0 B6R1.2 BrC1=CNC=N1 HY-W002226 [0,0,0,0,0,0|2,0,0]=2 1 B6R1.2 BrC1=CNN=C1 HY-78243 [0,0,0,0,0,0|4,0,0]=4 2 B6R1.2 BrC1=CSC=C1 HY-59299 [0,0,0,0,0,0|2,0,0]=2 3 B6R1.2 BrC1=NC=CS1 HY-W001223 [0,0,0,0,0,0|3,0,0]=3 4 B6R1.2 CC1=CC=CS1 HY-W010615 [0,0,0,0,0,0|2,0,0]=2 5 B6R1.2 CC1=CNN=C1 HY-B0876A [0,0,0,0,0,0|3,0,0]=3 6 B6R1.2 CC1=NNC=C1 HY-66054 [0,0,0,0,0,0|2,0,0]=2 7 B6R1.2 CN1C=CN=C1 HY-59137 [0,0,0,0,0,0|3,0,0]=3 8 B6R1.2 IC1=CN=CN1 HY-W002802 [0,0,0,0,0,0|2,0,1]=3 9 B6R1.2 NC1=NC=CN1 HY-W062216 [0,0,0,0,0,0|3,0,0]=3 10 B6R1.2 NC1=NC=CS1 HY-12396 [0,0,0,0,0,0|3,0,0]=3 11 B6R1.2 NC1=NNC=N1 HY-W027592 [0,0,0,0,0,0|3,0,0]=3 12 B6R1.2 NC1=NOC=C1 HY-W007329 [0,0,0,0,0,0|3,0,0]=3 13 B6R1.2 O=C1C=CCC1 HY-W010643 [0,0,0,0,0,0|3,0,1]=4 14 B6R1.2 O=C1C=CCO1 HY-W008270 [0,0,0,0,0,0|3,0,1]=4 15 B6R1.2 O=C1CCSC1 HY-W010594 [0,0,0,0,0,0|2,0,2]=4 16 B6R1.2 SC1=NCCN1 HY-W010593 [0,0,0,0,0,0|3,0,1]=4 17 B5R1.1 C1=CNC=N1 HY-D0837 [1,0,0,0,0,0|1,0,0]=2 18 B5R1.1 C1=CNC=N1 HY-ER010 [1,0,0,0,0,0|1,0,0]=2 19 B5R1.1 C1=CNN=C1 HY-76228 [1,0,0,0,0,0|2,0,0]=3 20 B5R1.1 C1=COC=N1 HY-34631 [1,0,0,0,0,0|0,1,0]=2 21 B5R1.1 C1=CON=C1 HY-W010649 [1,0,0,0,0,0|2,0,0]=3 22 B5R1.1 C1=NC=NN1 HY-Y0219 [1,0,0,0,0,0|2,0,0]=3 23 B5R1.1 C1=NC=NN1 HY-Y0219R [1,0,0,0,0,0|2,0,0]=3 24 B5R1.1 C1=NN=CN1 HY-Y0219A [1,0,0,0,0,0|2,0,0]=3 25 B7R1.1 CCN1C=CC=N1 HY-Z1094 [0,1,0,0,0,0|2,0,0]=3 26 B7R1.1 N#CC1=NC=CS1 HY-W003625 [0,1,0,0,0,0|2,0,1]=4 27 B7R1.1 O=CC1=CC=CS1 HY-W012941 [0,1,0,0,0,0|2,0,1]=4 28 B7R1.1 O=CC1=CN=CS1 HY-69015 [0,1,0,0,0,0|2,0,1]=4 29 B7R1.1 O=CC1=CNC=C1 HY-59307 [0,1,0,0,0,0|2,0,1]=4 30 B7R1.1 O=CC1=CNC=N1 HY-59303 [0,1,0,0,0,0|1,0,1]=3 31 B7R1.1 O=CC1=NC=CN1 HY-W007321 [0,1,0,0,0,0|2,0,1]=4 32 B7R1.1 OCC1=CC=CS1 HY-34751 [0,1,0,0,0,0|2,0,0]=3 33 B7R1.1 OCC1=CN=CS1 HY-W012905 [0,1,0,0,0,0|2,0,0]=3 34 B7R1.1 OCC1=CNN=C1 HY-33914 [0,1,0,0,0,0|3,0,0]=4 35 B7R1.1 OCC1=COC=C1 