0 B11R1.166 CC1=CC(Br)=C(C(N)=O)C=C1 4748-9-0B [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 6760-1-87 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.166 CC1=CC=C(B(O)O)C(O)=N1 8H60-1-JN [0,0,0,0,0,0|4,0,0]=4 3 B11R1.166 CC1=CN=C([N+](=O)[O-])C(O)=C1 4H54-1-G7 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.166 C[C@@H](N)C1=CC=C(Cl)C=C1Cl 3630-5-R2 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 3631-F-S0 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1Cl 3630-5-S2 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.166 C[C@H](N)C1=CC=C(Cl)N=C1Cl 3H30-5-S7 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1Cl 3H32-D-S0 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1Br 3H32-D-S1 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1F 3H30-7-S9 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.166 C[C@H](N)C1=NC=C(F)C=C1Br 3H32-B-S0 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.166 FC1=CC(Br)=CC=C1C(F)F 1700-B-Y7 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.166 O=C(Cl)C1=CC=C(F)C=C1O 2616-7-0C [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 1700-D-15 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 CC(C)C1=CC=C(N)N=C1 3H30-1-3E [1,0,0,0,0,0|2,0,0]=3 16 B10R1.13 CC(C)C1=CC=[N+]([O-])C=C1 4H55-1-1C [1,0,0,0,0,0|2,0,0]=3 17 B10R1.13 CC(C)C1=CN=C(N)N=C1 3H30-1-TT [1,0,0,0,0,0|3,0,0]=4 18 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 1700-7-30 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.13 CC1=CC=C(C(C)O)C=N1 4H02-1-0E [1,0,0,0,0,0|2,0,0]=3 20 B10R1.13 CC1=CN=C([C@H](C)N)N=C1 3H30-1-SD [1,0,0,0,0,0|3,0,0]=4 21 B10R1.13 CN(C)C1=CC=C(F)C=N1 3H32-3-6P [1,0,0,0,0,0|3,0,0]=4 22 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 6665-5-03 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 2602-5-R0 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.13 C[C@H](N)C1=CC=C(Cl)N=C1 3H30-5-S6 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.25 CC1=CC(Br)=CC=C1CN 3730-D-03 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.25 CC1=CC(N)=CC=C1CO 4756-1-1T [1,0,0,0,0,0|3,0,0]=4 27 B10R1.25 CC1=CC(O)=C(CO)C=C1 2701-1-1V [1,0,0,0,0,0|1,0,0]=2 28 B10R1.25 CC1=CN=C(CN)C(C)=C1 3H30-5-W9 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.25 CCC1=CC=C(O)C=C1F 2701-3-0D [1,0,0,0,0,0|2,0,0]=3 30 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 3631-7-02 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.25 COC1=CN=C(Br)C=C1O 4H56-9-X1 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.25 COC1=NC=C(C)C=C1N 4H30-1-B2 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.25 CSC1=CC=C(F)C=C1O 6666-3-0B [1,0,0,0,0,0|2,0,0]=3 34 B10R1.25 CSC1=CC=C(O)C=C1F 6666-3-0C [1,0,0,0,0,0|3,0,0]=4 35 B10R1.25 OCC1=C(Cl)C=C(O)C=C1 2604-5-0D [1,0,0,0,0,0|3,0,0]=4 