0 B10R1.13 CC1=CCC(C(C)C)=CC1 195024 [0,0,0,0,0,0|0,0,4]=4 1 B10R1.13 CN(C)C1=CC=C(N)C=C1 106160 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 064474 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 064485 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 097856 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.1 CC1=CC=C(CS)C=C1 105406 [1,0,0,0,0,0|1,0,1]=3 6 B9R1.1 CC1=CN=C(CN)C=C1 065464 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.1 CNC1=CC=C(I)C=C1 045902 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.1 COC1=NC=C(I)C=C1 033478 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.6 CC(N)C1=CC=CC=N1 300972 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.3 COC1=CC=C(S(=O)[O-])C=C1 097673 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.3 COC1=CC=C(S(C)=O)C=C1 094784 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 075220 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.21 CC(=O)C1=CC(O)=C(I)C=C1 105437 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.21 CC(C)C1=CC(Br)=C(Br)C=C1 035647 [0,1,0,0,0,0|1,0,2]=4 15 B11R1.21 CC(C)C1=CC(Br)=C(F)C=C1 037569 [0,1,0,0,0,0|1,0,2]=4 16 B11R1.21 CC(C)C1=CC=C(S)C(Br)=C1 037913 [0,1,0,0,0,0|1,0,2]=4 17 B11R1.21 CC1=C(C)C=C(S(C)=O)C=C1 064526 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 062746 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Br)C=C1 038130 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.166 NC(=O)C1=C(F)C=C(N)C=C1 432306 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.35 CC(=O)C1=CC(Cl)=CS1 033141 [0,0,0,0,1,0|3,0,0]=4 22 B9R1.35 CC(N)C1=CN(C)C=C1 105283 [0,0,0,0,1,0|2,0,1]=4 23 B9R1.35 CC1=CNC(C(=O)O)=C1 040049 [0,0,0,0,1,0|3,0,0]=4 24 B11R1.20 CC(=S)NC1=CC=C(F)C=C1 331457 [0,0,0,0,0,1|2,0,0]=3 25 B8R1.2 COC1=CC=CC=C1 M03556 [2,0,0,0,0,0|1,0,0]=3 26 B8R1.2 NCC1=CC=CC=C1 098408 [2,0,0,0,0,0|1,0,1]=4 27 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [2,0,0,0,0,0|1,0,1]=4 28 B8R1.3 CC1=NC=C(I)C=C1 080146 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.1 CC1=CC=C(CON)C=C1 025883 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.1 CCOC1=CC=C(S)C=C1 038427 [1,1,0,0,0,0|1,0,1]=4 31 B10R1.1 CCSC1=CC=C(S)C=C1 023079 [1,1,0,0,0,0|1,0,1]=4 32 B10R1.1 COCC1=CC=C(N)C=C1 098494 [1,1,0,0,0,0|1,0,1]=4 33 B10R1.25 CC1=CC(C)=C(CO)C=C1 049893 [1,1,0,0,0,0|1,0,1]=4 34 B10R1.25 CC1=CC=C(CBr)C(C)=C1 221500 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.25 COC1=C(F)C=C(C)C=C1 009215 [1,1,0,0,0,0|1,0,0]=3 36 B10R1.25 COC1=C(F)C=C(I)C=C1 038782 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.25 COC1=C(O)C=C(C)C=C1 009947 [1,1,0,0,0,0|1,0,0]=3 38 B10R1.176 CC1=C(N)C=C(CN)C=C1 075753 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.176 CCC1=CC=C(S)C(Br)=C1 061618 [1,1,0,0,0,0|1,0,1]=4 40 B10R1.176 COC1=CC=C(Br)C(S)=C1 062585 [1,1,0,0,0,0|2,0,0]=4 41 B10R1.176 COC1=CC=C(I)C(N)=C1 062579 [1,1,0,0,0,0|2,0,0]=4 42 B10R1.176 COC1=CC=C(S)C(C)=C1 023081 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.176 CSC1=CC=C(Br)C(S)=C1 070273 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.176 CSC1=CC=C(C)C(S)=C1 070026 [1,1,0,0,0,0|1,0,0]=3 45 B10R1.176 CSC1=CC=C(Cl)C(S)=C1 070092 [1,1,0,0,0,0|2,0,0]=4 46 B10R1.15 C=C(CC)C1=CC=CC=C1 319906 [1,1,0,0,0,0|0,0,0]=2 47 B10R1.61 CC(F)C1=C(Br)C=CC=C1 035830 [1,1,0,0,0,0|1,0,1]=4 48 B10R1.61 CS(=O)C1=C(Cl)C=CC=C1 064490 [1,1,0,0,0,0|2,0,0]=4 49 B10R1.61 CS(=O)C1=C(F)C=CC=C1 064511 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.113 CC1=CC=CC(C(C)N)=C1 094296 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.113 CC1=CC=CC(S(C)=O)=C1 064559 [1,1,0,0,0,0|2,0,0]=4 52 B10R1.113 CS(=O)C1=CC(Cl)=CC=C1 064493 [1,1,0,0,0,0|2,0,0]=4 53 B10R1.113 CS(=O)C1=CC(F)=CC=C1 064508 [1,1,0,0,0,0|2,0,0]=4 54 B10R1.113 CS(=O)C1=CC=CC(Br)=C1 064477 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.58 CC(=O)C1=CC(C)=C(Cl)S1 038280 [0,1,0,0,1,0|2,0,0]=4 56 B12R1.4 COC1=CC=C(NC(C)=S)C=C1 331458 [0,1,0,0,0,1|1,0,0]=3 57 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 064722 [0,1,0,0,0,1|2,0,0]=4 58 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 026034 [0,1,0,0,0,1|1,0,0]=3 59 B12R1.49 CC1=CN=C(NC(=O)CBr)C=C1 042915 [0,1,0,0,0,1|2,0,0]=4 60 B12R1.49 CNC(=O)OC1=CC=C(I)C=C1 105082 [0,1,0,0,0,1|2,0,0]=4 61 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 039340 [0,1,0,0,0,1|2,0,0]=4 62 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 039175 [0,1,0,0,0,1|2,0,0]=4 63 B12R1.233 CC1=CC=C(NC(N)=S)C(F)=C1 062895 [0,1,0,0,0,1|2,0,0]=4 64 B12R1.48 COC1=C(I)C=C(C(=O)Cl)C=C1 038117 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.48 COC1=CC=C(C(C)C)C=C1N 491146 [0,2,0,0,0,0|0,0,2]=4 66 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 065385 [0,2,0,0,0,0|1,0,1]=4 67 B12R1.452 COC1=CC(C)=C(C(C)=O)C=C1 396494 [0,2,0,0,0,0|1,0,0]=3 68 B12R1.452 COC1=CC=C(C(C)=O)C(Br)=C1 335944 [0,2,0,0,0,0|1,0,0]=3 69 B12R1.232 CC1=CC(F)=C(C(=O)Cl)C=C1F 062726 [0,2,0,0,0,0|2,0,0]=4 70 B12R1.1005 CC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1 104853 [0,2,0,0,0,0|2,0,0]=4 71 B12R1.16 N#CCC(=O)C1=CC=C(I)C=C1 225905 [0,2,0,0,0,0|2,0,0]=4 72 B12R1.1703 COC(=O)C1=CC=C(I)C=C1C 234140 [0,2,0,0,0,0|2,0,0]=4 73 B12R1.1703 O=C(CBr)C1=C(F)C=C(Cl)C=C1 095249 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.18 CC(=O)NC1=CC=CC=N1 433646 [1,0,0,0,0,1|2,0,0]=4