HY-W007708 [0,1,0,0,0,0|1,1,0]=3 36 B7R1.2 BrC1=CN=C(Br)S1 HY-69360 [0,1,0,0,0,0|3,0,0]=4 37 B7R1.2 BrC1=CSC(Br)=N1 HY-59304 [0,1,0,0,0,0|1,0,0]=2 38 B7R1.2 CC1=CC(=O)CC1 HY-W013014 [0,1,0,0,0,0|2,0,1]=4 39 B7R1.2 CC1=CC(N)=NN1 HY-75637 [0,1,0,0,0,0|2,0,1]=4 40 B7R1.2 CC1=CC(N)=NO1 HY-W041676 [0,1,0,0,0,0|3,0,0]=4 41 B7R1.2 CC1=CCC(=O)O1 HY-N0548 [0,1,0,0,0,0|2,0,0]=3 42 B7R1.2 CC1=CN=C(N)S1 HY-WAA0093 [0,1,0,0,0,0|2,0,0]=3 43 B7R1.2 CC1=NN(C)C=C1 HY-W002168 [0,1,0,0,0,0|2,0,0]=3 44 B7R1.2 CN1C=CC(N)=N1 HY-76189 [0,1,0,0,0,0|2,0,0]=3 45 B7R1.2 NC1=NC=C(Br)S1 HY-59343 [0,1,0,0,0,0|3,0,0]=4 46 B7R1.2 O=C1C=CC(=O)N1 HY-W007324 [0,1,0,0,0,0|2,0,1]=4 47 B7R1.2 O=C1CSC(=O)N1 HY-59272 [0,1,0,0,0,0|1,0,2]=4 48 B7R1.2 O=C1CSC(=S)N1 HY-W010365 [0,1,0,0,0,0|1,0,2]=4 49 B7R1.4 BrC1=CSC=C1Br HY-20022 [0,1,0,0,0,0|2,0,0]=3 50 B7R1.4 CC1=CNN=C1C HY-W019334 [0,1,0,0,0,0|2,0,0]=3 51 B7R1.4 CN1C=CN=C1S HY-B0208 [0,1,0,0,0,0|3,0,0]=4 52 B7R1.4 CN1SC=CC1=O HY-W010243 [0,1,0,0,0,0|3,0,0]=4 53 B7R1.4 CN1SC=CC1=O HY-W010520 [0,1,0,0,0,0|3,0,0]=4 54 B7R1.4 NC1=NNC=C1Br HY-W007681 [0,1,0,0,0,0|3,0,0]=4 55 B5R0.1 CC(C)=CC=O HY-34409 [0,0,1,0,0,0|1,1,1]=4 56 B5R0.1 CC(C)=CCO HY-W013035 [0,0,1,0,0,0|3,0,0]=4 57 B5R0.2 CC\C=C\C=O HY-W111375 [0,0,1,0,0,0|2,0,1]=4 58 B7R1.3 BrC1=CN=CN=C1 HY-W008017 [0,0,0,0,0,1|2,0,0]=3 59 B7R1.3 CC1=NC=CN=C1 HY-W067358 [0,0,0,0,0,1|1,0,0]=2 60 B7R1.3 ClC1=NC=CN=C1 HY-Y0109 [0,0,0,0,0,1|2,0,0]=3 61 B7R1.3 IC1=CC=CC=C1 HY-Y0747 [0,0,0,0,0,1|3,0,0]=4 62 B7R1.3 IC1=CC=CC=N1 HY-W004126 [0,0,0,0,0,1|2,0,0]=3 63 B7R1.3 N=C1N=NC=CN1 HY-W004843 [0,0,0,0,0,1|3,0,0]=4 64 B7R1.3 NC1=CN=CN=C1 HY-60351 [0,0,0,0,0,1|2,0,0]=3 65 B7R1.3 NC1=NC=CC=N1 HY-41340 [0,0,0,0,0,1|2,0,0]=3 66 B7R1.3 NC1=NC=CN=C1 HY-34068 [0,0,0,0,0,1|2,0,0]=3 67 B7R1.3 O=C1C=CC=CN1 HY-Y0191 [0,0,0,0,0,1|2,0,1]=4 68 B7R1.3 OC1=CC=CN=C1 HY-Y1129 [0,0,0,0,0,1|2,0,0]=3 69 B4R0.1 