0 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [0,0,0,0,0,0|1,0,0]=1 1 B10R2.7 C1=CC2=C(C=C1)CNC2 Z1263820391 [0,0,0,0,0,0|2,0,1]=3 2 B10R2.7 C1=CC2=C(C=C1)COC2 Z839134770 [0,0,0,0,0,0|2,0,1]=3 3 B10R2.7 C1=CC2=C(C=C1)N=[Se]=N2 Z56941035 [0,0,0,0,0,0|3,0,0]=3 4 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [0,0,0,0,0,0|1,0,0]=1 5 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [0,0,0,0,0,0|2,0,0]=2 6 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [0,0,0,0,0,0|1,0,2]=3 7 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [0,0,0,0,0,0|2,0,0]=2 8 B10R2.7 C1=CC2=C(C=C1)NN=N2 Z57127352 [0,0,0,0,0,0|3,0,0]=3 9 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [0,0,0,0,0,0|0,0,0]=0 10 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [0,0,0,0,0,0|0,0,2]=2 11 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [0,0,0,0,0,0|1,0,0]=1 12 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [0,0,0,0,0,0|0,1,0]=1 13 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [0,0,0,0,0,0|1,1,0]=2 14 B10R2.7 C1=CC2=C(C=C1)SN=N2 Z1198148806 [0,0,0,0,0,0|2,1,0]=3 15 B10R2.7 C1=CC2=C(C=CN2)C=N1 Z1079456082 [0,0,0,0,0,0|2,0,0]=2 16 B10R2.7 C1=CC2=C(C=CO2)N=C1 Z2831987589 [0,0,0,0,0,0|1,0,0]=1 17 B10R2.7 C1=CC2=C(C=CS2)C=N1 Z810507710 [0,0,0,0,0,0|1,1,0]=2 18 B10R2.7 C1=CC2=C(C=N1)C=NN2 Z1157651607 [0,0,0,0,0,0|3,0,0]=3 19 B10R2.7 C1=CC2=C(C=N1)CCN2 Z1650168304 [0,0,0,0,0,0|2,0,2]=4 20 B10R2.7 C1=CC2=C(C=N1)CCO2 Z1681336163 [0,0,0,0,0,0|1,0,2]=3 21 B10R2.7 C1=CC2=C(C=N1)NC=C2 Z871773918 [0,0,0,0,0,0|2,0,0]=2 22 B10R2.7 C1=CC2=C(C=N1)NC=N2 Z1117890443 [0,0,0,0,0,0|3,0,0]=3 23 B10R2.7 C1=CC2=C(C=N1)NCC2 Z1603826893 [0,0,0,0,0,0|2,0,2]=4 24 B10R2.7 C1=CC2=C(CCN2)N=C1 Z1203748137 [0,0,0,0,0,0|2,0,2]=4 25 B10R2.7 C1=CC2=C(CNC2)N=C1 Z1741974952 [0,0,0,0,0,0|3,0,1]=4 26 B10R2.7 C1=CC2=C(N1)N=CC=N2 Z1198233190 [0,0,0,0,0,0|3,0,0]=3 27 B10R2.7 C1=CC2=C(N1)N=CN=C2 Z1741974263 [0,0,0,0,0,0|3,0,0]=3 28 B10R2.7 C1=CC2=C(N=C1)NC=C2 Z271099378 [0,0,0,0,0,0|2,0,0]=2 29 B10R2.7 C1=CC2=C(N=C1)NC=N2 Z276130126 [0,0,0,0,0,0|3,0,0]=3 30 B10R2.7 C1=CC2=C(N=C1)NCC2 Z979438826 [0,0,0,0,0,0|2,0,2]=4 31 B10R2.7 C1=CC2=C(N=C1)NN=C2 Z1147474011 [0,0,0,0,0,0|3,0,0]=3 32 B10R2.7 C1=CC2=C(N=C1)NN=N2 Z3235024586 [0,0,0,0,0,0|4,0,0]=4 33 B10R2.7 C1=CC2=C(N=N1)NC=C2 Z1198313815 [0,0,0,0,0,0|3,0,0]=3 34 B10R2.7 C1=CC2=CN=CN2C=C1 Z1124125455 [0,0,0,0,0,0|3,0,0]=3 35 B10R2.7 C1=CC2=CNN=C2C=N1 Z1079443440 [0,0,0,0,0,0|3,0,0]=3 36 B10R2.7 C1=CC2=NC=CN2C=C1 Z838912682 [0,0,0,0,0,0|2,0,0]=2 37 B10R2.7 C1=CC2=NC=CN2C=N1 Z1198268810 [0,0,0,0,0,0|3,0,0]=3 38 B10R2.7 C1=CC2=NC=NN2C=C1 Z1198163032 [0,0,0,0,0,0|3,0,0]=3 39 B10R2.7 C1=CC2=NNC=C2N=C1 Z2236735376 [0,0,0,0,0,0|3,0,0]=3 40 B10R2.7 C1=CC2=NSN=C2C=C1 Z56893124 [0,0,0,0,0,0|3,0,0]=3 41 B10R2.7 C1=CN2C=CN=C2C=N1 Z1154553199 [0,0,0,0,0,0|3,0,0]=3 42 B10R2.7 C1=CN2C=NC=C2C=N1 Z1198219267 [0,0,0,0,0,0|4,0,0]=4 43 B10R2.7 C1=CN2C=NN=C2C=N1 Z1182328459 [0,0,0,0,0,0|4,0,0]=4 44 B10R2.7 C1=CN2N=CC=C2N=C1 Z1198279686 [0,0,0,0,0,0|3,0,0]=3 45 B10R2.7 C1=CN2N=CN=C2C=N1 Z1198233350 [0,0,0,0,0,0|4,0,0]=4 46 B10R2.7 C1=CN2N=CN=C2N=C1 Z2039477480 [0,0,0,0,0,0|4,0,0]=4 47 B10R2.7 C1=CNC2=CC=NC2=C1 Z1925930568 [0,0,0,0,0,0|2,0,0]=2 48 B10R2.7 C1=NC2=C(N=C1)NC=N2 Z1198180623 [0,0,0,0,0,0|4,0,0]=4 49 B10R2.7 C1=NC2=C(N=C1)SC=N2 Z2044801495 [0,0,0,0,0,0|3,1,0]=4 50 B10R2.7 C1=NC=C2N=NNC2=C1 Z56777354 [0,0,0,0,0,0|4,0,0]=4 51 B10R2.7 C1=NC=NC2=C1C=NN2 Z1198168658 [0,0,0,0,0,0|4,0,0]=4 52 B10R2.7 C1=NC=NC2=C1NC=N2 Z1203730725 [0,0,0,0,0,0|4,0,0]=4 53 B11R2.1 BrC1=C2C=CC=CN2C=N1 Z1198169943 [0,1,0,0,0,0|3,0,0]=4 54 B11R2.1 BrC1=C2C=CC=CN2N=C1 Z1198169703 [0,1,0,0,0,0|2,0,0]=3 55 B11R2.1 BrC1=C2C=CC=NN2N=C1 Z1255495342 [0,1,0,0,0,0|3,0,0]=4 56 B11R2.1 BrC1=C2C=NC=CN2N=C1 Z1785656348 [0,1,0,0,0,0|3,0,0]=4 57 B11R2.1 BrC1=CNC2=C1C=CC=N2 Z1665033561 [0,1,0,0,0,0|2,0,0]=3 58 B11R2.1 BrC1=CNC2=C1C=CN=C2 Z3302856393 [0,1,0,0,0,0|2,0,0]=3 59 B11R2.1 BrC1=NNC2=C1C=CC=C2 Z56791616 [0,1,0,0,0,0|2,0,0]=3 60 B11R2.1 CC1=C2C=CC=CC2=NN1 Z1258992514 [0,1,0,0,0,0|2,0,0]=3 61 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [0,1,0,0,0,0|1,0,0]=2 62 B11R2.1 CC1=CNC2=C1N=CC=C2 Z1203733882 [0,1,0,0,0,0|2,0,0]=3 63 B11R2.1 CC1=COC2=C1C=CC=C2 Z1203161674 [0,1,0,0,0,0|0,0,0]=1 64 B11R2.1 CC1=CSC2=C1N=CN=C2 Z1201626971 [0,1,0,0,0,0|2,1,0]=4 65 B11R2.1 CC1=NC=C2N1C=CC=C2 Z57213534 [0,1,0,0,0,0|3,0,0]=4 66 B11R2.1 CC1=NNC2=C1C=CC=N2 Z1198220784 [0,1,0,0,0,0|3,0,0]=4 67 B11R2.1 CC1=NNC2=C1C=NC=C2 Z1198341461 [0,1,0,0,0,0|3,0,0]=4 68 B11R2.1 CC1=NOC2=C1C=CC=C2 Z104341886 [0,1,0,0,0,0|1,0,0]=2 69 B11R2.1 CC1=NOC2=C1C=CN=C2 Z1255459053 [0,1,0,0,0,0|2,0,0]=3 70 B11R2.1 CC1=NSC2=C1C=CC=N2 Z1198182022 [0,1,0,0,0,0|2,1,0]=4 71 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [0,1,0,0,0,0|1,0,2]=4 72 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [0,1,0,0,0,0|2,0,1]=4 73 B11R2.1 CN1C=CC2=C1C=CN=C2 Z1255373921 [0,1,0,0,0,0|2,0,0]=3 74 B11R2.1 CN1C=NC2=C1C=CC=C2 Z53833303 [0,1,0,0,0,0|2,0,0]=3 75 B11R2.1 CN1C=NC2=C1C=CN=C2 Z991187082 [0,1,0,0,0,0|3,0,0]=4 76 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 Z56791134 [0,1,0,0,0,0|1,1,0]=3 77 B11R2.1 ClC1=C2C=CC=CC2=NN1 Z1695729006 [0,1,0,0,0,0|2,0,0]=3 78 B11R2.1 ClC1=C2C=CC=CC2=NS1 Z992921742 [0,1,0,0,0,0|2,0,0]=3 79 B11R2.1 ClC1=CNC2=C1C=CC=C2 Z1020823312 [0,1,0,0,0,0|1,0,0]=2 80 B11R2.1 ClC1=CNC2=C1C=CN=C2 Z1618035710 [0,1,0,0,0,0|2,0,0]=3 81 B11R2.1 ClC1=NSC2=C1C=CC=C2 Z57033963 [0,1,0,0,0,0|1,1,0]=3 82 B11R2.1 IC1=C2C=CC=CN2N=C1 Z1416202327 [0,1,0,0,0,0|2,0,0]=3 83 B11R2.1 IC1=C2N=CC=CN2N=C1 Z1618148549 [0,1,0,0,0,0|3,0,0]=4 84 B11R2.1 IC1=CN=C2N1C=CC=C2 Z1262250911 [0,1,0,0,0,0|2,0,0]=3 85 B11R2.1 IC1=CNC2=C1C=CC=N2 Z1269158296 [0,1,0,0,0,0|2,0,0]=3 86 B11R2.1 IC1=CNC2=C1C=CN=C2 Z1269236830 [0,1,0,0,0,0|2,0,0]=3 87 B11R2.1 IC1=CNC2=C1C=NC=C2 Z1154254658 [0,1,0,0,0,0|2,0,0]=3 88 B11R2.1 IC1=CNC2=C1N=CC=C2 Z1269234225 [0,1,0,0,0,0|2,0,0]=3 89 B11R2.1 N=C1NCC2=C1N=CC=C2 Z4310348945 [0,1,0,0,0,0|3,0,0]=4 90 B11R2.1 NC1=C2C=CC=CC2=NS1 Z1198161072 [0,1,0,0,0,0|2,0,0]=3 91 B11R2.1 NC1=C2C=CC=NC2=NS1 Z1198182071 [0,1,0,0,0,0|3,0,0]=4 92 B11R2.1 NC1=C2N=CC=CN2N=C1 Z3241266259 [0,1,0,0,0,0|3,0,0]=4 93 B11R2.1 NC1=CN=C2N1C=CC=C2 Z1203578955 [0,1,0,0,0,0|2,0,0]=3 94 B11R2.1 NC1=CN=C2N1C=CN=C2 Z1203580780 [0,1,0,0,0,0|3,0,0]=4 95 B11R2.1 NC1=CN=C2N1N=CC=C2 Z3241271378 [0,1,0,0,0,0|3,0,0]=4 96 B11R2.1 NC1=NC=C2N1C=CC=C2 Z1551955789 [0,1,0,0,0,0|3,0,0]=4 97 B11R2.1 NC1=NN=C2N1C=CC=C2 Z362020366 [0,1,0,0,0,0|3,0,0]=4 98 B11R2.1 NC1=NNC2=C1C=CC=C2 Z56820416 [0,1,0,0,0,0|2,0,0]=3 99 B11R2.1 NC1=NNC2=C1C=CN=C2 Z1203582635 [0,1,0,0,0,0|3,0,0]=4 100 B11R2.1 NC1=NNC2=C1N=CC=C2 Z1203639500 [0,1,0,0,0,0|3,0,0]=4 101 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [0,1,0,0,0,0|1,0,0]=2 102 B11R2.1 NC1=NOC2=C1C=CN=C2 Z1203581328 [0,1,0,0,0,0|2,0,0]=3 103 B11R2.1 NC1=NOC2=C1N=CC=C2 Z1203581327 [0,1,0,0,0,0|2,0,0]=3 104 B11R2.1 NC1=NSC2=C1C=CC=C2 Z56774438 [0,1,0,0,0,0|1,1,0]=3 105 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [0,1,0,0,0,0|1,0,2]=4 106 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [0,1,0,0,0,0|0,1,2]=4 107 B11R2.1 NN1C=NC2=C1C=CC=C2 Z99599676 [0,1,0,0,0,0|2,0,0]=3 108 B11R2.1 NN1N=NC2=C1C=CC=C2 Z56788890 [0,1,0,0,0,0|3,0,0]=4 109 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [0,1,0,0,0,0|1,0,2]=4 110 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [0,1,0,0,0,0|1,0,1]=3 111 B11R2.1 O=C1CCC2=C1C=NC=C2 Z1198181243 [0,1,0,0,0,0|2,0,1]=4 112 B11R2.1 O=C1COC2=C1C=CC=C2 Z57101103 [0,1,0,0,0,0|0,0,1]=2 113 B11R2.1 O=C1COC2=C1C=CN=C2 Z1255373514 [0,1,0,0,0,0|1,0,1]=3 114 B11R2.1 O=C1CSC2=C1C=CC=C2 Z1117911699 [0,1,0,0,0,0|0,1,1]=3 115 B11R2.1 O=C1NCC2=C1C=CC=C2 Z362519344 [0,1,0,0,0,0|2,0,0]=3 116 B11R2.1 O=C1NCC2=C1C=CC=N2 Z1203733001 [0,1,0,0,0,0|3,0,0]=4 117 B11R2.1 O=C1NCC2=C1C=CN=C2 Z1255451661 [0,1,0,0,0,0|3,0,0]=4 118 B11R2.1 O=C1NCC2=C1C=NC=C2 Z2758801175 [0,1,0,0,0,0|3,0,0]=4 119 B11R2.1 O=C1NCC2=C1N=CC=C2 Z1255449267 [0,1,0,0,0,0|3,0,0]=4 120 B11R2.1 O=C1NN=C2N1C=CC=C2 Z56987654 [0,1,0,0,0,0|3,0,0]=4 121 B11R2.1 O=C1NNC2=C1C=CC=C2 Z586248764 [0,1,0,0,0,0|2,0,0]=3 122 B11R2.1 O=C1NNC2=C1C=CC=N2 Z381404338 [0,1,0,0,0,0|3,0,0]=4 123 B11R2.1 O=C1NOC2=C1C=CC=C2 Z1592042113 [0,1,0,0,0,0|1,0,0]=2 124 B11R2.1 O=C1NSC2=C1C=CC=C2 Z56983154 [0,1,0,0,0,0|1,1,0]=3 125 B11R2.1 O=C1NSC2=C1C=CC=N2 Z1551930532 [0,1,0,0,0,0|2,1,0]=4 126 B11R2.1 O=C1OCC2=C1C=CC=C2 Z211309000 [0,1,0,0,0,0|2,0,0]=3 127 B11R2.1 O=C1OCC2=C1N=CC=C2 Z1255428832 [0,1,0,0,0,0|3,0,0]=4 128 B11R2.1 O=C1SNC2=C1C=CC=C2 Z992282928 [0,1,0,0,0,0|2,0,0]=3 129 B11R2.1 OB1OCC2=C1C=CC=C2 Z1255356609 [0,1,0,0,0,0|2,0,1]=4 130 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [0,1,0,0,0,0|0,0,2]=3 131 B11R2.1 ON1N=NC2=C1C=CC=C2 Z56900935 [0,1,0,0,0,0|3,0,0]=4 132 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [0,1,0,0,0,0|0,1,2]=4 133 B11R2.1 SC1=NC=C2N1C=CC=C2 Z57041981 [0,1,0,0,0,0|3,0,0]=4 134 B11R2.1 SC1=NN=C2N1C=CC=C2 Z56767793 [0,1,0,0,0,0|3,0,0]=4 135 B11R2.10 BrC1=CC2=C(S1)C=NC=C2 Z1269169662 [0,1,0,0,0,0|1,1,0]=3 136 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [0,1,0,0,0,0|1,0,0]=2 137 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [0,1,0,0,0,0|1,1,0]=3 138 B11R2.10 CC1=CC2=C(N1)C=CC=N2 Z1255424933 [0,1,0,0,0,0|2,0,0]=3 139 B11R2.10 CC1=CC2=C(N1)C=CN=C2 Z1255388194 [0,1,0,0,0,0|2,0,0]=3 140 B11R2.10 CC1=CC2=C(N1)C=NC=C2 Z1198174139 [0,1,0,0,0,0|2,0,0]=3 141 B11R2.10 CC1=CC2=C(N1)C=NC=N2 Z1255417566 [0,1,0,0,0,0|3,0,0]=4 142 B11R2.10 CC1=CC2=C(N1)N=CC=C2 Z1198180660 [0,1,0,0,0,0|2,0,0]=3 143 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [0,1,0,0,0,0|0,0,0]=1 144 B11R2.10 CC1=CN2C=CC=CC2=N1 Z82176792 [0,1,0,0,0,0|2,0,0]=3 145 B11R2.10 CC1=CN2C=CC=NC2=N1 Z666291262 [0,1,0,0,0,0|3,0,0]=4 146 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,1,0,0,0,0|2,0,0]=3 147 B11R2.10 CC1=NC2=C(N1)N=CC=C2 Z857667464 [0,1,0,0,0,0|3,0,0]=4 148 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [0,1,0,0,0,0|1,1,0]=3 149 B11R2.10 CC1=NC2=C(S1)C=CN=C2 Z1255375955 [0,1,0,0,0,0|2,1,0]=4 150 B11R2.10 CC1=NN2C=CC=NC2=C1 Z1198176737 [0,1,0,0,0,0|3,0,0]=4 151 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,1,0,0,0,0|1,0,2]=4 152 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,1,0,0,0,0|0,0,2]=3 153 B11R2.10 ClC1=CN2C=CC=CC2=N1 Z55928902 [0,1,0,0,0,0|2,0,0]=3 154 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [0,1,0,0,0,0|2,0,0]=3 155 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [0,1,0,0,0,0|1,0,0]=2 156 B11R2.10 NC1=CN2C=CN=CC2=N1 Z1263714413 [0,1,0,0,0,0|3,0,0]=4 157 B11R2.10 NC1=CN2N=CC=CC2=N1 Z5183354462 [0,1,0,0,0,0|3,0,0]=4 158 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,1,0,0,0,0|1,0,1]=3 159 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [0,1,0,0,0,0|2,0,0]=3 160 B11R2.10 NC1=NC2=C(N1)C=CC=N2 Z1436185321 [0,1,0,0,0,0|3,0,0]=4 161 B11R2.10 NC1=NC2=C(N1)C=CN=C2 Z1575082215 [0,1,0,0,0,0|3,0,0]=4 162 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [0,1,0,0,0,0|1,0,0]=2 163 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [0,1,0,0,0,0|2,0,0]=3 164 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [0,1,0,0,0,0|2,0,0]=3 165 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [0,1,0,0,0,0|2,0,0]=3 166 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [0,1,0,0,0,0|1,1,0]=3 167 B11R2.10 NC1=NC2=C(S1)C=CC=N2 Z1255491591 [0,1,0,0,0,0|2,1,0]=4 168 B11R2.10 NC1=NC2=C(S1)N=CC=C2 Z1198152308 [0,1,0,0,0,0|2,1,0]=4 169 B11R2.10 NC1=NC2=[N+](S1)C=CC=C2 Z1262632043 [0,1,0,0,0,0|2,1,0]=4 170 B11R2.10 NC1=NN2C=CC=CC2=C1 Z1203587619 [0,1,0,0,0,0|2,0,0]=3 171 B11R2.10 NC1=NN2C=CC=CC2=N1 Z1203578956 [0,1,0,0,0,0|3,0,0]=4 172 B11R2.10 NC1=NN2C=CC=NC2=C1 Z1198317143 [0,1,0,0,0,0|3,0,0]=4 173 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,1,0,0,0,0|1,0,2]=4 174 B11R2.10 O=C1C=C2NCCC=C2O1 Z1203733742 [0,1,0,0,0,0|1,0,2]=4 175 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,1,0,0,0,0|1,0,1]=3 176 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,1,0,0,0,0|1,0,1]=3 177 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [0,1,0,0,0,0|2,0,1]=4 178 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [0,1,0,0,0,0|2,0,0]=3 179 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [0,1,0,0,0,0|1,0,0]=2 180 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [0,1,0,0,0,0|2,0,0]=3 181 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [0,1,0,0,0,0|1,1,0]=3 182 B11R2.10 OC1=CN2C=CC=CC2=N1 Z3305157547 [0,1,0,0,0,0|2,0,0]=3 183 B11R2.10 OC1=NN2C=CC=CC2=C1 Z1198235676 [0,1,0,0,0,0|2,0,0]=3 184 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [0,1,0,0,0,0|1,1,0]=3 185 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [0,1,0,0,0,0|2,0,0]=3 186 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [0,1,0,0,0,0|1,0,0]=2 187 B11R2.10 SC1=NC2=C(O1)C=CC=N2 Z1201620735 [0,1,0,0,0,0|2,0,0]=3 188 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [0,1,0,0,0,0|1,1,0]=3 189 B11R2.10 SC1=NC2=C(S1)C=CC=N2 Z1201619791 [0,1,0,0,0,0|2,1,0]=4 190 B11R2.10 SC1=NC2=C(S1)C=CN=C2 Z1255396445 [0,1,0,0,0,0|2,1,0]=4 191 B11R2.10 SC1=NC2=C(S1)N=CC=C2 Z2587654832 [0,1,0,0,0,0|2,1,0]=4 192 B11R2.36 BrC1=CC2=C(C=C1)C=NS2 Z1269192731 [0,1,0,0,0,0|1,1,0]=3 193 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 Z1255379634 [0,1,0,0,0,0|1,0,0]=2 194 B11R2.36 BrC1=CC2=C(C=C1)CCC2 Z359513410 [0,1,0,0,0,0|1,0,2]=4 195 B11R2.36 BrC1=CC2=C(C=C1)CCN2 Z1267773746 [0,1,0,0,0,0|1,0,2]=4 196 B11R2.36 BrC1=CC2=C(C=C1)CCO2 Z1198181832 [0,1,0,0,0,0|0,0,2]=3 197 B11R2.36 BrC1=CC2=C(C=C1)CNC2 Z1694636353 [0,1,0,0,0,0|2,0,1]=4 198 B11R2.36 BrC1=CC2=C(C=C1)COC2 Z1079162022 [0,1,0,0,0,0|2,0,1]=4 199 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 Z1198161423 [0,1,0,0,0,0|1,0,0]=2 200 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 Z104489174 [0,1,0,0,0,0|1,0,0]=2 201 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 Z382822766 [0,1,0,0,0,0|2,0,0]=3 202 B11R2.36 BrC1=CC2=C(C=C1)NN=C2 Z57192026 [0,1,0,0,0,0|2,0,0]=3 203 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 Z1198153729 [0,1,0,0,0,0|3,0,0]=4 204 B11R2.36 BrC1=CC2=C(C=C1)OCC2 Z299596228 [0,1,0,0,0,0|0,0,2]=3 205 B11R2.36 BrC1=CC2=C(C=C1)OCO2 Z1269199980 [0,1,0,0,0,0|1,0,1]=3 206 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 Z1269222968 [0,1,0,0,0,0|1,1,0]=3 207 B11R2.36 BrC1=CC2=C(C=C1)SN=C2 Z1269153896 [0,1,0,0,0,0|1,1,0]=3 208 B11R2.36 BrC1=CC2=C(C=C1)SN=N2 Z2733024046 [0,1,0,0,0,0|2,1,0]=4 209 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 Z752239748 [0,1,0,0,0,0|1,0,0]=2 210 B11R2.36 BrC1=CC2=C(C=CN2)N=C1 Z1198219527 [0,1,0,0,0,0|2,0,0]=3 211 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 Z1198180633 [0,1,0,0,0,0|0,0,0]=1 212 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 Z1269160602 [0,1,0,0,0,0|0,1,0]=2 213 B11R2.36 BrC1=CC2=C(C=NN2)N=C1 Z1255365976 [0,1,0,0,0,0|3,0,0]=4 214 B11R2.36 BrC1=CC2=C(N=C1)OCC2 Z1269230252 [0,1,0,0,0,0|1,0,2]=4 215 B11R2.36 BrC1=CC2=C(N=C1)SC=C2 Z1269204905 [0,1,0,0,0,0|1,1,0]=3 216 B11R2.36 BrC1=CC2=C(N=C1)SC=N2 Z1269127152 [0,1,0,0,0,0|2,1,0]=4 217 B11R2.36 BrC1=CC2=CN=CN2C=C1 Z1255367773 [0,1,0,0,0,0|3,0,0]=4 218 B11R2.36 BrC1=CC2=CON=C2C=C1 Z1255367395 [0,1,0,0,0,0|2,0,0]=3 219 B11R2.36 BrC1=CC2=NN=CN2C=C1 Z1198268145 [0,1,0,0,0,0|3,0,0]=4 220 B11R2.36 BrC1=CC2=NNC=C2C=C1 Z2255110900 [0,1,0,0,0,0|2,0,0]=3 221 B11R2.36 BrC1=CC2=NOC=C2C=C1 Z1255363120 [0,1,0,0,0,0|2,0,0]=3 222 B11R2.36 BrC1=CC2=NON=C2C=C1 Z1201621839 [0,1,0,0,0,0|3,0,0]=4 223 B11R2.36 BrC1=CC2=NSN=C2C=C1 Z1269146473 [0,1,0,0,0,0|3,0,0]=4 224 B11R2.36 BrC1=CN2C=CN=C2C=C1 Z855892306 [0,1,0,0,0,0|2,0,0]=3 225 B11R2.36 BrC1=CN2C=CN=C2C=N1 Z4603316148 [0,1,0,0,0,0|3,0,0]=4 226 B11R2.36 BrC1=CN2C=CN=C2N=C1 Z1201625038 [0,1,0,0,0,0|3,0,0]=4 227 B11R2.36 BrC1=CN2C=NC=C2C=C1 Z1255503028 [0,1,0,0,0,0|3,0,0]=4 228 B11R2.36 BrC1=CN2C=NN=C2C=C1 Z1201624738 [0,1,0,0,0,0|3,0,0]=4 229 B11R2.36 BrC1=CN2N=CC=C2N=C1 Z489928452 [0,1,0,0,0,0|3,0,0]=4 230 B11R2.36 BrC1=CNC2=NC=CC2=C1 Z1696844476 [0,1,0,0,0,0|2,0,0]=3 231 B11R2.36 BrC1=CNC2=NC=NC2=C1 Z1259341134 [0,1,0,0,0,0|3,0,0]=4 232 B11R2.36 BrC1=NC2=C(N=C1)NC=C2 Z1198233192 [0,1,0,0,0,0|3,0,0]=4 233 B11R2.36 BrC1=NC2=CC=NN2C=C1 Z1198306339 [0,1,0,0,0,0|3,0,0]=4 234 B11R2.36 BrC1=NC2=NC=CN2C=C1 Z1255426128 [0,1,0,0,0,0|3,0,0]=4 235 B11R2.36 BrC1=NN2C=CN=C2C=C1 Z3445096357 [0,1,0,0,0,0|3,0,0]=4 236 B11R2.36 CC1=CC2=C(C=C1)CCN2 Z1269638555 [0,1,0,0,0,0|1,0,2]=4 237 B11R2.36 CC1=CC2=C(C=C1)CNC2 Z2238336530 [0,1,0,0,0,0|2,0,1]=4 238 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [0,1,0,0,0,0|2,0,0]=3 239 B11R2.36 CC1=CC2=C(C=C1)N=CS2 Z1198156828 [0,1,0,0,0,0|1,1,0]=3 240 B11R2.36 CC1=CC2=C(C=C1)NC=C2 Z979311300 [0,1,0,0,0,0|1,0,0]=2 241 B11R2.36 CC1=CC2=C(C=C1)NCC2 Z235539062 [0,1,0,0,0,0|1,0,2]=4 242 B11R2.36 CC1=CC2=C(C=C1)NN=C2 Z276614446 [0,1,0,0,0,0|2,0,0]=3 243 B11R2.36 CC1=CC2=C(C=C1)OC=C2 Z1198151070 [0,1,0,0,0,0|0,0,0]=1 244 B11R2.36 CC1=CC2=C(C=C1)OCO2 Z1255364672 [0,1,0,0,0,0|1,0,1]=3 245 B11R2.36 CC1=CC2=C(C=CN2)C=C1 Z384970524 [0,1,0,0,0,0|1,0,0]=2 246 B11R2.36 CC1=CC2=C(N=C1)NC=C2 Z4875053303 [0,1,0,0,0,0|2,0,0]=3 247 B11R2.36 CC1=CC2=NSN=C2C=C1 Z1201619539 [0,1,0,0,0,0|3,0,0]=4 248 B11R2.36 CC1=NC2=C(C=C1)N=CN2 Z1925930546 [0,1,0,0,0,0|3,0,0]=4 249 B11R2.36 CC1=NC2=C(C=CN2)C=N1 Z1198729301 [0,1,0,0,0,0|3,0,0]=4 250 B11R2.36 CC1=NC=C2C=CNC2=C1 Z1255420119 [0,1,0,0,0,0|2,0,0]=3 251 B11R2.36 ClC1=CC2=C(C=C1)CCC2 Z1198234594 [0,1,0,0,0,0|1,0,2]=4 252 B11R2.36 ClC1=CC2=C(C=C1)CCN2 Z926915320 [0,1,0,0,0,0|1,0,2]=4 253 B11R2.36 ClC1=CC2=C(C=C1)CNC2 Z1198319382 [0,1,0,0,0,0|2,0,1]=4 254 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 Z1095352660 [0,1,0,0,0,0|1,0,0]=2 255 B11R2.36 ClC1=CC2=C(C=C1)NCC2 Z235537274 [0,1,0,0,0,0|1,0,2]=4 256 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [0,1,0,0,0,0|1,0,0]=2 257 B11R2.36 ClC1=CC2=C(N=C1)OC=C2 Z1862012743 [0,1,0,0,0,0|1,0,0]=2 258 B11R2.36 ClC1=CC2=NC=CN2C=C1 Z1198176971 [0,1,0,0,0,0|2,0,0]=3 259 B11R2.36 ClC1=CN2C=CN=C2C=N1 Z1171768617 [0,1,0,0,0,0|3,0,0]=4 260 B11R2.36 ClC1=NC2=C(C=CN2)C=N1 Z1198175094 [0,1,0,0,0,0|3,0,0]=4 261 B11R2.36 ClC1=NC2=C(C=CS2)C=N1 Z1255357890 [0,1,0,0,0,0|2,1,0]=4 262 B11R2.36 ClC1=NC2=C(C=N1)SC=C2 Z1201626541 [0,1,0,0,0,0|2,1,0]=4 263 B11R2.36 ClC1=NC2=CC=NN2C=C1 Z608420946 [0,1,0,0,0,0|3,0,0]=4 264 B11R2.36 ClC1=NC2=NC=CN2C=C1 Z1198278440 [0,1,0,0,0,0|3,0,0]=4 265 B11R2.36 ClC1=NN2C=CN=C2C=C1 Z1201624203 [0,1,0,0,0,0|3,0,0]=4 266 B11R2.36 ClC1=NN=C2C=CNC2=C1 Z1198728930 [0,1,0,0,0,0|3,0,0]=4 267 B11R2.36 FC1=CC2=C(C=C1)CCN2 Z440803576 [0,1,0,0,0,0|1,0,2]=4 268 B11R2.36 FC1=CC2=C(C=C1)CNC2 Z1094758928 [0,1,0,0,0,0|2,0,1]=4 269 B11R2.36 FC1=CC2=C(C=C1)NC=C2 Z1160902020 [0,1,0,0,0,0|1,0,0]=2 270 B11R2.36 FC1=CC2=C(C=C1)NN=N2 Z1198154825 [0,1,0,0,0,0|3,0,0]=4 271 B11R2.36 FC1=CC2=C(C=CN2)C=C1 Z382723676 [0,1,0,0,0,0|1,0,0]=2 272 B11R2.36 FC1=CC2=C(C=CN2)N=C1 Z1255388239 [0,1,0,0,0,0|2,0,0]=3 273 B11R2.36 FC1=CC2=C(N=C1)NC=C2 Z1198169606 [0,1,0,0,0,0|2,0,0]=3 274 B11R2.36 FC1=CC2=C(N=C1)OCC2 Z2732449946 [0,1,0,0,0,0|1,0,2]=4 275 B11R2.36 FC1=CN2N=CC=C2N=C1 Z1486028289 [0,1,0,0,0,0|3,0,0]=4 276 B11R2.36 FC1=NC2=C(C=N1)SC=C2 Z2568988298 [0,1,0,0,0,0|2,1,0]=4 277 B11R2.36 IC1=CC2=C(C=C1)CCC2 Z381540774 [0,1,0,0,0,0|1,0,2]=4 278 B11R2.36 IC1=CC2=C(C=C1)N=CN2 Z2757552913 [0,1,0,0,0,0|2,0,0]=3 279 B11R2.36 IC1=CC2=C(C=C1)OCO2 Z381540748 [0,1,0,0,0,0|1,0,1]=3 280 B11R2.36 IC1=CC2=C(C=C1)SN=C2 Z1766014603 [0,1,0,0,0,0|1,1,0]=3 281 B11R2.36 NC1=CC2=C(C=C1)C=NN2 Z104500558 [0,1,0,0,0,0|2,0,0]=3 282 B11R2.36 NC1=CC2=C(C=C1)CCO2 Z1203579091 [0,1,0,0,0,0|0,0,2]=3 283 B11R2.36 NC1=CC2=C(C=C1)CCS2 Z1198181342 [0,1,0,0,0,0|0,1,2]=4 284 B11R2.36 NC1=CC2=C(C=C1)CNC2 Z1192340875 [0,1,0,0,0,0|2,0,1]=4 285 B11R2.36 NC1=CC2=C(C=C1)COC2 Z995041906 [0,1,0,0,0,0|2,0,1]=4 286 B11R2.36 NC1=CC2=C(C=C1)N=CO2 Z385373514 [0,1,0,0,0,0|1,0,0]=2 287 B11R2.36 NC1=CC2=C(C=C1)NC=C2 Z271138340 [0,1,0,0,0,0|1,0,0]=2 288 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [0,1,0,0,0,0|2,0,0]=3 289 B11R2.36 NC1=CC2=C(C=C1)NN=C2 Z319217146 [0,1,0,0,0,0|2,0,0]=3 290 B11R2.36 NC1=CC2=C(C=C1)SC=C2 Z119989090 [0,1,0,0,0,0|0,1,0]=2 291 B11R2.36 NC1=CC2=C(C=C1)SC=N2 Z425486860 [0,1,0,0,0,0|1,1,0]=3 292 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Z752239752 [0,1,0,0,0,0|1,0,0]=2 293 B11R2.36 NC1=CC2=C(C=CN2)N=C1 Z1198234651 [0,1,0,0,0,0|2,0,0]=3 294 B11R2.36 NC1=CC2=C(C=CO2)C=C1 Z1198313503 [0,1,0,0,0,0|0,0,0]=1 295 B11R2.36 NC1=CC2=C(C=CS2)C=C1 Z2651578500 [0,1,0,0,0,0|0,1,0]=2 296 B11R2.36 NC1=CC2=C(C=CS2)N=C1 Z3068510136 [0,1,0,0,0,0|1,1,0]=3 297 B11R2.36 NC1=CC2=C(N=C1)NC=C2 Z1198169609 [0,1,0,0,0,0|2,0,0]=3 298 B11R2.36 NC1=CC2=C(N=C1)NC=N2 Z1198182829 [0,1,0,0,0,0|3,0,0]=4 299 B11R2.36 NC1=CC2=NC=CN2C=C1 Z1946684529 [0,1,0,0,0,0|2,0,0]=3 300 B11R2.36 NC1=CC2=NC=NN2C=C1 Z3637084929 [0,1,0,0,0,0|3,0,0]=4 301 B11R2.36 NC1=CC2=NN=CN2C=C1 Z3241275732 [0,1,0,0,0,0|3,0,0]=4 302 B11R2.36 NC1=CC2=NON=C2C=C1 Z3606329476 [0,1,0,0,0,0|3,0,0]=4 303 B11R2.36 NC1=CC2=NSN=C2C=C1 Z1201619601 [0,1,0,0,0,0|3,0,0]=4 304 B11R2.36 NC1=CN2C=CN=C2C=C1 Z1235951207 [0,1,0,0,0,0|2,0,0]=3 305 B11R2.36 NC1=CN2C=CN=C2N=C1 Z2681277208 [0,1,0,0,0,0|3,0,0]=4 306 B11R2.36 NC1=CN2C=NC=C2C=C1 Z2940302030 [0,1,0,0,0,0|3,0,0]=4 307 B11R2.36 NC1=CN2C=NN=C2C=C1 Z992419190 [0,1,0,0,0,0|3,0,0]=4 308 B11R2.36 NC1=CN2N=CC=C2C=C1 Z4762145525 [0,1,0,0,0,0|2,0,0]=3 309 B11R2.36 NC1=CN2N=CC=C2N=C1 Z1198221258 [0,1,0,0,0,0|3,0,0]=4 310 B11R2.36 NC1=NC2=C(C=C1)NC=C2 Z1198224605 [0,1,0,0,0,0|2,0,0]=3 311 B11R2.36 NC1=NC2=C(C=C1)OCC2 Z1203582734 [0,1,0,0,0,0|1,0,2]=4 312 B11R2.36 NC1=NC2=C(C=CN2)C=C1 Z1198176781 [0,1,0,0,0,0|2,0,0]=3 313 B11R2.36 NC1=NC2=CC=NN2C=C1 Z1203653834 [0,1,0,0,0,0|3,0,0]=4 314 B11R2.36 NC1=NC=C2C=NNC2=C1 Z1255467862 [0,1,0,0,0,0|3,0,0]=4 315 B11R2.36 NC1=NC=C2NC=CC2=C1 Z1198155237 [0,1,0,0,0,0|2,0,0]=3 316 B11R2.36 NC1=NC=C2NN=CC2=C1 Z1203652936 [0,1,0,0,0,0|3,0,0]=4 317 B11R2.36 NC1=NN2C=CN=C2C=C1 Z1198278272 [0,1,0,0,0,0|3,0,0]=4 318 B11R2.36 O=C1C=CN2N=CC=C2N1 Z1966571755 [0,1,0,0,0,0|3,0,0]=4 319 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [0,1,0,0,0,0|2,0,0]=3 320 B11R2.36 OC1=CC2=C(C=C1)C=NS2 Z1513829991 [0,1,0,0,0,0|1,1,0]=3 321 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [0,1,0,0,0,0|1,0,2]=4 322 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [0,1,0,0,0,0|2,0,1]=4 323 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [0,1,0,0,0,0|1,0,0]=2 324 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [0,1,0,0,0,0|2,0,0]=3 325 B11R2.36 OC1=CC2=C(C=C1)NN=C2 Z1209763128 [0,1,0,0,0,0|2,0,0]=3 326 B11R2.36 OC1=CC2=C(C=C1)OC=N2 Z1198313500 [0,1,0,0,0,0|1,0,0]=2 327 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [0,1,0,0,0,0|0,0,2]=3 328 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [0,1,0,0,0,0|1,0,1]=3 329 B11R2.36 OC1=CC2=C(C=C1)SC=C2 Z1255397714 [0,1,0,0,0,0|0,1,0]=2 330 B11R2.36 OC1=CC2=C(C=C1)SN=C2 Z1513812276 [0,1,0,0,0,0|1,1,0]=3 331 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [0,1,0,0,0,0|1,0,0]=2 332 B11R2.36 OC1=CC2=C(N=C1)NC=C2 Z3215302164 [0,1,0,0,0,0|2,0,0]=3 333 B11R2.36 OC1=CC2=C(N=C1)NN=C2 Z5930869226 [0,1,0,0,0,0|3,0,0]=4 334 B11R2.36 OC1=CC2=CC=NN2C=C1 Z1198176729 [0,1,0,0,0,0|2,0,0]=3 335 B11R2.36 OC1=CC2=NC=CN2C=C1 Z3270903809 [0,1,0,0,0,0|2,0,0]=3 336 B11R2.36 OC1=CN2C=NN=C2C=C1 Z1813109429 [0,1,0,0,0,0|3,0,0]=4 337 B11R2.36 OC1=NC2=C(C=C1)NC=C2 Z1198317461 [0,1,0,0,0,0|2,0,0]=3 338 B11R2.36 SC1=CC2=C(C=C1)OCC2 Z361891428 [0,1,0,0,0,0|0,0,2]=3 339 B11R2.106 BrC1=C2C=CNC2=CC=C1 Z1255488032 [0,1,0,0,0,0|1,0,0]=2 340 B11R2.106 BrC1=C2C=CNC2=CN=C1 Z1255357182 [0,1,0,0,0,0|2,0,0]=3 341 B11R2.106 BrC1=C2C=CNC2=NC=N1 Z1198178310 [0,1,0,0,0,0|3,0,0]=4 342 B11R2.106 BrC1=C2C=COC2=CC=C1 Z1198184786 [0,1,0,0,0,0|0,0,0]=1 343 B11R2.106 BrC1=C2C=NNC2=CC=C1 Z952016260 [0,1,0,0,0,0|2,0,0]=3 344 B11R2.106 BrC1=C2C=NSC2=CC=C1 Z1269142041 [0,1,0,0,0,0|1,1,0]=3 345 B11R2.106 BrC1=C2CCNC2=CC=C1 Z1198172382 [0,1,0,0,0,0|1,0,2]=4 346 B11R2.106 BrC1=C2CNCC2=CC=C1 Z1715153806 [0,1,0,0,0,0|2,0,1]=4 347 B11R2.106 BrC1=C2COCC2=CC=C1 Z1504682798 [0,1,0,0,0,0|2,0,1]=4 348 B11R2.106 BrC1=C2N=CNC2=CC=C1 Z1198223652 [0,1,0,0,0,0|2,0,0]=3 349 B11R2.106 BrC1=C2N=CNC2=NC=C1 Z1201625914 [0,1,0,0,0,0|3,0,0]=4 350 B11R2.106 BrC1=C2N=CSC2=CC=C1 Z1269177018 [0,1,0,0,0,0|1,1,0]=3 351 B11R2.106 BrC1=C2NC=NC2=CN=C1 Z1198233084 [0,1,0,0,0,0|3,0,0]=4 352 B11R2.106 BrC1=C2NCCC2=CC=C1 Z2739025449 [0,1,0,0,0,0|1,0,2]=4 353 B11R2.106 BrC1=C2NN=NC2=CC=C1 Z1198320503 [0,1,0,0,0,0|3,0,0]=4 354 B11R2.106 BrC1=C2OC=CC2=CC=C1 Z1201624951 [0,1,0,0,0,0|0,0,0]=1 355 B11R2.106 BrC1=C2OC=NC2=CC=C1 Z1198176459 [0,1,0,0,0,0|1,0,0]=2 356 B11R2.106 BrC1=C2OCCC2=CC=C1 Z1198219525 [0,1,0,0,0,0|0,0,2]=3 357 B11R2.106 BrC1=C2OCOC2=CC=C1 Z1269207841 [0,1,0,0,0,0|1,0,1]=3 358 B11R2.106 BrC1=C2SC=CC2=CC=C1 Z1269180460 [0,1,0,0,0,0|0,1,0]=2 359 B11R2.106 BrC1=C2SC=CC2=NC=N1 Z415645034 [0,1,0,0,0,0|2,1,0]=4 360 B11R2.106 BrC1=C2SC=NC2=CC=C1 Z1269130621 [0,1,0,0,0,0|1,1,0]=3 361 B11R2.106 BrC1=C2SN=NC2=CC=C1 Z1416172740 [0,1,0,0,0,0|2,1,0]=4 362 B11R2.106 BrC1=CC=CC2=CNN=C12 Z1116381744 [0,1,0,0,0,0|2,0,0]=3 363 B11R2.106 BrC1=CC=CC2=NON=C12 Z1198638843 [0,1,0,0,0,0|3,0,0]=4 364 B11R2.106 BrC1=CC=CC2=NSN=C12 Z367452128 [0,1,0,0,0,0|3,0,0]=4 365 B11R2.106 BrC1=CC=CN2C1=CN=C2 Z1255402010 [0,1,0,0,0,0|3,0,0]=4 366 B11R2.106 BrC1=CC=CN2C1=NN=C2 Z1255395495 [0,1,0,0,0,0|3,0,0]=4 367 B11R2.106 BrC1=CC=NC2=CC=NN12 Z1198306340 [0,1,0,0,0,0|3,0,0]=4 368 B11R2.106 BrC1=CC=NC2=NC=CN12 Z3752757775 [0,1,0,0,0,0|3,0,0]=4 369 B11R2.106 BrC1=NC=CN2C1=CC=C2 Z2867491681 [0,1,0,0,0,0|3,0,0]=4 370 B11R2.106 BrC1=NC=CN2C1=CC=N2 Z1198637053 [0,1,0,0,0,0|3,0,0]=4 371 B11R2.106 BrC1=NC=CN2C1=NC=C2 Z1255503206 [0,1,0,0,0,0|3,0,0]=4 372 B11R2.106 CC1=C2C=CNC2=CC=C1 Z384970526 [0,1,0,0,0,0|1,0,0]=2 373 B11R2.106 CC1=C2C=CNC2=NC=C1 Z1198155764 [0,1,0,0,0,0|2,0,0]=3 374 B11R2.106 CC1=C2C=NNC2=CC=C1 Z1198166368 [0,1,0,0,0,0|2,0,0]=3 375 B11R2.106 CC1=C2CCNC2=CC=C1 Z916962812 [0,1,0,0,0,0|1,0,2]=4 376 B11R2.106 CC1=C2CNCC2=CC=C1 Z3244819771 [0,1,0,0,0,0|2,0,1]=4 377 B11R2.106 CC1=C2N=CNC2=NC=C1 Z1154249055 [0,1,0,0,0,0|3,0,0]=4 378 B11R2.106 CC1=C2N=NNC2=CC=C1 Z1198147968 [0,1,0,0,0,0|3,0,0]=4 379 B11R2.106 CC1=C2NC=CC2=CC=C1 Z1171217428 [0,1,0,0,0,0|1,0,0]=2 380 B11R2.106 CC1=C2NCCC2=CC=C1 Z1331055683 [0,1,0,0,0,0|1,0,2]=4 381 B11R2.106 CC1=C2SC=CC2=CC=C1 Z1171716174 [0,1,0,0,0,0|0,1,0]=2 382 B11R2.106 CC1=CC=CC2=NC=CN12 Z1201623273 [0,1,0,0,0,0|2,0,0]=3 383 B11R2.106 ClC1=C2C=CNC2=CC=C1 Z1203162552 [0,1,0,0,0,0|1,0,0]=2 384 B11R2.106 ClC1=C2C=CNC2=NC=N1 Z857668178 [0,1,0,0,0,0|3,0,0]=4 385 B11R2.106 ClC1=C2C=COC2=CC=N1 Z234894281 [0,1,0,0,0,0|1,0,0]=2 386 B11R2.106 ClC1=C2C=CSC2=CC=N1 Z425813692 [0,1,0,0,0,0|1,1,0]=3 387 B11R2.106 ClC1=C2C=CSC2=NC=N1 Z56899146 [0,1,0,0,0,0|2,1,0]=4 388 B11R2.106 ClC1=C2C=NNC2=CC=C1 Z1116312852 [0,1,0,0,0,0|2,0,0]=3 389 B11R2.106 ClC1=C2CCNC2=CC=C1 Z1407007539 [0,1,0,0,0,0|1,0,2]=4 390 B11R2.106 ClC1=C2CNCC2=CC=C1 Z1198176551 [0,1,0,0,0,0|2,0,1]=4 391 B11R2.106 ClC1=C2N=CNC2=CC=C1 Z2787257831 [0,1,0,0,0,0|2,0,0]=3 392 B11R2.106 ClC1=C2N=CSC2=CC=C1 Z1198305220 [0,1,0,0,0,0|1,1,0]=3 393 B11R2.106 ClC1=C2N=NNC2=CC=C1 Z3227153221 [0,1,0,0,0,0|3,0,0]=4 394 B11R2.106 ClC1=C2NC=CC2=NC=N1 Z1198169463 [0,1,0,0,0,0|3,0,0]=4 395 B11R2.106 ClC1=C2NCCC2=CC=C1 Z235537094 [0,1,0,0,0,0|1,0,2]=4 396 B11R2.106 ClC1=C2OC=CC2=CN=N1 Z1089879742 [0,1,0,0,0,0|2,0,0]=3 397 B11R2.106 ClC1=C2OC=CC2=NC=N1 Z1198233275 [0,1,0,0,0,0|2,0,0]=3 398 B11R2.106 ClC1=C2OC=NC2=NC=N1 Z2732470170 [0,1,0,0,0,0|3,0,0]=4 399 B11R2.106 ClC1=C2SC=CC2=CN=N1 Z2044827036 [0,1,0,0,0,0|2,1,0]=4 400 B11R2.106 ClC1=C2SC=CC2=NC=C1 Z1198178447 [0,1,0,0,0,0|1,1,0]=3 401 B11R2.106 ClC1=C2SC=CC2=NC=N1 Z169853972 [0,1,0,0,0,0|2,1,0]=4 402 B11R2.106 ClC1=CC=CC2=NON=C12 Z1255442611 [0,1,0,0,0,0|3,0,0]=4 403 B11R2.106 ClC1=CC=CC2=NSN=C12 Z1255433948 [0,1,0,0,0,0|3,0,0]=4 404 B11R2.106 ClC1=CC=NC2=CC=NN12 Z1198163753 [0,1,0,0,0,0|3,0,0]=4 405 B11R2.106 ClC1=CC=NC2=NC=CN12 Z3285744091 [0,1,0,0,0,0|3,0,0]=4 406 B11R2.106 ClC1=CN=CC2=NC=CN12 Z2696918767 [0,1,0,0,0,0|3,0,0]=4 407 B11R2.106 ClC1=NC=CC2=NC=CN12 Z1198330353 [0,1,0,0,0,0|3,0,0]=4 408 B11R2.106 ClC1=NC=CN2C1=CC=C2 Z1198234116 [0,1,0,0,0,0|3,0,0]=4 409 B11R2.106 ClC1=NC=CN2C1=CC=N2 Z1255375720 [0,1,0,0,0,0|3,0,0]=4 410 B11R2.106 ClC1=NC=CN2C1=NC=C2 Z4519890287 [0,1,0,0,0,0|3,0,0]=4 411 B11R2.106 FC1=C2C=CNC2=CC=C1 Z1203161966 [0,1,0,0,0,0|1,0,0]=2 412 B11R2.106 FC1=C2C=NNC2=CC=C1 Z1198172357 [0,1,0,0,0,0|2,0,0]=3 413 B11R2.106 FC1=C2CCNC2=CC=C1 Z1688198379 [0,1,0,0,0,0|1,0,2]=4 414 B11R2.106 FC1=C2N=CNC2=CC=C1 Z1203731926 [0,1,0,0,0,0|2,0,0]=3 415 B11R2.106 FC1=C2NCCC2=CC=C1 Z235538802 [0,1,0,0,0,0|1,0,2]=4 416 B11R2.106 FC1=CC=CC2=NON=C12 Z1198162619 [0,1,0,0,0,0|3,0,0]=4 417 B11R2.106 IC1=C2CCOC2=NC=C1 Z3247248061 [0,1,0,0,0,0|1,0,2]=4 418 B11R2.106 IC1=C2N=CNC2=CC=C1 Z4765819468 [0,1,0,0,0,0|2,0,0]=3 419 B11R2.106 IC1=C2OCOC2=CC=C1 Z1269158268 [0,1,0,0,0,0|1,0,1]=3 420 B11R2.106 NC1=C2C=CNC2=CC=C1 Z970344664 [0,1,0,0,0,0|1,0,0]=2 421 B11R2.106 NC1=C2C=CNC2=NC=C1 Z3242404317 [0,1,0,0,0,0|2,0,0]=3 422 B11R2.106 NC1=C2C=COC2=CC=C1 Z3617770745 [0,1,0,0,0,0|0,0,0]=1 423 B11R2.106 NC1=C2C=COC2=CC=N1 Z1198233274 [0,1,0,0,0,0|1,0,0]=2 424 B11R2.106 NC1=C2C=CSC2=CC=C1 Z1198158929 [0,1,0,0,0,0|0,1,0]=2 425 B11R2.106 NC1=C2C=CSC2=NC=N1 Z316122296 [0,1,0,0,0,0|2,1,0]=4 426 B11R2.106 NC1=C2C=NNC2=CC=C1 Z381673574 [0,1,0,0,0,0|2,0,0]=3 427 B11R2.106 NC1=C2CCOC2=CC=C1 Z1198169532 [0,1,0,0,0,0|0,0,2]=3 428 B11R2.106 NC1=C2CCOC2=CC=N1 Z2732447796 [0,1,0,0,0,0|1,0,2]=4 429 B11R2.106 NC1=C2CCOC2=NC=C1 Z1862023680 [0,1,0,0,0,0|1,0,2]=4 430 B11R2.106 NC1=C2CNCC2=CC=C1 Z3234889976 [0,1,0,0,0,0|2,0,1]=4 431 B11R2.106 NC1=C2N=CC=C2NC=N1 Z2312286840 [0,1,0,0,0,0|3,0,0]=4 432 B11R2.106 NC1=C2N=CNC2=CC=C1 Z1259162108 [0,1,0,0,0,0|2,0,0]=3 433 B11R2.106 NC1=C2N=COC2=CC=C1 Z1201620730 [0,1,0,0,0,0|1,0,0]=2 434 B11R2.106 NC1=C2N=NNC2=CC=C1 Z1198155806 [0,1,0,0,0,0|3,0,0]=4 435 B11R2.106 NC1=C2NC=CC2=CC=C1 Z1201621605 [0,1,0,0,0,0|1,0,0]=2 436 B11R2.106 NC1=C2NCCC2=CC=C1 Z1203580163 [0,1,0,0,0,0|1,0,2]=4 437 B11R2.106 NC1=C2NN=CC2=CC=C1 Z235348069 [0,1,0,0,0,0|2,0,0]=3 438 B11R2.106 NC1=C2NN=CC2=NC=C1 Z4367799221 [0,1,0,0,0,0|3,0,0]=4 439 B11R2.106 NC1=C2OC=CC2=CC=C1 Z3244747114 [0,1,0,0,0,0|0,0,0]=1 440 B11R2.106 NC1=C2SC=CC2=CC=C1 Z1511495074 [0,1,0,0,0,0|0,1,0]=2 441 B11R2.106 NC1=C2SC=CC2=NC=N1 Z390143644 [0,1,0,0,0,0|2,1,0]=4 442 B11R2.106 NC1=C2SN=CC2=CC=C1 Z1198157385 [0,1,0,0,0,0|1,1,0]=3 443 B11R2.106 NC1=CC=CC2=NC=CN12 Z1262246090 [0,1,0,0,0,0|2,0,0]=3 444 B11R2.106 NC1=CC=CC2=NON=C12 Z275128438 [0,1,0,0,0,0|3,0,0]=4 445 B11R2.106 NC1=CC=CN2C1=CC=N2 Z1813199786 [0,1,0,0,0,0|2,0,0]=3 446 B11R2.106 NC1=CC=CN2C1=NC=C2 Z3235023303 [0,1,0,0,0,0|2,0,0]=3 447 B11R2.106 NC1=CC=CN2C1=NN=C2 Z4943330910 [0,1,0,0,0,0|3,0,0]=4 448 B11R2.106 NC1=CC=NC2=CC=NN12 Z1065639210 [0,1,0,0,0,0|3,0,0]=4 449 B11R2.106 NC1=NC=CN2C1=CC=C2 Z4750892645 [0,1,0,0,0,0|3,0,0]=4 450 B11R2.106 NC1=NC=CN2C1=NC=C2 Z1147460443 [0,1,0,0,0,0|3,0,0]=4 451 B11R2.106 O=C1C=CNC2=C1SC=C2 Z1948933786 [0,1,0,0,0,0|1,1,0]=3 452 B11R2.106 O=C1C=CNC2=CC=NN12 Z2211231405 [0,1,0,0,0,0|3,0,0]=4 453 B11R2.106 O=C1CCCC2=C1C=CO2 Z763285450 [0,1,0,0,0,0|0,0,3]=4 454 B11R2.106 O=C1N=CNC2=C1NC=C2 Z1198184375 [0,1,0,0,0,0|3,0,0]=4 455 B11R2.106 O=C1NC=CC2=C1NC=C2 Z1065582766 [0,1,0,0,0,0|2,0,0]=3 456 B11R2.106 O=C1NC=CC2=C1NN=C2 Z1203746870 [0,1,0,0,0,0|3,0,0]=4 457 B11R2.106 O=C1NC=CC2=C1SC=C2 Z1216812547 [0,1,0,0,0,0|1,1,0]=3 458 B11R2.106 O=C1NC=CC2=NC=CN12 Z1198149460 [0,1,0,0,0,0|3,0,0]=4 459 B11R2.106 O=C1NC=CN2C1=CC=C2 Z1198233236 [0,1,0,0,0,0|3,0,0]=4 460 B11R2.106 O=C1NC=CN2C1=NC=C2 Z1259155946 [0,1,0,0,0,0|3,0,0]=4 461 B11R2.106 O=C1NC=NC2=C1C=CS2 Z56761824 [0,1,0,0,0,0|2,1,0]=4 462 B11R2.106 O=C1NC=NC2=C1SC=C2 Z166665672 [0,1,0,0,0,0|2,1,0]=4 463 B11R2.106 O=C1NN=CC2=C1C=CS2 Z2718939004 [0,1,0,0,0,0|2,1,0]=4 464 B11R2.106 O=C1NN=CC2=C1NC=C2 Z2732447311 [0,1,0,0,0,0|3,0,0]=4 465 B11R2.106 OC1=C2C=CNC2=CC=C1 Z1203730747 [0,1,0,0,0,0|1,0,0]=2 466 B11R2.106 OC1=C2C=CNC2=NC=C1 Z1198176784 [0,1,0,0,0,0|2,0,0]=3 467 B11R2.106 OC1=C2C=CSC2=CC=C1 Z1198157413 [0,1,0,0,0,0|0,1,0]=2 468 B11R2.106 OC1=C2C=NNC2=CC=C1 Z596251856 [0,1,0,0,0,0|2,0,0]=3 469 B11R2.106 OC1=C2CCCC2=CC=C1 Z1198149277 [0,1,0,0,0,0|1,0,2]=4 470 B11R2.106 OC1=C2CCNC2=CC=C1 Z1715153863 [0,1,0,0,0,0|1,0,2]=4 471 B11R2.106 OC1=C2CCOC2=CC=C1 Z1198181637 [0,1,0,0,0,0|0,0,2]=3 472 B11R2.106 OC1=C2CNCC2=CC=C1 Z1198279842 [0,1,0,0,0,0|2,0,1]=4 473 B11R2.106 OC1=C2N=CNC2=CC=C1 Z1198155823 [0,1,0,0,0,0|2,0,0]=3 474 B11R2.106 OC1=C2N=COC2=CC=C1 Z1198170499 [0,1,0,0,0,0|1,0,0]=2 475 B11R2.106 OC1=C2NC=CC2=NC=C1 Z1255400430 [0,1,0,0,0,0|2,0,0]=3 476 B11R2.106 OC1=C2NC=NC2=CC=N1 Z2692093689 [0,1,0,0,0,0|3,0,0]=4 477 B11R2.106 OC1=C2NN=NC2=CC=C1 Z1198168465 [0,1,0,0,0,0|3,0,0]=4 478 B11R2.106 OC1=C2OC=NC2=CC=C1 Z1255385602 [0,1,0,0,0,0|1,0,0]=2 479 B11R2.106 OC1=C2OCCC2=CC=C1 Z1486027488 [0,1,0,0,0,0|0,0,2]=3 480 B11R2.106 OC1=C2OCOC2=CC=C1 Z409065236 [0,1,0,0,0,0|1,0,1]=3 481 B11R2.106 OC1=C2ON=CC2=CC=C1 Z1198182558 [0,1,0,0,0,0|1,0,0]=2 482 B11R2.106 OC1=C2SC=CC2=CN=N1 Z3039311070 [0,1,0,0,0,0|2,1,0]=4 483 B11R2.106 OC1=CC=CC2=CNN=C12 Z1262398563 [0,1,0,0,0,0|2,0,0]=3 484 B11R2.106 OC1=CC=CC2=NC=NN12 Z1504687202 [0,1,0,0,0,0|3,0,0]=4 485 B11R2.106 OC1=CC=CN2C1=CC=N2 Z1198155673 [0,1,0,0,0,0|2,0,0]=3 486 B11R2.106 OC1=CC=CN2C1=NC=C2 Z1201623531 [0,1,0,0,0,0|2,0,0]=3 487 B11R2.106 OC1=NC=CN2C1=CC=N2 Z1222423678 [0,1,0,0,0,0|3,0,0]=4 488 B11R2.106 SC1=C2C=COC2=CC=N1 Z3401842123 [0,1,0,0,0,0|1,0,0]=2 489 B11R2.106 SC1=C2C=CSC2=NC=N1 Z203045820 [0,1,0,0,0,0|2,1,0]=4 490 B11R2.106 SC1=C2SC=CC2=NC=N1 Z169851152 [0,1,0,0,0,0|2,1,0]=4 491 B11R2.106 SC1=NC=CN2C1=NC=C2 Z1704489544 [0,1,0,0,0,0|3,0,0]=4 492 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [0,0,1,0,0,0|1,0,2]=4 493 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [0,0,1,0,0,0|1,0,2]=4 494 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [0,0,1,0,0,0|1,0,1]=3 495 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [0,0,1,0,0,0|2,0,1]=4 496 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [0,0,1,0,0,0|2,0,1]=4 497 B9R1.8 O/N=C/C1=NN=CC=C1 Z1726150759 [0,0,1,0,0,0|3,0,0]=4 498 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [0,0,1,0,0,0|0,0,2]=3 