0 B12R1.128 CC(C)(C)C1=C(Cl)C=CC(Br)=C1 D75507 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.128 CC(C)(C)C1=C(F)C=CC(Br)=C1 D76065 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.128 CC(F)(F)C1=C(Br)C=CC(F)=C1 AT20080 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.87 CC(C)(C)C1=C(Br)C=CC=N1 AT10672 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.87 CC(C)(C)C1=C(Cl)C=CC=N1 68805 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.87 CC(C)(C)C1=NC=CN=C1N AT11137 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.87 CC(C)(N)C1=C(N)C=CC=C1 D86445 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.87 CC(C)(O)C1=NC=CC=C1N AT11529 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.87 CP(C)(=O)C1=C(I)C=CC=C1 AT11111 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.87 C[Si](C)(C)C1=C(F)C=NC=C1 AT11641 [1,0,0,0,0,0|2,1,0]=4 10 B11R1.87 [2H]C([2H])([2H])C1=C(O)C=CC=C1 D98895 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.155 CC(C)(C)C1=CC(N)=NC=N1 CS1086 [1,0,0,0,0,0|3,0,0]=4 12 B11R1.155 CC(C)(C)C1=CN=CC(N)=C1 F51180 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.155 CC(C)(N)C1=CC(F)=CN=C1 AT26869 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.155 CC(C)(O)C1=CC(F)=CN=C1 AT26870 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.155 [2H]C([2H])([2H])C1=CC=CC(O)=C1 D98620 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.167 CC(C)C1=C(Br)C=CC(N)=N1 AT24913 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.167 CC1=CC(C(C)C)=C(N)C=C1 F52420 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.167 CC1=CC([C@H](C)N)=C(Br)C=C1 C92014 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.167 CC1=CC([C@H](C)N)=C(Br)C=C1 C92021 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.167 CC1=CN=C(N)C(C(C)C)=C1 AT11126 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.167 C[C@H](N)C1=C(Br)C=CC(Cl)=C1 C91966 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.167 C[C@H](N)C1=C(Br)C=CC(Cl)=C1 C91970 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24142 [1,0,0,0,0,0|3,0,0]=4 24 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24143 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N13234 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.167 C[C@H](N)C1=C(O)C=CC(Cl)=C1 50793 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.167 NC1=CC(C(F)F)=C(O)C=C1 AT26539 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.167 OC1=C(C(F)F)C=C(F)C=C1 79333 [1,0,0,0,0,0|3,0,0]=4 29 B13R1.98 CC(C)(C)C1=C(N)C=CC(C#N)=C1 AT24177 [0,1,0,0,0,0|2,0,0]=3 30 B13R1.877 CC(C)(C)C1=CC(F)=C(N)C=C1O C91648 [0,1,0,0,0,0|1,0,0]=2 31 B13R1.2815 CC(C)(C)C1=CC(I)=CC(Br)=C1O AT24310 [0,1,0,0,0,0|1,0,0]=2 32 B13R2.3791 CC1(C)CNC2=C1C=C(Cl)C=C2 85461 [0,0,0,1,0,0|2,0,0]=3 33 B13R2.3791 CC1(C)NCC2=C1C=C(Br)C=C2 P13036 [0,0,0,1,0,0|3,0,0]=4 34 B13R2.10533 CC1=C(C2(N)CC2)C=C(F)C=C1 AC3375 [0,0,0,1,0,0|3,0,0]=4 35 B13R2.10533 NC1(C2=C(Br)C=CC(F)=C2)CC1 83680 [0,0,0,1,0,0|3,0,0]=4 36 B13R2.10533 NC1(C2=C(Cl)C=CC(Cl)=C2)CC1 AC3489 [0,0,0,1,0,0|3,0,0]=4 37 B13R2.10533 NC1(C2=C(F)C=CC(Br)=C2)CC1 AC3359 [0,0,0,1,0,0|3,0,0]=4 38 B13R2.10533 NC1(C2=C(F)C=CC(F)=C2)CC1 AC3201 [0,0,0,1,0,0|3,0,0]=4 39 B13R1.894 CC(C)(C)OC1=C(O)C=CC(I)=C1 AT24022 [0,0,0,0,0,1|1,0,0]=2 40 B10R1.61 CN(C)C1=C(O)C=CC=C1 