0 B12R1.286 C=CCc1ccc(O)c(OC)c1 HR136842 [0,0,0,0,0,0|0,0,0]=0 1 B12R1.286 CCCC1=CC(OC)=C(O)C=C1 HR117956 [0,0,0,0,0,0|0,0,2]=2 2 B12R1.286 COC1=C(Br)C=CC(CC#N)=C1 HR139014 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 HR147364 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.286 COC1=C(O)C=CC(CCN)=C1 HR113785 [0,0,0,0,0,0|1,0,1]=2 5 B12R1.286 COC1=C(O)C=CC(CCN)=C1 HR34140 [0,0,0,0,0,0|1,0,1]=2 6 B12R1.286 C\C=C\C1=CC=C(O)C(OC)=C1 HR134214 [0,0,0,0,0,0|0,0,2]=2 7 B12R1.286 C\C=C\c1ccc(O)c(OC)c1 HR125245 [0,0,0,0,0,0|0,0,2]=2 8 B11R1.189 CNCC1=CC(OC)=CC=C1 HR144818 [1,0,0,0,0,0|1,0,1]=3 9 B11R1.189 COC1=CC=CC(CC#N)=C1 HR125470 [1,0,0,0,0,0|1,0,1]=3 10 B11R1.189 COC1=CC=CC(CC#N)=C1 HR144619 [1,0,0,0,0,0|1,0,1]=3 11 B11R1.189 COC1=CC=CC(CC#N)=N1 HR102765 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.189 COC1=CC=CC(CCN)=C1 HR136244 [1,0,0,0,0,0|1,0,1]=3 13 B11R1.189 COC1=CC=CC(CCO)=C1 HR141693 [1,0,0,0,0,0|1,0,1]=3 14 B11R1.189 COC1=CC=CC(CO[NH3+])=C1 HR105186 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.189 COC1=CC=CC(N=C=O)=C1 HR132620 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.192 C=CCC1=CC=C(O)C(O)=C1 HR139971 [1,0,0,0,0,0|0,0,0]=1 17 B11R1.192 CC1=C(O)C=CC(SC#N)=C1 HR118699 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.192 COCC1=CC(C)=C(Br)C=C1 HR154369 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.192 NCCC1=CC(O)=C(O)C=C1 HR136658 [1,0,0,0,0,0|1,0,1]=3 20 B11R1.192 NCCC1=CC(O)=C(O)C=C1 HR144007 [1,0,0,0,0,0|1,0,1]=3 21 B11R1.192 O=CCC1=CC(Cl)=C(Cl)C=C1 HR147100 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.192 OCCc1ccc(O)c(O)c1 HR131274 [1,0,0,0,0,0|1,0,1]=3 23 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 HR123662 [1,0,0,0,0,0|0,0,0]=1 24 B11R1.280 CCC1=C(Cl)C=CC(C=O)=C1 HR154413 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.280 CCC1=C(Cl)C=CC(CO)=C1 HR154830 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.280 CCC1=C(F)C=CC(CN)=C1 HR150313 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 HR30581 [1,0,0,0,0,0|2,0,0]=3 28 B11R1.280 CCC1=CC(C=O)=C(O)C=C1 HR118333 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.280 CCC1=CC(OC)=C(O)C=C1 HR126495 [1,0,0,0,0,0|0,0,1]=2 30 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 HR112336 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 HR153491 [1,0,0,0,0,0|2,0,0]=3 32 B11R1.280 COC1=C(Br)C=CC(CO)=C1 HR140453 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.280 COC1=C(Br)N=CC(C=O)=C1 HR153071 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.280 COC1=C(Br)N=CC(CO)=C1 HR153966 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.280 COC1=C(C)C=CC(C#N)=C1 HR144718 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.280 COC1=C(C)C=CC(C=O)=C1 HR146605 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 HR154433 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 HR154261 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 HR154442 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.280 COC1=C(Cl)N=CC(CO)=C1 HR153161 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.280 COC1=C(F)C=CC(C#N)=C1 HR103204 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.280 COC1=C(F)C=CC(C=O)=C1 