499 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [0,0,1,0,0,0|0,0,2]=3 500 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [0,0,1,0,0,0|1,0,2]=4 501 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [0,0,1,0,0,0|1,0,2]=4 502 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [0,0,1,0,0,0|1,1,1]=4 503 B9R1.12 O=C/C=C/C1=CC=CO1 Z3219926044 [0,0,1,0,0,0|1,0,0]=2 504 B9R1.14 C=CN1C=CN=C1C=O Z1255489858 [0,0,1,0,0,0|3,0,0]=4 505 B9R1.14 C=CN1N=CC=C1C=O Z3243520084 [0,0,1,0,0,0|3,0,0]=4 506 B9R1.14 CCC1=C(OC=C1)C=O Z1511886468 [0,0,1,0,0,0|1,0,2]=4 507 B9R1.15 BrCC1=C(C=CC=C1)Br Z56969700 [0,0,1,0,0,0|2,0,1]=4 508 B9R1.15 C#CC1=C(C=CC=C1)Cl Z1080385584 [0,0,1,0,0,0|1,0,2]=4 509 B9R1.15 C#CC1=C(C=CC=C1)F Z1080385538 [0,0,1,0,0,0|1,0,2]=4 510 B9R1.15 C=CC1=C(C=CC=C1)Cl Z957339910 [0,0,1,0,0,0|1,0,0]=2 511 B9R1.15 C=CC1=[N+](C=CC=C1)[O-] Z1255451651 [0,0,1,0,0,0|1,0,1]=3 512 B9R1.15 CC1=C(C=CC=C1)C=O Z104478122 [0,0,1,0,0,0|2,0,0]=3 513 B9R1.15 CC1=C(C=CC=C1)CO Z335244790 [0,0,1,0,0,0|2,0,1]=4 514 B9R1.15 CC1=C(C=CC=C1)NN Z56933829 [0,0,1,0,0,0|2,0,1]=4 515 B9R1.15 CC1=C(C=CC=N1)C=O Z1104852897 [0,0,1,0,0,0|3,0,0]=4 516 B9R1.15 CC1=C(C=CN=C1)C=O Z1201621679 [0,0,1,0,0,0|3,0,0]=4 517 B9R1.15 CC1=C(C=NC=C1)C=O Z1198173330 [0,0,1,0,0,0|3,0,0]=4 518 B9R1.15 CC1=C(N=CC=C1)C=O Z1079442732 [0,0,1,0,0,0|3,0,0]=4 519 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [0,0,1,0,0,0|1,0,2]=4 520 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [0,0,1,0,0,0|0,0,2]=3 521 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [0,0,1,0,0,0|1,0,2]=4 522 B9R1.15 CNC1=C(C=CC=C1)Br Z2588063702 [0,0,1,0,0,0|2,0,1]=4 523 B9R1.15 CNC1=C(C=CC=C1)F Z335276746 [0,0,1,0,0,0|2,0,1]=4 524 B9R1.15 CNC1=C(C=CC=C1)N Z57472969 [0,0,1,0,0,0|2,0,1]=4 525 B9R1.15 COC1=C(C=CC=C1)F Z54600290 [0,0,1,0,0,0|1,0,1]=3 526 B9R1.15 COC1=C(C=CC=C1)O Z104474028 [0,0,1,0,0,0|1,0,1]=3 527 B9R1.15 COC1=C(C=CC=N1)N Z240084308 [0,0,1,0,0,0|2,0,1]=4 528 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [0,0,1,0,0,0|2,0,1]=4 529 B9R1.15 COC1=C(C=NC=C1)Br Z1198165840 [0,0,1,0,0,0|2,0,1]=4 530 B9R1.15 COC1=C(C=NC=C1)N Z359373528 [0,0,1,0,0,0|2,0,1]=4 531 B9R1.15 COC1=C(N=CC=C1)C Z1198150814 [0,0,1,0,0,0|1,0,2]=4 532 B9R1.15 COC1=C(N=CC=C1)N Z362783902 [0,0,1,0,0,0|2,0,1]=4 533 B9R1.15 COC1=CC=CNC1=O Z2678251321 [0,0,1,0,0,0|2,0,1]=4 534 B9R1.15 CSC1=C(C=CC=C1)C Z785054008 [0,0,1,0,0,0|0,1,2]=4 535 B9R1.15 CSC1=C(C=CC=C1)N Z104478220 [0,0,1,0,0,0|1,1,1]=4 536 B9R1.15 N#CC1=C(C=CC=C1)Br Z57899728 [0,0,1,0,0,0|2,0,1]=4 537 B9R1.15 N#CC1=C(C=CC=C1)Cl Z57756581 [0,0,1,0,0,0|2,0,1]=4 538 B9R1.15 N#CC1=C(C=CC=C1)I Z57899723 [0,0,1,0,0,0|2,0,1]=4 539 B9R1.15 N#CC1=C(C=CC=C1)N Z104478174 [0,0,1,0,0,0|2,0,1]=4 540 B9R1.15 N#CC1=C(C=CC=C1)O Z104477750 [0,0,1,0,0,0|1,0,1]=3 541 B9R1.15 N#CC1=C(C=NC=C1)O Z1255404294 [0,0,1,0,0,0|2,0,1]=4 542 B9R1.15 NC1=C(C=CC=C1)C=O Z3034936011 [0,0,1,0,0,0|2,0,0]=3 543 B9R1.15 NC1=C(C=CC=C1)CO Z104495736 [0,0,1,0,0,0|2,0,1]=4 544 B9R1.15 NC1=C(C=CC=N1)C=O Z787969952 [0,0,1,0,0,0|3,0,0]=4 545 B9R1.15 NC1=C(C=CN=C1)C=O Z1741972771 [0,0,1,0,0,0|3,0,0]=4 546 B9R1.15 NC1=C(C=NC=C1)C=O Z1157726300 [0,0,1,0,0,0|3,0,0]=4 547 B9R1.15 NCC1=C(C=CC=C1)Cl Z55002587 [0,0,1,0,0,0|2,0,1]=4 548 B9R1.15 NCC1=C(C=CC=C1)I Z2574934431 [0,0,1,0,0,0|2,0,1]=4 549 B9R1.15 NCC1=C(C=CC=C1)O Z993991142 [0,0,1,0,0,0|1,0,1]=3 550 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [0,0,1,0,0,0|2,0,1]=4 551 B9R1.15 NNC1=C(C=CC=C1)Br Z216309278 [0,0,1,0,0,0|3,0,0]=4 552 B9R1.15 NNC1=C(C=CC=C1)Cl Z56928643 [0,0,1,0,0,0|3,0,0]=4 553 B9R1.15 NNC1=C(C=CC=C1)F Z220383458 [0,0,1,0,0,0|3,0,0]=4 554 B9R1.15 O=CC1=C(C=CC=C1)Br Z104478338 [0,0,1,0,0,0|2,0,0]=3 555 B9R1.15 O=CC1=C(C=CC=C1)Cl Z104472866 [0,0,1,0,0,0|2,0,0]=3 556 B9R1.15 O=CC1=C(C=CC=C1)F Z104476570 [0,0,1,0,0,0|2,0,0]=3 557 B9R1.15 O=CC1=C(C=CC=C1)I Z56899024 [0,0,1,0,0,0|2,0,0]=3 558 B9R1.15 O=CC1=C(C=CC=C1)O Z57127523 [0,0,1,0,0,0|1,0,0]=2 559 B9R1.15 O=CC1=C(C=CC=N1)Br Z1201624233 [0,0,1,0,0,0|3,0,0]=4 560 B9R1.15 O=CC1=C(C=CC=N1)Cl Z1198267206 [0,0,1,0,0,0|3,0,0]=4 561 B9R1.15 O=CC1=C(C=CC=N1)F Z1201624236 [0,0,1,0,0,0|3,0,0]=4 562 B9R1.15 O=CC1=C(C=CC=N1)O Z1201623419 [0,0,1,0,0,0|2,0,0]=3 563 B9R1.15 O=CC1=C(C=CN=C1)Br Z1201623579 [0,0,1,0,0,0|3,0,0]=4 564 B9R1.15 O=CC1=C(C=CN=C1)Cl Z1198164100 [0,0,1,0,0,0|3,0,0]=4 565 B9R1.15 O=CC1=C(C=CN=C1)O Z1198277591 [0,0,1,0,0,0|2,0,0]=3 566 B9R1.15 O=CC1=C(C=NC=C1)Br Z1192338771 [0,0,1,0,0,0|3,0,0]=4 567 B9R1.15 O=CC1=C(C=NC=C1)Cl Z1255391336 [0,0,1,0,0,0|3,0,0]=4 568 B9R1.15 O=CC1=C(C=NC=C1)F Z1203162407 [0,0,1,0,0,0|3,0,0]=4 569 B9R1.15 O=CC1=CC=CNC1=O Z1198173495 [0,0,1,0,0,0|2,0,1]=4 570 B9R1.15 OCC1=C(C=CC=C1)Br Z335245004 [0,0,1,0,0,0|2,0,1]=4 571 B9R1.15 OCC1=C(C=CC=C1)Cl Z104476786 [0,0,1,0,0,0|2,0,1]=4 572 B9R1.15 OCC1=C(C=CC=C1)F Z104495204 [0,0,1,0,0,0|2,0,1]=4 573 B9R1.15 OCC1=C(C=CC=C1)I Z57472670 [0,0,1,0,0,0|2,0,1]=4 574 B9R1.15 OCC1=C(C=CC=C1)O Z335244902 [0,0,1,0,0,0|1,0,1]=3 575 B9R1.15 SCC1=C(C=CC=C1)Cl Z55948221 [0,0,1,0,0,0|2,0,1]=4 576 B9R2.3 C1=CC2=C(S1)C=NN2 Z1255441058 [0,0,0,0,1,0|2,1,0]=4 577 B11R2.20 C1=CC2=C(C=C1)C=CC=C2 Z104506008 [0,0,0,0,0,1|1,0,0]=2 578 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 Z104472854 [0,0,0,0,0,1|1,0,0]=2 579 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [0,0,0,0,0,1|1,0,0]=2 580 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,0,0,0,0,1|1,0,2]=4 581 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,0,0,0,0,1|0,0,2]=3 582 B11R2.20 C1=CC2=C(C=C1)CONC2 Z2096086829 [0,0,0,0,0,1|1,0,1]=3 583 B11R2.20 C1=CC2=C(C=C1)N=CC=C2 Z104472852 [0,0,0,0,0,1|1,0,0]=2 584 B11R2.20 C1=CC2=C(C=C1)N=CC=N2 Z104495568 [0,0,0,0,0,1|1,0,0]=2 585 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,0,0,0,0,1|0,0,2]=3 586 B11R2.20 C1=CC2=C(C=C1)OCCN2 Z228584850 [0,0,0,0,0,1|0,0,2]=3 587 B11R2.20 C1=CC2=C(C=C1)SCCN2 Z56943460 [0,0,0,0,0,1|0,1,2]=4 588 B11R2.20 C1=CC2=C(C=CC=N2)N=C1 Z212045452 [0,0,0,0,0,1|2,0,0]=3 589 B11R2.20 C1=CC2=C(C=CN=C2)N=C1 Z1201618481 [0,0,0,0,0,1|2,0,0]=3 590 B11R2.20 C1=CC2=C(C=N1)COCC2 Z4394915129 [0,0,0,0,0,1|1,0,2]=4 591 B11R2.20 C1=CC2=C(C=N1)NCCO2 Z2217033032 [0,0,0,0,0,1|1,0,2]=4 592 B11R2.20 C1=CC2=C(C=NC=C2)N=C1 Z1198330965 [0,0,0,0,0,1|2,0,0]=3 593 B11R2.20 C1=CC2=C(N=C1)N=CC=C2 Z1201618482 [0,0,0,0,0,1|2,0,0]=3 594 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [0,0,0,0,0,1|1,0,2]=4 595 B11R2.20 C1=CC2=CN=CC=C2C=N1 Z1255356832 [0,0,0,0,0,1|2,0,0]=3 596 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [1,0,1,0,0,0|0,0,0]=2 597 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [1,0,1,0,0,0|1,0,0]=3 598 B8R1.2 CCC1=CC=CC=C1 Z104473632 [1,0,1,0,0,0|0,0,2]=4 599 B8R1.2 CNC1=CC=CC=C1 Z104472478 [1,0,1,0,0,0|1,0,1]=4 600 B8R1.2 COC1=CC=CC=C1 Z53833865 [1,0,1,0,0,0|0,0,1]=3 601 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [1,0,1,0,0,0|1,1,0]=4 602 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [1,0,1,0,0,0|1,0,1]=4 603 B8R1.2 NCC1=CC=CC=C1 Z54748260 [1,0,1,0,0,0|1,0,1]=4 604 B8R1.2 NNC1=CC=CC=C1 Z104472442 [1,0,1,0,0,0|2,0,0]=4 605 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [1,0,1,0,0,0|1,0,1]=4 606 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [1,0,1,0,0,0|1,0,1]=4 607 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [1,0,1,0,0,0|1,0,1]=4 608 B8R1.2 OCC1=CC=CC=C1 Z104476418 [1,0,1,0,0,0|0,0,1]=3 609 B8R1.2 OCC1=CC=NC=C1 Z335244866 [1,0,1,0,0,0|1,0,1]=4 610 B8R1.2 OCC1=CN=CC=C1 Z104495622 [1,0,1,0,0,0|1,0,1]=4 611 B8R1.2 OCC1=NC=CC=C1 Z57921252 [1,0,1,0,0,0|1,0,1]=4 612 B8R1.8 O=CCC1=CC=CO1 Z1179944709 [1,0,1,0,0,0|1,0,1]=4 613 B8R1.11 CC1=C(C=CO1)C=O Z1079442526 [1,0,1,0,0,0|1,0,1]=4 614 B8R1.11 CC1=C(OC=C1)C=O Z1079442566 [1,0,1,0,0,0|1,0,1]=4 615 B8R1.11 O=CC1=C(C=CO1)Br Z1183458973 [1,0,1,0,0,0|2,0,0]=4 616 B8R1.11 O=CC1=C(C=CO1)F Z1416198484 [1,0,1,0,0,0|2,0,0]=4 617 B8R1.11 O=CC1=C(OC=C1)Br Z1255361306 [1,0,1,0,0,0|2,0,0]=4 618 B8R1.5 CC1=C(C=CC=C1)C Z212053190 [1,0,1,0,0,0|0,0,2]=4 619 B8R1.5 CC1=C(C=CC=C1)F Z104474026 [1,0,1,0,0,0|1,0,1]=4 620 B8R1.5 CC1=C(C=CC=C1)N Z57127943 [1,0,1,0,0,0|1,0,1]=4 621 B8R1.5 CC1=C(C=CC=C1)O Z104473822 [1,0,1,0,0,0|0,0,1]=3 622 B8R1.5 ClC1=C(C=CC=C1)Cl Z104473644 [1,0,1,0,0,0|2,0,0]=4 623 B8R1.5 FC1=C(C=CC=C1)Br Z756953644 [1,0,1,0,0,0|2,0,0]=4 624 B8R1.5 FC1=C(C=CC=C1)F Z104473256 [1,0,1,0,0,0|2,0,0]=4 625 B8R1.5 NC1=C(C=CC=C1)Br Z104472512 [1,0,1,0,0,0|2,0,0]=4 626 B8R1.5 NC1=C(C=CC=C1)F Z104474198 [1,0,1,0,0,0|2,0,0]=4 627 B8R1.5 NC1=C(C=CC=C1)I Z104472778 [1,0,1,0,0,0|2,0,0]=4 628 B8R1.5 NC1=C(C=CC=C1)N Z104472742 [1,0,1,0,0,0|2,0,0]=4 629 B8R1.5 NC1=C(C=CC=C1)O Z57127952 [1,0,1,0,0,0|1,0,0]=3 630 B8R1.5 NC1=C(C=CC=N1)O Z104495292 [1,0,1,0,0,0|2,0,0]=4 631 B8R1.5 NC1=C(C=CN=C1)O Z370653926 [1,0,1,0,0,0|2,0,0]=4 632 B8R1.5 NC1=C(C=NC=C1)O Z1664348606 [1,0,1,0,0,0|2,0,0]=4 633 B8R1.5 NC1=C(N=CC=C1)O Z969560564 [1,0,1,0,0,0|2,0,0]=4 634 B8R1.5 O=C1C=CC=CN1O Z1198152560 [1,0,1,0,0,0|2,0,0]=4 635 B8R1.5 O=C1C=COC=C1O Z1198235068 [1,0,1,0,0,0|2,0,0]=4 636 B8R1.5 O=C1NC=CC=C1O Z104495360 [1,0,1,0,0,0|2,0,0]=4 637 B8R1.5 O=C1OC=CC=C1O Z1198156687 [1,0,1,0,0,0|2,0,0]=4 638 B8R1.5 OC1=C(C=CC=C1)Br Z56347198 [1,0,1,0,0,0|1,0,0]=3 639 B8R1.5 OC1=C(C=CC=C1)Cl Z104473270 [1,0,1,0,0,0|1,0,0]=3 640 B8R1.5 OC1=C(C=CC=C1)I Z384970702 [1,0,1,0,0,0|1,0,0]=3 641 B8R1.5 OC1=C(C=CC=C1)O Z104473810 [1,0,1,0,0,0|1,0,0]=3 642 B8R1.5 OC1=C(C=CC=N1)F Z850327726 [1,0,1,0,0,0|2,0,0]=4 643 B8R1.5 OC1=C(N=CC=C1)F Z1198164106 [1,0,1,0,0,0|2,0,0]=4 644 B10R1.1 CC1=CC=C(C=C1)/C=N/O Z49568558 [0,1,1,0,0,0|1,0,0]=3 645 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [0,1,1,0,0,0|0,0,2]=4 646 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [0,1,1,0,0,0|0,0,2]=4 647 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [0,1,1,0,0,0|0,0,2]=4 648 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [0,1,1,0,0,0|0,0,2]=4 649 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [0,1,1,0,0,0|0,0,2]=4 650 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [0,1,1,0,0,0|0,0,2]=4 651 B10R1.1 O/N=C/C1=CC=C(C=C1)Br Z49568330 [0,1,1,0,0,0|1,0,0]=3 652 B10R1.1 O/N=C/C1=CC=C(C=C1)Cl Z49568332 [0,1,1,0,0,0|1,0,0]=3 653 B10R1.1 O/N=C/C1=CC=C(C=C1)F Z49568341 [0,1,1,0,0,0|1,0,0]=3 654 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [0,1,1,0,0,0|1,0,0]=3 655 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [0,1,1,0,0,0|0,0,2]=4 656 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [0,1,1,0,0,0|0,0,2]=4 657 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [0,1,1,0,0,0|0,0,2]=4 658 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [0,1,1,0,0,0|1,0,1]=4 659 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [0,1,1,0,0,0|0,0,2]=4 660 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [0,1,1,0,0,0|0,0,2]=4 661 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [0,1,1,0,0,0|0,0,2]=4 662 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [0,1,1,0,0,0|1,0,0]=3 663 B10R1.4 CC1=C(C=CC=C1)/C=N/O Z49568554 [0,1,1,0,0,0|1,0,0]=3 664 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [0,1,1,0,0,0|0,0,2]=4 665 B10R1.4 CCOC1=C(C=CC=C1)Br Z153728256 [0,1,1,0,0,0|0,0,2]=4 666 B10R1.4 CCOC1=C(C=CC=C1)I Z406416174 [0,1,1,0,0,0|0,0,2]=4 667 B10R1.4 CCOC1=C(C=CC=C1)N Z104478442 [0,1,1,0,0,0|0,0,2]=4 668 B10R1.4 CCOC1=C(C=CC=C1)O Z104480244 [0,1,1,0,0,0|0,0,2]=4 669 B10R1.4 C[N+]1=C(C=CC=C1)/C=N/O Z57931208 [0,1,1,0,0,0|2,0,0]=4 670 B10R1.4 NC1=C(C=CC=C1)CCO Z3417485770 [0,1,1,0,0,0|0,0,2]=4 671 B10R1.4 O/N=C/C1=C(C=CC=C1)Br Z49568618 [0,1,1,0,0,0|1,0,0]=3 672 B10R1.4 O/N=C/C1=C(C=CC=C1)F Z49568531 [0,1,1,0,0,0|1,0,0]=3 673 B10R1.4 O/N=C/C1=C(C=CC=C1)O Z49568319 [0,1,1,0,0,0|1,0,0]=3 674 B10R1.4 O/N=C/C1=C(N=CC=C1)Cl Z89270863 [0,1,1,0,0,0|2,0,0]=4 675 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [0,1,1,0,0,0|0,0,2]=4 676 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [0,1,1,0,0,0|0,0,2]=4 677 B10R1.4 OCCC1=C(C=CC=C1)Br Z1183459188 [0,1,1,0,0,0|0,0,2]=4 678 B10R1.4 OCCC1=C(C=CC=C1)F Z397587382 [0,1,1,0,0,0|0,0,2]=4 679 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [0,1,1,0,0,0|0,0,0]=2 680 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [0,1,1,0,0,0|0,0,2]=4 681 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [0,1,1,0,0,0|0,0,2]=4 682 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [0,1,1,0,0,0|0,0,2]=4 683 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [0,1,1,0,0,0|1,0,1]=4 684 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [0,1,1,0,0,0|0,0,2]=4 685 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [0,1,1,0,0,0|0,0,2]=4 686 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [0,1,1,0,0,0|1,0,1]=4 687 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [0,1,1,0,0,0|0,0,2]=4 688 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [0,1,1,0,0,0|0,0,2]=4 689 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [0,1,1,0,0,0|1,0,1]=4 690 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [0,1,1,0,0,0|1,0,0]=3 691 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [0,1,1,0,0,0|0,0,2]=4 692 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [0,1,1,0,0,0|1,0,1]=4 693 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [0,1,1,0,0,0|2,0,0]=4 694 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [0,1,1,0,0,0|2,0,0]=4 695 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [0,1,1,0,0,0|2,0,0]=4 696 B10R1.15 N/C(=N\O)/C1=CC=CC=C1 Z56827052 [0,1,1,0,0,0|1,0,0]=3 697 B10R1.15 N/C(=N\O)/C1=CC=NC=C1 Z220383526 [0,1,1,0,0,0|2,0,0]=4 698 B10R1.15 N/C(=N\O)/C1=CN=CC=C1 Z221503662 [0,1,1,0,0,0|2,0,0]=4 699 B10R1.15 N/C(=N\O)/C1=NC=CC=C1 Z228474568 [0,1,1,0,0,0|2,0,0]=4 700 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [0,1,1,0,0,0|0,0,2]=4 701 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [0,1,1,0,0,0|1,0,1]=4 702 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [0,1,1,0,0,0|2,0,0]=4 703 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [0,1,1,0,0,0|0,0,2]=4 704 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [0,1,1,0,0,0|0,0,2]=4 705 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [0,1,1,0,0,0|1,0,1]=4 706 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [0,1,1,0,0,0|0,0,1]=3 707 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [0,1,1,0,0,0|1,0,0]=3 708 B10R1.15 O=C(NO)C1=CN=CC=C1 Z59181939 [0,1,1,0,0,0|2,0,0]=4 709 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [0,1,1,0,0,0|0,0,1]=3 710 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,1,1,0,0,0|0,0,2]=4 711 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [0,1,1,0,0,0|0,0,2]=4 712 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [0,1,1,0,0,0|0,0,2]=4 713 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [0,1,1,0,0,0|1,0,0]=3 714 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,1,1,0,0,0|2,0,0]=4 715 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,1,1,0,0,0|0,0,2]=4 716 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [0,1,1,0,0,0|0,0,1]=3 717 B10R1.17 O=C/C=C/C1=CC=NC=C1 Z2417822722 [0,1,1,0,0,0|1,0,1]=4 718 B10R1.17 O=C/C=C/C1=NC=CC=C1 Z1255366309 [0,1,1,0,0,0|1,0,1]=4 719 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [0,1,1,0,0,0|0,0,2]=4 720 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [0,1,1,0,0,0|0,0,2]=4 721 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [0,1,1,0,0,0|0,0,1]=3 722 B10R1.17 O=CCOC1=NC=CC=C1 Z1255434510 [0,1,1,0,0,0|1,0,1]=4 723 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [0,1,1,0,0,0|0,0,2]=4 724 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [0,1,1,0,0,0|1,0,1]=4 725 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [0,1,1,0,0,0|0,0,0]=2 726 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [0,1,1,0,0,0|0,0,2]=4 727 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,1,1,0,0,0|0,0,2]=4 728 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [0,1,1,0,0,0|0,0,2]=4 729 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [0,1,1,0,0,0|1,0,1]=4 730 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,1,1,0,0,0|0,0,2]=4 731 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,1,1,0,0,0|0,0,2]=4 732 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [0,1,1,0,0,0|1,0,1]=4 733 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [0,1,1,0,0,0|0,0,2]=4 734 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [0,1,1,0,0,0|1,0,0]=3 735 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [0,1,1,0,0,0|0,1,1]=4 736 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [0,1,1,0,0,0|1,1,0]=4 737 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [0,1,1,0,0,0|1,0,1]=4 738 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [0,1,1,0,0,0|1,0,1]=4 739 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [0,1,1,0,0,0|1,0,1]=4 740 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [0,1,1,0,0,0|1,0,1]=4 741 B10R1.27 C/C(=C\C1=CC=CO1)/C=O Z3061414163 [0,1,1,0,0,0|1,0,0]=3 742 B10R1.29 CN1C=CC=C1/C=C/C=O Z1255493927 [0,1,1,0,0,0|2,0,0]=4 743 B10R1.66 CC(=O)/C=C/C1=CC=CO1 Z57114540 [0,1,1,0,0,0|0,0,1]=3 744 B10R1.66 O=C(O)/C=C/C1=CC=CN1 Z1198166880 [0,1,1,0,0,0|2,0,0]=4 745 B10R1.66 