0 B12R1.308 C=C(OCC)C1=C(C)C=CN=C1 HR143272 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.308 CC1=C(C(=O)CC#N)C=CC=C1 HR115767 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.308 CCCC(=O)c1ccccc1O HR131433 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.308 CCOC(=O)C1=C(Br)C=CC=C1 HR3937 [0,0,0,0,0,0|1,0,0]=1 4 B12R1.308 CCOC(=O)C1=C(Br)C=CN=C1 HR156134 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.308 CCOC(=O)C1=C(Br)C=NC=C1 HR17515 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.308 CCOC(=O)C1=C(Br)N=CC=C1 HR113599 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 HR135267 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.308 CCOC(=O)C1=C(C)N=CC=C1 HR120106 [0,0,0,0,0,0|2,0,0]=2 9 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 HR132470 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.308 CCOC(=O)C1=C(Cl)C=NC=C1 HR153064 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 AVSA08201 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 HR131948 [0,0,0,0,0,0|1,0,0]=1 13 B12R1.308 CCOC(=O)C1=C(I)C=CC=C1 HR139013 [0,0,0,0,0,0|1,0,0]=1 14 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 HR16750 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.308 CCOC(=O)C1=C(N)N=CC=C1 HR123220 [0,0,0,0,0,0|2,0,0]=2 16 B12R1.308 CCOC(=O)C1=C(O)C=CC=C1 HR133809 [0,0,0,0,0,0|0,0,0]=0 17 B12R1.308 CCOC(=O)C1=CC=CC=C1N HR131822 [0,0,0,0,0,0|1,0,0]=1 18 B12R1.308 CCOC(=O)C1=CC=CC=C1S HR101914 [0,0,0,0,0,0|0,1,0]=1 19 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl HR120423 [0,0,0,0,0,0|2,0,0]=2 20 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl HR146872 [0,0,0,0,0,0|2,0,0]=2 21 B12R1.308 CCOC(=O)C1=CN=CN=C1C HR114062 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.308 CCOC(=O)C1=CN=CN=C1Cl HR113423 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.308 CCOC(=O)C1=CN=CN=C1N HR105056 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.308 CCOC(=O)C1=CN=CN=C1O HR31763 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.308 CCOC(=O)C1=NC=CC=C1C HR108803 [0,0,0,0,0,0|2,0,0]=2 26 B12R1.308 CCOC(=O)C1=NC=CC=C1N HR101384 [0,0,0,0,0,0|2,0,0]=2 27 B12R1.308 CCOC(=O)c1cnccc1C HR154971 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.308 N#CCC(=O)C1=C(Br)C=CC=C1 HR132074 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.308 N#CCC(=O)C1=C(Cl)C=CC=C1 HR110789 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.308 N#CCC(=O)C1=C(F)C=CC=C1 HR120267 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.308 N#CCC(=O)C1=C(I)C=CC=C1 HR103166 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.308 N#CCC(=O)C1=C(O)C=CC=C1 HR113874 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.308 O=C(CCCl)C1=C(Cl)C=CC=C1 HR112241 [0,0,0,0,0,0|3,0,0]=3 34 B12R1.308 O=C(NCO)C1=C(O)C=CC=C1 HR110287 [0,0,0,0,0,0|2,0,0]=2 35 B11R1.16 C=COC(=O)C1=CC=CC=C1 HR140227 [1,0,0,0,0,0|0,0,2]=3 36 B11R1.16 CCCC(=O)C1=CC=CN=C1 HR33915 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.16 CCCC(C)C1=CC=CC=C1 HR141702 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.16 CCNC(=O)C1=CC=CC=C1 HR101895 [1,0,0,0,0,0|1,0,0]=2 39 B11R1.16 CCOC(=N)C1=CC=CC=C1 HR136304 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.16 CCOC(=O)C1=CC=CC=C1 HR125048 [1,0,0,0,0,0|0,0,0]=1 41 B11R1.16 CCOC(=O)C1=CC=NC=C1 HR134517 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.16 CCOC(=O)C1=CN=CC=C1 HR11727 [1,0,0,0,0,0|1,0,0]=2 43 B11R1.16 CCOC(=O)C1=CN=CN=C1 HR113110 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.16 CCOC(=O)C1=NC=CC=C1 HR128716 [1,0,0,0,0,0|1,0,0]=2 45 B11R1.16 CCOC(=O)C1=NC=NC=C1 HR132270 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.16 CCO[P+](=O)C1=CC=CC=C1 HR103825 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.16 CNCC(=O)C1=CC=CC=C1 HR112980 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.16 COCC(=O)C1=CC=CC=C1 HR140919 [1,0,0,0,0,0|2,0,0]=3 49 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 HR118986 [1,0,0,0,0,0|1,0,1]=3 50 B11R1.16 N#CCC(=O)C1=CC=CC=C1 HR137993 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.16 O=C(CCCl)C1=CC=CC=C1 HR130530 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.16 O=C(CCF)C1=CC=CC=C1 HR132438 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.16 O=C(CCO)C1=CC=CC=C1 HR126368 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 TOSA04604 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.16 O=C(NCO)C1=CC=CC=C1 HR123357 [1,0,0,0,0,0|2,0,0]=3 56 B11R1.16 O=C(NCO)C1=CC=CN=C1 HR125464 [1,0,0,0,0,0|3,0,0]=4 57 B11R1.16 O=C(OCCl)C1=CC=CC=C1 HR119720 [1,0,0,0,0,0|1,0,0]=2 58 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 HR125383 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.16 O=C=NC(=O)C1=CC=CC=C1 HR143927 [1,0,0,0,0,0|2,0,1]=4 60 B11R1.16 O=[P+](OCO)C1=CC=CC=C1 HR114544 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.17 CCCOC1=C(O)C=CC=C1 HR13203 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.17 OCCOC1=C(O)C=CC=C1 HR108321 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.222 CC1=C(C(=O)CBr)C=CC=C1 HR146594 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 HR102662 [1,0,0,0,0,0|1,0,0]=2 65 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 HR102022 [1,0,0,0,0,0|1,0,0]=2 66 B11R1.222 CCC(=O)C1=C(F)C=CC=C1 HR123619 [1,0,0,0,0,0|1,0,0]=2 67 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 HR132318 [1,0,0,0,0,0|0,0,0]=1 68 B11R1.222 CCC(C)C1=C(O)C=CC=C1 HR135290 [1,0,0,0,0,0|1,0,1]=3 69 B11R1.222 CCC(N)C1=C(F)C=CC=C1 HR150575 [1,0,0,0,0,0|2,0,1]=4 70 B11R1.222 CCC(N)C1=C(F)C=CC=C1 HR150617 [1,0,0,0,0,0|2,0,1]=4 71 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 HR120290 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 HR143082 [1,0,0,0,0,0|1,1,0]=3 73 B11R1.222 CNC(=O)C1=CC=CN=C1N HR114744 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 HR3956 [1,0,0,0,0,0|1,0,0]=2 75 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 HR113099 [1,0,0,0,0,0|2,0,0]=3 76 B11R1.222 COC(=O)C1=C(Br)N=CC=C1 HR104355 [1,0,0,0,0,0|2,0,0]=3 77 B11R1.222 COC(=O)C1=C(C)C=CN=C1 HR102279 [1,0,0,0,0,0|2,0,0]=3 78 B11R1.222 COC(=O)C1=C(C)C=NC=C1 HR117529 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.222 COC(=O)C1=C(C)N=CC=C1 HR118985 [1,0,0,0,0,0|2,0,0]=3 80 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 HR131154 [1,0,0,0,0,0|1,0,0]=2 81 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 HR116894 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.222 COC(=O)C1=C(Cl)N=CC=C1 HR140247 [1,0,0,0,0,0|2,0,0]=3 83 B11R1.222 COC(=O)C1=C(F)C=CC=C1 HR123467 [1,0,0,0,0,0|1,0,0]=2 84 B11R1.222 COC(=O)C1=C(F)C=NC=C1 HR151157 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.222 COC(=O)C1=C(F)N=CC=C1 HR104283 [1,0,0,0,0,0|2,0,0]=3 86 B11R1.222 COC(=O)C1=C(I)C=CC=C1 HR138423 [1,0,0,0,0,0|1,0,0]=2 87 B11R1.222 COC(=O)C1=C(I)C=NC=C1 HR147362 [1,0,0,0,0,0|2,0,0]=3 88 B11R1.222 COC(=O)C1=C(N)C=NC=C1 HR9760 [1,0,0,0,0,0|2,0,0]=3 89 B11R1.222 COC(=O)C1=C(N)N=CC=C1 HR16778 [1,0,0,0,0,0|2,0,0]=3 90 B11R1.222 COC(=O)C1=C(O)C=NC=C1 HR144250 [1,0,0,0,0,0|1,0,0]=2 91 B11R1.222 COC(=O)C1=CC=CC=C1C HR136739 [1,0,0,0,0,0|1,0,0]=2 92 B11R1.222 COC(=O)C1=CC=CC=C1N