HR1449 [1,0,0,0,0,0|2,0,0]=3 43 B11R1.280 COC1=C(F)C=CC(CBr)=C1 HR115119 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.280 COC1=C(F)C=CC(CO)=C1 HR154002 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.280 COC1=C(N)C=CC(C#N)=C1 HR142109 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.280 COC1=C(N)C=CC(CO)=C1 HR109935 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.280 COC1=C(O)C=CC(C=O)=C1 COCQ01601 [1,0,0,0,0,0|1,0,0]=2 48 B11R1.280 COC1=C(O)C=CC(C=O)=C1 CUSA07106 [1,0,0,0,0,0|1,0,0]=2 49 B11R1.280 COC1=C(O)C=CC(C=O)=C1 HR135364 [1,0,0,0,0,0|1,0,0]=2 50 B11R1.280 COC1=C(O)C=CC(CN)=C1 HR128201 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.280 COC1=C(O)C=CC(CO)=C1 HR136664 [1,0,0,0,0,0|1,0,0]=2 52 B11R1.280 COC1=CC(C=O)=CN=C1Cl HR152748 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.280 COC1=CC(C=O)=CN=C1F HR152630 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.280 COC1=CC(OC)=C(Br)C=C1 HR131596 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.280 COC1=CC(OC)=C(Cl)C=C1 HR156624 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.280 COC1=CC(OC)=C(F)C=C1 HR112366 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.280 COC1=CC(OC)=C(N)C=C1 HR134424 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.280 COC1=CC(OC)=C(O)C=C1 HR112880 [1,0,0,0,0,0|1,0,1]=3 59 B11R1.280 COC1=CC=C(O)C(OC)=N1 HR152838 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.280 CSC1=C(Br)C=CC(C=O)=C1 HR155274 [1,0,0,0,0,0|2,1,0]=4 61 B11R1.280 CSC1=C(C)C=CC(C=O)=C1 HR154285 [1,0,0,0,0,0|2,1,0]=4 62 B11R1.280 CSC1=C(F)C=CC(C=O)=C1 HR154009 [1,0,0,0,0,0|2,1,0]=4 63 B11R1.280 CSC1=C(F)C=CC(CO)=C1 HR154160 [1,0,0,0,0,0|2,1,0]=4 64 B11R1.280 O=CC1=CC(C=O)=C(O)C=C1 HR112384 [1,0,0,0,0,0|3,0,0]=4 65 B13R1.49 CCC(=O)C1=CC(OC)=C(O)C=C1 HR137395 [0,1,0,0,0,0|0,0,3]=4 66 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 HR130025 [0,1,0,0,0,0|1,0,2]=4 67 B13R1.49 COC1=C(O)C=CC(C(=O)CBr)=C1 HR120647 [0,1,0,0,0,0|1,0,2]=4 68 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 HR139484 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 HR147027 [0,1,0,0,0,0|2,0,0]=3 70 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 HR132400 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.52 COC1=C(O)C=CC(CC(C)=O)=C1 HR138994 [0,1,0,0,0,0|0,0,1]=2 72 B13R1.386 C=CCC1=CC=C(OC)C(OC)=C1 HR129493 [0,1,0,0,0,0|0,0,0]=1 73 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 HR130464 [0,1,0,0,0,0|1,0,1]=3 74 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 HR132577 [0,1,0,0,0,0|1,0,1]=3 75 B13R1.386 COC1=C(OC)C=C(CCO)C=C1 HR133802 [0,1,0,0,0,0|1,0,1]=3 76 B13R1.386 COC1=C(OC)C=C(N=C=O)C=C1 HR133914 [0,1,0,0,0,0|2,0,1]=4 77 B13R1.386 COC1=C(OC)C=C(\C=N\O)C=C1 HR112657 [0,1,0,0,0,0|2,0,1]=4 78 B13R1.387 CCCC1=CC(C(C)=O)=C(O)C=C1 HR150881 [0,1,0,0,0,0|1,0,2]=4 79 B13R1.575 COCOC1=CC(OC)=C(Br)C=C1 HR155313 [0,1,0,0,0,0|2,0,1]=4 80 B13R1.575 COCOC1=CC(OC)=C(Cl)C=C1 HR155291 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.575 COc1cc(CCCO)ccc1O HR107916 [0,1,0,0,0,0|0,0,2]=3 82 B13R2.121 COC1=C2C=CNC2=NC=C1Cl HR150117 [0,0,0,1,0,0|3,0,0]=4 83 B13R2.449 BrCCC1=CC2=C(C=C1)OCC2 HR127986 [0,0,0,1,0,0|2,0,1]=4 84 B13R2.449 