0 B9R1.35 NC(=S)C1=NC=C(N)S1 F2124-1103 [0,0,0,0,0,0|3,1,0]=4 1 B9R1.35 NC1CC=C(C(=O)O)C1 F1967-2233 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.35 O=C(O)C1=CC=C(I)O1 F0848-0308 [0,0,0,0,0,0|0,2,0]=2 3 B8R1.1 C#CC1=CC=C(C)S1 F2147-2801 [1,0,0,0,0,0|2,0,1]=4 4 B8R1.7 C=C(F)C1=CC=CO1 F1967-3018 [1,0,0,0,0,0|2,1,0]=4 5 B8R1.7 C=C(F)C1=CC=CS1 F1967-3019 [1,0,0,0,0,0|2,0,0]=3 6 B8R1.7 CC(=O)C1=NOC=C1 F2147-8062 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.7 FC(F)C1=CC=CS1 F1913-5799 [1,0,0,0,0,0|2,0,1]=4 8 B8R1.7 O=C(O)C1=CCCO1 F8889-5190 [1,0,0,0,0,0|0,1,2]=4 9 B10R1.31 C#CC1=CSC(C(=O)O)=C1 F2167-2856 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.31 NCC1=NC(C(=O)O)=CO1 F1901-0234 [0,1,0,0,0,0|3,0,0]=4 11 B10R1.31 NCC1=NC=C(C(=O)O)N1 F9995-2668 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.59 CC1=NC(C)=C(C(=O)Cl)S1 F2190-0144 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.59 O=C(O)C1=C(Br)SC(Cl)=N1 F2158-0663 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.59 O=C(O)C1=C(Cl)SC(Br)=N1 F2158-0661 [0,1,0,0,0,0|2,1,0]=4 15 B10R1.13 C=C(F)C1=CC=C(Cl)C=C1 F1967-2980 [0,0,0,0,0,1|3,0,0]=4 16 B10R1.13 O=C(O)C1=NC=C(F)C=N1 F2147-5291 [0,0,0,0,0,1|2,1,0]=4 17 B10R1.54 NC1=NC=C(CC(=O)O)S1 F1913-3635 [0,0,0,0,0,1|2,0,0]=3 18 B10R1.113 CC1=NC(C(=O)O)=NC=C1 F1912-0121 [0,0,0,0,0,1|2,0,0]=3 19 B10R1.113 CC1=NN=CC(C(=O)O)=C1 F1967-2909 [0,0,0,0,0,1|3,0,0]=4 20 B7R0.4 C\C=C\C=C/C(=O)O F2191-0241 [1,0,1,0,0,0|1,0,0]=3 21 B7R1.1 C=CC1=CC=CO1 F1967-3022 [2,0,0,0,0,0|1,1,0]=4 22 B9R1.21 O=CC1=CC=C(CBr)O1 F1913-1504 [1,1,0,0,0,0|0,2,0]=4 23 B9R1.132 O=CC1=CSC(Cl)=C1Br F1913-5800 [1,1,0,0,0,0|2,0,0]=4 24 B9R1.11 CC(C=O)C1=CC=CS1 F1967-2633 [1,1,0,0,0,0|1,0,1]=4 25 B9R1.41 O=C(O)C1=NOC=C1Br F2147-8096 [1,1,0,0,0,0|2,0,0]=4 26 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)N=C1 F2124-0034 [0,1,0,0,0,1|2,0,0]=4 27 B11R1.21 CC1=CC(C(=O)O)=NC=C1F F1904-6297 [0,1,0,0,0,1|1,1,0]=4 28 B11R1.21 O=C(O)C1=CC(O)=C(Br)N=C1 F1957-0118 [0,1,0,0,0,1|1,1,0]=4 29 B11R1.166 CC1=CC(F)=CN=C1C(=O)O F1904-6295 [0,1,0,0,0,1|1,1,0]=4 30 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 F1904-6296 [0,1,0,0,0,1|2,0,0]=4 31 B11R1.43 CNC1=NC=C(CC(=O)O)S1 F1913-3636 [0,1,0,0,0,1|2,0,0]=4 32 B11R1.74 O=C(O)C1=CC(Br)=CC(S)=C1 F8885-4537 [0,1,0,0,0,1|1,1,0]=4 33 B11R1.159 CC1=C(S)C(C(=O)O)=CC=C1 F1904-0032 [0,1,0,0,0,1|2,0,0]=4 34 B11R1.167 CC1=NC(C(=O)O)=C(O)C=N1 F2147-2684 [0,1,0,0,0,1|2,0,0]=4 35 B11R1.266 C#CC1=CN=CC(C(=O)O)=C1 F2167-2825 [0,1,0,0,0,1|2,0,0]=4 36 B11R1.266 CNC1=NC(C(=O)O)=NC=C1 F1904-2292 [0,1,0,0,0,1|2,0,0]=4 37 B11R1.266 CNC1=NC=CC(C(=O)O)=N1 F1904-3723 [0,1,0,0,0,1|2,0,0]=4 38 B11R1.266 COC1=NC(C(=O)O)=NC=C1 F1904-5169 [0,1,0,0,0,1|2,0,0]=4 39 B11R1.11 COC(CN)C1=CC=C(Cl)S1 F2148-2119 [0,2,0,0,0,0|1,0,1]=4 40 B11R1.15 CCOC(=O)C1=CC=C(N)S1 F2163-0146 [0,2,0,0,0,0|1,0,0]=3 41 B11R1.175 CC(=O)C1=CC=C(C(F)F)S1 F1913-1748 [0,2,0,0,0,0|1,1,0]=4 42 B11R1.175 NC(=O)C1=CC=C(C(=O)O)S1 F0912-1358 [0,2,0,0,0,0|1,0,0]=3 43 B11R1.175 O=C(Cl)C1=CC=C(C(F)F)S1 F1913-0088 [0,2,0,0,0,0|1,1,0]=4 44 B11R1.175 O=C(Cl)C1=CC=C([N+](=O)[O-])S1 F1908-0048 [0,2,0,0,0,0|1,0,1]=4 45 B11R1.175 O=C(O)C1=NC=C(C(F)F)S1 F1913-6499 [0,2,0,0,0,0|1,1,0]=4 46 B11R1.672 CC1=C(Br)SC(C(=O)O)=C1O F2147-4611 [0,2,0,0,0,0|0,1,0]=3 47 B9R1.6 O=C(O)C1=NC=CC=C1 F0001-1025 [0,0,1,1,0,0|2,0,0]=4 48 B7R1.18 O=C(O)C1=CCC1 F8889-7863 [1,0,0,0,1,0|0,0,2]=4 49 B9R1.13 O=C(O)CC1=CN=CS1 F2100-0037 [1,0,0,0,0,1|1,0,0]=3