HR136079 [1,0,0,0,0,0|1,0,0]=2 93 B11R1.222 COC(=O)C1=CC=CC=C1O HR123095 [1,0,0,0,0,0|0,0,0]=1 94 B11R1.222 COC(=O)C1=CC=CC=C1O HR131277 [1,0,0,0,0,0|0,0,0]=1 95 B11R1.222 COC(=O)C1=CC=CC=C1S HR101714 [1,0,0,0,0,0|0,1,0]=2 96 B11R1.222 COC(=O)C1=CC=CNC1=O HR106531 [1,0,0,0,0,0|1,0,1]=3 97 B11R1.222 COC(=O)C1=CC=COC1=O ESJL02102 [1,0,0,0,0,0|1,0,1]=3 98 B11R1.222 COC(=O)C1=CN=CC=C1Br HR153150 [1,0,0,0,0,0|2,0,0]=3 99 B11R1.222 COC(=O)C1=CN=CC=C1N HR122147 [1,0,0,0,0,0|2,0,0]=3 100 B11R1.222 COC(=O)C1=CN=CC=C1O HR107792 [1,0,0,0,0,0|1,0,0]=2 101 B11R1.222 COC(=O)C1=CN=CN=C1C HR113745 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.222 COC(=O)C1=CN=CN=C1N HR148241 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.222 COC(=O)C1=CN=CN=C1O HR111719 [1,0,0,0,0,0|2,0,0]=3 104 B11R1.222 COC(=O)C1=NC=CC=C1Br HR113410 [1,0,0,0,0,0|2,0,0]=3 105 B11R1.222 COC(=O)C1=NC=CC=C1C HR109173 [1,0,0,0,0,0|2,0,0]=3 106 B11R1.222 COC(=O)C1=NC=CC=C1Cl HR107488 [1,0,0,0,0,0|2,0,0]=3 107 B11R1.222 COC(=O)C1=NC=CC=C1F HR153076 [1,0,0,0,0,0|2,0,0]=3 108 B11R1.222 COC(=O)C1=NC=CC=C1N HR107795 [1,0,0,0,0,0|2,0,0]=3 109 B11R1.222 COC(=O)C1=NC=CC=C1O HR138652 [1,0,0,0,0,0|1,0,0]=2 110 B11R1.222 COC(=O)C1=NC=CN=C1Br HR31741 [1,0,0,0,0,0|3,0,0]=4 111 B11R1.222 COC(=O)C1=NC=CN=C1Cl HR101961 [1,0,0,0,0,0|3,0,0]=4 112 B11R1.222 COC(=O)C1=NC=CN=C1I HR104890 [1,0,0,0,0,0|3,0,0]=4 113 B11R1.222 COC(=O)C1=NC=CN=C1N HR127982 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.222 COC(=O)C1=NC=CN=C1O HR147649 [1,0,0,0,0,0|2,0,0]=3 115 B11R1.222 COC(=O)C1=NC=NC=C1Br HR148109 [1,0,0,0,0,0|3,0,0]=4 116 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 HR132526 [1,0,0,0,0,0|2,0,0]=3 117 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 HR105319 [1,0,0,0,0,0|2,0,0]=3 118 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 HR150266 [1,0,0,0,0,0|2,0,0]=3 119 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 HR113116 [1,0,0,0,0,0|3,0,0]=4 120 B11R1.222 NNC(=O)C1=CC=CC=C1O HR137584 [1,0,0,0,0,0|2,0,0]=3 121 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 HR119979 [1,0,0,0,0,0|1,0,0]=2 122 B11R1.222 O=C(CBr)c1ccccc1Cl HR114861 [1,0,0,0,0,0|2,0,0]=3 123 B11R1.222 O=C(CBr)c1ccccc1F HR105882 [1,0,0,0,0,0|2,0,0]=3 124 B11R1.222 O=C(NO)C1=CC=CC=C1O HR124345 [1,0,0,0,0,0|2,0,0]=3 125 B13R1.12 CCOC(=O)C1=C(Br)C(Cl)=NC=C1 HR155185 [0,1,0,0,0,0|2,0,0]=3 126 B13R1.12 CCOC(=O)C1=C(Br)C(F)=CC=C1 HR154659 [0,1,0,0,0,0|1,0,0]=2 127 B13R1.12 CCOC(=O)C1=C(C)C(Br)=CC=C1 HR154471 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.12 CCOC(=O)C1=C(C)C(Cl)=NC=C1 HR121287 [0,1,0,0,0,0|2,0,0]=3 129 B13R1.12 CCOC(=O)C1=C(C)C(F)=CC=C1 HR156047 [0,1,0,0,0,0|1,0,0]=2 130 B13R1.12 CCOC(=O)C1=C(Cl)C(Cl)=NC=C1 HR156363 [0,1,0,0,0,0|2,0,0]=3 131 B13R1.12 CCOC(=O)C1=C(F)C(Br)=CC=C1 HR113571 [0,1,0,0,0,0|1,0,0]=2 132 B13R1.12 CCOC(=O)C1=C(O)C(O)=CC=C1 HR118269 [0,1,0,0,0,0|0,0,0]=1 133 B13R1.12 CCOC(=O)C1=NC=NC(Cl)=C1Cl HR31971 [0,1,0,0,0,0|3,0,0]=4 134 B13R1.201 CC(=O)CC(=O)C1=C(O)C=CC=C1 HR141768 [0,1,0,0,0,0|1,0,1]=3 135 B13R1.201 CC(C)OC(=O)C1=C(N)C=CC=C1 HR146525 [0,1,0,0,0,0|1,0,0]=2 136 B13R1.201 CC(C)OC(=O)C1=CC=CC=C1O HR130827 [0,1,0,0,0,0|0,0,0]=1 137 B13R1.446 CC1=CC(C(=O)CC#N)=C(O)C=C1 HR104106 [0,1,0,0,0,0|2,0,1]=4 138 B13R1.446 CCOC(=O)C1=C(Br)C=CC(Cl)=C1 HR155782 [0,1,0,0,0,0|1,0,0]=2 139 B13R1.446 CCOC(=O)C1=C(C)C=CC(F)=C1 HR155789 [0,1,0,0,0,0|1,0,0]=2 140 B13R1.446 CCOC(=O)C1=C(C)N=CC(Br)=C1 HR148424 [0,1,0,0,0,0|2,0,0]=3 141 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 HR139577 [0,1,0,0,0,0|1,0,0]=2 142 B13R1.446 CCOC(=O)C1=C(Cl)N=CC(F)=C1 HR138564 [0,1,0,0,0,0|2,0,0]=3 143 B13R1.446 CCOC(=O)C1=C(F)C=CC(Br)=C1 HR155572 [0,1,0,0,0,0|1,0,0]=2 144 B13R1.446 CCOC(=O)C1=C(F)N=CC(Cl)=C1 HR152654 [0,1,0,0,0,0|2,0,0]=3 145 B13R1.446 CCOC(=O)C1=C(I)C=CC(Cl)=C1 HR155780 [0,1,0,0,0,0|1,0,0]=2 146 B13R1.446 CCOC(=O)C1=C(N)C=CC(I)=C1 HR124844 [0,1,0,0,0,0|1,0,0]=2 147 B13R1.446 CCOC(=O)C1=C(O)C=CC(C)=C1 HR115924 [0,1,0,0,0,0|0,0,0]=1 148 B13R1.446 CCOC(=O)C1=CC(Br)=CN=C1Br HR152641 [0,1,0,0,0,0|2,0,0]=3 149 B13R1.446 CCOC(=O)C1=CC(Br)=CN=C1Cl HR153100 [0,1,0,0,0,0|2,0,0]=3 150 B13R1.446 CCOC(=O)C1=CC(Br)=CN=C1F HR152715 [0,1,0,0,0,0|2,0,0]=3 151 B13R1.446 CCOC(=O)C1=CC(Br)=NC=C1Br HR152625 [0,1,0,0,0,0|2,0,0]=3 152 B13R1.446 CCOC(=O)C1=CC(Cl)=NC=C1Cl HR152695 [0,1,0,0,0,0|2,0,0]=3 153 B13R1.446 CCOC(=O)C1=CC(F)=NC=C1Br HR153157 [0,1,0,0,0,0|2,0,0]=3 154 B13R1.464 CCOC(=O)C1=C(C#N)C=CC=C1 HR139632 [0,1,0,0,0,0|1,0,0]=2 155 B13R1.464 CCOC(=O)C1=C(C=O)C=CC=C1 HR126906 [0,1,0,0,0,0|0,0,1]=2 156 B13R1.464 CCOC(=O)C1=C(CBr)C=CC=C1 HR108121 [0,1,0,0,0,0|1,0,0]=2 157 B13R1.464 CCOC(=O)C1=C(CCl)C=CC=C1 HR128279 [0,1,0,0,0,0|1,0,0]=2 158 B13R1.464 CCOC(=O)C1=C(NC)C=CC=C1 HR148726 [0,1,0,0,0,0|1,0,0]=2 159 B13R1.464 CCOC(=O)C1=C(OC)N=CC=C1 HR153109 [0,1,0,0,0,0|1,0,0]=2 160 B13R1.674 CCCCC(=O)C1=C(C)C=CC=C1 HR110780 [0,1,0,0,0,0|2,0,0]=3 161 B13R1.674 CCCOC(=O)C1=CC=CC=C1O HR133061 [0,1,0,0,0,0|0,0,0]=1 162 B13R1.674 O=C(OCCO)C1=CC=CC=C1O HR138380 [0,1,0,0,0,0|0,0,0]=1 163 B13R1.696 COC(=O)C(=O)C1=C(C)C=CC=C1 HR141668 [0,1,0,0,0,0|3,0,0]=4 164 B13R1.696 COC(=O)C(=O)C1=C(Cl)C=CC=C1 HR109102 [0,1,0,0,0,0|3,0,0]=4 165 B13R1.696 CON(C)C(=O)C1=C(Br)C=CC=C1 HR153739 [0,1,0,0,0,0|3,0,0]=4 166 B13R1.696 CON(C)C(=O)C1=C(F)C=CC=C1 HR134753 [0,1,0,0,0,0|3,0,0]=4 167 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1Cl HR132407 [0,1,0,0,0,0|2,0,0]=3 168 B13R1.1511 CCOC(=O)C1=C(C)N=C(Cl)C=C1 HR33577 [0,1,0,0,0,0|2,0,0]=3 169 B13R1.1511 CCOC(=O)C1=C(Cl)N=C(Cl)C=C1 HR153055 [0,1,0,0,0,0|2,0,0]=3 170 B13R1.1511 CCOC(=O)C1=C(F)C=C(Br)C=C1 HR154837 [0,1,0,0,0,0|1,0,0]=2 171 B13R1.1511 CCOC(=O)C1=C(F)C=C(F)C=C1 HR103910 [0,1,0,0,0,0|1,0,0]=2 172 B13R1.1511 CCOC(=O)C1=C(F)C=C(I)C=C1 HR114187 [0,1,0,0,0,0|1,0,0]=2 173 B13R1.1511 CCOC(=O)C1=C(N)C=C(F)C=C1 HR150884 [0,1,0,0,0,0|1,0,0]=2 174 B13R1.1511 CCOC(=O)C1=C(N)NC(=O)N=C1 HR111538 [0,1,0,0,0,0|3,0,0]=4 175 B13R1.1511 CCOC(=O)C1=CC=C(C)N=C1C HR121692 [0,1,0,0,0,0|2,0,0]=3 176 B13R1.1511 CCOC(=O)C1=CC=C(C)N=C1Cl HR107473 [0,1,0,0,0,0|2,0,0]=3 177 B13R1.1511 CCOC(=O)C1=CN=C(C)N=C1O HR111930 [0,1,0,0,0,0|2,0,0]=3 178 B13R1.1511 CCOC(=O)C1=CN=C(C)N=C1O HR146629 [0,1,0,0,0,0|2,0,0]=3 179 B13R1.1511 CCOC(=O)C1=CN=C(Cl)C=C1Cl HR122748 [0,1,0,0,0,0|2,0,0]=3 180 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1C HR111800 [0,1,0,0,0,0|3,0,0]=4 181 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1Cl HR113932 [0,1,0,0,0,0|3,0,0]=4 182 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1N HR119680 [0,1,0,0,0,0|3,0,0]=4 183 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1O HR103161 [0,1,0,0,0,0|2,0,0]=3 184 B13R1.1511 CCOC(=O)C1=CN=C(S)N=C1N HR105046 [0,1,0,0,0,0|3,0,0]=4 185 B13R1.1511 CCOC(=O)C1=CN=C(S)N=C1O HR146423 [0,1,0,0,0,0|2,0,0]=3 186 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O HR130457 [0,1,0,0,0,0|2,0,1]=4 187 B13R1.1511 CCOC(=O)C1=NC=C(Br)C=C1C HR152885 [0,1,0,0,0,0|2,0,0]=3 188 B13R1.1511 CCOC(=O)C1=NC=C(Cl)C=C1Br HR155244 [0,1,0,0,0,0|2,0,0]=3 189 B13R1.1511 N#CCC(=O)C1=C(O)C=C(O)C=C1 HR122079 [0,1,0,0,0,0|2,0,1]=4 190 B13R1.2819 CCNS(=O)(=O)C1=CC=CC=C1C HR137730 [0,1,0,0,0,0|3,0,0]=4 191 B13R1.4453 CCOC(=O)C1=C(Br)C=NC=C1Br HR156548 [0,1,0,0,0,0|2,0,0]=3 192 B13R1.4453 CCOC(=O)C1=C(C)C=CC=C1O HR116496 [0,1,0,0,0,0|0,0,0]=1 193 B13R1.4453 CCOC(=O)C1=C(C)N=CC=C1C HR146524 [0,1,0,0,0,0|2,0,0]=3 194 B13R1.4453 CCOC(=O)C1=C(Cl)C=CC=C1O HR147613 [0,1,0,0,0,0|0,0,0]=1 195 B13R1.4453 CCOC(=O)C1=C(Cl)C=NC=C1Cl HR156598 [0,1,0,0,0,0|2,0,0]=3 196 B13R1.4453 CCOC(=O)C1=C(Cl)N=CC=C1Br HR156364 [0,1,0,0,0,0|2,0,0]=3 197 B13R1.4453 CCOC(=O)C1=C(Cl)N=CC=C1Cl HR147879 [0,1,0,0,0,0|2,0,0]=3 198 B13R1.4453 CCOC(=O)c1c(Cl)ncnc1Cl HR148694 [0,1,0,0,0,0|3,0,0]=4 199 B13R2.1 NCCC1=COC2=C1C=CC=C2 HR120817 [0,0,0,1,0,0|3,0,0]=4 200 B13R2.18 BrC1=C(C2OCCO2)C=CC=C1 HR117267 [0,0,0,1,0,0|1,0,2]=4 201 B13R2.45 CCC1=C(C)C2=C(C=CC=C2)O1 HR117128 [0,0,0,1,0,0|2,0,0]=3 202 B13R2.328 CC1=NC2=C(C=NC=C2)C(=O)O1 HR117869 [0,0,0,1,0,0|2,0,1]=4 203 B13R2.328 O=C1CC2=CC=CC=C2C(=O)O1 HR108671 [0,0,0,1,0,0|2,0,1]=4 204 B13R2.328 O=C1NC(=O)C2=C(C=CC=C2)O1 HR115010 [0,0,0,1,0,0|2,0,1]=4 205 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 HR136649 [0,0,0,1,0,0|2,0,1]=4 206 B13R2.328 O=C1O[Bi](O)Oc2ccccc21 HR132912 [0,0,0,1,0,0|2,0,0]=3 207 B13R2.4857 CC1=C2C(=O)OC(=O)C2=CC=C1 HR111621 [0,0,0,1,0,0|2,0,1]=4 208 B13R2.4857 O=C1OC(=O)C2=C(Br)C=CC=C12 HR144148 [0,0,0,1,0,0|2,0,1]=4 209 B13R2.4857 O=C1OC(=O)C2=C(Cl)C=CC=C12 HR135072 [0,0,0,1,0,0|2,0,1]=4 210 B13R2.4857 O=C1OC(=O)C2=C(F)C=CC=C12 HR1949 [0,0,0,1,0,0|2,0,1]=4 211 B13R2.4857 O=C1OC(=O)C2=C(O)C=CC=C12 HR110748 [0,0,0,1,0,0|1,0,1]=3 212 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2I HR112140 [0,0,0,1,0,0|2,0,1]=4 213 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 HR125755 [0,0,0,1,0,0|2,0,0]=3 214 B13R2.5252 O=C1CCCNC2=C1C=CC=C2 HR110952 [0,0,0,1,0,0|2,0,0]=3 215 B13R2.5252 O=C1NCCCC2=C1C=CC=C2 HR109025 [0,0,0,1,0,0|2,0,0]=3 216 B13R2.5252 O=C1NCCNC2=C1C=CC=C2 HR147131 [0,0,0,1,0,0|2,0,0]=3 217 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 HR144523 [0,0,0,1,0,0|1,0,0]=2 218 B11R1.199 CCOC(=O)C1=C(Br)C=CS1 HR154808 [0,0,0,0,1,0|2,0,0]=3 219 B11R1.199 CCOC(=O)C1=C(Br)N=CS1 HR118682 [0,0,0,0,1,0|3,0,0]=4 220 B11R1.199 CCOC(=O)C1=C(Br)SC=N1 HR31794 [0,0,0,0,1,0|3,0,0]=4 221 B11R1.199 CCOC(=O)C1=C(C)C=CN1 HR116200 [0,0,0,0,1,0|2,0,0]=3 222 B11R1.199 CCOC(=O)C1=C(C)N=CN1 HR7225 [0,0,0,0,1,0|3,0,0]=4 223 B11R1.199 CCOC(=O)C1=C(C)N=CO1 HR113425 [0,0,0,0,1,0|3,0,0]=4 224 B11R1.199 CCOC(=O)C1=C(C)N=CS1 HR126334 [0,0,0,0,1,0|3,0,0]=4 225 B11R1.199 CCOC(=O)C1=C(C)NC=C1 HR104175 [0,0,0,0,1,0|2,0,0]=3 226 B11R1.199 CCOC(=O)C1=C(C)OC=N1 HR117467 [0,0,0,0,1,0|3,0,0]=4 227 B11R1.199 CCOC(=O)C1=C(C)ON=C1 HR129429 [0,0,0,0,1,0|3,0,0]=4 228 B11R1.199 CCOC(=O)C1=C(C)SC=C1 HR117489 [0,0,0,0,1,0|2,0,0]=3 229 B11R1.199 CCOC(=O)C1=C(C)SC=N1 HR21564 [0,0,0,0,1,0|3,0,0]=4 230 B11R1.199 CCOC(=O)C1=C(F)C=CN1 HR150469 [0,0,0,0,1,0|2,0,0]=3 231 B11R1.199 CCOC(=O)C1=C(I)SC=N1 HR31795 [0,0,0,0,1,0|3,0,0]=4 232 B11R1.199 CCOC(=O)C1=C(N)C=CN1 HR102384 [0,0,0,0,1,0|2,0,0]=3 233 B11R1.199 CCOC(=O)C1=C(N)NC=C1 HR146417 [0,0,0,0,1,0|2,0,0]=3 234 B11R1.199 CCOC(=O)C1=C(N)NN=C1 HR102913 [0,0,0,0,1,0|3,0,0]=4 235 B11R1.199 CCOC(=O)C1=C(N)NN=C1 HR146924 [0,0,0,0,1,0|3,0,0]=4 236 B11R1.199 CCOC(=O)C1=C(N)SC=C1 HR129806 [0,0,0,0,1,0|2,0,0]=3 237 B11R1.199 CCOC(=O)C1=C(N)SC=N1 HR112792 [0,0,0,0,1,0|3,0,0]=4 238 B11R1.199 CCOC(=O)C1=CNN=C1I HR113407 [0,0,0,0,1,0|3,0,0]=4 239 B11R1.199 CCOC(=O)C1=CNN=C1N HR132321 [0,0,0,0,1,0|3,0,0]=4 240 B11R1.199 CCOC(=O)C1=CNOC1=O HR105887 [0,0,0,0,1,0|2,0,1]=4 241 B11R1.199 CCOC(=O)C1=CSN=C1C HR110171 [0,0,0,0,1,0|3,0,0]=4 242 B11R1.199 CCOC(=O)C1=NC=CN1C HR112211 [0,0,0,0,1,0|3,0,0]=4 243 B11R1.199 CCOC(=O)C1=NNC=C1Br HR33663 [0,0,0,0,1,0|3,0,0]=4 244 B11R1.199 CCOC(=O)C1=NNC=C1C HR103497 [0,0,0,0,1,0|3,0,0]=4 245 B13R1.470 CCOC(=O)CC1=C(Br)C=CC=C1 HR132221 [0,0,0,0,0,1|1,0,0]=2 246 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 HR110130 [0,0,0,0,0,1|2,0,0]=3 247 B13R1.470 CCOC(=O)CC1=CN=CNC1=O HR141523 [0,0,0,0,0,1|2,0,1]=4 248 B10R0.1 CCOC(=O)\C=C\C=C\CO HR144343 [1,0,1,0,0,0|0,0,1]=3 249 B10R1.15 C#CC(=O)C1=CC=CC=C1 HR112867 [2,0,0,0,0,0|0,0,2]=4 250 B10R1.15 C=CC(=O)C1=CC=CC=C1 HR110349 [2,0,0,0,0,0|0,0,2]=4 251 B10R1.15 CCC(=O)C1=CC=CN=C1 HR113623 [2,0,0,0,0,0|1,0,0]=3 252 B10R1.15 CCC(N)C1=CC=CC=C1 HR116998 [2,0,0,0,0,0|1,0,1]=4 253 B10R1.15 CCC(N)C1=CC=CC=C1 HR6025 [2,0,0,0,0,0|1,0,1]=4 254 B10R1.15 CCC(O)C1=CC=CC=C1 HR135505 [2,0,0,0,0,0|0,0,2]=4 255 B10R1.15 CCC(O)c1ccccc1 HR104663 [2,0,0,0,0,0|0,0,2]=4 256 B10R1.15 CCC(O)c1ccccc1 HR141130 [2,0,0,0,0,0|0,0,2]=4 257 B10R1.15 CCN(C)C1=CC=CC=C1 HR129175 [2,0,0,0,0,0|2,0,0]=4 258 B10R1.15 CNC(=O)C1=CC=CC=C1 HR142749 [2,0,0,0,0,0|1,0,0]=3 259 B10R1.15 CNC(=O)C1=CN=CC=C1 HR145172 [2,0,0,0,0,0|2,0,0]=4 260 B10R1.15 COC(=O)C1=CC=NC=C1 HR132138 [2,0,0,0,0,0|1,0,0]=3 261 B10R1.15 COC(=O)C1=CN=CC=C1 HR133976 [2,0,0,0,0,0|1,0,0]=3 262 B10R1.15 COC(=O)C1=CN=CN=C1 HR112795 [2,0,0,0,0,0|2,0,0]=4 263 B10R1.15 COC(=O)C1=CN=NC=C1 HR148442 [2,0,0,0,0,0|2,0,0]=4 264 B10R1.15 COC(=O)C1=NC=CC=C1 HR128455 [2,0,0,0,0,0|1,0,0]=3 265 B10R1.15 COC(=O)C1=NC=CC=N1 HR124842 [2,0,0,0,0,0|2,0,0]=4 266 B10R1.15 COC(=O)C1=NC=CN=C1 HR127231 [2,0,0,0,0,0|2,0,0]=4 267 B10R1.15 COC(=O)C1=NC=NC=C1 HR114041 [2,0,0,0,0,0|2,0,0]=4 268 B10R1.15 N#CC(=O)C1=CC=CC=C1 HR142553 [2,0,0,0,0,0|1,0,1]=4 269 B10R1.15 NCC(=O)C1=CC=CC=C1 HR122484 [2,0,0,0,0,0|1,0,0]=3 270 B10R1.15 NCC(=O)C1=CC=CC=C1 HR125421 [2,0,0,0,0,0|1,0,0]=3 271 B10R1.15 NCC(=O)C1=CC=CC=C1 HR136963 [2,0,0,0,0,0|1,0,0]=3 272 B10R1.15 NNC(=O)C1=CC=CC=C1 HR124238 [2,0,0,0,0,0|2,0,0]=4 273 B10R1.15 O=C(CBr)C1=CC=NC=C1 HR122230 [2,0,0,0,0,0|2,0,0]=4 274 B10R1.15 O=C(CBr)C1=NC=CC=C1 HR112217 [2,0,0,0,0,0|2,0,0]=4 275 B10R1.15 O=C(CBr)C1=NC=CC=C1 HR130419 [2,0,0,0,0,0|2,0,0]=4 276 B10R1.15 O=C(CBr)c1cccnc1 HR128066 [2,0,0,0,0,0|2,0,0]=4 277 B10R1.15 O=C(CCl)C1=CC=CC=C1 HR3264 [2,0,0,0,0,0|1,0,0]=3 278 B10R1.15 O=C(CF)C1=CC=CC=C1 HR146967 [2,0,0,0,0,0|1,0,0]=3 279 B10R1.15 O=C(CO)C1=CC=CC=C1 HR130474 [2,0,0,0,0,0|1,0,0]=3 280 B10R1.15 O=C(NO)C1=CC=CC=C1 HR107221 [2,0,0,0,0,0|2,0,0]=4 281 B10R1.15 O=CC(=O)C1=CC=CC=C1 HR101665 [2,0,0,0,0,0|1,0,1]=4 282 B10R1.17 BrC\C=C\C1=CC=CC=C1 HR137089 [2,0,0,0,0,0|2,0,0]=4 283 B10R1.17 CCCNC1=CC=CC=C1 HR129739 [2,0,0,0,0,0|2,0,0]=4 284 B10R1.17 CCCOC1=CC=CC=C1 HR112246 [2,0,0,0,0,0|2,0,0]=4 285 B10R1.17 CCNCC1=CC=CC=C1 HR126061 [2,0,0,0,0,0|1,0,1]=4 286 B10R1.17 CCOCC1=CC=CC=C1 HR135944 [2,0,0,0,0,0|0,0,1]=3 287 B10R1.17 ClC\C=C\C1=CC=CC=C1 HR137335 [2,0,0,0,0,0|2,0,0]=4 288 B10R1.17 OCOCC1=CC=CC=C1 HR100600 [2,0,0,0,0,0|1,0,1]=4 289 B10R1.17 OC\C=C\C1=CC=CC=C1 HR126268 [2,0,0,0,0,0|2,0,0]=4 290 B10R1.4 CCCC1=C(N)C=CC=C1 HR101743 [2,0,0,0,0,0|1,0,1]=4 291 B10R1.4 CCNC1=CC=CC=C1C HR132311 [2,0,0,0,0,0|2,0,0]=4 292 B10R1.4 CCOC1=C(Br)C=CC=C1 HR3136 [2,0,0,0,0,0|1,0,0]=3 293 B10R1.4 CCOC1=C(Br)C=NC=C1 HR33456 [2,0,0,0,0,0|2,0,0]=4 294 B10R1.4 CCOC1=C(Cl)C=CC=C1 HR143151 [2,0,0,0,0,0|1,0,0]=3 295 B10R1.4 CCOC1=C(F)C=CC=C1 HR153838 [2,0,0,0,0,0|1,0,0]=3 296 B10R1.4 CCOC1=C(N)C=CN=C1 HR32244 [2,0,0,0,0,0|2,0,0]=4 297 B10R1.4 CCOC1=C(O)C=CC=C1 HR134039 [2,0,0,0,0,0|0,0,0]=2 298 B10R1.4 CCOC1=CC=CN=C1C HR33539 [2,0,0,0,0,0|2,0,0]=4 