O=C(O)/C=C/C1=CC=CO1 Z2311574202 [0,1,1,0,0,0|1,0,0]=3 746 B10R1.66 O=C(O)/C=C/C1=CC=CS1 Z56855126 [0,1,1,0,0,0|1,1,0]=4 747 B10R1.66 O=C(O)/C=C/C1=CNC=C1 Z1203733427 [0,1,1,0,0,0|2,0,0]=4 748 B10R1.66 O=C(O)/C=C/C1=COC=N1 Z2633786305 [0,1,1,0,0,0|2,0,0]=4 749 B10R1.66 O=C(O)/C=C/C1=CSC=C1 Z2417572197 [0,1,1,0,0,0|1,1,0]=4 750 B10R1.66 O=C(O)/C=C/C1=NC=CO1 Z2648955764 [0,1,1,0,0,0|2,0,0]=4 751 B10R1.66 O=[N+]([O-])/C=C/C1=CC=CO1 Z199438876 [0,1,1,0,0,0|2,0,0]=4 752 B10R1.5 C=CCC1=C(C=CO1)C=O Z1511896697 [0,1,1,0,0,0|1,0,0]=3 753 B10R1.39 O=CC1=C(C=CO1)C(=O)O Z1205495058 [0,1,1,0,0,0|2,0,0]=4 754 B10R1.39 O=CC1=C(OC=C1)C(=O)O Z2681280636 [0,1,1,0,0,0|2,0,0]=4 755 B10R1.2 CC1=C(C(=CC=C1)C=O)Br Z1255464769 [0,1,1,0,0,0|2,0,0]=4 756 B10R1.2 CC1=C(C(=CC=C1)C=O)C Z147641438 [0,1,1,0,0,0|2,0,0]=4 757 B10R1.2 CC1=C(C(=CC=C1)C=O)F Z1255387503 [0,1,1,0,0,0|2,0,0]=4 758 B10R1.2 CC1=C(C(=CC=C1)C=O)N Z1203582628 [0,1,1,0,0,0|2,0,0]=4 759 B10R1.2 CC1=C(C(=CC=C1)C=O)O Z406682006 [0,1,1,0,0,0|1,0,0]=3 760 B10R1.2 CC1=C(C(=CC=C1)CN)O Z2568737629 [0,1,1,0,0,0|1,0,1]=4 761 B10R1.2 CC1=C(C=CC=C1Br)C=O Z1255373549 [0,1,1,0,0,0|2,0,0]=4 762 B10R1.2 CC1=C(C=CC=C1Cl)C=O Z1198308873 [0,1,1,0,0,0|2,0,0]=4 763 B10R1.2 CC1=C(C=CC=C1F)C=O Z1255402882 [0,1,1,0,0,0|2,0,0]=4 764 B10R1.2 CCC1=C(C(=CC=C1)N)O Z2895200771 [0,1,1,0,0,0|0,0,2]=4 765 B10R1.2 COC1=C(C(=CC=C1)Br)O Z1269110250 [0,1,1,0,0,0|1,0,1]=4 766 B10R1.2 COC1=C(C(=CC=C1)C)N Z421792238 [0,1,1,0,0,0|1,0,1]=4 767 B10R1.2 COC1=C(C(=CC=C1)F)N Z451392160 [0,1,1,0,0,0|1,0,1]=4 768 B10R1.2 COC1=C(C(=CC=C1)F)O Z850124378 [0,1,1,0,0,0|1,0,1]=4 769 B10R1.2 COC1=C(C(=CC=C1)I)C Z1269190043 [0,1,1,0,0,0|0,0,2]=4 770 B10R1.2 COC1=C(C(=CC=C1)I)F Z1269143141 [0,1,1,0,0,0|1,0,1]=4 771 B10R1.2 COC1=C(C(=CC=C1)N)Br Z1269199811 [0,1,1,0,0,0|1,0,1]=4 772 B10R1.2 COC1=C(C(=CC=C1)N)F Z1198306024 [0,1,1,0,0,0|1,0,1]=4 773 B10R1.2 COC1=C(C(=CC=C1)N)N Z1198177096 [0,1,1,0,0,0|1,0,1]=4 774 B10R1.2 COC1=C(C(=CC=C1)N)O Z1623872003 [0,1,1,0,0,0|1,0,1]=4 775 B10R1.2 COC1=C(C(=CC=C1)O)N Z4658970175 [0,1,1,0,0,0|1,0,1]=4 776 B10R1.2 N#CC1=CC=CC(=C1O)N Z1203579159 [0,1,1,0,0,0|1,0,1]=4 777 B10R1.2 NC1=C(C=CC=C1Cl)C=O Z1255404490 [0,1,1,0,0,0|2,0,0]=4 778 B10R1.2 NC1=C(C=CC=C1F)C=O Z1203586128 [0,1,1,0,0,0|2,0,0]=4 779 B10R1.2 NCC1=C(C(=CC=C1)Br)O Z1869802506 [0,1,1,0,0,0|1,0,1]=4 780 B10R1.2 NCC1=C(C(=CC=C1)Cl)O Z2935017011 [0,1,1,0,0,0|1,0,1]=4 781 B10R1.2 NCC1=C(C(=CC=C1)F)O Z2753740771 [0,1,1,0,0,0|1,0,1]=4 782 B10R1.2 NCC1=C(C(=CC=C1)O)O Z2755766575 [0,1,1,0,0,0|1,0,1]=4 783 B10R1.2 O=CC1=C(C(=CC=C1)Br)Cl Z1269190527 [0,1,1,0,0,0|2,0,0]=4 784 B10R1.2 O=CC1=C(C(=CC=C1)Br)F Z1205757906 [0,1,1,0,0,0|2,0,0]=4 785 B10R1.2 O=CC1=C(C(=CC=C1)Br)O Z354084788 [0,1,1,0,0,0|1,0,0]=3 786 B10R1.2 O=CC1=C(C(=CC=C1)Cl)F Z1203161792 [0,1,1,0,0,0|2,0,0]=4 787 B10R1.2 O=CC1=C(C(=CC=C1)Cl)O Z406682010 [0,1,1,0,0,0|1,0,0]=3 788 B10R1.2 O=CC1=C(C(=CC=C1)F)O Z406682008 [0,1,1,0,0,0|1,0,0]=3 789 B10R1.2 O=CC1=CC=CC(=C1Br)Br Z1269211860 [0,1,1,0,0,0|2,0,0]=4 790 B10R1.2 O=CC1=CC=CC(=C1Br)Cl Z1269133465 [0,1,1,0,0,0|2,0,0]=4 791 B10R1.2 O=CC1=CC=CC(=C1Br)F Z1269200334 [0,1,1,0,0,0|2,0,0]=4 792 B10R1.2 O=CC1=CC=CC(=C1Br)O Z1269217079 [0,1,1,0,0,0|2,0,0]=4 793 B10R1.2 O=CC1=CC=CC(=C1Cl)Cl Z104474602 [0,1,1,0,0,0|2,0,0]=4 794 B10R1.2 O=CC1=CC=CC(=C1Cl)F Z1198174775 [0,1,1,0,0,0|2,0,0]=4 795 B10R1.2 O=CC1=CC=CC(=C1Cl)O Z1255489787 [0,1,1,0,0,0|2,0,0]=4 796 B10R1.2 O=CC1=CC=CC(=C1F)F Z1079442742 [0,1,1,0,0,0|2,0,0]=4 797 B10R1.2 O=CC1=CC=CC(=C1F)O Z1198313363 [0,1,1,0,0,0|2,0,0]=4 798 B10R1.2 O=CC1=CC=CC(=C1I)F Z1269167420 [0,1,1,0,0,0|2,0,0]=4 799 B10R1.2 O=CC1=CC=CC(=C1O)O Z56899185 [0,1,1,0,0,0|1,0,0]=3 800 B10R1.20 C#CC1=C(C=CC=C1)C=O Z1255373145 [0,1,1,0,0,0|1,0,1]=4 801 B10R1.20 C=CC1=C(C=CC=N1)C=O Z1198169175 [0,1,1,0,0,0|1,0,1]=4 802 B10R1.20 CCC1=C(C=CC=C1)C=O Z979776466 [0,1,1,0,0,0|1,0,1]=4 803 B10R1.20 CNC1=C(C=CC=C1)C=O Z1203730947 [0,1,1,0,0,0|1,0,1]=4 804 B10R1.20 COC1=C(C=CC=C1)C#N Z51119297 [0,1,1,0,0,0|0,0,2]=4 805 B10R1.20 COC1=C(C=CC=C1)C=O Z53833342 [0,1,1,0,0,0|0,0,1]=3 806 B10R1.20 COC1=C(C=CC=C1)CN Z57102476 [0,1,1,0,0,0|0,0,2]=4 807 B10R1.20 COC1=C(C=CC=C1)CO Z104479146 [0,1,1,0,0,0|0,0,2]=4 808 B10R1.20 COC1=C(C=CC=C1)OC Z53833941 [0,1,1,0,0,0|0,0,2]=4 809 B10R1.20 COC1=C(C=CC=N1)C=O Z1079442776 [0,1,1,0,0,0|1,0,1]=4 810 B10R1.20 COC1=C(N=CC=C1)C=O Z1198165843 [0,1,1,0,0,0|1,0,1]=4 811 B10R1.20 CSC1=C(C=CC=C1)CO Z1157829842 [0,1,1,0,0,0|1,0,1]=4 812 B10R1.20 N#CC1=C(C=CC=C1)C=O Z147641756 [0,1,1,0,0,0|2,0,0]=4 813 B10R1.20 NCC1=C(C=CC=C1)CO Z336080860 [0,1,1,0,0,0|1,0,1]=4 814 B10R1.20 O=CC1=C(C=CC=C1)C=O Z104494958 [0,1,1,0,0,0|1,0,1]=4 815 B10R1.20 O=CC1=C(C=CC=C1)CO Z1216844620 [0,1,1,0,0,0|1,0,0]=3 816 B10R1.25 C=CC1=C(N=C(C=C1)Cl)Cl Z1255390099 [0,1,1,0,0,0|2,0,0]=4 817 B10R1.25 CC1=C(C=CC(=C1)Br)C=O Z1079442722 [0,1,1,0,0,0|2,0,0]=4 818 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O Z1201621733 [0,1,1,0,0,0|2,0,0]=4 819 B10R1.25 CC1=C(C=CC(=C1)F)C=O Z853084730 [0,1,1,0,0,0|2,0,0]=4 820 B10R1.25 CC1=C(C=CC(=C1)O)C=O Z1161074806 [0,1,1,0,0,0|2,0,0]=4 821 B10R1.25 CC1=CC(=C(C=C1)C=O)Br Z1255427913 [0,1,1,0,0,0|2,0,0]=4 822 B10R1.25 CC1=CC(=C(C=C1)C=O)C Z104479608 [0,1,1,0,0,0|2,0,0]=4 823 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl Z1198280103 [0,1,1,0,0,0|2,0,0]=4 824 B10R1.25 CC1=CC(=C(C=C1)C=O)F Z732814038 [0,1,1,0,0,0|2,0,0]=4 825 B10R1.25 CC1=CC(=C(C=C1)C=O)N Z1198276968 [0,1,1,0,0,0|2,0,0]=4 826 B10R1.25 CC1=CC(=C(C=C1)C=O)O Z1203159482 [0,1,1,0,0,0|1,0,0]=3 827 B10R1.25 CC1=CC(=C(C=C1)CN)O Z4525848236 [0,1,1,0,0,0|1,0,1]=4 828 B10R1.25 CCC1=C(C=C(C=C1)C)O Z1198181015 [0,1,1,0,0,0|0,0,2]=4 829 B10R1.25 CCC1=C(C=C(C=C1)O)O Z104499414 [0,1,1,0,0,0|0,0,2]=4 830 B10R1.25 COC1=C(C=C(C=C1)Br)F Z54183592 [0,1,1,0,0,0|1,0,1]=4 831 B10R1.25 COC1=C(C=C(C=C1)Br)N Z330803600 [0,1,1,0,0,0|1,0,1]=4 832 B10R1.25 COC1=C(C=C(C=C1)Br)S Z367661854 [0,1,1,0,0,0|1,0,1]=4 833 B10R1.25 COC1=C(C=C(C=C1)C)N Z104477476 [0,1,1,0,0,0|1,0,1]=4 834 B10R1.25 COC1=C(C=C(C=C1)Cl)I Z1269181635 [0,1,1,0,0,0|1,0,1]=4 835 B10R1.25 COC1=C(C=C(C=C1)Cl)N Z56782009 [0,1,1,0,0,0|1,0,1]=4 836 B10R1.25 COC1=C(C=C(C=C1)F)N Z332375930 [0,1,1,0,0,0|1,0,1]=4 837 B10R1.25 COC1=C(C=C(C=C1)I)Br Z362776936 [0,1,1,0,0,0|1,0,1]=4 838 B10R1.25 COC1=C(C=C(C=C1)I)F Z57073900 [0,1,1,0,0,0|1,0,1]=4 839 B10R1.25 COC1=C(C=C(C=C1)N)Br Z57450975 [0,1,1,0,0,0|1,0,1]=4 840 B10R1.25 COC1=C(C=C(C=C1)N)C Z385462626 [0,1,1,0,0,0|0,0,2]=4 841 B10R1.25 COC1=C(C=C(C=C1)N)F Z362635046 [0,1,1,0,0,0|1,0,1]=4 842 B10R1.25 COC1=C(C=C(C=C1)N)O Z104494830 [0,1,1,0,0,0|1,0,1]=4 843 B10R1.25 COC1=C(C=C(C=C1)O)F Z415739536 [0,1,1,0,0,0|1,0,1]=4 844 B10R1.25 COC1=C(C=C(C=C1)O)I Z1269222013 [0,1,1,0,0,0|1,0,1]=4 845 B10R1.25 N#CC1=C(C=C(C=C1)Cl)O Z1082858088 [0,1,1,0,0,0|1,0,1]=4 846 B10R1.25 N#CC1=C(C=C(C=C1)O)O Z1255361029 [0,1,1,0,0,0|1,0,1]=4 847 B10R1.25 NC1=CC(=C(C=C1)C=O)Cl Z1206884716 [0,1,1,0,0,0|2,0,0]=4 848 B10R1.25 NCC1=C(C=C(C=C1)Br)O Z1269160590 [0,1,1,0,0,0|1,0,1]=4 849 B10R1.25 NCC1=C(C=C(C=C1)N)O Z3034846582 [0,1,1,0,0,0|1,0,1]=4 850 B10R1.25 NCC1=C(C=C(C=C1)O)O Z2350903951 [0,1,1,0,0,0|1,0,1]=4 851 B10R1.25 O=CC1=C(C=C(C=C1)Br)Br Z1269133882 [0,1,1,0,0,0|2,0,0]=4 852 B10R1.25 O=CC1=C(C=C(C=C1)Br)Cl Z1079442724 [0,1,1,0,0,0|2,0,0]=4 853 B10R1.25 O=CC1=C(C=C(C=C1)Br)F Z104486154 [0,1,1,0,0,0|2,0,0]=4 854 B10R1.25 O=CC1=C(C=C(C=C1)Br)I Z1269178376 [0,1,1,0,0,0|2,0,0]=4 855 B10R1.25 O=CC1=C(C=C(C=C1)Br)O Z405051414 [0,1,1,0,0,0|1,0,0]=3 856 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Br Z1269165294 [0,1,1,0,0,0|2,0,0]=4 857 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Cl Z57127525 [0,1,1,0,0,0|2,0,0]=4 858 B10R1.25 O=CC1=C(C=C(C=C1)Cl)F Z1079442614 [0,1,1,0,0,0|2,0,0]=4 859 B10R1.25 O=CC1=C(C=C(C=C1)Cl)O Z1201623478 [0,1,1,0,0,0|1,0,0]=3 860 B10R1.25 O=CC1=C(C=C(C=C1)F)Br Z1079442442 [0,1,1,0,0,0|2,0,0]=4 861 B10R1.25 O=CC1=C(C=C(C=C1)F)Cl Z1079442562 [0,1,1,0,0,0|2,0,0]=4 862 B10R1.25 O=CC1=C(C=C(C=C1)F)F Z104495222 [0,1,1,0,0,0|2,0,0]=4 863 B10R1.25 O=CC1=C(C=C(C=C1)F)I Z1269211883 [0,1,1,0,0,0|2,0,0]=4 864 B10R1.25 O=CC1=C(C=C(C=C1)F)O Z1201622454 [0,1,1,0,0,0|1,0,0]=3 865 B10R1.25 O=CC1=C(C=C(C=C1)I)Cl Z1269135461 [0,1,1,0,0,0|2,0,0]=4 866 B10R1.25 O=CC1=C(C=C(C=C1)O)Br Z622749802 [0,1,1,0,0,0|2,0,0]=4 867 B10R1.25 O=CC1=C(C=C(C=C1)O)Cl Z1255419357 [0,1,1,0,0,0|2,0,0]=4 868 B10R1.25 O=CC1=C(C=C(C=C1)O)F Z1201623850 [0,1,1,0,0,0|2,0,0]=4 869 B10R1.25 O=CC1=C(C=C(C=C1)O)O Z104497974 [0,1,1,0,0,0|1,0,0]=3 870 B10R1.25 O=CC1=C(C=C(C=N1)Br)O Z1269226619 [0,1,1,0,0,0|2,0,0]=4 871 B10R1.30 C=CC1=C(N=CC(=C1)Cl)F Z1618169063 [0,1,1,0,0,0|2,0,0]=4 872 B10R1.30 CC1=C(C=C(C=C1)Br)C=O Z871801782 [0,1,1,0,0,0|2,0,0]=4 873 B10R1.30 CC1=C(C=C(C=C1)Cl)C=O Z871801780 [0,1,1,0,0,0|2,0,0]=4 874 B10R1.30 CC1=C(C=C(C=C1)F)C=O Z1080470282 [0,1,1,0,0,0|2,0,0]=4 875 B10R1.30 CC1=CC(=C(C=C1)Br)C=O Z871833034 [0,1,1,0,0,0|2,0,0]=4 876 B10R1.30 CC1=CC(=C(C=C1)C)C=O Z104479610 [0,1,1,0,0,0|2,0,0]=4 877 B10R1.30 CC1=CC(=C(C=C1)Cl)C=O Z871801784 [0,1,1,0,0,0|2,0,0]=4 878 B10R1.30 CC1=CC(=C(C=C1)F)C=O Z732814056 [0,1,1,0,0,0|2,0,0]=4 879 B10R1.30 CC1=CC(=C(C=C1)O)C=O Z274774390 [0,1,1,0,0,0|1,0,0]=3 880 B10R1.30 CC1=NC(=C(C=C1)O)C=O Z1104852896 [0,1,1,0,0,0|2,0,0]=4 881 B10R1.30 CCC1=C(C=CC(=C1)Br)O Z1269214466 [0,1,1,0,0,0|0,0,2]=4 882 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [0,1,1,0,0,0|0,0,2]=4 883 B10R1.30 COC1=C(C=CC(=C1)C)N Z607822396 [0,1,1,0,0,0|1,0,1]=4 884 B10R1.30 COC1=C(C=CC(=C1)Cl)N Z851801172 [0,1,1,0,0,0|1,0,1]=4 885 B10R1.30 COC1=C(C=CC(=C1)F)N Z240869728 [0,1,1,0,0,0|1,0,1]=4 886 B10R1.30 COC1=C(C=CC(=C1)I)Br Z1269142199 [0,1,1,0,0,0|1,0,1]=4 887 B10R1.30 COC1=C(C=CC(=C1)I)N Z2230911387 [0,1,1,0,0,0|1,0,1]=4 888 B10R1.30 COC1=C(C=CC(=C1)N)Br Z1269152504 [0,1,1,0,0,0|1,0,1]=4 889 B10R1.30 COC1=C(C=CC(=C1)N)Cl Z586249876 [0,1,1,0,0,0|1,0,1]=4 890 B10R1.30 COC1=C(C=CC(=C1)N)N Z1147221600 [0,1,1,0,0,0|1,0,1]=4 891 B10R1.30 COC1=C(C=CC(=C1)N)O Z3244869289 [0,1,1,0,0,0|1,0,1]=4 892 B10R1.30 COC1=C(C=CC(=C1)O)Br Z1258567775 [0,1,1,0,0,0|1,0,1]=4 893 B10R1.30 COC1=C(C=CC(=C1)O)N Z2574932955 [0,1,1,0,0,0|1,0,1]=4 894 B10R1.30 N#CC1=C(C=CC(=C1)Br)O Z1203161758 [0,1,1,0,0,0|1,0,1]=4 895 B10R1.30 NC1=C(C=C(C=C1)Br)C=O Z1269131915 [0,1,1,0,0,0|2,0,0]=4 896 B10R1.30 NCC1=C(C=CC(=C1)Br)O Z57102487 [0,1,1,0,0,0|1,0,1]=4 897 B10R1.30 NCC1=C(C=CC(=C1)Cl)O Z594413668 [0,1,1,0,0,0|1,0,1]=4 898 B10R1.30 NCC1=C(C=CC(=C1)N)O Z2786366737 [0,1,1,0,0,0|1,0,1]=4 899 B10R1.30 NCC1=C(C=CC(=C1)O)O Z2757657768 [0,1,1,0,0,0|1,0,1]=4 900 B10R1.30 O=CC1=C(C=CC(=C1)Br)Br Z385370000 [0,1,1,0,0,0|2,0,0]=4 901 B10R1.30 O=CC1=C(C=CC(=C1)Br)Cl Z871801788 [0,1,1,0,0,0|2,0,0]=4 902 B10R1.30 O=CC1=C(C=CC(=C1)Br)F Z104482596 [0,1,1,0,0,0|2,0,0]=4 903 B10R1.30 O=CC1=C(C=CC(=C1)Br)I Z1269213434 [0,1,1,0,0,0|2,0,0]=4 904 B10R1.30 O=CC1=C(C=CC(=C1)Br)O Z57313901 [0,1,1,0,0,0|1,0,0]=3 905 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Br Z871833038 [0,1,1,0,0,0|2,0,0]=4 906 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Cl Z871801786 [0,1,1,0,0,0|2,0,0]=4 907 B10R1.30 O=CC1=C(C=CC(=C1)Cl)F Z819785594 [0,1,1,0,0,0|2,0,0]=4 908 B10R1.30 O=CC1=C(C=CC(=C1)Cl)I Z1269163931 [0,1,1,0,0,0|2,0,0]=4 909 B10R1.30 O=CC1=C(C=CC(=C1)Cl)O Z57772439 [0,1,1,0,0,0|1,0,0]=3 910 B10R1.30 O=CC1=C(C=CC(=C1)F)Br Z1079442476 [0,1,1,0,0,0|2,0,0]=4 911 B10R1.30 O=CC1=C(C=CC(=C1)F)Cl Z1201622451 [0,1,1,0,0,0|2,0,0]=4 912 B10R1.30 O=CC1=C(C=CC(=C1)F)F Z385369882 [0,1,1,0,0,0|2,0,0]=4 913 B10R1.30 O=CC1=C(C=CC(=C1)F)O Z415638796 [0,1,1,0,0,0|1,0,0]=3 914 B10R1.30 O=CC1=C(C=CC(=C1)I)Br Z1269223795 [0,1,1,0,0,0|2,0,0]=4 915 B10R1.30 O=CC1=C(C=CC(=C1)I)Cl Z1269146293 [0,1,1,0,0,0|2,0,0]=4 916 B10R1.30 O=CC1=C(C=CC(=C1)O)Br Z1269171271 [0,1,1,0,0,0|2,0,0]=4 917 B10R1.30 O=CC1=C(C=CC(=C1)O)Cl Z1198174868 [0,1,1,0,0,0|2,0,0]=4 918 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [0,1,1,0,0,0|1,0,0]=3 919 B10R1.30 O=CC1=C(C=NC(=C1)Cl)O Z1255357850 [0,1,1,0,0,0|2,0,0]=4 920 B10R1.30 O=CC1=C(N=CC(=C1)Br)O Z1269150338 [0,1,1,0,0,0|2,0,0]=4 921 B10R1.30 OCC1=C(C=CC(=C1)Br)O Z56969308 [0,1,1,0,0,0|1,0,1]=4 922 B10R1.61 C=C(C)C1=C(C=CC=C1)Br Z1238836250 [0,1,1,0,0,0|1,0,0]=3 923 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [0,1,1,0,0,0|1,0,1]=4 924 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [0,1,1,0,0,0|1,0,1]=4 925 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [0,1,1,0,0,0|1,0,1]=4 926 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [0,1,1,0,0,0|1,0,1]=4 927 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [0,1,1,0,0,0|0,0,1]=3 928 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [0,1,1,0,0,0|1,0,1]=4 929 B10R1.61 CC(=O)C1=C(C=NC=C1)O Z1255445560 [0,1,1,0,0,0|1,0,1]=4 930 B10R1.61 CC(C)C1=C(C=CC=C1)O Z104485440 [0,1,1,0,0,0|0,0,2]=4 931 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [0,1,1,0,0,0|0,0,2]=4 932 B10R1.61 CC1=C(C=CC=C1)C(=N)N Z1483957011 [0,1,1,0,0,0|2,0,0]=4 933 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [0,1,1,0,0,0|2,0,0]=4 934 B10R1.61 CC1=C(C=CC=C1)C(=S)N Z57046956 [0,1,1,0,0,0|2,0,0]=4 935 B10R1.61 CN(C)C1=C(C=CC=C1)O Z2681253687 [0,1,1,0,0,0|1,0,1]=4 936 B10R1.61 N=C(N)C1=C(C=CC=C1)Br Z1266823189 [0,1,1,0,0,0|2,0,0]=4 937 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl Z1695669929 [0,1,1,0,0,0|2,0,0]=4 938 B10R1.61 N=C(N)C1=C(C=CC=C1)F Z2442104317 [0,1,1,0,0,0|2,0,0]=4 939 B10R1.61 N=C(N)C1=C(C=CC=C1)N Z199055442 [0,1,1,0,0,0|2,0,0]=4 940 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [0,1,1,0,0,0|1,0,0]=3 941 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [0,1,1,0,0,0|2,0,0]=4 942 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [0,1,1,0,0,0|2,0,0]=4 943 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [0,1,1,0,0,0|2,0,0]=4 944 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [0,1,1,0,0,0|2,0,0]=4 945 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [0,1,1,0,0,0|1,0,0]=3 946 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [0,1,1,0,0,0|2,0,0]=4 947 B10R1.61 NC(=S)C1=C(C=CC=C1)N Z99601360 [0,1,1,0,0,0|2,0,0]=4 948 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [0,1,1,0,0,0|2,0,0]=4 949 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [0,1,1,0,0,0|2,0,0]=4 950 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [0,1,1,0,0,0|2,0,0]=4 951 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [0,1,1,0,0,0|2,0,0]=4 952 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [0,1,1,0,0,0|1,0,0]=3 953 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [0,1,1,0,0,0|1,1,0]=4 954 B10R1.61 O=C(O)C1=C(C=CC=N1)O Z608353738 [0,1,1,0,0,0|2,0,0]=4 955 B10R1.61 OB(O)C1=C(C=CC=C1)O Z1201620791 [0,1,1,0,0,0|2,0,0]=4 956 B10R1.245 CC1=C(C(=CC=C1)Br)C=O Z1255468524 [0,1,1,0,0,0|2,0,0]=4 957 B10R1.245 CC1=C(C(=CC=C1)Cl)C=O Z1203162282 [0,1,1,0,0,0|2,0,0]=4 958 B10R1.245 CC1=C(C(=CC=C1)F)C=O Z1255490372 [0,1,1,0,0,0|2,0,0]=4 959 B10R1.245 CC1=C(C(=CC=C1)O)C=O Z1255404975 [0,1,1,0,0,0|1,0,0]=3 960 B10R1.245 CC1=CC=CC(=C1C=O)C Z1233237340 [0,1,1,0,0,0|2,0,0]=4 961 B10R1.245 CNC1=C(C=CC=C1O)F Z3689709670 [0,1,1,0,0,0|1,0,1]=4 962 B10R1.245 COC1=C(C=CC=C1N)Cl Z274541918 [0,1,1,0,0,0|1,0,1]=4 963 B10R1.245 N#CC1=C(C=CC=C1Cl)O Z992258522 [0,1,1,0,0,0|1,0,1]=4 964 B10R1.245 N#CC1=C(C=CC=C1F)O Z425420618 [0,1,1,0,0,0|1,0,1]=4 965 B10R1.245 NCC1=C(C=CC=C1O)Br Z3182659555 [0,1,1,0,0,0|1,0,1]=4 966 B10R1.245 NCC1=C(C=CC=C1O)F Z2787034658 [0,1,1,0,0,0|1,0,1]=4 967 B10R1.245 NCC1=C(C=CC=C1O)O Z2906109104 [0,1,1,0,0,0|1,0,1]=4 968 B10R1.245 O=CC1=C(C=CC=C1Br)Br Z1269166406 [0,1,1,0,0,0|2,0,0]=4 969 B10R1.245 O=CC1=C(C=CC=C1Br)Cl Z1269187937 [0,1,1,0,0,0|2,0,0]=4 970 B10R1.245 O=CC1=C(C=CC=C1Br)F Z1138557911 [0,1,1,0,0,0|2,0,0]=4 971 B10R1.245 O=CC1=C(C=CC=C1Br)O Z1269175728 [0,1,1,0,0,0|1,0,0]=3 972 B10R1.245 O=CC1=C(C=CC=C1Cl)Cl Z57773430 [0,1,1,0,0,0|2,0,0]=4 973 B10R1.245 O=CC1=C(C=CC=C1Cl)F Z104472904 [0,1,1,0,0,0|2,0,0]=4 974 B10R1.245 O=CC1=C(C=CC=C1Cl)O Z385458800 [0,1,1,0,0,0|1,0,0]=3 975 B10R1.245 O=CC1=C(C=CC=C1F)F Z104477798 [0,1,1,0,0,0|2,0,0]=4 976 B10R1.245 O=CC1=C(C=CC=C1F)O Z1201620838 [0,1,1,0,0,0|1,0,0]=3 977 B10R1.245 O=CC1=C(C=CC=C1I)F Z1269131251 [0,1,1,0,0,0|2,0,0]=4 978 B10R1.245 O=CC1=C(C=CC=C1O)O Z1198175863 [0,1,1,0,0,0|1,0,0]=3 979 B10R1.245 O=CC1=C(C=NC=C1Cl)O Z1255504780 [0,1,1,0,0,0|2,0,0]=4 980 B10R2.2 CC1=CC2=C(N1)SC=C2 Z1486022690 [0,1,0,0,1,0|1,1,0]=4 981 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [0,1,0,0,1,0|0,0,2]=4 982 B12R2.1041 O=C1N=C2C=CC=CC=C2N1 Z1509141704 [0,1,0,0,0,1|2,0,0]=4 983 B12R2.24 BrC1=CC2=C(C=C1)C=NC=C2 Z1258567795 [0,1,0,0,0,1|1,0,0]=3 984 B12R2.24 BrC1=CC2=C(C=C1)N=CC=C2 Z732220500 [0,1,0,0,0,1|1,0,0]=3 985 B12R2.24 BrC1=CC2=C(C=C1)N=CC=N2 Z1262255201 [0,1,0,0,0,1|1,0,0]=3 986 B12R2.24 BrC1=CC2=C(C=C1)N=CN=C2 Z1263714006 [0,1,0,0,0,1|1,0,0]=3 987 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 Z1741976975 [0,1,0,0,0,1|0,0,2]=4 988 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 Z56944508 [0,1,0,0,0,1|0,0,2]=4 989 B12R2.24 BrC1=CC2=C(C=CC=C2)C=C1 Z166622678 [0,1,0,0,0,1|1,0,0]=3 990 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 Z337707764 [0,1,0,0,0,1|1,0,0]=3 991 B12R2.24 