0 B12R2.606 CC1=CC2=C(C=C1)N=C(N2)N Z995046368 [0,0,0,0,0,0|4,0,0]=4 1 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.606 CC1=CC2=C(C=C1)N=C(S2)N Z57069881 [0,0,0,0,0,0|3,1,0]=4 3 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)C Z57370047 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)S Z57298378 [0,0,0,0,0,0|3,1,0]=4 6 B12R2.606 CC1=CC2=C(C=C1)OC(=N2)S Z56864608 [0,0,0,0,0,0|2,2,0]=4 7 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [0,0,0,0,0,0|2,1,0]=3 8 B12R2.606 CC1=CC2=C(C=C1)SC(=N2)S Z1198307587 [0,0,0,0,0,0|2,1,0]=3 9 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)Br Z1269196919 [0,0,0,0,0,0|4,0,0]=4 10 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)F Z1201624894 [0,0,0,0,0,0|4,0,0]=4 11 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)F Z1203162476 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)N Z361880768 [0,0,0,0,0,0|4,0,0]=4 13 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [0,0,0,0,0,0|3,0,0]=3 14 B12R2.606 CC1=CC2=C(N=C1)SC(=N2)N Z1255491544 [0,0,0,0,0,0|4,0,0]=4 15 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)Br Z1269240413 [0,0,0,0,0,0|3,1,0]=4 16 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)I Z1269130980 [0,0,0,0,0,0|3,1,0]=4 17 B12R2.606 CC1=CC2=C(O1)C=CC(=C2)N Z2106607528 [0,0,0,0,0,0|3,1,0]=4 18 B12R2.606 CC1=CC2=C(S1)C=C(C=C2)Br Z1322795816 [0,0,0,0,0,0|3,1,0]=4 19 B12R2.606 CC1=CC2=C(S1)C=CC(=C2)Br Z1269233897 [0,0,0,0,0,0|3,0,0]=3 20 B12R2.606 CC1=CC2=C(S1)C=CC(=C2)F Z1340419229 [0,0,0,0,0,0|3,0,0]=3 21 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)Br Z382823070 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [0,0,0,0,0,0|3,0,0]=3 23 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)N Z235353833 [0,0,0,0,0,0|3,0,0]=3 24 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [0,0,0,0,0,0|2,0,0]=2 25 B12R2.606 CC1=NC2=C(O1)C=C(C=N2)Br Z1269209286 [0,0,0,0,0,0|4,0,0]=4 26 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Br Z1203159513 [0,0,0,0,0,0|3,1,0]=4 27 B12R2.606 CC1=NC2=C(O1)C=CC(=C2)Cl Z104486454 [0,0,0,0,0,0|3,1,0]=4 28 B12R2.606 CC1=NC2=C(S1)C=C(C=C2)N Z56896242 [0,0,0,0,0,0|3,1,0]=4 29 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)Cl Z104493618 [0,0,0,0,0,0|3,0,0]=3 30 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)N Z2901974823 [0,0,0,0,0,0|3,0,0]=3 31 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [0,0,0,0,0,0|2,0,0]=2 32 B12R2.606 CC1=NC2=C(S1)N=CC(=C2)Br Z1269232045 [0,0,0,0,0,0|4,0,0]=4 33 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [0,0,0,0,0,0|2,1,1]=4 34 B12R2.606 CN1C=C2C=C(C=CC2=N1)O Z1198343475 [0,0,0,0,0,0|4,0,0]=4 35 B12R2.606 ClC1=CC2=C(C=C1)C=C(S2)Br Z3300737228 [0,0,0,0,0,0|3,1,0]=4 36 B12R2.606 FC1=CC2=C(C=C1)N=C(O2)S Z1147226283 [0,0,0,0,0,0|2,1,0]=3 37 B12R2.606 FC1=CC2=C(C=C1)N=C(S2)S Z1201620440 [0,0,0,0,0,0|2,2,0]=4 38 B12R2.606 FC1=CC2=C(C=C1)SC(=N2)S Z1201621686 [0,0,0,0,0,0|2,1,0]=3 39 B12R2.606 N=C1OC2=C(S1)C=C(C=C2)O Z1513863695 [0,0,0,0,0,0|1,2,0]=3 40 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,0,0,0,0,0|3,0,0]=3 41 B12R2.606 NC1=CC2=C(C=C1)N=C(O2)S Z1198180819 [0,0,0,0,0,0|2,1,0]=3 42 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)Cl Z57160346 [0,0,0,0,0,0|3,1,0]=4 43 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)N Z2289761601 [0,0,0,0,0,0|3,1,0]=4 44 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [0,0,0,0,0,0|3,0,0]=3 45 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 Z56793257 [0,0,0,0,0,0|3,0,0]=3 46 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 Z1270210776 [0,0,0,0,0,0|2,1,0]=3 47 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [0,0,0,0,0,0|2,1,0]=3 48 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)S Z1255404077 [0,0,0,0,0,0|2,1,0]=3 49 B12R2.606 NC1=NC2=C(C=C1)SC(=N2)N Z56761871 [0,0,0,0,0,0|4,0,0]=4 50 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br Z1270207960 [0,0,0,0,0,0|4,0,0]=4 51 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl Z995046354 [0,0,0,0,0,0|4,0,0]=4 52 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)I Z1269176820 [0,0,0,0,0,0|4,0,0]=4 53 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [0,0,0,0,0,0|3,0,0]=3 54 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [0,0,0,0,0,0|3,0,0]=3 55 B12R2.606 NC1=NC2=C(O1)C=C(C=N2)Br Z2733008466 [0,0,0,0,0,0|4,0,0]=4 56 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [0,0,0,0,0,0|3,1,0]=4 57 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [0,0,0,0,0,0|3,1,0]=4 58 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [0,0,0,0,0,0|3,1,0]=4 59 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Br Z56858257 [0,0,0,0,0,0|3,1,0]=4 60 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Cl Z56896352 [0,0,0,0,0,0|3,1,0]=4 61 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)F Z56899125 [0,0,0,0,0,0|3,1,0]=4 62 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)I Z1741785969 [0,0,0,0,0,0|3,1,0]=4 63 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)Cl Z228584306 [0,0,0,0,0,0|3,0,0]=3 64 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)O Z1198155943 [0,0,0,0,0,0|2,0,0]=2 65 B12R2.606 NC1=NC2=C(S1)N=C(C=C2)O Z3324768322 [0,0,0,0,0,0|3,1,0]=4 66 B12R2.606 NC1=NC2=C(S1)N=CC(=C2)Br Z1269221304 [0,0,0,0,0,0|4,0,0]=4 67 B12R2.606 O=C1C=C2C=CC(=CN2N1)Br