C=CC(=O)O HY-W243303A [1,0,1,0,0,0|2,0,0]=4 70 B4R0.1 C=CC(=O)O HY-W243303C [1,0,1,0,0,0|2,0,0]=4 71 B4R0.1 C=CC(=O)O HY-W243303D [1,0,1,0,0,0|2,0,0]=4 72 B4R0.1 C=CC(=O)O HY-W243303E [1,0,1,0,0,0|2,0,0]=4 73 B4R0.1 C=CC(=O)O HY-W243303O [1,0,1,0,0,0|2,0,0]=4 74 B4R0.1 C=CC(N)=O HY-W115727 [1,0,1,0,0,0|1,0,1]=4 75 B4R0.1 C=CC(N)=O HY-W115727A [1,0,1,0,0,0|1,0,1]=4 76 B4R0.1 C=CC(N)=O HY-W115727B [1,0,1,0,0,0|1,0,1]=4 77 B4R0.1 CC(=O)C=O HY-W020014 [1,0,1,0,0,0|1,1,0]=4 78 B4R0.1 CC(C)=NO HY-W008840 [1,0,1,0,0,0|0,1,1]=4 79 B4R0.2 C=CCSC HY-128447 [1,0,1,0,0,0|2,0,0]=4 80 B6R0.6 C\C=C\C=C\CO HY-W017690 [0,1,1,0,0,0|2,0,0]=4 81 B8R1.2 BrCC1=CC=CN=C1 HY-W004131 [0,1,0,0,0,1|1,0,0]=3 82 B8R1.2 C#CC1=CC=CN=C1 HY-34604 [0,1,0,0,0,1|1,0,1]=4 83 B8R1.2 CCC1=NC=CN=C1 HY-W040948 [0,1,0,0,0,1|1,0,0]=3 84 B8R1.2 COC1=CC=NC=C1 HY-W007634 [0,1,0,0,0,1|2,0,0]=4 85 B8R1.2 COC1=CN=CC=C1 HY-W008119 [0,1,0,0,0,1|1,0,0]=3 86 B8R1.2 COC1=CN=CC=N1 HY-W010562 [0,1,0,0,0,1|1,0,0]=3 87 B8R1.2 ClCC1=NC=CC=N1 HY-52102 [0,1,0,0,0,1|1,0,0]=3 88 B8R1.2 N#CC1=NC=CC=N1 HY-Y0241 [0,1,0,0,0,1|1,0,1]=4 89 B8R1.2 N#CC1=NC=CN=C1 HY-Y0131 [0,1,0,0,0,1|1,0,1]=4 90 B8R1.2 NCC1=CC=CC=C1 HY-76253 [0,1,0,0,0,1|2,0,0]=4 91 B8R1.2 NCC1=CC=CN=C1 HY-Y0047 [0,1,0,0,0,1|1,0,0]=3 92 B8R1.2 NCC1=CC=NC=C1 HY-W007632 [0,1,0,0,0,1|2,0,0]=4 93 B8R1.2 NCC1=NC=CC=N1 HY-60347A [0,1,0,0,0,1|1,0,0]=3 94 B8R1.2 O=NC1=NC=CC=C1 HY-136590 [0,1,0,0,0,1|2,0,0]=4 95 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [0,1,0,0,0,1|2,0,0]=4 96 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [0,1,0,0,0,1|2,0,0]=4 97 B8R1.2 OCC1=CC=CN=C1 HY-B0893 [0,1,0,0,0,1|1,0,0]=3 98 B8R1.2 OCC1=NC=CC=C1 HY-Y0004 [0,1,0,0,0,1|1,0,0]=3 99 B8R1.3 BrC1=CN=C(I)C=C1 HY-W002668 [0,1,0,0,0,1|2,0,0]=4 100 B8R1.3 BrC1=NC=C(I)C=C1 HY-W003027 [0,1,0,0,0,1|2,0,0]=4 101 B8R1.3 BrC1=NN=C(Br)C=C1 HY-59234 [0,1,0,0,0,1|2,0,0]=4 102 