0 B8R1.8 BrCCC1=CC=CS1 HR139597 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.8 C=CCN1C=CN=C1 HR135430 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.8 CCCC1=CSC=C1 HR111780 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 CCCC1=NC=CN1 HR125523 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 CCCC1=NC=CS1 HR129777 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.8 CCCN1C=CC=N1 HR153199 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.8 CCCc1cccs1 HR132275 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.8 CCSC1=NN=NN1 HR135530 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.8 CNCC1=CC=CS1 HR110963 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.8 CNCC1=CC=CS1 HR117241 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.8 CNCC1=CC=NN1 HR111449 [0,0,0,0,0,0|4,0,0]=4 11 B8R1.8 CNCC1=CC=NO1 HR110883 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.8 COCC1=CC=CS1 HR153359 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.8 COCN1C=CN=C1 HR33953 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.8 CSCC1=CC=CO1 HR129428 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.8 ClCCC1=CC=CS1 HR118860 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.8 ClCCC1=CNN=C1 HR15789 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.8 ClCCC1=NC=CN1 HR104772 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.8 ClCCC1=NNN=N1 HR132614 [0,0,0,0,0,0|3,0,1]=4 19 B8R1.8 ClCCN1C=NC=N1 HR115226 [0,0,0,0,0,0|2,0,1]=3 20 B8R1.8 N#CCC1=CC=CS1 HR134457 [0,0,0,0,0,0|2,0,2]=4 21 B8R1.8 N#CCC1=CSC=C1 HR133104 [0,0,0,0,0,0|2,0,2]=4 22 B8R1.8 N#CCN1C=CN=C1 HR107958 [0,0,0,0,0,0|2,0,2]=4 23 B8R1.8 NCCC1=CC=CO1 HR118527 [0,0,0,0,0,0|2,0,0]=2 24 B8R1.8 NCCC1=CC=CS1 HR127239 [0,0,0,0,0,0|2,0,0]=2 25 B8R1.8 NCCC1=CNC=N1 HR122599 [0,0,0,0,0,0|0,0,2]=2 26 B8R1.8 NCCC1=CNC=N1 HR135573 [0,0,0,0,0,0|0,0,2]=2 27 B8R1.8 NCCC1=CNC=N1 HR135577 [0,0,0,0,0,0|0,0,2]=2 28 B8R1.8 NCCC1=CSC=C1 HR108024 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.8 NCCN1C=CC=N1 HR108678 [0,0,0,0,0,0|2,0,1]=3 30 B8R1.8 NCCN1C=CN=C1 HR12985 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.8 NCCN1C=CN=N1 HR108972 [0,0,0,0,0,0|3,0,0]=3 32 B8R1.8 NCCc1ccsc1 HR118216 [0,0,0,0,0,0|2,0,0]=2 33 B8R1.8 O=CCC1=CC=CS1 HR104291 [0,0,0,0,0,0|3,0,1]=4 34 B8R1.8 OCCC1=CC=CS1 HR126977 [0,0,0,0,0,0|3,0,0]=3 35 B8R1.8 OCCC1=CNC=N1 HR138319 [0,0,0,0,0,0|1,0,2]=3 36 B8R1.8 OCCC1=CNN=C1 HR121047 [0,0,0,0,0,0|3,0,0]=3 37 B8R1.8 OCCC1=CON=C1 HR106040 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.8 OCCC1=CSC=C1 HR122222 