Z2158595246 [0,0,0,0,0,0|4,0,0]=4 68 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,0,0,0,0,0|3,0,0]=3 69 B12R2.606 O=C1CC2=C(N1)C=C(C=N2)Br Z1269225776 [0,0,0,0,0,0|4,0,0]=4 70 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [0,0,0,0,0,0|3,0,0]=3 71 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [0,0,0,0,0,0|3,0,0]=3 72 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [0,0,0,0,0,0|3,0,0]=3 73 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,0,0,0,0,0|2,0,0]=2 74 B12R2.606 O=C1NC2=C(N1)C=C(C=C2)F Z1198165756 [0,0,0,0,0,0|3,0,0]=3 75 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [0,0,0,0,0,0|2,0,0]=2 76 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [0,0,0,0,0,0|2,0,0]=2 77 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [0,0,0,0,0,0|2,0,0]=2 78 B12R2.606 O=C1NC2=C(O1)C=C(C=N2)Br Z1269188809 [0,0,0,0,0,0|3,0,0]=3 79 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [0,0,0,0,0,0|2,1,0]=3 80 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [0,0,0,0,0,0|2,1,0]=3 81 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [0,0,0,0,0,0|2,1,0]=3 82 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,0,0,0,0,0|1,1,0]=2 83 B12R2.606 O=C1NC2=C(S1)C=CC(=C2)F Z1198222395 [0,0,0,0,0,0|2,0,0]=2 84 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)Br Z1269212344 [0,0,0,0,0,0|1,1,0]=2 85 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [0,0,0,0,0,0|0,1,0]=1 86 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [0,0,0,0,0,0|0,2,0]=2 87 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [0,0,0,0,0,0|0,0,0]=0 88 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [0,0,0,0,0,0|2,0,2]=4 89 B12R2.606 SC1=NC2=C(N1)C=C(C=C2)Cl Z56921384 [0,0,0,0,0,0|3,1,0]=4 90 B12R2.606 SC1=NC2=C(N1)C=CC(=C2)I Z3235033507 [0,0,0,0,0,0|3,1,0]=4 91 B12R2.606 SC1=NC2=C(O1)C=C(C=C2)Cl Z56969312 [0,0,0,0,0,0|2,1,0]=3 92 B12R2.606 SC1=NC2=C(O1)C=C(C=N2)Cl Z1688656989 [0,0,0,0,0,0|3,1,0]=4 93 B12R2.606 SC1=NC2=C(O1)C=CC(=C2)Cl Z56824483 [0,0,0,0,0,0|2,2,0]=4 94 B12R2.606 SC1=NC2=C(S1)C=CC(=C2)Cl Z104497390 [0,0,0,0,0,0|2,1,0]=3 95 B11R2.10 BrC1=CC2=C(S1)C=NC=C2 Z1269169662 [1,0,0,0,0,0|3,0,0]=4 96 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [1,0,0,0,0,0|2,0,0]=3 97 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [1,0,0,0,0,0|2,0,0]=3 98 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [1,0,0,0,0,0|2,0,0]=3 99 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [1,0,0,0,0,0|3,0,0]=4 100 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [1,0,0,0,0,0|2,0,0]=3 101 B11R2.10 CC1=NC2=C(S1)C=CN=C2 Z1255375955 [1,0,0,0,0,0|3,0,0]=4 102 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [1,0,0,0,0,0|2,0,1]=4 103 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [1,0,0,0,0,0|3,0,0]=4 104 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [1,0,0,0,0,0|2,0,0]=3 105 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [1,0,0,0,0,0|3,0,0]=4 106 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [1,0,0,0,0,0|3,0,0]=4 107 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [1,0,0,0,0,0|2,0,0]=3 108 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [1,0,0,0,0,0|3,0,0]=4 109 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [1,0,0,0,0,0|3,0,0]=4 110 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [1,0,0,0,0,0|3,0,0]=4 111 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [1,0,0,0,0,0|2,0,0]=3 112 B11R2.10 NC1=NC2=C(S1)C=CC=N2 Z1255491591 [1,0,0,0,0,0|3,0,0]=4 113 B11R2.10 NC1=NC2=C(S1)N=CC=C2 Z1198152308 [1,0,0,0,0,0|3,0,0]=4 114 B11R2.10 NC1=NC2=[N+](S1)C=CC=C2 Z1262632043 [1,0,0,0,0,0|3,0,0]=4 115 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,0,0,0|2,0,0]=3 116 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,0,0,0|2,0,0]=3 117 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [1,0,0,0,0,0|3,0,0]=4 118 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [1,0,0,0,0,0|2,0,0]=3 119 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [1,0,0,0,0,0|1,0,0]=2 120 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [1,0,0,0,0,0|2,0,0]=3 121 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [1,0,0,0,0,0|1,0,0]=2 122 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [1,0,0,0,0,0|0,2,0]=3 123 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [1,0,0,0,0,0|2,1,0]=4 124 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [1,0,0,0,0,0|1,1,0]=3 125 B11R2.10 SC1=NC2=C(O1)C=CC=N2 Z1201620735 [1,0,0,0,0,0|2,1,0]=4 126 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [1,0,0,0,0,0|1,1,0]=3 127 B11R2.10 SC1=NC2=C(S1)C=CC=N2 Z1201619791 [1,0,0,0,0,0|2,1,0]=4 128 B11R2.10 SC1=NC2=C(S1)C=CN=C2 Z1255396445 [1,0,0,0,0,0|2,1,0]=4 129 B11R2.10 SC1=NC2=C(S1)N=CC=C2 Z2587654832 [1,0,0,0,0,0|2,1,0]=4 130 B11R2.36 BrC1=CC2=C(C=C1)CC=C2 Z1255379634 [1,0,0,0,0,0|3,0,0]=4 131 B11R2.36 BrC1=CC2=C(C=C1)CCO2 Z1198181832 [1,0,0,0,0,0|2,0,1]=4 132 B11R2.36 BrC1=CC2=C(C=C1)N=CO2 Z1198161423 [1,0,0,0,0,0|2,0,0]=3 133 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 Z104489174 [1,0,0,0,0,0|3,0,0]=4 134 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 Z382822766 [1,0,0,0,0,0|3,0,0]=4 135 B11R2.36 BrC1=CC2=C(C=C1)OCO2 Z1269199980 [1,0,0,0,0,0|1,1,1]=4 136 B11R2.36 BrC1=CC2=C(C=C1)SC=N2 Z1269222968 [1,0,0,0,0,0|2,0,0]=3 137 