299 B10R1.4 CCOC1=CC=CN=C1F HR152949 [2,0,0,0,0,0|2,0,0]=4 300 B10R1.4 CCOC1=NC=CC=C1Br HR109498 [2,0,0,0,0,0|2,0,0]=4 301 B10R1.4 CCOC1=NC=CC=C1Cl HR155974 [2,0,0,0,0,0|2,0,0]=4 302 B10R1.4 CCSC1=C(Br)C=CC=C1 HR140258 [2,0,0,0,0,0|1,1,0]=4 303 B10R1.4 COCC1=C(Br)C=CC=C1 HR33821 [2,0,0,0,0,0|1,0,1]=4 304 B10R1.4 ClCOC1=C(Cl)C=CC=C1 HR113890 [2,0,0,0,0,0|2,0,0]=4 305 B10R1.4 NCCC1=C(O)C=CC=C1 HR101392 [2,0,0,0,0,0|1,0,1]=4 306 B10R1.4 OCCC1=C(O)C=CC=C1 HR135654 [2,0,0,0,0,0|1,0,1]=4 307 B10R1.4 O\N=C\C1=CC=CC=C1O HR104932 [2,0,0,0,0,0|2,0,0]=4 308 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 HR126524 [2,0,0,0,0,0|1,0,0]=3 309 B10R1.61 CC(=O)C1=C(Cl)C=NC=C1 HR112596 [2,0,0,0,0,0|2,0,0]=4 310 B10R1.61 CC(=O)C1=C(F)C=CC=C1 HR127569 [2,0,0,0,0,0|1,0,0]=3 311 B10R1.61 CC(=O)C1=C(F)C=NC=C1 HR32706 [2,0,0,0,0,0|2,0,0]=4 312 B10R1.61 CC(=O)C1=C(I)C=CC=C1 HR141132 [2,0,0,0,0,0|1,0,0]=3 313 B10R1.61 CC(=O)C1=C(N)C=NC=C1 HR135805 [2,0,0,0,0,0|2,0,0]=4 314 B10R1.61 CC(=O)C1=C(O)C=CC=C1 HR100975 [2,0,0,0,0,0|0,0,0]=2 315 B10R1.61 CC(=O)C1=CC=CN=C1Br HR121467 [2,0,0,0,0,0|2,0,0]=4 316 B10R1.61 CC(=O)C1=CC=CN=C1C HR119485 [2,0,0,0,0,0|2,0,0]=4 317 B10R1.61 CC(=O)C1=CC=CN=C1Cl HR14410 [2,0,0,0,0,0|2,0,0]=4 318 B10R1.61 CC(=O)C1=CC=CN=C1F HR105702 [2,0,0,0,0,0|2,0,0]=4 319 B10R1.61 CC(=O)C1=CC=CN=C1N HR109973 [2,0,0,0,0,0|2,0,0]=4 320 B10R1.61 CC(=O)C1=CC=CNC1=O HR33876 [2,0,0,0,0,0|1,0,1]=4 321 B10R1.61 CC(=O)C1=NC=CC=C1Cl HR33494 [2,0,0,0,0,0|2,0,0]=4 322 B10R1.61 CC(=O)C1=NC=CC=C1F HR143958 [2,0,0,0,0,0|2,0,0]=4 323 B10R1.61 CC(=O)C1=NC=CC=C1O HR105092 [2,0,0,0,0,0|1,0,0]=3 324 B10R1.61 CC(=O)c1ccccc1C HR134249 [2,0,0,0,0,0|1,0,0]=3 325 B10R1.61 CC(=O)c1ccccc1N HR124033 [2,0,0,0,0,0|1,0,0]=3 326 B10R1.61 CC(C)C1=C(O)C=CC=C1 HR154250 [2,0,0,0,0,0|1,0,1]=4 327 B10R1.61 CC1=C(C(=O)O)C=CC=N1 HR2458 [2,0,0,0,0,0|2,0,0]=4 328 B10R1.61 CC1=C(C(=O)O)C=CN=C1 HR112036 [2,0,0,0,0,0|2,0,0]=4 329 B10R1.61 CC1=CC=CC=C1C(=O)Cl HR133150 [2,0,0,0,0,0|2,0,0]=4 330 B10R1.61 CC1=CC=CC=C1C(=O)O HR15431 [2,0,0,0,0,0|1,0,0]=3 331 B10R1.61 CC1=CC=CN=C1C(=O)O HR126365 [2,0,0,0,0,0|2,0,0]=4 332 B10R1.61 CC1=CC=NC=C1C(=O)O HR101960 [2,0,0,0,0,0|2,0,0]=4 333 B10R1.61 CC1=CC=NC=C1C(=O)O HR32399 [2,0,0,0,0,0|2,0,0]=4 334 B10R1.61 Cc1ccccc1C(N)=O HR113826 [2,0,0,0,0,0|2,0,0]=4 335 B10R1.61 Cc1cccnc1C(=O)O HR101642 [2,0,0,0,0,0|2,0,0]=4 336 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 HR140333 [2,0,0,0,0,0|2,0,0]=4 337 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 HR131103 [2,0,0,0,0,0|2,0,0]=4 338 B10R1.61 NC(=O)C1=C(F)C=CC=C1 HR106582 [2,0,0,0,0,0|2,0,0]=4 339 B10R1.61 NC(=O)C1=C(I)C=CC=C1 HR143474 [2,0,0,0,0,0|2,0,0]=4 340 B10R1.61 NC(=O)C1=C(N)C=CC=C1 HR132086 [2,0,0,0,0,0|2,0,0]=4 341 B10R1.61 NC(=O)C1=CC=CC=C1O HR125402 [2,0,0,0,0,0|1,0,0]=3 342 B10R1.61 NC(=O)C1=NC=CC=C1O HR135388 [2,0,0,0,0,0|2,0,0]=4 343 B10R1.61 NC1=C(C(=O)O)C=CC=N1 HR1216 [2,0,0,0,0,0|2,0,0]=4 344 B10R1.61 NC1=C(C(=O)O)C=CN=C1 HR118193 [2,0,0,0,0,0|2,0,0]=4 345 B10R1.61 NC1=C(C(=O)O)C=CN=C1 HR2420 [2,0,0,0,0,0|2,0,0]=4 346 B10R1.61 NC1=CC=CC=C1C(=O)O HR150880 [2,0,0,0,0,0|1,0,0]=3 347 B10R1.61 NC1=CC=CN=C1C(=O)O HR2015 [2,0,0,0,0,0|2,0,0]=4 348 B10R1.61 NC1=CC=NC=C1C(=O)O HR131231 [2,0,0,0,0,0|2,0,0]=4 349 B10R1.61 NC1=CC=NC=C1C(=O)O HR135111 [2,0,0,0,0,0|2,0,0]=4 350 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 HR132584 [2,0,0,0,0,0|2,0,0]=4 351 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 HR140717 [2,0,0,0,0,0|2,0,0]=4 352 B10R1.61 O=C(Cl)C1=C(O)C=CC=C1 HR123739 [2,0,0,0,0,0|1,0,0]=3 353 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 HR3739 [2,0,0,0,0,0|1,0,0]=3 354 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 HR13576 [2,0,0,0,0,0|2,0,0]=4 355 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 HR125435 [2,0,0,0,0,0|1,0,0]=3 356 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 HR138538 [2,0,0,0,0,0|2,0,0]=4 357 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 HR133112 [2,0,0,0,0,0|2,0,0]=4 358 B10R1.61 O=C(O)C1=C(F)C=CC=C1 HR131263 [2,0,0,0,0,0|1,0,0]=3 359 B10R1.61 O=C(O)C1=C(F)C=CN=C1 HR10434 [2,0,0,0,0,0|2,0,0]=4 360 B10R1.61 O=C(O)C1=C(F)C=NC=C1 HR3549 [2,0,0,0,0,0|2,0,0]=4 361 B10R1.61 O=C(O)C1=C(F)N=CC=C1 HR122975 [2,0,0,0,0,0|2,0,0]=4 362 B10R1.61 O=C(O)C1=C(I)C=CC=C1 HR3924 [2,0,0,0,0,0|1,0,0]=3 363 B10R1.61 O=C(O)C1=C(I)C=NC=C1 HR102674 [2,0,0,0,0,0|2,0,0]=4 364 B10R1.61 O=C(O)C1=C(I)N=CC=C1 HR33323 [2,0,0,0,0,0|2,0,0]=4 365 B10R1.61 O=C(O)C1=C(O)C=NC=C1 HR16741 [2,0,0,0,0,0|1,0,0]=3 366 B10R1.61 O=C(O)C1=C(O)N=CC=C1 HR2597 [2,0,0,0,0,0|1,0,0]=3 367 B10R1.61 O=C(O)C1=C(S)N=CC=C1 HR125258 [2,0,0,0,0,0|1,1,0]=4 368 B10R1.61 O=C(O)C1=CC=CC=C1O HR100716 [2,0,0,0,0,0|0,0,0]=2 369 B10R1.61 O=C(O)C1=CC=CC=C1O HR125538 [2,0,0,0,0,0|0,0,0]=2 370 B10R1.61 O=C(O)C1=CC=CC=C1O HR125657 [2,0,0,0,0,0|0,0,0]=2 371 B10R1.61 O=C(O)C1=CC=CC=C1S HR127782 [2,0,0,0,0,0|0,1,0]=3 372 B10R1.61 O=C(O)C1=CC=CN=C1Br HR5071 [2,0,0,0,0,0|2,0,0]=4 373 B10R1.61 O=C(O)C1=CN=CC=C1Br HR30049 [2,0,0,0,0,0|2,0,0]=4 374 B10R1.61 O=C(O)C1=CN=CC=C1Cl HR136495 [2,0,0,0,0,0|2,0,0]=4 375 B10R1.61 O=C(O)C1=CN=CC=C1I HR32033 [2,0,0,0,0,0|2,0,0]=4 376 B10R1.61 O=C(O)C1=CN=CN=C1O HR148280 [2,0,0,0,0,0|2,0,0]=4 377 B10R1.61 O=C(O)C1=NC=CC=C1Br HR130112 [2,0,0,0,0,0|2,0,0]=4 378 B10R1.61 O=C(O)C1=NC=CC=C1F HR5140 [2,0,0,0,0,0|2,0,0]=4 379 B10R1.61 O=C(O)C1=NC=CC=C1I HR147787 [2,0,0,0,0,0|2,0,0]=4 380 B10R1.61 O=C(O)C1=NC=CC=C1O HR129856 [2,0,0,0,0,0|1,0,0]=3 381 B10R1.61 O=C(O)C1=NC=CN=C1O HR8870 [2,0,0,0,0,0|2,0,0]=4 382 B10R1.61 O=C(O)c1cccnc1Cl HR110156 [2,0,0,0,0,0|2,0,0]=4 383 B10R1.61 O=C(O)c1ncccc1Cl HR132226 [2,0,0,0,0,0|2,0,0]=4 384 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 HR144253 [2,0,0,0,0,0|1,0,1]=4 385 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 HR105411 [2,0,0,0,0,0|0,0,1]=3 386 B10R1.61 O=C([O-])C1=CC=CC=C1O HR132880 [2,0,0,0,0,0|0,0,1]=3 387 B10R1.61 O=C([O-])C1=CC=CC=C1O HR133063 [2,0,0,0,0,0|0,0,1]=3 388 B10R1.61 O=C([O-])C1=CC=CC=C1O HR140036 [2,0,0,0,0,0|0,0,1]=3 389 B10R1.61 O=C([O-])C1=CC=CC=C1O HR140181 [2,0,0,0,0,0|0,0,1]=3 390 B10R1.61 O=C([O-])C1=CC=CC=C1O HR143915 [2,0,0,0,0,0|0,0,1]=3 391 B10R1.61 O=C([O-])c1ccccc1O HR133808 [2,0,0,0,0,0|0,0,1]=3 392 B10R1.61 O=C([O-])c1ccccc1O HR143157 [2,0,0,0,0,0|0,0,1]=3 393 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 HR133322 [2,0,0,0,0,0|1,0,1]=4 394 B10R1.61 OB(O)C1=C(O)C=CC=C1 HR116289 [2,0,0,0,0,0|1,0,1]=4 395 B10R1.61 OC1=CC=CC=C1C(=S)S HR143624 [2,0,0,0,0,0|0,2,0]=4 396 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 HR134086 [1,1,0,0,0,0|2,0,0]=4 397 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 HR115117 [1,1,0,0,0,0|1,0,0]=3 398 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 HR123750 [1,1,0,0,0,0|1,0,0]=3 399 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 HR3946 [1,1,0,0,0,0|0,0,0]=2 400 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 HR129424 [1,1,0,0,0,0|0,0,0]=2 401 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 HR143369 [1,1,0,0,0,0|1,0,0]=3 402 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 HR120132 [1,1,0,0,0,0|0,0,0]=2 403 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 