0 B11R1.28 C=CCNCC1=CC=CC=C1 4090793 [1,0,0,0,0,0|3,0,0]=4 1 B11R1.28 C=CCNCC1=CC=CC=C1 9070780 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.40 CNC(C)CC1=NC=CN=C1 4016114 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.40 NNC(=O)CC1=CC=CC=C1 3002732 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 4110663 [0,1,0,0,0,0|2,0,0]=3 5 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4003361 [0,1,0,0,0,0|3,0,0]=4 6 B13R1.348 CN(CC(=O)O)CC1=CC=NC=C1 4088460 [0,1,0,0,0,0|3,0,0]=4 7 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4003359 [0,1,0,0,0,0|3,0,0]=4 8 B13R1.348 CN(CC(=O)O)CC1=CN=CC=C1 4090519 [0,1,0,0,0,0|3,0,0]=4 9 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4003360 [0,1,0,0,0,0|3,0,0]=4 10 B13R1.348 CN(CC(=O)O)CC1=NC=CC=C1 4088525 [0,1,0,0,0,0|3,0,0]=4 11 B13R2.64 C1=CC=C(CC2CCNC2)C=C1 4042868 [0,0,0,1,0,0|2,0,1]=4 12 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)S1 4012562 [0,0,0,1,0,0|2,0,1]=4 13 B13R2.328 CC1=NC2=C(C=CC=N2)C(=O)N1 4043360 [0,0,0,1,0,0|2,0,1]=4 14 B11R1.16 CC(CCN)C1=CC=CC=C1 4004088 [0,0,0,0,1,0|2,0,1]=4 15 B11R1.16 CC(N=C=O)C1=CC=CC=C1 4040282 [0,0,0,0,1,0|0,0,2]=3 16 B11R1.16 CCNC(C)C1=CC=CC=C1 6592586 [0,0,0,0,1,0|1,0,1]=3 17 B13R1.42 CCCC(C)NCC1=CC=CC=C1 4024859 [0,0,0,0,0,1|2,0,1]=4 18 B13R1.42 CCCC(C)NCC1=CC=CC=C1 4088657 [0,0,0,0,0,1|2,0,1]=4 19 B10R1.17 C=CCCC1=CC=CN=C1 4073007 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.17 CNCCC1=CC=NC=C1 4004718 [2,0,0,0,0,0|1,0,1]=4 21 B10R1.17 CNCCC1=CC=NC=C1 4087817 [2,0,0,0,0,0|1,0,1]=4 22 B10R1.18 CC(=O)CC1=CC=CN=C1 4301933 [2,0,0,0,0,0|1,0,1]=4 23 B10R1.18 CC(=O)CC1=NC=CC=C1 4301932 [2,0,0,0,0,0|1,0,1]=4 24 B10R1.18 CC(N)CC1=CN=CC=C1 4002035 [2,0,0,0,0,0|1,0,0]=3 25 B10R1.18 CC(N)CC1=NC=CN=C1 4010867 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.18 CC(N)CC1=NC=CN=C1 4087844 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.18 CC(O)CC1=NC=CC=C1 4041318 [2,0,0,0,0,0|1,0,1]=4 28 B12R1.8 CCCNCCC1=CC=CC=C1 6382736 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.8 CCNCCCC1=CC=CC=C1 4024844 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.8 CCNCCOC1=CC=CC=C1 4088022 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.8 CCNCCOC1=CC=CC=C1 9070430 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.252 CC(C)NCCC1=CC=CC=C1 4024832 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.252 CC(C)NCCC1=CC=CC=C1 4088731 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.252 N=C(N)CCCC1=CC=CC=C1 4059893 [1,1,0,0,0,0|2,0,0]=4 35 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O 3001886 [1,1,0,0,0,0|1,0,0]=3 36 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O 4400386 [1,1,0,0,0,0|2,0,0]=4 37 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4015994 [1,1,0,0,0,0|2,0,0]=4 38 B12R1.43 CN(CC1=CC=CC=C1)C(=N)N 4090580 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.43 CN(CC1=CC=CC=C1)C(N)=S 4009975 [1,1,0,0,0,0|1,1,0]=4 40 B12R1.118 CCC(CN)CC1=CC=CC=C1 4033135 [1,1,0,0,0,0|1,0,1]=4 41 B12R1.118 CCC(CN)CC1=CC=CC=C1 4110768 [1,1,0,0,0,0|1,0,1]=4 42 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 4002596 [0,1,0,0,1,0|1,0,0]=3 43 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 4090863 [0,1,0,0,1,0|1,0,0]=3 44 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 4026827 [0,1,0,0,1,0|2,0,0]=4 45 B14R1.1485 CC(=O)CC(C)(C)NC1=CC=CC=C1 4091164 [0,2,0,0,0,0|2,0,0]=4 46 B14R1.1485 CC(=O)CC(C)(C)NC1=CC=CC=C1 5230713 [0,2,0,0,0,0|2,0,0]=4 47 B12R2.1081 O=C1NCCC2=CC=CC=C12 4045791 [1,0,0,1,0,0|0,0,0]=2 48 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 4002962 [0,0,0,1,1,0|1,0,0]=3 49 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4030655 [0,0,0,1,1,0|0,0,0]=2 50 B14R2.598 NC1CC(=O)N(C2=CC=CC=C2)C1 4014086 [0,0,0,1,0,1|2,0,0]=4 51 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(=O)N1 4014422 [0,1,0,1,0,0|1,0,1]=4 52 B14R2.6 C1=CC=C(CC2CCCCN2)C=C1 3002612 [0,1,0,1,0,0|1,0,1]=4 53 B14R2.19 O=C1CC(CC2=CC=CC=C2)CN1 4026758 [0,1,0,1,0,0|0,0,0]=2 54 B14R2.1019 NCC1=NC2=CC=CC=C2C(=O)N1 4009695 [0,1,0,1,0,0|1,0,1]=4 55 B14R2.1019 O=C1NC(CO)=NC2=CC=CC=C12 4043769 [0,1,0,1,0,0|1,0,1]=4 56 B14R2.768 O=C(O)CN1CC2=CC=CC=C2C1 4003155 [0,1,0,1,0,0|2,0,0]=4 57 B14R2.29496 CC1NC(C)(C)CC2=C1C=CC=C2 4000293 [0,1,0,1,0,0|1,0,1]=4 58 B10R1.15 CNC(C)C1=CC=NC=C1 4087979 [1,0,0,0,1,0|1,0,1]=4 59 B10R1.15 CNC(C)C1=CC=NC=C1 4089962 [1,0,0,0,1,0|1,0,1]=4 60 B10R1.15 CNC(C)C1=CC=NC=C1 4102792 [1,0,0,0,1,0|1,0,1]=4 61 B10R1.15 CNC(C)C1=CN=CC=C1 4089365 [1,0,0,0,1,0|1,0,1]=4 62 B10R1.15 CNC(C)C1=CN=CC=C1 4102793 [1,0,0,0,1,0|1,0,1]=4 63 B10R1.15 CNC(C)C1=NC=CC=C1 4090171 [1,0,0,0,1,0|1,0,1]=4 64 B10R1.15 CNC(C)C1=NC=CC=C1 4102794 [1,0,0,0,1,0|1,0,1]=4