36 B10R1.61 CC(C)C1=CC=CN=C1N 3H30-1-LE [1,0,0,0,0,0|2,0,0]=3 37 B10R1.61 CC1=CC=CC=C1C(F)F 1700-3-59 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.61 CS(=O)C1=CC=CC=C1I 6667-H-00 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.61 O=C(Cl)C1=CC=CC=C1O 2616-5-0D [1,0,0,0,0,0|2,0,1]=4 40 B12R1.232 CC1=CC(O)=C([N+](=O)[O-])C=C1C 4754-1-V3 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.1000 CC(=O)C1=C(F)C=C(F)C=C1O 2617-3-0Z [0,1,0,0,0,0|2,0,1]=4 42 B12R1.1000 OC1=CC(Cl)=CC(F)=C1C(F)F 2701-7-03 [0,1,0,0,0,0|3,0,0]=4 43 B12R1.1703 COC(=O)C1=C(F)C=C(C)C=C1 2723-3-0C [0,1,0,0,0,0|2,0,1]=4 44 B12R1.1703 NCC(O)C1=CC=C(F)C=C1F 4656-7-0R [0,1,0,0,0,0|3,0,0]=4 45 B12R1.1703 O=C(CCl)C1=CC=C(F)C=C1O 2617-7-59 [0,1,0,0,0,0|2,0,1]=4 46 B12R2.612 CC1=CC=C2C(=C1)ON=C2N 4H30-1-BF [0,0,0,1,0,0|2,0,1]=4 47 B12R2.612 CC1=NOC2=CC(Cl)=CC=C21 4H47-5-0R [0,0,0,1,0,0|2,0,1]=4 48 B12R1.233 CC(=O)NC1=C(O)C=C(Cl)C=C1 4648-5-2F [0,0,0,0,0,1|2,0,1]=4 49 B12R1.233 CC1=C(OC(C)C)C=CC(Cl)=C1 2707-5-0F [0,0,0,0,0,1|2,0,0]=3 50 B12R1.233 CC1=CC(Cl)=CN=C1OC(C)C 4H07-5-2L [0,0,0,0,0,1|3,0,0]=4 51 B12R1.233 CC1=CC(O)=CC=C1OC(C)C 2707-1-1F [0,0,0,0,0,1|2,0,0]=3 52 B12R1.233 CC1=CC(O)=CN=C1OC(C)C 4H07-1-4V [0,0,0,0,0,1|3,0,0]=4 53 B12R1.233 CC1=CN=C(OC(C)C)C(Cl)=C1 4H07-5-2X [0,0,0,0,0,1|2,0,0]=3 54 B12R1.233 CN(C)CC1=CC=C(Br)C=C1F 3632-B-10 [0,0,0,0,0,1|3,0,0]=4 55 B9R1.1 CC1=CC=C(CCl)N=C1 3H32-5-CY [2,0,0,0,0,0|2,0,0]=4 56 B9R1.1 CCC1=CC=C(Br)N=C1 3H32-9-5W [2,0,0,0,0,0|2,0,0]=4 57 B9R1.15 CCC1=CN=CN=C1O 4H56-1-0HW [2,0,0,0,0,0|2,0,0]=4 58 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 2620-1-57 [1,1,0,0,0,0|1,0,1]=4 59 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 2607-1-R5 [1,1,0,0,0,0|1,0,0]=3 60 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 4H50-1-0D [1,1,0,0,0,0|2,0,0]=4 61 B11R1.19 CC(C)(O)C1=CC=C(Br)C=N1 4H03-9-01 [1,1,0,0,0,0|2,0,0]=4 62 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 63 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 4756-1-1S [1,1,0,0,0,0|1,0,1]=4 64 B11R1.21 CC(C)C1=CC=C(F)C(O)=C1 2701-3-0S [1,1,0,0,0,0|1,0,0]=3 65 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 4756-5-16 [1,1,0,0,0,0|1,0,1]=4 66 B11R1.22 CC1=CC=C(C(O)CN)C=C1 4756-5-0A [1,1,0,0,0,0|1,0,0]=3 67 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 4756-1-RV [1,1,0,0,0,0|1,0,0]=3 68 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 4656-9-S3 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 2604-5-R1 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.22 [C-]#[N+]C(C)C1=CC=C(Cl)C=C1 3637-5-12 [1,1,0,0,0,0|1,0,1]=4 71 B11R1.81 CCNC1=C(Cl)C=C(Cl)C=C1 3631-5-0U [1,1,0,0,0,0|2,0,0]=4 72 B11R1.81 CCOC1=C(C)C=C(Cl)C=C1 2707-5-0G [1,1,0,0,0,0|2,0,0]=4 73 B11R1.81 CCOC1=C(Cl)C=C(C)C=C1 2707-5-0H [1,1,0,0,0,0|1,0,0]=3 74 B11R1.81 CCOC1=C(O)C=C(Cl)C=C1 2607-5-1G [1,1,0,0,0,0|1,0,0]=3 75 B11R1.81 CCOC1=C(O)C=C(F)C=C1 2607-3-7R [1,1,0,0,0,0|1,0,0]=3 76 B11R1.81 CCOC1=CC=C(C)C=C1O 2707-1-1V [1,1,0,0,0,0|0,0,0]=2 77 B11R1.81 CCOC1=CC=C(O)C=C1C 2707-1-1G [1,1,0,0,0,0|2,0,0]=4 78 B11R1.81 CCOC1=CC=C(O)C=C1Cl 2607-5-1R [1,1,0,0,0,0|2,0,0]=4 79 B11R1.277 COC1=C(O)C=C(F)C(Br)=C1 2607-B-4K [1,1,0,0,0,0|2,0,0]=4 80 B11R1.279 CCC1=CC=C(C=O)C(O)=C1 2715-1-57 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.279 COC1=CC=C(CN)C=C1Br 4656-9-50 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.279 COC1=CC=C(CO)C(O)=C1 2607-1-33 [1,1,0,0,0,0|1,0,0]=3 83 B11R1.279 COC1=CC=C(CO)C=C1O 2607-1-24 [1,1,0,0,0,0|1,0,0]=3 84 B11R1.464 COC1=C(Cl)C=C(F)C=C1O 2607-7-0F [1,1,0,0,0,0|2,0,0]=4 85 B11R1.53 COC1=CC=CC=C1C(C)N 4630-1-1F [1,1,0,0,0,0|1,0,0]=3 86 B11R1.53 COC1=NC=CC=C1C(C)O 4H07-1-84 [1,1,0,0,0,0|2,0,0]=4 87 B11R1.156 CC(N)C1=C(F)C=CC=C1F 3630-3-52 [1,1,0,0,0,0|2,0,0]=4 88 B11R1.167 OC1=CC=C(I)C=C1C(F)F 2701-K-09 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.222 CC1=CC=CC=C1C(N)CO 4656-1-8W [1,1,0,0,0,0|2,0,0]=4 90 B11R1.222 NC(CO)C1=CC=CC=C1F 4656-3-C9 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.222 NCC(O)C1=CC=CC=C1Br 4656-D-0B [1,1,0,0,0,0|2,0,0]=4 92 B11R1.222 NCC(O)C1=CC=CC=C1F 4656-7-0S [1,1,0,0,0,0|2,0,0]=4 93 B13R1.2809 CC(C)(C)C1=C(F)C=C(O)C=C1F 2701-3-44 [0,2,0,0,0,0|2,0,0]=4 94 B13R1.651 COC1=CC(C(C)C)=C(O)C=C1I 2707-H-00 [0,2,0,0,0,0|1,0,0]=3 95 B13R1.961 COC(OC)C1=C(F)C=C(N)C=C1 4656-3-B0 [0,2,0,0,0,0|2,0,0]=4 96 B11R2.34 BrC1=CC=C([C@@H]2CO2)C=C1 2609-9-R0 [1,0,0,1,0,0|2,0,0]=4 97 B11R2.34 ClC1=NC=C(C2CC2)C=C1 3H32-5-US [1,0,0,1,0,0|2,0,0]=4 98 B11R2.36 CC1=CC=C2CCNC2=C1 3H31-1-8V [1,0,0,1,0,0|1,0,0]=3 99 B11R2.1 NC1COC2=NC=CC=C21 4H30-1-CV [1,0,0,1,0,0|2,0,0]=4 100 B13R2.5179 N[C@@H]1CCOC2=CC(F)=CC=C21 4H30-7-R3 [0,1,0,1,0,0|2,0,0]=4 101 B13R2.5179 O[C@@H]1CCOC2=CC(F)=CC=C21 2H01-3-R1 [0,1,0,1,0,0|2,0,0]=4 102 B13R2.3125 NC1(C2=CC=C(Cl)C=C2Cl)CC1 3630-5-21 [0,1,0,1,0,0|2,0,0]=4 103 B11R1.20 CC(C)CC1=CC=C(O)C=C1 2701-1-1K [1,0,0,0,0,1|1,0,0]=3 104 B11R1.20 CC(C)NC1=CC=C(F)C=N1 3H31-3-1M [1,0,0,0,0,1|2,0,0]=4 105 B11R1.20 CC(C)OC1=CC=C(O)C=N1 4H07-1-4S [1,0,0,0,0,1|2,0,0]=4 106 B11R1.20 CC(C)SC1=CC=C(O)C=C1 6666-1-0X [1,0,0,0,0,1|1,0,0]=3 107 B11R1.20 CC(C)SC1=NC=C(Cl)C=C1 7H66-5-0V [1,0,0,0,0,1|2,0,0]=4 108 B11R1.20 CN(C)CC1=CC=C(Cl)C=C1 3632-5-0A [1,0,0,0,0,1|2,0,0]=4 109 B11R1.20 CN(C)CC1=CC=C(O)C=C1 4632-1-0S [1,0,0,0,0,1|2,0,0]=4 110 B11R1.74 CC1=CC(C(C)N)=CC(Br)=C1 3730-D-0B [0,0,0,0,1,1|2,0,0]=4 111 B11R1.74 CC1=CC(N)=NC(C(C)C)=N1 3H30-1-0H [0,0,0,0,1,1|2,0,0]=4 112 B11R1.74 CC1=NC(C(C)C)=NC(Cl)=C1 3H31-5-A1 [0,0,0,0,1,1|2,0,0]=4 113 B13R1.164 CC1=CC=C(OC[C@@H](C)N)C(C)=C1 4756-1-1H [0,0,0,0,0,2|2,0,0]=4