HR104774 [1,1,0,0,0,0|2,0,0]=4 404 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 HR123367 [1,1,0,0,0,0|0,0,0]=2 405 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 HR129556 [1,1,0,0,0,0|0,0,0]=2 406 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HR123915 [1,1,0,0,0,0|0,0,0]=2 407 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HR127293 [1,1,0,0,0,0|0,0,0]=2 408 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 HR110997 [1,1,0,0,0,0|1,0,0]=3 409 B12R1.16 CCOC(=O)C1=CN=C(C)N=C1 HR111611 [1,1,0,0,0,0|2,0,0]=4 410 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 HR130814 [1,1,0,0,0,0|1,0,0]=3 411 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 HR116989 [1,1,0,0,0,0|2,0,0]=4 412 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 HR138771 [1,1,0,0,0,0|1,0,0]=3 413 B12R1.16 CCOC(=O)C1=CN=C(N)N=C1 HR22201 [1,1,0,0,0,0|2,0,0]=4 414 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 HR143370 [1,1,0,0,0,0|1,0,0]=3 415 B12R1.16 CCOC(=O)C1=CN=C(O)N=C1 HR115312 [1,1,0,0,0,0|2,0,0]=4 416 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 HR12621 [1,1,0,0,0,0|1,0,0]=3 417 B12R1.16 CCOC(=O)C1=NC=C(Br)C=N1 HR148127 [1,1,0,0,0,0|2,0,0]=4 418 B12R1.16 CCOC(=O)C1=NC=C(Br)N=C1 HR147757 [1,1,0,0,0,0|2,0,0]=4 419 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 HR148608 [1,1,0,0,0,0|1,0,0]=3 420 B12R1.16 CCOC(=O)C1=NC=C(N)N=C1 HR136080 [1,1,0,0,0,0|2,0,0]=4 421 B12R1.16 CCOC(=O)c1ccc(N)cc1 HR124144 [1,1,0,0,0,0|0,0,0]=2 422 B12R1.16 CCOC(=O)c1ccc(N)cc1 HR136064 [1,1,0,0,0,0|0,0,0]=2 423 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 HR115955 [1,1,0,0,0,0|2,0,0]=4 424 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 HR131870 [1,1,0,0,0,0|2,0,0]=4 425 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 HR136607 [1,1,0,0,0,0|2,0,0]=4 426 B12R1.17 CCOC(=O)C1=CC(Br)=CC=C1 HR134633 [1,1,0,0,0,0|0,0,0]=2 427 B12R1.17 CCOC(=O)C1=CC(Br)=NC=C1 HR15173 [1,1,0,0,0,0|1,0,0]=3 428 B12R1.17 CCOC(=O)C1=CC(C)=CC=C1 HR134475 [1,1,0,0,0,0|0,0,0]=2 429 B12R1.17 CCOC(=O)C1=CC(C)=CN=C1 HR115787 [1,1,0,0,0,0|1,0,0]=3 430 B12R1.17 CCOC(=O)C1=CC(Cl)=CC=C1 HR140619 [1,1,0,0,0,0|0,0,0]=2 431 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 HR146763 [1,1,0,0,0,0|1,0,0]=3 432 B12R1.17 CCOC(=O)C1=CC(F)=CC=C1 HR130900 [1,1,0,0,0,0|0,0,0]=2 433 B12R1.17 CCOC(=O)C1=CC(I)=CC=C1 HR121321 [1,1,0,0,0,0|0,0,0]=2 434 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 HR125017 [1,1,0,0,0,0|0,0,0]=2 435 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 HR110392 [1,1,0,0,0,0|1,0,0]=3 436 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 HR143164 [1,1,0,0,0,0|0,0,0]=2 437 B12R1.17 CCOC(=O)C1=CN=CC(Br)=C1 HR2416 [1,1,0,0,0,0|1,0,0]=3 438 B12R1.17 CCOC(=O)C1=NC(=O)NC=C1 HR30643 [1,1,0,0,0,0|2,0,0]=4 439 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 HR10591 [1,1,0,0,0,0|1,0,0]=3 440 B12R1.17 CCOC(=O)C1=NC(Br)=NC=C1 HR31773 [1,1,0,0,0,0|2,0,0]=4 441 B12R1.17 CCOC(=O)C1=NC(C)=NC=C1 HR112972 [1,1,0,0,0,0|2,0,0]=4 442 B12R1.17 CCOC(=O)C1=NC(Cl)=CC=C1 HR17513 [1,1,0,0,0,0|1,0,0]=3 443 B12R1.17 CCOC(=O)C1=NC(Cl)=NC=C1 HR30644 [1,1,0,0,0,0|2,0,0]=4 444 B12R1.17 CCOC(=O)C1=NC(N)=NC=C1 HR30642 [1,1,0,0,0,0|2,0,0]=4 445 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 HR103815 [1,1,0,0,0,0|1,0,0]=3 446 B12R1.17 CCOC(=O)C1=NC=CC(Cl)=C1 HR116261 [1,1,0,0,0,0|1,0,0]=3 447 B12R1.17 CCOC(=O)C1=NC=CC(N)=N1 HR119937 [1,1,0,0,0,0|2,0,0]=4 448 B12R1.17 CCOC(=O)C1=NC=NC(Cl)=C1 HR31767 [1,1,0,0,0,0|2,0,0]=4 449 B12R1.17 CCOC(=O)C1=NC=NC(O)=C1 HR31972 [1,1,0,0,0,0|2,0,0]=4 450 B12R1.17 CCOC(=O)c1cccc(N)c1 HR135156 [1,1,0,0,0,0|0,0,0]=2 451 B12R1.17 CCOC(=O)c1cccc(N)n1 HR147526 [1,1,0,0,0,0|1,0,0]=3 452 B12R1.17 CNCC(=O)C1=CC(O)=CC=C1 HR139204 [1,1,0,0,0,0|2,0,0]=4 453 B12R1.30 C#CCOC(=O)C1=CC=CC=C1 HR154538 [1,1,0,0,0,0|0,0,1]=3 454 B12R1.30 CCCCC(=O)C1=CC=CC=C1 HR134818 [1,1,0,0,0,0|1,0,0]=3 455 B12R1.30 CCCOC(=O)C1=CC=CC=C1 HR120887 [1,1,0,0,0,0|0,0,0]=2 456 B12R1.30 O=C(CCCO)C1=CC=CC=C1 HR129432 [1,1,0,0,0,0|1,0,0]=3 457 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 HR143643 [1,1,0,0,0,0|1,0,0]=3 458 B12R1.30 O=C(NCCO)C1=CN=CC=C1 HR147673 [1,1,0,0,0,0|2,0,0]=4 459 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 HR106956 [1,1,0,0,0,0|0,0,0]=2 460 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 HR118335 [1,1,0,0,0,0|0,0,0]=2 461 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 HR137616 [1,1,0,0,0,0|2,0,0]=4 462 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 HR121091 [1,1,0,0,0,0|2,0,0]=4 463 B12R1.39 CCOS(=O)(=O)C1=CC=CC=C1 HR135017 [1,1,0,0,0,0|1,0,0]=3 464 B12R1.39 CCO[Si](C)(C)C1=CC=CC=C1 HR140816 [1,1,0,0,0,0|1,1,0]=4 465 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HR134134 [1,1,0,0,0,0|1,0,1]=4 466 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 HR101162 [1,1,0,0,0,0|1,0,0]=3 467 B12R1.69 CCCCC1=C(O)C=C(O)C=C1 HR33193 [1,1,0,0,0,0|1,0,1]=4 468 B12R1.24 CCC(=O)C1=C(Br)C(F)=CC=C1 HR33372 [1,1,0,0,0,0|1,0,0]=3 469 B12R1.24 CCC(=O)C1=C(Cl)C(Cl)=CC=C1 HR121001 [1,1,0,0,0,0|1,0,0]=3 470 B12R1.24 CNC(=O)C1=C(C)C(N)=CC=C1 HR32738 [1,1,0,0,0,0|2,0,0]=4 471 B12R1.24 COC(=O)C1=C(Br)C(Br)=CC=C1 HR145117 [1,1,0,0,0,0|1,0,0]=3 472 B12R1.24 COC(=O)C1=C(Br)C(C)=CC=C1 HR118669 [1,1,0,0,0,0|1,0,0]=3 473 B12R1.24 COC(=O)C1=C(Br)C(Cl)=NC=C1 HR155610 [1,1,0,0,0,0|2,0,0]=4 474 B12R1.24 COC(=O)C1=C(Br)C(F)=CC=C1 HR154658 [1,1,0,0,0,0|1,0,0]=3 475 B12R1.24 COC(=O)C1=C(C)C(Br)=CC=C1 HR155381 [1,1,0,0,0,0|1,0,0]=3 476 B12R1.24 COC(=O)C1=C(C)C(Br)=CN=C1 HR152824 [1,1,0,0,0,0|2,0,0]=4 477 B12R1.24 COC(=O)C1=C(C)C(Cl)=CC=C1 HR154726 [1,1,0,0,0,0|1,0,0]=3 478 B12R1.24 COC(=O)C1=C(C)C(F)=CC=C1 HR156048 [1,1,0,0,0,0|1,0,0]=3 479 B12R1.24 COC(=O)C1=C(C)C(N)=CC=C1 HR132429 [1,1,0,0,0,0|1,0,0]=3 480 B12R1.24 COC(=O)C1=C(Cl)C(Cl)=CC=C1 HR106880 [1,1,0,0,0,0|1,0,0]=3 481 B12R1.24 COC(=O)C1=C(Cl)C(Cl)=NC=C1 HR156502 [1,1,0,0,0,0|2,0,0]=4 482 B12R1.24 COC(=O)C1=C(Cl)C(F)=CC=C1 HR153737 [1,1,0,0,0,0|1,0,0]=3 483 B12R1.24 COC(=O)C1=C(Cl)C(F)=NC=C1 HR155461 [1,1,0,0,0,0|2,0,0]=4 484 B12R1.24 COC(=O)C1=C(F)C(Br)=CC=C1 HR113257 [1,1,0,0,0,0|1,0,0]=3 485 B12R1.24 COC(=O)C1=C(F)C(Cl)=NC=C1 HR139883 [1,1,0,0,0,0|2,0,0]=4 486 B12R1.24 COC(=O)C1=C(F)C(F)=CC=C1 HR115763 [1,1,0,0,0,0|1,0,0]=3 487 B12R1.24 COC(=O)C1=C(F)C(N)=CC=C1 HR18729 [1,1,0,0,0,0|1,0,0]=3 488 B12R1.24 COC(=O)C1=C(N)C(Br)=CC=C1 HR148723 [1,1,0,0,0,0|1,0,0]=3 489 B12R1.24 COC(=O)C1=C(N)C(C)=CC=C1 HR136780 [1,1,0,0,0,0|1,0,0]=3 490 B12R1.24 COC(=O)C1=C(N)C(Cl)=CC=C1 HR124167 [1,1,0,0,0,0|1,0,0]=3 491 B12R1.24 COC(=O)C1=C(N)C(Cl)=NC=C1 HR33263 [1,1,0,0,0,0|2,0,0]=4 492 B12R1.24 COC(=O)C1=C(N)C(F)=CC=C1 HR121306 [1,1,0,0,0,0|1,0,0]=3 493 B12R1.24 COC(=O)C1=C(N)C(N)=CC=C1 HR119863 [1,1,0,0,0,0|1,0,0]=3 494 B12R1.24 COC(=O)C1=C(O)C(C)=CC=C1 HR135951 [1,1,0,0,0,0|0,0,0]=2 495 B12R1.24 COC(=O)C1=C(O)C(Cl)=CC=C1 HR148300 [1,1,0,0,0,0|0,0,0]=2 496 B12R1.24 COC(=O)C1=C(O)C(N)=CC=C1 HR117273 [1,1,0,0,0,0|0,0,0]=2 497 B12R1.24 COC(=O)C1=C(O)C(O)=CC=C1 HR143534 [1,1,0,0,0,0|0,0,0]=2 498 B12R1.24 COC(=O)C1=CN=CC(Br)=C1Cl HR153149 [1,1,0,0,0,0|2,0,0]=4 499 B12R1.24 O=C(CCl)C1=C(F)C(F)=CC=C1 HR119372 [1,1,0,0,0,0|2,0,0]=4 500 