CCNC1=CC2=C(C=C1)OCO2 HR130252 [0,0,0,1,0,0|1,0,2]=4 85 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 HR103631 [0,0,0,1,0,0|1,0,1]=3 86 B13R2.449 ClCCC1=CC2=C(C=C1)OCC2 HR140506 [0,0,0,1,0,0|2,0,1]=4 87 B13R2.449 N#CCc1ccc2c(c1)OCO2 HR102242 [0,0,0,1,0,0|1,0,1]=3 88 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 HR130214 [0,0,0,1,0,0|1,0,1]=3 89 B13R2.449 O=C=NC1=CC2=C(C=C1)OCO2 HR116317 [0,0,0,1,0,0|2,0,1]=4 90 B13R2.449 OCCC1=CC2=C(C=C1)OCC2 HR112488 [0,0,0,1,0,0|2,0,1]=4 91 B13R2.599 COC1=C(Br)C=C2C=CNC2=N1 HR109126 [0,0,0,1,0,0|3,0,0]=4 92 B13R2.599 COC1=C(Br)C=C2C=NNC2=C1 HR114051 [0,0,0,1,0,0|3,0,0]=4 93 B13R2.599 COC1=C(C)C=C2C=CNC2=C1 HR109430 [0,0,0,1,0,0|2,0,0]=3 94 B13R2.599 COC1=C(C)C=C2NC=CC2=C1 HR119540 [0,0,0,1,0,0|2,0,1]=4 95 B13R2.599 COC1=C(Cl)C=C2NC=CC2=C1 HR103153 [0,0,0,1,0,0|2,0,1]=4 96 B13R2.599 COC1=C(F)C=C2C=CNC2=C1 HR111651 [0,0,0,1,0,0|2,0,0]=3 97 B13R2.599 COC1=C(O)C=C2C=NNC2=C1 HR107921 [0,0,0,1,0,0|2,0,0]=3 98 B10R1.10 CC1=CC=CC(CC#N)=C1 HR124223 [2,0,0,0,0,0|1,0,1]=4 99 B10R1.10 CC1=CC=CC(CCO)=C1 HR126660 [2,0,0,0,0,0|1,0,1]=4 100 B10R1.10 Cc1cccc(C[Mg]Cl)c1 HR113056 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.10 NCCc1cccc(O)c1 HR142280 [2,0,0,0,0,0|1,0,1]=4 102 B10R1.10 NNCC1=CC(O)=CC=C1 HR30014 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.10 O=CCC1=CC(Br)=CC=C1 HR118019 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.172 C#CC1=CC=CC(OC)=C1 HR116055 [2,0,0,0,0,0|0,0,2]=4 105 B10R1.172 C=CC1=NC(OC)=CC=C1 HR113314 [2,0,0,0,0,0|1,0,0]=3 106 B10R1.172 CCC1=CC(SC)=CC=C1 HR154156 [2,0,0,0,0,0|0,1,1]=4 107 B10R1.172 CCC1=CC=CC(C=O)=C1 HR3073 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.172 CCC1=CC=CC(CO)=C1 HR154155 [2,0,0,0,0,0|2,0,0]=4 109 B10R1.172 CCC1=NC(OC)=CC=C1 HR152523 [2,0,0,0,0,0|1,0,1]=4 110 B10R1.172 CCc1cccc(CC)c1 HR121574 [2,0,0,0,0,0|1,0,1]=4 111 B10R1.172 COC1=CC(C=O)=NC=C1 HR32296 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.172 COC1=CC(CN)=NC=C1 HR31884 [2,0,0,0,0,0|2,0,0]=4 113 B10R1.172 COC1=CC(CN)=NC=C1 HR33722 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.172 COC1=CC(CO)=NC=C1 HR145024 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.172 COC1=CC(SC)=CC=C1 HR140753 [2,0,0,0,0,0|1,0,1]=4 116 B10R1.172 COC1=CC=CC(C#N)=C1 HR121362 [2,0,0,0,0,0|1,0,1]=4 117 B10R1.172 COC1=CC=CC(C=O)=C1 HR128606 [2,0,0,0,0,0|1,0,0]=3 118 B10R1.172 COC1=CC=CC(C=O)=N1 HR127263 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.172 COC1=CC=CC(CBr)=C1 HR121376 [2,0,0,0,0,0|1,0,0]=3 120 B10R1.172 COC1=CC=CC(CCl)=C1 HR138731 [2,0,0,0,0,0|1,0,0]=3 121 B10R1.172 COC1=CC=CC(CN)=C1 HR117311 [2,0,0,0,0,0|1,0,0]=3 122 B10R1.172 COC1=CC=CC(CN)=N1 HR107631 [2,0,0,0,0,0|2,0,0]=4 123 B10R1.172 COC1=CC=CC(CO)=C1 HR124149 [2,0,0,0,0,0|1,0,0]=3 124 B10R1.172 COC1=CC=CC(CO)=N1 HR109997 [2,0,0,0,0,0|2,0,0]=4 125 B10R1.172 COC1=CC=CC(NN)=C1 HR120510 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.172 COC1=CC=CC(OC)=C1 HR128107 [2,0,0,0,0,0|1,0,1]=4 127 B10R1.172 COC1=CC=CC([Mg]Br)=C1 HR108623 [2,0,0,0,0,0|2,0,0]=4 128 B10R1.172 COC1=CN=CC(C=O)=C1 HR116459 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.172 COC1=CN=CC(CO)=C1 HR104545 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.172 