0 B12R1.891 CC(C)(C)\N=C\C1=CC=CC=C1 3635-1-02 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.891 FC(F)(F)COC1=CC=CC=C1 2607-3-60 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 8H64-1-24 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.91 CC(=O)COC1=CC=CC=C1 2617-1-0W [1,0,0,0,0,0|1,0,2]=4 4 B11R1.91 CC(N)CCC1=CC=CC=C1 3630-1-X9 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.91 CC(O)CCC1=CC=CC=C1 2602-1-09 [1,0,0,0,0,0|0,0,0]=1 6 B11R1.91 CN(C)CCC1=CC=CC=N1 3H32-1-N6 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.91 FC(F)COC1=CC=CC=C1 2607-3-36 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.91 FC(F)SCC1=CC=CC=C1 5666-3-07 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 2616-5-13 [1,0,0,0,0,0|1,0,2]=4 10 B11R1.91 O=C(O)CCC1=CC=CC=C1 2721-1-01 [1,0,0,0,0,0|1,0,1]=3 11 B11R1.91 O=C(O)CCC1=CC=CN=C1 4H21-1-XY [1,0,0,0,0,0|2,0,1]=4 12 B11R1.91 O=C(O)CCC1=CC=NC=C1 P612-A-35 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.91 O=C(O)COC1=CC=CC=C1 2621-1-02 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.91 OB(O)CCC1=CC=CC=C1 6760-1-W3 [1,0,0,0,0,0|2,0,0]=3 15 B13R1.353 CC(C)(C)C(=O)NC1=CC=CC=C1 4648-1-21 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 6763-1-02 [0,0,0,0,1,0|2,0,1]=4 17 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 3633-M-01 [0,0,0,0,1,0|2,0,0]=3 18 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 3732-9-X1 [0,0,0,0,1,0|2,0,0]=3 19 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 M007-3-61 [0,0,0,0,1,0|2,0,0]=3 20 B11R1.509 C[Si](C)(C)CC1=CC=CC=C1 5680-1-01 [0,0,0,0,1,0|1,1,0]=3 21 B13R1.3523 C[Si](C)(C)CNCC1=CC=CC=C1 7680-1-00 [0,0,0,0,0,1|1,1,0]=3 22 B13R1.3523 FC(F)(F)CSCC1=CC=CC=C1 5666-3-02 [0,0,0,0,0,1|3,0,0]=4 23 B10R1.17 BrCCCC1=CC=CC=C1 1700-9-Z5 [2,0,0,0,0,0|1,0,0]=3 24 B10R1.17 BrCCOC1=CC=CC=C1 2607-9-X6 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.17 CCNCC1=CC=CC=C1 3731-1-04 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.17 CCNCC1=CC=CC=N1 3H31-1-3M [2,0,0,0,0,0|2,0,0]=4 27 B10R1.17 CNCCC1=CC=CC=N1 3H31-1-Q6 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.17 COCSC1=CC=CC=C1 6666-1-0Q [2,0,0,0,0,0|2,0,0]=4 29 B10R1.17 ClCCSC1=CC=CC=C1 5666-5-04 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.17 NCCCC1=CC=CC=C1 3H30-1-H6 [2,0,0,0,0,0|1,0,0]=3 31 B10R1.17 NCCOC1=CC=CC=C1 4656-1-Y0 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.17 OCC#CC1=CC=CC=C1 2901-1-02 [2,0,0,0,0,0|0,0,2]=4 33 B10R1.17 OCCCC1=CC=CC=N1 4H56-1-LM [2,0,0,0,0,0|1,0,0]=3 34 B10R1.17 OCCNC1=CC=CC=N1 4H56-1-FB [2,0,0,0,0,0|2,0,0]=4 35 B10R1.17 OCCNC1=CC=CC=N1 4H56-5-20 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.17 OCCNC1=CC=NC=C1 4H56-1-DX [2,0,0,0,0,0|2,0,0]=4 37 B10R1.17 OCCOC1=CC=CC=C1 2607-1-06 [2,0,0,0,0,0|1,0,0]=3 38 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 2620-1-X5 [1,1,0,0,0,0|0,0,2]=4 39 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 2721-1-42 [1,1,0,0,0,0|1,0,1]=4 40 B12R1.21 CN(C)CCC1=CC=C(N)C=C1 3632-1-0M [1,1,0,0,0,0|1,0,0]=3 41 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 4757-1-06 [1,1,0,0,0,0|1,0,1]=4 42 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 2721-9-07 [1,1,0,0,0,0|1,0,1]=4 43 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 2721-5-06 [1,1,0,0,0,0|1,0,1]=4 44 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 2721-3-14 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 2721-H-X2 [1,1,0,0,0,0|1,0,1]=4 46 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 2729-1-X5 