A [0,2,0,0,0,0|2,0,0]=4 109 B13R1.385 CCOC1=CC=C(C(=O)O)C(Cl)=C1 2621-5-47 [0,2,0,0,0,0|1,0,0]=3 110 B13R1.99 CCC1=C(C(=O)O)C=CC(OC)=N1 4H21-1-PG [0,2,0,0,0,0|2,0,0]=4 111 B13R1.428 COC1=CC(C)=C([N+](=O)[O-])C(C)=C1 4754-1-1M [0,2,0,0,0,0|2,0,0]=4 112 B13R2.2121 COC1=CC2=NC(C)=CN2C=C1 4H07-1-82 [0,0,0,1,0,1|2,0,0]=4 113 B13R2.2121 COC1=CC=C2OC(Cl)=NC2=C1 4656-5-1E [0,0,0,1,0,1|2,0,0]=4 114 B13R2.2121 O=CC1=CC=C2NC(=O)CC2=C1 4H15-1-4J [0,0,0,1,0,1|2,0,0]=4 115 B13R2.2130 COC1=CC=C2C(=C1)C=NN2C 4H07-1-3G [0,1,0,1,0,0|2,0,0]=4 116 B13R2.2130 COC1=CC=C2C(=C1)N=CN2C 4H07-1-3F [0,1,0,1,0,0|2,0,0]=4 117 B13R2.430 CC(=O)C1=CC=C2C=NNC2=C1 4H56-1-F3 [0,1,0,1,0,0|2,0,0]=4 118 B13R2.430 CC(=O)C1=CC=C2NC=NC2=C1 4H17-1-34 [0,1,0,1,0,0|1,0,1]=4 119 B13R2.430 CC(=O)C1=CC=C2NCCC2=C1 4H17-1-8E [0,1,0,1,0,0|1,0,0]=3 120 B13R2.430 CC(=O)C1=CC=C2SC=CC2=C1 6H17-1-0E [0,1,0,1,0,0|0,1,1]=4 121 B13R2.430 O=C(Cl)C1=CC=C2OC=CC2=C1 2H16-5-15 [0,1,0,1,0,0|1,0,1]=4 122 B13R2.430 O=C(O)C1=CC=C2CCCC2=C1 2721-1-3D [0,1,0,1,0,0|2,0,0]=4 123 B9R1.35 CC(=O)C1=CC(C)=NS1 8H15-1-0F [1,0,0,0,1,0|2,0,0]=4 124 B9R1.35 CC(=O)C1=CC=C(Br)O1 2H17-9-30 [1,0,0,0,1,0|2,0,0]=4 125 B9R1.35 CC(=O)N1C=CC(N)=C1 4H48-1-WC [1,0,0,0,1,0|2,0,0]=4 126 B11R1.20 CC(=O)NC1=CC=C(Cl)N=C1 4H48-5-HJ [1,0,0,0,0,1|2,0,0]=4 127 B11R1.20 CC(C)CC1=CC=C(O)C=C1 2701-1-1K [1,0,0,0,0,1|1,0,1]=4 128 B11R1.20 CC(C)SC1=CC=C(O)C=C1 6666-1-0X [1,0,0,0,0,1|1,0,1]=4 129 B11R1.20 CN(C)CC1=CC=C(O)C=C1 4632-1-0S [1,0,0,0,0,1|2,0,0]=4 130 B13R1.3 CC(=O)\C=C\C1=CC=C(C=O)C=C1 2917-1-0L [0,0,0,0,0,2|2,0,0]=4 131 B13R1.3 COC1=CC=C(OCC(C)O)C=C1 2608-1-1L [0,0,0,0,0,2|0,0,2]=4