BrC1=CC2=C(N=CC=N2)N=C1 Z1143430675 [0,1,0,0,0,1|2,0,0]=4 992 B12R2.24 BrC1=NC2=C(C=CC=C2)C=N1 Z1269157598 [0,1,0,0,0,1|1,0,0]=3 993 B12R2.24 BrC1=NC2=C(C=CC=C2)N=C1 Z979455958 [0,1,0,0,0,1|1,0,0]=3 994 B12R2.24 BrC1=NC2=C(C=CC=C2)N=N1 Z1416198357 [0,1,0,0,0,1|2,0,0]=4 995 B12R2.24 BrC1=NC2=C(C=CC=N2)C=N1 Z3716166932 [0,1,0,0,0,1|2,0,0]=4 996 B12R2.24 BrC1=NN=C2C=CC=CC2=C1 Z1269157470 [0,1,0,0,0,1|1,0,0]=3 997 B12R2.24 CC1=CC2=C(C=C1)C=NC=C2 Z1201624992 [0,1,0,0,0,1|1,0,0]=3 998 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 Z277960616 [0,1,0,0,0,1|1,0,0]=3 999 B12R2.24 CC1=CC2=C(C=C1)NCCO2 Z1203731551 [0,1,0,0,0,1|0,0,2]=4 1000 B12R2.24 CC1=CC2=C(C=C1)OCCC2 Z939648534 [0,1,0,0,0,1|0,0,2]=4 1001 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 Z104476894 [0,1,0,0,0,1|1,0,0]=3 1002 B12R2.24 CC1=CC2=C(C=CC=C2)N=C1 Z1217215047 [0,1,0,0,0,1|1,0,0]=3 1003 B12R2.24 CC1=CC2=C(C=CC=N2)N=C1 Z1255447010 [0,1,0,0,0,1|2,0,0]=4 1004 B12R2.24 CC1=CC2=C(C=CN=C2)C=C1 Z1198320696 [0,1,0,0,0,1|1,0,0]=3 1005 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 Z56926563 [0,1,0,0,0,1|1,0,0]=3 1006 B12R2.24 CC1=NC2=C(C=CC=C2)N=C1 Z1255423472 [0,1,0,0,0,1|1,0,0]=3 1007 B12R2.24 CC1=NC2=C(C=CC=C2)SC1 Z2895174345 [0,1,0,0,0,1|0,1,1]=4 1008 B12R2.24 CC1=NC2=C(C=CC=N2)C=C1 Z1192378575 [0,1,0,0,0,1|2,0,0]=4 1009 B12R2.24 CC1=NC=C2C=CC=CC2=C1 Z1255419276 [0,1,0,0,0,1|1,0,0]=3 1010 B12R2.24 CC1CNC2=C(O1)C=CC=C2 Z1165160777 [0,1,0,0,0,1|0,0,2]=4 1011 B12R2.24 CC1COC2=C(N1)C=CC=C2 Z1201621516 [0,1,0,0,0,1|0,0,2]=4 1012 B12R2.24 C[N+]1=CC2=C(C=CC=C2)C=C1 Z56791123 [0,1,0,0,0,1|1,0,0]=3 1013 B12R2.24 ClC1=CC2=C(C=C1)C=NC=C2 Z1198267117 [0,1,0,0,0,1|1,0,0]=3 1014 B12R2.24 ClC1=CC2=C(C=C1)N=CC=C2 Z425469218 [0,1,0,0,0,1|1,0,0]=3 1015 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 Z1198179941 [0,1,0,0,0,1|0,0,2]=4 1016 B12R2.24 ClC1=CC2=C(C=C1)OCCO2 Z382713970 [0,1,0,0,0,1|0,0,2]=4 1017 B12R2.24 ClC1=CC2=C(C=CC=C2)C=C1 Z1255485910 [0,1,0,0,0,1|1,0,0]=3 1018 B12R2.24 ClC1=CC2=C(C=CN=C2)C=C1 Z1198150534 [0,1,0,0,0,1|1,0,0]=3 1019 B12R2.24 ClC1=NC2=C(C=CC=C2)C=N1 Z1198266697 [0,1,0,0,0,1|1,0,0]=3 1020 B12R2.24 ClC1=NC2=C(C=CC=C2)N=C1 Z240126804 [0,1,0,0,0,1|1,0,0]=3 1021 B12R2.24 ClC1=NC2=C(C=CC=C2)N=N1 Z1198315022 [0,1,0,0,0,1|2,0,0]=4 1022 B12R2.24 ClC1=NC2=C(C=CC=N2)C=N1 Z1255451811 [0,1,0,0,0,1|2,0,0]=4 1023 B12R2.24 ClC1=NN=C2C=CC=CC2=C1 Z1255399482 [0,1,0,0,0,1|1,0,0]=3 1024 B12R2.24 FC1=CC2=C(C=C1)C=NC=C2 Z916823870 [0,1,0,0,0,1|1,0,0]=3 1025 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 Z361878560 [0,1,0,0,0,1|1,0,0]=3 1026 B12R2.24 FC1=NC2=C(C=CC=C2)N=C1 Z1255428916 [0,1,0,0,0,1|1,0,0]=3 1027 B12R2.24 IC1=CC2=C(C=C1)N=CC=C2 Z993990690 [0,1,0,0,0,1|1,0,0]=3 1028 B12R2.24 IC1=CC2=C(C=CC=C2)N=C1 Z1172379319 [0,1,0,0,0,1|1,0,0]=3 1029 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 Z255114686 [0,1,0,0,0,1|1,0,0]=3 1030 B12R2.24 NC1=CC2=C(C=C1)N=CC=N2 Z445162266 [0,1,0,0,0,1|1,0,0]=3 1031 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Z728136682 [0,1,0,0,0,1|0,0,2]=4 1032 B12R2.24 NC1=CC2=C(C=C1)OCCO2 Z56893112 [0,1,0,0,0,1|0,0,2]=4 1033 B12R2.24 NC1=CC2=C(C=CC=C2)C=C1 Z104494980 [0,1,0,0,0,1|1,0,0]=3 1034 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 Z234895085 [0,1,0,0,0,1|1,0,0]=3 1035 B12R2.24 NC1=CC2=C(C=CC=N2)C=C1 Z3069264308 [0,1,0,0,0,1|1,0,0]=3 1036 B12R2.24 NC1=CC2=C(C=CC=N2)N=C1 Z4445880327 [0,1,0,0,0,1|2,0,0]=4 1037 B12R2.24 NC1=NC2=C(C=C1)C=NC=C2 Z3195801694 [0,1,0,0,0,1|2,0,0]=4 1038 B12R2.24 NC1=NC2=C(C=C1)N=CC=C2 Z1198156324 [0,1,0,0,0,1|2,0,0]=4 1039 B12R2.24 NC1=NC2=C(C=CC=C2)C=C1 Z56347237 [0,1,0,0,0,1|1,0,0]=3 1040 B12R2.24 NC1=NC2=C(C=CC=C2)CS1 Z1198725303 [0,1,0,0,0,1|1,0,1]=4 1041 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 Z979455432 [0,1,0,0,0,1|1,0,0]=3 1042 B12R2.24 NC1=NC2=C(C=CC=C2)N=N1 Z57724710 [0,1,0,0,0,1|2,0,0]=4 1043 B12R2.24 NC1=NC2=C(C=CC=N2)C=C1 Z3991429262 [0,1,0,0,0,1|2,0,0]=4 1044 B12R2.24 NC1=NC=C2C=CC=CC2=C1 Z1201619117 [0,1,0,0,0,1|1,0,0]=3 1045 B12R2.24 NC1=NN=C2C=CC=CC2=C1 Z1198155761 [0,1,0,0,0,1|1,0,0]=3 1046 B12R2.24 NC1COC2=C(C1)C=CC=C2 Z415636540 [0,1,0,0,0,1|0,0,2]=4 1047 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Z1203731786 [0,1,0,0,0,1|1,0,0]=3 1048 B12R2.24 O=C1C=CC2=C(N1)C=CC=C2 Z57473020 [0,1,0,0,0,1|1,0,0]=3 1049 B12R2.24 O=C1C=CC2=C(N1)N=CC=C2 Z3235031491 [0,1,0,0,0,1|2,0,0]=4 1050 B12R2.24 O=C1C=CC2=C(O1)C=CC=C2 Z57169486 [0,1,0,0,0,1|0,0,0]=2 1051 B12R2.24 O=C1C=CN2C=CC=CC2=N1 Z2932603201 [0,1,0,0,0,1|2,0,0]=4 1052 B12R2.24 O=C1C=NC2=C(N1)C=CC=C2 Z56824051 [0,1,0,0,0,1|1,0,0]=3 1053 B12R2.24 O=C1C=NC2=C(N1)C=NC=C2 Z1198311650 [0,1,0,0,0,1|2,0,0]=4 1054 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [0,1,0,0,0,1|1,0,1]=4 1055 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 Z1255486033 [0,1,0,0,0,1|0,0,1]=3 1056 B12R2.24 O=C1CCC2=C(C1)C=CC=C2 Z104495562 [0,1,0,0,0,1|1,0,1]=4 1057 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [0,1,0,0,0,1|1,0,1]=4 1058 B12R2.24 O=C1CCC2=C(O1)C=CC=C2 Z586249466 [0,1,0,0,0,1|0,0,1]=3 1059 B12R2.24 O=C1CNC2=C(N1)C=CC=C2 Z56990723 [0,1,0,0,0,1|1,0,1]=4 1060 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [0,1,0,0,0,1|0,0,1]=3 1061 B12R2.24 O=C1COC2=C(N1)C=CC=N2 Z1198157043 [0,1,0,0,0,1|1,0,1]=4 1062 B12R2.24 O=C1COC2=C(N1)C=NC=C2 Z1198175968 [0,1,0,0,0,1|1,0,1]=4 1063 B12R2.24 O=C1COC2=C(N1)N=CC=C2 Z1255378941 [0,1,0,0,0,1|1,0,1]=4 1064 B12R2.24 O=C1CSC2=C(N1)C=CC=C2 Z55120717 [0,1,0,0,0,1|0,1,1]=4 1065 B12R2.24 O=C1N=CC2=C(N1)C=CC=C2 Z1198176626 [0,1,0,0,0,1|1,0,0]=3 1066 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [0,1,0,0,0,1|1,0,0]=3 1067 B12R2.24 O=C1NCC2=C(O1)C=CC=C2 Z1198723657 [0,1,0,0,0,1|0,0,1]=3 1068 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 Z2753800586 [0,1,0,0,0,1|1,0,0]=3 1069 B12R2.24 OC1=CC2=C(C=C1)C=NC=N2 Z1198278088 [0,1,0,0,0,1|1,0,0]=3 1070 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Z1551961557 [0,1,0,0,0,1|0,0,2]=4 1071 B12R2.24 OC1=CC2=C(C=C1)COCC2 Z1255359696 [0,1,0,0,0,1|0,0,2]=4 1072 B12R2.24 OC1=CC2=C(C=C1)N=CC=C2 Z759294450 [0,1,0,0,0,1|1,0,0]=3 1073 B12R2.24 OC1=CC2=C(C=C1)N=CC=N2 Z636018680 [0,1,0,0,0,1|1,0,0]=3 1074 B12R2.24 OC1=CC2=C(C=C1)N=CN=C2 Z1255435182 [0,1,0,0,0,1|1,0,0]=3 1075 B12R2.24 OC1=CC2=C(C=C1)NCCO2 Z4967332209 [0,1,0,0,0,1|0,0,2]=4 1076 B12R2.24 OC1=CC2=C(C=C1)OCCC2 Z1201627010 [0,1,0,0,0,1|0,0,2]=4 1077 B12R2.24 OC1=CC2=C(C=C1)OCCN2 Z3234815231 [0,1,0,0,0,1|0,0,2]=4 1078 B12R2.24 OC1=CC2=C(C=C1)OCCO2 Z168827500 [0,1,0,0,0,1|0,0,2]=4 1079 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 Z57127515 [0,1,0,0,0,1|1,0,0]=3 1080 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 Z1255419538 [0,1,0,0,0,1|1,0,0]=3 1081 B12R2.24 OC1=CC2=C(C=CN=C2)C=C1 Z56928661 [0,1,0,0,0,1|1,0,0]=3 1082 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [0,1,0,0,0,1|1,0,1]=4 1083 B12R2.24 SC1=NC2=C(C=CC=C2)C=C1 Z203045038 [0,1,0,0,0,1|1,0,0]=3 1084 B12R2.24 SC1=NC2=C(C=CC=C2)N=C1 Z119989150 [0,1,0,0,0,1|1,0,0]=3 1085 B12R2.1081 BrC1=C2C=CC=CC2=CN=C1 Z57474193 [0,1,0,0,0,1|1,0,0]=3 1086 B12R2.1081 BrC1=C2C=CC=CC2=NC=N1 Z600501698 [0,1,0,0,0,1|1,0,0]=3 1087 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 Z57204608 [0,1,0,0,0,1|1,0,0]=3 1088 B12R2.1081 BrC1=C2C=CN=CC2=CN=C1 Z1269154560 [0,1,0,0,0,1|2,0,0]=4 1089 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 Z1269224644 [0,1,0,0,0,1|1,0,0]=3 1090 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 Z839152792 [0,1,0,0,0,1|1,0,0]=3 1091 B12R2.1081 BrC1=C2N=CC=CC2=CN=C1 Z1269219247 [0,1,0,0,0,1|2,0,0]=4 1092 B12R2.1081 BrC1=C2N=CC=NC2=CC=C1 Z1269202681 [0,1,0,0,0,1|1,0,0]=3 1093 B12R2.1081 BrC1=C2N=CC=NC2=CN=C1 Z1269239929 [0,1,0,0,0,1|2,0,0]=4 1094 B12R2.1081 BrC1=C2NCCOC2=CC=C1 Z2943434775 [0,1,0,0,0,1|0,0,2]=4 1095 B12R2.1081 BrC1=C2OCCCC2=CC=C1 Z1269242001 [0,1,0,0,0,1|0,0,2]=4 1096 B12R2.1081 BrC1=C2OCCNC2=CC=C1 Z1983132695 [0,1,0,0,0,1|0,0,2]=4 1097 B12R2.1081 CC1=C2C=CC=CC2=CC=C1 Z104475342 [0,1,0,0,0,1|1,0,0]=3 1098 B12R2.1081 CC1=C2C=CC=CC2=CC=N1 Z1255415440 [0,1,0,0,0,1|1,0,0]=3 1099 B12R2.1081 CC1=C2C=CC=CC2=NC=C1 Z104472668 [0,1,0,0,0,1|1,0,0]=3 1100 B12R2.1081 CC1=C2N=CC=CC2=NC=C1 Z1255451101 [0,1,0,0,0,1|2,0,0]=4 1101 B12R2.1081 ClC1=C2C=CC=CC2=CC=C1 Z104504716 [0,1,0,0,0,1|1,0,0]=3 1102 B12R2.1081 ClC1=C2C=CC=CC2=CN=N1 Z2768165624 [0,1,0,0,0,1|2,0,0]=4 1103 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 Z431511604 [0,1,0,0,0,1|1,0,0]=3 1104 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 Z119990038 [0,1,0,0,0,1|1,0,0]=3 1105 B12R2.1081 ClC1=C2C=CC=NC2=NC=N1 Z255149910 [0,1,0,0,0,1|2,0,0]=4 1106 B12R2.1081 ClC1=C2C=CN=CC2=CC=C1 Z1255446597 [0,1,0,0,0,1|1,0,0]=3 1107 B12R2.1081 ClC1=C2C=CN=CC2=NC=N1 Z1198269948 [0,1,0,0,0,1|2,0,0]=4 1108 B12R2.1081 ClC1=C2C=NC=CC2=CC=C1 Z1201624136 [0,1,0,0,0,1|1,0,0]=3 1109 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 Z362567890 [0,1,0,0,0,1|1,0,0]=3 1110 B12R2.1081 ClC1=C2N=CC=CC2=NC=N1 Z1198275135 [0,1,0,0,0,1|2,0,0]=4 1111 B12R2.1081 ClC1=C2OCCNC2=CC=C1 Z1255446801 [0,1,0,0,0,1|0,0,2]=4 1112 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 Z1162445957 [0,1,0,0,0,1|1,0,0]=3 1113 B12R2.1081 FC1=C2C=NC=CC2=CC=C1 Z916812496 [0,1,0,0,0,1|1,0,0]=3 1114 B12R2.1081 FC1=C2N=CC=CC2=CC=C1 Z243277338 [0,1,0,0,0,1|1,0,0]=3 1115 B12R2.1081 FC1=C2N=CC=NC2=CC=C1 Z1198266668 [0,1,0,0,0,1|1,0,0]=3 1116 B12R2.1081 FC1=C2NCCOC2=CC=C1 Z1255361602 [0,1,0,0,0,1|0,0,2]=4 1117 B12R2.1081 IC1=C2C=CC=NC2=CC=C1 Z381540734 [0,1,0,0,0,1|1,0,0]=3 1118 B12R2.1081 NC1=C2C=CC=CC2=CC=C1 Z57127984 [0,1,0,0,0,1|1,0,0]=3 1119 B12R2.1081 NC1=C2C=CC=CC2=CC=N1 Z1203162487 [0,1,0,0,0,1|1,0,0]=3 1120 B12R2.1081 NC1=C2C=CC=CC2=CN=C1 Z1524694515 [0,1,0,0,0,1|1,0,0]=3 1121 B12R2.1081 NC1=C2C=CC=CC2=CN=N1 Z425847324 [0,1,0,0,0,1|2,0,0]=4 1122 B12R2.1081 NC1=C2C=CC=CC2=NC=C1 Z381037214 [0,1,0,0,0,1|1,0,0]=3 1123 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 Z99599970 [0,1,0,0,0,1|1,0,0]=3 1124 B12R2.1081 NC1=C2C=CC=NC2=CC=C1 Z56919160 [0,1,0,0,0,1|1,0,0]=3 1125 B12R2.1081 NC1=C2C=CC=NC2=NC=N1 Z1198236222 [0,1,0,0,0,1|2,0,0]=4 1126 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 Z104472972 [0,1,0,0,0,1|1,0,0]=3 1127 B12R2.1081 NC1=C2C=CN=CC2=CN=C1 Z1203642415 [0,1,0,0,0,1|2,0,0]=4 1128 B12R2.1081 NC1=C2C=CN=CC2=NC=C1 Z1203580795 [0,1,0,0,0,1|2,0,0]=4 1129 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 Z1201619572 [0,1,0,0,0,1|1,0,0]=3 1130 B12R2.1081 NC1=C2C=NC=CC2=NC=C1 Z1198157283 [0,1,0,0,0,1|2,0,0]=4 1131 B12R2.1081 NC1=C2C=NN=CC2=CC=C1 Z1198176739 [0,1,0,0,0,1|2,0,0]=4 1132 B12R2.1081 NC1=C2CCOCC2=CC=C1 Z3398761712 [0,1,0,0,0,1|0,0,2]=4 1133 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 Z57032752 [0,1,0,0,0,1|1,0,0]=3 1134 B12R2.1081 NC1=C2N=CC=CC2=CC=N1 Z3034935779 [0,1,0,0,0,1|2,0,0]=4 1135 B12R2.1081 NC1=C2N=CC=CC2=NC=C1 Z1198152636 [0,1,0,0,0,1|2,0,0]=4 1136 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 Z1198157683 [0,1,0,0,0,1|1,0,0]=3 1137 B12R2.1081 NC1=C2N=CC=NC2=CC=N1 Z1198234140 [0,1,0,0,0,1|2,0,0]=4 1138 B12R2.1081 NC1=C2N=CC=NC2=CN=C1 Z1203583309 [0,1,0,0,0,1|2,0,0]=4 1139 B12R2.1081 NC1=C2OCCCC2=CC=C1 Z1723491871 [0,1,0,0,0,1|0,0,2]=4 1140 B12R2.1081 NC1=C2OCCOC2=CC=C1 Z440625166 [0,1,0,0,0,1|0,0,2]=4 1141 B12R2.1081 NC1CCOC2=C1C=CC=C2 Z85923435 [0,1,0,0,0,1|0,0,2]=4 1142 B12R2.1081 NC1COCC2=C1C=CC=C2 Z1198178449 [0,1,0,0,0,1|0,0,2]=4 1143 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 Z1442208747 [0,1,0,0,0,1|0,0,2]=4 1144 B12R2.1081 N[N+]1=C2C=CC=CC2=CC=C1 Z56760714 [0,1,0,0,0,1|1,0,0]=3 1145 B12R2.1081 O=C1C=CNC2=C1C=CN=C2 Z4513281563 [0,1,0,0,0,1|2,0,0]=4 1146 B12R2.1081 O=C1C=COC2=C1C=CC=C2 Z1218937140 [0,1,0,0,0,1|0,0,0]=2 1147 B12R2.1081 O=C1CCCC2=C1C=CC=C2 Z104477014 [0,1,0,0,0,1|1,0,1]=4 1148 B12R2.1081 O=C1CCNC2=C1C=CC=C2 Z1492781321 [0,1,0,0,0,1|1,0,1]=4 1149 B12R2.1081 O=C1CCOC2=C1C=CC=C2 Z85920466 [0,1,0,0,0,1|0,0,1]=3 1150 B12R2.1081 O=C1CCOC2=C1C=CC=N2 Z1198233082 [0,1,0,0,0,1|1,0,1]=4 1151 B12R2.1081 O=C1CCSC2=C1C=CC=C2 Z56914832 [0,1,0,0,0,1|0,1,1]=4 1152 B12R2.1081 O=C1COCC2=C1C=CC=C2 Z1201625145 [0,1,0,0,0,1|0,0,1]=3 1153 B12R2.1081 O=C1N=CNC2=C1N=CC=C2 Z3037257396 [0,1,0,0,0,1|2,0,0]=4 1154 B12R2.1081 O=C1NC=CC2=C1C=CC=C2 Z56960237 [0,1,0,0,0,1|1,0,0]=3 1155 B12R2.1081 O=C1NC=CC2=C1C=CC=N2 Z3227107005 [0,1,0,0,0,1|2,0,0]=4 1156 B12R2.1081 O=C1NC=CC2=C1C=NC=C2 Z1203731790 [0,1,0,0,0,1|2,0,0]=4 1157 B12R2.1081 O=C1NC=CC2=C1C=NC=N2 Z1203746699 [0,1,0,0,0,1|2,0,0]=4 1158 B12R2.1081 O=C1NC=CC2=C1N=CC=N2 Z1203732948 [0,1,0,0,0,1|2,0,0]=4 1159 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 Z56862715 [0,1,0,0,0,1|1,0,0]=3 1160 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 Z227832770 [0,1,0,0,0,1|2,0,0]=4 1161 B12R2.1081 O=C1NC=NC2=C1C=CN=C2 Z1198269947 [0,1,0,0,0,1|2,0,0]=4 1162 B12R2.1081 O=C1NCCC2=C1C=CC=C2 Z56801375 [0,1,0,0,0,1|1,0,1]=4 1163 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 Z48957540 [0,1,0,0,0,1|2,0,0]=4 1164 B12R2.1081 O=C1NN=NC2=C1C=CC=C2 Z56943376 [0,1,0,0,0,1|2,0,0]=4 1165 B12R2.1081 O=C1OC=CC2=C1C=CC=C2 Z1198175817 [0,1,0,0,0,1|0,0,0]=2 1166 B12R2.1081 O=C1OC=CC2=C1N=CC=C2 Z1127388775 [0,1,0,0,0,1|1,0,0]=3 1167 B12R2.1081 OB1OCCC2=C1C=CC=C2 Z1201624582 [0,1,0,0,0,1|0,0,2]=4 1168 B12R2.1081 OC1=C2C=CC=CC2=CC=C1 Z104474036 [0,1,0,0,0,1|1,0,0]=3 1169 B12R2.1081 OC1=C2C=CC=CC2=CN=C1 Z1198152661 [0,1,0,0,0,1|1,0,0]=3 1170 B12R2.1081 OC1=C2C=CC=CC2=NC=C1 Z818727120 [0,1,0,0,0,1|1,0,0]=3 1171 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 Z104495104 [0,1,0,0,0,1|1,0,0]=3 1172 B12R2.1081 OC1=C2C=CC=NC2=NC=C1 Z1198181777 [0,1,0,0,0,1|2,0,0]=4 1173 B12R2.1081 OC1=C2C=NC=CC2=CC=C1 Z5141131098 [0,1,0,0,0,1|1,0,0]=3 1174 B12R2.1081 OC1=C2C=NC=CC2=NC=C1 Z1335657679 [0,1,0,0,0,1|2,0,0]=4 1175 B12R2.1081 OC1=C2C=NC=NC2=CC=C1 Z1198155756 [0,1,0,0,0,1|1,0,0]=3 1176 B12R2.1081 OC1=C2CCOCC2=CC=C1 Z1255506128 [0,1,0,0,0,1|0,0,2]=4 1177 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 Z56926518 [0,1,0,0,0,1|1,0,0]=3 1178 B12R2.1081 OC1=C2N=CC=CC2=CC=N1 Z1201626988 [0,1,0,0,0,1|2,0,0]=4 1179 B12R2.1081 OC1=C2N=CC=CC2=NC=C1 Z1198152632 [0,1,0,0,0,1|2,0,0]=4 1180 B12R2.1081 OC1=C2OCCCC2=CC=C1 Z1198726643 [0,1,0,0,0,1|0,0,2]=4 1181 B12R2.1081 OC1=C2OCCOC2=CC=C1 Z1069599524 [0,1,0,0,0,1|0,0,2]=4 1182 B12R2.1081 OC1CCOC2=C1C=CC=C2 Z335244980 [0,1,0,0,0,1|0,0,2]=4 1183 B12R2.1081 OC1COCC2=C1C=CC=C2 Z1255366473 [0,1,0,0,0,1|0,0,2]=4 1184 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 Z959151866 [0,1,0,0,0,1|0,0,2]=4 1185 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 Z959151868 [0,1,0,0,0,1|0,0,2]=4 1186 B12R2.1081 S=C1C=CNC2=C1C=CC=C2 Z1258992692 [0,1,0,0,0,1|1,0,0]=3 1187 B12R2.1081 S=C1C=NNC2=C1C=CC=C2 Z126932680 [0,1,0,0,0,1|1,0,0]=3 1188 B12R2.1081 SC1=C2C=CC=CC2=CN=N1 Z56754260 [0,1,0,0,0,1|2,0,0]=4 1189 B12R2.1081 SC1=C2C=CC=CC2=NC=N1 Z203045188 [0,1,0,0,0,1|1,0,0]=3 1190 B12R2.1 C=CN1C=NC2=C1C=CC=C2 Z87001578 [0,2,0,0,0,0|2,0,0]=4 1191 B12R2.1 CCC1=CNC2=C1C=CC=C2 Z1198159100 [0,2,0,0,0,0|1,0,0]=3 1192 B12R2.1 CCN1C=NC2=C1C=CC=C2 Z53833304 [0,2,0,0,0,0|2,0,0]=4 1193 B12R2.1 CNC1=NSC2=C1C=CC=C2 Z54745174 [0,2,0,0,0,0|1,1,0]=4 1194 B12R2.1 CSC1=CNC2=C1C=CC=C2 Z1262562193 [0,2,0,0,0,0|1,0,0]=3 1195 B12R2.1 ClCC1=CN=C2N1C=CC=C2 Z57033916 [0,2,0,0,0,0|2,0,0]=4 1196 B12R2.1 N#CC1=CN=C2N1C=CC=C2 Z1198158121 [0,2,0,0,0,0|2,0,0]=4 1197 B12R2.1 N#CC1=CNC2=C1C=CC=C2 Z57204989 [0,2,0,0,0,0|1,0,0]=3 1198 B12R2.1 N#CC1=COC2=C1C=CC=C2 Z1188275503 [0,2,0,0,0,0|0,0,0]=2 1199 B12R2.1 N#CC1=NNC2=C1C=CC=C2 Z1198158918 [0,2,0,0,0,0|2,0,0]=4 1200 B12R2.1 N#CC1=NSC2=C1C=CC=C2 Z3241894086 [0,2,0,0,0,0|1,1,0]=4 1201 B12R2.1 NCC1=C2C=CC=CN2N=C1 Z2065464373 [0,2,0,0,0,0|2,0,0]=4 1202 B12R2.1 NCC1=CN=C2N1C=CC=C2 Z3234882063 [0,2,0,0,0,0|2,0,0]=4 1203 B12R2.1 NCC1=CSC2=C1C=CC=C2 Z425459986 [0,2,0,0,0,0|0,1,0]=3 1204 B12R2.1 NCC1=CSC2=C1N=CC=C2 Z1618144423 [0,2,0,0,0,0|1,1,0]=4 1205 B12R2.1 NCC1=NOC2=C1C=CC=C2 Z1203581810 [0,2,0,0,0,0|1,0,0]=3 1206 B12R2.1 NCC1=NSC2=C1C=CC=C2 Z2456396538 [0,2,0,0,0,0|1,1,0]=4 1207 B12R2.1 NCC1COC2=C1C=CC=C2 Z1197877490 [0,2,0,0,0,0|0,0,2]=4 1208 B12R2.1 O=CC1=C2C=CC=CC2=NS1 Z1504687602 [0,2,0,0,0,0|2,0,0]=4 1209 B12R2.1 O=CC1=C2C=CC=CN2N=C1 Z1123806715 [0,2,0,0,0,0|2,0,0]=4 1210 B12R2.1 O=CC1=CN=C2N1C=CC=C2 Z727564760 [0,2,0,0,0,0|2,0,0]=4 1211 B12R2.1 O=CC1=CNC2=C1C=CC=C2 Z56785575 [0,2,0,0,0,0|1,0,0]=3 1212 B12R2.1 O=CC1=CNC2=C1C=CC=N2 Z57337365 [0,2,0,0,0,0|2,0,0]=4 1213 B12R2.1 O=CC1=CNC2=C1C=CN=C2 Z1198176790 [0,2,0,0,0,0|2,0,0]=4 1214 B12R2.1 O=CC1=CNC2=C1C=NC=C2 Z1079456084 [0,2,0,0,0,0|2,0,0]=4 1215 B12R2.1 O=CC1=CNC2=C1N=CC=C2 Z1203747933 [0,2,0,0,0,0|2,0,0]=4 1216 B12R2.1 O=CC1=COC2=C1C=CC=C2 Z1197879644 [0,2,0,0,0,0|0,0,0]=2 1217 B12R2.1 O=CC1=CSC2=C1C=CC=C2 Z199535912 [0,2,0,0,0,0|0,1,0]=3 1218 B12R2.1 O=CC1=NNC2=C1C=CC=C2 Z1065726010 [0,2,0,0,0,0|2,0,0]=4 1219 B12R2.1 OCC1=CN=C2N1C=CC=C2 Z1198235297 [0,2,0,0,0,0|2,0,0]=4 1220 B12R2.1 OCC1=CNC2=C1C=CC=C2 Z85923165 [0,2,0,0,0,0|1,0,0]=3 1221 B12R2.1 OCC1=CNC2=C1C=CN=C2 Z2471603543 [0,2,0,0,0,0|2,0,0]=4 1222 B12R2.1 OCC1=CSC2=C1C=CC=C2 Z385370244 [0,2,0,0,0,0|0,1,0]=3 1223 B12R2.1 OCN1C=NC2=C1C=CC=C2 Z56926682 [0,2,0,0,0,0|2,0,0]=4 1224 