0 B10R1.18 CC(=O)CC1=CN=CC=C1 BB32-2986 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 CC(C)CC1=NC=CC=C1 BB31-5691 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.18 CC(C)NC1=CC=CN=N1 BB32-0176 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 N=C(N)CC1=NC=CC=C1 BB52-5801 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.18 O=C(O)CC1=NC=CN=C1 BB31-2541 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.8 CCNC1=NC=CC=C1 BB31-5587 [1,0,0,0,0,0|1,0,0]=2 6 B9R1.8 CNCC1=CC=NC=C1 BB52-3970 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.8 N#CCC1=CC=CN=N1 BB20-2554 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.8 N#CCC1=NC=CN=C1 BB32-2625 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.8 NNCC1=NC=CC=C1 BB32-1215 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 BB32-3681 [0,1,0,0,0,0|2,0,1]=4 11 B11R1.20 CC(C)CC1=CC=C(N)C=C1 BB32-1078 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.20 CC(C)CC1=NNC(N)=NN1 BB52-7897 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.20 CC(C)CC1=NNC(S)=NN1 BB52-7872 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.20 CC(C)NC1=CC=C(Cl)N=N1 BB52-5739 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 BB31-9408 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.20 CC(C)OC1=NC=C(N)C=C1 BB32-2377 [0,1,0,0,0,0|1,0,0]=2 17 B11R1.20 CC(C)OC1=NN=C(Cl)C=C1 BB52-5755 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.20 CC(C)SC1=CC=C(Cl)C=C1 BB31-6923 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 BB31-9657 [0,1,0,0,0,0|2,0,1]=4 20 B11R1.20 NC1=CN=C(OC(F)F)C=C1 BB32-2040 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 BB31-0029 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 BB31-0032 [0,1,0,0,0,0|2,0,1]=4 23 B11R1.36 C=C(C1=CC=CC=C1)C(C)C BB31-3442 [0,1,0,0,0,0|1,0,1]=3 24 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 BB32-1369 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.36 CC(C)C(C)C1=CC=CC=C1 BB31-5345 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 BB31-5054 [0,1,0,0,0,0|1,0,0]=2 27 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 BB31-7042 [0,1,0,0,0,0|1,0,0]=2 28 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 BB31-5646 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.40 CC(C#N)NC1=CC=CC=C1 BB32-1220 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.40 NCC(=O)CC1=CC=CC=C1 BB31-4674 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.40 