0 B14R2.20 CC1=CC=C(C2=CSC(N)=N2)C=C1 7H30-1-31 [0,0,0,0,0,0|1,1,2]=4 1 B14R2.20 CC1=CC=C(C2=NOC(C)=N2)C=C1 4H47-1-0R [0,0,0,0,0,0|3,0,1]=4 2 B14R2.20 CC1=CC=C(C2=NOC(N)=C2)C=C1 4H56-1-589 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.20 CC1=NC(C2=CC=C(Cl)C=C2)=NO1 4H56-5-PK [0,0,0,0,0,0|2,0,1]=3 4 B14R2.20 CC1=NC(C2=CC=C(F)C=C2)=NO1 4H47-3-0E [0,0,0,0,0,0|2,1,1]=4 5 B14R2.20 CC1=NC(C2=CC=C(N)C=C2)=NO1 4H56-1-K5 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.20 CC1=NN(C2=CC=C(Cl)C=C2)C=C1 3H32-5-PR [0,0,0,0,0,0|3,0,1]=4 7 B14R2.20 CC1=NSC(C2=CC=C(Cl)C=C2)=N1 7H70-5-54 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NO1 4H30-9-X5 [0,0,0,0,0,0|2,1,1]=4 9 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NO1 4H30-5-31 [0,0,0,0,0,0|2,0,1]=3 10 B14R2.20 NC1=CC(C2=CC=C(F)C=C2)=NO1 4H30-3-X2 [0,0,0,0,0,0|2,1,1]=4 11 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=NS1 7H30-3-19 [0,0,0,0,0,0|1,2,1]=4 12 B14R2.20 NC1=NCC(C2=CC=C(Br)C=C2)O1 4H30-9-06 [0,0,0,0,0,0|2,1,0]=3 13 B14R2.20 NC1=NN(C2=CC=C(Cl)C=C2)C=C1 3H30-5-8Q [0,0,0,0,0,0|2,0,1]=3 14 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)O1 4H30-5-16 [0,0,0,0,0,0|3,0,1]=4 15 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)S1 7H30-5-12 [0,0,0,0,0,0|3,0,1]=4 16 B14R2.20 NC1=NNC(C2=CC=C(Cl)C=N2)=N1 3H30-5-1M [0,0,0,0,0,0|3,0,1]=4 17 B14R2.20 NC1=NOC(C2=CC=C(F)C=C2)=N1 4H30-3-33 [0,0,0,0,0,0|2,1,1]=4 18 B14R2.20 OC1=NN(C2=CC=C(Cl)C=C2)C=C1 4H01-5-1Y [0,0,0,0,0,0|3,0,1]=4 19 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 4H44-1-17 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.10 ClC1=NC(C2=CC=CC=C2)=CO1 4H47-5-0E [1,0,0,0,0,0|1,0,2]=4 21 B13R2.10 ClC1=NC(C2=CC=CC=C2)=NO1 4H56-5-BL [1,0,0,0,0,0|2,0,1]=4 22 B13R2.10 NC1=NC(C2=CC=CC=C2)=CN1 3H30-1-GL [1,0,0,0,0,0|1,0,2]=4 23 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 7H30-1-03 [1,0,0,0,0,0|0,1,2]=4 24 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 3H30-1-PK [1,0,0,0,0,0|2,0,1]=4 25 B13R2.10 NC1=NOC(C2=CC=CC=C2)=N1 4H30-1-BJ [1,0,0,0,0,0|2,0,1]=4 26 B13R2.10 O=C1CCC(C2=CC=CC=C2)O1 2H25-1-2C [1,0,0,0,0,0|3,0,0]=4 27 B13R2.10 OC1=NC(C2=CC=CC=C2)=CO1 4H01-1-9P [1,0,0,0,0,0|1,0,2]=4 28 B13R2.10 OC1=NC(C2=CC=CC=C2)=NO1 4H56-1-919 