B11R2.36 BrC1=CC2=C(C=C1)SN=C2 Z1269153896 [1,0,0,0,0,0|3,0,0]=4 138 B11R2.36 BrC1=CC2=C(C=C1)SN=N2 Z2733024046 [1,0,0,0,0,0|3,0,0]=4 139 B11R2.36 BrC1=CC2=C(C=CN2)C=C1 Z752239748 [1,0,0,0,0,0|3,0,0]=4 140 B11R2.36 BrC1=CC2=C(C=CO2)C=C1 Z1198180633 [1,0,0,0,0,0|2,0,0]=3 141 B11R2.36 BrC1=CC2=C(C=CS2)C=C1 Z1269160602 [1,0,0,0,0,0|2,1,0]=4 142 B11R2.36 BrC1=CC2=C(N=C1)SC=C2 Z1269204905 [1,0,0,0,0,0|3,0,0]=4 143 B11R2.36 BrC1=CC2=C(N=C1)SC=N2 Z1269127152 [1,0,0,0,0,0|3,0,0]=4 144 B11R2.36 CC1=CC2=C(C=C1)N=CN2 Z3234957798 [1,0,0,0,0,0|3,0,0]=4 145 B11R2.36 CC1=CC2=C(C=C1)N=CS2 Z1198156828 [1,0,0,0,0,0|2,1,0]=4 146 B11R2.36 CC1=CC2=C(C=C1)NC=C2 Z979311300 [1,0,0,0,0,0|3,0,0]=4 147 B11R2.36 CC1=CC2=C(C=C1)OC=C2 Z1198151070 [1,0,0,0,0,0|2,1,0]=4 148 B11R2.36 CC1=CC2=C(C=C1)OCO2 Z1255364672 [1,0,0,0,0,0|1,1,1]=4 149 B11R2.36 CC1=CC2=C(C=CN2)C=C1 Z384970524 [1,0,0,0,0,0|3,0,0]=4 150 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 Z1095352660 [1,0,0,0,0,0|3,0,0]=4 151 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 Z382723678 [1,0,0,0,0,0|3,0,0]=4 152 B11R2.36 FC1=CC2=C(C=C1)NC=C2 Z1160902020 [1,0,0,0,0,0|3,0,0]=4 153 B11R2.36 FC1=CC2=C(C=CN2)C=C1 Z382723676 [1,0,0,0,0,0|3,0,0]=4 154 B11R2.36 IC1=CC2=C(C=C1)N=CN2 Z2757552913 [1,0,0,0,0,0|3,0,0]=4 155 B11R2.36 IC1=CC2=C(C=C1)OCO2 Z381540748 [1,0,0,0,0,0|1,1,1]=4 156 B11R2.36 IC1=CC2=C(C=C1)SN=C2 Z1766014603 [1,0,0,0,0,0|3,0,0]=4 157 B11R2.36 NC1=CC2=C(C=C1)CCO2 Z1203579091 [1,0,0,0,0,0|2,0,1]=4 158 B11R2.36 NC1=CC2=C(C=C1)N=CO2 Z385373514 [1,0,0,0,0,0|2,0,0]=3 159 B11R2.36 NC1=CC2=C(C=C1)NC=C2 Z271138340 [1,0,0,0,0,0|3,0,0]=4 160 B11R2.36 NC1=CC2=C(C=C1)NC=N2 Z1741960823 [1,0,0,0,0,0|3,0,0]=4 161 B11R2.36 NC1=CC2=C(C=C1)SC=C2 Z119989090 [1,0,0,0,0,0|2,0,0]=3 162 B11R2.36 NC1=CC2=C(C=C1)SC=N2 Z425486860 [1,0,0,0,0,0|2,0,0]=3 163 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Z752239752 [1,0,0,0,0,0|3,0,0]=4 164 B11R2.36 NC1=CC2=C(C=CO2)C=C1 Z1198313503 [1,0,0,0,0,0|2,0,0]=3 165 B11R2.36 NC1=CC2=C(C=CS2)C=C1 Z2651578500 [1,0,0,0,0,0|2,1,0]=4 166 B11R2.36 OC1=CC2=C(C=C1)C=NN2 Z1198147845 [1,0,0,0,0,0|3,0,0]=4 167 B11R2.36 OC1=CC2=C(C=C1)C=NS2 Z1513829991 [1,0,0,0,0,0|2,1,0]=4 168 B11R2.36 OC1=CC2=C(C=C1)CCN2 Z3241260546 [1,0,0,0,0,0|2,0,1]=4 169 B11R2.36 OC1=CC2=C(C=C1)CNC2 Z2489383861 [1,0,0,0,0,0|3,0,0]=4 170 B11R2.36 OC1=CC2=C(C=C1)NC=C2 Z1203162319 [1,0,0,0,0,0|2,0,0]=3 171 B11R2.36 OC1=CC2=C(C=C1)NC=N2 Z1042386518 [1,0,0,0,0,0|2,0,0]=3 172 B11R2.36 OC1=CC2=C(C=C1)NN=C2 Z1209763128 [1,0,0,0,0,0|3,0,0]=4 173 B11R2.36 OC1=CC2=C(C=C1)OC=N2 Z1198313500 [1,0,0,0,0,0|1,1,0]=3 174 B11R2.36 OC1=CC2=C(C=C1)OCC2 Z1198182902 [1,0,0,0,0,0|1,1,1]=4 175 B11R2.36 OC1=CC2=C(C=C1)OCO2 Z104473678 [1,0,0,0,0,0|0,1,1]=3 176 B11R2.36 OC1=CC2=C(C=C1)SC=C2 Z1255397714 [1,0,0,0,0,0|1,0,0]=2 177 B11R2.36 OC1=CC2=C(C=C1)SN=C2 Z1513812276 [1,0,0,0,0,0|2,0,0]=3 178 B11R2.36 OC1=CC2=C(C=CN2)C=C1 Z1203162244 [1,0,0,0,0,0|2,0,0]=3 179 B11R2.36 OC1=CC2=C(N=C1)NC=C2 Z3215302164 [1,0,0,0,0,0|3,0,0]=4 180 B11R2.36 OC1=CC2=CC=NN2C=C1 Z1198176729 [1,0,0,0,0,0|3,0,0]=4 181 B11R2.36 OC1=CC2=NC=CN2C=C1 Z3270903809 [1,0,0,0,0,0|3,0,0]=4 182 B11R2.36 OC1=NC2=C(C=C1)NC=C2 Z1198317461 [1,0,0,0,0,0|3,0,0]=4 183 B13R2.43 CC1=CC2=C(C=C1)C=C(N2)C=O Z1255489598 [0,1,0,0,0,0|3,0,0]=4 184 B13R2.43 CC1=CC2=C(C=C1)C=C(O2)C=O Z1198335258 [0,1,0,0,0,0|2,0,0]=3 185 B13R2.43 CC1=CC2=C(C=C1)OC(=C2)C=O Z1079442806 [0,1,0,0,0,0|2,1,0]=4 186 B13R2.43 CC1=CC2=C(C=C1)SC(=N2)CN Z2680313744 [0,1,0,0,0,0|3,0,0]=4 187 B13R2.43 CC1=CC2=C(C=C1)SC(=N2)CO Z1255393536 [0,1,0,0,0,0|2,0,1]=4 188 B13R2.43 CNC1=NC2=C(S1)C=CC(=C2)Br Z412044510 [0,1,0,0,0,0|3,0,0]=4 189 B13R2.43 CSC1=NC2=C(S1)C=CC(=C2)Cl Z18552842 [0,1,0,0,0,0|2,1,0]=4 190 B13R2.43 NCC1=CC2=C(S1)C=CC(=C2)Br Z2375650208 [0,1,0,0,0,0|3,0,0]=4 191 B13R2.43 NCC1=NC2=C(N1)C=CC(=C2)O Z5004215696 [0,1,0,0,0,0|3,0,0]=4 192 B13R2.43 NCC1=NC2=C(O1)C=C(C=C2)Br Z2217033071 [0,1,0,0,0,0|3,0,0]=4 193 B13R2.43 NCC1=NC2=C(S1)C=CC(=C2)Cl Z319450042 [0,1,0,0,0,0|3,0,0]=4 194 B13R2.43 NNC1=NC2=C(S1)C=CC(=C2)Cl Z255150100 [0,1,0,0,0,0|3,0,0]=4 195 B13R2.43 O=CC1=CC2=C(N1)C=C(C=C2)Br Z228589116 [0,1,0,0,0,0|3,0,0]=4 196 B13R2.43 O=CC1=CC2=C(N1)C=C(C=C2)F Z1198305780 [0,1,0,0,0,0|3,0,0]=4 197 B13R2.43 O=CC1=CC2=C(N1)C=CC(=C2)Br Z1203159747 [0,1,0,0,0,0|3,0,0]=4 198 B13R2.43 O=CC1=CC2=C(N1)C=CC(=C2)Cl Z1198170786 [0,1,0,0,0,0|3,0,0]=4 199 B13R2.43 O=CC1=CC2=C(O1)C=C(C=C2)Br Z1416186426 [0,1,0,0,0,0|2,0,0]=3 200 B13R2.43 O=CC1=CC2=C(O1)C=C(C=C2)Cl Z2732565714 [0,1,0,0,0,0|2,0,0]=3 201 B13R2.43 O=CC1=CC2=C(O1)C=C(C=N2)Br Z1269129339 [0,1,0,0,0,0|3,0,0]=4 202 B13R2.43 O=CC1=CC2=C(O1)C=CC(=C2)Br Z1197664681 [0,1,0,0,0,0|2,1,0]=4 203 B13R2.43 O=CC1=CC2=C(O1)C=CC(=C2)Cl Z1198335266 [0,1,0,0,0,0|2,1,0]=4 204 B13R2.43 O=CC1=CC2=C(O1)C=CC(=C2)F Z1258932126 [0,1,0,0,0,0|2,1,0]=4 205 B13R2.43 O=CC1=CC2=C(S1)C=CC(=C2)Br Z1269192528 [0,1,0,0,0,0|2,0,0]=3 206 B13R2.43 O=CC1=CC2=C(S1)C=CC(=C2)Cl Z1201628726 [0,1,0,0,0,0|2,0,0]=3 207 B13R2.43 O=CC1=CC2=C(S1)C=CC(=N2)Cl Z2405055229 [0,1,0,0,0,0|3,0,0]=4 208 B13R2.43 O=CC1=NC2=C(O1)C=C(C=C2)F Z1198182539 [0,1,0,0,0,0|2,0,0]=3 209 B13R2.43 O=CC1=NC2=C(O1)C=CC(=C2)Br Z1269206620 [0,1,0,0,0,0|2,1,0]=4 210 B13R2.43 O=CC1=NC2=C(O1)C=CC(=C2)F Z1198182537 [0,1,0,0,0,0|2,1,0]=4 211 B13R2.43 O=CC1=NC2=C(S1)C=C(C=C2)Br Z1352941619 [0,1,0,0,0,0|2,1,0]=4 212 B13R2.43 O=CC1=NC2=C(S1)C=C(C=C2)F Z1255357354 [0,1,0,0,0,0|2,1,0]=4 213 B13R2.43 O=CC1=NC2=C(S1)C=CC(=C2)Br Z1101094230 [0,1,0,0,0,0|2,0,0]=3 214 B13R2.43 O=CC1=NC2=C(S1)C=CC(=C2)F Z1352941591 [0,1,0,0,0,0|2,0,0]=3 215 B13R2.43 OCC1=NC2=C(O1)C=C(C=C2)F Z1416203144 [0,1,0,0,0,0|2,0,1]=4 216 B13R2.43 OCC1=NC2=C(S1)C=CC(=C2)Cl Z228584310 [0,1,0,0,0,0|2,0,1]=4 217 B13R2.2121 CC1=NC2=C(O1)C=C(C=C2)C=O Z1322794612 [0,1,0,0,0,0|2,0,1]=4 218 B13R2.2121 CC1=NC2=C(S1)C=C(C=C2)CO Z56823516 [0,1,0,0,0,0|2,1,0]=4 219 B13R2.2121 CC1=NC2=C(S1)C=CC(=C2)C=O Z56756341 [0,1,0,0,0,0|2,0,1]=4 220 B13R2.2121 CC1=NC2=C(S1)C=CC(=C2)CO Z56824171 [0,1,0,0,0,0|2,0,0]=3 221 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)C Z90123542 [0,1,0,0,0,0|2,1,0]=4 222 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)N Z56756338 [0,1,0,0,0,0|2,1,0]=4 223 B13R2.2121 COC1=CC2=C(C=C1)NC(=C2)C Z1197882538 [0,1,0,0,0,0|3,0,0]=4 224 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)C Z1587257377 [0,1,0,0,0,0|3,0,0]=4 225 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)N Z1198160975 [0,1,0,0,0,0|3,0,0]=4 226 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)S Z221604426 [0,1,0,0,0,0|2,1,0]=4 227 B13R2.2121 COC1=CC2=C(C=C1)OC(=N2)N Z1255435333 [0,1,0,0,0,0|2,1,0]=4 228 B13R2.2121 COC1=NC=C2CC(=O)NC2=C1 Z1198180903 [0,1,0,0,0,0|3,0,0]=4 229 B13R2.2121 N#CC1=CC2=C(C=C1)CC(=O)N2 Z1201621656 [0,1,0,0,0,0|3,0,0]=4 230 B13R2.2121 N#CC1=CC2=C(C=C1)N=C(O2)N Z1862023191 [0,1,0,0,0,0|3,0,0]=4 231 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)C2 Z336286144 [0,1,0,0,0,0|3,0,0]=4 232 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)N2 Z1198169635 [0,1,0,0,0,0|3,0,0]=4 233 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)O2 Z1255403754 [0,1,0,0,0,0|2,0,0]=3 234 B13R2.2121 N#CC1=CC2=C(C=C1)OC(=O)N2 Z1255399985 [0,1,0,0,0,0|2,1,0]=4 235 B13R2.2121 N#CC1=CC2=C(C=C1)SC(=N2)S Z2234170000 [0,1,0,0,0,0|2,1,0]=4 236 B13R2.2121 N#CC1=CC2=C(C=C1)SC(=O)N2 Z1862024907 [0,1,0,0,0,0|2,0,0]=3 237 B13R2.2121 NC1=NC2=C(N1)C=CC(=C2)CO Z1263714733 [0,1,0,0,0,0|3,0,0]=4 238 B13R2.2121 NC1=NC2=C(O1)C=C(C=C2)CO Z1262682792 [0,1,0,0,0,0|2,0,0]=3 239 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)C2 Z1431002537 [0,1,0,0,0,0|3,0,0]=4 240 B13R2.2121 NCC1=CC2=C(C=C1)OC(=O)N2 Z2753783365 [0,1,0,0,0,0|2,1,0]=4 241 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)N2 Z385370012 [0,1,0,0,0,0|2,0,1]=4 242 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)O2 Z385370014 [0,1,0,0,0,0|1,0,1]=3 243 B13R2.2121 O=CC1=CC2=C(C=C1)OC(=O)O2 Z1511745480 [0,1,0,0,0,0|0,1,1]=3 244 B13R2.3028 CC1=C(C2=C(N1)C=CC(=C2)O)C Z1509154773 [0,1,0,0,0,0|3,0,0]=4 245 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O Z56899023 [0,1,0,0,0,0|3,0,0]=4 246 B13R2.3028 CC1C(=O)NC2=C1C=C(C=C2)N Z442035298 [0,1,0,0,0,0|3,0,0]=4 247 B13R2.3028 CC1C(=O)NC2=C1C=C(C=C2)O Z1198169095 [0,1,0,0,0,0|2,0,0]=3 248 B13R2.3028 CN1C(=O)NC2=C1C=C(C=C2)Br Z1504682191 [0,1,0,0,0,0|3,0,0]=4 249 B13R2.3028 CN1C(=O)NC2=C1C=C(C=C2)N Z1981870338 [0,1,0,0,0,0|3,0,0]=4 250 B13R2.3028 CN1C(=O)OC2=C1C=C(C=C2)I Z1343941255 [0,1,0,0,0,0|2,1,0]=4 251 B13R2.3028 CN1C(=O)OC2=C1C=C(C=C2)N Z424795770 [0,1,0,0,0,0|2,1,0]=4 252 B13R2.3028 CN1C(=O)SC2=C1C=C(C=C2)N Z1262647048 [0,1,0,0,0,0|2,0,0]=3 253 B13R2.3028 NC1C(=O)NC2=C1C=C(C=C2)Cl Z1270210921 [0,1,0,0,0,0|3,0,0]=4 254 B13R2.3028 NC1C(=O)NC2=C1C=C(C=C2)F Z3243412944 [0,1,0,0,0,0|3,0,0]=4 255 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Br Z57833927 [0,1,0,0,0,0|3,0,0]=4 256 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Cl Z56899110 [0,1,0,0,0,0|3,0,0]=4 257 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)F Z56837144 [0,1,0,0,0,0|3,0,0]=4 258 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)I Z247609704 [0,1,0,0,0,0|3,0,0]=4 259 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)O Z1198280387 [0,1,0,0,0,0|2,0,0]=3 260 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)Br Z235447292 [0,1,0,0,0,0|3,0,0]=4 261 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)F Z335244996 [0,1,0,0,0,0|3,0,0]=4 262 B13R2.3050 CC1=C(C2=C(C=C1)NC(=O)N2)Br Z1551949017 [0,1,0,0,0,0|3,0,0]=4 263 B13R2.3050 CC1=C(C2=C(C=C1)SC(=N2)N)C Z275138808 [0,1,0,0,0,0|3,0,0]=4 264 B13R2.3050 CC1=C(C=CC2=C1NC(=O)C2)Br Z1269161601 [0,1,0,0,0,0|3,0,0]=4 265 B13R2.3050 CC1=C2N=C(SC2=CC=C1Cl)N Z1741967087 [0,1,0,0,0,0|3,0,0]=4 266 B13R2.3050 CC1=C2NC(=O)OC2=CC=C1Br Z1551955902 [0,1,0,0,0,0|2,1,0]=4 267 B13R2.3050 CC1=CC2=C(N1)C=CC(=C2F)O Z1198172122 [0,1,0,0,0,0|3,0,0]=4 268 B13R2.3050 CC1=NC2=C(S1)C=CC(=C2N)Cl Z1262646775 [0,1,0,0,0,0|3,0,0]=4 269 B13R2.3050 NC1=NC2=C(S1)C=CC(=C2Cl)Cl Z57603637 [0,1,0,0,0,0|3,0,0]=4 270 B13R2.3050 NC1=NC2=C(S1)C=CC(=C2F)Cl Z1601562526 [0,1,0,0,0,0|3,0,0]=4 271 B13R2.3050 O=C1CC2=C(N1)C(=C(C=C2)Br)F Z3244825035 [0,1,0,0,0,0|3,0,0]=4 272 B13R2.3050 O=C1CC2=C(N1)C=CC(=C2F)O Z1198223512 [0,1,0,0,0,0|2,0,0]=3 273 B13R2.3050 O=C1NC2=CC=C(C(=C2O1)F)Br Z3847811868 [0,1,0,0,0,0|2,0,0]=3 274 B13R2.3050 O=C1NC2=CC=C(C(=C2O1)F)I Z5209174207 [0,1,0,0,0,0|2,0,0]=3 275 B13R2.5190 CC1=CC2=C(C=C1)C(=O)C(=O)N2 Z274364524 [0,1,0,0,0,0|3,0,0]=4 276 B13R2.5190 CC1=CC2=C(C=C1)N(C(=O)C2)C Z1813125838 [0,1,0,0,0,0|3,0,0]=4 277 B13R2.5190 CC1=CC2=C(N1C)C=CC(=C2)O Z1198161075 [0,1,0,0,0,0|3,0,0]=4 278 B13R2.5190 CC1=NC2=C(N1C)C=CC(=C2)O Z1255488408 [0,1,0,0,0,0|3,0,0]=4 279 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)Br Z56921150 [0,1,0,0,0,0|3,0,0]=4 280 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)Cl Z1255364078 [0,1,0,0,0,0|3,0,0]=4 281 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)N Z1901070872 [0,1,0,0,0,0|3,0,0]=4 282 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)O Z1255384169 [0,1,0,0,0,0|2,0,0]=3 283 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)S Z361892540 [0,1,0,0,0,0|2,1,0]=4 284 B13R2.5190 CN1C(=O)NC2=C1C=CC(=C2)Cl Z1509147664 [0,1,0,0,0,0|3,0,0]=4 285 B13R2.5190 CN1C(=O)NC2=C1C=CC(=C2)N Z1262624542 [0,1,0,0,0,0|3,0,0]=4 286 B13R2.5190 CN1C(=O)OC2=C1C=CC(=C2)Br Z952016252 [0,1,0,0,0,0|2,0,0]=3 287 B13R2.5190 CN1C(=O)OC2=C1C=CC(=C2)N Z802845692 [0,1,0,0,0,0|2,0,0]=3 288 B13R2.5190 NC1C(=O)NC2=C1C=CC(=C2)Br Z4198432889 [0,1,0,0,0,0|3,0,0]=4 289 B13R2.5190 NC1C(=O)NC2=C1C=CC(=C2)Cl Z3868711859 [0,1,0,0,0,0|3,0,0]=4 290 B13R2.5190 NC1C(=O)NC2=C1C=CC(=C2)F Z2768189190 [0,1,0,0,0,0|3,0,0]=4 291 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)Br Z199464140 [0,1,0,0,0,0|3,0,0]=4 292 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)Cl Z440599648 [0,1,0,0,0,0|3,0,0]=4 293 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)F Z104511010 [0,1,0,0,0,0|3,0,0]=4 294 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)I Z1269200560 [0,1,0,0,0,0|3,0,0]=4 295 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)O Z432087574 [0,1,0,0,0,0|2,0,0]=3 296 B13R2.5190 O=C1NC2=C(C1O)C=CC(=C2)Br Z235448248 [0,1,0,0,0,0|3,0,0]=4 297 B13R2.5190 O=C1NC2=C(C1O)C=CC(=C2)F Z335245186 [0,1,0,0,0,0|3,0,0]=4 298 B13R2.5397 CC1=C2NC(=O)CC2=CC(=C1)Br Z1269112518 [0,1,0,0,0,0|3,0,0]=4 299 B13R2.5397 CC1=C2OC(=O)NC2=CC(=C1)Br Z1098334149 [0,1,0,0,0,0|2,1,0]=4 300 B13R2.5397 CC1=C2OC(=O)NC2=CC(=C1)Cl Z979487988 [0,1,0,0,0,0|2,1,0]=4 301 B13R2.5397 CC1=C2OC(=O)SC2=CC(=C1)O Z1551943232 [0,1,0,0,0,0|0,2,0]=3 302 B13R2.5397 CC1=C2SC(=O)OC2=CC(=C1)O Z1513830609 [0,1,0,0,0,0|0,0,0]=1 303 B13R2.5397 CC1=CC(=C2CC(=O)NC2=C1)C Z1255424565 [0,1,0,0,0,0|3,0,0]=4 304 B13R2.5397 NC1=CC2=C(OC(=O)N2)C(=C1)F Z1251362941 [0,1,0,0,0,0|2,1,0]=4 305 B13R2.5397 O=C1NC2=C(C=C(C=C2O1)Br)Cl Z1269174940 [0,1,0,0,0,0|2,0,0]=3 306 B13R2.5397 O=C1NC2=C(N1)C(=CC(=C2)Cl)Cl Z1269218830 [0,1,0,0,0,0|3,0,0]=4 307 B13R2.5397 O=C1NC2=C(N1)C(=CC(=C2)F)Br Z1551955752 [0,1,0,0,0,0|3,0,0]=4 308 B13R2.5397 O=C1NC2=C(S1)C=C(C=C2Br)F Z1269150068 [0,1,0,0,0,0|2,1,0]=4 309 B13R2.5397 O=C1NC2=CC(=CC(=C2O1)Cl)Br Z979487996 [0,1,0,0,0,0|2,1,0]=4 310 B13R2.5397 O=C1NC2=CC(=CC(=C2O1)F)Br Z979488000 [0,1,0,0,0,0|2,1,0]=4 311 B13R2.5397 O=C1OC2=C(S1)C(=CC(=C2)O)O Z1513858138 [0,1,0,0,0,0|0,0,0]=1 312 B13R2.5397 O=C1OC2=C(S1)C=C(C=C2Br)O Z1551936664 [0,1,0,0,0,0|0,2,0]=3 313 B13R2.5397 O=C1OC2=C(S1)C=C(C=C2Cl)O Z1551930326 [0,1,0,0,0,0|0,2,0]=3 314 B13R2.13083 CC1=C(C=C2N=C(SC2=C1)N)F Z1198180698 [0,1,0,0,0,0|3,0,0]=4 315 B13R2.13083 CC1=C(C=C2N=C(SC2=C1)N)N Z277112732 [0,1,0,0,0,0|3,0,0]=4 316 B13R2.13083 CC1=C(C=C2SC(=NC2=C1)N)C Z56772511 [0,1,0,0,0,0|3,0,0]=4 317 B13R2.13083 CC1=C(C=C2SC(=NC2=C1)N)F Z1681348700 [0,1,0,0,0,0|3,0,0]=4 318 B13R2.13083 CC1=CC2=C(C=C1C)SC(=N2)C Z56922109 [0,1,0,0,0,0|3,0,0]=4 319 B13R2.13083 CC1=NC2=C(S1)C=C(C(=C2)Cl)N Z1262629529 [0,1,0,0,0,0|3,0,0]=4 320 B13R2.13083 FC1=C(C=C2SC(=NC2=C1)S)Br Z3184890103 [0,1,0,0,0,0|2,1,0]=4 321 B13R2.13083 NC1=C(C=C2NC(=O)CC2=C1)Cl Z335455232 [0,1,0,0,0,0|3,0,0]=4 322 B13R2.13083 NC1=C(C=C2NC(=O)NC2=C1)Br Z56895678 [0,1,0,0,0,0|3,0,0]=4 323 B13R2.13083 NC1=C(C=C2NC(=O)OC2=C1)F Z1262644575 [0,1,0,0,0,0|2,0,0]=3 324 B13R2.13083 NC1=C(C=C2SC(=O)OC2=C1)O Z1551917573 [0,1,0,0,0,0|1,0,0]=2 325 B13R2.13083 NC1=NC2=C(S1)C=C(C(=C2)F)Br Z1629735523 [0,1,0,0,0,0|3,0,0]=4 326 B13R2.13083 NC1=NC2=C(S1)C=C(C(=C2)F)F Z1262246177 [0,1,0,0,0,0|3,0,0]=4 327 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)Br Z425365108 [0,1,0,0,0,0|3,0,0]=4 328 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)F Z1198234271 [0,1,0,0,0,0|3,0,0]=4 329 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)F)Br Z1629740138 [0,1,0,0,0,0|3,0,0]=4 330 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)Br)Br Z979712242 [0,1,0,0,0,0|3,0,0]=4 331 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)Br)Cl Z1470894503 [0,1,0,0,0,0|3,0,0]=4 332 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)Cl)F Z1255404205 [0,1,0,0,0,0|3,0,0]=4 333 B13R2.13083 O=C1NC2=CC(=C(C=C2N1)F)F Z235363045 [0,1,0,0,0,0|3,0,0]=4 334 B13R2.13083 O=C1NC2=CC(=C(C=C2O1)Br)F Z1416185624 [0,1,0,0,0,0|2,0,0]=3 335 B13R2.13083 O=C1NC2=CC(=C(C=C2O1)F)Br Z1495453869 [0,1,0,0,0,0|2,0,0]=3 336 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)Cl Z1513833014 [0,1,0,0,0,0|1,0,0]=2 337 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)I Z1551960387 [0,1,0,0,0,0|1,0,0]=2 338 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)O Z1551923954 [0,1,0,0,0,0|0,0,0]=1 339 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,0,1,0,0,0|3,0,0]=4 340 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,0,1,0,0,0|3,0,0]=4 341 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,0,1,0,0,0|3,0,0]=4 342 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,0,1,0,0,0|3,0,0]=4 343 