NCC(O)CC1=CC=CC=C1 BB32-2349 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.86 CC(C)CC1=C(N)C=CC=C1 BB31-7006 [0,1,0,0,0,0|1,0,0]=2 33 B11R1.86 CC(C)NC1=NC=CC=C1N BB31-8117 [0,1,0,0,0,0|1,0,0]=2 34 B11R1.86 CC(C)OC1=C(Cl)C=CC=N1 BB32-1109 [0,1,0,0,0,0|1,0,0]=2 35 B11R1.86 CC(C)OC1=C(I)C=CC=N1 BB31-5799 [0,1,0,0,0,0|1,0,0]=2 36 B11R1.86 O=C(O)CC1=C(Cl)C=CC=N1 BB31-5786 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.86 O=C(O)CC1=C(F)C=CC=N1 BB31-0028 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 BB31-0336 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.157 CC(=O)NC1=NC=CC(I)=C1 BB31-6635 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 BB31-5028 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 BB32-1278 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.157 CC(C)NC1=CC=CC(F)=C1 BB31-8175 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.157 CC1=CC=CC(NC(C)C)=C1 BB31-0290 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.157 FC(F)OC1=CC=CC(Cl)=N1 BB31-2161 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 BB31-6394 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 BB31-0031 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.509 CS(=N)(=O)CC1=CC=CC=C1 BB31-7855 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.509 CS(=O)(=O)NC1=NC=CC=C1 BB31-1369 [0,1,0,0,0,0|3,0,0]=4 49 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 BB31-4761 [0,0,0,1,0,0|2,0,0]=3 50 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 BB31-5270 [0,0,0,1,0,0|2,0,0]=3 51 B11R2.10 BrC1CC2=C(C=CC=C2)C1 BB31-3617 [0,0,0,1,0,0|2,0,0]=3 52 B11R2.10 CC1CC2=C(C=CC=C2)C1 BB31-4827 [0,0,0,1,0,0|1,0,0]=2 53 B11R2.10 O=C1CC2=C(C=CC=N2)N1 BB31-4947 [0,0,0,1,0,0|2,0,1]=4 54 B9R1.6 CC(=O)C1=NC=NC=C1 BB32-1309 [0,0,0,0,1,0|2,0,1]=4 55 B9R1.6 CC(=O)C1=NN=CC=C1 BB31-8246 [0,0,0,0,1,0|2,0,1]=4 56 B9R1.6 CC(N)C1=NC=CC=N1 BB31-3285 [0,0,0,0,1,0|2,0,0]=3 57 B9R1.6 CN(C)C1=NC=NC=C1 BB32-2121 [0,0,0,0,1,0|2,0,0]=3 58 B9R1.6 C[C@@H](N)C1=CC=NC=C1 BB31-0181 [0,0,0,0,1,0|3,0,0]=4 59 B9R1.6 C[C@@H](N)C1=NC=CC=C1 BB31-9751 [0,0,0,0,1,0|1,0,0]=2 60 B9R1.13 CC(N)CC1=NC=CS1 BB57-1486 [0,0,0,0,1,0|2,0,0]=3 61 B9R1.13 CN(C)C=C1C=CC=C1 BB31-7355 [0,0,0,0,1,0|1,0,1]=3 62 B11R1.91 CC(C)NCC1=CC=CN=C1 BB31-3857 [0,0,0,0,0,1|2,0,0]=3 63 B11R1.91 O=C(O)CCC1=NC=CC=C1 BB52-8590 [0,0,0,0,0,1|2,0,1]=4 64 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB52-3334 [0,0,0,0,0,1|2,0,1]=4 65 B8R1.2 BrCC1=NN=CC=C1 