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.27 CC(CO)NCC1=CC=CC=C1 4656-1-AA [1,1,0,0,0,0|1,0,0]=3 48 B12R1.27 COC(=O)CCC1=CC=CC=C1 2723-1-38 [1,1,0,0,0,0|0,0,2]=4 49 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O 4757-1-R0 [1,1,0,0,0,0|1,0,1]=4 50 B12R1.107 CC(C)OC(=O)C1=CC=CC=C1 2623-1-07 [1,1,0,0,0,0|1,0,1]=4 51 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 2621-1-2X [1,1,0,0,0,0|1,0,1]=4 52 B12R1.107 CN(C)CC(N)C1=CC=CC=C1 3732-1-X7 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 4657-1-29 [1,1,0,0,0,0|1,0,1]=4 54 B12R1.125 CC1=CC=CC=C1CCC(=O)O 2721-1-41 [1,1,0,0,0,0|1,0,1]=4 55 B12R1.125 O=C(O)CCC1=CC=CC=C1Br 2721-9-05 [1,1,0,0,0,0|1,0,1]=4 56 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl 2721-5-05 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.125 O=C(O)CCC1=CC=CC=C1F 2721-3-12 [1,1,0,0,0,0|1,0,1]=4 58 B12R1.125 O=C(O)CCC1=CC=CC=C1O 2729-1-16 [1,1,0,0,0,0|1,0,1]=4 59 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 2721-1-03 [1,1,0,0,0,0|1,0,1]=4 60 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 4657-1-Z7 [1,1,0,0,0,0|1,0,1]=4 61 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 2721-3-13 [1,1,0,0,0,0|1,0,1]=4 62 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 2721-9-06 [1,1,0,0,0,0|1,0,1]=4 63 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 2721-5-Y0 [1,1,0,0,0,0|1,0,1]=4 64 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 2721-H-05 [1,1,0,0,0,0|1,0,1]=4 65 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 2729-1-17 [1,1,0,0,0,0|1,0,1]=4 66 B12R1.106 CC(C)(C)OC1=CC=C(Br)C=C1 2607-9-Y5 [0,1,0,0,1,0|2,0,0]=4 67 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 3730-3-10 [0,1,0,0,1,0|1,0,0]=3 68 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 3730-7-05 [0,1,0,0,1,0|1,0,0]=3 69 B12R1.106 CC(C)(O)CC1=CC=C(F)C=C1 2703-3-02 [0,1,0,0,1,0|0,0,0]=2 70 B12R1.119 CC(C)(C)OC1=CC=CC(Br)=C1 2607-9-0X [0,1,0,0,1,0|2,0,0]=4 71 B12R1.564 CC(C)(C)C(=O)C1=CC=CC=C1 2617-1-Y2 [0,1,0,0,1,0|1,0,1]=4 72 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 3630-1-0L [0,1,0,0,1,0|1,0,0]=3 73 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 2620-1-06 [0,1,0,0,1,0|0,0,1]=3 74 B14R1.292 C#CC(C)(C)COCC1=CC=CC=C1 2607-1-16 [0,1,0,0,0,1|1,0,0]=3 75 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 2717-1-Z2 [1,0,0,1,0,0|0,0,2]=4 76 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 2617-1-2B [1,0,0,1,0,0|0,0,2]=4 77 B12R2.24 OC1CCC2=CC=CC=C2C1 2602-1-08 [1,0,0,1,0,0|0,0,0]=2 78 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 3731-1-03 [1,0,0,1,0,0|1,0,0]=3 79 B12R2.2403 CC1(C)CNC2=CC=CC=C21 3H31-1-R3 [1,0,0,1,0,0|1,0,0]=3 80 B14R2.6175 CC1(C)CCC2=CC=CC=C2C1=O 2617-1-55 [0,1,0,1,0,0|0,0,1]=3 81 B10R1.18 CC(C)CC1=CC=CC=C1 1700-1-X0 [1,0,0,0,1,0|0,0,0]=2 82 B10R1.18 CC(C)OC1=CC=CC=C1 2607-1-10 [1,0,0,0,1,0|1,0,0]=3 83 B10R1.18 CC(C)SC1=CC=CC=C1 5666-1-X2 [1,0,0,0,1,0|1,0,0]=3 84 B10R1.18 CN(C)CC1=CC=CC=C1 3632-1-07 [1,0,0,0,1,0|1,0,0]=3 85 B10R1.28 CC(C)(C)C1=CC=CC=C1 1700-1-X6 [0,0,0,0,2,0|1,0,0]=3 86 B10R1.28 CC(C)(N)C1=CC=CC=N1 3H30-1-HF [0,0,0,0,2,0|2,0,0]=4 87 B10R1.28 CC(C)(O)C1=CC=CC=C1 2603-1-X0 [0,0,0,0,2,0|0,0,0]=2 88 B10R1.28 CC(C)(O)C1=CC=CC=N1 4H56-1-8A [0,0,0,0,2,0|1,0,0]=3 89 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 2607-1-S4 [1,0,0,0,0,1|0,0,0]=2 90 B12R1.252 O=C(O)CCCC1=CC=CC=C1 2621-1-X9 [1,0,0,0,0,1|1,0,1]=4 91 B12R1.252 O=C(O)CCOC1=CC=CC=C1 2621-1-Z8 [1,0,0,0,0,1|1,0,1]=4 92 B12R1.252 O=C(O)COCC1=CC=CC=C1 2721-1-97 [1,0,0,0,0,1|1,0,1]=4