0 B12R1.125 CC(=O)SCC1=CC=CC=C1F 6667-3-02 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.125 CC1=CC=CC=C1CCC(=O)Cl 2716-5-0D [0,0,0,0,0,0|2,0,2]=4 2 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1Cl 2916-5-01 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.91 O=C(Cl)CNC1=CC=CC=C1 4631-5-00 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.91 O=C(O)C#CC1=CC=CC=N1 4H58-1-470 [1,0,0,0,0,0|1,0,2]=4 5 B11R1.91 O=C(O)C#CC1=CC=CN=C1 4H58-1-471 [1,0,0,0,0,0|1,0,2]=4 6 B13R1.90 COC1=CC=CC=C1OCC(=O)Cl 2616-5-19 [0,1,0,0,0,0|2,0,1]=4 7 B13R1.90 N#CC1=CC=CC=C1CCC(=O)O 4637-1-2Y [0,1,0,0,0,0|1,0,2]=4 8 B13R1.164 NC1=CC=C(CCC(=O)O)C(F)=C1 4757-3-43 [0,1,0,0,0,0|1,0,2]=4 9 B13R1.164 O=C(O)CCC1=CC=C(F)C=C1Cl 2621-7-76 [0,1,0,0,0,0|1,0,2]=4 10 B13R1.164 O=C(O)CCC1=CC=C(O)C=C1F 2729-3-04 [0,1,0,0,0,0|1,0,2]=4 11 B13R1.164 O=C(O)\C=C\C1=CC=C(O)C=C1F 2621-3-5U [0,1,0,0,0,0|1,0,0]=2 12 B13R1.201 CC(=O)CC(=O)C1=CC=CC=C1O 2620-1-68 [0,1,0,0,0,0|1,0,1]=3 13 B13R1.528 COC(=O)CCC1=C(Cl)C=CC=C1 2623-5-1F [0,1,0,0,0,0|1,0,2]=4 14 B13R1.528 COC(=O)CCC1=CC=CC=C1Br 2623-9-34 [0,1,0,0,0,0|1,0,2]=4 15 B13R1.528 COC(=O)CNC1=C(F)C=CC=C1 4631-3-0C [0,1,0,0,0,0|2,0,1]=4 16 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1Cl 2624-5-E0 [0,1,0,0,0,0|1,0,0]=2 17 B13R1.893 CC(=O)\C=C\C1=C(F)C=CC(F)=C1 2617-3-EA [0,1,0,0,0,0|2,0,0]=3 18 B13R1.893 O=C(O)CCC1=CC(Br)=CC=C1O 2629-9-0D [0,1,0,0,0,0|0,0,2]=3 19 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 4H17-1-8J [0,0,0,1,0,0|2,0,0]=3 20 B13R2.435 NC(=O)C1CC2=CC=CC=C2O1 4H48-1-03A [0,0,0,1,0,0|1,0,2]=4 21 B13R2.435 O=C(O)C1=CC2=CC=NC=C2O1 4H21-1-75 [0,0,0,1,0,0|1,0,0]=2 22 B13R2.435 O=C(O)C1=NC2=CC=NC=C2S1 8H21-1-83 [0,0,0,1,0,0|2,1,0]=4 23 B13R2.5179 CC1=NC=CC2=NC(O)=CC=C12 4H01-1-7M [0,0,0,1,0,0|3,0,0]=4 24 B13R2.5179 O=C1C=CC2=C(Br)C=CC=C2N1 4H17-9-51 [0,0,0,1,0,0|2,0,0]=3 25 B13R2.5179 OC1=CC2=NC=CC(O)=C2C=C1 4H04-1-17 [0,0,0,1,0,0|2,0,0]=3 26 B13R2.5179 OC1=NC=CC2=CC(Cl)=CC=C21 4H01-5-2N [0,0,0,1,0,0|3,0,0]=4 27 B11R1.86 NC(=O)CC1=CC=CC=C1I 4648-H-06 [0,0,0,0,1,0|2,0,1]=4 28 B13R1.158 O=C(O)CCCC1=CC=CC=C1F 