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)Br Z361892264 [0,2,0,0,0,0|1,0,0]=3 1225 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)C Z56867202 [0,2,0,0,0,0|1,0,0]=3 1226 B12R2.18 CC1=C(C2=C(S1)C=CC=C2)Br Z1269212248 [0,2,0,0,0,0|0,1,0]=3 1227 B12R2.18 CC1=C(N2C=CC=CC2=N1)I Z1259335950 [0,2,0,0,0,0|2,0,0]=4 1228 B12R2.18 CC1=NC2=C(N1C)C=CC=C2 Z53833319 [0,2,0,0,0,0|2,0,0]=4 1229 B12R2.18 CC1=NC2=C(N1N)C=CC=C2 Z119919218 [0,2,0,0,0,0|2,0,0]=4 1230 B12R2.18 CC1=NN2C=CC=CC2=C1Br Z1416171576 [0,2,0,0,0,0|2,0,0]=4 1231 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,2,0,0,0,0|1,0,1]=4 1232 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,2,0,0,0,0|1,0,1]=4 1233 B12R2.18 CC1OC2=C(C1N)C=CC=C2 Z2160887371 [0,2,0,0,0,0|0,0,2]=4 1234 B12R2.18 CN1C(=CC2=C1C=CC=C2)N Z3243653956 [0,2,0,0,0,0|1,0,0]=3 1235 B12R2.18 CN1C(=N)SC2=C1C=CC=C2 Z56812812 [0,2,0,0,0,0|1,1,0]=4 1236 B12R2.18 CN1C(=NC2=C1C=CC=C2)Cl Z1198154841 [0,2,0,0,0,0|2,0,0]=4 1237 B12R2.18 CN1C(=NC2=C1C=CC=C2)S Z56891250 [0,2,0,0,0,0|2,0,0]=4 1238 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,2,0,0,0,0|1,0,1]=4 1239 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 Z57070418 [0,2,0,0,0,0|2,0,0]=4 1240 B12R2.18 CN1N=C2C=CC=CC2=C1N Z4958191038 [0,2,0,0,0,0|2,0,0]=4 1241 B12R2.18 CN1NC2=C(C1=O)C=CC=C2 Z1255429786 [0,2,0,0,0,0|2,0,0]=4 1242 B12R2.18 ClC1=C(C2=C(S1)C=CC=C2)Cl Z1269130316 [0,2,0,0,0,0|0,1,0]=3 1243 B12R2.18 NC1=NC2=C(N1N)C=CC=C2 Z56788891 [0,2,0,0,0,0|2,0,0]=4 1244 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,2,0,0,0,0|1,0,1]=4 1245 B12R2.18 NN1CC2=C(C1=O)C=CC=C2 Z1953500024 [0,2,0,0,0,0|2,0,0]=4 1246 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,2,0,0,0,0|1,0,1]=4 1247 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [0,2,0,0,0,0|1,0,0]=3 1248 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,2,0,0,0,0|1,0,1]=4 1249 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,2,0,0,0,0|2,0,0]=4 1250 B12R2.18 O=C1SC2=C(C1=O)C=CC=C2 Z1198153623 [0,2,0,0,0,0|0,1,0]=3 1251 B12R2.132 BrC1=CC2=C(N=C1)NC=C2I Z1269150540 [0,2,0,0,0,0|2,0,0]=4 1252 B12R2.132 CC1=CC2=C(C=C1)CCC2=O Z814904824 [0,2,0,0,0,0|1,0,1]=4 1253 B12R2.132 CC1=CC2=C(C=C1)COC2=O Z1255391985 [0,2,0,0,0,0|2,0,0]=4 1254 B12R2.132 CC1=CC2=C(C=C1)NN=C2N Z1203579236 [0,2,0,0,0,0|2,0,0]=4 1255 B12R2.132 CC1=CC2=C(C=C1)OCC2N Z1431002725 [0,2,0,0,0,0|0,0,2]=4 1256 B12R2.132 CC1=CN=C2N1C=C(C=C2)Br Z4647253375 [0,2,0,0,0,0|2,0,0]=4 1257 B12R2.132 CC1=CN=C2N1C=C(C=C2)N Z4606336944 [0,2,0,0,0,0|2,0,0]=4 1258 B12R2.132 CC1=CNC2=C1C=C(C=N2)Br Z1269219081 [0,2,0,0,0,0|2,0,0]=4 1259 B12R2.132 CC1=CNC2=C1C=C(C=N2)Cl Z1255504908 [0,2,0,0,0,0|2,0,0]=4 1260 B12R2.132 CC1=COC2=C1C=C(C=C2)Br Z1269218033 [0,2,0,0,0,0|0,0,0]=2 1261 B12R2.132 CC1=COC2=C1C=C(C=C2)Cl Z1198170631 [0,2,0,0,0,0|0,0,0]=2 1262 B12R2.132 CC1=COC2=C1C=C(C=C2)F Z1255384789 [0,2,0,0,0,0|0,0,0]=2 1263 B12R2.132 CC1=COC2=C1C=C(C=C2)N Z1203586519 [0,2,0,0,0,0|0,0,0]=2 1264 B12R2.132 CC1=CSC2=C1C=C(C=C2)Br Z1269161739 [0,2,0,0,0,0|0,1,0]=3 1265 B12R2.132 CC1=CSC2=C1C=C(C=C2)Cl Z1201618278 [0,2,0,0,0,0|0,1,0]=3 1266 B12R2.132 CC1=NNC2=C1C=C(C=C2)Br Z1269128137 [0,2,0,0,0,0|2,0,0]=4 1267 B12R2.132 CC1=NOC2=C1C=C(C=N2)Br Z680888866 [0,2,0,0,0,0|2,0,0]=4 1268 B12R2.132 CC1=NOC2=C1C=C(C=N2)N Z992914582 [0,2,0,0,0,0|2,0,0]=4 1269 B12R2.132 CN1C=CC2=C1C=C(C=C2)Br Z1269186749 [0,2,0,0,0,0|1,0,0]=3 1270 B12R2.132 CN1C=CC2=C1C=C(C=C2)N Z414315292 [0,2,0,0,0,0|1,0,0]=3 1271 B12R2.132 CN1C=CC2=C1C=C(C=C2)O Z1255447420 [0,2,0,0,0,0|1,0,0]=3 1272 B12R2.132 CN1C=NC2=C1C=C(C=C2)Br Z1269128394 [0,2,0,0,0,0|2,0,0]=4 1273 B12R2.132 CN1C=NC2=C1C=C(C=C2)N Z2935001169 [0,2,0,0,0,0|2,0,0]=4 1274 B12R2.132 CN1N=CC2=C1C=C(C=C2)N Z444871566 [0,2,0,0,0,0|2,0,0]=4 1275 B12R2.132 ClC1=C2C=C(C=CC2=NS1)Br Z4456757010 [0,2,0,0,0,0|2,0,0]=4 1276 B12R2.132 ClC1=CC2=C(C=C1)SC=C2Br Z1269194561 [0,2,0,0,0,0|0,1,0]=3 1277 B12R2.132 ClC1=CC2=C(C=NN2C=C1)Br Z2733315063 [0,2,0,0,0,0|2,0,0]=4 1278 B12R2.132 FC1=CC2=C(C=C1)OC=C2Br Z1551949935 [0,2,0,0,0,0|0,0,0]=2 1279 B12R2.132 NC1=C2C=C(C=CC2=NS1)Br Z1269127809 [0,2,0,0,0,0|2,0,0]=4 1280 B12R2.132 NC1=CC2=C(C=C1)CCC2=O Z1201619096 [0,2,0,0,0,0|1,0,1]=4 1281 B12R2.132 NC1=CC2=C(C=C1)CNC2=O Z234898249 [0,2,0,0,0,0|2,0,0]=4 1282 B12R2.132 NC1=CC2=C(C=C1)COC2=O Z276599558 [0,2,0,0,0,0|2,0,0]=4 1283 B12R2.132 NC1=CC2=C(C=C1)NN=C2N Z1203581749 [0,2,0,0,0,0|2,0,0]=4 1284 B12R2.132 NC1=CC2=C(C=C1)NN=C2O Z1198174712 [0,2,0,0,0,0|2,0,0]=4 1285 B12R2.132 NC1=CNC2=C1C=C(C=C2)Cl Z3397208193 [0,2,0,0,0,0|1,0,0]=3 1286 B12R2.132 NC1=CNC2=C1C=C(C=C2)F Z4946628390 [0,2,0,0,0,0|1,0,0]=3 1287 B12R2.132 NC1=NNC2=C1C=C(C=C2)Br Z1203159770 [0,2,0,0,0,0|2,0,0]=4 1288 B12R2.132 NC1=NNC2=C1C=C(C=C2)Cl Z1198173226 [0,2,0,0,0,0|2,0,0]=4 1289 B12R2.132 NC1=NNC2=C1C=C(C=C2)F Z1095219060 [0,2,0,0,0,0|2,0,0]=4 1290 B12R2.132 NC1=NOC2=C1C=C(C=C2)Br Z1269129668 [0,2,0,0,0,0|1,0,0]=3 1291 B12R2.132 NC1=NOC2=C1C=C(C=C2)Cl Z1255458428 [0,2,0,0,0,0|1,0,0]=3 1292 B12R2.132 NC1=NOC2=C1C=C(C=C2)F Z1255462148 [0,2,0,0,0,0|1,0,0]=3 1293 B12R2.132 NC1=NSC2=C1C=C(C=C2)Br Z1269208321 [0,2,0,0,0,0|1,1,0]=4 1294 B12R2.132 NC1COC2=C1C=C(C=C2)Br Z3241275758 [0,2,0,0,0,0|0,0,2]=4 1295 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [0,2,0,0,0,0|0,0,2]=4 1296 B12R2.132 NC1COC2=C1C=C(C=C2)F Z1698549696 [0,2,0,0,0,0|0,0,2]=4 1297 B12R2.132 O=C1CCC2=C1C=C(C=C2)F Z814904728 [0,2,0,0,0,0|1,0,1]=4 1298 B12R2.132 O=C1CCC2=C1C=C(C=C2)I Z1269230336 [0,2,0,0,0,0|1,0,1]=4 1299 B12R2.132 O=C1COC2=C1C=C(C=C2)Cl Z334863058 [0,2,0,0,0,0|0,0,1]=3 1300 B12R2.132 O=C1COC2=C1C=C(C=C2)F Z334863052 [0,2,0,0,0,0|0,0,1]=3 1301 B12R2.132 O=C1NCC2=C1C=C(C=C2)Br Z1269144955 [0,2,0,0,0,0|2,0,0]=4 1302 B12R2.132 O=C1NCC2=C1C=C(C=C2)Cl Z1198176504 [0,2,0,0,0,0|2,0,0]=4 1303 B12R2.132 O=C1NCC2=C1C=C(C=C2)F Z1198221016 [0,2,0,0,0,0|2,0,0]=4 1304 B12R2.132 O=C1NCC2=C1C=C(C=C2)I Z1269110301 [0,2,0,0,0,0|2,0,0]=4 1305 B12R2.132 O=C1NCC2=C1C=C(C=C2)O Z1198177071 [0,2,0,0,0,0|2,0,0]=4 1306 B12R2.132 O=C1OCC2=C1C=C(C=C2)Br Z1258932820 [0,2,0,0,0,0|2,0,0]=4 1307 B12R2.132 O=C1OCC2=C1C=C(C=C2)F Z1198309551 [0,2,0,0,0,0|2,0,0]=4 1308 B12R2.132 O=C1OCC2=C1C=C(C=C2)O Z1198181162 [0,2,0,0,0,0|2,0,0]=4 1309 B12R2.132 OC1=CC2=C(C=C1)OC=C2O Z1216838816 [0,2,0,0,0,0|0,0,0]=2 1310 B12R2.132 OC1=CC2=C(C=C1)SC=C2Br Z1269146168 [0,2,0,0,0,0|0,1,0]=3 1311 B12R2.132 OC1=NNC2=C1C=C(C=C2)Br Z1269130677 [0,2,0,0,0,0|2,0,0]=4 1312 B12R2.132 OC1=NOC2=C1C=C(C=C2)Cl Z1201619168 [0,2,0,0,0,0|1,0,0]=3 1313 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 Z334686316 [0,2,0,0,0,0|1,0,1]=4 1314 B12R2.196 CC1=C2NN=C(C2=CC=C1)N Z1198235844 [0,2,0,0,0,0|2,0,0]=4 1315 B12R2.196 CC1=CC=CC2=C(C=NN12)Br Z1486028385 [0,2,0,0,0,0|2,0,0]=4 1316 B12R2.196 CC1=CSC2=C1C=CC=C2Br Z1269175775 [0,2,0,0,0,0|0,1,0]=3 1317 B12R2.196 CC1=CSC2=C1C=CC=C2N Z4952832526 [0,2,0,0,0,0|0,1,0]=3 1318 B12R2.196 CC1=NNC2=C1C=CC=C2F Z1255385841 [0,2,0,0,0,0|2,0,0]=4 1319 B12R2.196 CN1C=NC2=C1C=CC=C2Br Z1269128357 [0,2,0,0,0,0|2,0,0]=4 1320 B12R2.196 CN1C=NC2=C1C=CC=C2N Z1203580579 [0,2,0,0,0,0|2,0,0]=4 1321 B12R2.196 CN1C=NC2=C1C=CC=C2O Z1824511324 [0,2,0,0,0,0|2,0,0]=4 1322 B12R2.196 ClC1=C2NC=C(C2=CC=C1)Br Z1269127355 [0,2,0,0,0,0|1,0,0]=3 1323 B12R2.196 FC1=C2SC=C(C2=CC=C1)Br Z3244825551 [0,2,0,0,0,0|0,1,0]=3 1324 B12R2.196 NC1=C2C=CC=C(C2=NN1)Cl Z1474025932 [0,2,0,0,0,0|2,0,0]=4 1325 B12R2.196 NC1=C2C=CC=C(C2=NS1)Br Z4199101871 [0,2,0,0,0,0|2,0,0]=4 1326 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 Z5097408049 [0,2,0,0,0,0|1,0,1]=4 1327 B12R2.196 NC1=C2CNC(=O)C2=CC=C1 Z1198176565 [0,2,0,0,0,0|2,0,0]=4 1328 B12R2.196 NC1=C2COC(=O)C2=CC=C1 Z1198164599 [0,2,0,0,0,0|2,0,0]=4 1329 B12R2.196 NC1=CN=C2N1C=CC=C2Br Z5976226712 [0,2,0,0,0,0|2,0,0]=4 1330 B12R2.196 NC1=NNC2=C1C=CC=C2Br Z1269197206 [0,2,0,0,0,0|2,0,0]=4 1331 B12R2.196 NC1=NSC2=C1C=CC=C2Br Z3481422925 [0,2,0,0,0,0|1,1,0]=4 1332 B12R2.196 NC1COC2=C(C=CC=C12)Cl Z1416282556 [0,2,0,0,0,0|0,0,2]=4 1333 B12R2.196 NC1COC2=C(C=CC=C12)F Z4574897577 [0,2,0,0,0,0|0,0,2]=4 1334 B12R2.196 O=C1CCC2=C(C=CC=C12)Br Z334686326 [0,2,0,0,0,0|1,0,1]=4 1335 B12R2.196 O=C1CCC2=C(C=CC=C12)Cl Z234895081 [0,2,0,0,0,0|1,0,1]=4 1336 B12R2.196 O=C1CCC2=C(C=CC=C12)F Z334686322 [0,2,0,0,0,0|1,0,1]=4 1337 B12R2.196 O=C1CCC2=C(C=CC=C12)O Z203881856 [0,2,0,0,0,0|1,0,1]=4 1338 B12R2.196 O=C1COC2=C(C=CC=C12)Br Z334863098 [0,2,0,0,0,0|0,0,1]=3 1339 B12R2.196 O=C1COC2=C(C=CC=C12)Cl Z334863094 [0,2,0,0,0,0|0,0,1]=3 1340 B12R2.196 O=C1NCC2=C(C=CC=C12)Br Z1258930120 [0,2,0,0,0,0|2,0,0]=4 1341 B12R2.196 O=C1NCC2=C(C=CC=C12)Cl Z1198221042 [0,2,0,0,0,0|2,0,0]=4 1342 B12R2.196 O=C1NCC2=C(C=CC=C12)F Z1255380598 [0,2,0,0,0,0|2,0,0]=4 1343 B12R2.196 O=C1NCC2=C(C=CC=C12)O Z1741980680 [0,2,0,0,0,0|2,0,0]=4 1344 B12R2.196 OC1=C2SC=C(C2=CC=N1)Br Z2719319246 [0,2,0,0,0,0|1,1,0]=4 1345 B12R2.196 OC1=NNC2=C1C=CC=C2Br Z2757551695 [0,2,0,0,0,0|2,0,0]=4 1346 B12R2.203 BrC1=C2C(=CNC2=CN=C1)I Z1269241362 [0,2,0,0,0,0|2,0,0]=4 1347 B12R2.203 BrC1=CC=CC2=C1C(=CS2)Br Z3300762315 [0,2,0,0,0,0|0,1,0]=3 1348 B12R2.203 CC1=C2C(=CC=C1)ON=C2N Z1203653600 [0,2,0,0,0,0|1,0,0]=3 1349 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 Z1255399735 [0,2,0,0,0,0|1,0,1]=4 1350 B12R2.203 CC1=CC=CN2C1=C(C=N2)Br Z1504682951 [0,2,0,0,0,0|2,0,0]=4 1351 B12R2.203 CC1=CNC2=C1C(=CC=N2)Cl Z2900189148 [0,2,0,0,0,0|2,0,0]=4 1352 B12R2.203 CC1=CSC2=C1C(=CC=C2)Br Z1862000479 [0,2,0,0,0,0|0,1,0]=3 1353 B12R2.203 CN1C=CC2=C1C(=CC=C2)N Z1203585452 [0,2,0,0,0,0|1,0,0]=3 1354 B12R2.203 CN1C=CC2=C1C(=NC=C2)Cl Z1258976743 [0,2,0,0,0,0|2,0,0]=4 1355 B12R2.203 CN1C=CC2=C1C(=O)NC=C2 Z1170358515 [0,2,0,0,0,0|2,0,0]=4 1356 B12R2.203 CN1N=CC2=C1C(=CC=C2)Br Z1269228508 [0,2,0,0,0,0|2,0,0]=4 1357 B12R2.203 CN1N=CC2=C1C(=CC=C2)N Z1201625303 [0,2,0,0,0,0|2,0,0]=4 1358 B12R2.203 FC1=C2C(=CNC2=CC=C1)Br Z1544675659 [0,2,0,0,0,0|1,0,0]=3 1359 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 Z234893819 [0,2,0,0,0,0|2,0,0]=4 1360 B12R2.203 NC1=NNC2=C1C(=CC=C2)Br Z1269220695 [0,2,0,0,0,0|2,0,0]=4 1361 B12R2.203 NC1=NNC2=C1C(=CC=C2)F Z381676076 [0,2,0,0,0,0|2,0,0]=4 1362 B12R2.203 NC1=NNC2=C1C(=CC=C2)I Z1269133602 [0,2,0,0,0,0|2,0,0]=4 1363 B12R2.203 NC1=NOC2=C1C(=CC=C2)Cl Z381676070 [0,2,0,0,0,0|1,0,0]=3 1364 B12R2.203 NC1COC2=C1C(=CC=C2)Cl Z2111525790 [0,2,0,0,0,0|0,0,2]=4 1365 B12R2.203 O=C1CCC2=CC=CC(=C12)F Z1201624056 [0,2,0,0,0,0|1,0,1]=4 1366 B12R2.203 O=C1CCC2=CC=CC(=C12)O Z1255416018 [0,2,0,0,0,0|1,0,1]=4 1367 B12R2.203 O=C1COC2=CC=CC(=C12)Cl Z1255379841 [0,2,0,0,0,0|0,0,1]=3 1368 B12R2.203 O=C1COC2=CC=CC(=C12)F Z1198342984 [0,2,0,0,0,0|0,0,1]=3 1369 B12R2.203 O=C1NCC2=CC=CC(=C12)Br Z1269173290 [0,2,0,0,0,0|2,0,0]=4 1370 B12R2.203 O=C1NCC2=CC=CC(=C12)Cl Z1198221040 [0,2,0,0,0,0|2,0,0]=4 1371 B12R2.203 O=C1NCC2=CC=CC(=C12)O Z1203833101 [0,2,0,0,0,0|2,0,0]=4 1372 B12R2.203 O=C1NNC2=CC=CC(=C12)Br Z1269126740 [0,2,0,0,0,0|2,0,0]=4 1373 B12R2.203 O=C1NNC2=CC=CC(=C12)Cl Z1098880205 [0,2,0,0,0,0|2,0,0]=4 1374 B12R2.203 O=C1NSC2=CC=CC(=C12)Br Z3002992543 [0,2,0,0,0,0|1,1,0]=4 1375 B12R2.203 OC1=C2C(=CSC2=CC=C1)Br Z1862026502 [0,2,0,0,0,0|0,1,0]=3 1376 B12R2.203 OC1=C2C(=CSC2=CC=N1)Br Z1269169886 [0,2,0,0,0,0|1,1,0]=4 1377 B12R2.612 CC1=CC2=C(C=C1)C(=CN2)C Z1203732482 [0,2,0,0,0,0|1,0,0]=3 1378 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 Z318770612 [0,2,0,0,0,0|1,0,1]=4 1379 B12R2.612 CC1=CC2=C(C=C1)C(=O)CO2 Z1255397223 [0,2,0,0,0,0|0,0,1]=3 1380 B12R2.612 CC1=CC2=C(C=C1)C(=O)CS2 Z1255404471 [0,2,0,0,0,0|0,1,1]=4 1381 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 Z1198184833 [0,2,0,0,0,0|2,0,0]=4 1382 B12R2.612 CC1=CN=C2N1C=CC(=C2)N Z4297106667 [0,2,0,0,0,0|2,0,0]=4 1383 B12R2.612 CC1=CNC2=C1C=CC(=C2)Cl Z1255439930 [0,2,0,0,0,0|1,0,0]=3 1384 B12R2.612 CC1=CNC2=C1C=CC(=C2)O Z1203731448 [0,2,0,0,0,0|1,0,0]=3 1385 B12R2.612 CC1=CSC2=C1N=CC(=C2)Br Z4633825755 [0,2,0,0,0,0|1,1,0]=4 1386 B12R2.612 CC1=NC2=C(C=C1)C(=NO2)N Z1198339770 [0,2,0,0,0,0|2,0,0]=4 1387 B12R2.612 CC1=NNC2=C1C=CC(=C2)Br Z1269153561 [0,2,0,0,0,0|2,0,0]=4 1388 B12R2.612 CC1=NNC2=C1C=CC(=C2)I Z1269153698 [0,2,0,0,0,0|2,0,0]=4 1389 B12R2.612 CC1=NNC2=C1C=CC(=C2)N Z1198280276 [0,2,0,0,0,0|2,0,0]=4 1390 B12R2.612 CC1=NOC2=C1C=CC(=C2)Br Z765350404 [0,2,0,0,0,0|1,0,0]=3 1391 B12R2.612 CC1=NSC2=C1C=CC(=C2)Br Z2733281973 [0,2,0,0,0,0|1,1,0]=4 1392 B12R2.612 CN1C=CC2=C1C=CC(=C2)Br Z274764436 [0,2,0,0,0,0|1,0,0]=3 1393 B12R2.612 CN1C=CC2=C1C=CC(=C2)N Z385461802 [0,2,0,0,0,0|1,0,0]=3 1394 B12R2.612 CN1C=CC2=C1N=CC(=C2)Br Z1269215836 [0,2,0,0,0,0|2,0,0]=4 1395 B12R2.612 CN1C=NC2=C1C=CC(=C2)Br Z1269186274 [0,2,0,0,0,0|2,0,0]=4 1396 B12R2.612 CN1C=NC2=C1C=CC(=C2)F Z1255464709 [0,2,0,0,0,0|2,0,0]=4 1397 B12R2.612 CN1C=NC2=C1C=CC(=C2)N Z57290792 [0,2,0,0,0,0|2,0,0]=4 1398 B12R2.612 CN1C=NC2=C1C=CC(=C2)O Z275242686 [0,2,0,0,0,0|2,0,0]=4 1399 B12R2.612 CN1N=CC2=C1C=CC(=C2)Br Z1269209773 [0,2,0,0,0,0|2,0,0]=4 1400 B12R2.612 CN1N=CC2=C1C=CC(=C2)N Z1201622162 [0,2,0,0,0,0|2,0,0]=4 1401 B12R2.612 ClC1=CC2=C(C=C1)C(=CN2)I Z1269185626 [0,2,0,0,0,0|1,0,0]=3 1402 B12R2.612 ClC1=CNC2=C1N=CC(=C2)Br Z1269216808 [0,2,0,0,0,0|2,0,0]=4 1403 B12R2.612 N=C1C=CC2=C(NNC2=C1)N Z1350606408 [0,2,0,0,0,0|2,0,0]=4 1404 B12R2.612 NC1=C2C=CC(=CC2=NN1)O Z2197092363 [0,2,0,0,0,0|2,0,0]=4 1405 B12R2.612 NC1=CC2=C(C=C1)C(=CS2)Cl Z4135016645 [0,2,0,0,0,0|0,1,0]=3 1406 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 Z57109500 [0,2,0,0,0,0|1,0,1]=4 1407 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 Z1198272534 [0,2,0,0,0,0|2,0,0]=4 1408 B12R2.612 NC1=CC2=C(C=C1)C(=O)NS2 Z1262664713 [0,2,0,0,0,0|1,1,0]=4 1409 B12R2.612 NC1=CN=C2N1C=CC(=C2)Br Z3477944362 [0,2,0,0,0,0|2,0,0]=4 1410 B12R2.612 NC1=NNC2=C1C=CC(=C2)F Z1198169924 [0,2,0,0,0,0|2,0,0]=4 1411 B12R2.612 NC1=NOC2=C1C=CC(=C2)Br Z1269208232 [0,2,0,0,0,0|1,0,0]=3 1412 B12R2.612 NC1=NOC2=C1C=CC(=C2)Cl Z1255490361 [0,2,0,0,0,0|1,0,0]=3 1413 B12R2.612 NC1COC2=C1C=CC(=C2)Br Z1269171640 [0,2,0,0,0,0|0,0,2]=4 1414 B12R2.612 NC1COC2=C1C=CC(=C2)Cl Z3244818242 [0,2,0,0,0,0|0,0,2]=4 1415 B12R2.612 NC1COC2=C1C=CC(=C2)F Z3014279399 [0,2,0,0,0,0|0,0,2]=4 1416 B12R2.612 O=C1CCC2=C1C=CC(=C2)Br Z318770638 [0,2,0,0,0,0|1,0,1]=4 1417 B12R2.612 O=C1CCC2=C1C=CC(=C2)Cl Z318770634 [0,2,0,0,0,0|1,0,1]=4 1418 B12R2.612 O=C1CCC2=C1C=CC(=C2)F Z318770630 [0,2,0,0,0,0|1,0,1]=4 1419 B12R2.612 O=C1CCC2=C1C=CC(=C2)O Z1255457932 [0,2,0,0,0,0|1,0,1]=4 1420 B12R2.612 O=C1COC2=C1C=CC(=C2)Br Z1269152090 [0,2,0,0,0,0|0,0,1]=3 1421 B12R2.612 O=C1COC2=C1C=CC(=C2)Cl Z1198169822 [0,2,0,0,0,0|0,0,1]=3 1422 B12R2.612 O=C1COC2=C1C=CC(=C2)F Z1198221984 [0,2,0,0,0,0|0,0,1]=3 1423 B12R2.612 O=C1COC2=C1C=CC(=C2)O Z111875098 [0,2,0,0,0,0|0,0,1]=3 1424 B12R2.612 O=C1NCC2=C1C=CC(=C2)Br Z1269136562 [0,2,0,0,0,0|2,0,0]=4 1425 B12R2.612 O=C1NCC2=C1C=CC(=C2)Cl Z1198176501 [0,2,0,0,0,0|2,0,0]=4 1426 B12R2.612 O=C1NCC2=C1C=CC(=C2)F Z1255503451 [0,2,0,0,0,0|2,0,0]=4 1427 B12R2.612 O=C1NCC2=C1C=CC(=C2)O Z1198272536 [0,2,0,0,0,0|2,0,0]=4 1428 B12R2.612 O=C1NSC2=C1C=CC(=C2)Cl Z1198155415 [0,2,0,0,0,0|1,1,0]=4 1429 B12R2.612 O=C1OCC2=C1C=CC(=C2)Cl Z1198234542 [0,2,0,0,0,0|2,0,0]=4 1430 B12R2.612 O=C1OCC2=C1C=CC(=C2)F Z1198234543 [0,2,0,0,0,0|2,0,0]=4 1431 B12R2.612 O=C1OCC2=C1C=CC(=C2)O Z1198162647 [0,2,0,0,0,0|2,0,0]=4 1432 B12R2.612 OC1=CSC2=C1C=CC(=C2)Br Z3300768645 [0,2,0,0,0,0|0,1,0]=3 1433 B12R2.612 OC1=NNC2=C1C=CC(=C2)F Z1198174696 [0,2,0,0,0,0|2,0,0]=4 1434 B12R2.612 OC1=NSC2=C1C=CC(=C2)Br Z1681372035 [0,2,0,0,0,0|1,1,0]=4 1435 B12R2.612 OC1COC2=C1C=CC(=C2)Br Z1362940613 [0,2,0,0,0,0|0,0,2]=4 1436 B12R2.612 OC1COC2=C1C=CC(=C2)Cl Z1362956560 [0,2,0,0,0,0|0,0,2]=4 1437 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 Z335243948 [0,2,0,0,0,0|1,0,1]=4 1438 B12R2.2028 CN1C=C(C2=C1C=CC=C2)N Z2787455551 [0,2,0,0,0,0|1,0,0]=3 1439 B12R2.2028 CN1C=C(C2=C1C=CN=C2)Br Z1416166399 [0,2,0,0,0,0|2,0,0]=4 1440 B12R2.2028 CN1NC(=O)C2=C1C=CC=C2 Z1255452290 [0,2,0,0,0,0|2,0,0]=4 1441 B12R2.2028 NC1=NC(=O)C2=C1C=CC=C2 Z316121514 [0,2,0,0,0,0|2,0,0]=4 1442 B12R2.2028 O=C1CC(=O)C2=C1C=CC=C2 Z57131040 [0,2,0,0,0,0|1,0,1]=4 1443 B12R2.2028 O=C1NC(=O)C2=C1C=CC=C2 Z57127356 [0,2,0,0,0,0|2,0,0]=4 1444 B12R2.2028 O=C1OC(C2=C1C=CC=C2)O Z104507040 [0,2,0,0,0,0|2,0,0]=4 1445 B12R2.2403 CC1(COC2=C1C=CC=C2)N Z5094222723 [0,2,0,0,0,0|0,0,2]=4 1446 B12R2.2403 O=S1(=O)C=CC2=C1C=CC=C2 Z425439028 [0,2,0,0,0,0|0,1,0]=3 1447 B12R2.32 CCC1=NC2=C(N1)C=CC=C2 Z55692907 [0,2,0,0,0,0|2,0,0]=4 1448 B12R2.32 CNC1=NC2=C(N1)C=CC=C2 Z56767838 [0,2,0,0,0,0|2,0,0]=4 1449 B12R2.32 CNC1=NC2=C(O1)C=CC=C2 Z235341203 [0,2,0,0,0,0|1,0,0]=3 1450 B12R2.32 CNC1=NC2=C(S1)C=CC=C2 Z235344695 [0,2,0,0,0,0|1,1,0]=4 1451 B12R2.32 CSC1=NC2=C(N1)C=CC=C2 Z53833331 [0,2,0,0,0,0|2,0,0]=4 1452 B12R2.32 CSC1=NC2=C(O1)C=CC=N2 Z1157710337 [0,2,0,0,0,0|2,0,0]=4 1453 B12R2.32 CSC1=NC2=C(O1)C=CN=C2 Z1157710338 [0,2,0,0,0,0|2,0,0]=4 1454 B12R2.32 ClCC1=CN2C=CC=CC2=N1 Z90661818 [0,2,0,0,0,0|2,0,0]=4 1455 B12R2.32 ClCC1=NC2=C(N1)C=CC=C2 Z56943426 [0,2,0,0,0,0|2,0,0]=4 1456 B12R2.32 ClCC1CC2=C(O1)C=CC=C2 Z397587656 [0,2,0,0,0,0|0,0,2]=4 1457 B12R2.32 N#CC1=CC2=C(N1)C=CC=C2 Z1255419551 [0,2,0,0,0,0|1,0,0]=3 1458 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [0,2,0,0,0,0|0,0,0]=2 1459 B12R2.32 N#CC1=CN2C=CC=CC2=C1 