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.8 OCCN1C=CN=C1 HR137262 [0,0,0,0,0,0|3,0,0]=3 40 B7R1.1 BrCC1=CC=CS1 HR107794 [1,0,0,0,0,0|3,0,0]=4 41 B7R1.1 BrCC1=CC=NN1 HR119316 [1,0,0,0,0,0|3,0,0]=4 42 B7R1.1 BrCC1=CC=NO1 HR111380 [1,0,0,0,0,0|3,0,0]=4 43 B7R1.1 BrCC1=CN=CN1 HR106193 [1,0,0,0,0,0|1,0,0]=2 44 B7R1.1 BrCC1=CN=CS1 HR111858 [1,0,0,0,0,0|2,0,0]=3 45 B7R1.1 BrCC1=COC=C1 HR105237 [1,0,0,0,0,0|3,0,0]=4 46 B7R1.1 BrCC1=CSC=C1 HR126049 [1,0,0,0,0,0|3,0,0]=4 47 B7R1.1 BrCC1=CSC=N1 HR112334 [1,0,0,0,0,0|2,0,1]=4 48 B7R1.1 BrCC1=NC=CN1 HR106504 [1,0,0,0,0,0|3,0,0]=4 49 B7R1.1 CCC1=CC=CO1 HR125873 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.1 CCC1=CC=CS1 HR111385 [1,0,0,0,0,0|2,0,0]=3 51 B7R1.1 CCC1=CSC=C1 HR124094 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.1 CCC1=NC=CN1 HR15972 [1,0,0,0,0,0|2,0,0]=3 53 B7R1.1 CCC1=NC=CS1 HR130841 [1,0,0,0,0,0|2,0,1]=4 54 B7R1.1 CCN1C=CC=C1 HR125020 [1,0,0,0,0,0|3,0,0]=4 55 B7R1.1 CCN1C=CC=N1 HR102255 [1,0,0,0,0,0|2,0,1]=4 56 B7R1.1 CCN1C=CN=C1 HR124211 [1,0,0,0,0,0|2,0,0]=3 57 B7R1.1 CCN1C=NC=N1 HR113069 [1,0,0,0,0,0|1,0,1]=3 58 B7R1.1 CNC1=CN=CO1 HR119721 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.1 CNC1=COC=N1 HR112378 [1,0,0,0,0,0|2,0,1]=4 60 B7R1.1 COC1=CC=CS1 HR128854 [1,0,0,0,0,0|3,0,0]=4 61 B7R1.1 COC1=CSC=C1 HR138278 [1,0,0,0,0,0|3,0,0]=4 62 B7R1.1 CSC1=CC=CS1 HR119424 [1,0,0,0,0,0|3,0,0]=4 63 B7R1.1 CSC1=CSC=C1 HR153189 [1,0,0,0,0,0|3,0,0]=4 64 B7R1.1 ClCC1=CC=CS1 HR130983 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.1 ClCC1=CC=NO1 HR106390 [1,0,0,0,0,0|3,0,0]=4 66 B7R1.1 ClCC1=CN=CO1 HR116607 [1,0,0,0,0,0|2,0,0]=3 67 B7R1.1 ClCC1=CN=CS1 HR112175 [1,0,0,0,0,0|2,0,0]=3 68 B7R1.1 ClCC1=CNC=N1 HR105878 [1,0,0,0,0,0|1,0,2]=4 69 B7R1.1 ClCC1=COC=C1 HR104894 [1,0,0,0,0,0|3,0,0]=4 70 B7R1.1 ClCC1=CSC=N1 HR108408 [1,0,0,0,0,0|2,0,1]=4 71 B7R1.1 ClCC1=CSC=N1 HR113899 [1,0,0,0,0,0|2,0,1]=4 72 B7R1.1 ClCC1=NC=CN1 HR106818 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.1 ClCC1=NN=NN1 HR137948 [1,0,0,0,0,0|3,0,0]=4 74 B7R1.1 N#CC1=CC=CN1 HR131195 [1,0,0,0,0,0|1,0,2]=4 75 B7R1.1 N#CC1=CN=CO1 HR119400 [1,0,0,0,0,0|1,0,2]=4 76 B7R1.1 N#CC1=CN=CS1 HR148087 [1,0,0,0,0,0|1,0,2]=4 77 B7R1.1 NCC1=CC=CN1 HR148675 [1,0,0,0,0,0|1,0,0]=2 78 B7R1.1 NCC1=CC=CS1 HR128270 [1,0,0,0,0,0|2,0,0]=3 79 B7R1.1 NCC1=CC=NN1 HR14846 [1,0,0,0,0,0|2,0,0]=3 80 B7R1.1 NCC1=CC=NO1 HR104828 [1,0,0,0,0,0|2,0,0]=3 81 B7R1.1 NCC1=CN=CO1 HR146908 [1,0,0,0,0,0|1,0,0]=2 82 B7R1.1 NCC1=CN=CS1 HR109298 [1,0,0,0,0,0|1,0,0]=2 83 B7R1.1 NCC1=CNN=N1 HR105258 [1,0,0,0,0,0|1,0,2]=4 84 B7R1.1 