2721-3-1Q [0,0,0,0,0,1|1,0,2]=4 29 B10R1.17 OC\C=C\C1=CC=NC=C1 4H56-1-0G2 [2,0,0,0,0,0|1,0,1]=4 30 B12R1.121 COC1=CC=CC=C1\C=C\C=O 2615-1-1F [1,1,0,0,0,0|0,0,0]=2 31 B12R1.21 CC(O)\C=C\C1=CC=C(Br)C=C1 2602-9-03 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 6661-1-0B [1,1,0,0,0,0|0,0,2]=4 33 B12R1.21 O=C(O)\C=C\C1=CN=C(Cl)C=C1 4H21-5-2Q [1,1,0,0,0,0|1,0,0]=3 34 B12R1.27 COC(=O)\C=C\C1=CC=NC=C1 4H23-1-J0 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.27 COC(=O)\C=C\C1=CN=CN=C1 4H23-1-28 [1,1,0,0,0,0|2,0,0]=4 36 B12R1.27 COC(=O)\C=C\C1=NC=CC=C1 4H23-1-LJ [1,1,0,0,0,0|1,0,0]=3 37 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 2629-1-2Q [1,1,0,0,0,0|0,0,1]=3 38 B12R1.107 C\C(N)=C\C(=O)C1=CC=CC=C1 4636-1-Z8 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.226 O=C(O)CSC1=CC=CC(F)=C1 6666-3-24 [1,1,0,0,0,0|1,0,1]=4 40 B12R1.226 O=[N+]([O-])\C=C\C1=CC=CC(O)=C1 4654-1-B5 [1,1,0,0,0,0|1,0,1]=4 41 B12R1.75 CC(=O)NC1=CC=CC=C1CO 4648-1-2J [0,1,0,0,1,0|2,0,0]=4 42 B12R1.75 COC1=CC=CN=C1CC(=O)O 4H21-1-MP [0,1,0,0,1,0|1,0,1]=4 43 B12R1.224 O=C(O)CC1=C(Cl)C(F)=CC=C1 2621-7-0H [0,1,0,0,1,0|1,0,1]=4 44 B12R1.233 CC(=O)NC1=C(O)C=C(Cl)C=C1 4648-5-2F [0,1,0,0,1,0|2,0,0]=4 45 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1Br 2621-B-37 [0,1,0,0,1,0|1,0,1]=4 46 B14R1.837 COC(=O)N\N=C\C1=C(Cl)C=CC=C1 4656-5-EA [0,1,0,0,0,1|2,0,0]=4 47 B14R1.727 NNC(=O)\C=C\C1=C(Cl)C=C(Cl)C=C1 4656-5-EC [0,2,0,0,0,0|2,0,0]=4 48 B14R1.6036 O=C(O)\C=C\C1=C(F)C=C(F)C(Cl)=C1 2621-7-80 [0,2,0,0,0,0|1,0,0]=3 49 B14R1.587 COC(=O)CC(=O)C1=C(C)C=CC=C1 2729-1-0W [0,2,0,0,0,0|1,0,1]=4 50 B12R1.232 CC1=CC(C(=O)O)=C(C)C=C1O 2729-1-81 [0,0,1,1,0,0|0,0,2]=4 51 B12R1.56 CC1=CC=C(C(=O)O)C=C1C=O 2721-1-1Y [0,0,1,1,0,0|2,0,0]=4 52 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1O 2629-1-0U [0,0,1,1,0,0|1,0,0]=3 53 B12R1.453 O=C(O)C1=CC(CO)=CC=C1F 2729-3-12 [0,0,1,1,0,0|1,0,1]=4 54 B12R1.453 O=CC1=CC=C(Br)C(C(=O)O)=C1 2621-9-34 [0,0,1,1,0,0|1,0,1]=4 55 B12R2.24 O=C1NCC2=CC=CC=C2O1 4H56-1-06F [1,0,0,1,0,0|1,0,1]=4 56 B12R2.24 OC1=NC2=CC=CC=C2C=N1 4H01-1-A3 [1,0,0,1,0,0|2,0,0]=4 