COC1=NC=CC(C=O)=C1 HR135456 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.172 COC1=NC=CC(CO)=C1 HR108626 [2,0,0,0,0,0|2,0,0]=4 132 B10R1.1 C=CCC1=CC=C(O)C=C1 HOJB00101 [2,0,0,0,0,0|0,0,0]=2 133 B10R1.1 C=COC1=CC=C(Br)C=C1 HR153896 [2,0,0,0,0,0|2,0,0]=4 134 B10R1.1 CC1=CC=C(CC=O)C=C1 HR126727 [2,0,0,0,0,0|2,0,0]=4 135 B10R1.1 CCCC1=CC=C(O)C=C1 HR132793 [2,0,0,0,0,0|0,0,2]=4 136 B10R1.1 COCC1=CC=C(O)C=C1 HR118976 [2,0,0,0,0,0|1,0,1]=4 137 B10R1.1 N#CCC1=CC=C(O)C=C1 HR134484 [2,0,0,0,0,0|1,0,1]=4 138 B10R1.1 NCCC1=CC=C(O)C=C1 HR125143 [2,0,0,0,0,0|1,0,1]=4 139 B10R1.1 NCCC1=CC=C(O)C=C1 HR129690 [2,0,0,0,0,0|1,0,1]=4 140 B10R1.1 O=CCC1=CC=C(Br)C=C1 HR109805 [2,0,0,0,0,0|2,0,0]=4 141 B10R1.1 O=CCC1=CC=C(Cl)C=C1 HR117587 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.1 O=CCC1=CC=C(F)C=C1 HR150460 [2,0,0,0,0,0|2,0,0]=4 143 B10R1.1 OCCC1=CC=C(O)C=C1 HR128389 [2,0,0,0,0,0|1,0,1]=4 144 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 HR147419 [2,0,0,0,0,0|2,0,0]=4 145 B10R1.176 CC1=C(Br)C=CC(CO)=C1 HR104908 [2,0,0,0,0,0|2,0,0]=4 146 B10R1.176 CC1=C(C)C=C(C=O)C=C1 HR136647 [2,0,0,0,0,0|2,0,0]=4 147 B10R1.176 CC1=C(C)C=C(CBr)C=C1 HR148530 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.176 CC1=C(C)C=C(CCl)C=C1 HR134054 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.176 CC1=C(C)C=C(CN)C=C1 HR134320 [2,0,0,0,0,0|2,0,0]=4 150 B10R1.176 CC1=C(C)C=C(CO)C=C1 HR133520 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 HR106839 [2,0,0,0,0,0|2,0,0]=4 152 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 HR154352 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.176 CC1=C(F)C=CC(C=O)=C1 HR133009 [2,0,0,0,0,0|2,0,0]=4 154 B10R1.176 CC1=C(F)C=CC(CN)=C1 HR110135 [2,0,0,0,0,0|2,0,0]=4 155 B10R1.176 CC1=C(O)C=C(C=O)C=C1 HR153769 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.176 CC1=C(O)C=CC(C=O)=C1 HR32117 [2,0,0,0,0,0|1,0,0]=3 157 B10R1.176 CC1=CC(C=O)=CN=C1O HR31912 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.176 CCC1=CC(N)=C(O)C=C1 HR32286 [2,0,0,0,0,0|1,0,1]=4 159 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 HR33554 [2,0,0,0,0,0|1,0,1]=4 160 B10R1.176 CCC1=CC(O)=C(N)C=C1 HR107994 [2,0,0,0,0,0|1,0,1]=4 161 B10R1.176 CCC1=CC=C(O)C(O)=C1 HR30585 [2,0,0,0,0,0|0,0,1]=3 162 B10R1.176 COC1=CC(C)=C(O)C=C1 HR153982 [2,0,0,0,0,0|1,0,1]=4 163 B10R1.176 COC1=CC=C(O)C(O)=C1 HR32130 [2,0,0,0,0,0|1,0,1]=4 164 B10R1.176 CSC1=CC(C)=C(O)C=C1 HR154883 [2,0,0,0,0,0|1,0,1]=4 165 B10R1.176 N#CC1=CC(O)=C(O)C=C1 HR3120 [2,0,0,0,0,0|1,0,1]=4 166 B10R1.176 NCC1=CC(O)=C(O)C=C1 HR144709 [2,0,0,0,0,0|1,0,0]=3 167 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 HR3778 [2,0,0,0,0,0|2,0,0]=4 168 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 POCQ01903 [2,0,0,0,0,0|2,0,0]=4 169 B10R1.176 O=CC1=CC(F)=C(O)C=C1 HR1443 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.176 O=CC1=CC(I)=C(O)C=C1 HR143092 [2,0,0,0,0,0|2,0,0]=4 171 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 HR146258 [2,0,0,0,0,0|2,0,0]=4 172 B10R1.176 O=CC1=CC(O)=C(F)C=C1 HR108620 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.176 O=CC1=CC(O)=C(O)C=C1 HR8231 [2,0,0,0,0,0|1,0,0]=3 174 B10R1.176 OCC1=CC(Br)=C(O)C=C1 