0 B9R1.13 CC(N)CN1C=CC=N1 BB05-2151 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.13 O=C(O)CC1=CC=CS1 BB01-6099 [0,0,0,0,0,0|1,1,0]=2 2 B9R1.13 O=C(O)CC1=CSC=C1 BB01-0976 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.13 O=C(O)CN1C=CC=N1 BB05-3145 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 CNCC1=CC=CO1 BB01-5301 [1,0,0,0,0,0|1,0,0]=2 5 B8R1.8 CNCC1=CC=CS1 BB55-3486 [1,0,0,0,0,0|1,1,0]=3 6 B8R1.8 CNCC1=CSC=C1 BB55-8319 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.8 NCCC1=CC=CS1 BB01-0963 [1,0,0,0,0,0|1,1,1]=4 8 B10R1.27 NNC(=O)CC1=CC=CS1 BB55-1939 [0,1,0,0,0,0|1,1,0]=3 9 B10R1.27 NNC(=O)CN1C=CC=N1 BB57-2118 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.27 O=C(CCl)NC1=NC=CS1 BB01-5548 [0,1,0,0,0,0|2,1,0]=4 11 B10R1.54 CC1=NC(CC(=O)O)=CS1 BB01-3647 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.54 CC1=NN(CC(=O)O)C=C1 BB05-0867 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.54 NC1=NC(CC(=O)O)=CS1 BB01-6022 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.54 O=C(O)CN1C=C(Br)C=N1 BB55-3059 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 BB55-3419 [0,1,0,0,0,0|3,0,0]=4 16 B8R1.7 CC(=O)C1=CSC=C1 BB57-0215 [0,0,0,0,1,0|2,0,0]=3 17 B8R1.7 CC(N)C1=CC=CO1 BB01-4826 [0,0,0,0,1,0|1,0,1]=3 18 B8R1.7 CC(N)C1=CC=CS1 BB01-4334 [0,0,0,0,1,0|1,1,1]=4 19 B8R1.7 NC(=O)C1=CC=CS1 BB01-2734 [0,0,0,0,1,0|1,1,0]=3 20 B8R1.7 O=C(O)C1=CNC=N1 BB57-6654 [0,0,0,0,1,0|3,0,0]=4 21 B8R1.7 O=C(O)C1=COC=C1 BB57-0214 [0,0,0,0,1,0|3,0,0]=4 22 B8R1.7 O=C(O)C1=CSC=C1 BB53-1742 [0,0,0,0,1,0|3,0,0]=4 23 B8R1.7 O=C(O)C1=CSC=N1 BB01-8351 [0,0,0,0,1,0|3,0,0]=4 24 B8R1.7 O=C(O)C1=NNC=C1 BB53-1765 [0,0,0,0,1,0|3,0,0]=4 25 B8R1.7 O=[N+]([O-])C1=CC=CS1 BB17-0786 [0,0,0,0,1,0|2,1,0]=4 26 B10R1.18 CC(=O)NC1=NC=CC=C1 BB20-1257 [0,0,0,0,0,1|2,0,0]=3 27 B10R1.18 CC(=O)OC1=CC=CN=C1 BB57-3384 [0,0,0,0,0,1|2,0,0]=3 28 B10R1.18 NC(=S)CC1=CC=CC=C1 BB57-5511 [0,0,0,0,0,1|2,1,0]=4 29 B10R1.18 O=C(O)CC1=CC=CN=C1 BB01-8322 [0,0,0,0,0,1|2,0,0]=3 30 B10R1.66 CC(N)CCC1=CC=CO1 BB01-4327 [0,0,0,0,0,1|1,0,1]=3 31 B10R1.66 O=C(Cl)\C=C\C1=CC=CO1 BB55-6083 [0,0,0,0,0,1|1,0,1]=3 32 B10R1.66 O=C(Cl)\C=C\C1=CC=CS1 BB55-6084 [0,0,0,0,0,1|1,1,1]=4 33 B10R1.66 O=C(O)CCN1C=CC=C1 BB01-6486 [0,0,0,0,0,1|3,0,0]=4 34 B10R1.66 O=C(O)CCN1C=CC=N1 BB58-3552 [0,0,0,0,0,1|3,0,0]=4 35 B10R1.66 O=C(O)\C=C\C1=CC=CO1 BB55-6068 [0,0,0,0,0,1|1,0,1]=3 36 B10R1.66 O=C(O)\C=C\C1=CC=CS1 BB01-2450 [0,0,0,0,0,1|1,1,1]=4 37 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CO1 BB01-5589 [0,0,0,0,0,1|2,0,1]=4 38 B7R1.1 CCN1C=CC=N1 BB01-5044 [2,0,0,0,0,0|2,0,0]=4 39 B7R1.1 