AT26775 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.61 CN(C)C1=C(O)C=NC=C1 AT23568 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 D75506 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.61 OC1=C(C(F)F)C=CC=C1 AT20035 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.113 C[C@H](N)C1=CC(O)=NC=C1 N13197 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.30 CSC1=C(O)C=CC(F)=C1 C11142 [2,0,0,0,0,0|2,0,0]=4 46 B12R1.126 CC(C)(O)C1=C(Br)C=C(F)C=C1 AT23560 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.23 CC1=C(F)C=C(C(C)(C)N)C=C1 AT22342 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.23 CC1=C(F)C=CC(C(C)(C)N)=C1 AT22340 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.436 C#CC1=CC(C(C)(C)C)=CC=C1 D75641 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.436 CC(C)(C)C1=CC(C#N)=NC=C1 D87776 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.46 COC1=C([C@H](C)O)C=C(F)C=C1 F52411 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.453 COC1=CC([C@H](C)N)=C(Br)C=C1 C92017 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.511 CC(C)C1=CC(F)=CC(Br)=C1N AT11373 [1,1,0,0,0,0|2,0,0]=4 54 B12R2.88 NC1(C2=C(O)C=CC=C2)CC1 D75141 [1,0,0,1,0,0|1,0,0]=3 55 B12R2.88 NC1=C(C2(N)CC2)C=CC=C1 AC3778 [1,0,0,1,0,0|2,0,0]=4 56 B12R2.88 OC1(C2=C(Cl)C=CC=C2)CC1 AT26675 [1,0,0,1,0,0|2,0,0]=4 57 B12R2.88 OC1(C2=C(F)C=CC=C2)CC1 AT23533 [1,0,0,1,0,0|2,0,0]=4 58 B12R2.1282 NC1(C2=CC=CC(O)=C2)CC1 AT26939 [1,0,0,1,0,0|1,0,0]=3 59 B12R2.1282 OC1(C2=CC=CC(Br)=C2)CC1 AT23531 [1,0,0,1,0,0|2,0,0]=4 60 B12R2.1282 OC1(C2=CC=CC(F)=C2)CC1 AT23534 [1,0,0,1,0,0|2,0,0]=4 61 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 33360 [1,0,0,1,0,0|2,0,0]=4 62 B12R2.132 N[C@H]1COC2=C1C=C(F)C=C2 N11246 [1,0,0,1,0,0|2,0,0]=4 63 B12R2.132 OC1=CC2=C(C=C1)OC[C@@H]2O AT23844 [1,0,0,1,0,0|1,0,0]=3 64 B12R2.132 O[C@H]1COC2=C1C=C(Cl)C=C2 AT23846 [1,0,0,1,0,0|2,0,0]=4 65 B12R2.132 O[C@H]1COC2=C1C=C(F)C=C2 AT23851 [1,0,0,1,0,0|2,0,0]=4 66 B12R2.1316 NC1=CC(C2CC2)=C(Br)C=C1 AT14293 [1,0,0,1,0,0|2,0,0]=4 67 B12R2.1316 NC1=CC(C2CC2)=C(F)C=C1 90409 [1,0,0,1,0,0|2,0,0]=4 68 B14R2.4491 CC1(C)CCC2=C(C=C(O)C=C2)O1 D86170 [0,0,0,1,0,1|1,0,0]=3 69 B14R2.4491 CC1(C)CNC2=C(C=C(Br)C=C2)C1 AC9612 [0,0,0,1,0,1|2,0,0]=4 70 B14R2.2496 COC1=CC2=C(C=C1)NCC2(C)C C90694 [0,1,0,1,0,0|1,0,0]=3 71 B14R2.3417 CC1=C(C2(CN)CC2)C=C(F)C=C1 AC4488 [0,1,0,1,0,0|2,0,0]=4 72 B14R2.3417 NCC1(C2=C(Cl)C=CC(Cl)=C2)CC1 AC4243 [0,1,0,1,0,0|2,0,0]=4 73 B14R2.3417 NCC1(C2=C(F)C=CC(Br)=C2)CC1 AC4384 [0,1,0,1,0,0|2,0,0]=4 74 B14R2.3417 NCC1(C2=C(F)C=CC(F)=C2)CC1 AC3994 [0,1,0,1,0,0|2,0,0]=4 75 B14R2.4536 CC1(C)CNCC2=C1C=C(F)C=C2 AT19625 [0,1,0,1,0,0|2,0,0]=4 76 B14R2.4536 CC1(C)CNCC2=C1C=C(F)C=C2 AT19626 [0,1,0,1,0,0|2,0,0]=4 77 B14R2.29994 CC1(C2=C(Cl)C=C(O)C(N)=C2)CC1 D77514 [0,1,0,1,0,0|2,0,0]=4 78 B14R2.3069 COC1=C(C2(N)CC2)C=C(Br)C=C1 AC3740 [0,1,0,1,0,0|2,0,0]=4 79 B14R2.3069 COC1=C(C2(N)CC2)C=C(Br)C=C1 AC5058 [0,1,0,1,0,0|2,0,0]=4 80 B14R2.8732 CC1(C)NC(=O)C2=C1C=C(O)C=C2 32114 [0,1,0,1,0,0|1,0,1]=4 81 B12R1.119 CC(C)(C)SC1=CC(Cl)=CN=C1 AT19858 [1,0,0,0,0,1|2,0,0]=4 82 B12R1.119 CC(C)(N)CC1=CC=CC(Br)=C1 AT24486 [1,0,0,0,0,1|2,0,0]=4 83 B12R1.119 CC(C)(O)CC1=CC(N)=CC=C1 D75585 [1,0,0,0,0,1|2,0,0]=4 84 B12R1.127 CC(C)OC1=C(F)C=CC(N)=C1 AT11980 [1,0,0,0,0,1|2,0,0]=4