BB31-2836 [2,0,0,0,0,0|2,0,0]=4 66 B8R1.2 COC1=NC=CC=N1 BB31-5696 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.2 NNC1=NC=CC=C1 BB52-0908 [2,0,0,0,0,0|2,0,0]=4 68 B8R1.2 OCC1=NC=NC=C1 BB32-1282 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.1 CC1=CN=C(CC#N)C=C1 BB32-2135 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.1 CCOC1=NC=C(F)C=C1 BB31-8599 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.1 CCOC1=NC=C(N)C=N1 BB31-7243 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.1 CCOC1=NN=C(Cl)C=C1 BB52-5754 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.1 CSCC1=CC=C(F)C=C1 BB32-3225 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.1 OCCC1=NC=C(Br)C=C1 BB31-8160 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.4 CCNC1=C(O)C=CC=C1 BB31-4887 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.4 CNCC1=C(O)C=CC=C1 BB31-5689 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.4 N#CCC1=C(Cl)C=CC=N1 BB32-0418 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.4 OCCC1=C(I)C=CC=C1 BB31-4375 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.10 CCCC1=CC=CC(Br)=C1 BB31-3877 [1,1,0,0,0,0|1,0,0]=3 80 B10R1.10 CCCC1=CC=CC(F)=C1 BB31-4486 [1,1,0,0,0,0|1,0,0]=3 81 B10R1.10 CCOC1=CC=CC(S)=C1 BB31-5788 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.10 CCOC1=CC=NC(Cl)=N1 BB31-4811 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.10 CCOC1=NC=CC(Br)=C1 BB32-3242 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.10 COCC1=CC(Cl)=NC=N1 BB32-1441 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.10 COCC1=CC=NC(Cl)=N1 BB31-1861 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.10 COCC1=NC(N)=CC=N1 BB31-5890 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.10 N#CCC1=CC=CC(Br)=N1 BB31-8916 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.10 N#CCC1=NC=CC(Br)=C1 BB32-1067 [1,1,0,0,0,0|1,0,1]=4 89 B10R1.15 C=C(CC)C1=CC=CC=C1 BB31-3793 [1,1,0,0,0,0|1,0,1]=4 90 B10R1.15 CCC(=O)C1=NC=CN=C1 BB32-2771 [1,1,0,0,0,0|1,0,1]=4 91 B10R1.15 CCC(N)C1=CC=CN=C1 BB31-0914 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.15 C[C@@H](CO)C1=CC=CC=C1 BB31-4000 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.15 C[C@H](CO)C1=CC=CC=C1 BB31-5425 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.15 NC(CO)C1=NC=CC=C1 BB31-5647 [1,1,0,0,0,0|1,0,0]=3 95 B10R1.17 CCCCC1=CC=CN=C1 BB31-4701 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.17 