NCC1=COC=N1 HR106091 [1,0,0,0,0,0|1,0,1]=3 85 B7R1.1 NCC1=CSC=C1 HR134337 [1,0,0,0,0,0|2,0,0]=3 86 B7R1.1 NCC1=NC=CN1 HR115302 [1,0,0,0,0,0|2,0,0]=3 87 B7R1.1 NCC1=NC=CN1 HR117949 [1,0,0,0,0,0|2,0,0]=3 88 B7R1.1 NCC1=NC=CO1 HR121937 [1,0,0,0,0,0|2,0,1]=4 89 B7R1.1 NCC1=NC=CS1 HR117910 [1,0,0,0,0,0|2,0,1]=4 90 B7R1.1 NCC1=NC=CS1 HR118256 [1,0,0,0,0,0|2,0,1]=4 91 B7R1.1 NCC1=NN=CO1 HR32217 [1,0,0,0,0,0|2,0,0]=3 92 B7R1.1 NCC1=NNC=C1 HR110853 [1,0,0,0,0,0|2,0,1]=4 93 B7R1.1 NCC1=NNN=N1 HR105085 [1,0,0,0,0,0|2,0,1]=4 94 B7R1.1 NCC1=NOC=N1 HR116324 [1,0,0,0,0,0|2,0,1]=4 95 B7R1.1 NCC1=NOC=N1 HR120542 [1,0,0,0,0,0|2,0,1]=4 96 B7R1.1 NCC1=NSC=C1 HR102659 [1,0,0,0,0,0|2,0,1]=4 97 B7R1.1 NCc1ccno1 HR111646 [1,0,0,0,0,0|2,0,0]=3 98 B7R1.1 NCc1cncs1 HR117632 [1,0,0,0,0,0|1,0,0]=2 99 B7R1.1 O=CC1=CC=CN1 HR133248 [1,0,0,0,0,0|2,0,1]=4 100 B7R1.1 O=CC1=CN=CO1 HR120030 [1,0,0,0,0,0|2,0,1]=4 101 B7R1.1 O=CC1=CN=CS1 HR127222 [1,0,0,0,0,0|2,0,1]=4 102 B7R1.1 OCC1=CC=CO1 HR147620 [1,0,0,0,0,0|3,0,0]=4 103 B7R1.1 OCC1=CC=CS1 HR136423 [1,0,0,0,0,0|3,0,0]=4 104 B7R1.1 OCC1=CC=NN1 HR118693 [1,0,0,0,0,0|3,0,0]=4 105 B7R1.1 OCC1=CC=NO1 HR105454 [1,0,0,0,0,0|3,0,0]=4 106 B7R1.1 OCC1=CC=NS1 HR114846 [1,0,0,0,0,0|3,0,0]=4 107 B7R1.1 OCC1=CN=CO1 HR120976 [1,0,0,0,0,0|2,0,0]=3 108 B7R1.1 OCC1=CN=CS1 HR126084 [1,0,0,0,0,0|2,0,0]=3 109 B7R1.1 OCC1=CNC=N1 HR138057 [1,0,0,0,0,0|1,0,2]=4 110 B7R1.1 OCC1=CNN=C1 HR147089 [1,0,0,0,0,0|3,0,0]=4 111 B7R1.1 OCC1=COC=C1 HR124594 [1,0,0,0,0,0|3,0,0]=4 112 B7R1.1 OCC1=COC=N1 HR121921 [1,0,0,0,0,0|2,0,1]=4 113 B7R1.1 OCC1=CSC=C1 HR123712 [1,0,0,0,0,0|3,0,0]=4 114 B7R1.1 OCC1=CSC=N1 HR121654 [1,0,0,0,0,0|2,0,1]=4 115 B7R1.1 OCC1=NC=CN1 HR146395 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.1 OCN1C=CN=C1 HR8052 [1,0,0,0,0,0|3,0,0]=4 117 B7R1.1 OCN1C=NC=N1 HR121523 [1,0,0,0,0,0|2,0,1]=4 118 B7R1.1 SCC1=CC=CS1 HR139099 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.7 CCCC1=CC(N)=NN1 HR102903 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.7 CCCC1=CSC(N)=N1 HR120059 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.7 CN1C=C(CCN)C=N1 HR117114 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.7 NCCC1=CC=C(Br)S1 HR104636 [0,1,0,0,0,0|2,0,0]=3 123 B9R1.7 NCCC1=CN=C(N)N1 HR113361 [0,1,0,0,0,0|0,0,0]=1 124 B9R1.7 NCCc1ccc(Cl)s1 HR120576 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.11 CCC(=O)C1=CC=CN1 HR132813 [0,1,0,0,0,0|2,0,1]=4 126 B9R1.11 NCC(=O)c1cccs1 HR114373 [0,1,0,0,0,0|2,0,1]=4 127 B9R1.11 NNC(=O)C1=CC=CN1 HR120604 [0,1,0,0,0,0|2,0,1]=4 128 B9R1.12 C=NCCC1=CC=CS1 HR118796 [0,1,0,0,0,0|2,0,1]=4 