B12R1.77 CNc1ccccc1C(=O)OC HR134254 [1,1,0,0,0,0|1,0,0]=3 501 B12R1.77 COC(=O)C1=C(C#N)C=CC=C1 HR120756 [1,1,0,0,0,0|1,0,0]=3 502 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 HR126638 [1,1,0,0,0,0|0,0,1]=3 503 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 HR12369 [1,1,0,0,0,0|1,0,0]=3 504 B12R1.77 COC(=O)C1=C(CCl)C=CC=C1 HR124526 [1,1,0,0,0,0|1,0,0]=3 505 B12R1.77 COC(=O)C1=C(OC)C=CC=C1 HR131314 [1,1,0,0,0,0|0,0,0]=2 506 B12R1.77 COC(=O)C1=C(OC)C=NC=C1 HR117216 [1,1,0,0,0,0|1,0,0]=3 507 B12R1.77 COC(=O)C1=C(OC)N=CC=C1 HR110362 [1,1,0,0,0,0|1,0,0]=3 508 B12R1.77 COC(=O)C1=CN=CC=C1OC HR32379 [1,1,0,0,0,0|1,0,0]=3 509 B12R1.77 COC(=O)C1=NC=CC=C1C=O HR106278 [1,1,0,0,0,0|1,0,1]=4 510 B12R1.77 COC(=O)C1=NC=CC=C1OC HR147365 [1,1,0,0,0,0|1,0,0]=3 511 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 HR124684 [1,1,0,0,0,0|1,0,0]=3 512 B12R1.124 CN(N)C(=O)C1=C(N)C=CC=C1 HR103275 [1,1,0,0,0,0|2,0,0]=4 513 B12R1.195 CCC(C)(C)C1=C(O)C=CC=C1 HR118263 [1,1,0,0,0,0|1,0,1]=4 514 B12R1.195 COS(=O)(=O)C1=C(C)C=CC=C1 HR140459 [1,1,0,0,0,0|2,0,0]=4 515 B12R1.354 CCC(=O)C1=C(N)C=CC(Br)=C1 HR33617 [1,1,0,0,0,0|1,0,0]=3 516 B12R1.354 COC(=O)C1=C(Br)C=CC(Br)=C1 HR114741 [1,1,0,0,0,0|1,0,0]=3 517 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 HR122200 [1,1,0,0,0,0|1,0,0]=3 518 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 HR154399 [1,1,0,0,0,0|1,0,0]=3 519 B12R1.354 COC(=O)C1=C(Br)C=CC(I)=C1 HR155229 [1,1,0,0,0,0|1,0,0]=3 520 B12R1.354 COC(=O)C1=C(Br)N=CC(Cl)=C1 HR153106 [1,1,0,0,0,0|2,0,0]=4 521 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 HR134407 [1,1,0,0,0,0|1,0,0]=3 522 B12R1.354 COC(=O)C1=C(C)C=CC(F)=C1 HR109125 [1,1,0,0,0,0|1,0,0]=3 523 B12R1.354 COC(=O)C1=C(C)C=CC(N)=C1 HR106026 [1,1,0,0,0,0|1,0,0]=3 524 B12R1.354 COC(=O)C1=C(Cl)C=CC(=O)N1 HR105851 [1,1,0,0,0,0|2,0,0]=4 525 B12R1.354 COC(=O)C1=C(Cl)C=CC(Br)=C1 HR116970 [1,1,0,0,0,0|1,0,0]=3 526 B12R1.354 COC(=O)C1=C(Cl)C=CC(C)=C1 HR154048 [1,1,0,0,0,0|1,0,0]=3 527 B12R1.354 COC(=O)C1=C(Cl)C=CC(Cl)=C1 HR113192 [1,1,0,0,0,0|1,0,0]=3 528 B12R1.354 COC(=O)C1=C(Cl)C=CC(F)=C1 HR154757 [1,1,0,0,0,0|1,0,0]=3 529 B12R1.354 COC(=O)C1=C(Cl)N=CC(Br)=C1 HR12966 [1,1,0,0,0,0|2,0,0]=4 530 B12R1.354 COC(=O)C1=C(Cl)N=CC(Cl)=C1 HR147647 [1,1,0,0,0,0|2,0,0]=4 531 B12R1.354 COC(=O)C1=C(Cl)N=CC(I)=C1 HR118470 [1,1,0,0,0,0|2,0,0]=4 532 B12R1.354 COC(=O)C1=C(Cl)N=CC(O)=C1 HR30250 [1,1,0,0,0,0|2,0,0]=4 533 B12R1.354 COC(=O)C1=C(F)C=CC(Br)=C1 HR144532 [1,1,0,0,0,0|1,0,0]=3 534 B12R1.354 COC(=O)C1=C(F)C=CC(C)=C1 HR154734 [1,1,0,0,0,0|1,0,0]=3 535 B12R1.354 COC(=O)C1=C(F)C=CC(F)=C1 HR104852 [1,1,0,0,0,0|1,0,0]=3 536 B12R1.354 COC(=O)C1=C(F)C=CC(I)=C1 HR154451 [1,1,0,0,0,0|1,0,0]=3 537 B12R1.354 COC(=O)C1=C(F)N=CC(Br)=C1 HR148097 [1,1,0,0,0,0|2,0,0]=4 538 B12R1.354 COC(=O)C1=C(F)N=CC(Cl)=C1 HR152653 [1,1,0,0,0,0|2,0,0]=4 539 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 HR102887 [1,1,0,0,0,0|1,0,0]=3 540 B12R1.354 COC(=O)C1=C(I)C=CC(Cl)=C1 HR155781 [1,1,0,0,0,0|1,0,0]=3 541 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 HR144047 [1,1,0,0,0,0|1,0,0]=3 542 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=C1 HR3346 [1,1,0,0,0,0|1,0,0]=3 543 B12R1.354 COC(=O)C1=C(N)C=CC(F)=C1 HR102901 [1,1,0,0,0,0|1,0,0]=3 544 B12R1.354 COC(=O)C1=C(N)C=CC(O)=C1 HR147891 [1,1,0,0,0,0|1,0,0]=3 545 B12R1.354 COC(=O)C1=C(N)N=CC(C)=C1 HR148173 [1,1,0,0,0,0|2,0,0]=4 546 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 ELXM02406 [1,1,0,0,0,0|0,0,0]=2 547 B12R1.354 COC(=O)C1=C(O)C=CC(Cl)=C1 HR125728 [1,1,0,0,0,0|0,0,0]=2 548 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 HR125415 [1,1,0,0,0,0|0,0,0]=2 549 B12R1.354 COC(=O)C1=C(O)N=CC(Br)=C1 HR102545 [1,1,0,0,0,0|1,0,0]=3 550 B12R1.354 COC(=O)C1=CC(Br)=CN=C1Br HR152640 [1,1,0,0,0,0|2,0,0]=4 551 B12R1.354 COC(=O)C1=CC(Br)=CN=C1N HR103709 [1,1,0,0,0,0|2,0,0]=4 552 B12R1.354 COC(=O)C1=CC(Br)=NC=C1Br HR152623 [1,1,0,0,0,0|2,0,0]=4 553 B12R1.354 COC(=O)C1=CC(C)=CC=C1O HR129827 [1,1,0,0,0,0|0,0,0]=2 554 B12R1.354 COC(=O)C1=CC(C)=CN=C1F HR152749 [1,1,0,0,0,0|2,0,0]=4 555 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1C HR103992 [1,1,0,0,0,0|2,0,0]=4 556 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Br HR152996 [1,1,0,0,0,0|2,0,0]=4 557 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1Cl HR152676 [1,1,0,0,0,0|2,0,0]=4 558 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1F HR107013 [1,1,0,0,0,0|2,0,0]=4 559 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1O HR33524 [1,1,0,0,0,0|1,0,0]=3 560 B12R1.354 COC(=O)C1=CC(F)=NC=C1Br HR153156 [1,1,0,0,0,0|2,0,0]=4 561 B12R1.354 COC(=O)C1=CC(I)=CC=C1N HR121942 [1,1,0,0,0,0|1,0,0]=3 562 B12R1.354 COC(=O)C1=CC(I)=CC=C1O HR121630 [1,1,0,0,0,0|0,0,0]=2 563 B12R1.354 COC(=O)C1=CC(I)=CNC1=O HR118159 [1,1,0,0,0,0|1,0,1]=4 564 B12R1.354 COC(=O)C1=CC(N)=NC=C1Br HR121737 [1,1,0,0,0,0|2,0,0]=4 565 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1C HR104018 [1,1,0,0,0,0|2,0,0]=4 566 B12R1.354 COC(=O)C1=NC(N)=CC=C1Br HR119352 [1,1,0,0,0,0|2,0,0]=4 567 B12R1.354 COC(=O)c1nc(Cl)ccc1Cl HR116901 [1,1,0,0,0,0|2,0,0]=4 568 B12R1.354 O=C(CBr)c1cc(F)ccc1F HR121840 [1,1,0,0,0,0|2,0,0]=4 569 B12R1.354 O=C(CCl)c1cc(F)ccc1F HR128871 [1,1,0,0,0,0|2,0,0]=4 570 B12R1.1703 CCC(=O)C1=C(F)C=C(Br)C=C1 HR31893 [1,1,0,0,0,0|1,0,0]=3 571 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HR119761 [1,1,0,0,0,0|0,0,0]=2 572 B12R1.1703 CCC(=O)c1ccc(F)cc1F HR137095 [1,1,0,0,0,0|1,0,0]=3 573 B12R1.1703 CNC(=O)C1=C(F)C=C(Br)C=C1 HR143951 [1,1,0,0,0,0|2,0,0]=4 574 B12R1.1703 CNC(=O)c1ccc(N)cc1F HR34131 [1,1,0,0,0,0|2,0,0]=4 575 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 HR117962 [1,1,0,0,0,0|1,0,0]=3 576 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)C=C1 HR148625 [1,1,0,0,0,0|1,0,0]=3 577 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 HR152371 [1,1,0,0,0,0|1,0,0]=3 578 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 HR33504 [1,1,0,0,0,0|2,0,0]=4 579 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 HR147839 [1,1,0,0,0,0|1,0,0]=3 580 B12R1.1703 COC(=O)C1=C(C)C=C(Br)N=C1 HR153017 [1,1,0,0,0,0|2,0,0]=4 581 B12R1.1703 COC(=O)C1=C(C)C=C(F)C=C1 HR148734 [1,1,0,0,0,0|1,0,0]=3 582 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=C1 HR108816 [1,1,0,0,0,0|1,0,0]=3 583 B12R1.1703 COC(=O)C1=C(C)N=C(F)C=C1 HR152995 [1,1,0,0,0,0|2,0,0]=4 584 B12R1.1703 COC(=O)C1=C(Cl)C=C(C)C=C1 HR154439 [1,1,0,0,0,0|1,0,0]=3 585 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)C=C1 HR106566 [1,1,0,0,0,0|1,0,0]=3 586 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 HR110721 [1,1,0,0,0,0|1,0,0]=3 587 B12R1.1703 COC(=O)C1=C(Cl)C=C(N)C=C1 HR128259 [1,1,0,0,0,0|1,0,0]=3 588 B12R1.1703 COC(=O)C1=C(Cl)C=C(O)C=C1 HR154078 [1,1,0,0,0,0|1,0,0]=3 589 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 HR111311 [1,1,0,0,0,0|1,0,0]=3 590 B12R1.1703 COC(=O)C1=C(F)C=C(Cl)C=C1 HR114701 [1,1,0,0,0,0|1,0,0]=3 591 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 HR113443 [1,1,0,0,0,0|1,0,0]=3 592 B12R1.1703 COC(=O)C1=C(F)C=C(N)C=C1 HR146902 [1,1,0,0,0,0|1,0,0]=3 593 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=C1 HR148466 [1,1,0,0,0,0|1,0,0]=3 594 