NCC1=CC=CS1 BB01-5532 [2,0,0,0,0,0|1,1,0]=4 40 B7R1.1 O=CC1=CSC=C1 BB01-6172 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.7 CNCC1=CC=C(C)S1 BB55-8316 [1,1,0,0,0,0|1,1,0]=4 42 B9R1.11 CCC(N)C1=CC=CS1 BB01-4366 [1,1,0,0,0,0|0,1,1]=4 43 B9R1.12 O=C=NCC1=CC=CO1 BB57-0294 [1,1,0,0,0,0|0,0,1]=3 44 B9R1.12 O=CNCC1=CC=CO1 BB01-8225 [1,1,0,0,0,0|0,0,0]=2 45 B9R1.12 O=C\C=C\C1=CC=CO1 BB01-6397 [1,1,0,0,0,0|0,0,1]=3 46 B9R1.12 S=C=NCC1=CC=CO1 BB01-4063 [1,1,0,0,0,0|0,1,1]=4 47 B9R1.35 CC(=O)C1=CC=C(Br)S1 BB01-7781 [0,1,0,0,1,0|0,1,0]=3 48 B9R1.35 CC(=O)C1=CC=C(C)O1 BB55-2250 [0,1,0,0,1,0|0,0,0]=2 49 B9R1.35 CC(=O)C1=CC=C(C)S1 BB17-2349 [0,1,0,0,1,0|0,1,0]=3 50 B9R1.35 CC(=O)C1=CC=C(Cl)S1 BB17-2354 [0,1,0,0,1,0|0,1,0]=3 51 B9R1.35 CC1=CC=C(C(=O)Cl)O1 BB58-1944 [0,1,0,0,1,0|1,0,0]=3 52 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB20-1586 [0,1,0,0,1,0|1,1,0]=4 53 B9R1.35 CC1=CC=C(C(=O)O)O1 BB58-0337 [0,1,0,0,1,0|1,0,0]=3 54 B9R1.35 CC1=CC=C(C(=O)O)S1 BB55-0510 [0,1,0,0,1,0|1,1,0]=4 55 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 BB55-5570 [0,1,0,0,1,0|1,1,0]=4 56 B9R1.35 O=C(O)C1=CC=C(Br)S1 BB55-0508 [0,1,0,0,1,0|1,1,0]=4 57 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BB55-0509 [0,1,0,0,1,0|1,1,0]=4 58 B9R1.41 CC1=C(C(=O)O)OC=N1 BB01-8336 [0,1,0,0,1,0|2,0,0]=4 59 B9R1.41 CC1=C(C(=O)O)SC=C1 BB01-0916 [0,1,0,0,1,0|1,1,0]=4 60 B9R1.41 CN1C=CC=C1C(=O)O BB01-1072 [0,1,0,0,1,0|2,0,0]=4 61 B9R1.41 NC1=C(C(=O)[O-])SC=C1 BB58-0066 [0,1,0,0,1,0|1,1,0]=4 62 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 BB01-5900 [0,1,0,0,0,1|2,0,0]=4 63 B11R1.20 CC(=O)NC1=CC=C(N)C=N1 BB20-3082 [0,1,0,0,0,1|2,0,0]=4 64 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 BB01-6131 [0,1,0,0,0,1|2,0,0]=4 65 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 BB01-4680 [0,1,0,0,0,1|2,0,0]=4 66 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 BB01-6305 [0,1,0,0,0,1|2,0,0]=4 67 B11R1.40 CCC(=O)CC1=CC=CC=C1 BB57-4116 [0,1,0,0,0,1|1,0,0]=3 68 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BB01-5922 [0,1,0,0,0,1|1,0,1]=4 69 B11R1.40 NCC(=O)NC1=CC=CC=C1 BB58-5120 [0,1,0,0,0,1|2,0,0]=4 70 B11R1.40 NNC(=O)CC1=CC=CC=C1 BB01-5971 [0,1,0,0,0,1|2,0,0]=4 71 B11R1.40 O=C(CCl)NC1=CC=CC=C1 BB12-3619 [0,1,0,0,0,1|2,0,0]=4 72 B11R1.40 O=C(CCl)NC1=CC=CN=C1 BB20-1606 [0,1,0,0,0,1|2,0,0]=4 73 B11R1.40 O=C(CCl)NC1=NC=CC=C1 BB52-2356 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.86 CC(=O)NC1=CC=CC=C1O BB17-0735 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.86 CC(=O)NC1=NC=CC=C1O BB20-6648 [0,1,0,0,0,1|2,0,0]=4 76 B11R1.86 CC1=C(CC(=O)Cl)C=CC=C1 