129 B9R1.12 CCCCC1=CC=CS1 HR153368 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.12 CCCCC1=CSC=C1 HR104000 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.12 CCCCN1C=CN=C1 HR147152 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.12 CCNCC1=CC=CS1 HR115954 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.12 N#CCCN1C=CN=C1 HR136232 [0,1,0,0,0,0|2,0,1]=4 134 B9R1.12 NCCCN1C=CN=C1 HR127677 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.12 OCCCC1=CC=CS1 HR103357 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.12 OCCCC1=CN=CN1 HR34117 [0,1,0,0,0,0|1,0,0]=2 137 B9R1.12 OCCCC1=CON=C1 HR106355 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.13 CC(N)CC1=CC=CS1 HR106138 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.13 CC(N)CC1=CC=NN1 HR108621 [0,1,0,0,0,0|2,0,0]=3 140 B9R1.13 O=C(O)CC1=CN=CN1 OSXM01601 [0,1,0,0,0,0|1,0,1]=3 141 B9R1.33 CC1=C(CCCl)SC=N1 HR133331 [0,1,0,0,0,0|2,0,0]=3 142 B9R1.33 CC1=C(CCN)SC=N1 HR107058 [0,1,0,0,0,0|1,0,0]=2 143 B9R1.33 CC1=C(CCO)SC=N1 HR122761 [0,1,0,0,0,0|2,0,0]=3 144 B9R1.33 CC1=NC=CN1CCO HR142319 [0,1,0,0,0,0|3,0,0]=4 145 B9R1.33 CCOC1=C(C)N=CO1 HR8651 [0,1,0,0,0,0|3,0,0]=4 146 B9R1.33 CN1C=CC=C1CC#N HR130216 [0,1,0,0,0,0|1,0,2]=4 147 B9R1.33 CN1C=NC=C1N=C=O HR119081 [0,1,0,0,0,0|2,0,1]=4 148 B9R2.2 C1=CNC(C2CC2)=N1 HR104592 [0,0,0,1,0,0|3,0,0]=4 149 B9R1.8 BrCCC1=CC=CC=C1 HR137400 [0,0,0,0,0,1|3,0,0]=4 150 B9R1.8 BrCCC1=CC=CN=C1 HR145991 [0,0,0,0,0,1|2,0,0]=3 151 B9R1.8 BrCCC1=NC=CC=C1 HR108401 [0,0,0,0,0,1|2,0,1]=4 152 B9R1.8 BrCCC1=NC=CC=C1 HR140265 [0,0,0,0,0,1|2,0,1]=4 153 B9R1.8 CCCC1=CC=NC=C1 HR126194 [0,0,0,0,0,1|2,0,0]=3 154 B9R1.8 CCCC1=NC=CC=C1 HR129514 [0,0,0,0,0,1|2,0,1]=4 155 B9R1.8 CCOC1=NC=CN=C1 HR132551 [0,0,0,0,0,1|2,0,1]=4 156 B9R1.8 CNCC1=CC=CN=C1 HR115545 [0,0,0,0,0,1|3,0,0]=4 157 B9R1.8 CNCC1=NC=CN=C1 HR146839 [0,0,0,0,0,1|2,0,1]=4 158 B9R1.8 CNCC1=NC=NC=C1 HR120571 [0,0,0,0,0,1|2,0,1]=4 159 B9R1.8 ClCCC1=CC=CC=C1 HR133891 [0,0,0,0,0,1|3,0,0]=4 160 B9R1.8 ClCCC1=NC=CC=C1 HR142690 [0,0,0,0,0,1|2,0,1]=4 161 B9R1.8 N#CCC1=CC=CN=C1 HR123244 [0,0,0,0,0,1|1,0,2]=4 162 B9R1.8 N#CCC1=CC=NC=C1 HR129755 [0,0,0,0,0,1|1,0,2]=4 163 B9R1.8 N#CCC1=CC=NC=C1 HR143282 [0,0,0,0,0,1|1,0,2]=4 164 B9R1.8 NCCC1=CC=CC=C1 HR124878 [0,0,0,0,0,1|2,0,0]=3 165 B9R1.8 NCCC1=CC=CC=C1 HR126697 [0,0,0,0,0,1|2,0,0]=3 166 B9R1.8 NCCC1=CC=CN=C1 HR134041 [0,0,0,0,0,1|1,0,0]=2 167 B9R1.8 NCCC1=CC=NC=C1 HR116357 [0,0,0,0,0,1|1,0,0]=2 168 B9R1.8 NCCC1=CC=NC=C1 HR119181 [0,0,0,0,0,1|1,0,0]=2 169 B9R1.8 NCCC1=CCCCC1 HR113892 [0,0,0,0,0,1|2,0,1]=4 170 B9R1.8 