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,0,1,0,0,0|3,0,0]=4 344 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,0,1,0,0,0|3,0,0]=4 345 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,0,1,0,0,0|2,0,0]=3 346 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,0,1,0,0,0|2,1,0]=4 347 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,0,1,0,0,0|1,1,0]=3 348 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,0,1,0,0,0|2,0,0]=3 349 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,0,1,0,0,0|3,0,0]=4 350 B11R1.20 CC1=NC=C(C=C1)CC(=O)O Z424795892 [0,0,1,0,0,0|3,0,0]=4 351 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,0,1,0,0,0|3,0,0]=4 352 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,0,1,0,0,0|3,0,0]=4 353 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,0,1,0,0,0|3,0,0]=4 354 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,0,1,0,0,0|3,0,0]=4 355 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,0,1,0,0,0|3,0,0]=4 356 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,0,1,0,0,0|3,0,0]=4 357 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,0,1,0,0,0|3,0,0]=4 358 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,0,1,0,0,0|3,0,0]=4 359 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,0,1,0,0,0|3,0,0]=4 360 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,0,1,0,0,0|2,0,0]=3 361 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,0,1,0,0,0|3,0,0]=4 362 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,0,1,0,0,0|2,0,0]=3 363 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,0,1,0,0,0|2,0,0]=3 364 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,0,1,0,0,0|2,0,0]=3 365 B11R1.20 O=C(O)CC1=CN=C(C=C1)Cl Z1165304038 [0,0,1,0,0,0|3,0,0]=4 366 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 Z1198338224 [0,0,1,0,0,0|2,0,1]=4 367 B11R1.20 O=C(O)CC1=NC=C(C=C1)F Z1945984141 [0,0,1,0,0,0|3,0,0]=4 368 B11R1.75 CC1=CC=C(S1)/C=C/C(=O)O Z2942853021 [0,0,1,0,0,0|3,0,0]=4 369 B11R1.75 O=C(O)/C=C/C1=CC=C(S1)Br Z2315579743 [0,0,1,0,0,0|3,0,0]=4 370 B11R1.75 O=C(O)/C=C/C1=CC=C(S1)Cl Z221300456 [0,0,1,0,0,0|3,0,0]=4 371 B11R1.81 CC1=CC(=C(C=C1)CC=O)C Z1020787114 [0,0,1,0,0,0|3,0,0]=4 372 B11R1.81 NCCC1=C(C=C(C=C1)O)O Z1166113553 [0,0,1,0,0,0|2,0,1]=4 373 B11R1.81 O=CCC1=C(C=C(C=C1)Cl)Cl Z1183459048 [0,0,1,0,0,0|3,0,0]=4 374 B11R1.81 O=CCC1=C(C=C(C=C1)F)Cl Z1183459114 [0,0,1,0,0,0|3,0,0]=4 375 B11R1.81 O=CCC1=C(C=C(C=C1)F)F Z1020790242 [0,0,1,0,0,0|3,0,0]=4 376 B11R1.81 OCCC1=C(C=C(C=C1)O)O Z1513827466 [0,0,1,0,0,0|1,0,2]=4 377 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [0,0,1,0,0,0|3,0,0]=4 378 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [0,0,1,0,0,0|3,0,0]=4 379 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [0,0,1,0,0,0|3,0,0]=4 380 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [0,0,1,0,0,0|3,0,0]=4 381 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [0,0,1,0,0,0|3,0,0]=4 382 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [0,0,1,0,0,0|3,0,0]=4 383 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [0,0,1,0,0,0|2,0,0]=3 384 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [0,0,1,0,0,0|2,0,1]=4 385 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [0,0,1,0,0,0|3,0,0]=4 386 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [0,0,1,0,0,0|3,0,0]=4 387 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [0,0,1,0,0,0|2,0,0]=3 388 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [0,0,1,0,0,0|3,0,0]=4 389 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [0,0,1,0,0,0|3,0,0]=4 390 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [0,0,1,0,0,0|3,0,0]=4 391 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [0,0,1,0,0,0|3,0,0]=4 392 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [0,0,1,0,0,0|2,0,0]=3 393 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [0,0,1,0,0,0|2,0,1]=4 394 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [0,0,1,0,0,0|2,1,0]=4 395 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [0,0,1,0,0,0|2,1,0]=4 396 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [0,0,1,0,0,0|2,1,0]=4 397 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [0,0,1,0,0,0|2,1,0]=4 398 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [0,0,1,0,0,0|2,1,0]=4 399 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [0,0,1,0,0,0|1,1,0]=3 400 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [0,0,1,0,0,0|2,1,0]=4 401 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [0,0,1,0,0,0|2,1,0]=4 402 B11R1.182 CC1=CC(=C(C=C1)C)CC=O Z993017798 [0,0,1,0,0,0|3,0,0]=4 403 B11R1.182 CCOC1=C(C=CC(=C1)O)N Z1837073495 [0,0,1,0,0,0|2,0,1]=4 404 B13R2.155 CC1=CC2=C(C=C1)C=CC(=C2)O Z1198184356 [0,0,0,0,0,1|3,0,0]=4 405 B13R2.155 CC1=CC2=C(C=C1)CCC(=O)N2 Z1255357756 [0,0,0,0,0,1|3,0,0]=4 406 B13R2.155 CC1=CC2=C(C=CC(=C2)O)N=C1 Z5038876053 [0,0,0,0,0,1|3,0,0]=4 407 B13R2.155 CC1=NC=C2C=CC(=CC2=C1)O Z5244902488 [0,0,0,0,0,1|3,0,0]=4 408 B13R2.155 NC1=CC2=C(C=C1)OCC(=O)N2 Z147646768 [0,0,0,0,0,1|2,1,0]=4 409 B13R2.155 NC1=CC2=C(C=C1)SCC(=O)N2 Z57472207 [0,0,0,0,0,1|2,0,0]=3 410 B13R2.155 O=C1C=CC2=C(N1)C=C(C=C2)Cl Z2010010271 [0,0,0,0,0,1|3,0,0]=4 411 B13R2.155 O=C1C=CC2=C(N1)C=C(C=C2)O Z1198164610 [0,0,0,0,0,1|2,0,0]=3 412 B13R2.155 O=C1C=CC2=C(O1)C=C(C=C2)O