57 B12R2.32 O=CC1=NC2=CC=CC=C2O1 4H15-1-1Y [1,0,0,1,0,0|1,0,0]=3 58 B12R2.1081 FC1=CC=CC2=NC=CC=C12 3H32-3-T8 [1,0,0,1,0,0|2,0,0]=4 59 B12R2.202 OC1=CC=CC2=C1NC(=S)O2 8H67-1-1J [0,0,0,1,1,0|1,1,0]=4 60 B14R2.256 CC1=C(C2=NC=C(Br)O2)C=CC=C1 4H56-9-7G [0,0,0,1,0,1|2,0,0]=4 61 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 4H21-1-NZ [0,0,0,1,0,1|2,0,0]=4 62 B14R2.781 O=C(O)C1=CN=C2C=CN=CC2=C1 4H21-1-XD [0,0,0,1,0,1|2,0,0]=4 63 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 4H21-1-Z1 [0,0,0,1,0,1|2,0,0]=4 64 B14R2.8032 O=C(O)C1=CSC2=C(F)C=CC=C12 6H21-3-0Q [0,0,0,1,0,1|1,0,0]=3 65 B14R2.450 CC(=O)C1=C(Br)C2=CC=CC=C2O1 2H17-9-0E [0,1,0,1,0,0|1,0,0]=3 66 B14R2.450 CC(=O)C1=C(N)C2=CC=CC=C2O1 4H56-1-467 [0,1,0,1,0,0|1,0,0]=3 67 B14R2.450 CC1=C(C(=O)O)CC2=CC=CC=C21 2721-1-3E [0,1,0,1,0,0|1,0,0]=3 68 B14R2.450 O=C(O)C1=C(I)N2C=CC=CC2=N1 4H21-H-0E [0,1,0,1,0,0|2,0,0]=4 69 B14R2.7969 O=C(O)C1=CC2=CC=CC(O)=C2N1 4H29-1-3H [0,1,0,1,0,0|1,0,0]=3 70 B14R2.4529 CC(=O)C1=CC2=CC(F)=CC=C2N1 4H56-3-4Z [0,1,0,1,0,0|2,0,0]=4 71 B14R2.4529 CC1=CC=C2OC(C(=O)O)=CC2=C1 2H21-1-0P [0,1,0,1,0,0|0,0,0]=2 72 B14R2.4529 CC1=CC=C2OC(C(N)=O)=CC2=C1 4H48-1-03C [0,1,0,1,0,0|1,0,0]=3 73 B14R2.4529 O=C(O)C1=CN2C=C(F)C=CC2=N1 4H21-3-U9 [0,1,0,1,0,0|2,0,0]=4 74 B14R2.4529 O=C(O)C1=CN2C=CC(Br)=CC2=N1 4H21-9-33 [0,1,0,1,0,0|2,0,0]=4 75 B14R2.4529 O=C(O)C1=NC2=CC(Br)=CC=C2O1 4H58-9-5R [0,1,0,1,0,0|1,0,0]=3 76 B14R2.4529 O=C(O)C1=NC2=CC(F)=CC=C2O1 4H21-3-85 [0,1,0,1,0,0|1,0,0]=3 77 B14R2.4529 O=C(O)C1=NC2=CC=C(F)C=C2O1 4H21-3-86 [0,1,0,1,0,0|1,0,0]=3 78 B14R2.972 COC(=O)C1=CN2C=CC=CC2=N1 4H23-1-J6 [0,1,0,1,0,0|2,0,0]=4 79 B14R2.972 COC(=O)C1=NC2=CC=CC=C2O1 4H23-1-DR [0,1,0,1,0,0|1,0,0]=3 80 B14R2.972 COC(=O)C1=NN2C=CC=CC2=C1 4H23-1-DN [0,1,0,1,0,0|2,0,0]=4 81 B14R2.1801 N#CC1=CC=C2C(O)=CC=CC2=N1 4H56-1-154 [0,1,0,1,0,0|2,0,0]=4 82 B14R2.8751 CC1=C2C=CC(=O)OC2=C(O)C=C1 2H25-1-2F [0,1,0,1,0,0|1,0,0]=3 83 B10R1.61 O=C(Cl)C1=CC=CC=C1O 2616-5-0D [0,0,0,0,2,0|1,0,0]=3 84 B10R1.61 O=C(Cl)C1=CC=CC=C1S 6661-5-00 [0,0,0,0,2,0|1,1,0]=4 85 B10R1.61 O=C(O)C1=CC=CC=C1S 6661-1-X8 [0,0,0,0,2,0|0,1,0]=3