NCCC1=NC=CC=C1 HR141302 [0,0,0,0,0,1|1,0,1]=3 171 B9R1.8 NNCC1=CC=CC=C1 HR134091 [0,0,0,0,0,1|3,0,0]=4 172 B9R1.8 NNCC1=CC=CC=C1 HR30015 [0,0,0,0,0,1|3,0,0]=4 173 B9R1.8 NNCC1=CC=CN=C1 HR105274 [0,0,0,0,0,1|2,0,0]=3 174 B9R1.8 NNCC1=NC=CN=C1 HR116503 [0,0,0,0,0,1|1,0,1]=3 175 B9R1.8 NOCC1=CC=CC=C1 HR139396 [0,0,0,0,0,1|3,0,0]=4 176 B9R1.8 NOCC1=CC=CC=C1 HR7095 [0,0,0,0,0,1|3,0,0]=4 177 B9R1.8 OCCC1=CC=CC=C1 HR126434 [0,0,0,0,0,1|3,0,0]=4 178 B9R1.8 OCCC1=CC=CN=C1 HR117461 [0,0,0,0,0,1|2,0,0]=3 179 B9R1.8 OCCC1=CC=NC=C1 HR134681 [0,0,0,0,0,1|2,0,0]=3 180 B9R1.8 OCCC1=CN=CN=C1 HR147923 [0,0,0,0,0,1|1,0,1]=3 181 B9R1.8 OCCC1=NC=CC=C1 HR132012 [0,0,0,0,0,1|2,0,1]=4 182 B9R1.8 OCCC1=NC=CN=C1 HR109193 [0,0,0,0,0,1|1,0,1]=3 183 B9R1.8 OCCC1=NC=NC=C1 HR112757 [0,0,0,0,0,1|1,0,1]=3 184 B9R1.8 SCCC1=CC=CC=C1 HR137189 [0,0,0,0,0,1|3,0,0]=4 185 B9R1.8 SCCC1=NC=CN=C1 HR126064 [0,0,0,0,0,1|1,0,1]=3 186 B6R0.6 C=CCCCCN HR143196 [1,0,1,0,0,0|1,0,1]=4 187 B6R0.6 CCC\C=C\C=O HR127670 [1,0,1,0,0,0|2,0,0]=4 188 B6R0.1 C=CC(=O)CCC HR100488 [1,0,1,0,0,0|2,0,0]=4 189 B6R1.2 BrC1=CN=CO1 HR146519 [2,0,0,0,0,0|2,0,0]=4 190 B6R1.2 BrC1=CN=CS1 HR33453 [2,0,0,0,0,0|2,0,0]=4 191 B6R1.2 CC1=CC=CN1 HR147294 [2,0,0,0,0,0|1,0,0]=3 192 B6R1.2 CC1=CC=CS1 HR131866 [2,0,0,0,0,0|2,0,0]=4 193 B6R1.2 CC1=CC=NN1 HR10442 [2,0,0,0,0,0|2,0,0]=4 194 B6R1.2 CC1=CC=NO1 HR131159 [2,0,0,0,0,0|2,0,0]=4 195 B6R1.2 CC1=CN=CS1 HR128769 [2,0,0,0,0,0|1,0,0]=3 196 B6R1.2 CC1=CNC=C1 HR13921 [2,0,0,0,0,0|1,0,1]=4 197 B6R1.2 CC1=CNC=N1 HR7153 [2,0,0,0,0,0|0,0,2]=4 198 B6R1.2 CC1=CNN=C1 HR13055 [2,0,0,0,0,0|2,0,0]=4 199 B6R1.2 CC1=COC=C1 HR125178 [2,0,0,0,0,0|2,0,0]=4 200 B6R1.2 CC1=COC=N1 HR121299 [2,0,0,0,0,0|1,0,1]=4 201 B6R1.2 CC1=CSC=N1 HR132874 [2,0,0,0,0,0|1,0,1]=4 202 B6R1.2 CC1=NC=CN1 HR135019 [2,0,0,0,0,0|2,0,0]=4 203 B6R1.2 CN1C=CN=C1 HR134754 [2,0,0,0,0,0|2,0,0]=4 204 B6R1.2 CN1C=NC=N1 HR113481 [2,0,0,0,0,0|1,0,1]=4 205 B6R1.2 IC1=CN=CS1 HR30442 [2,0,0,0,0,0|2,0,0]=4 206 B6R1.2 NC1=CC=CN1 HR107433 [2,0,0,0,0,0|1,0,0]=3 207 B6R1.2 NC1=CC=CS1 HR102647 [2,0,0,0,0,0|2,0,0]=4 208 B6R1.2 NC1=CC=NN1 HR147285 [2,0,0,0,0,0|2,0,0]=4 209 B6R1.2 NC1=CC=NO1 HR120254 [2,0,0,0,0,0|2,0,0]=4 210 B6R1.2 NC1=CN=CS1 HR127505 [2,0,0,0,0,0|1,0,0]=3 211 B6R1.2 NC1=CN=CS1 HR147472 [2,0,0,0,0,0|1,0,0]=3 212 B6R1.2 NC1=CN=NS1 HR129201 [2,0,0,0,0,0|2,0,0]=4 213 B6R1.2 NC1=CNC=N1 HR129839 [2,0,0,0,0,0|0,0,2]=4 214 B6R1.2 NC1=CNN=C1 HR102513 [2,0,0,0,0,0|2,0,0]=4 215 B6R1.2 NC1=CNN=C1 HR146877 [2,0,0,0,0,0|2,0,0]=4 216 B6R1.2 NC1=CON=C1 HR102737 [2,0,0,0,0,0|2,0,0]=4 217 B6R1.2 NC1=CSC=C1 HR102995 [2,0,0,0,0,0|2,0,0]=4 