ClCCSC1=NC=CC=C1 BB52-9581 [1,1,0,0,0,0|1,0,0]=3 97 B10R1.17 NCCCC1=CC=CN=C1 BB31-5719 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.17 NCCNC1=NC=CC=C1 BB52-8028 [1,1,0,0,0,0|1,0,0]=3 99 B10R1.17 NCCOC1=NC=CC=C1 BB31-4550 [1,1,0,0,0,0|1,0,0]=3 100 B10R1.17 NCCSC1=NC=CC=C1 BB52-8924 [1,1,0,0,0,0|1,0,0]=3 101 B10R1.17 OCCSC1=NC=CC=C1 BB52-9072 [1,1,0,0,0,0|1,0,0]=3 102 B10R1.17 OC\C=C\C1=NC=CC=C1 BB31-1899 [1,1,0,0,0,0|0,0,2]=4 103 B10R1.13 CC(=O)C1=NC=C(O)C=C1 BB32-3774 [0,1,0,0,1,0|1,0,1]=4 104 B10R1.13 CC(C)C1=CC=C(N)N=N1 BB32-3140 [0,1,0,0,1,0|1,0,0]=3 105 B10R1.13 CC(C)C1=NC=C(Br)C=C1 BB31-0706 [0,1,0,0,1,0|0,0,0]=2 106 B10R1.13 CC(C)C1=NN=C(Br)C=C1 BB31-9165 [0,1,0,0,1,0|1,0,0]=3 107 B10R1.13 CC(C)C1=NN=C(Br)C=C1 BB31-9854 [0,1,0,0,1,0|1,0,0]=3 108 B10R1.13 CN(C)C1=CC=C(I)C=C1 BB12-5133 [0,1,0,0,1,0|2,0,0]=4 109 B10R1.13 CN(C)C1=NC=C(I)C=C1 BB32-1805 [0,1,0,0,1,0|1,0,0]=3 110 B10R1.13 CN(C)C1=NC=C(N)C=C1 BB32-2424 [0,1,0,0,1,0|1,0,0]=3 111 B10R1.13 CN(C)C1=NC=C(N)C=N1 BB32-3323 [0,1,0,0,1,0|2,0,0]=4 112 B10R1.13 CN(C)C1=NN=C(Br)C=C1 BB31-2883 [0,1,0,0,1,0|2,0,0]=4 113 B10R1.13 CN(C)C1=NN=C(Cl)C=C1 BB52-0912 [0,1,0,0,1,0|2,0,0]=4 114 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 BB31-0481 [0,1,0,0,1,0|2,0,0]=4 115 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-1090 [0,1,0,0,1,0|2,0,0]=4 116 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-2900 [0,1,0,0,1,0|2,0,0]=4 117 B10R1.28 CC(C)(N)C1=CC=CN=C1 BB31-5567 [0,1,0,0,1,0|2,0,0]=4 118 B10R1.28 CC(C)(N)C1=CC=NC=C1 BB31-5575 [0,1,0,0,1,0|2,0,0]=4 119 B10R1.28 CC(C)(N)C1=NC=CC=C1 BB32-2362 [0,1,0,0,1,0|0,0,0]=2 120 B10R1.28 CC(C)(O)C1=NC=CC=C1 BB32-1616 [0,1,0,0,1,0|0,0,0]=2 121 B10R1.61 CC(C)C1=C(O)C=CC=N1 BB31-4057 [0,1,0,0,1,0|0,0,0]=2 122 B10R1.61 CC(N)C1=C(Br)C=CC=C1 BB31-0378 [0,1,0,0,1,0|2,0,0]=4 123 B10R1.61 CC(O)C1=C(F)C=CC=N1 BB31-5459 [0,1,0,0,1,0|1,0,0]=3 124 B10R1.61 CN(C)C1=C(Br)C=CC=N1 BB31-9343 [0,1,0,0,1,0|1,0,0]=3 125 B10R1.61 CN(C)C1=C(F)C=CC=C1 BB32-1594 [0,1,0,0,1,0|2,0,0]=4 126 B10R1.61 C[C@@H](N)C1=C(Cl)C=CC=C1 BB31-0478 [0,1,0,0,1,0|2,0,0]=4 127 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-0488 [0,1,0,0,1,0|2,0,0]=4 128 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 BB31-7807 [0,1,0,0,1,0|2,0,0]=4 129 B10R1.61 C[C@@H](N)C1=C(O)C=CC=C1 BB31-1004 [0,1,0,0,1,0|2,0,0]=4 130 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 BB31-2127 [0,1,0,0,1,0|2,0,0]=4 131 B10R1.61 C[C@H](N)C1=C(O)C=CC=C1 