0 B9R1.6 C=C(C)C1=NC=CC=C1 F1967-3030 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 CC(N)C1=NC=CN=C1 F2147-1133 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.6 CC(O)C1=NC=CN=C1 F8880-1914 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.2 C#CC1=CN=CN=C1 F8883-2540 [1,0,0,0,0,0|2,0,1]=4 4 B8R1.2 C#CC1=NC=CN=C1 F2167-5013 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.13 CC1=NN=C(C(=O)O)C=C1 F1903-9768 [0,1,0,0,0,0|2,0,0]=3 6 B10R1.15 NC(CCl)C1=CC=CC=C1 F2185-0694 [0,1,0,0,0,0|2,0,1]=4 7 B10R1.15 NCC(=O)C1=CC=NC=C1 F8888-6178 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.15 NCC(=O)C1=NC=CC=C1 F8888-5037 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.15 O=C(CBr)C1=NC=CN=C1 F2147-1579 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.15 O=C(CCl)C1=CC=NC=C1 F2108-0200 [0,1,0,0,0,0|3,0,0]=4 11 B10R1.61 O=C(O)C1=CC=NN=C1O F2147-1142 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.113 CC(=O)C1=CC(F)=CN=C1 F8889-6458 [0,1,0,0,0,0|1,0,0]=2 13 B10R1.113 CN(C)C1=CN=CC(Br)=C1 F1913-3104 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.113 FC1=CN=CC(C(F)F)=C1 F1913-3115 [0,1,0,0,0,0|2,0,1]=4 15 B8R1.7 C=C(C)C1=CC=CO1 F1967-3020 [0,0,0,0,1,0|3,0,0]=4 16 B8R1.7 N=C(N)C1=CC=CO1 F2197-0081 [0,0,0,0,1,0|2,0,0]=3 17 B8R1.7 O=C(O)C1=CN=NS1 F1984-0294 [0,0,0,0,1,0|3,0,0]=4 18 B10R1.18 O=C(O)CC1=NC=CC=C1 F1967-3208 [0,0,0,0,0,1|3,0,0]=4 19 B9R1.1 C#CC1=CC=C(Cl)N=C1 F1913-1305 [1,1,0,0,0,0|1,0,1]=4 20 B9R1.1 NCC1=CN=C(N)C=C1 F8887-5395 [1,1,0,0,0,0|0,0,1]=3 21 B9R1.1 NCC1=CN=C(N)C=C1 F8888-7281 [1,1,0,0,0,0|0,0,1]=3 22 B9R1.2 C#CC1=CC(C)=CN=C1 F2197-7933 [1,1,0,0,0,0|1,0,1]=4 23 B9R1.2 C#CC1=CC(F)=CN=C1 F2197-2465 [1,1,0,0,0,0|1,0,1]=4 24 B9R1.2 OCC1=CC(F)=CN=C1 F1910-8476 [1,1,0,0,0,0|0,0,2]=4 25 B9R1.8 BrCCC1=CC=CN=C1 F1910-8458 [1,1,0,0,0,0|1,0,1]=4 26 B9R1.8 O=CNC1=CC=NC=C1 F1984-0331 [1,1,0,0,0,0|2,0,0]=4 27 B9R1.15 C#CC1=C(C)C=CN=C1 F2197-7934 [1,1,0,0,0,0|1,0,1]=4 28 B9R1.15 C#CC1=CC=CN=C1C F2197-2459 [1,1,0,0,0,0|1,0,1]=4 29 B9R1.15 C#CC1=CC=CN=C1Cl F2147-2794 [1,1,0,0,0,0|1,0,1]=4 30 B9R1.15 NCC1=CC=CNC1=O F2147-1264 [1,1,0,0,0,0|0,0,2]=4 31 B9R1.15 O=CC1=NC=CC=C1O F1957-0037 [1,1,0,0,0,0|2,0,0]=4 32 B9R1.11 NCC(=O)C1=CC=CS1 F0017-0499 [0,1,0,0,1,0|1,0,0]=3 33 B9R1.11 NNC(=O)C1=CSC=N1 F0451-0494 [0,1,0,0,1,0|1,0,0]=3 34 B9R1.11 N\C(=N/O)C1=CC=CO1 F2145-0889 [0,1,0,0,1,0|1,0,1]=4 35 B9R1.11 O=C(CCl)C1=CC=CN1 F1791-1135 [0,1,0,0,1,0|1,0,1]=4 36 B9R1.35 CC1=CSC(C(=O)Cl)=C1 F2158-1127 [0,1,0,0,1,0|2,0,0]=4 37 B9R1.35 NC(=O)C1=CC=C(I)O1 F1303-0037 [0,1,0,0,1,0|1,0,0]=3 38 B9R1.35 O=C(Cl)C1=CC=C(Br)O1 F2190-0123 [0,1,0,0,1,0|2,0,0]=4 39 B9R1.35 O=C(O)C1=CN=C(S)N1 F1791-0552 [0,1,0,0,1,0|2,0,0]=4 40 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 F2199-0278 [0,1,0,0,0,1|1,0,0]=3 41 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 F2167-0157 [0,1,0,0,0,1|1,0,0]=3 42 B11R1.40 CC(CN)OC1=CN=CC=C1 F8886-6148 [0,1,0,0,0,1|1,0,1]=4 43 B11R1.40 O=C(CBr)NC1=CC=CC=C1 F3310-0572 [0,1,0,0,0,1|2,0,0]=4 44 B11R1.40 O=C(CS)NC1=CC=CC=C1 F0482-0001 [0,1,0,0,0,1|2,0,0]=4 45 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 F2158-0398 [0,1,0,0,0,1|2,0,0]=4 46 B11R1.86 N=C(N)NC1=C(Br)C=CC=C1 F2158-0710 [0,1,0,0,0,1|2,0,0]=4 47 B11R1.157 CC1=CC=CC(NC(=N)N)=C1 F2158-0390 [0,1,0,0,0,1|2,0,0]=4 48 B11R1.3 NCC1=CN=C(C(N)=O)C=C1 F2147-1265 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.19 NS(=O)(=O)C1=CN=C(Cl)C=C1 F2113-0302 [0,2,0,0,0,0|1,0,0]=3 50 B11R1.22 COC(=O)C1=NN=C(C)C=C1 F1903-9769 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.53 COC1=NC=NC=C1C(=O)O F2147-8633 [0,2,0,0,0,0|2,0,0]=4 52 B11R1.53 NNC1=C(C(=O)O)C=CC=N1 F3111-0406 [0,2,0,0,0,0|1,0,0]=3 53 B11R1.167 CC1=CC=C(Cl)C(C(=O)Cl)=C1 F1913-1593 [0,2,0,0,0,0|2,0,0]=4 54 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 F1967-2907 [0,2,0,0,0,0|2,0,0]=4 55 B11R2.10 CC1=NC2=C(C=NC=C2)N1 F0378-0006 [0,0,0,1,0,1|1,0,1]=4 56 B11R2.10 O=C1NC2=NC=CC=C2S1 F1902-0087 [0,0,0,1,0,1|0,0,0]=2 57 B11R2.1 O=C1SNC2=CC=CC=C12 F2147-0250 [0,1,0,1,0,0|1,0,0]=3 58 B7R1.1 NCC1=CC=NO1 F2199-0010 [1,0,0,0,1,0|1,0,1]=4 59 B7R1.1 NCC1=CN=CO1 F9995-1827 [1,0,0,0,1,0|1,0,1]=4 60 B7R1.1 NCC1=COC=N1 F1905-0258 [1,0,0,0,1,0|1,0,1]=4 61 B7R1.1 NCC1=CSC=N1 F2173-0021 [1,0,0,0,1,0|1,0,1]=4 62 B11R1.91 NC(=O)NCC1=NC=CC=C1 F1967-1592 [0,0,0,0,0,2|2,0,0]=4