B12R1.1703 COC(=O)C1=C(F)N=C(Cl)C=C1 HR150603 [1,1,0,0,0,0|2,0,0]=4 595 B12R1.1703 COC(=O)C1=C(F)N=C(F)C=C1 HR150570 [1,1,0,0,0,0|2,0,0]=4 596 B12R1.1703 COC(=O)C1=C(N)C=C(Br)C=C1 HR4635 [1,1,0,0,0,0|1,0,0]=3 597 B12R1.1703 COC(=O)C1=C(N)C=C(C)C=C1 HR147922 [1,1,0,0,0,0|1,0,0]=3 598 B12R1.1703 COC(=O)C1=C(N)C=C(Cl)C=C1 HR4643 [1,1,0,0,0,0|1,0,0]=3 599 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 HR151182 [1,1,0,0,0,0|1,0,0]=3 600 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 HR113165 [1,1,0,0,0,0|0,0,0]=2 601 B12R1.1703 COC(=O)C1=C(O)C=C(N)C=C1 HR134223 [1,1,0,0,0,0|0,0,0]=2 602 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 HR128923 [1,1,0,0,0,0|0,0,0]=2 603 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1C HR156408 [1,1,0,0,0,0|2,0,0]=4 604 B12R1.1703 COC(=O)C1=CC=C(C)C=C1O HR135901 [1,1,0,0,0,0|0,0,0]=2 605 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl HR109610 [1,1,0,0,0,0|2,0,0]=4 606 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1C HR156395 [1,1,0,0,0,0|2,0,0]=4 607 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1Cl HR119407 [1,1,0,0,0,0|2,0,0]=4 608 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C HR156523 [1,1,0,0,0,0|2,0,0]=4 609 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl HR134902 [1,1,0,0,0,0|2,0,0]=4 610 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C HR17156 [1,1,0,0,0,0|2,0,0]=4 611 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl HR111319 [1,1,0,0,0,0|2,0,0]=4 612 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br HR155245 [1,1,0,0,0,0|2,0,0]=4 613 B12R1.1703 COC(=O)c1ccc(Br)nc1Br HR152692 [1,1,0,0,0,0|2,0,0]=4 614 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 HR103331 [1,1,0,0,0,0|2,0,0]=4 615 B12R1.1703 NCC(=O)C1=C(F)C=C(F)C=C1 HR103644 [1,1,0,0,0,0|2,0,0]=4 616 B12R1.1703 NCC(=O)c1ccc(Cl)cc1Cl HR132739 [1,1,0,0,0,0|2,0,0]=4 617 B12R1.1703 NCC(=O)c1ccc(F)cc1F HR122968 [1,1,0,0,0,0|2,0,0]=4 618 B12R1.1703 O=C(CBr)C1=C(Cl)C=C(Cl)C=C1 LEXM00302 [1,1,0,0,0,0|2,0,0]=4 619 B12R1.1703 O=C(CBr)c1ccc(F)cc1F HR123499 [1,1,0,0,0,0|2,0,0]=4 620 B12R1.1703 O=C(CCl)C1=C(Cl)C=C(Cl)C=C1 HR136534 [1,1,0,0,0,0|2,0,0]=4 621 B12R1.1703 O=C(CCl)c1ccc(F)cc1F HR133348 [1,1,0,0,0,0|2,0,0]=4 622 B12R1.3441 CCC(=O)C1=C(F)C=CC=C1F HR119129 [1,1,0,0,0,0|1,0,0]=3 623 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1C HR141811 [1,1,0,0,0,0|1,0,0]=3 624 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1Cl HR108072 [1,1,0,0,0,0|1,0,0]=3 625 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1F HR151990 [1,1,0,0,0,0|1,0,0]=3 626 B12R1.3441 COC(=O)C1=C(Br)C=CN=C1Cl HR152929 [1,1,0,0,0,0|2,0,0]=4 627 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1Br HR152643 [1,1,0,0,0,0|2,0,0]=4 628 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1F HR152622 [1,1,0,0,0,0|2,0,0]=4 629 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1O HR154062 [1,1,0,0,0,0|0,0,0]=2 630 B12R1.3441 COC(=O)C1=C(Cl)C=NC=C1Cl HR155648 [1,1,0,0,0,0|2,0,0]=4 631 B12R1.3441 COC(=O)C1=C(Cl)N=CC=C1Cl HR154586 [1,1,0,0,0,0|2,0,0]=4 632 B12R1.3441 COC(=O)C1=C(F)C=CC=C1F HR111029 [1,1,0,0,0,0|1,0,0]=3 633 B12R1.3441 COC(=O)C1=C(I)C=CC=C1C HR139112 [1,1,0,0,0,0|1,0,0]=3 634 B12R1.3441 COC(=O)C1=C(I)C=CN=C1Cl HR152953 [1,1,0,0,0,0|2,0,0]=4 635 B12R1.3441 COC(=O)C1=C(I)C=CN=C1F HR143760 [1,1,0,0,0,0|2,0,0]=4 636 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl HR103705 [1,1,0,0,0,0|2,0,0]=4 637 B12R1.3441 O=C(CBr)C1=C(F)C=CC=C1F HR122753 [1,1,0,0,0,0|2,0,0]=4 638 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 HR31817 [0,1,0,0,1,0|2,0,0]=4 639 B12R1.313 CCOC(=O)C1=C(C)NC(C)=C1 HR30450 [0,1,0,0,1,0|2,0,0]=4 640 B12R1.316 CCOC(=O)C1=C(C#N)C=CN1 HR116514 [0,1,0,0,1,0|2,0,0]=4 641 B12R1.1589 CCOC(=O)C1=C(C)NC=C1C HR127437 [0,1,0,0,1,0|2,0,0]=4 642 B12R1.1589 CCOC(=O)C1=C(C)SC=C1C HR155477 [0,1,0,0,1,0|2,0,0]=4 643 B12R1.1589 CCOC(=O)C1=C(N)SC=C1C HR109771 [0,1,0,0,1,0|2,0,0]=4 644 B14R1.17 CCOC(=O)CC1=C(Cl)C(Cl)=CC=C1 HR120523 [0,1,0,0,0,1|1,0,0]=3 645 B14R1.337 CC(C)NC(=O)OC1=C(F)C=CC=C1 HR153589 [0,1,0,0,0,1|2,0,0]=4 646 B14R1.965 CCOC(=O)CC1=C(C#N)C=CC=C1 HR107720 [0,1,0,0,0,1|1,0,0]=3 647 B14R1.6823 CCOC(=O)Cc1ccc(Cl)cc1Cl HR143135 [0,1,0,0,0,1|1,0,0]=3 648 B14R1.19171 CCOC(=O)CC1=C(Cl)C=CC=C1F HR116117 [0,1,0,0,0,1|1,0,0]=3 649 B14R1.7265 CCOC(=O)C1=C(C)C(C)=C(Br)C=C1 HR154760 [0,2,0,0,0,0|1,0,0]=3 650 B14R1.7265 CCOC(=O)C1=C(C)C(F)=C(F)C=C1 HR155464 [0,2,0,0,0,0|1,0,0]=3 651 B14R1.7265 CCOC(=O)C1=C(Cl)C(F)=C(Cl)C=C1 HR155220 [0,2,0,0,0,0|1,0,0]=3 652 B14R1.7265 CCOC(=O)C1=C(F)C(F)=C(C)C=C1 HR154753 [0,2,0,0,0,0|1,0,0]=3 653 B14R1.7265 CCOC(=O)C1=C(O)C(O)=C(Br)C=C1 HR32958 [0,2,0,0,0,0|0,0,0]=2 654 B14R1.7265 CCOC(=O)C1=CNC(=O)C(Cl)=C1O HR116147 [0,2,0,0,0,0|1,0,0]=3 655 B14R1.7281 CCOC(=O)C1=C(Br)C(F)=CC=C1F HR155503 [0,2,0,0,0,0|1,0,0]=3 656 B14R1.7281 CCOC(=O)C1=C(F)C(Br)=CC=C1F HR155512 [0,2,0,0,0,0|1,0,0]=3 657 B14R1.7281 CCOC(=O)c1c(F)ccc(F)c1Cl HR155261 [0,2,0,0,0,0|1,0,0]=3 658 B14R1.18985 CCOC(=O)C1=C(C)C(Cl)=CC(Cl)=C1 HR155238 [0,2,0,0,0,0|1,0,0]=3 659 B14R1.18985 CCOC(=O)C1=C(Cl)C(C)=CC(F)=C1 HR154786 [0,2,0,0,0,0|1,0,0]=3 660 B14R1.18985 CCOC(=O)C1=C(Cl)C(F)=CC(C)=C1 HR155247 [0,2,0,0,0,0|1,0,0]=3 661 B14R1.18985 CCOC(=O)C1=C(F)C(Br)=CC(C)=C1 HR155203 [0,2,0,0,0,0|1,0,0]=3 662 B14R1.587 COC(=O)CC(=O)C1=C(O)C=CC=C1 HR116076 [0,2,0,0,0,0|1,0,1]=4 663 B14R1.4451 CC(C)(C)OC(=O)C1=C(Br)C=CC=C1 HR153700 [0,2,0,0,0,0|1,0,0]=3 664 B14R1.4451 CC(C)(C)OC(=O)C1=CC=CN=C1Cl HR113529 [0,2,0,0,0,0|2,0,0]=4 665 B14R1.599 CCOC(=O)C1=C(OC)C=CC(F)=C1 HR155786 [0,2,0,0,0,0|0,0,0]=2 666 B14R1.601 CCOC(=O)C1=NC(OC)=CC=C1N HR120035 [0,2,0,0,0,0|2,0,0]=4 667 B14R1.918 O=C(NCCO)C1=C(O)C=CC(O)=C1 HR142391 [0,2,0,0,0,0|1,0,0]=3 668 B14R1.7264 CCOC(=O)C1=C(Br)C=C(F)C(F)=C1 HR154699 [0,2,0,0,0,0|1,0,0]=3 669 B14R1.7264 CCOC(=O)C1=C(C)C=C(Br)C(C)=C1 HR154841 [0,2,0,0,0,0|1,0,0]=3 670 B14R1.7264 CCOC(=O)C1=C(F)C=C(Cl)C(F)=C1 HR156530 [0,2,0,0,0,0|1,0,0]=3 671 B14R1.7264 CCOC(=O)C1=C(N)C=C(Cl)C(Cl)=C1 HR148575 [0,2,0,0,0,0|1,0,0]=3 672 B14R1.7264 CCOC(=O)C1=CC(F)=C(Cl)N=C1Cl HR106994 [0,2,0,0,0,0|2,0,0]=4 673 B14R1.263 CCCC(=O)C1=C(OCC)C=CN=C1 HR33844 [0,2,0,0,0,0|2,0,0]=4 674 B14R1.263 CCOC(=O)C1=C(OCC)C=CC=C1 HR124653 [0,2,0,0,0,0|0,0,0]=2 675 B14R1.263 CCOC(=O)C1=C(OCC)N=CC=C1 HR153112 [0,2,0,0,0,0|1,0,0]=3 676 B14R1.623 CCOC(=O)C1=C(B(O)O)C=CC=C1 HR113825 [0,2,0,0,0,0|0,0,0]=2 677 B14R1.7276 CCOC(=O)C1=C(Br)C=CC=C1OC HR155589 [0,2,0,0,0,0|0,0,0]=2 678 B14R1.160 CC(C)COC(=O)C1=C(N)C=CC=C1 HR127044 [0,2,0,0,0,0|1,0,0]=3 679 B14R1.160 CC(C)COC(=O)C1=CC=CC=C1O HR124358 [0,2,0,0,0,0|0,0,0]=2 680 B14R1.1035 CCCCOC(=O)C1=CC=CC=C1O HR125171 [0,2,0,0,0,0|0,0,0]=2 681 B14R1.2523 O=C(NCCO)C1=C(O)C=C(O)C=C1 HR131770 [0,2,0,0,0,0|1,0,0]=3 682 B14R1.3624 CCN(CC)C(=O)C1=C(O)C=CC=C1 HR123297 [0,2,0,0,0,0|1,0,0]=3 683 B14R1.7234 CCOC(=O)C1=C(F)C=C(OC)C=C1 HR154877 [0,2,0,0,0,0|1,0,0]=3 684 B14R1.7234 CCOC(=O)C1=CN=C(SC)N=C1O HR103046 [0,2,0,0,0,0|2,0,0]=4 685 B14R1.18811 CCOC(=O)C1=C(Br)C=C(F)C=C1Br HR155916 [0,2,0,0,0,0|1,0,0]=3 686 B14R1.18811 CCOC(=O)C1=C(Br)C=C(F)C=C1F HR154888 [0,2,0,0,0,0|1,0,0]=3 687 B14R1.18811 CCOC(=O)C1=C(C)C=C(C)C=C1C HR135002 [0,2,0,0,0,0|1,0,0]=3 