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [0,1,0,0,0,1|1,0,0]=3 103 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [0,1,0,0,0,1|1,0,0]=3 104 B8R1.3 CC1=CN=C(C)C=N1 HY-34439 [0,1,0,0,0,1|1,0,0]=3 105 B8R1.3 CC1=CN=C(N)C=N1 HY-65255 [0,1,0,0,0,1|1,0,0]=3 106 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [0,1,0,0,0,1|1,0,1]=4 107 B8R1.3 CC1=NN=C(Cl)C=C1 HY-W001297 [0,1,0,0,0,1|1,0,0]=3 108 B8R1.3 ClC1=CN=C(Cl)C=C1 HY-W015626 [0,1,0,0,0,1|2,0,0]=4 109 B8R1.3 ClC1=NC=C(Br)C=C1 HY-W002767 [0,1,0,0,0,1|2,0,0]=4 110 B8R1.3 ClC1=NC=C(I)C=C1 HY-W002858 [0,1,0,0,0,1|2,0,0]=4 111 B8R1.3 FC1=NC=C(Br)C=C1 HY-32746 [0,1,0,0,0,1|2,0,0]=4 112 B8R1.3 FC1=NC=C(Br)C=N1 HY-W008137 [0,1,0,0,0,1|2,0,0]=4 113 B8R1.3 FC1=NC=C(I)C=C1 HY-W007531 [0,1,0,0,0,1|2,0,0]=4 114 B8R1.3 NC1=CC=C(F)N=C1 HY-65254 [0,1,0,0,0,1|2,0,0]=4 115 B8R1.3 NC1=CN=C(Br)C=C1 HY-W016849 [0,1,0,0,0,1|2,0,0]=4 116 B8R1.3 NC1=CN=C(Cl)C=C1 HY-W007481 [0,1,0,0,0,1|2,0,0]=4 117 B8R1.3 NC1=NC=C(Br)N=C1 HY-59261 [0,1,0,0,0,1|2,0,0]=4 118 B8R1.3 NC1=NC=C(O)C=N1 HY-W018339 [0,1,0,0,0,1|2,0,0]=4 119 B8R1.3 NC1=NN=C(Cl)C=C1 HY-Y0141 [0,1,0,0,0,1|2,0,0]=4 120 B8R1.4 BrC1=CC=CC(Br)=N1 HY-59162 [0,1,0,0,0,1|2,0,0]=4 121 B8R1.4 BrC1=CN=CC(Br)=C1 HY-Y0491 [0,1,0,0,0,1|2,0,0]=4 122 B8R1.4 BrC1=NC=CC(I)=C1 HY-W008398 [0,1,0,0,0,1|2,0,0]=4 123 B8R1.4 CC1=CC(Br)=CC=N1 HY-W007447 [0,1,0,0,0,1|1,0,0]=3 124 B8R1.4 CC1=CC(Cl)=NC=C1 HY-W010423 [0,1,0,0,0,1|2,0,0]=4 125 B8R1.4 CC1=CC(N)=NC=C1 HY-W003969 [0,1,0,0,0,1|2,0,0]=4 126 B8R1.4 CC1=CN=CC(C)=N1 HY-W040790 [0,1,0,0,0,1|1,0,0]=3 127 B8R1.4 CC1=NC(Cl)=CC=C1 HY-W001993 [0,1,0,0,0,1|1,0,0]=3 128 B8R1.4 ClC1=CC=NC(Br)=C1 HY-W003129 [0,1,0,0,0,1|2,0,0]=4 129 B8R1.4 ClC1=CN=CC(Br)=C1 HY-W003165 [0,1,0,0,0,1|2,0,0]=4 130 B8R1.4 ClC1=CN=CC(Cl)=C1 HY-W015627 [0,1,0,0,0,1|2,0,0]=4 131 B8R1.4 ClC1=NC=CC(Br)=C1 HY-32752 [0,1,0,0,0,1|2,0,0]=4 132 B8R1.4 