0 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 BB56-1783 [0,0,0,0,0,0|1,1,0]=2 1 B12R2.252 O=C(O)C1=CC2=C(C=CS2)N1 BB01-2518 [0,0,0,0,0,0|1,0,0]=1 2 B12R2.252 O=C(O)C1=CC2=C(CCC2)S1 BB12-1787 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.400 CC1=CC2=C(C=C(C(=O)O)N2)O1 BB56-1784 [0,1,0,0,0,0|1,1,0]=3 4 B13R2.400 CC1=CC2=C(C=C(C(=O)O)N2)S1 BB56-2140 [0,1,0,0,0,0|1,0,0]=2 5 B13R2.531 COC(=O)C1=CC2=C(N1)SC=C2 BB01-2516 [0,1,0,0,0,0|2,0,0]=3 6 B13R2.531 COC(=O)C1=CC2=C(N=CS2)S1 BB58-3284 [0,1,0,0,0,0|1,0,0]=2 7 B13R2.531 NNC(=O)C1=CC2=C(C=CO2)N1 BB01-2863 [0,1,0,0,0,0|2,1,0]=4 8 B13R2.531 NNC(=O)C1=CC2=C(C=CS2)N1 BB58-3728 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.2334 CN1C(C(=O)O)=CC2=C1C=CS2 BB90-0053 [0,1,0,0,0,0|1,0,0]=2 10 B11R1.35 NC(CC1=CC=CS1)C(=O)O BB57-4844 [0,0,1,0,0,0|1,0,2]=4 11 B11R1.90 CN1N=CC=C1\C=C\C(=O)O BB05-3478 [0,0,1,0,0,0|3,0,0]=4 12 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 BB54-5302 [0,0,0,0,0,1|3,0,0]=4 13 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 BB12-2808 [0,0,0,0,0,1|2,0,0]=3 14 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)N=CS2 BB57-4425 [0,0,0,0,0,1|2,0,1]=4 15 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 BB12-3811 [0,0,0,0,0,1|3,0,0]=4 16 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 BB50-0386 [0,0,0,0,0,1|3,0,0]=4 17 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 BB31-7905 [0,0,0,0,0,1|3,0,0]=4 18 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 BB54-4264 [0,0,0,0,0,1|3,0,0]=4 19 B13R2.435 O=C(O)C1=NC2=CC=CN=C2N1 BB12-3038 [0,0,0,0,0,1|2,0,0]=3 20 B14R2.601 NC1=NC2=CC=C(C(=O)O)C=C2S1 BB56-0890 [0,1,0,0,0,1|1,0,0]=3 21 B14R2.5719 CN1C=NC2=C1C=CC(C(=O)O)=C2 BB54-5788 [0,1,0,0,0,1|2,0,0]=4 22 B14R2.8824 NC1=CC(C(=O)O)=CC2=C1N=CN2 BB54-5709 [0,1,0,0,0,1|2,0,0]=4 23 B14R2.450 CC1=C(C(=O)O)NC2=CC=CC=C21 BB57-0315 [0,1,0,0,0,1|2,0,0]=4 24 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2N1 BB12-2295 [0,1,0,0,0,1|2,0,0]=4 25 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 BB11-0045 [0,1,0,0,0,1|1,0,0]=3 26 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 BB56-1149 [0,1,0,0,0,1|2,0,0]=4 27 B14R2.4529 CC1=CC=C2NC(C(=O)O)=CC2=C1 BB01-5002 [0,1,0,0,0,1|2,0,0]=4 28 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)N1 BB54-2925 [0,1,0,0,0,1|2,0,0]=4 29 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 BB20-4570 [0,1,0,0,0,1|2,0,0]=4 30 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2N1 BB56-0738 [0,1,0,0,0,1|2,0,0]=4 31 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 BB56-0739 [0,1,0,0,0,1|2,0,0]=4 32 B14R2.4529 O=C(O)C1=CC2=CC=C(I)C=C2N1 BB56-1734 [0,1,0,0,0,1|2,0,0]=4 33 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 BB56-0399 [0,1,0,0,0,1|2,0,0]=4 34 B14R2.7969 N1C(C(=O)O)=CC2=CC=CC(C)=C21 BB54-4230 [0,1,0,0,0,1|2,0,0]=4 35 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2N1 BB56-0695 [0,1,0,0,0,1|2,0,0]=4 36 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 BB56-1354 [0,1,0,0,0,1|2,0,0]=4 37 B14R2.10815 COC(=O)C1=CC2=C(C=C(C)O2)N1 BB51-1066 [0,2,0,0,0,0|1,1,0]=4 38 B14R2.10815 COC(=O)C1=CC2=C(C=C(C)S2)N1 BB51-1183 [0,2,0,0,0,0|1,0,0]=3 39 B14R2.839 CCOC(=O)C1=CC2=C(N1)SC=C2 BB01-2519 [0,2,0,0,0,0|2,0,0]=4 40 B14R2.4281 CCN1C(C(=O)O)=CC2=C1C=CO2 BB01-3562 [0,2,0,0,0,0|1,1,0]=4 41 B14R2.4281 CCN1C(C(=O)O)=CC2=C1C=CS2 BB90-0054 [0,2,0,0,0,0|1,0,0]=3 42 B10R1.23 NC(C(=O)O)C1=CC=CS1 BB56-0352 [0,0,1,0,1,0|1,0,1]=4 43 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 BB55-3550 [0,0,1,0,0,1|2,0,0]=4 44 B12R2.32 OCC1=CC2=CC=CN=C2N1 BB58-3263 [1,0,0,0,0,1|1,0,1]=4 45 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)NC=N2 BB54-3737 [0,0,0,0,0,2|2,0,0]=4