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 8H67-1-S2 [1,0,0,0,0,0|1,0,1]=3 30 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 7H67-1-S2 [1,0,0,0,0,0|1,1,1]=4 31 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 8H67-1-R3 [1,0,0,0,0,0|1,0,1]=3 32 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 7H67-1-R1 [1,0,0,0,0,0|1,1,1]=4 33 B13R2.12 BrC1=CC=C(C2=NOC=N2)C=C1 4H44-9-06 [1,0,0,0,0,0|1,1,1]=4 34 B13R2.12 ClC1=CC=C(C2=CNC=N2)C=C1 3H31-5-X3 [1,0,0,0,0,0|1,0,2]=4 35 B13R2.12 ClC1=CC=C(C2=CSC=N2)C=C1 7H70-5-2E [1,0,0,0,0,0|0,1,2]=4 36 B13R2.12 ClC1=CC=C(C2=NC=NN2)C=C1 3H31-5-BA [1,0,0,0,0,0|2,0,1]=4 37 B13R2.12 ClC1=CC=C(C2=NOC=C2)C=C1 4H56-5-PL [1,0,0,0,0,0|2,0,1]=4 38 B13R2.12 ClC1=CC=C(C2=NOC=N2)C=C1 4648-5-1W [1,0,0,0,0,0|1,0,1]=3 39 B13R2.12 ClC1=CC=C(C2CCNC2)C=C1 4H21-5-77 [1,0,0,0,0,0|2,0,1]=4 40 B13R2.12 ClC1=CC=C(N2C=CC=N2)C=C1 3H32-5-FS [1,0,0,0,0,0|2,0,1]=4 41 B13R2.12 FC1=CC=C(C2=NOC=N2)C=C1 4H47-3-0F [1,0,0,0,0,0|1,1,1]=4 42 B13R2.12 NC1=CC=C(C2CSN=N2)C=C1 7H30-1-0X [1,0,0,0,0,0|2,1,0]=4 43 B15R2.275 CC1=CC=C(C2=NOC(CN)=N2)C=C1 4H30-1-C8 [0,1,0,0,0,0|2,0,1]=4 44 B15R2.275 NCC1=NC(C2=CC=C(F)C=C2)=NO1 4H30-3-30 [0,1,0,0,0,0|1,1,1]=4 45 B15R2.275 NCC1=NC(C2=CC=C(F)C=C2)=NO1 4H56-7-2V [0,1,0,0,0,0|1,1,1]=4 46 B15R2.275 O=CC1=NC(C2=CC=C(Cl)C=C2)=NO1 4H15-5-79 [0,1,0,0,0,0|2,0,1]=4 47 B15R2.275 OCC1=NC(C2=CC=C(Cl)C=C2)=NO1 4H01-5-Y4 [0,1,0,0,0,0|2,0,1]=4 48 B15R2.307 CC1CN(C2=CC=C(Cl)C=N2)N=C1N 3H30-5-6H [0,1,0,0,0,0|3,0,0]=4 49 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 2623-3-2J [0,0,1,0,0,0|2,1,0]=4 50 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 4658-1-1E [0,0,1,0,0,0|3,0,0]=4 51 B13R1.132 CC(CC(=O)O)C1=CC=C(F)C=C1 2721-3-97 [0,0,1,0,0,0|2,1,0]=4 52 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 4657-5-01 [0,0,1,0,0,0|3,0,0]=4 53 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 4630-5-R1 [0,0,1,0,0,0|3,0,0]=4 54 B13R2.147 O=C1CC(C2=CC=C(Cl)C=C2)C1 2217-5-05 [0,0,0,0,1,0|2,0,0]=3 55 B15R2.28 NC1=NC(C2=CC=C(Cl)C=C2)=CC=N1 3H30-5-P2 [0,0,0,0,0,1|1,0,2]=4 56 B15R2.28 N[C@@H]1CCC[C@H](C2=CC=C(Cl)C=C2)C1 3630-5-0K [0,0,0,0,0,1|2,0,1]=4 57 B15R2.98 NC1=NC(NC2=CC=C(Cl)C=C2)=NN1 3H31-5-56 [0,0,0,0,0,1|2,0,1]=4 58 B15R2.98 NC1=NC(NC2=CC=C(Cl)C=C2)N=N1 3H31-5-75 [0,0,0,0,0,1|2,0,0]=3 