0 B14R2.22 CC1=CC=CC(C2=NOC(N)=C2)=C1 1044AF [0,0,0,0,0,0|3,0,1]=4 1 B14R2.22 CC1=NC(C2=CC(N)=CC=C2)=NO1 Y6811 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.22 NC1=CC(C2=CC=CC(Br)=C2)=NO1 3271AA [0,0,0,0,0,0|2,1,1]=4 3 B14R2.22 NC1=CC(C2=CC=CC(F)=C2)=NO1 6324AJ [0,0,0,0,0,0|2,0,1]=3 4 B14R2.22 NC1=CC(C2=CSC(N)=N2)=CC=C1 Z6692 [0,0,0,0,0,0|1,1,2]=4 5 B14R2.22 NC1=NC(C2=CC(O)=CC=C2)=CS1 8136AC [0,0,0,0,0,0|1,1,2]=4 6 B14R2.22 NC1=NC(C2=CC(O)=CC=C2)=CS1 X6425 [0,0,0,0,0,0|1,1,2]=4 7 B14R2.22 NC1=NC(C2=CC=CC(F)=C2)=CS1 V5992 [0,0,0,0,0,0|0,1,2]=3 8 B14R2.22 NC1=NN=C(C2=CC(F)=CC=C2)O1 0911AE [0,0,0,0,0,0|3,0,1]=4 9 B14R2.22 NC1=NNC(C2=CC(F)=CC=C2)=N1 4377AE [0,0,0,0,0,0|2,0,1]=3 10 B14R2.22 O=C1CC(C2=CC=CC(Br)=C2)CN1 X8946 [0,0,0,0,0,0|3,1,0]=4 11 B13R2.10 BrC1=NC(C2=CC=CC=C2)=NO1 Z4057 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 3448AA [1,0,0,0,0,0|2,0,1]=4 13 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 1400AQ [1,0,0,0,0,0|0,1,2]=4 14 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 0419AE [1,0,0,0,0,0|2,0,0]=3 15 B13R2.10 NC1=NNC(C2=CC=CC=C2)=N1 8058AF [1,0,0,0,0,0|2,0,1]=4 16 B13R2.10 NC1=NOC(C2=CC=CC=C2)=N1 2210AC [1,0,0,0,0,0|2,0,1]=4 17 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 8837AA [1,0,0,0,0,0|1,0,1]=3 18 B13R2.13 FC1=CC(C2CCCN2)=CC=C1 Q590 [1,0,0,0,0,0|1,0,2]=4 19 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 4837AJ [1,0,0,0,0,0|1,0,2]=4 20 B13R2.13 FC1=CC([C@H]2CCCN2)=CC=C1 4802AJ [1,0,0,0,0,0|1,0,2]=4 21 B13R2.13 FC1=CC([C@H]2CCCN2)=CC=C1 X6111 [1,0,0,0,0,0|1,0,2]=4 22 B13R2.13 FC1=CC=CC([C@H]2CCCN2)=C1 4801AJ [1,0,0,0,0,0|1,0,2]=4 23 B15R2.14 NCC1=CC(C2=CC(F)=CC=C2)=NO1 7773AC [0,1,0,0,0,0|2,0,1]=4 24 B15R2.14 NCC1=CSC(C2=CC=CC(F)=C2)=N1 8427AH [0,1,0,0,0,0|2,0,1]=4 25 B15R2.290 NC1=NC(C2=CC(F)=CC=C2F)=CS1 2118AE [0,1,0,0,0,0|0,1,2]=4 26 B15R2.299 NC1=CC(C2=CC=C(F)C(F)=C2)=NO1 2209AL [0,1,0,0,0,0|2,0,1]=4 27 B13R1.147 N[C@H](CC(=O)O)C1=CC(F)=CC=C1 1221AC [0,0,1,0,0,0|3,0,0]=4 28 B15R2.28 NC1=NC=C(C2=CC=CC(F)=C2)C=C1 V8219 [0,0,0,0,0,1|1,0,2]=4 29 B15R2.1115 NC1=NN(CC2=CC(F)=CC=C2)C=C1 4437AF [0,0,0,0,0,1|2,0,1]=4 30 B12R1.13 CC1=CC(C(CN)CO)=CC=C1 W7845 [1,0,1,0,0,0|1,0,1]=4 31 B12R1.27 COC(=O)NCC1=CC=CC=C1 6020AE [1,0,1,0,0,0|1,0,1]=4 32 B12R1.226 CC(=O)CCC1=CC=CC(F)=C1 1147AE [1,0,1,0,0,0|2,0,0]=4 33 B12R1.107 CC(NC(N)=S)C1=CC=CC=C1 V7228 [1,0,1,0,0,0|0,1,1]=4 34 B14R1.820 COC(=O)CCC1=CC(F)=CC=C1Br 5065AA [0,1,1,0,0,0|2,0,0]=4 35 B14R2.70 CC1=CC=C(C2=NOC=N2)C=C1F 2415AA [1,1,0,0,0,0|1,0,1]=4 36 B14R2.390 O=C1CCCC2=C(N1)C(F)=CC=C2 2490AA [0,0,1,1,0,0|2,0,0]=4 37 B12R1.225 CC(C(=O)O)C1=CC=CC(F)=C1 0039AC [0,0,1,0,1,0|1,0,0]=3 38 B12R1.225 CC1=CC(C(C)C(=O)O)=CC=C1 1119AJ [0,0,1,0,1,0|2,0,0]=4 39 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 5419AJ [0,0,1,0,1,0|2,0,0]=4 40 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 Z5958 [0,0,1,0,1,0|2,0,0]=4 41 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 8284AB [1,0,0,0,1,0|1,0,1]=4 42 B12R2.80 NC1CC1C2=CC(Cl)=CC=C2 5207AJ [0,0,0,0,2,0|0,1,1]=4 43 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 7199AA [1,0,0,0,0,1|1,0,1]=4 44 B14R2.68 NC1=NN=C(C2=CC=CC=C2)CS1 5485AE [1,0,0,0,0,1|0,1,1]=4