Z1203730717 [0,2,0,0,0,0|2,0,0]=4 1460 B12R2.32 N#CC1=NC2=C(O1)C=CC=C2 Z1198309541 [0,2,0,0,0,0|1,0,0]=3 1461 B12R2.32 NCC1=CC2=C(N1)C=CC=C2 Z2106601624 [0,2,0,0,0,0|1,0,0]=3 1462 B12R2.32 NCC1=CC2=C(N1)C=CN=C2 Z2830496387 [0,2,0,0,0,0|2,0,0]=4 1463 B12R2.32 NCC1=CC2=C(N1)N=CC=C2 Z2310722918 [0,2,0,0,0,0|2,0,0]=4 1464 B12R2.32 NCC1=CC2=C(O1)C=CN=C2 Z2740369894 [0,2,0,0,0,0|1,0,0]=3 1465 B12R2.32 NCC1=CC2=C(S1)C=CC=C2 Z57206121 [0,2,0,0,0,0|0,1,0]=3 1466 B12R2.32 NCC1=CC2=C(S1)C=CC=N2 Z3716577874 [0,2,0,0,0,0|1,1,0]=4 1467 B12R2.32 NCC1=CN2C=CC=CC2=N1 Z90668419 [0,2,0,0,0,0|2,0,0]=4 1468 B12R2.32 NCC1=NC2=C(N1)C=CC=C2 Z104479710 [0,2,0,0,0,0|2,0,0]=4 1469 B12R2.32 NCC1=NC2=C(O1)C=CC=C2 Z2106602610 [0,2,0,0,0,0|1,0,0]=3 1470 B12R2.32 NCC1=NC2=C(S1)C=CC=C2 Z166630948 [0,2,0,0,0,0|1,1,0]=4 1471 B12R2.32 NCC1CC2=C(O1)C=CC=C2 Z291234246 [0,2,0,0,0,0|0,0,2]=4 1472 B12R2.32 NNC1=NC2=C(N1)C=CC=C2 Z57087494 [0,2,0,0,0,0|2,0,0]=4 1473 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [0,2,0,0,0,0|1,0,0]=3 1474 B12R2.32 NNC1=NC2=C(S1)C=CC=C2 Z56756340 [0,2,0,0,0,0|1,1,0]=4 1475 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [0,2,0,0,0,0|1,0,0]=3 1476 B12R2.32 O=CC1=CC2=C(N1)C=CC=N2 Z1198177421 [0,2,0,0,0,0|2,0,0]=4 1477 B12R2.32 O=CC1=CC2=C(N1)C=CN=C2 Z3305262316 [0,2,0,0,0,0|2,0,0]=4 1478 B12R2.32 O=CC1=CC2=C(N1)N=CC=C2 Z1198177420 [0,2,0,0,0,0|2,0,0]=4 1479 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [0,2,0,0,0,0|0,0,0]=2 1480 B12R2.32 O=CC1=CC2=C(O1)C=CC=N2 Z1198330026 [0,2,0,0,0,0|1,0,0]=3 1481 B12R2.32 O=CC1=CC2=C(O1)C=CN=C2 Z1255417643 [0,2,0,0,0,0|1,0,0]=3 1482 B12R2.32 O=CC1=CC2=C(O1)N=CC=C2 Z1255505540 [0,2,0,0,0,0|1,0,0]=3 1483 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [0,2,0,0,0,0|0,1,0]=3 1484 B12R2.32 O=CC1=CC2=C(S1)C=CC=N2 Z1216823029 [0,2,0,0,0,0|1,1,0]=4 1485 B12R2.32 O=CC1=CC2=C(S1)C=NC=C2 Z1198309374 [0,2,0,0,0,0|1,1,0]=4 1486 B12R2.32 O=CC1=CC2=C(S1)N=CC=C2 Z1160905957 [0,2,0,0,0,0|1,1,0]=4 1487 B12R2.32 O=CC1=CN2C=CC=CC2=N1 Z622445034 [0,2,0,0,0,0|2,0,0]=4 1488 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [0,2,0,0,0,0|2,0,0]=4 1489 B12R2.32 O=CC1=NC2=C(O1)C=CC=C2 Z1198162173 [0,2,0,0,0,0|1,0,0]=3 1490 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [0,2,0,0,0,0|1,1,0]=4 1491 B12R2.32 O=CC1=NN2C=CC=CC2=C1 Z1171753365 [0,2,0,0,0,0|2,0,0]=4 1492 B12R2.32 OCC1=CC2=C(N1)C=CC=N2 Z1255398720 [0,2,0,0,0,0|2,0,0]=4 1493 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [0,2,0,0,0,0|0,0,0]=2 1494 B12R2.32 OCC1=CC2=C(O1)C=CN=C2 Z1255452234 [0,2,0,0,0,0|1,0,0]=3 1495 B12R2.32 OCC1=CC2=C(S1)C=CC=C2 Z816841922 [0,2,0,0,0,0|0,1,0]=3 1496 B12R2.32 OCC1=CC2=C(S1)C=CC=N2 Z1216823027 [0,2,0,0,0,0|1,1,0]=4 1497 B12R2.32 OCC1=CC2=C(S1)C=NC=C2 Z1198727572 [0,2,0,0,0,0|1,1,0]=4 1498 B12R2.32 OCC1=CN2C=CC=CC2=N1 Z228586390 [0,2,0,0,0,0|2,0,0]=4 1499 B12R2.32 OCC1=NC2=C(N1)C=CC=C2 Z56791635 [0,2,0,0,0,0|2,0,0]=4 1500 B12R2.32 OCC1=NC2=C(O1)C=CC=C2 Z431953250 [0,2,0,0,0,0|1,0,0]=3 1501 B12R2.32 OCC1=NC2=C(S1)C=CC=C2 Z56899191 [0,2,0,0,0,0|1,1,0]=4 1502 B12R2.32 OCC1=NN2C=CC=CC2=C1 Z3464516042 [0,2,0,0,0,0|2,0,0]=4 1503 B12R2.32 OCC1CC2=C(O1)C=CC=C2 Z397587206 [0,2,0,0,0,0|0,0,2]=4 1504 B12R2.95 CC1(OC2=C(O1)C=CC=C2)C Z1255424302 [0,2,0,0,0,0|1,0,1]=4 1505 B12R2.202 BrC1=C2C=C(SC2=CC=C1)I Z3073514295 [0,2,0,0,0,0|0,1,0]=3 1506 B12R2.202 BrC1=CC2=C(S1)C=CC=C2Br Z4063649916 [0,2,0,0,0,0|0,1,0]=3 1507 B12R2.202 CC1=C2N=C(NC2=CC=C1)N Z995046466 [0,2,0,0,0,0|2,0,0]=4 1508 B12R2.202 CC1=C2N=C(NC2=CC=C1)S Z596250516 [0,2,0,0,0,0|2,0,0]=4 1509 B12R2.202 CC1=C2N=C(SC2=CC=C1)N Z56174289 [0,2,0,0,0,0|1,1,0]=4 1510 B12R2.202 CC1=C2N=C(SC2=CC=C1)O Z1198163380 [0,2,0,0,0,0|1,1,0]=4 1511 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [0,2,0,0,0,0|1,0,1]=4 1512 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [0,2,0,0,0,0|2,0,0]=4 1513 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [0,2,0,0,0,0|1,0,0]=3 1514 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [0,2,0,0,0,0|1,0,0]=3 1515 B12R2.202 CC1=C2SC(=NC2=CC=C1)N Z1262621975 [0,2,0,0,0,0|1,1,0]=4 1516 B12R2.202 CC1=C2SC(=O)NC2=CC=C1 Z1198222422 [0,2,0,0,0,0|1,1,0]=4 1517 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)C Z1198147838 [0,2,0,0,0,0|1,0,0]=3 1518 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)Cl Z1198221008 [0,2,0,0,0,0|1,0,0]=3 1519 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)F Z1255418917 [0,2,0,0,0,0|1,0,0]=3 1520 B12R2.202 CC1=CC2=C(O1)C(=CC=C2)Br Z1269204422 [0,2,0,0,0,0|0,0,0]=2 1521 B12R2.202 CC1=CC2=C(O1)C=CNC2=O Z3219924807 [0,2,0,0,0,0|1,0,0]=3 1522 B12R2.202 CC1=CC2=C(S1)C(=CC=C2)Br Z1269210790 [0,2,0,0,0,0|0,1,0]=3 1523 B12R2.202 CC1=CN2C=CC=C(C2=N1)Br Z1269194651 [0,2,0,0,0,0|2,0,0]=4 1524 B12R2.202 CC1=CN2C=CC=C(C2=N1)C Z5590161347 [0,2,0,0,0,0|2,0,0]=4 1525 B12R2.202 CC1=NC2=C(N1)C=CC=C2Br Z1269227518 [0,2,0,0,0,0|2,0,0]=4 1526 B12R2.202 CC1=NC2=C(O1)C=CC=C2N Z1201624543 [0,2,0,0,0,0|1,0,0]=3 1527 B12R2.202 CC1CC2=C(O1)C(=CC=C2)Cl Z803153168 [0,2,0,0,0,0|0,0,2]=4 1528 B12R2.202 CN1C=C2C=CC=C(C2=N1)N Z5028578288 [0,2,0,0,0,0|2,0,0]=4 1529 B12R2.202 FC1=C2N=C(OC2=CC=C1)S Z1869902596 [0,2,0,0,0,0|1,0,0]=3 1530 B12R2.202 FC1=C2SC(=NC2=CC=C1)S Z1255424549 [0,2,0,0,0,0|1,1,0]=4 1531 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [0,2,0,0,0,0|1,0,1]=4 1532 B12R2.202 NC1=C2NC(=O)NC2=CC=C1 Z1741972722 [0,2,0,0,0,0|2,0,0]=4 1533 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [0,2,0,0,0,0|1,0,0]=3 1534 B12R2.202 NC1=CC2=C(N1)C(=CC=C2)Br Z4503522928 [0,2,0,0,0,0|1,0,0]=3 1535 B12R2.202 NC1=CC2=C(N1)C=CC=C2Br Z4503522930 [0,2,0,0,0,0|1,0,0]=3 1536 B12R2.202 NC1=CC=CC2=C1NC(=N2)N Z1263620937 [0,2,0,0,0,0|2,0,0]=4 1537 B12R2.202 NC1=NC2=C(N1)C=CC=C2Br Z1269129228 [0,2,0,0,0,0|2,0,0]=4 1538 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [0,2,0,0,0,0|1,0,0]=3 1539 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [0,2,0,0,0,0|1,0,0]=3 1540 B12R2.202 NC1=NC2=C(S1)C(=CC=C2)Br Z1269131394 [0,2,0,0,0,0|1,1,0]=4 1541 B12R2.202 NC1=NC2=C(S1)C=CC=C2Br Z2092369020 [0,2,0,0,0,0|1,1,0]=4 1542 B12R2.202 NC1=NC2=C(S1)C=CC=C2Cl Z57607000 [0,2,0,0,0,0|1,1,0]=4 1543 B12R2.202 NC1=NN2C=CC=C(C2=C1)Br Z1618107118 [0,2,0,0,0,0|2,0,0]=4 1544 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [0,2,0,0,0,0|1,0,1]=4 1545 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [0,2,0,0,0,0|1,0,1]=4 1546 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [0,2,0,0,0,0|1,0,1]=4 1547 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [0,2,0,0,0,0|0,0,1]=3 1548 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [0,2,0,0,0,0|1,0,0]=3 1549 B12R2.202 O=C1NC2=CC=CC(=C2N1)Br Z1269197007 [0,2,0,0,0,0|2,0,0]=4 1550 B12R2.202 O=C1NC2=CC=CC(=C2N1)F Z1575308465 [0,2,0,0,0,0|2,0,0]=4 1551 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [0,2,0,0,0,0|2,0,0]=4 1552 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [0,2,0,0,0,0|1,0,0]=3 1553 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [0,2,0,0,0,0|1,0,0]=3 1554 B12R2.202 O=C1NC2=CC=CC(=C2S1)F Z1198222418 [0,2,0,0,0,0|1,1,0]=4 1555 B12R2.202 OC1=C2C=C(SC2=CC=C1)Br Z2582394723 [0,2,0,0,0,0|0,1,0]=3 1556 B12R2.202 OC1=C2C=C(SC2=CC=N1)Br Z1269191983 [0,2,0,0,0,0|1,1,0]=4 1557 B12R2.202 OC1=C2N=C(OC2=CC=C1)S Z3235037659 [0,2,0,0,0,0|1,0,0]=3 1558 B12R2.202 OC1=C2SC(=CC2=CC=N1)Br Z3241734462 [0,2,0,0,0,0|1,1,0]=4 1559 B12R2.202 OC1=CC=CC2=C1N=C(O2)O Z1322795564 [0,2,0,0,0,0|1,0,0]=3 1560 B12R2.202 OC1=NC2=C(N1)C=CC=C2Cl Z1245791555 [0,2,0,0,0,0|2,0,0]=4 1561 B12R2.202 SC1=NC2=C(O1)C(=CC=C2)Cl Z1720684812 [0,2,0,0,0,0|1,0,0]=3 1562 B12R2.202 SC1=NC2=C(S1)C(=CC=C2)Br Z1269230329 [0,2,0,0,0,0|1,1,0]=4 1563 B12R2.202 SC1=NC2=C(S1)C=CC=C2Br Z1269173262 [0,2,0,0,0,0|1,1,0]=4 1564 B12R2.606 CC1=CC2=C(C=C1)N=C(N2)N Z995046368 [0,2,0,0,0,0|2,0,0]=4 1565 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [0,2,0,0,0,0|1,0,0]=3 1566 B12R2.606 CC1=CC2=C(C=C1)N=C(S2)N Z57069881 [0,2,0,0,0,0|1,1,0]=4 1567 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [0,2,0,0,0,0|1,0,1]=4 1568 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)C Z57370047 [0,2,0,0,0,0|2,0,0]=4 1569 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)S Z57298378 [0,2,0,0,0,0|2,0,0]=4 1570 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)S Z56864608 [0,2,0,0,0,0|1,0,0]=3 1571 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [0,2,0,0,0,0|1,0,0]=3 1572 B12R2.606 CC1=CC2=C(C=C1)SC(=N2)S Z1198307587 [0,2,0,0,0,0|1,1,0]=4 1573 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)Br Z1269196919 [0,2,0,0,0,0|1,0,0]=3 1574 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)F Z1201624894 [0,2,0,0,0,0|1,0,0]=3 1575 B12R2.606 CC1=CC2=C(N1)C=C(C=N2)Br Z1269127925 [0,2,0,0,0,0|2,0,0]=4 1576 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)F Z1203162476 [0,2,0,0,0,0|1,0,0]=3 1577 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)N Z361880768 [0,2,0,0,0,0|1,0,0]=3 1578 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [0,2,0,0,0,0|1,0,0]=3 1579 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br Z1269240413 [0,2,0,0,0,0|0,0,0]=2 1580 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)I Z1269130980 [0,2,0,0,0,0|0,0,0]=2 1581 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N Z2106607528 [0,2,0,0,0,0|0,0,0]=2 1582 B12R2.606 CC1=CC2=C(S1)C=C(C=C2)Br Z1322795816 [0,2,0,0,0,0|0,1,0]=3 1583 B12R2.606 CC1=CC2=C(S1)C=CC(=C2)Br Z1269233897 [0,2,0,0,0,0|0,1,0]=3 1584 B12R2.606 CC1=CC2=C(S1)C=CC(=C2)F Z1340419229 [0,2,0,0,0,0|0,1,0]=3 1585 B12R2.606 CC1=CN2C=C(C=CC2=C1)Br Z1813148502 [0,2,0,0,0,0|2,0,0]=4 1586 B12R2.606 CC1=CN2C=C(C=CC2=N1)Br Z82174544 [0,2,0,0,0,0|2,0,0]=4 1587 B12R2.606 CC1=CN2C=C(C=CC2=N1)N Z406361488 [0,2,0,0,0,0|2,0,0]=4 1588 B12R2.606 CC1=CN2C=CC(=CC2=N1)Br Z1269220752 [0,2,0,0,0,0|2,0,0]=4 1589 B12R2.606 CC1=NC2=C(C=C1)OC(=N2)S Z1198309540 [0,2,0,0,0,0|2,0,0]=4 1590 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)Br Z382823070 [0,2,0,0,0,0|2,0,0]=4 1591 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [0,2,0,0,0,0|2,0,0]=4 1592 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N Z235353833 [0,2,0,0,0,0|1,0,0]=3 1593 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,2,0,0,0,0|1,0,0]=3 1594 B12R2.606 CC1=NC2=C(O1)C=C(C=N2)Br Z1269209286 [0,2,0,0,0,0|2,0,0]=4 1595 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Br Z1203159513 [0,2,0,0,0,0|1,0,0]=3 1596 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Cl Z104486454 [0,2,0,0,0,0|1,0,0]=3 1597 B12R2.606 CC1=NC2=C(O1)C=CC(=N2)Br Z1269241013 [0,2,0,0,0,0|2,0,0]=4 1598 B12R2.606 CC1=NC2=C(O1)N=CC(=C2)Br Z1269238277 [0,2,0,0,0,0|2,0,0]=4 1599 B12R2.606 CC1=NC2=C(S1)C=C(C=C2)N Z56896242 [0,2,0,0,0,0|1,1,0]=4 1600 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)Cl Z104493618 [0,2,0,0,0,0|1,1,0]=4 1601 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)N Z2901974823 [0,2,0,0,0,0|1,1,0]=4 1602 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [0,2,0,0,0,0|1,1,0]=4 1603 B12R2.606 CC1=NN2C=C(C=CC2=C1)Br Z4461968756 [0,2,0,0,0,0|2,0,0]=4 1604 B12R2.606 CC1CC2=C(O1)C=CC(=C2)Br Z409451514 [0,2,0,0,0,0|0,0,2]=4 1605 B12R2.606 CC1CC2=C(O1)C=CC(=C2)N Z2888802910 [0,2,0,0,0,0|0,0,2]=4 1606 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,2,0,0,0,0|0,0,2]=4 1607 B12R2.606 CN1C=C2C=C(C=CC2=N1)Br Z1269233669 [0,2,0,0,0,0|2,0,0]=4 1608 B12R2.606 CN1C=C2C=C(C=CC2=N1)O Z1198343475 [0,2,0,0,0,0|2,0,0]=4 1609 B12R2.606 CN1C=C2C=CC(=CC2=N1)N Z3352767151 [0,2,0,0,0,0|2,0,0]=4 1610 B12R2.606 ClC1=CC2=C(C=C1)C=C(S2)Br Z3300737228 [0,2,0,0,0,0|0,1,0]=3 1611 B12R2.606 FC1=CC2=C(C=C1)N=C(O2)S Z1147226283 [0,2,0,0,0,0|1,0,0]=3 1612 B12R2.606 FC1=CC2=C(C=C1)N=C(S2)S Z1201620440 [0,2,0,0,0,0|1,1,0]=4 1613 B12R2.606 FC1=CC2=C(C=C1)SC(=N2)S Z1201621686 [0,2,0,0,0,0|1,1,0]=4 1614 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [0,2,0,0,0,0|1,0,0]=3 1615 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,2,0,0,0,0|1,0,1]=4 1616 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S Z1198180819 [0,2,0,0,0,0|1,0,0]=3 1617 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)Cl Z57160346 [0,2,0,0,0,0|1,1,0]=4 1618 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)N Z2289761601 [0,2,0,0,0,0|1,1,0]=4 1619 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [0,2,0,0,0,0|1,0,1]=4 1620 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 Z56793257 [0,2,0,0,0,0|2,0,0]=4 1621 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 Z1270210776 [0,2,0,0,0,0|1,1,0]=4 1622 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [0,2,0,0,0,0|1,0,0]=3 1623 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)S Z1255404077 [0,2,0,0,0,0|1,1,0]=4 1624 B12R2.606 NC1=CN2C=C(C=CC2=N1)Br Z1269161620 [0,2,0,0,0,0|2,0,0]=4 1625 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br Z1270207960 [0,2,0,0,0,0|2,0,0]=4 1626 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl Z995046354 [0,2,0,0,0,0|2,0,0]=4 1627 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)I Z1269176820 [0,2,0,0,0,0|2,0,0]=4 1628 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [0,2,0,0,0,0|1,0,0]=3 1629 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [0,2,0,0,0,0|1,0,0]=3 1630 B12R2.606 NC1=NC2=C(O1)C=C(C=N2)Br Z2733008466 [0,2,0,0,0,0|2,0,0]=4 1631 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [0,2,0,0,0,0|1,0,0]=3 1632 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [0,2,0,0,0,0|1,0,0]=3 1633 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [0,2,0,0,0,0|1,0,0]=3 1634 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Br Z56858257 [0,2,0,0,0,0|1,1,0]=4 1635 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Cl Z56896352 [0,2,0,0,0,0|1,1,0]=4 1636 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)F Z56899125 [0,2,0,0,0,0|1,1,0]=4 1637 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)I Z1741785969 [0,2,0,0,0,0|1,1,0]=4 1638 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)Cl Z228584306 [0,2,0,0,0,0|1,1,0]=4 1639 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)O Z1198155943 [0,2,0,0,0,0|1,1,0]=4 1640 B12R2.606 O=C1C=C2C=CC(=CN2N1)Br Z2158595246 [0,2,0,0,0,0|2,0,0]=4 1641 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,2,0,0,0,0|1,0,1]=4 1642 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [0,2,0,0,0,0|1,0,1]=4 1643 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [0,2,0,0,0,0|1,0,1]=4 1644 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [0,2,0,0,0,0|1,0,1]=4 1645 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,2,0,0,0,0|1,0,1]=4 1646 B12R2.606 O=C1NC2=C(N1)C=C(C=C2)F Z1198165756 [0,2,0,0,0,0|2,0,0]=4 1647 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [0,2,0,0,0,0|1,0,0]=3 1648 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [0,2,0,0,0,0|1,0,0]=3 1649 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [0,2,0,0,0,0|1,0,0]=3 1650 B12R2.606 O=C1NC2=C(O1)C=C(C=N2)Br Z1269188809 [0,2,0,0,0,0|2,0,0]=4 1651 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [0,2,0,0,0,0|1,0,0]=3 1652 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [0,2,0,0,0,0|1,0,0]=3 1653 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [0,2,0,0,0,0|1,0,0]=3 1654 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,2,0,0,0,0|1,0,0]=3 1655 B12R2.606 O=C1NC2=C(S1)C=CC(=C2)F Z1198222395 [0,2,0,0,0,0|1,1,0]=4 1656 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [0,2,0,0,0,0|1,0,0]=3 1657 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [0,2,0,0,0,0|1,0,0]=3 1658 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [0,2,0,0,0,0|1,0,0]=3 1659 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [0,2,0,0,0,0|1,0,0]=3 1660 B12R2.606 OC1=CN2C=C(C=CC2=N1)Br Z1813175670 [0,2,0,0,0,0|2,0,0]=4 1661 B12R2.606 SC1=NC2=C(N1)C=C(C=C2)Cl Z56921384 [0,2,0,0,0,0|2,0,0]=4 1662 B12R2.606 SC1=NC2=C(N1)C=CC(=C2)I Z3235033507 [0,2,0,0,0,0|2,0,0]=4 1663 B12R2.606 SC1=NC2=C(O1)C=C(C=C2)Cl Z56969312 [0,2,0,0,0,0|1,0,0]=3 1664 B12R2.606 SC1=NC2=C(O1)C=C(C=N2)Cl Z1688656989 [0,2,0,0,0,0|2,0,0]=4 1665 B12R2.606 SC1=NC2=C(O1)C=CC(=C2)Cl Z56824483 [0,2,0,0,0,0|1,0,0]=3 1666 B12R2.606 SC1=NC2=C(S1)C=CC(=C2)Cl Z104497390 [0,2,0,0,0,0|1,1,0]=4 1667 B12R2.44 C#CC1=CC2=C(C=C1)C=NN2 Z1322794222 [0,2,0,0,0,0|2,0,0]=4 1668 B12R2.44 C#CC1=CC2=C(C=C1)NC=C2 Z1201625706 [0,2,0,0,0,0|1,0,0]=3 1669 B12R2.44 C#CC1=CC2=C(C=C1)NN=C2 Z1322795432 [0,2,0,0,0,0|2,0,0]=4 1670 B12R2.44 C#CC1=CC2=C(N=C1)NC=C2 Z3339531998 [0,2,0,0,0,0|2,0,0]=4 1671 B12R2.44 C#CC1=CC2=NC=CN2C=C1 Z1255425113 [0,2,0,0,0,0|2,0,0]=4 1672 B12R2.44 CCC1=CC2=C(C=C1)NC=N2 Z1474026103 [0,2,0,0,0,0|2,0,0]=4 1673 B12R2.44 CNC1=CC2=C(C=C1)OCO2 Z4179948758 [0,2,0,0,0,0|1,0,1]=4 1674 B12R2.44 COC1=CC2=C(C=C1)NC=C2 Z104507276 [0,2,0,0,0,0|1,0,0]=3 1675 B12R2.44 COC1=CC2=C(C=C1)OC=N2 Z1198314976 [0,2,0,0,0,0|1,0,0]=3 1676 B12R2.44 COC1=CC2=C(C=C1)SC=N2 Z1198169594 [0,2,0,0,0,0|1,1,0]=4 1677 B12R2.44 COC1=NC2=C(C=CN2)C=C1 Z1203732536 [0,2,0,0,0,0|2,0,0]=4 1678 B12R2.44 N#CC1=CC2=C(C=C1)C=NN2 Z1198165338 [0,2,0,0,0,0|2,0,0]=4 1679 B12R2.44 N#CC1=CC2=C(C=C1)CCO2 Z1255394026 [0,2,0,0,0,0|0,0,2]=4 1680 B12R2.44 N#CC1=CC2=C(C=C1)N=CN2 Z1642061012 [0,2,0,0,0,0|2,0,0]=4 1681 B12R2.44 N#CC1=CC2=C(C=C1)NC=C2 