Z57150899 [0,0,0,0,0,1|1,0,0]=2 413 B13R2.155 O=C1C=NC2=C(N1)C=C(C=C2)Cl Z1198224613 [0,0,0,0,0,1|3,0,0]=4 414 B13R2.155 O=C1CC2=C(C=CC(=C2)Br)CN1 Z1813375979 [0,0,0,0,0,1|3,0,0]=4 415 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)Br Z1262475341 [0,0,0,0,0,1|3,0,0]=4 416 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)Cl Z1198183609 [0,0,0,0,0,1|3,0,0]=4 417 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)F Z285201176 [0,0,0,0,0,1|3,0,0]=4 418 B13R2.155 O=C1CCC2=C(N1)C=C(C=C2)O Z1255450792 [0,0,0,0,0,1|2,0,0]=3 419 B13R2.155 O=C1CNC2=C(N1)C=C(C=C2)F Z558637624 [0,0,0,0,0,1|3,0,0]=4 420 B13R2.155 O=C1COC2=C(C1)C=C(C=C2)Br Z1269182618 [0,0,0,0,0,1|2,1,0]=4 421 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Br Z227266368 [0,0,0,0,0,1|2,1,0]=4 422 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)Cl Z57515847 [0,0,0,0,0,1|2,1,0]=4 423 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)F Z1255450712 [0,0,0,0,0,1|2,1,0]=4 424 B13R2.155 O=C1COC2=C(N1)C=C(C=C2)O Z1255458499 [0,0,0,0,0,1|1,1,0]=3 425 B13R2.155 O=C1CSC2=C(N1)C=C(C=N2)Br Z1762890066 [0,0,0,0,0,1|3,0,0]=4 426 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)Br Z2751295691 [0,0,0,0,0,1|2,0,0]=3 427 B13R2.155 O=C1NCC2=C(O1)C=C(C=C2)O Z2963142130 [0,0,0,0,0,1|1,0,0]=2 428 B13R2.155 OC1=CC2=C(C=C1)C=CC(=C2)O Z104495344 [0,0,0,0,0,1|2,0,1]=4 429 B13R2.155 OC1=CC2=C(C=C1)N=CC(=C2)Br Z1269182939 [0,0,0,0,0,1|3,0,0]=4 430 B13R2.155 OC1=CC2=C(C=C1)N=CC(=C2)I Z1269226225 [0,0,0,0,0,1|3,0,0]=4 431 B13R2.3683 CC1=CC2=C(C=C1)C=C(C=C2)O Z1198148710 [0,0,0,0,0,1|3,0,0]=4 432 B13R2.3683 CC1=CC2=CNC(=O)C=C2C=C1 Z1509179839 [0,0,0,0,0,1|3,0,0]=4 433 B13R2.3683 CC1=NC2=C(C=C1)C=C(C=C2)O Z1201618122 [0,0,0,0,0,1|3,0,0]=4 434 B13R2.3683 CC1=NC2=C(C=C1)NC(=O)CO2 Z1509337017 [0,0,0,0,0,1|3,0,0]=4 435 B13R2.3683 CC1=NC=C2C=C(C=CC2=C1)O Z5141162648 [0,0,0,0,0,1|3,0,0]=4 436 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 Z285150736 [0,0,0,0,0,1|3,0,0]=4 437 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CO2 Z285498242 [0,0,0,0,0,1|2,0,0]=3 438 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 Z56754502 [0,0,0,0,0,1|2,1,0]=4 439 B13R2.3683 NC1=CC2=C(N=C1)NC(=O)CO2 Z3477389166 [0,0,0,0,0,1|3,0,0]=4 440 B13R2.3683 O=C1C=NC2=C(N1)C=CC(=C2)Br Z1269154729 [0,0,0,0,0,1|3,0,0]=4 441 B13R2.3683 O=C1C=NC2=C(N1)C=CC(=C2)Cl Z1198166471 [0,0,0,0,0,1|3,0,0]=4 442 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)Br Z299596072 [0,0,0,0,0,1|3,0,0]=4 443 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)Cl Z586255942 [0,0,0,0,0,1|3,0,0]=4 444 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)F Z330795836 [0,0,0,0,0,1|3,0,0]=4 445 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)I Z1269172761 [0,0,0,0,0,1|3,0,0]=4 446 B13R2.3683 O=C1CCC2=C(N1)C=CC(=C2)O Z234893935 [0,0,0,0,0,1|2,0,0]=3 447 B13R2.3683 O=C1CCC2=C(O1)C=CC(=C2)Br Z1269147954 [0,0,0,0,0,1|2,1,0]=4 448 B13R2.3683 O=C1CCC2=C(O1)C=CC(=C2)O Z1513805017 [0,0,0,0,0,1|1,1,0]=3 449 B13R2.3683 O=C1CNC2=C(N1)C=CC(=C2)Br Z1269175847 [0,0,0,0,0,1|3,0,0]=4 450 B13R2.3683 O=C1CNC2=C(N1)C=CC(=C2)O Z1255398014 [0,0,0,0,0,1|2,0,0]=3 451 B13R2.3683 O=C1COC2=C(N1)C=CC(=C2)Br Z235338061 [0,0,0,0,0,1|2,0,0]=3 452 B13R2.3683 O=C1COC2=C(N1)C=CC(=C2)Cl Z1198161300 [0,0,0,0,0,1|2,0,0]=3 453 B13R2.3683 O=C1COC2=C(N1)C=CC(=C2)F Z1198173830 [0,0,0,0,0,1|2,0,0]=3 454 B13R2.3683 O=C1COC2=C(N1)N=CC(=C2)F Z1551922808 [0,0,0,0,0,1|3,0,0]=4 455 B13R2.3683 O=C1CSC2=C(N1)C=CC(=C2)Cl Z56974851 [0,0,0,0,0,1|2,1,0]=4 456 B13R2.3683 O=C1NC2=C(C=C(C=C2)Br)CO1 Z1269239432 [0,0,0,0,0,1|2,0,0]=3 457 B13R2.3683 O=C1NC2=C(C=C(C=N2)Br)CO1 Z1269136119 [0,0,0,0,0,1|3,0,0]=4 458 B13R2.3683 O=C1NCC2=C(N1)C=CC(=C2)Br Z1269196478 [0,0,0,0,0,1|3,0,0]=4 459 B13R2.3683 O=C1NCC2=C(O1)C=CC(=C2)Br Z1269142316 [0,0,0,0,0,1|2,1,0]=4 460 B13R2.3683 OC1=CC2=C(C=C1)C=C(C=C2)Br Z57074412 [0,0,0,0,0,1|3,0,0]=4 461 B13R2.3683 OC1=CC2=C(C=C1)C=C(C=C2)O Z1255382953 [0,0,0,0,0,1|2,0,1]=4 462 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,0,1,0,0,0|2,0,0]=4 463 B10R1.1 O/N=C/C1=CC=C(C=C1)O Z49568314 [1,0,1,0,0,0|2,0,0]=4 464 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,0,1,0,0,0|2,0,0]=4 465 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,0,1,0,0,0|2,0,0]=4 466 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,0,1,0,0,0|2,0,0]=4 467 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,0,1,0,0,0|1,0,0]=3 468 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [1,0,1,0,0,0|1,0,1]=4 469 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,1,0,0,0|2,0,0]=4 470 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,1,0,0,0|2,0,0]=4 471 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,1,0,0,0|1,0,0]=3 472 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [1,0,1,0,0,0|2,0,0]=4 473 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [1,0,1,0,0,0|2,0,0]=4 474 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,1,0,0,0|2,0,0]=4 475 B10R1.66 O=C(O)/C=C/C1=CC=CS1 Z56855126 [1,0,1,0,0,0|2,0,0]=4 476 B10R1.66 O=C(O)/C=C/C1=CN=CS1 Z1198166918 [1,0,1,0,0,0|2,0,0]=4 477 B10R1.66 O=C(O)/C=C/C1=COC=N1 Z2633786305 [1,0,1,0,0,0|2,0,0]=4 478 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,0,1,0,0,0|2,0,0]=4 479 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,0,1,0,0,0|2,0,0]=4 