ClC1=NC=CC(I)=C1 HY-32754 [0,1,0,0,0,1|2,0,0]=4 133 B8R1.4 FC1=CC(Br)=NC=C1 HY-W003601 [0,1,0,0,0,1|2,0,0]=4 134 B8R1.4 FC1=NC=CC(Br)=C1 HY-32742 [0,1,0,0,0,1|2,0,0]=4 135 B8R1.4 NC1=CC(Br)=CN=C1 HY-66052 [0,1,0,0,0,1|2,0,0]=4 136 B8R1.4 NC1=CC=CC(N)=N1 HY-Y0198 [0,1,0,0,0,1|2,0,0]=4 137 B8R1.4 NC1=CN=CC(Cl)=N1 HY-59335 [0,1,0,0,0,1|2,0,0]=4 138 B8R1.4 NC1=NC(=O)C=CN1 HY-W002272 [0,1,0,0,0,1|2,0,0]=4 139 B8R1.4 NC1=NC(=O)NC=C1 HY-I0626 [0,1,0,0,0,1|2,0,0]=4 140 B8R1.4 NC1=NC(Br)=CC=C1 HY-Y1049 [0,1,0,0,0,1|2,0,0]=4 141 B8R1.4 NC1=NC(Cl)=NC=C1 HY-30139 [0,1,0,0,0,1|2,0,0]=4 142 B8R1.4 NC1=NC=CC(Br)=C1 HY-41000 [0,1,0,0,0,1|2,0,0]=4 143 B8R1.4 NC1=NC=CC(Cl)=C1 HY-60325 [0,1,0,0,0,1|2,0,0]=4 144 B8R1.4 NC1=NC=CC(F)=C1 HY-W005118 [0,1,0,0,0,1|2,0,0]=4 145 B8R1.4 OC1=CC(Cl)=NC=C1 HY-I0304 [0,1,0,0,0,1|2,0,0]=4 146 B8R1.4 OC1=CC(O)=NC=N1 HY-W015902 [0,1,0,0,0,1|2,0,0]=4 147 B8R1.4 OC1=CN=CC(Br)=C1 HY-66053 [0,1,0,0,0,1|2,0,0]=4 148 B8R1.4 OC1=NC=CC(Br)=C1 HY-65036 [0,1,0,0,0,1|2,0,0]=4 149 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [0,1,0,0,0,1|1,0,0]=3 150 B8R1.5 CC1=C(C)N=CC=N1 HY-W015914 [0,1,0,0,0,1|1,0,0]=3 151 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [0,1,0,0,0,1|1,0,0]=3 152 B8R1.5 CC1=NC=CC=C1O HY-W002339 [0,1,0,0,0,1|1,0,0]=3 153 B8R1.5 ClC1=C(Br)N=CC=C1 HY-W007662 [0,1,0,0,0,1|2,0,0]=4 154 B8R1.5 ClC1=C(Cl)N=CC=C1 HY-W012591 [0,1,0,0,0,1|2,0,0]=4 155 B8R1.5 ClC1=NC=CC=C1Br HY-32751 [0,1,0,0,0,1|2,0,0]=4 156 B8R1.5 ClC1=NC=CC=C1I HY-32753 [0,1,0,0,0,1|2,0,0]=4 157 B8R1.5 FC1=CN=CC=C1I HY-W012392 [0,1,0,0,0,1|2,0,0]=4 158 B8R1.5 NC1=C(Cl)C=CN=C1 HY-33868 [0,1,0,0,0,1|2,0,0]=4 159 B8R1.5 NC1=C(Cl)N=CC=N1 HY-W007499 [0,1,0,0,0,1|2,0,0]=4 160 B8R1.5 NC1=C(I)C=NC=C1 HY-W002945 [0,1,0,0,0,1|2,0,0]=4 161 B8R1.5 NC1=C(N)C=NC=C1 HY-14946 [0,1,0,0,0,1|2,0,0]=4 162 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [0,1,0,0,0,1|2,0,0]=4 