688 B14R1.18811 CCOC(=O)C1=C(C)C=C(Cl)C=C1C HR154881 [0,2,0,0,0,0|1,0,0]=3 689 B14R1.18811 CCOC(=O)C1=C(C)N=C(Cl)C=C1Cl HR140935 [0,2,0,0,0,0|2,0,0]=4 690 B14R1.18811 CCOC(=O)C1=C(C)OC(=O)C=C1C HR127417 [0,2,0,0,0,0|2,0,0]=4 691 B14R1.18811 CCOC(=O)C1=C(Cl)C=C(Br)C=C1C HR155268 [0,2,0,0,0,0|1,0,0]=3 692 B14R1.18811 CCOC(=O)C1=C(Cl)C=C(C)N=C1C HR114764 [0,2,0,0,0,0|2,0,0]=4 693 B14R1.18811 CCOC(=O)C1=C(Cl)C=C(C)N=C1Cl HR126297 [0,2,0,0,0,0|2,0,0]=4 694 B14R1.18811 CCOC(=O)C1=C(F)C=C(F)C=C1F HR155489 [0,2,0,0,0,0|1,0,0]=3 695 B14R1.18811 CCOC(=O)C1=C(O)N=C(C)C=C1C HR32527 [0,2,0,0,0,0|1,0,0]=3 696 B14R1.18811 CCOC(=O)C1=C(O)N=C(C)C=C1O HR126560 [0,2,0,0,0,0|1,0,0]=3 697 B12R1.32 CCOC(=O)CC1=CC=CC=C1 HR133131 [0,0,1,1,0,0|1,0,1]=4 698 B12R1.32 CCOC(=O)CC1=NC=CC=C1 HR114031 [0,0,1,1,0,0|1,0,1]=4 699 B12R1.51 CCOC(=O)CCC1=CC=CO1 HR139371 [0,0,1,1,0,0|0,0,2]=4 700 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 HR133665 [0,0,1,1,0,0|2,0,0]=4 701 B12R1.283 CCOC1=C(C(=O)O)C=CC=N1 HR153110 [0,0,1,1,0,0|2,0,0]=4 702 B12R1.55 CCOC(=O)C(=O)C1=CC=CS1 HR117772 [0,0,1,1,0,0|1,1,0]=4 703 B12R1.312 C=CC1=NC(C(=O)OCC)=CO1 HR106464 [0,0,1,1,0,0|1,0,0]=3 704 B12R1.312 CCOC(=O)C1=COC(C=O)=N1 HR105837 [0,0,1,1,0,0|2,0,0]=4 705 B12R2.2 C1=CC=C(C2=CCCC2)C=C1 HR141466 [1,0,0,1,0,0|2,0,0]=4 706 B12R2.2 C1=CC=C(C2=NCCN2)C=C1 HR129619 [1,0,0,1,0,0|2,0,0]=4 707 B12R2.2 C1=CC=C(C2=NCCO2)C=C1 HR112193 [1,0,0,1,0,0|1,0,0]=3 708 B12R2.1081 O=C1CCCC2=C1C=CC=N2 HR104993 [1,0,0,1,0,0|2,0,0]=4 709 B12R2.1081 O=C1CCCC2=C1C=CN=C2 HR120098 [1,0,0,1,0,0|2,0,0]=4 710 B12R2.1081 O=C1CCCC2=C1C=NC=C2 HR120765 [1,0,0,1,0,0|2,0,0]=4 711 B12R2.1081 O=C1CCCC2=C1N=CC=C2 HR130627 [1,0,0,1,0,0|2,0,0]=4 712 B12R2.1081 O=C1CCCC2=CC=CC=C12 HR132797 [1,0,0,1,0,0|1,0,0]=3 713 B12R2.1081 O=C1CCCc2cnccc21 HR115668 [1,0,0,1,0,0|2,0,0]=4 714 B12R2.1081 O=C1CCNC2=CC=CC=C12 HR30546 [1,0,0,1,0,0|2,0,0]=4 715 B12R2.1081 O=C1CCOC2=CC=CC=C12 HR126217 [1,0,0,1,0,0|2,0,0]=4 716 B12R2.1081 O=C1CCSC2=CC=CC=C12 HR142757 [1,0,0,1,0,0|2,0,0]=4 717 B12R2.1081 O=C1COCC2=CC=CC=C12 HR147792 [1,0,0,1,0,0|2,0,0]=4 718 B12R2.1081 O=C1NCCC2=CC=CC=C12 HR129688 [1,0,0,1,0,0|1,0,0]=3 719 B12R2.1081 O=C1OCCC2=CC=CC=C12 HR31885 [1,0,0,1,0,0|0,0,0]=2 720 B12R2.1081 O=C1OCCC2=CC=NC=C12 HR112992 [1,0,0,1,0,0|1,0,0]=3 721 B12R2.1081 OB1OCCC2=C1C=CC=C2 HR115814 [1,0,0,1,0,0|1,0,1]=4 722 B12R2.2028 CC1CC(=O)C2=CC=CC=C21 HR112566 [1,0,0,1,0,0|1,0,0]=3 723 B12R2.2028 CC1OB(O)C2=C1C=CC=C2 HR153403 [1,0,0,1,0,0|1,0,1]=4 724 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 NASA01414 [1,0,0,1,0,0|1,0,1]=4 725 B12R2.2028 O=C1OC(Br)C2=CC=CC=C12 HR123586 [1,0,0,1,0,0|1,0,0]=3 726 B12R2.2028 O=C1OC(Cl)C2=C1C=CC=C2 HR130975 [1,0,0,1,0,0|1,0,0]=3 727 B12R2.32 CCC1=CC2=C(C=CC=C2)O1 HR138004 [1,0,0,1,0,0|1,0,0]=3 728 B12R2.32 CCC1=CC2=CC=CC=C2N1 HR109310 [1,0,0,1,0,0|2,0,0]=4 729 B12R2.196 CN1C=CC2=C1C=CC=C2O HR148416 [1,0,0,1,0,0|2,0,0]=4 730 B12R2.196 CN1N=CC2=C1C=CC=C2O HR30533 [1,0,0,1,0,0|2,0,0]=4 731 B12R2.1 CCC1=C2C=CC=CC2=NN1 HR121575 [1,0,0,1,0,0|2,0,0]=4 732 B12R2.1 CCC1=CNC2=CC=CC=C12 HR104764 [1,0,0,1,0,0|2,0,0]=4 733 B12R2.18 CC1=C(C)C2=C(C=CC=C2)O1 HR100052 [1,0,0,1,0,0|1,0,1]=4 734 B12R2.18 CC1CC2=CC=CC=C2C1=O HR122000 [1,0,0,1,0,0|1,0,0]=3 735 B12R2.18 CN1NC2=CC=CC=C2C1=O HR31920 [1,0,0,1,0,0|2,0,0]=4 736 B12R2.18 O=C1C2=CC=CC=C2CC1Br HR138045 [1,0,0,1,0,0|2,0,0]=4 737 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 HR118490 [1,0,0,1,0,0|1,0,0]=3 738 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 HR124125 [1,0,0,1,0,0|1,0,0]=3 739 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 HR123543 [1,0,0,1,0,0|1,0,0]=3 740 B12R2.203 O=C1CCC2=CC=CC(F)=C12 HR124373 [1,0,0,1,0,0|1,0,0]=3 741 B12R2.203 O=C1CCC2=CC=CC(O)=C12 HR105905 [1,0,0,1,0,0|0,0,0]=2 742 B12R2.203 O=C1CCc2cccc(Cl)c21 HR126278 [1,0,0,1,0,0|1,0,0]=3 743 B12R2.203 O=C1NCC2=CC=CC(Br)=C12 HR143754 [1,0,0,1,0,0|2,0,0]=4 744 B14R2.112 CCOC1=CC2=CC=CC=C2C=C1 HR130256 [0,0,0,1,0,1|2,0,0]=4 745 B14R2.390 O=C1CCCC2=C(N1)C(F)=CC=C2 HR110291 [0,0,0,1,0,1|2,0,0]=4 746 B14R2.4621 O=C(Cc1ccccc1F)C2CC2 HR123036 [0,0,0,1,0,1|2,0,0]=4 747 B14R2.517 CO\C=C1\C(=O)OC2=C1C=CC=C2 HR117702 [0,1,0,1,0,0|2,0,0]=4 748 B14R2.1129 CCC1=C(C#N)C2=C(C=CC=C2)O1 HR121845 [0,1,0,1,0,0|2,0,0]=4 749 B14R2.1129 CCC1=C(C=O)C2=C(C=CC=C2)O1 HR120589 [0,1,0,1,0,0|1,0,0]=3 750 B14R2.7150 CCOC1=CC=CC2=CC=CC=C21 HR105391 [0,1,0,1,0,0|2,0,0]=4 751 B14R2.11635 COC1=C2C(=O)CCCC2=CC=C1 HR147571 [0,1,0,1,0,0|1,0,0]=3 752 B14R2.2 CC(=O)OC1=COC2=C1C=CC=C2 HR104843 [0,1,0,1,0,0|1,0,1]=4 753 B14R2.8052 CC1(C)OC(=O)C2=C1C=CN=C2Cl HR34079 [0,1,0,1,0,0|2,0,0]=4 754 B14R2.5637 O=C1CCCNC2=C1C=C(Cl)C=C2 HR103698 [0,1,0,1,0,0|2,0,0]=4 755 B14R2.5637 O=C1NCCOC2=C1C=C(Br)C=C2 ELXM02402 [0,1,0,1,0,0|1,0,0]=3 756 B14R2.215 CCN1C(=O)C2=CC=CC=C2C1=O HR112094 [0,1,0,1,0,0|1,0,1]=4 757 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)N1 HR107757 [0,1,0,1,0,0|2,0,0]=4 758 B14R2.8719 O=C1CCCCC2=C1C=CC(Br)=C2 HR114045 [0,1,0,1,0,0|2,0,0]=4 759 B10R1.11 CCOC(=O)C1=CC=CN1 HR14843 [1,0,0,0,1,0|1,0,0]=3 760 B10R1.11 CCOC(=O)C1=CC=CO1 HR131883 [1,0,0,0,1,0|1,0,0]=3 761 B10R1.11 CCOC(=O)C1=CC=CS1 HR123759 [1,0,0,0,1,0|1,0,0]=3 762 B10R1.11 CCOC(=O)C1=CN=CO1 HR120344 [1,0,0,0,1,0|2,0,0]=4 763 B10R1.11 CCOC(=O)C1=CN=CS1 HR133317 [1,0,0,0,1,0|2,0,0]=4 764 B10R1.11 CCOC(=O)C1=CNC=N1 HR30079 [1,0,0,0,1,0|2,0,0]=4 765 B10R1.11 CCOC(=O)C1=CNN=C1 HR130389 [1,0,0,0,1,0|2,0,0]=4 766 B10R1.11 CCOC(=O)C1=COC=C1 HR119569 [1,0,0,0,1,0|1,0,0]=3 767 B10R1.11 CCOC(=O)C1=COC=N1 HR15937 [1,0,0,0,1,0|2,0,0]=4 768 B10R1.11 CCOC(=O)C1=CON=C1 HR109645 [1,0,0,0,1,0|2,0,0]=4 769 B10R1.11 CCOC(=O)C1=CSC=C1 HR118607 [1,0,0,0,1,0|1,0,0]=3 770 B10R1.11 CCOC(=O)C1=CSC=N1 HR143288 [1,0,0,0,1,0|2,0,0]=4 771 B10R1.11 CCOC(=O)C1=NC=CN1 HR112529 [1,0,0,0,1,0|2,0,0]=4 772 B10R1.11 CCOC(=O)C1=NC=CO1 HR102588 [1,0,0,0,1,0|2,0,0]=4 773 B10R1.11 CCOC(=O)C1=NNC=C1 HR115529 [1,0,0,0,1,0|2,0,0]=4 774 B10R1.149 COC(=O)C1=C(Br)C=CS1 HR32756 [1,0,0,0,1,0|2,0,0]=4 775 B10R1.149 COC(=O)C1=C(C)C=CO1 HR128331 [1,0,0,0,1,0|2,0,0]=4 776 B10R1.149 COC(=O)C1=C(C)C=CS1 HR10098 [1,0,0,0,1,0|2,0,0]=4 777 B10R1.149 COC(=O)C1=C(C)OC=C1 HR145352 [1,0,0,0,1,0|2,0,0]=4 778 B10R1.149 COC(=O)C1=C(C)SC=C1 HR15770 [1,0,0,0,1,0|2,0,0]=4 779 B10R1.149 COC(=O)C1=C(Cl)C=CS1 HR144257 [1,0,0,0,1,0|2,0,0]=4 780 B10R1.149 COC(=O)C1=C(F)C=CS1 HR15241 [1,0,0,0,1,0|2,0,0]=4 781 B10R1.149 COC(=O)C1=C(I)C=CS1 HR32415 [1,0,0,0,1,0|2,0,0]=4 782 B10R1.149 COC(=O)C1=C(N)C=CO1 HR119353 [1,0,0,0,1,0|2,0,0]=4 783 B10R1.149 COC(=O)C1=C(N)C=CS1 HR7304 [1,0,0,0,1,0|2,0,0]=4 784 B10R1.149 COC(=O)C1=C(N)SC=C1 HR5551 [1,0,0,0,1,0|2,0,0]=4 785 B10R1.149 COC(=O)C1=C(O)C=CS1 HR131605 [1,0,0,0,1,0|1,0,0]=3 786 B10R1.149 COC(=O)C1=CC=CN1C HR124791 [1,0,0,0,1,0|2,0,0]=4 787 B10R1.149 COC(=O)C1=CSC=C1C HR153402 [1,0,0,0,1,0|2,0,0]=4 788 B10R1.149 COC(=O)C1=CSC=C1N HR106147 [1,0,0,0,1,0|2,0,0]=4 789 B10R1.149 COC(=O)C1=CSC=C1N HR108676 [1,0,0,0,1,0|2,0,0]=4 790 B14R1.598 CCOC(=O)CCC1=C(Br)C=CC=C1 HR122074 [0,0,0,0,0,2|1,0,0]=3 791 B14R1.598 CCOC(=O)COC1=C(O)C=CC=C1 HR33225 [0,0,0,0,0,2|0,0,0]=2 792 B14R1.598 CCOC(=O)COC1=NC=CC=C1O HR34083 [0,0,0,0,0,2|1,0,0]=3