0 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.66 CC(N)CCC1=CC=CO1 BB05-2102 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.66 NC(=O)NCC1=CC=CO1 BB01-7602 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.66 O=C(O)CCC1=CC=NO1 BB54-1995 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 BB01-2590 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.12 CCNCC1=CC=CO1 BB01-4781 [1,0,0,0,0,0|1,0,2]=4 6 B11R1.25 NCC(=O)NCC1=CC=CO1 BB53-1842 [0,1,0,0,0,0|1,0,1]=3 7 B11R1.35 C\C(=C\C1=CC=CO1)[N+](=O)[O-] BB57-4623 [0,1,0,0,0,0|2,0,0]=3 8 B11R1.75 CC1=CC=C(\C=C\[N+](=O)[O-])O1 BB58-3354 [0,1,0,0,0,0|2,0,0]=3 9 B11R1.75 NC(=O)\C=C\C1=CC=C(Br)S1 BB17-2532 [0,1,0,0,0,0|1,1,0]=3 10 B11R1.75 O=C(O)\C=C\C1=CC=C(Br)S1 BB17-2524 [0,1,0,0,0,0|1,1,0]=3 11 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 BB54-4313 [0,1,0,0,0,0|0,1,1]=3 12 B11R1.90 CN1N=CC=C1\C=C\C(=O)O BB05-3478 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.510 CS(=O)(=O)NCC1=CC=CO1 BB17-1504 [0,1,0,0,0,0|2,0,1]=4 14 B11R2.36 CC1=CC2=C(C=CN2)C=C1 BB01-7867 [0,0,0,1,0,0|3,0,0]=4 15 B11R2.36 CC1=CC=C2N=CNC2=C1 BB12-4747 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,0,0,0,1,0|0,1,1]=3 17 B9R1.13 CC(=O)CN1C=CC=N1 BB54-2703 [0,0,0,0,1,0|2,0,1]=4 18 B9R1.13 CC(N)CC1=CC=CO1 BB01-4437 [0,0,0,0,1,0|1,0,2]=4 19 B9R1.13 CC(N)CC1=CC=CO1 BB05-3274 [0,0,0,0,1,0|1,0,2]=4 20 B9R1.13 O=C(O)CC1=CC=CN1 BB58-0483 [0,0,0,0,1,0|2,0,1]=4 21 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [0,0,0,0,0,1|2,0,1]=4 22 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 BB57-7143 [0,0,0,0,0,1|2,0,0]=3 23 B10R1.16 CC1=CC=C(\C=C\C=O)O1 BB17-2261 [1,1,0,0,0,0|0,0,0]=2 24 B10R1.27 CCC(=O)CC1=CC=CO1 BB54-3617 [1,1,0,0,0,0|0,0,2]=4 25 B10R1.27 C\C(C=O)=C/C1=CC=CO1 BB17-1881 [1,1,0,0,0,0|0,0,0]=2 26 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 BB17-2516 [0,1,0,0,0,1|2,0,0]=4 27 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [0,1,0,0,0,1|1,0,1]=4 28 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1289 [0,1,0,0,0,1|2,0,0]=4 29 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 BB54-4987 [0,1,0,0,0,1|2,0,0]=4 30 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 BB55-3550 [0,1,0,0,0,1|2,0,0]=4 31 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BB17-0708 [0,1,0,0,0,1|2,0,0]=4 32 B12R1.226 O=C(O)\C=C\C1=CC(I)=CC=C1 BB56-2320 [0,1,0,0,0,1|2,0,0]=4 33 B12R1.54 CN(C)\C=N\C(=O)C1=CC=CO1 BB57-4245 [0,1,0,0,0,1|2,0,0]=4 34 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 BB54-4290 [0,1,0,0,0,1|1,0,1]=4 35 B12R1.15 COC(=O)CC(=O)C1=CC=CS1 BB57-3597 [0,2,0,0,0,0|0,1,1]=4 36 B12R1.51 CCOC(=O)\C=C\C1=CC=CO1 BB54-0050 [0,2,0,0,0,0|0,0,0]=2 37 B10R1.10 CC1=CC(\C=N\O)=CC=C1 BB20-3238 [0,0,1,1,0,0|2,0,0]=4 38 B10R1.10 CC1=CC=CC(\C=N\O)=N1 BB57-4721 [0,0,1,1,0,0|2,0,0]=4 39 B10R1.18 CC(=O)CC1=NC=CC=C1 BB55-8084 [0,0,1,1,0,0|1,0,1]=4 40 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [0,0,1,1,0,0|2,0,0]=4 41 B10R1.61 NC(=O)C1=CC=CC=C1O BB01-7441 [0,0,1,1,0,0|1,0,0]=3 42 B10R1.113 CC(N)C1=CC=CC(O)=C1 BB57-2921 [0,0,1,1,0,0|1,0,1]=4 43 B10R1.113 O=C(O)C1=CC(O)=CN=C1 BB01-2808 [0,0,1,1,0,0|2,0,0]=4 44 B12R2.24 O=C1C=CC2=C(C=NC=C2)N1 BB32-2378 [0,0,0,1,0,1|2,0,0]=4 45 B12R2.24 O=C1C=CC2=CN=CC=C2N1 BB57-7205 [0,0,0,1,0,1|2,0,0]=4 46 B12R2.6 NC1=NC(C2=CC=CO2)=CS1 BB56-1222 [0,0,0,1,0,1|2,0,0]=4 47 B12R2.6 O=C1CC(C2=CC=CS2)=NN1 BB58-3331 [0,0,0,1,0,1|1,1,0]=4 48 B12R2.6 O=C1NC=C(C2=CC=CS2)N1 BB58-5096 [0,0,0,1,0,1|1,1,0]=4 49 B12R2.44 NCC1=CC2=C(C=C1)NC=C2 BB53-1611 [0,1,0,1,0,0|2,0,0]=4 50 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 BB55-6203 [0,1,0,1,0,0|1,1,0]=4 51 B12R2.252 O=C(O)C1=CC2=C(C=CO2)N1 BB56-1783 [0,1,0,1,0,0|1,0,0]=3 52 B12R2.252 O=C(O)C1=CC2=C(C=CS2)N1 BB01-2518 [0,1,0,1,0,0|1,1,0]=4 53 B12R2.606 CC1=CC2=C(C=C1)OC(S)=N2 BB55-6684 [0,1,0,1,0,0|2,0,0]=4 54 B12R2.606 CC1=CC2=CC(N)=CC=C2O1 BB12-1929 [0,1,0,1,0,0|1,0,1]=4 55 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [0,1,0,1,0,0|2,0,0]=4 56 B12R2.606 CC1=CC=C2OC(Cl)=NC2=C1 BB58-0200 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.606 CC1=CC=C2OC(N)=NC2=C1 BB57-5828 [0,1,0,1,0,0|2,0,0]=4 58 B12R2.606 CC1=CC=C2OC(S)=NC2=N1 BB12-1580 [0,1,0,1,0,0|2,0,0]=4 59 B8R1.7 CC(=O)C1=NC=CN1 BB58-3749 [0,0,0,0,2,0|2,0,0]=4