BB58-4047 [0,1,0,0,0,1|2,0,0]=4 77 B11R1.86 NC(=O)CC1=CC=CC=C1O BB57-7069 [0,1,0,0,0,1|2,0,0]=4 78 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 BB20-1588 [0,1,0,0,0,1|2,0,0]=4 79 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 BB01-6130 [0,1,0,0,0,1|2,0,0]=4 80 B11R1.86 O=C(O)CC1=CC=CC=C1Cl BB01-6128 [0,1,0,0,0,1|2,0,0]=4 81 B11R1.86 O=C(O)CC1=CC=CC=C1F BB01-6129 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 BB55-6190 [0,1,0,0,0,1|1,0,0]=3 83 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 BB20-0245 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.157 CC(=O)NC1=CC(Cl)=CC=C1 BB20-0244 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.157 CC(=O)NC1=CC=CC(C)=N1 BB58-5319 [0,1,0,0,0,1|2,0,0]=4 86 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 BB57-6667 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.157 O=C(Cl)CC1=CC(F)=CC=C1 BB20-1584 [0,1,0,0,0,1|2,0,0]=4 88 B11R1.157 O=C(Cl)CC1=CC=CC(O)=C1 BB58-5014 [0,1,0,0,0,1|2,0,0]=4 89 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 BB01-6066 [0,1,0,0,0,1|2,0,0]=4 90 B11R1.25 CNC(C)CCC1=CC=CO1 BB01-4354 [0,1,0,0,0,1|1,0,1]=4 91 B11R1.25 O=C(CCl)NCC1=CC=CO1 BB01-5135 [0,1,0,0,0,1|0,0,0]=2 92 B11R1.25 O=C(CCl)NCC1=CC=CS1 BB01-5542 [0,1,0,0,0,1|0,1,0]=3 93 B11R1.75 CC1=CC=C(\C=C\C(=O)Cl)O1 BB55-6096 [0,1,0,0,0,1|1,0,1]=4 94 B11R1.75 CC1=CC=C(\C=C\C(=O)O)O1 BB20-6607 [0,1,0,0,0,1|1,0,1]=4 95 B11R1.75 O=C(O)CCC1=CC(Br)=NO1 BB55-7299 [0,1,0,0,0,1|2,0,0]=4 96 B11R1.75 O=C(O)CCC1=CC(Cl)=NO1 BB01-4355 [0,1,0,0,0,1|2,0,0]=4 97 B11R1.75 O=C(O)\C=C\C1=CC=C(I)O1 BB17-2841 [0,1,0,0,0,1|1,0,1]=4 98 B11R1.77 NC(CC(=O)O)C1=CC=CO1 BB01-4001 [0,1,0,0,0,1|1,0,0]=3 99 B11R1.510 CC(C)(C)NCC1=CC=CO1 BB01-5427 [0,1,0,0,0,1|1,0,1]=4 100 B11R1.30 CCOC(=O)CC1=CC=CS1 BB01-7823 [0,2,0,0,0,0|0,1,0]=3 101 B11R1.30 CCOC(=O)CN1C=CC=N1 BB55-7404 [0,2,0,0,0,0|2,0,0]=4 102 B11R1.228 CN1C=CC=C1CC(=O)NN BB55-1934 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.43 C(=O)C1=CC=C(NC(C)=O)S1 BB01-8251 [0,2,0,0,0,0|1,1,0]=4 104 B11R1.80 CC(=O)NC1=CC(C)=C(C)S1 BB01-6336 [0,2,0,0,0,0|1,1,0]=4 105 B11R2.10 O=C1CC2=C(C=CC=C2)C1 BB01-8363 [0,0,0,1,0,1|1,0,0]=3 106 B9R1.8 CNCC1=CC=CN=C1 BB01-7899 [1,0,0,0,0,1|2,0,0]=4 107 B9R1.8 O=CCC1=CC=CC=C1 BB01-5910 [1,0,0,0,0,1|1,0,0]=3 108 B11R1.91 C=C(C)COC1=CC=CC=C1 BB58-4833 [0,0,0,0,0,2|2,0,0]=4 109 B11R1.91 O=C(Cl)CSC1=CC=CC=C1 BB20-1581 [0,0,0,0,0,2|2,0,0]=4 110 B11R1.91 O=C(O)CCC1=CC=CN=C1 BB20-1516 [0,0,0,0,0,2|2,0,0]=4 111 B11R1.91 O=C(O)CSC1=CC=NC=C1 BB01-8280 [0,0,0,0,0,2|2,0,0]=4 112 B11R1.172 NC(=O)NCCC1=CC=CS1 BB57-5469 [0,0,0,0,0,2|1,1,0]=4