BB31-8099 [0,1,0,0,1,0|2,0,0]=4 132 B10R1.61 FC(F)C1=C(Br)C=CC=N1 BB31-9330 [0,1,0,0,1,0|2,0,0]=4 133 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 BB32-0630 [0,1,0,0,1,0|1,0,1]=4 134 B10R1.113 CC(=O)C1=CC=CC(F)=N1 BB31-7596 [0,1,0,0,1,0|1,0,1]=4 135 B10R1.113 CC(=O)C1=NC(N)=CC=C1 BB31-9363 [0,1,0,0,1,0|1,0,1]=4 136 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 BB31-8955 [0,1,0,0,1,0|1,0,1]=4 137 B10R1.113 CC(C)C1=CN=CC(N)=C1 BB31-1267 [0,1,0,0,1,0|2,0,0]=4 138 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 BB31-7554 [0,1,0,0,1,0|0,0,0]=2 139 B10R1.113 CC(C)C1=NC=CC(Cl)=N1 BB31-7204 [0,1,0,0,1,0|1,0,0]=3 140 B10R1.113 CC(C)C1=NC=CC(N)=C1 BB32-2144 [0,1,0,0,1,0|0,0,0]=2 141 B10R1.113 CC(O)C1=CC=CC(Br)=N1 BB31-9694 [0,1,0,0,1,0|1,0,0]=3 142 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 BB31-0480 [0,1,0,0,1,0|2,0,0]=4 143 B10R1.113 CC1=CC=CC([C@@H](C)O)=C1 BB32-1902 [0,1,0,0,1,0|2,0,0]=4 144 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 BB32-2691 [0,1,0,0,1,0|2,0,0]=4 145 B10R1.113 CN(C)C1=CC=CC(Br)=N1 BB31-8405 [0,1,0,0,1,0|1,0,0]=3 146 B10R1.113 CN(C)C1=CC=CC(F)=C1 BB31-4166 [0,1,0,0,1,0|2,0,0]=4 147 B10R1.113 CN(C)C1=NC(=N)C=CN1 BB31-9904 [0,1,0,0,1,0|2,0,0]=4 148 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 BB32-0142 [0,1,0,0,1,0|2,0,0]=4 149 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 BB31-7991 [0,1,0,0,1,0|2,0,0]=4 150 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 BB31-5432 [0,1,0,0,1,0|2,0,0]=4 151 B10R1.113 FC(F)C1=CC=CC(Cl)=N1 BB31-0333 [0,1,0,0,1,0|2,0,0]=4 152 B10R1.113 NC1=CC(C(F)F)=NC=C1 BB31-4066 [0,1,0,0,1,0|2,0,0]=4 153 B10R1.27 CC(CO)CN1C=CC=N1 BB52-8662 [0,1,0,0,1,0|1,0,0]=3 154 B10R1.54 CC(C)CC1=NN=C(N)O1 BB52-9000 [0,1,0,0,1,0|2,0,0]=4 155 B10R1.54 CC(C)CC1=NN=C(N)S1 BB52-0937 [0,1,0,0,1,0|2,0,0]=4 156 B10R1.64 CC(C)CN1N=CC=C1N BB05-2490 [0,1,0,0,1,0|1,0,0]=3 157 B12R1.21 CC(C)CNC1=CC=C(Cl)N=N1 BB52-5740 [0,1,0,0,0,1|1,0,0]=3 158 B12R1.21 CN(C)\C=N\C1=NC=C(Br)C=C1 BB31-2421 [0,1,0,0,0,1|1,0,1]=4 159 B12R1.21 NC1=CN=C(OCC(F)F)C=C1 BB05-4266 [0,1,0,0,0,1|2,0,0]=4 160 B12R1.27 COC(=O)CCC1=NC=CC=C1 BB31-4510 [0,1,0,0,0,1|1,0,1]=4 161 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 BB32-1672 [0,1,0,0,0,1|1,0,0]=3 162 B12R1.27 O=C(CBr)NCC1=NC=CC=C1 BB53-1125 [0,1,0,0,0,1|1,0,1]=4 163 B12R1.107 CC(C)C[C@H](N)C1=CC=CC=C1 BB31-1753 [0,1,0,0,0,1|1,0,0]=3 164 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 