0 B12R1.34 CC(CN)N(C)C1=CC=CC=C1 4027273 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 4034385 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 3002604 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.16 CC(CCN)C1=CC=CC=C1 4004088 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.16 CCCC(N)C1=CC=CC=C1 4006320 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 4096885 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 4091353 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.16 CCNC(C)C1=CC=CC=C1 6592586 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.16 COCC(N)C1=NC=CC=C1 4025883 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.36 CC(C)C(=O)C1=CC=CN=C1 4026591 [1,0,0,0,0,0|1,0,2]=4 10 B11R1.36 CC(C)C(N)C1=CC=CC=C1 4043717 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.36 CC(C)C(N)C1=CC=CC=C1 4108973 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.36 CC(C)C(N)C1=CC=CN=C1 4026592 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.36 CC(C)C(N)C1=NC=CC=C1 4025879 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.36 CC(C)C(N)C1=NC=CC=C1 4088647 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 4100427 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 4012626 [1,0,0,0,0,0|1,0,1]=3 17 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 4088244 [1,0,0,0,0,0|1,0,1]=3 18 B11R1.40 CNC(C)CC1=NC=CN=C1 4016114 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.40 NNC(=O)CC1=CC=CC=C1 3002732 [1,0,0,0,0,0|2,0,1]=4 20 B13R1.152 CN(C)C(=O)C(N)C1=CC=CC=C1 4033561 [0,1,0,0,0,0|2,0,1]=4 21 B13R2.3085 CN1C(=O)C(N)C2=C1C=CC=C2 4011262 [0,0,0,1,0,0|2,0,1]=4 22 B10R1.15 CCC(N)C1=CC=CN=C1 4026589 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.15 CCC(N)C1=CC=NC=C1 4011086 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.15 CCC(N)C1=NC=CC=C1 4025877 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.15 CNC(C)C1=CC=NC=C1 4087979 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.15 CNC(C)C1=CC=NC=C1 4089962 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.15 CNC(C)C1=CC=NC=C1 4102792 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.15 CNC(C)C1=CN=CC=C1 4089365 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.15 CNC(C)C1=CN=CC=C1 4102793 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.15 CNC(C)C1=NC=CC=C1 4090171 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.15 CNC(C)C1=NC=CC=C1 4102794 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.15 NCC(O)C1=CN=CC=C1 4013988 [2,0,0,0,0,0|1,0,0]=3 33 B10R1.17 CNCCC1=CC=NC=C1 4004718 [2,0,0,0,0,0|1,0,0]=3 34 B10R1.17 CNCCC1=CC=NC=C1 4087817 [2,0,0,0,0,0|1,0,0]=3 35 B10R1.18 CC(N)CC1=CN=CC=C1 4002035 [2,0,0,0,0,0|1,0,0]=3 36 B10R1.18 CC(N)CC1=NC=CN=C1 4010867 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.18 CC(N)CC1=NC=CN=C1 4087844 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.18 CC(O)CC1=NC=CC=C1 4041318 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.16 CCCC(O)C1=CC=C(Br)C=C1 5101703 [1,1,0,0,0,0|1,0,0]=3 40 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 9071337 [1,1,0,0,0,0|0,0,2]=4 41 B12R1.30 CCCNC(C)C1=CC=CC=C1 4088824 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.30 CCCNC(C)C1=CC=CC=C1 6594188 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 4026826 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 4090930 [1,1,0,0,0,0|2,0,0]=4 45 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 6230715 [1,1,0,0,0,0|1,0,1]=4 46 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 4032694 [1,1,0,0,0,0|1,0,1]=4 47 B12R1.50 CNC(=O)CC1=CC=CC(N)=C1 4032584 [1,1,0,0,0,0|1,0,1]=4 48 B12R1.118 CCC(CN)CC1=CC=CC=C1 4033135 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.118 CCC(CN)CC1=CC=CC=C1 4110768 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.371 CCC(C)OC1=C(N)C=CC=C1 4028507 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.371 CNC(=O)CC1=CC=CC=C1N 4032938 [1,1,0,0,0,0|1,0,1]=4 52 B12R2.1081 OC1CNCC2=CC=CC=C21 4020540 [1,0,0,1,0,0|0,0,0]=2 53 B12R2.24 NC1CCC2=C(C=CC=C2)C1 4028420 [1,0,0,1,0,0|2,0,0]=4 54 B12R2.94 NC1(CC2=CC=CC=C2)CC1 4033380 [1,0,0,1,0,0|2,0,0]=4 55 B14R2.24 O[C@@H]1CNCC[C@H]1C2=CC=CC=C2 4037194 [0,1,0,1,0,0|2,0,0]=4 56 B14R2.24 O[C@H]1CNCC[C@H]1C2=CC=CC=C2 4110596 [0,1,0,1,0,0|2,0,0]=4 57 B12R1.27 CCC(C)NCC1=CC=CN=C1 4090038 [1,0,0,0,0,1|2,0,0]=4 58 B12R1.27 CCC(C)NCC1=CC=CN=C1 9071485 [1,0,0,0,0,1|2,0,0]=4 59 B12R1.27 CCC(C)NCC1=CC=NC=C1 4089267 [1,0,0,0,0,1|2,0,0]=4 60 B12R1.27 CCC(C)NCC1=CC=NC=C1 9071023 [1,0,0,0,0,1|2,0,0]=4 61 B12R1.27 CCC(C)NCC1=NC=CC=C1 4088188 [1,0,0,0,0,1|2,0,0]=4 62 B12R1.27 CCC(C)NCC1=NC=CC=C1 9070682 [1,0,0,0,0,1|2,0,0]=4