218 B6R1.2 NC1=CSC=N1 HR111500 [2,0,0,0,0,0|1,0,1]=4 219 B6R1.2 NC1=NC=CN1 HR125916 [2,0,0,0,0,0|2,0,0]=4 220 B6R1.2 NC1=NC=CN1 HR146724 [2,0,0,0,0,0|2,0,0]=4 221 B6R1.2 NC1=NC=CN1 HR8378 [2,0,0,0,0,0|2,0,0]=4 222 B6R1.2 NC1=NC=NS1 HR11136 [2,0,0,0,0,0|1,0,1]=4 223 B6R1.2 NC1=NC=NS1 HR121510 [2,0,0,0,0,0|1,0,1]=4 224 B6R1.2 NC1=NN=CN1 HR112169 [2,0,0,0,0,0|1,0,0]=3 225 B6R1.2 NC1=NN=CS1 HR132092 [2,0,0,0,0,0|2,0,0]=4 226 B6R1.2 NC1=NN=NN1 HR124615 [2,0,0,0,0,0|2,0,0]=4 227 B6R1.2 NC1=NN=NN1 HR135786 [2,0,0,0,0,0|2,0,0]=4 228 B6R1.2 Nc1ccsc1 HR114587 [2,0,0,0,0,0|2,0,0]=4 229 B6R1.2 Nc1cnoc1 HR108880 [2,0,0,0,0,0|2,0,0]=4 230 B6R1.2 [S-]C1=CN=NN1 HR136077 [2,0,0,0,0,0|2,0,0]=4 231 B8R1.1 BrCC1=CN=C(Br)S1 HR147266 [1,1,0,0,0,0|2,0,0]=4 232 B8R1.1 CC1=CC=C(CN)S1 HR103044 [1,1,0,0,0,0|2,0,0]=4 233 B8R1.1 CC1=NC=C(C=O)N1 HR108199 [1,1,0,0,0,0|1,0,1]=4 234 B8R1.1 CC1=NN=C(CN)O1 HR104579 [1,1,0,0,0,0|2,0,0]=4 235 B8R1.1 CC1=NOC(CN)=C1 HR118262 [1,1,0,0,0,0|2,0,0]=4 236 B8R1.1 CCC1=CC(N)=NN1 HR103219 [1,1,0,0,0,0|2,0,0]=4 237 B8R1.1 CCC1=CC=C(C)S1 HR107230 [1,1,0,0,0,0|2,0,0]=4 238 B8R1.1 CCC1=CCC(C)=C1 HR108113 [1,1,0,0,0,0|2,0,0]=4 239 B8R1.1 CCC1=CN=C(C)N1 HR134215 [1,1,0,0,0,0|0,0,0]=2 240 B8R1.1 CCC1=NC(C)=CN1 HR127274 [1,1,0,0,0,0|2,0,0]=4 241 B8R1.1 CCC1=NN=C(N)S1 HR137915 [1,1,0,0,0,0|2,0,0]=4 242 B8R1.1 CN1C=C(CN)C=N1 HR107602 [1,1,0,0,0,0|2,0,0]=4 243 B8R1.1 CN1C=NC(CN)=C1 HR110008 [1,1,0,0,0,0|0,0,2]=4 244 B8R1.1 CSC1=CN=C(N)S1 HR114688 [1,1,0,0,0,0|2,0,0]=4 245 B8R1.1 ClCC1=CN=C(Cl)S1 HR17773 [1,1,0,0,0,0|2,0,0]=4 246 B8R1.1 NC1=NC=C(CO)S1 HR112957 [1,1,0,0,0,0|2,0,0]=4 247 B8R1.1 NCC1=CC=C(Br)S1 HR103535 [1,1,0,0,0,0|2,0,0]=4 248 B8R1.1 NCC1=CC=C(Cl)S1 HR120256 [1,1,0,0,0,0|2,0,0]=4 249 B8R1.1 NCC1=CN=C(Cl)S1 HR113082 [1,1,0,0,0,0|1,0,0]=3 250 B8R1.1 NCC1=CN=C(Cl)S1 HR148151 [1,1,0,0,0,0|1,0,0]=3 251 B8R1.1 NCc1cc(Br)no1 HR106352 [1,1,0,0,0,0|2,0,0]=4 252 B8R1.1 OCC1=CN=C(Br)S1 HR109795 [1,1,0,0,0,0|2,0,0]=4 253 B8R1.7 CC(=O)C1=CC=CN1 HR125135 [1,1,0,0,0,0|1,0,1]=4 254 B8R1.7 CC(=O)C1=CN=CN1 HR107179 [1,1,0,0,0,0|0,0,1]=3 255 B8R1.7 CC(C)C1=CC=CO1 HR128818 [1,1,0,0,0,0|2,0,0]=4 256 B8R1.7 CC(C)C1=NC=CN1 HR125779 [1,1,0,0,0,0|2,0,0]=4 257 B8R1.7 CC(C)N1C=CN=C1 HR142416 [1,1,0,0,0,0|2,0,0]=4 258 B8R1.7 CC(N)C1=CC=CS1 HR106452 [1,1,0,0,0,0|2,0,0]=4 259 B8R1.7 CC(O)C1=CC=CO1 HR110830 [1,1,0,0,0,0|2,0,0]=4 260 B8R1.7 NC(=O)C1=CN=CS1 HR117462 [1,1,0,0,0,0|1,0,1]=4 261 B8R1.7 NC(=S)C1=CN=CS1 HR117148 [1,1,0,0,0,0|1,0,1]=4 262 B8R1.11 CC1=C(CN)SC=C1 HR120374 [1,1,0,0,0,0|2,0,0]=4 263 B8R1.11 CC1=C(CO)NC=N1 HR131832 [1,1,0,0,0,0|1,0,0]=3 264 B8R1.11 CC1=C(CO)OC=N1 HR103087 [1,1,0,0,0,0|2,0,0]=4 265 B8R1.11 CCC1=CNN=C1N DIXM01401 [1,1,0,0,0,0|2,0,0]=4 266 B8R1.11 CCC1=CNN=C1N HR148695 [1,1,0,0,0,0|2,0,0]=4 267 B8R1.11 CCN1C=CN=C1C HR142503 [1,1,0,0,0,0|2,0,0]=4 268 B8R1.11 CCN1NN=NC1=S HR128911 [1,1,0,0,0,0|2,0,0]=4 269 B8R1.11 CN1C=NC=C1C#N HR118218 [1,1,0,0,0,0|0,0,2]=4 270 B8R1.11 CN1C=NC=C1C=O HR138042 [1,1,0,0,0,0|1,0,1]=4 271 B8R1.11 CN1C=NC=C1CO HR137103 [1,1,0,0,0,0|1,0,0]=3 272 B8R1.11 CN1N=CC=C1CN HR120987 [1,1,0,0,0,0|2,0,0]=4 273 B8R1.11 NNC1=NN=CN1N HR110199 [1,1,0,0,0,0|2,0,0]=4 274 B8R1.11 OCC1=C(Br)N=CS1 HR147771 [1,1,0,0,0,0|2,0,0]=4 275 B10R1.1 CC1=CC=C(CCN)C=C1 HR140819 [0,1,0,0,0,1|2,0,0]=4 276 B10R1.1 CC1=CC=C(CCO)C=N1 HR120419 [0,1,0,0,0,1|2,0,0]=4 277 B10R1.1 CC1=CC=C(CNN)C=N1 HR119804 [0,1,0,0,0,1|2,0,0]=4 278 B10R1.1 CC1=NC=C(CCBr)C=C1 HR110577 [0,1,0,0,0,1|2,0,0]=4 279 B10R1.1 CCCC1=CN=C(Cl)N=C1 HR101172 [0,1,0,0,0,1|1,0,1]=4 280 B10R1.1 NCCC1=CC=C(Br)C=C1 HR129862 [0,1,0,0,0,1|2,0,0]=4 281 B10R1.1 NCCC1=CC=C(Cl)C=C1 HR134473 [0,1,0,0,0,1|2,0,0]=4 282 B10R1.1 NCCC1=CC=C(F)C=C1 HR122552 [0,1,0,0,0,1|2,0,0]=4 283 B10R1.1 NCCC1=CC=C(N)C=C1 HR117857 [0,1,0,0,0,1|2,0,0]=4 284 B10R1.1 NCCC1=CC=C(N)C=C1 HR132329 [0,1,0,0,0,1|2,0,0]=4 285 B10R1.1 NCCC1=CC=C(O)C=C1 HR125143 [0,1,0,0,0,1|2,0,0]=4 286 B10R1.1 NCCC1=CC=C(O)C=C1 HR129690 [0,1,0,0,0,1|2,0,0]=4 287 B10R1.4 CCCC1=C(C)C=CN=C1 HR152912 [0,1,0,0,0,1|2,0,0]=4 288 B10R1.4 CCCC1=NC=NC=C1Br HR107265 [0,1,0,0,0,1|1,0,1]=4 289 B10R1.4 NCCC1=C(Br)C=CC=C1 HR124317 [0,1,0,0,0,1|2,0,0]=4 290 B10R1.4 NCCC1=C(Br)C=CC=C1 HR147094 [0,1,0,0,0,1|2,0,0]=4 291 B10R1.4 NCCC1=C(Cl)C=CC=C1 HR123339 [0,1,0,0,0,1|2,0,0]=4 292 B10R1.4 NCCC1=C(F)C=CC=C1 HR110592 [0,1,0,0,0,1|2,0,0]=4 293 B10R1.4 NCCC1=C(N)C=CC=C1 HR115501 [0,1,0,0,0,1|2,0,0]=4 294 B10R1.4 NCCC1=C(O)C=CC=C1 HR101392 [0,1,0,0,0,1|2,0,0]=4 295 B10R1.10 CC1=CC=CC(CCN)=N1 HR110232 [0,1,0,0,0,1|1,0,1]=4 296 B10R1.10 CCCC1=CC(N)=NC=C1 HR110640 [0,1,0,0,0,1|2,0,0]=4 297 B10R1.10 NCCC1=CC(Br)=CC=C1 HR122472 [0,1,0,0,0,1|2,0,0]=4 298 B10R1.10 NCCC1=CC(Cl)=CC=C1 HR123086 [0,1,0,0,0,1|2,0,0]=4 299 B10R1.10 NCCC1=CC(F)=CC=C1 HR138031 [0,1,0,0,0,1|2,0,0]=4 300 B10R1.10 NCCC1=CC=CC(N)=C1 HR115502 [0,1,0,0,0,1|2,0,0]=4 301 B10R1.10 NCCc1cccc(Cl)c1 HR112844 [0,1,0,0,0,1|2,0,0]=4 302 B10R1.10 NCCc1cccc(N)c1 HR114446 [0,1,0,0,0,1|2,0,0]=4 303 B10R1.10 NCCc1cccc(O)c1 HR142280 [0,1,0,0,0,1|2,0,0]=4 304 B10R1.15 CC(CN)C1=CC=CC=C1 HR100395 [0,1,0,0,0,1|2,0,0]=4 305 B10R1.15 CC(CN)C1=CC=CC=C1 HR142367 [0,1,0,0,0,1|2,0,0]=4 306 B10R1.15 CC(CN)c1ccccc1 HR146638 [0,1,0,0,0,1|2,0,0]=4 307 B10R1.15 NC(CO)C1=CC=CN=C1 HR148601 [0,1,0,0,0,1|2,0,0]=4 308 B10R1.15 NCC(O)C1=CC=CC=C1 HR124494 [0,1,0,0,0,1|2,0,0]=4 309 B10R1.15 NCC(O)C1=CC=CN=C1 HR115544 [0,1,0,0,0,1|1,0,0]=3 310 B10R1.15 NCC(O)c1ccccc1 HR124760 [0,1,0,0,0,1|2,0,0]=4 311 B10R1.17 CCCCC1=NC=CN=C1 HR117547 [0,1,0,0,0,1|1,0,1]=4 312 B10R1.17 CCNCC1=CC=CN=C1 HR144925 [0,1,0,0,0,1|2,0,0]=4 313 B10R1.17 CCNCC1=CC=NC=C1 HR123024 [0,1,0,0,0,1|2,0,0]=4 314 B10R1.17 CNCCC1=CC=NC=C1 HR145120 [0,1,0,0,0,1|1,0,0]=3 315 B10R1.17 CNCCc1ccccc1 HR117849 [0,1,0,0,0,1|2,0,0]=4 316 B10R1.17 CNCCc1ccccn1 HR108850 [0,1,0,0,0,1|1,0,1]=4 317 B10R1.17 CNCCc1ccccn1 HR138471 [0,1,0,0,0,1|1,0,1]=4 318 B10R1.17 CNCCc1ccccn1 HR138733 [0,1,0,0,0,1|1,0,1]=4 319 B10R1.17 N#CCCC1=CC=NC=C1 HR131271 [0,1,0,0,0,1|1,0,1]=4 320 B10R1.17 NCCCC1=CC=CC=C1 HR143725 [0,1,0,0,0,1|2,0,0]=4 321 B10R1.17 NCCCC1=NC=CC=C1 HR110635 [0,1,0,0,0,1|1,0,1]=4 322 B10R1.17 NCCNC1=CC=CC=C1 HR124669 [0,1,0,0,0,1|2,0,0]=4 323 B10R1.17 NCCOC1=CC=CC=C1 HR138452 [0,1,0,0,0,1|2,0,0]=4 324 B10R1.17 NNCCC1=CC=CC=C1 HR100277 [0,1,0,0,0,1|2,0,0]=4 325 B10R1.17 OCCCC1=CC=NC=C1 HR135105 [0,1,0,0,0,1|2,0,0]=4 326 B10R1.18 CC(C)CC1=NC=CN=C1 HR134173 [0,1,0,0,0,1|1,0,1]=4 327 B10R1.18 N=C(N)CC1=CC=NC=C1 HR114647 [0,1,0,0,0,1|1,0,1]=4 328 B10R1.18 NC(=O)CC1=CC=CN=C1 HR112388 [0,1,0,0,0,1|1,0,1]=4 329 B10R1.16 NCCCC1=CN=C(N)N1 HR119174 [0,2,0,0,0,0|0,0,0]=2 330 B10R1.66 O=C(O)CCC1=CC=CN1 HR147312 [0,2,0,0,0,0|2,0,0]=4 331 B8R1.2 NCC1=CC=CN=C1 HR131367 [0,0,1,1,0,0|1,0,1]=4 332 B8R1.2 NCC1=CC=NC=C1 HR119360 [0,0,1,1,0,0|1,0,1]=4 333 B8R1.2 NCC1=CC=NC=C1 HR146144 [0,0,1,1,0,0|1,0,1]=4 334 B8R1.2 NCC1=CN=CN=C1 HR120018 [0,0,1,1,0,0|0,0,2]=4 335 B8R1.2 NCC1=NC=NC=C1 HR109749 [0,0,1,1,0,0|0,0,2]=4 336 B8R1.5 NC1=CC=CN=C1N HR1296 [0,0,1,1,0,0|0,0,2]=4 337 B8R1.5 NC1=NC=CN=C1N HR111087 [0,0,1,1,0,0|1,0,1]=4 338 B8R1.4 NC1=CN=CC(N)=C1 HR106990 [0,0,1,1,0,0|0,0,2]=4 339 B8R1.4 NC1=CN=CC(N)=N1 HR148747 [0,0,1,1,0,0|1,0,1]=4 340 B8R1.4 O=C1CCNC(=O)N1 HR117246 [0,0,1,1,0,0|2,0,0]=4 341 B10R2.6 C1=CC(C2CC2)=CC=N1 HR152661 [0,0,0,1,0,1|2,0,0]=4 342 B10R2.7 C1=CC=C2NCCC2=C1 HR123117 [0,0,0,1,0,1|2,0,0]=4 343 B10R2.7 C1=CN=C2NCCC2=C1 HR105139 [0,0,0,1,0,1|1,0,0]=3 344 B10R2.7 C1=NC=C2NCCC2=C1 HR117707 [0,0,0,1,0,1|1,0,0]=3 345 B10R2.7 c1cnc2c(c1)CCC2 HR128445 [0,0,0,1,0,1|2,0,0]=4 346 B10R2.2 NC1=NC2=C(CCC2)S1 HR104608 [0,1,0,1,0,0|2,0,0]=4 347 B10R2.2 NC1=NC2=C(CCC2)S1 HR31801 [0,1,0,1,0,0|2,0,0]=4 348 B10R2.2 NC1CC2=NC=CN2C1 HR33799 [0,1,0,1,0,0|2,0,0]=4 349 B10R2.2 SC1Cn2cnc[n+]2C1 HR127929 [0,1,0,1,0,0|2,0,0]=4