BB31-9902 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.4 CC(C)OC1=CC=C(NN)C=C1 BB31-8459 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.4 CC(C)SC1=NC=C(C=O)C=N1 BB52-2738 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 BB31-8211 [0,2,0,0,0,0|1,0,1]=4 168 B12R1.20 CC(C)C(=O)C1=CC=C(O)C=C1 BB32-2115 [0,2,0,0,0,0|1,0,1]=4 169 B12R1.20 CC(C)[C@@H](N)C1=CC=C(F)C=C1 BB31-9782 [0,2,0,0,0,0|1,0,0]=3 170 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 BB32-0150 [0,2,0,0,0,0|1,0,0]=3 171 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 BB31-9783 [0,2,0,0,0,0|1,0,0]=3 172 B12R1.20 CC1=CC=C([C@@H](N)C(C)C)C=C1 BB32-0151 [0,2,0,0,0,0|1,0,0]=3 173 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 BB31-6128 [0,2,0,0,0,0|2,0,0]=4 174 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 BB31-6129 [0,2,0,0,0,0|2,0,0]=4 175 B12R1.106 CC(C)(C)OC1=NC=C(Br)C=C1 BB32-3926 [0,2,0,0,0,0|1,0,0]=3 176 B12R1.106 CC(C)(O)CC1=CC=C(Br)C=C1 BB32-3514 [0,2,0,0,0,0|1,0,0]=3 177 B12R1.233 CN(C)CC1=C(F)C=C(Br)C=C1 BB31-9341 [0,2,0,0,0,0|2,0,0]=4 178 B12R1.34 CON(C)C(=O)C1=NC=CC=C1 BB31-2847 [0,2,0,0,0,0|1,0,1]=4 179 B12R1.225 CC(C)[C@@H](N)C1=CC=CC(Cl)=C1 BB31-9733 [0,2,0,0,0,0|1,0,0]=3 180 B12R1.478 CC(C)[C@H](CN)C1=CC=CC=C1 BB31-4663 [0,2,0,0,0,0|1,0,0]=3 181 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 BB32-3592 [0,2,0,0,0,0|2,0,0]=4 182 B12R1.371 COC(=O)CC1=C(Br)C=CC=N1 BB31-4026 [0,2,0,0,0,0|1,0,1]=4 183 B12R1.75 C=CC1=C(OC(C)C)C=CC=C1 BB31-7090 [0,2,0,0,0,0|2,0,0]=4 184 B12R1.75 CC(C)OC1=C(C#N)C=CC=N1 BB52-5988 [0,2,0,0,0,0|1,0,0]=3 185 B12R1.75 CC(C)OC1=C(CN)C=CC=C1 BB31-5356 [0,2,0,0,0,0|2,0,0]=4 186 B12R1.127 CC(C)NC1=C(N)C=CC(Br)=C1 BB31-9307 [0,2,0,0,0,0|2,0,0]=4 187 B12R1.151 CC(C)(O)CC1=C(Cl)C=CC=C1 BB32-3575 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.101 CC(C)CC1=NC(Cl)=CC(Cl)=N1 BB31-9055 [0,2,0,0,0,0|1,0,0]=3 189 B12R1.101 CC(C)OC1=NC(N)=CC(=O)N1 BB52-6374 [0,2,0,0,0,0|2,0,0]=4 190 B12R1.101 CC(C)SC1=NC(N)=CC(=O)N1 BB52-2918 [0,2,0,0,0,0|2,0,0]=4 191 B10R2.7 C1=CN=C2CCNC2=C1 BB31-9759 [1,0,0,1,0,0|1,0,0]=3 192 B10R2.7 C1=CN=C2CCNC2=C1 BB32-0564 [1,0,0,1,0,0|1,0,0]=3 193 B10R2.7 C1=NC=C2CNCC2=N1 BB31-3008 [1,0,0,1,0,0|2,0,0]=4 194 B12R2.22 N[C@H]1C[C@H](C2=CC=CC=C2)C1 BB31-3001 [0,0,0,1,0,1|2,0,0]=4 195 B12R2.24 CC1CNC2=C(C=CC=C2)C1 BB31-4086 [0,0,0,1,0,1|1,0,0]=3 196 B12R2.24 CC1CNC2=C(C=CC=C2)N1 BB32-3882 [0,0,0,1,0,1|2,0,0]=4 197 B12R2.24 