0 B11R1.267 CCC1=CC=CC(CC)=C1O BB12-1897 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB01-6537 [1,0,0,0,0,0|3,0,0]=4 2 B10R1.2 CC1=C(C)C(NN)=CC=C1 BB56-2527 [1,0,0,0,0,0|3,0,0]=4 3 B10R1.2 COC1=C(C)C(C)=CC=C1 BB12-4726 [1,0,0,0,0,0|1,0,0]=2 4 B10R1.2 COC1=CC=C[N+]([O-])=C1Br BB12-1810 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.2 O=CC1=CC=CC(F)=C1O BB01-7911 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.172 COC1=CC(NN)=CC=C1 BB01-6124 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.172 COC1=NC(OC)=NC=C1 BB01-7898 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.235 CCC1=CC(Br)=CC(CC)=C1N BB55-5000 [0,1,0,0,0,0|3,0,0]=4 9 B12R1.235 COC1=C(O)C(CO)=CC(Br)=C1 BB53-1955 [0,1,0,0,0,0|2,0,0]=3 10 B12R1.235 COC1=CC(Cl)=CC(C=O)=C1O BB17-1587 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.1879 CCC1=CC=CC(CC)=C1NC BB01-8190 [0,1,0,0,0,0|3,0,0]=4 12 B12R1.1879 CCC1=CC=CC(CC)=C1NN BB56-1064 [0,1,0,0,0,0|3,0,0]=4 13 B12R2.315 COC1=CC=CC2=C1C=CN2 BB01-7869 [0,0,0,1,0,0|2,0,1]=4 14 B9R1.2 C=CC1=CC(O)=CC=C1 BB58-0330 [2,0,0,0,0,0|1,0,1]=4 15 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.2 CNC1=CC(C)=CC=C1 BB01-7304 [2,0,0,0,0,0|1,0,0]=3 17 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.3 CC1=C(N)C(N)=CC=C1 BB12-3003 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.3 CC1=CC=CC(N)=C1O BB55-6937 [2,0,0,0,0,0|1,0,0]=3 21 B9R1.3 NC1=C(O)C(Cl)=CC=C1 BB12-1563 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.15 COC1=C(N)C=NC=C1 BB54-5707 [2,0,0,0,0,0|2,0,0]=4 25 B9R1.15 COC1=CC=CN=C1C BB17-0165 [2,0,0,0,0,0|2,0,0]=4 26 B11R1.8 CC1=CC(Br)=CC(C=O)=C1O BB17-1050 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.8 CC1=CC(Br)=CC(CO)=C1O BB17-1051 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.8 CC1=CC(I)=CC(C=O)=C1O BB17-1054 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.8 CC1=CC(I)=CC(CO)=C1O BB17-1055 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.8 CC1=CC(N)=CC(CO)=C1O BB17-1071 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.8 COC1=C(O)C(Br)=CC(Br)=C1 BB17-1853 [1,1,0,0,0,0|1,0,0]=3 32 B11R1.13 CCOC1=CC=CC(F)=C1Br BB31-2088 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.265 CCC1=CC=CC(C)=C1NN BB56-0058 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.278 COC1=C(C)C(C)=C(N)C=C1 BB57-7105 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.9 COC1=CC(N)=NC(OC)=N1 BB55-7891 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.189 CCNC1=CC=CC(OC)=C1 BB32-1922 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.189 COC1=CC(CNN)=CC=C1 BB55-6524 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.189 COC1=CC=CC(CCN)=C1 BB12-0768 [1,1,0,0,0,0|1,0,0]=3 39 B11R1.266 COC1=CC(C(C)N)=CC=C1 BB05-0763 [1,1,0,0,0,0|1,0,0]=3 40 B11R1.280 COC1=C(C)C=CC(CO)=C1 BB32-2628 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.280 COC1=C(O)C=CC(C#N)=C1 BB05-0505 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.280 COC1=C(O)C=CC(CO)=C1 BB17-0749 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.280 COC1=CC(C=O)=C(F)C=C1 BB01-6273 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.280 COC1=NC(OC)=C(F)C=N1 BB55-7754 [1,1,0,0,0,0|2,0,0]=4 45 B13R1.299 COC1=CC(Br)=CC(C(=O)O)=C1O BB17-1057 [0,2,0,0,0,0|2,0,0]=4 46 B13R1.299 COC1=CC(Cl)=CC(C(=O)O)=C1O BB17-0680 [0,2,0,0,0,0|2,0,0]=4 47 B13R1.302 COC1=CC(Br)=CC(C=O)=C1OC BB17-1632 [0,2,0,0,0,0|2,0,0]=4 48 B13R1.424 COC1=CC(Br)=C(Br)C(C=O)=C1O BB17-0410 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.433 COC1=C(O)C(CCl)=CC(C=O)=C1 BB57-7170 [0,2,0,0,0,0|2,0,0]=4 50 B13R1.3982 CCOC1=CC(Br)=CC(C=O)=C1O BB17-1590 [0,2,0,0,0,0|2,0,0]=4 51 B13R1.3982 CCOC1=CC(Cl)=CC(C=O)=C1O BB17-1593 [0,2,0,0,0,0|2,0,0]=4 52 B13R1.3982 CCOC1=CC(I)=CC(C=O)=C1O BB17-2317 [0,2,0,0,0,0|2,0,0]=4 53 B13R1.3911 CNCC1=CC=CC(OC)=C1OC BB57-7046 [0,2,0,0,0,0|1,0,0]=3 54 B13R1.3911 COC1=CC=CC(CCO)=C1OC BB57-6621 [0,2,0,0,0,0|1,0,0]=3 55 B13R1.3911 COC1=CC=CC(\C=N\O)=C1OC BB20-3239 [0,2,0,0,0,0|2,0,0]=4 56 B13R2.1613 COC1=CC=CC2=C1NCCC2 BB57-7038 [0,1,0,1,0,0|2,0,0]=4 57 B11R1.279 COC1=C(O)C=C(CN)C=C1 BB54-0027 [0,0,0,0,1,1|2,0,0]=4 58 B11R1.279 COC1=CC=C(C#N)C=C1O BB54-1520 [0,0,0,0,1,1|2,0,0]=4