Z1203730728 [0,2,0,0,0,0|1,0,0]=3 1682 B12R2.44 N#CC1=CC2=C(C=C1)OC=N2 Z1033256930 [0,2,0,0,0,0|1,0,0]=3 1683 B12R2.44 N#CC1=CC2=C(C=C1)OCC2 Z448237308 [0,2,0,0,0,0|0,0,2]=4 1684 B12R2.44 N#CC1=CC2=C(C=C1)OCO2 Z57756578 [0,2,0,0,0,0|1,0,1]=4 1685 B12R2.44 N#CC1=CC2=C(C=C1)SC=C2 Z1198165874 [0,2,0,0,0,0|0,1,0]=3 1686 B12R2.44 N#CC1=CC2=C(C=C1)SC=N2 Z1198169595 [0,2,0,0,0,0|1,1,0]=4 1687 B12R2.44 N#CC1=CC2=C(C=CN2)C=C1 Z1201617280 [0,2,0,0,0,0|1,0,0]=3 1688 B12R2.44 N#CC1=CC2=C(C=CS2)N=C1 Z1198309926 [0,2,0,0,0,0|1,1,0]=4 1689 B12R2.44 N#CC1=CC2=C(N=C1)SC=C2 Z1198309925 [0,2,0,0,0,0|1,1,0]=4 1690 B12R2.44 N#CC1=NC2=C(C=C1)NC=C2 Z1198261710 [0,2,0,0,0,0|2,0,0]=4 1691 B12R2.44 N#CC1=NC2=C(C=CN2)C=C1 Z1198169602 [0,2,0,0,0,0|2,0,0]=4 1692 B12R2.44 N#CC1=NC=C2NC=CC2=C1 Z1255466100 [0,2,0,0,0,0|2,0,0]=4 1693 B12R2.44 NCC1=CC2=C(C=C1)C=NN2 Z3235024497 [0,2,0,0,0,0|2,0,0]=4 1694 B12R2.44 NCC1=CC2=C(C=C1)N=CS2 Z3681771763 [0,2,0,0,0,0|1,1,0]=4 1695 B12R2.44 NCC1=CC2=C(C=C1)NC=N2 Z2235810192 [0,2,0,0,0,0|2,0,0]=4 1696 B12R2.44 NCC1=CC2=C(C=C1)OCC2 Z448237126 [0,2,0,0,0,0|0,0,2]=4 1697 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 Z1198323676 [0,2,0,0,0,0|0,1,0]=3 1698 B12R2.44 NCC1=CC2=C(C=C1)SC=N2 Z5067435523 [0,2,0,0,0,0|1,1,0]=4 1699 B12R2.44 NCC1=CC2=C(C=CO2)C=C1 Z965074230 [0,2,0,0,0,0|0,0,0]=2 1700 B12R2.44 NCC1=CC2=NC=CN2C=C1 Z4862494269 [0,2,0,0,0,0|2,0,0]=4 1701 B12R2.44 NCC1=NC2=C(C=C1)OC=C2 Z5197556882 [0,2,0,0,0,0|1,0,0]=3 1702 B12R2.44 NCC1=NC2=C(C=CN2)C=C1 Z2310702029 [0,2,0,0,0,0|2,0,0]=4 1703 B12R2.44 O=CC1=CC2=C(C=C1)C=NN2 Z3485358093 [0,2,0,0,0,0|2,0,0]=4 1704 B12R2.44 O=CC1=CC2=C(C=C1)CCO2 Z1255367296 [0,2,0,0,0,0|0,0,2]=4 1705 B12R2.44 O=CC1=CC2=C(C=C1)N=CS2 Z1255419863 [0,2,0,0,0,0|1,1,0]=4 1706 B12R2.44 O=CC1=CC2=C(C=C1)NC=C2 Z254198328 [0,2,0,0,0,0|1,0,0]=3 1707 B12R2.44 O=CC1=CC2=C(C=C1)NC=N2 Z1021421726 [0,2,0,0,0,0|2,0,0]=4 1708 B12R2.44 O=CC1=CC2=C(C=C1)NN=C2 Z1198169739 [0,2,0,0,0,0|2,0,0]=4 1709 B12R2.44 O=CC1=CC2=C(C=C1)OC=C2 Z1201622196 [0,2,0,0,0,0|0,0,0]=2 1710 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 Z362120102 [0,2,0,0,0,0|0,0,2]=4 1711 B12R2.44 O=CC1=CC2=C(C=C1)ON=C2 Z1255451826 [0,2,0,0,0,0|1,0,0]=3 1712 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 Z1201623148 [0,2,0,0,0,0|0,1,0]=3 1713 B12R2.44 O=CC1=CC2=C(C=C1)SC=N2 Z1255396184 [0,2,0,0,0,0|1,1,0]=4 1714 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 Z1203162328 [0,2,0,0,0,0|1,0,0]=3 1715 B12R2.44 O=CC1=CC2=C(C=CS2)N=C1 Z1202209325 [0,2,0,0,0,0|1,1,0]=4 1716 B12R2.44 O=CC1=CC2=C(N=C1)NC=C2 Z2289798542 [0,2,0,0,0,0|2,0,0]=4 1717 B12R2.44 O=CC1=CC2=CC=NN2C=C1 Z1255420637 [0,2,0,0,0,0|2,0,0]=4 1718 B12R2.44 O=CC1=CC2=CON=C2C=C1 Z1416197933 [0,2,0,0,0,0|2,0,0]=4 1719 B12R2.44 O=CC1=CC2=NC=CN2C=C1 Z1255451026 [0,2,0,0,0,0|2,0,0]=4 1720 B12R2.44 O=CC1=CC2=NOC=C2C=C1 Z3038686912 [0,2,0,0,0,0|2,0,0]=4 1721 B12R2.44 O=CC1=NC2=C(C=C1)OC=C2 Z1416197932 [0,2,0,0,0,0|1,0,0]=3 1722 B12R2.44 O=CC1=NC2=C(C=CN2)C=C1 Z1198180847 [0,2,0,0,0,0|2,0,0]=4 1723 B12R2.44 OCC1=CC2=C(C=C1)C=NN2 Z1198309357 [0,2,0,0,0,0|2,0,0]=4 1724 B12R2.44 OCC1=CC2=C(C=C1)NC=C2 Z1201621651 [0,2,0,0,0,0|1,0,0]=3 1725 B12R2.44 OCC1=CC2=C(C=C1)OC=C2 Z1201622887 [0,2,0,0,0,0|0,0,0]=2 1726 B12R2.44 OCC1=CC2=C(C=C1)OCO2 Z104477372 [0,2,0,0,0,0|1,0,1]=4 1727 B12R2.44 OCC1=CC2=CC=NN2C=C1 Z1255416906 [0,2,0,0,0,0|2,0,0]=4 1728 B12R2.44 OCC1=CC2=NC=CN2C=C1 Z5087170256 [0,2,0,0,0,0|2,0,0]=4 1729 B12R2.44 OCC1=NC2=C(C=CN2)C=C1 Z1486000639 [0,2,0,0,0,0|2,0,0]=4 1730 B12R2.82 CC1=C(C2=C(C=C1)N=CN2)N Z1198223772 [0,2,0,0,0,0|2,0,0]=4 1731 B12R2.82 CC1=C(C2=C(C=C1)NC=N2)C Z1203731927 [0,2,0,0,0,0|2,0,0]=4 1732 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)Br Z1551923928 [0,2,0,0,0,0|1,0,0]=3 1733 B12R2.82 CC1=C(C2=C(C=CN2)C=C1)F Z1486007518 [0,2,0,0,0,0|1,0,0]=3 1734 B12R2.82 CC1=C(C2=CC=NN2C=C1)Br Z1681374921 [0,2,0,0,0,0|2,0,0]=4 1735 B12R2.82 CC1=C(C=CC2=NNC=C12)I Z3980242907 [0,2,0,0,0,0|2,0,0]=4 1736 B12R2.82 CC1=C2C=CNC2=NC=C1Br Z1269169147 [0,2,0,0,0,0|2,0,0]=4 1737 B12R2.82 CC1=C2C=CNC2=NC=C1N Z1939448352 [0,2,0,0,0,0|2,0,0]=4 1738 B12R2.82 CC1=C2NC=CC2=CC=C1Br Z1269148523 [0,2,0,0,0,0|1,0,0]=3 1739 B12R2.82 CC1=C2NC=CC2=CC=C1F Z1198182497 [0,2,0,0,0,0|1,0,0]=3 1740 B12R2.82 CC1=C2OC=NC2=CC=C1O Z3243446285 [0,2,0,0,0,0|1,0,0]=3 1741 B12R2.82 CN1C=CC2=C(C1=O)NC=C2 Z1203734446 [0,2,0,0,0,0|2,0,0]=4 1742 B12R2.82 ClC1=C(C2=C(C=CO2)C=C1)Br Z1681348708 [0,2,0,0,0,0|0,0,0]=2 1743 B12R2.82 ClC1=C2C=COC2=CC=C1Br Z1681355455 [0,2,0,0,0,0|0,0,0]=2 1744 B12R2.82 ClC1=C2C=NNC2=CC=C1Br Z1269146209 [0,2,0,0,0,0|2,0,0]=4 1745 B12R2.82 ClC1=C2N=CNC2=CC=C1I Z2311291810 [0,2,0,0,0,0|2,0,0]=4 1746 B12R2.82 ClC1=C2SN=CC2=CC=C1Br Z1681334373 [0,2,0,0,0,0|1,1,0]=4 1747 B12R2.82 FC1=C(C2=C(C=C1)NC=C2)Br Z1269216103 [0,2,0,0,0,0|1,0,0]=3 1748 B12R2.82 FC1=C(C2=C(C=C1)SC=C2)Br Z1681382899 [0,2,0,0,0,0|0,1,0]=3 1749 B12R2.82 FC1=C(C=CC2=C1OCO2)Br Z1269226431 [0,2,0,0,0,0|1,0,1]=4 1750 B12R2.82 FC1=C2C=CNC2=CC=C1Br Z1269143571 [0,2,0,0,0,0|1,0,0]=3 1751 B12R2.82 FC1=C2N=CNC2=CC=C1Br Z1509334088 [0,2,0,0,0,0|2,0,0]=4 1752 B12R2.82 FC1=C2NC=CC2=CC=C1Cl Z1255416961 [0,2,0,0,0,0|1,0,0]=3 1753 B12R2.82 FC1=C2OC=NC2=CC=C1Br Z1862021518 [0,2,0,0,0,0|1,0,0]=3 1754 B12R2.82 NC1=C(C2=C(C=C1)N=CS2)Br Z1269244230 [0,2,0,0,0,0|1,1,0]=4 1755 B12R2.82 NC1=C(C2=C(C=C1)N=CS2)N Z3098832159 [0,2,0,0,0,0|1,1,0]=4 1756 B12R2.82 NC1=C(C2=C(C=C1)NN=C2)Br Z2732978967 [0,2,0,0,0,0|2,0,0]=4 1757 B12R2.82 NC1=C(C2=C(C=C1)SC=N2)Br Z1269146869 [0,2,0,0,0,0|1,1,0]=4 1758 B12R2.82 NC1=C(C2=C(C=CS2)N=C1)O Z5766618507 [0,2,0,0,0,0|1,1,0]=4 1759 B12R2.82 NC1=C(C2=NNC=C2C=C1)Br Z1622825055 [0,2,0,0,0,0|2,0,0]=4 1760 B12R2.82 NC1=C(C=CC2=C1OCO2)Cl Z3244909352 [0,2,0,0,0,0|1,0,1]=4 1761 B12R2.82 NC1=C(C=CC2=C1OCO2)F Z1198184433 [0,2,0,0,0,0|1,0,1]=4 1762 B12R2.82 NC1=C2N=CSC2=CC=C1Cl Z382701610 [0,2,0,0,0,0|1,1,0]=4 1763 B12R2.82 OC1=C(C2=C(C=C1)NN=C2)Br Z1486007507 [0,2,0,0,0,0|2,0,0]=4 1764 B12R2.82 OC1=C(C2=C(C=C1)SC=C2)Br Z3243494650 [0,2,0,0,0,0|0,1,0]=3 1765 B12R2.82 OC1=C(C2=C(C=C1)SC=C2)Cl Z1513914425 [0,2,0,0,0,0|0,1,0]=3 1766 B12R2.82 OC1=C2C=CSC2=CC=C1Br Z1269129531 [0,2,0,0,0,0|0,1,0]=3 1767 B12R2.100 BrC1=C(C=C2NC=CC2=C1)Br Z1269152356 [0,2,0,0,0,0|1,0,0]=3 1768 B12R2.100 BrC1=C(C=C2NC=NC2=C1)Br Z3234801863 [0,2,0,0,0,0|2,0,0]=4 1769 B12R2.100 BrC1=C(C=C2OCOC2=C1)Br Z1269218699 [0,2,0,0,0,0|1,0,1]=4 1770 B12R2.100 CC1=C(C=C2C=NNC2=C1)Br Z1269177424 [0,2,0,0,0,0|2,0,0]=4 1771 B12R2.100 CC1=C(C=C2C=NNC2=C1)N Z1201622161 [0,2,0,0,0,0|2,0,0]=4 1772 B12R2.100 CC1=C(C=C2C=NNC2=C1)O Z1198181921 [0,2,0,0,0,0|2,0,0]=4 1773 B12R2.100 CC1=C(C=C2CCOC2=C1)N Z1416160381 [0,2,0,0,0,0|0,0,2]=4 1774 B12R2.100 CC1=C(C=C2N=CSC2=C1)Br Z3300754374 [0,2,0,0,0,0|1,1,0]=4 1775 B12R2.100 CC1=C(C=C2NC=CC2=C1)C Z1198330837 [0,2,0,0,0,0|1,0,0]=3 1776 B12R2.100 CC1=C(C=C2NC=CC2=C1)F Z1203748049 [0,2,0,0,0,0|1,0,0]=3 1777 B12R2.100 CC1=C(C=C2NC=NC2=C1)C Z55928828 [0,2,0,0,0,0|2,0,0]=4 1778 B12R2.100 CC1=C(C=C2NN=CC2=C1)N Z1065885440 [0,2,0,0,0,0|2,0,0]=4 1779 B12R2.100 CC1=C(C=C2OCOC2=C1)Br Z1681359009 [0,2,0,0,0,0|1,0,1]=4 1780 B12R2.100 CC1=C(C=C2OCOC2=C1)N Z1198154495 [0,2,0,0,0,0|1,0,1]=4 1781 B12R2.100 CC1=CC2=CC=NN2C=C1Br Z1269172473 [0,2,0,0,0,0|2,0,0]=4 1782 B12R2.100 ClC1=C(C=C2C=CNC2=C1)Br Z1269179223 [0,2,0,0,0,0|1,0,0]=3 1783 B12R2.100 ClC1=C(C=C2C=NNC2=C1)Br Z1269151511 [0,2,0,0,0,0|2,0,0]=4 1784 B12R2.100 ClC1=C(C=C2NC=CC2=C1)Br Z1269225967 [0,2,0,0,0,0|1,0,0]=3 1785 B12R2.100 ClC1=C(C=C2NC=CC2=C1)Cl Z1201620800 [0,2,0,0,0,0|1,0,0]=3 1786 B12R2.100 ClC1=C(C=C2NC=NC2=C1)Br Z1551930830 [0,2,0,0,0,0|2,0,0]=4 1787 B12R2.100 ClC1=C(C=C2NC=NC2=C1)Cl Z2941518564 [0,2,0,0,0,0|2,0,0]=4 1788 B12R2.100 ClC1=C(C=C2OC=CC2=C1)Br Z1681348707 [0,2,0,0,0,0|0,0,0]=2 1789 B12R2.100 ClC1=C(C=C2OCCC2=C1)Br Z1551957154 [0,2,0,0,0,0|0,0,2]=4 1790 B12R2.100 ClC1=C(C=C2OCOC2=C1)Br Z1278926390 [0,2,0,0,0,0|1,0,1]=4 1791 B12R2.100 ClC1=C(C=C2OCOC2=C1)Cl Z1198169249 [0,2,0,0,0,0|1,0,1]=4 1792 B12R2.100 FC1=C(C=C2C=CNC2=C1)Br Z1269189958 [0,2,0,0,0,0|1,0,0]=3 1793 B12R2.100 FC1=C(C=C2C=CNC2=C1)Cl Z1201620785 [0,2,0,0,0,0|1,0,0]=3 1794 B12R2.100 FC1=C(C=C2C=COC2=C1)Br Z1681355433 [0,2,0,0,0,0|0,0,0]=2 1795 B12R2.100 FC1=C(C=C2NC=CC2=C1)F Z1201620806 [0,2,0,0,0,0|1,0,0]=3 1796 B12R2.100 FC1=C(C=C2OC=CC2=C1)Br Z1551956538 [0,2,0,0,0,0|0,0,0]=2 1797 B12R2.100 FC1=C(C=C2OCOC2=C1)Br Z1681375391 [0,2,0,0,0,0|1,0,1]=4 1798 B12R2.100 NC1=C(C=C2N=CNC2=C1)F Z3670392749 [0,2,0,0,0,0|2,0,0]=4 1799 B12R2.100 NC1=C(C=C2OCOC2=C1)Br Z1489065337 [0,2,0,0,0,0|1,0,1]=4 1800 B12R2.100 NC1=C(C=C2OCOC2=C1)Cl Z168827492 [0,2,0,0,0,0|1,0,1]=4 1801 B12R2.100 OC1=C(C=C2NN=CC2=C1)F Z1939440102 [0,2,0,0,0,0|2,0,0]=4 1802 B12R2.100 OC1=C(C=C2OCOC2=C1)Cl Z1416158322 [0,2,0,0,0,0|1,0,1]=4 1803 B12R2.246 BrC1=CC(=NC2=C1C=CN2)Br Z1269210309 [0,2,0,0,0,0|2,0,0]=4 1804 B12R2.246 BrC1=CN2C=CN=C2C(=C1)I Z1389087052 [0,2,0,0,0,0|2,0,0]=4 1805 B12R2.246 CC1=C2C=NNC2=CC(=C1)N Z1198174638 [0,2,0,0,0,0|2,0,0]=4 1806 B12R2.246 CC1=C2N=CNC2=CC(=C1)O Z1509345768 [0,2,0,0,0,0|2,0,0]=4 1807 B12R2.246 CC1=C2N=CSC2=CC(=C1)Br Z2310185368 [0,2,0,0,0,0|1,1,0]=4 1808 B12R2.246 CC1=C2NC=CC2=CC(=C1)F Z1198280275 [0,2,0,0,0,0|1,0,0]=3 1809 B12R2.246 CC1=C2NC=CC2=CC(=C1)O Z1203832444 [0,2,0,0,0,0|1,0,0]=3 1810 B12R2.246 CC1=C2NN=CC2=CC(=C1)Br Z1269185548 [0,2,0,0,0,0|2,0,0]=4 1811 B12R2.246 CC1=C2OC=CC2=CC(=C1)N Z5411283142 [0,2,0,0,0,0|0,0,0]=2 1812 B12R2.246 CC1=C2SC=CC2=CC(=C1)N Z4956162368 [0,2,0,0,0,0|0,1,0]=3 1813 B12R2.246 CC1=CC(=CN2C1=NC=C2)Br Z1269209111 [0,2,0,0,0,0|2,0,0]=4 1814 B12R2.246 CC1=CC(=CN2C1=NC=C2)N Z2216711590 [0,2,0,0,0,0|2,0,0]=4 1815 B12R2.246 CC1=CC(=O)C2=C(N1)C=CS2 Z1274223291 [0,2,0,0,0,0|1,1,0]=4 1816 B12R2.246 CC1=CC2=C(NC=C2)C(=C1)F Z1203748018 [0,2,0,0,0,0|1,0,0]=3 1817 B12R2.246 CC1=CC2=C(NC=C2)C(=O)N1 Z1255368377 [0,2,0,0,0,0|2,0,0]=4 1818 B12R2.246 CC1=CC2=C(NC=N2)C(=C1)N Z1551929441 [0,2,0,0,0,0|2,0,0]=4 1819 B12R2.246 CC1=CC2=C(OC=C2)C(=C1)Br Z1269228041 [0,2,0,0,0,0|0,0,0]=2 1820 B12R2.246 CC1=CN2C=CN=C2C(=C1)Br Z2601737848 [0,2,0,0,0,0|2,0,0]=4 1821 B12R2.246 ClC1=C2NN=CC2=CC(=C1)Br Z1269130417 [0,2,0,0,0,0|2,0,0]=4 1822 B12R2.246 ClC1=C2OC=NC2=CC(=C1)Br Z1269148239 [0,2,0,0,0,0|1,0,0]=3 1823 B12R2.246 ClC1=CC2=C(C=CN2)C(=C1)Cl Z1198161528 [0,2,0,0,0,0|1,0,0]=3 1824 B12R2.246 ClC1=CC2=C(N=CN2)C(=C1)Br Z2010010281 [0,2,0,0,0,0|2,0,0]=4 1825 B12R2.246 FC1=C2C=CNC2=CC(=C1)Br Z1269127261 [0,2,0,0,0,0|1,0,0]=3 1826 B12R2.246 FC1=C2C=NNC2=CC(=C1)Br Z1269137546 [0,2,0,0,0,0|2,0,0]=4 1827 B12R2.246 FC1=C2OC=NC2=CC(=C1)Br Z1269201723 [0,2,0,0,0,0|1,0,0]=3 1828 B12R2.246 FC1=CC(=C2OCOC2=C1)Br Z1681333782 [0,2,0,0,0,0|1,0,1]=4 1829 B12R2.246 FC1=CC2=C(C=NN2)C(=C1)F Z1198174629 [0,2,0,0,0,0|2,0,0]=4 1830 B12R2.246 FC1=CC2=C(N=CN2)C(=C1)Br Z1269188802 [0,2,0,0,0,0|2,0,0]=4 1831 B12R2.246 FC1=CC2=C(NC=C2)C(=C1)F Z1201620809 [0,2,0,0,0,0|1,0,0]=3 1832 B12R2.246 FC1=CC2=C(OC=C2)C(=C1)Br Z1269233160 [0,2,0,0,0,0|0,0,0]=2 1833 B12R2.246 NC1=C2C=NNC2=CC(=C1)O Z1198174597 [0,2,0,0,0,0|2,0,0]=4 1834 B12R2.246 NC1=C2NN=CC2=CC(=C1)Br Z1269128715 [0,2,0,0,0,0|2,0,0]=4 1835 B12R2.246 NC1=C2NN=CC2=CC(=C1)Cl Z1262634115 [0,2,0,0,0,0|2,0,0]=4 1836 B12R2.246 NC1=C2OCCC2=CC(=C1)Cl Z1695822064 [0,2,0,0,0,0|0,0,2]=4 1837 B12R2.246 NC1=C2OCOC2=CC(=C1)Br Z1509409772 [0,2,0,0,0,0|1,0,1]=4 1838 B12R2.246 NC1=CC(=C2OCOC2=C1)Br Z3050164428 [0,2,0,0,0,0|1,0,1]=4 1839 B12R2.246 NC1=CC(=C2OCOC2=C1)Cl Z3050144527 [0,2,0,0,0,0|1,0,1]=4 1840 B12R2.246 NC1=CC2=C(C=NN2)C(=C1)Br Z1269182536 [0,2,0,0,0,0|2,0,0]=4 1841 B12R2.246 NC1=CC2=C(NN=C2)C(=C1)Br Z1269196016 [0,2,0,0,0,0|2,0,0]=4 1842 B12R2.246 NC1=NC2=C(C=CN2)C(=C1)Br Z1269201323 [0,2,0,0,0,0|2,0,0]=4 1843 B12R2.246 O=C1C=C(C2=C(N1)SC=C2)O Z1198181643 [0,2,0,0,0,0|1,1,0]=4 1844 B12R2.246 OC1=CC(=C2OCCC2=C1)Br Z2733023909 [0,2,0,0,0,0|0,0,2]=4 1845 B12R2.246 OC1=CC(=C2OCOC2=C1)Cl Z2681245806 [0,2,0,0,0,0|1,0,1]=4 1846 B12R2.246 OC1=NC2=C(OC=C2)C(=N1)O Z1198330349 [0,2,0,0,0,0|2,0,0]=4 1847 B12R2.221 BrC1=C2C=COC2=C(C=C1)Br Z1551943559 [0,2,0,0,0,0|0,0,0]=2 1848 B12R2.221 CC1=C2C=CNC2=C(C=C1)Br Z1269146528 [0,2,0,0,0,0|1,0,0]=3 1849 B12R2.221 CC1=C2C=CNC2=C(C=C1)C Z1198149116 [0,2,0,0,0,0|1,0,0]=3 1850 B12R2.221 CC1=C2C=CNC2=C(C=C1)Cl Z1201625087 [0,2,0,0,0,0|1,0,0]=3 1851 B12R2.221 CC1=C2C=CNC2=C(C=C1)F Z1509337854 [0,2,0,0,0,0|1,0,0]=3 1852 B12R2.221 CC1=C2C=NNC2=C(C=C1)N Z381673576 [0,2,0,0,0,0|2,0,0]=4 1853 B12R2.221 CC1=C2NC=CC2=C(C=C1)Cl Z1198182500 [0,2,0,0,0,0|1,0,0]=3 1854 B12R2.221 CC1=C2NC=CC2=C(C=C1)F Z1198182495 [0,2,0,0,0,0|1,0,0]=3 1855 B12R2.221 CC1=C2SC=NC2=C(C=C1)Br Z2310185330 [0,2,0,0,0,0|1,1,0]=4 1856 B12R2.221 CC1=CC=C(C2=NC=CN12)N Z5361566143 [0,2,0,0,0,0|2,0,0]=4 1857 B12R2.221 ClC1=C2C=CNC2=C(C=C1)Br Z1269149090 [0,2,0,0,0,0|1,0,0]=3 1858 B12R2.221 ClC1=C2C=COC2=C(C=C1)Br Z1681376172 [0,2,0,0,0,0|0,0,0]=2 1859 B12R2.221 ClC1=C2C=NNC2=C(C=C1)Br Z1269130858 [0,2,0,0,0,0|2,0,0]=4 1860 B12R2.221 ClC1=C2OC=CC2=C(C=C1)Br Z1269195555 [0,2,0,0,0,0|0,0,0]=2 1861 B12R2.221 FC1=C2C=CNC2=C(C=C1)F Z1201620808 [0,2,0,0,0,0|1,0,0]=3 1862 B12R2.221 FC1=CC=C(C2=CNN=C12)Br Z3300783001 [0,2,0,0,0,0|2,0,0]=4 1863 B12R2.221 NC1=C2NN=CC2=C(C=C1)Br Z1269212713 [0,2,0,0,0,0|2,0,0]=4 1864 B12R2.221 NC1=C2NN=CC2=C(C=C1)F Z1198163163 [0,2,0,0,0,0|2,0,0]=4 1865 B12R2.221 O=C1NC=C(C2=C1C=CS2)Br Z1269153834 [0,2,0,0,0,0|1,1,0]=4 1866 B12R2.221 O=C1NC=C(C2=C1C=CS2)Cl Z1198177338 [0,2,0,0,0,0|1,1,0]=4 1867 B12R2.221 O=C1NC=C(C2=C1SC=C2)Br Z1725969199 [0,2,0,0,0,0|1,1,0]=4 1868 B12R2.221 OC1=C2CCOC2=C(C=C1)F Z1255367770 [0,2,0,0,0,0|0,0,2]=4 1869 B12R2.315 C#CC1=C2C=NNC2=CC=C1 Z1322793831 [0,2,0,0,0,0|2,0,0]=4 1870 B12R2.315 CNC1=C2N=CNC2=CC=C1 Z1813134017 [0,2,0,0,0,0|2,0,0]=4 1871 B12R2.315 CNC1=C2NC=CC2=CC=C1 Z2690350437 [0,2,0,0,0,0|1,0,0]=3 1872 B12R2.315 COC1=C2C=CNC2=CC=C1 Z1203730757 [0,2,0,0,0,0|1,0,0]=3 1873 B12R2.315 COC1=C2C=CNC2=NC=C1 Z1198176785 [0,2,0,0,0,0|2,0,0]=4 1874 B12R2.315 COC1=C2C=NSC2=CC=C1 Z1617986360 [0,2,0,0,0,0|1,1,0]=4 1875 B12R2.315 COC1=C2N=CNC2=CC=C1 Z1198182091 [0,2,0,0,0,0|2,0,0]=4 1876 B12R2.315 COC1=C2NC=CC2=CC=C1 Z1192378717 [0,2,0,0,0,0|1,0,0]=3 1877 B12R2.315 COC1=C2NC=CC2=CC=N1 Z1203734686 [0,2,0,0,0,0|2,0,0]=4 1878 B12R2.315 COC1=C2NN=CC2=CC=C1 Z1198182195 [0,2,0,0,0,0|2,0,0]=4 1879 B12R2.315 COC1=C2OCOC2=CC=C1 Z1416163605 [0,2,0,0,0,0|1,0,1]=4 1880 B12R2.315 COC1=CC=CN2C1=NC=C2 Z4991178671 [0,2,0,0,0,0|2,0,0]=4 1881 B12R2.315 N#CC1=C2C=CN=C2C=CN1 Z2230911345 [0,2,0,0,0,0|2,0,0]=4 1882 B12R2.315 N#CC1=C2C=CNC2=CC=C1 Z1203162661 [0,2,0,0,0,0|1,0,0]=3 1883 B12R2.315 N#CC1=C2C=CNC2=NC=C1 Z1198176787 [0,2,0,0,0,0|2,0,0]=4 1884 B12R2.315 N#CC1=C2C=CSC2=CC=C1 Z1255460086 [0,2,0,0,0,0|0,1,0]=3 1885 B12R2.315 N#CC1=C2NC=CC2=CC=C1 Z1198155196 [0,2,0,0,0,0|1,0,0]=3 1886 B12R2.315 N#CC1=CC=CN2C1=NC=C2 Z1198268332 [0,2,0,0,0,0|2,0,0]=4 1887 B12R2.315 NCC1=C2C=CSC2=CC=C1 Z4591188109 [0,2,0,0,0,0|0,1,0]=3 1888 B12R2.315 NCC1=C2CCOC2=CC=C1 Z2310671934 [0,2,0,0,0,0|0,0,2]=4 1889 B12R2.315 NCC1=C2NC=CC2=CC=C1 Z1801307851 [0,2,0,0,0,0|1,0,0]=3 1890 B12R2.315 NCC1=C2OCOC2=CC=C1 Z432060938 [0,2,0,0,0,0|1,0,1]=4 1891 B12R2.315 NCC1=C2SC=CC2=CC=C1 Z2429425576 [0,2,0,0,0,0|0,1,0]=3 1892 B12R2.315 NCC1=CC=CC2=CC=NN12 Z4244625472 [0,2,0,0,0,0|2,0,0]=4 1893 B12R2.315 O=CC1=C2C=CNC2=CC=C1 Z1065768492 [0,2,0,0,0,0|1,0,0]=3 1894 B12R2.315 O=CC1=C2C=CNC2=NC=C1 Z1198176789 [0,2,0,0,0,0|2,0,0]=4 1895 B12R2.315 O=CC1=C2C=CSC2=CC=C1 Z1255419137 [0,2,0,0,0,0|0,1,0]=3 1896 B12R2.315 O=CC1=C2C=NNC2=CC=C1 Z1198169738 [0,2,0,0,0,0|2,0,0]=4 1897 B12R2.315 O=CC1=C2CCOC2=CC=C1 Z1198162687 [0,2,0,0,0,0|0,0,2]=4 1898 B12R2.315 O=CC1=C2N=CNC2=CC=C1 Z1198278885 [0,2,0,0,0,0|2,0,0]=4 1899 B12R2.315 O=CC1=C2N=COC2=CC=C1 Z1862025082 [0,2,0,0,0,0|1,0,0]=3 1900 B12R2.315 O=CC1=C2NC=CC2=CC=C1 Z1065768468 [0,2,0,0,0,0|1,0,0]=3 1901 B12R2.315 O=CC1=C2NN=CC2=CC=C1 Z1198169740 [0,2,0,0,0,0|2,0,0]=4 1902 B12R2.315 O=CC1=C2OC=CC2=CC=C1 Z1198176767 [0,2,0,0,0,0|0,0,0]=2 1903 B12R2.315 O=CC1=C2OCCC2=CC=C1 Z1201623257 [0,2,0,0,0,0|0,0,2]=4 1904 B12R2.315 O=CC1=C2OCOC2=CC=C1 Z275127918 [0,2,0,0,0,0|1,0,1]=4 1905 B12R2.315 O=CC1=C2SC=CC2=CC=C1 Z1201624702 [0,2,0,0,0,0|0,1,0]=3 1906 B12R2.315 O=CC1=CC=CC2=CC=NN12 Z1160902160 [0,2,0,0,0,0|2,0,0]=4 1907 B12R2.315 O=CC1=CC=CC2=NC=CN12 Z1198278372 [0,2,0,0,0,0|2,0,0]=4 1908 B12R2.315 O=CC1=CC=CN2C1=CC=N2 Z1255432455 [0,2,0,0,0,0|2,0,0]=4 1909 B12R2.315 O=CC1=CC=CN2C1=NC=C2 Z1198169960 [0,2,0,0,0,0|2,0,0]=4 1910 B12R2.315 OCC1=C2C=CSC2=CC=C1 Z1255453706 [0,2,0,0,0,0|0,1,0]=3 1911 B12R2.315 OCC1=C2N=CNC2=CC=C1 Z1203733033 [0,2,0,0,0,0|2,0,0]=4 1912 B12R2.315 OCC1=C2NN=CC2=CC=C1 Z1198309335 [0,2,0,0,0,0|2,0,0]=4 1913 B12R2.315 OCC1=CC=CC2=NC=CN12 Z1255495400 [0,2,0,0,0,0|2,0,0]=4 1914 B12R2.315 OCC1=CC=CN2C1=CC=N2 Z1255425269 [0,2,0,0,0,0|2,0,0]=4 1915 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [0,0,1,1,0,0|0,0,2]=4 1916 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [0,0,1,1,0,0|0,0,2]=4 1917 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [0,0,1,1,0,0|0,0,2]=4 1918 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 Z278165226 [0,0,0,1,0,1|0,0,2]=4 1919 B10R1.172 C=CC1=NC=CC(=C1)C=O Z1618142690 [0,0,1,0,0,1|2,0,0]=4