CC1CNC2=C(C=CC=C2)S1 BB32-3335 [0,0,0,1,0,1|2,0,0]=4 198 B12R2.24 CC1COC2=C(C=CC=C2)N1 BB32-1397 [0,0,0,1,0,1|2,0,0]=4 199 B12R2.24 CN1CCC2=C(C=CC=C2)C1 BB32-2641 [0,0,0,1,0,1|2,0,0]=4 200 B12R2.24 NC1CNC2=C(C=CC=C2)C1 BB32-1614 [0,0,0,1,0,1|2,0,0]=4 201 B12R2.24 NC1COC2=C(C=CC=C2)C1 BB31-4949 [0,0,0,1,0,1|2,0,0]=4 202 B12R2.24 OC1CNC2=C(C=CC=C2)C1 BB32-1531 [0,0,0,1,0,1|2,0,0]=4 203 B12R2.2057 C1=CN=C(CNC2CC2)C=C1 BB52-8660 [0,0,0,1,0,1|0,0,0]=2 204 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 BB31-9844 [0,1,0,1,0,0|2,0,0]=4 205 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 BB31-3897 [0,1,0,1,0,0|2,0,0]=4 206 B12R2.294 BrC1=CC=C(OC2CC2)C=C1 BB32-1305 [0,1,0,1,0,0|2,0,0]=4 207 B12R2.294 ClC1=CC=C(NC2CC2)N=N1 BB52-5736 [0,1,0,1,0,0|2,0,0]=4 208 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 BB31-6748 [0,1,0,1,0,0|2,0,0]=4 209 B12R2.606 CC1CC2=C(C=CC(N)=C2)O1 BB31-4398 [0,1,0,1,0,0|2,0,0]=4 210 B12R2.18 CC1=C(C)C2=CC=CN=C2N1 BB31-5615 [0,1,0,1,0,0|1,0,1]=4 211 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 BB31-5520 [0,1,0,1,0,0|1,0,0]=3 212 B12R2.2075 N[C@@H](C1=CC=CC=C1)C2CC2 BB31-7748 [0,1,0,1,0,0|1,0,0]=3 213 B12R2.2075 OC(C1=CN=CC=C1)C2CC2 BB31-2948 [0,1,0,1,0,0|2,0,0]=4 214 B12R2.32 C#CC1CC2=C(C=CC=C2)C1 BB32-0346 [0,1,0,1,0,0|1,0,1]=4 215 B12R2.32 O=CC1CC2=C(C=CC=C2)C1 BB32-1577 [0,1,0,1,0,0|1,0,1]=4 216 B12R2.32 OCC1CC2=C(C=CC=C2)C1 BB32-2348 [0,1,0,1,0,0|1,0,0]=3 217 B12R2.32 OC[C@@H]1CC2=C(C=CC=C2)N1 BB31-4454 [0,1,0,1,0,0|2,0,0]=4 218 B12R2.202 CC1CC2=CC=CC(N)=C2O1 BB31-4399 [0,1,0,1,0,0|2,0,0]=4 219 B12R2.225 BrC1=C(OC2CC2)C=CC=C1 BB32-1911 [0,1,0,1,0,0|2,0,0]=4 220 B12R2.1286 ClC1=NC=NC(NC2CC2)=C1 BB31-7546 [0,1,0,1,0,0|2,0,0]=4 221 B8R1.8 BrCCN1C=CC=C1 BB31-5450 [1,0,0,0,1,0|2,0,0]=4 222 B8R1.8 CCCC1=NNC=C1 BB31-7142 [1,0,0,0,1,0|1,0,0]=3 223 B8R1.8 CCNC1=NC=CS1 BB31-9923 [1,0,0,0,1,0|2,0,0]=4 224 B8R1.8 ClCCN1C=CC=N1 BB53-1069 [1,0,0,0,1,0|2,0,0]=4 225 B8R1.8 NCCC1=NC=CS1 BB52-6118 [1,0,0,0,1,0|2,0,0]=4 226 B8R1.8 NCCN1C=CC=N1 BB53-0567 [1,0,0,0,1,0|2,0,0]=4 227 B8R1.8 OCCC1=COC=C1 BB31-4913 [1,0,0,0,1,0|2,0,0]=4 228 B8R1.8 OCCC1=NNC=C1 BB32-1887 [1,0,0,0,1,0|2,0,0]=4 229 B8R1.8 OCCN1C=CC=N1 BB52-9321 [1,0,0,0,1,0|2,0,0]=4 230 B8R1.7 CC(N)C1=CC=CS1 BB32-0760 [0,0,0,0,2,0|2,0,0]=4 231 B8R1.7 CC(N)C1=NC=CS1 BB31-5454 [0,0,0,0,2,0|2,0,0]=4 232 B8R1.7 C[C@@H](O)C1=NC=CS1 BB32-0283 [0,0,0,0,2,0|2,0,0]=4 233 B8R1.7 C[C@H](O)C1=NC=CS1 BB31-9911 [0,0,0,0,2,0|2,0,0]=4