163 B8R1.5 NC1=CC=CN=C1Br HY-66051 [0,1,0,0,0,1|2,0,0]=4 164 B8R1.5 NC1=CC=CN=C1Cl HY-Y0244 [0,1,0,0,0,1|2,0,0]=4 165 B8R1.5 NC1=NC=CC=C1I HY-32813 [0,1,0,0,0,1|2,0,0]=4 166 B8R1.5 OC1=CC=CN=C1Br HY-20026 [0,1,0,0,0,1|2,0,0]=4 167 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [0,1,0,0,0,1|2,0,0]=4 168 B8R1.1 CC1=CC(CO)=NO1 HY-W012937 [0,2,0,0,0,0|2,0,0]=4 169 B8R1.1 CC1=CC=C(C=O)O1 HY-Y0543 [0,2,0,0,0,0|2,0,0]=4 170 B8R1.1 CC1=CC=C(C=O)S1 HY-34465 [0,2,0,0,0,0|2,0,0]=4 171 B8R1.1 CC1=CC=C(CO)O1 HY-W087919 [0,2,0,0,0,0|2,0,0]=4 172 B8R1.1 CN1C=C(C=O)C=N1 HY-69052 [0,2,0,0,0,0|2,0,0]=4 173 B8R1.7 CC(=O)C1=CC=CO1 HY-W015912 [0,2,0,0,0,0|2,0,0]=4 174 B8R1.7 CC(=O)C1=CC=CS1 HY-20585 [0,2,0,0,0,0|2,0,0]=4 175 B8R1.7 CC(=O)C1=CSC=C1 HY-W007361 [0,2,0,0,0,0|1,0,0]=3 176 B8R1.7 CC(=O)C1=NC=CS1 HY-Y0045 [0,2,0,0,0,0|2,0,0]=4 177 B8R1.7 CC(C)C1=NC=CN1 HY-W001201 [0,2,0,0,0,0|2,0,0]=4 178 B8R1.7 O=C(O)C1=CSC=C1 HY-W004615 [0,2,0,0,0,0|1,0,1]=4 179 B8R1.7 O=C(O)C1=CSC=N1 HY-59320 [0,2,0,0,0,0|0,0,1]=3 180 B8R1.7 OB(O)C1=CSC=C1 HY-W001066 [0,2,0,0,0,0|2,0,0]=4 181 B8R1.8 CCCN1C=CC=N1 HY-Z1093 [0,2,0,0,0,0|2,0,0]=4 182 B8R1.8 NCCC1=CN=CN1 HY-B0722 [0,2,0,0,0,0|1,0,1]=4 183 B8R1.8 NCCC1=CN=CN1 HY-B0722R [0,2,0,0,0,0|1,0,1]=4 184 B8R1.8 NCCC1=CN=CN1 HY-B1204 [0,2,0,0,0,0|1,0,1]=4 185 B8R1.8 NCCC1=CN=CN1 HY-B1204R [0,2,0,0,0,0|1,0,1]=4 186 B8R1.8 NCCC1=CNC=N1 HY-A0129 [0,2,0,0,0,0|1,0,0]=3 187 B8R1.11 O=CC1=C(Br)C=CS1 HY-W007753 [0,2,0,0,0,0|2,0,0]=4 188 B8R1.18 CC1=CC(=O)OC1=O HY-78035 [0,2,0,0,0,0|1,1,0]=4 189 B8R1.18 CC1=CC(C)=NN1C HY-N7086 [0,2,0,0,0,0|2,0,0]=4 190 B8R1.18 CC1=NC(C)=C(C)S1 HY-W100945 [0,2,0,0,0,0|0,0,0]=2 191 B8R1.50 CC1=NNC(C)=C1Br HY-W016754 [0,2,0,0,0,0|2,0,0]=4 192 B8R1.50 CC1=NOC(N)=C1Cl HY-70065 [0,2,0,0,0,0|2,0,0]=4 193 B6R1.1 C1=CC=NN=C1 HY-W007494 [0,0,1,1,0,0|2,0,0]=4 194 B6R1.1 C1=CN=CN=C1 HY-Y0519 [0,0,1,1,0,0|1,0,1]=4