59 B12R1.16 C[C@@H](N=C=S)C1=CC=C(Cl)C=C1 7668-5-00 [1,0,1,0,0,0|0,1,1]=4 60 B12R1.16 C[C@H](N=C=S)C1=CC=C(Cl)C=C1 7668-5-12 [1,0,1,0,0,0|0,1,1]=4 61 B12R1.21 C=C(C)CCC1=CC=C(Cl)C=C1 1900-5-09 [1,0,1,0,0,0|2,0,0]=4 62 B12R1.21 NC(=O)NCC1=CC=C(Cl)C=C1 4653-5-0C [1,0,1,0,0,0|0,0,2]=4 63 B12R1.252 N=C(N)NCCC1=CC=CC=C1 3641-5-00 [1,0,1,0,0,0|1,0,0]=3 64 B12R2.2 C1=CC=C(C2=COC=N2)C=C1 4H56-1-06D [2,0,0,0,0,0|0,0,2]=4 65 B14R1.694 CC(C)(CC(=O)O)C1=CC=C(Cl)C=C1 2621-5-25 [0,1,1,0,0,0|2,0,0]=4 66 B14R1.687 N=C(N)SCCC1=CC=C(Cl)C(Cl)=C1 7667-5-27 [0,1,1,0,0,0|0,1,0]=3 67 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 4H30-1-4B [1,1,0,0,0,0|1,0,1]=4 68 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 4H56-5-BA [1,1,0,0,0,0|1,0,1]=4 69 B14R2.4402 O=C(O)C1CC1C2=CC=C(Cl)C=C2 2621-5-0V [0,0,1,1,0,0|2,0,0]=4 70 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 2723-1-1A [0,0,1,0,1,0|2,0,0]=4 71 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 4H23-5-5B [0,0,1,0,1,0|2,0,0]=4 72 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 4658-5-0D [0,0,1,0,1,0|2,0,0]=4 73 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 2621-5-1A [0,0,1,0,1,0|1,0,0]=3 74 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 2721-3-79 [0,0,1,0,1,0|1,1,0]=4 75 B12R1.20 CC1=CC=C([C@@H](C)C(=O)O)C=C1 2721-1-R0 [0,0,1,0,1,0|2,0,0]=4 76 B12R1.20 CC1=CC=C([C@H](C)C(=O)O)C=C1 2721-1-S0 [0,0,1,0,1,0|2,0,0]=4 77 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(O)C=C1 2629-1-R1 [0,0,1,0,1,0|2,0,0]=4 78 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 4657-5-S7 [0,0,1,0,1,0|2,0,0]=4 79 B12R1.20 O=C(O)C(Br)C1=CC=C(Cl)C=C1 2621-D-11 [0,0,1,0,1,0|2,0,0]=4 80 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 4H48-1-GG [1,0,0,0,1,0|1,0,1]=4 81 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 2H10-9-64 [1,0,0,0,1,0|0,1,1]=4 82 B12R2.2302 NC1=CC=C(C2COC2)C=C1 4H56-1-420 [1,0,0,0,1,0|1,0,1]=4 83 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 3730-7-40 [0,0,0,0,2,0|0,1,1]=4 84 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 8H67-1-S3 [1,0,0,0,0,1|1,0,1]=4 85 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 8H67-1-R2 [1,0,0,0,0,1|1,0,1]=4 86 B14R2.21 O=C1CC(C2=CC=CC=C2)CCO1 2H25-1-77 [1,0,0,0,0,1|2,0,0]=4