0 B11R1.605 CCOC1=C(N)C=CC=C1Cl 4026787 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.4 CC1=C(CNN)C=CC=C1 4015027 [1,0,0,0,0,0|2,0,0]=3 2 B10R1.4 CC1=CC=CN=C1CCO 4040975 [1,0,0,0,0,0|3,0,0]=4 3 B10R1.4 CCSC1=CC=CC=C1N 4091232 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.4 CCSC1=CC=CC=C1N 9071805 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.4 CNCC1=CC=CC=C1C 4028163 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.4 CNCC1=CC=CN=C1Cl 4019511 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.4 CNCC1=CC=CN=C1Cl 4090749 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.4 NNCC1=C(Cl)C=CC=C1 4041333 [1,0,0,0,0,0|1,0,0]=2 9 B10R1.245 CCC1=C(Cl)N=CN=C1Cl 4044933 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.245 COC1=C(Cl)C=CN=C1C 4082425 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.245 COC1=C(Cl)C=CN=C1Cl 4066686 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.245 COC1=C(N)C=CN=C1Cl 4110612 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.245 CSC1=C(O)C=CC=C1C 4031718 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.1009 CC(C)OC1=C(N)C=CC=C1Cl 4027100 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.1631 CC1=C(OCCN)C(Cl)=CC=C1 9071832 [0,1,0,0,0,0|1,0,0]=2 16 B12R1.1631 CC1=CC=CC(=O)N1CCCN 4041003 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.1631 CC1=CC=CC(C)=C1OCCN 4030893 [0,1,0,0,0,0|2,0,0]=3 18 B12R1.1631 CCCOC1=C(N)C=CC=C1Cl 4027047 [0,1,0,0,0,0|2,0,0]=3 19 B12R2.202 NC1=NC2=CC=CC(Cl)=C2O1 4040807 [0,0,0,1,0,0|2,0,1]=4 20 B12R2.1081 ClC1=C2CCNCC2=CC=C1 4002741 [0,0,0,1,0,0|1,0,0]=2 21 B9R1.8 BrCCC1=CC=CN=C1 4054467 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.8 BrCCC1=NC=CC=C1 4028495 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.8 BrCCC1=NC=CC=C1 4090022 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.8 NCCC1=CC=CN=C1 4005651 [2,0,0,0,0,0|1,0,0]=3 25 B9R1.8 NCCC1=NC=CN=C1 4003591 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.8 NCCC1=NC=CN=C1 4091207 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.15 CC1=C(CN)C=CN=C1 4010335 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.15 COC1=C(Cl)N=CC=C1 4034759 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.15 NCC1=CC=CC=C1Br 4108297 [2,0,0,0,0,0|0,1,0]=3 30 B9R1.15 NCC1=CC=CN=C1N 4037637 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.15 NCC1=NC=CC=C1Cl 4038421 [2,0,0,0,0,0|1,0,0]=3 32 B9R1.3 NC1=C(Br)C=CN=C1Cl 4103939 [2,0,0,0,0,0|1,1,0]=4 33 B9R1.3 NC1=C(N)C(Br)=CC=C1 4067086 [2,0,0,0,0,0|1,1,0]=4 34 B9R1.3 OC1=C(Cl)C=CC=C1Br 4083176 [2,0,0,0,0,0|1,1,0]=4 35 B11R1.17 CC1=C(NCCN)C=CN=C1 4014008 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.17 CC1=C(NCCN)N=CC=C1 4019581 [1,1,0,0,0,0|2,0,0]=4 37 B11R1.17 CC1=C(OCCN)C=CC=C1 4030987 [1,1,0,0,0,0|1,0,0]=3 38 B11R1.17 CC1=C(OCCN)C=CC=C1 4089934 [1,1,0,0,0,0|1,0,0]=3 39 B11R1.17 CCCSC1=CC=CC=C1N 4088576 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.17 CCCSC1=CC=CC=C1N 9070713 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.17 CCNCC1=CC=CC=C1C 4028579 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.17 CCNCC1=CC=CC=C1Cl 4024924 [1,1,0,0,0,0|1,0,0]=3 43 B11R1.17 CCNCC1=CC=CC=C1Cl 4089658 [1,1,0,0,0,0|1,0,0]=3 44 B11R1.17 NCCCC1=C(F)C=CC=C1 4019782 [1,1,0,0,0,0|0,1,0]=3 45 B11R1.17 NCCCC1=CC=CC=C1Cl 4087888 [1,1,0,0,0,0|0,0,0]=2 46 B11R1.17 NCCCN1C=CC=CC1=O 4044394 [1,1,0,0,0,0|2,0,0]=4 47 B11R1.17 NCCOC1=CC=CC=C1Cl 4026894 [1,1,0,0,0,0|0,0,0]=2 48 B11R1.17 NCCOC1=CC=CC=C1F 4015039 [1,1,0,0,0,0|0,1,0]=3 49 B11R1.17 NCCOC1=CC=CC=C1F 4090505 [1,1,0,0,0,0|0,1,0]=3 50 B11R1.41 COC1=CC=CC=C1CNN 4040117 [1,1,0,0,0,0|2,0,0]=4 51 B11R1.41 COC1=CC=CC=C1CNN 4090874 [1,1,0,0,0,0|2,0,0]=4 52 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 4027242 [1,1,0,0,0,0|2,0,0]=4 53 B13R1.4928 NNC(=O)CC1=C(Cl)C=CC=C1Cl 3015006 [0,2,0,0,0,0|0,0,1]=3 54 B13R1.4928 NNC(=O)CC1=C(Cl)C=CC=C1F 3015352 [0,2,0,0,0,0|0,1,1]=4 55 B13R1.1601 CC1=CC(C)=C(OCCN)C(C)=C1 4090855 [0,2,0,0,0,0|2,0,0]=4 56 B13R1.1601 CC1=CC(C)=C(OCCN)C(C)=C1 9071196 [0,2,0,0,0,0|2,0,0]=4 57 B13R1.8919 C=CCNCC1=C(F)C=CC=C1Cl 4089716 [0,2,0,0,0,0|1,1,0]=4 58 B13R1.8919 C=CCNCC1=C(F)C=CC=C1Cl 9070871 [0,2,0,0,0,0|1,1,0]=4 59 B13R1.8919 CNCCOC1=C(C)C=CC=C1C 4088624 [0,2,0,0,0,0|2,0,0]=4 60 B13R1.8919 CNCCOC1=C(C)C=CC=C1C 9070842 [0,2,0,0,0,0|2,0,0]=4 61 B11R1.24 NCCOC1=CC(Cl)=CC=C1 4015036 [0,0,1,1,0,0|2,0,0]=4 62 B11R2.20 C1=CN=C2CCNCC2=C1 4012266 [1,0,0,1,0,0|2,0,0]=4 63 B11R2.106 BrC1=CC=CC2=C1CCO2 4072546 [1,0,0,1,0,0|1,1,0]=4 64 B11R2.106 ClC1=C2C=NNC2=CC=C1 4027063 [1,0,0,1,0,0|1,0,1]=4 65 B11R2.106 NC1=C2CCOC2=CC=C1 4088054 [1,0,0,1,0,0|2,0,0]=4 66 B9R1.33 CN1C=CC=C1CCN 4004553 [1,0,0,0,1,0|2,0,0]=4