HR115579 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.176 OCC1=CC(O)=C(Cl)C=C1 HR153870 [2,0,0,0,0,0|2,0,0]=4 176 B10R1.176 OCC1=CC(O)=C(F)C=C1 HR154466 [2,0,0,0,0,0|2,0,0]=4 177 B10R1.30 CC1=CC(C#N)=C(O)C=C1 HR31896 [2,0,0,0,0,0|2,0,0]=4 178 B10R1.30 CC1=CC(C=O)=C(O)C=C1 HR118603 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.30 CC1=CC(CO)=C(O)C=C1 HR155912 [2,0,0,0,0,0|2,0,0]=4 180 B10R1.30 CCC1=C(O)C=CC(Br)=C1 HR154665 [2,0,0,0,0,0|2,0,0]=4 181 B10R1.30 CCC1=C(O)C=CC(F)=C1 HR110444 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.30 CCC1=NC(C)=CC=C1O HR105919 [2,0,0,0,0,0|2,0,0]=4 183 B10R1.30 CCC1=NC(C)=CC=C1O HR127004 [2,0,0,0,0,0|2,0,0]=4 184 B10R1.30 CCC1=NC(C)=CC=C1O HR129578 [2,0,0,0,0,0|2,0,0]=4 185 B10R1.30 CNc1cc(N)ccc1O HR101307 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.30 COC1=C(Br)C=CC(Br)=C1 HR5357 [2,0,0,0,0,0|2,0,0]=4 187 B10R1.30 COC1=C(Br)C=CC(C)=C1 HR4136 [2,0,0,0,0,0|1,0,0]=3 188 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 HR105792 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.30 COC1=C(Br)C=CC(F)=C1 ANSA06434 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.30 COC1=C(Br)C=CC(I)=C1 HR153490 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.30 COC1=C(Br)C=CC(N)=C1 HR3794 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.30 COC1=C(Br)C=CC(O)=C1 HR33720 [2,0,0,0,0,0|2,0,0]=4 193 B10R1.30 COC1=C(C)C=CC(Br)=C1 HR153423 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.30 COC1=C(C)C=CC(C)=C1 HR144892 [2,0,0,0,0,0|1,0,0]=3 195 B10R1.30 COC1=C(C)C=CC(F)=C1 HR153543 [2,0,0,0,0,0|2,0,0]=4 196 B10R1.30 COC1=C(C)C=CC(N)=C1 HR146631 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.30 COC1=C(C)C=CC(O)=C1 HR154431 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 ECCQ01306 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 HR142755 [2,0,0,0,0,0|2,0,0]=4 200 B10R1.30 COC1=C(Cl)C=CC(F)=C1 HR105802 [2,0,0,0,0,0|2,0,0]=4 201 B10R1.30 COC1=C(Cl)C=CC(I)=C1 HR5289 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.30 COC1=C(Cl)C=CC(N)=C1 HR129951 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.30 COC1=C(Cl)C=CC(O)=C1 HR30594 [2,0,0,0,0,0|2,0,0]=4 204 B10R1.30 COC1=C(F)C=CC(Br)=C1 HR102218 [2,0,0,0,0,0|2,0,0]=4 205 B10R1.30 COC1=C(F)C=CC(F)=C1 HR118222 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.30 COC1=C(F)C=CC(N)=C1 HR129361 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.30 COC1=C(F)C=CC(O)=C1 HR14358 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.30 COC1=C(I)C=CC(Br)=C1 HR141139 [2,0,0,0,0,0|2,0,0]=4 209 B10R1.30 COC1=C(I)C=CC(Cl)=C1 HR5293 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.30 COC1=C(I)C=CC(F)=C1 HR154051 [2,0,0,0,0,0|2,0,0]=4 211 B10R1.30 COC1=C(I)C=CC(I)=C1 HR31862 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.30 COC1=C(N)C=CC(Br)=C1 HR2258 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.30 COC1=C(N)C=CC(Cl)=C1 HR143042 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.30 COC1=C(N)C=CC(F)=C1 HR141428 [2,0,0,0,0,0|2,0,0]=4 215 B10R1.30 COC1=C(N)C=CC(N)=C1 HR138327 [2,0,0,0,0,0|2,0,0]=4 216 B10R1.30 COC1=C(O)C=CC(Br)=C1 CUSA07101 [2,0,0,0,0,0|1,0,0]=3 217 B10R1.30 COC1=C(O)C=CC(C)=C1 HR129473 [2,0,0,0,0,0|0,0,0]=2 218 B10R1.30 COC1=C(O)C=CC(Cl)=C1 HR140558 [2,0,0,0,0,0|1,0,0]=3 219 B10R1.30 COC1=C(O)C=CC(F)=C1 HR31578 [2,0,0,0,0,0|1,0,0]=3 220 B10R1.30 COC1=C(O)C=CC(N)=C1 HR121551 [2,0,0,0,0,0|1,0,0]=3 221 B10R1.30 COC1=C(O)C=CC(N)=C1 HR31961 [2,0,0,0,0,0|1,0,0]=3 222 B10R1.30 COC1=C(O)C=CC(O)=C1 HR134070 [2,0,0,0,0,0|1,0,0]=3 223 B10R1.30 COC1=CC(=O)C=CC1=O HR114851 [2,0,0,0,0,0|1,0,1]=4 224 B10R1.30 COC1=CC(C)=CN=C1F HR152626 [2,0,0,0,0,0|2,0,0]=4 225 B10R1.30 COC1=NC(C)=CC=C1Br HR8122 [2,0,0,0,0,0|2,0,0]=4 226 B10R1.30 COC1=NC(C)=CC=C1F HR106695 [2,0,0,0,0,0|2,0,0]=4 227 B10R1.30 COC1=NC(C)=CC=C1N HR1266 [2,0,0,0,0,0|2,0,0]=4 228 B10R1.30 CSC1=C(Br)C=CC(C)=C1 HR154128 [2,0,0,0,0,0|1,1,0]=4 229 B10R1.30 CSC1=C(Cl)C=CC(C)=C1 HR154050 [2,0,0,0,0,0|1,1,0]=4 230 B10R1.30 CSC1=C(F)C=CC(C)=C1 HR154006 [2,0,0,0,0,0|1,1,0]=4 231 B12R1.41 COC1=CC(CC#N)=CC(F)=C1 HR148732 [1,1,0,0,0,0|1,0,1]=4 232 B12R1.270 COC1=CC(CC#N)=C(F)C=C1 HR146781 [1,1,0,0,0,0|1,0,1]=4 233 B12R1.270 COCC1=C(Br)C=CC(OC)=C1 HR154247 [1,1,0,0,0,0|1,0,1]=4 234 B12R1.280 C=CCC1=CC=CC(C=O)=C1O HR102450 [1,1,0,0,0,0|2,0,0]=4 235 B12R1.280 COCC1=CC=CC(OC)=C1Br HR155501 [1,1,0,0,0,0|1,0,1]=4 236 B12R1.382 COCOC1=CC=CC(OC)=C1 HR155334 [1,1,0,0,0,0|1,0,1]=4 237 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 HR123940 [1,1,0,0,0,0|1,0,0]=3 238 B12R1.438 COC1=CC=CC(NC(N)=S)=C1 HR112068 [1,1,0,0,0,0|2,0,0]=4 239 B12R1.19 CC(=O)Cc1ccc(O)c(O)c1 HR111398 [1,1,0,0,0,0|0,0,1]=3 240 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 HR116124 [1,1,0,0,0,0|1,0,0]=3 241 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 HR129360 [1,1,0,0,0,0|2,0,0]=4 242 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 HR101985 [1,1,0,0,0,0|2,0,0]=4 243 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 HR143146 [1,1,0,0,0,0|2,0,0]=4 244 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 HR117976 [1,1,0,0,0,0|1,0,0]=3 245 B12R1.288 COC1=C(O)C=C(\C=C\Br)C=C1 FOSA03903 [1,1,0,0,0,0|1,0,1]=4 246 B12R1.367 NCC(O)c1ccc(O)c(O)c1 HR137671 [1,1,0,0,0,0|1,0,1]=4 247 B12R1.367 NCC(O)c1ccc(O)c(O)c1 HR138474 [1,1,0,0,0,0|1,0,1]=4 248 B12R1.367 NCC(O)c1ccc(O)c(O)c1 HR143907 [1,1,0,0,0,0|1,0,1]=4 249 B12R1.385 CNCCc1ccc(O)c(O)c1 HR109293 [1,1,0,0,0,0|0,0,2]=4 250 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 HR114817 [1,1,0,0,0,0|2,0,0]=4 251 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 HR123051 [1,1,0,0,0,0|2,0,0]=4 252 B12R1.56 COC1=C(C)C=CC(C(C)C)=C1 HR115722 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 HR125689 [1,1,0,0,0,0|2,0,0]=4 254 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 HR105571 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 IDJL00708 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 HR32549 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.56 COC1=C(O)C=CC(C(=O)Cl)=C1 HR146292 [1,1,0,0,0,0|1,0,0]=3 258 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 HR129205 [1,1,0,0,0,0|1,0,0]=3 259 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 HR135201 [1,1,0,0,0,0|0,0,1]=3 260 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 HR32030 [1,1,0,0,0,0|2,0,0]=4 261 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O HR134455 [1,1,0,0,0,0|2,0,0]=4 262 B12R1.56 COc1cc(C(C)=O)ccc1F HR112970 [1,1,0,0,0,0|1,0,1]=4 263 B12R1.78 C#CC1=CC(OC)=C(OC)C=C1 HR118236 [1,1,0,0,0,0|0,0,2]=4 264 B12R1.78 C=CC1=CC(OC)=C(OC)C=C1 HR114137 [1,1,0,0,0,0|0,0,0]=2 265 B12R1.78 COC1=C(C#N)C=CC(C=O)=C1 HR153689 [1,1,0,0,0,0|2,0,0]=4 266 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 HR136295 [1,1,0,0,0,0|1,0,1]=4 267 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 HR30003 [1,1,0,0,0,0|1,0,0]=3 268 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 HR104002 [1,1,0,0,0,0|1,0,0]=3 269 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 HR125298 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.78 COC1=C(OC)C=C(CN)C=C1 HR134803 [1,1,0,0,0,0|1,0,0]=3 271 B12R1.78 COC1=C(OC)C=C(CO)C=C1 HR130194 [1,1,0,0,0,0|1,0,0]=3 272 B12R1.78 COC1=CC(OC)=C(CO)C=C1 HR126922 [1,1,0,0,0,0|1,0,1]=4 273 B12R1.78 COC1=CC(OC)=C(OC)C=C1 HR131050 [1,1,0,0,0,0|1,0,1]=4 274 B12R1.78 COc1cc(C=O)cnc1OC HR156074 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.300 COC1=C(F)C(C)=CC(C=O)=C1 HR156353 [1,1,0,0,0,0|2,0,0]=4 276 B12R1.300 COC1=C(O)C(Br)=CC(C=O)=C1 HR124283 [1,1,0,0,0,0|1,0,0]=3 277 B12R1.300 COC1=C(O)C(I)=CC(C=O)=C1 HR139856 [1,1,0,0,0,0|1,0,0]=3 278 B12R1.300 COC1=C(O)C(O)=CC(C=O)=C1 HR115075 [1,1,0,0,0,0|1,0,0]=3 279 B12R1.300 COC1=CC(C=O)=CC(Cl)=C1O HR104411 [1,1,0,0,0,0|1,0,0]=3 280 B12R1.300 COC1=CC(C=O)=CC(F)=C1O HR10464 [1,1,0,0,0,0|1,0,0]=3 281 B12R1.300 COC1=CC(CO)=CC(F)=C1O HR155818 [1,1,0,0,0,0|1,0,0]=3 282 B12R1.449 COC1=CC(C=O)=C(Br)C=C1O HR122205 [1,1,0,0,0,0|1,0,0]=3 283 B12R1.449 COC1=CC(C=O)=C(F)C=C1F HR154895 [1,1,0,0,0,0|2,0,0]=4 284 B12R1.449 COC1=CC(CO)=C(F)C=C1F HR154896 [1,1,0,0,0,0|2,0,0]=4 285 B12R1.449 COC1=CC(OC)=C(O)C=C1Br HR155983 [1,1,0,0,0,0|1,0,1]=4 286 B12R1.449 COC1=CC(OC)=C(O)C=C1Cl HR155978 [1,1,0,0,0,0|1,0,1]=4 287 B12R1.453 CCC1=CC(C(C)=O)=C(O)C=C1 HR150882 [1,1,0,0,0,0|1,0,1]=4 288 B12R1.654 COC1=C(Cl)C=CC(C=O)=C1F HR156636 [1,1,0,0,0,0|2,0,0]=4 289 B12R1.654 COC1=C(Cl)C=CC(CO)=C1F HR156028 [1,1,0,0,0,0|2,0,0]=4 290 B12R1.654 COC1=C(F)C=CC(C=O)=C1F HR107492 [1,1,0,0,0,0|2,0,0]=4 291 B14R1.1864 CCC(O)C1=CC(OC)=C(OC)C=C1 HR115586 [0,2,0,0,0,0|0,0,2]=4 292 B14R1.1864 COC1=C(OC)C=C(C(=O)C=O)C=C1 HR147327 [0,2,0,0,0,0|1,0,1]=4 293 B14R1.343 COC1=C(O)C(F)=CC(CN(C)C)=C1 HR154021 [0,2,0,0,0,0|1,0,1]=4 294 B14R1.3651 COC1=C(OC)C=C(CC(=O)Cl)C=C1 IVSA07711 [0,2,0,0,0,0|1,0,0]=3 295 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 HR124262 [0,2,0,0,0,0|1,0,0]=3 296 B14R1.3651 COC1=C(OC)C=C(CC(C)=O)C=C1 HR132053 [0,2,0,0,0,0|0,0,1]=3 297 B14R1.3651 COC1=C(OC)C=C(CC(C)O)C=C1 HR112973 [0,2,0,0,0,0|0,0,2]=4 298 B14R1.3651 COC1=C(OC)C=C(CC(C)O)C=C1 HR113285 [0,2,0,0,0,0|0,0,2]=4 299 B14R1.3651 COC1=C(OC)C=C(NC(C)=O)C=C1 HR121286 [0,2,0,0,0,0|1,0,1]=4 300 B14R1.793 CNCCC1=CC(OC)=C(OC)C=C1 ECCQ01307 [0,2,0,0,0,0|0,0,2]=4 301 B14R1.793 CNCCc1ccc(OC)c(OC)c1 HR122449 [0,2,0,0,0,0|0,0,2]=4 302 B14R1.793 COC1=C(OC)C=C(\C=C\C#N)C=C1 HR138363 [0,2,0,0,0,0|0,0,2]=4 303 B14R1.10285 COC1=C(OC)C(Cl)=C(CCN)C=C1 HR131606 [0,2,0,0,0,0|1,0,1]=4 304 B14R1.14946 C=CCC1=C(O)C=C(OC)C(OC)=C1 HR107596 [0,2,0,0,0,0|0,0,0]=2 305 B14R1.42 COC1=C(F)C=CC(\C=C\C(=O)O)=C1 HR140794 [0,2,0,0,0,0|1,0,1]=4 306 B14R1.42 COC1=C(O)C=CC(CCC(=O)O)=C1 HR114574 [0,2,0,0,0,0|0,0,1]=3 307 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 HR131096 [0,2,0,0,0,0|0,0,1]=3 308 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 HR124275 [0,2,0,0,0,0|0,0,1]=3 309 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 HR138641 [0,2,0,0,0,0|0,0,1]=3 310 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 HR141282 [0,2,0,0,0,0|0,0,1]=3 311 B14R1.42 COc1cc(\C=C\C(=O)[O-])ccc1O HR131061 [0,2,0,0,0,0|0,0,1]=3 312 B14R1.3236 C=CCC1=CC(OC)=C(O)C(OC)=C1 HR141894 [0,2,0,0,0,0|0,0,0]=2 313 B12R2.44 CCC1=CC=C2C=CNC2=C1 HR110902 [1,0,0,1,0,0|2,0,0]=4 314 B12R2.44 COC1=CC2=C(C=C1)N=CN2 HR140727 [1,0,0,1,0,0|2,0,0]=4 315 B12R2.44 COC1=CC2=C(C=C1)N=CS2 HR103327 [1,0,0,1,0,0|2,0,0]=4 316 B12R2.44 COC1=CC2=C(C=C1)OC=C2 HR106682 [1,0,0,1,0,0|1,0,1]=4 317 B12R2.44 COC1=CC2=C(C=CN2)C=N1 HR110074 [1,0,0,1,0,0|2,0,0]=4 318 B12R2.44 COC1=CC2=C(C=CO2)C=C1 HR32410 [1,0,0,1,0,0|1,0,0]=3 319 B12R2.44 COC1=CC2=C(C=CS2)C=C1 HR32404 [1,0,0,1,0,0|1,0,0]=3 320 B12R2.44 COC1=CC=C2C=CNC2=C1 HR1701 [1,0,0,1,0,0|1,0,0]=3 321 B12R2.44 COC1=CC=C2C=CNC2=N1 HR118604 [1,0,0,1,0,0|2,0,0]=4 322 B12R2.44 COC1=CC=C2C=NNC2=C1 HR104374 [1,0,0,1,0,0|2,0,0]=4 323 B12R2.44 COC1=CC=C2CNCC2=C1 HR103208 [1,0,0,1,0,0|1,0,1]=4 324 B12R2.44 COC1=CC=C2NC=CC2=C1 HR127042 [1,0,0,1,0,0|1,0,1]=4 325 B12R2.44 COC1=CC=C2NCCC2=C1 HR106518 [1,0,0,1,0,0|1,0,1]=4 326 B12R2.315 COC1=C2C=CNC2=CC=C1 HR129729 [1,0,0,1,0,0|1,0,0]=3 327 B12R2.315 COC1=C2C=CNC2=NC=C1 HR30147 [1,0,0,1,0,0|2,0,0]=4 328 B12R2.315 COC1=C2C=NNC2=CC=C1 HR115255 [1,0,0,1,0,0|2,0,0]=4 329 B12R2.315 COC1=C2CNCC2=CC=C1 HR33264 [1,0,0,1,0,0|1,0,1]=4 330 B12R2.315 COC1=C2NC=CC2=CC=C1 HR129989 [1,0,0,1,0,0|1,0,1]=4 331 B12R2.315 COC1=CC=CC2=C1N=CS2 HR111021 [1,0,0,1,0,0|2,0,0]=4 332 B12R2.315 COC1=NC=CC2=C1C=CN2 HR107551 [1,0,0,1,0,0|2,0,0]=4 333 B12R2.82 OC1=CC=C2NC=CC2=C1F HR116343 [1,0,0,1,0,0|2,0,0]=4 334 B12R2.100 CC1=C(Br)C=C2C=CNC2=C1 HR111342 [1,0,0,1,0,0|2,0,0]=4 335 B12R2.100 CC1=C(O)C=C2C=CNC2=N1 HR150143 [1,0,0,1,0,0|2,0,0]=4 336 B12R2.100 CC1=C(O)C=C2C=NNC2=C1 HR113020 [1,0,0,1,0,0|2,0,0]=4 337 B12R2.100 OC1=C(F)C=C2NC=CC2=C1 HR102019 [1,0,0,1,0,0|2,0,0]=4 338 B12R2.100 OC1=C(O)C=C2NC=CC2=C1 HR106855 [1,0,0,1,0,0|1,0,0]=3 339 B12R2.100 Oc1cc2c(cc1O)NCC2 HR128910 [1,0,0,1,0,0|1,0,1]=4 340 B14R2.966 O=CC(=O)C1=CC2=C(C=C1)OCO2 HR148721 [0,1,0,1,0,0|1,0,1]=4 341 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCC2 HR132714 [0,1,0,1,0,0|2,0,0]=4 342 B14R2.1008 O=C(O)Cc1ccc2c(c1)OCO2 ATXF02508 [0,1,0,1,0,0|1,0,0]=3 343 B14R2.82 COC1=C(OC)C=C2NC=CC2=C1 HR140825 [0,1,0,1,0,0|1,0,0]=3 344 B14R2.82 COC1=C(OC)C=C2NN=CC2=C1 HR115144 [0,1,0,1,0,0|2,0,0]=4 345 B14R2.82 COC1=CC2=C(C=C1OC)NC=N2 HR107530 [0,1,0,1,0,0|2,0,0]=4 346 B14R2.1238 COC1=CC=C2NC=CC2=C1OC HR33734 [0,1,0,1,0,0|1,0,0]=3 347 B14R2.11593 COC1=C(OC)C=C2C(=O)CC2=C1 IVSA07715 [0,1,0,1,0,0|1,0,0]=3 348 B14R2.203 COC1=C(Br)C=CC2=CC=CC=C21 HR119362 [0,1,0,1,0,0|1,0,1]=4 349 B14R2.1128 COC1=C(O)C=C2C=NCCC2=C1 HR109560 [0,1,0,1,0,0|0,0,1]=3 350 B14R2.1416 COC1=C(F)C=C2C(=O)CCC2=C1 HR108828 [0,1,0,1,0,0|1,0,1]=4 351 B14R3.3022 C1=CC2=C(C=C3OCOC3=C2)N1 HR116703 [0,0,0,2,0,0|1,0,0]=3