480 B10R1.4 CCSC1=C(C=CC=C1)O Z905204460 [1,0,1,0,0,0|1,0,1]=4 481 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,0,1,0,0,0|2,0,0]=4 482 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,0,1,0,0,0|2,0,0]=4 483 B10R1.25 CC1=C(C=CC(=C1)Br)C=O Z1079442722 [1,0,1,0,0,0|2,0,0]=4 484 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O Z1201621733 [1,0,1,0,0,0|2,0,0]=4 485 B10R1.25 CC1=C(C=CC(=C1)F)C=O Z853084730 [1,0,1,0,0,0|2,0,0]=4 486 B10R1.25 CC1=C(C=CC(=C1)O)C=O Z1161074806 [1,0,1,0,0,0|1,0,0]=3 487 B10R1.25 CC1=C(C=NC(=C1)O)C=O Z1486001188 [1,0,1,0,0,0|2,0,0]=4 488 B10R1.25 CC1=CC(=C(C=C1)C=O)Br Z1255427913 [1,0,1,0,0,0|2,0,0]=4 489 B10R1.25 CC1=CC(=C(C=C1)C=O)C Z104479608 [1,0,1,0,0,0|2,0,0]=4 490 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl Z1198280103 [1,0,1,0,0,0|2,0,0]=4 491 B10R1.25 CC1=CC(=C(C=C1)C=O)F Z732814038 [1,0,1,0,0,0|2,0,0]=4 492 B10R1.25 CC1=CC(=C(C=C1)C=O)N Z1198276968 [1,0,1,0,0,0|2,0,0]=4 493 B10R1.25 CC1=CC(=C(C=C1)C=O)O Z1203159482 [1,0,1,0,0,0|1,0,0]=3 494 B10R1.25 CCC1=C(C=C(C=C1)O)O Z104499414 [1,0,1,0,0,0|1,0,1]=4 495 B10R1.25 CSC1=C(C=C(C=C1)O)Br Z1269227695 [1,0,1,0,0,0|1,0,1]=4 496 B10R1.25 CSC1=C(C=C(C=C1)O)C Z277164168 [1,0,1,0,0,0|1,0,1]=4 497 B10R1.25 N#CC1=C(C=C(C=C1)O)O Z1255361029 [1,0,1,0,0,0|1,0,1]=4 498 B10R1.25 NC1=CC(=C(C=C1)C=O)Cl Z1206884716 [1,0,1,0,0,0|2,0,0]=4 499 B10R1.25 NCC1=C(C=C(C=C1)O)O Z2350903951 [1,0,1,0,0,0|1,0,1]=4 500 B10R1.25 O=CC1=C(C=C(C=C1)Br)Br Z1269133882 [1,0,1,0,0,0|2,0,0]=4 501 B10R1.25 O=CC1=C(C=C(C=C1)Br)Cl Z1079442724 [1,0,1,0,0,0|2,0,0]=4 502 B10R1.25 O=CC1=C(C=C(C=C1)Br)F Z104486154 [1,0,1,0,0,0|2,0,0]=4 503 B10R1.25 O=CC1=C(C=C(C=C1)Br)I Z1269178376 [1,0,1,0,0,0|2,0,0]=4 504 B10R1.25 O=CC1=C(C=C(C=C1)Br)O Z405051414 [1,0,1,0,0,0|1,0,0]=3 505 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Br Z1269165294 [1,0,1,0,0,0|2,0,0]=4 506 B10R1.25 O=CC1=C(C=C(C=C1)Cl)Cl Z57127525 [1,0,1,0,0,0|2,0,0]=4 507 B10R1.25 O=CC1=C(C=C(C=C1)Cl)F Z1079442614 [1,0,1,0,0,0|2,0,0]=4 508 B10R1.25 O=CC1=C(C=C(C=C1)Cl)O Z1201623478 [1,0,1,0,0,0|1,0,0]=3 509 B10R1.25 O=CC1=C(C=C(C=C1)F)Br Z1079442442 [1,0,1,0,0,0|2,0,0]=4 510 B10R1.25 O=CC1=C(C=C(C=C1)F)Cl Z1079442562 [1,0,1,0,0,0|2,0,0]=4 511 B10R1.25 O=CC1=C(C=C(C=C1)F)F Z104495222 [1,0,1,0,0,0|2,0,0]=4 512 B10R1.25 O=CC1=C(C=C(C=C1)F)I Z1269211883 [1,0,1,0,0,0|2,0,0]=4 513 B10R1.25 O=CC1=C(C=C(C=C1)F)O Z1201622454 [1,0,1,0,0,0|1,0,0]=3 514 B10R1.25 O=CC1=C(C=C(C=C1)I)Cl Z1269135461 [1,0,1,0,0,0|2,0,0]=4 515 B10R1.25 O=CC1=C(C=C(C=C1)O)Br Z622749802 [1,0,1,0,0,0|1,0,0]=3 516 B10R1.25 O=CC1=C(C=C(C=C1)O)Cl Z1255419357 [1,0,1,0,0,0|1,0,0]=3 517 B10R1.25 O=CC1=C(C=C(C=C1)O)F Z1201623850 [1,0,1,0,0,0|1,0,0]=3 518 B10R1.25 O=CC1=C(C=C(C=C1)O)O Z104497974 [1,0,1,0,0,0|0,0,0]=2 519 B10R1.25 O=CC1=C(C=C(C=N1)Br)O Z1269226619 [1,0,1,0,0,0|2,0,0]=4 520 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,0,1,0,0,0|2,0,0]=4 521 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,0,1,0,0,0|2,0,0]=4 522 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,0,1,0,0,0|2,0,0]=4 523 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,0,1,0,0,0|2,0,0]=4 524 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,0,1,0,0,0|1,0,0]=3 525 B10R1.30 CC1=C(C=C(C=C1)Br)C=O Z871801782 [1,0,1,0,0,0|2,0,0]=4 526 B10R1.30 CC1=C(C=C(C=C1)Cl)C=O Z871801780 [1,0,1,0,0,0|2,0,0]=4 527 B10R1.30 CC1=C(C=C(C=C1)F)C=O Z1080470282 [1,0,1,0,0,0|2,0,0]=4 528 B10R1.30 CC1=CC(=C(C=C1)Br)C=O Z871833034 [1,0,1,0,0,0|2,0,0]=4 529 B10R1.30 CC1=CC(=C(C=C1)C)C=O Z104479610 [1,0,1,0,0,0|2,0,0]=4 530 B10R1.30 CC1=CC(=C(C=C1)Cl)C=O Z871801784 [1,0,1,0,0,0|2,0,0]=4 531 B10R1.30 CC1=CC(=C(C=C1)F)C=O Z732814056 [1,0,1,0,0,0|2,0,0]=4 532 B10R1.30 CC1=CC(=C(C=C1)O)C=O Z274774390 [1,0,1,0,0,0|1,1,0]=4 533 B10R1.30 COC1=C(C=CC(=C1)O)Br Z1258567775 [1,0,1,0,0,0|1,0,1]=4 534 B10R1.30 COC1=C(C=CC(=C1)O)N Z2574932955 [1,0,1,0,0,0|1,0,1]=4 535 B10R1.30 NC1=C(C=C(C=C1)Br)C=O Z1269131915 [1,0,1,0,0,0|2,0,0]=4 536 B10R1.30 O=CC1=C(C=CC(=C1)Br)Br Z385370000 [1,0,1,0,0,0|2,0,0]=4 537 B10R1.30 O=CC1=C(C=CC(=C1)Br)Cl Z871801788 [1,0,1,0,0,0|2,0,0]=4 538 B10R1.30 O=CC1=C(C=CC(=C1)Br)F Z104482596 [1,0,1,0,0,0|2,0,0]=4 539 B10R1.30 O=CC1=C(C=CC(=C1)Br)I Z1269213434 [1,0,1,0,0,0|2,0,0]=4 540 B10R1.30 O=CC1=C(C=CC(=C1)Br)O Z57313901 [1,0,1,0,0,0|1,1,0]=4 541 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Br Z871833038 [1,0,1,0,0,0|2,0,0]=4 542 B10R1.30 O=CC1=C(C=CC(=C1)Cl)Cl Z871801786 [1,0,1,0,0,0|2,0,0]=4 543 B10R1.30 O=CC1=C(C=CC(=C1)Cl)F Z819785594 [1,0,1,0,0,0|2,0,0]=4 544 B10R1.30 O=CC1=C(C=CC(=C1)Cl)I Z1269163931 [1,0,1,0,0,0|2,0,0]=4 545 B10R1.30 O=CC1=C(C=CC(=C1)Cl)O Z57772439 [1,0,1,0,0,0|1,1,0]=4 546 B10R1.30 O=CC1=C(C=CC(=C1)F)Br Z1079442476 [1,0,1,0,0,0|2,0,0]=4 547 B10R1.30 O=CC1=C(C=CC(=C1)F)Cl Z1201622451 [1,0,1,0,0,0|2,0,0]=4 548 B10R1.30 O=CC1=C(C=CC(=C1)F)F Z385369882 [1,0,1,0,0,0|2,0,0]=4 549 B10R1.30 O=CC1=C(C=CC(=C1)F)O Z415638796 [1,0,1,0,0,0|1,1,0]=4 550 B10R1.30 O=CC1=C(C=CC(=C1)I)Br Z1269223795 [1,0,1,0,0,0|2,0,0]=4 551 B10R1.30 O=CC1=C(C=CC(=C1)I)Cl Z1269146293 [1,0,1,0,0,0|2,0,0]=4 552 B10R1.30 O=CC1=C(C=CC(=C1)O)Br Z1269171271 [1,0,1,0,0,0|1,0,0]=3 553 B10R1.30 O=CC1=C(C=CC(=C1)O)Cl Z1198174868 [1,0,1,0,0,0|1,0,0]=3 554 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [1,0,1,0,0,0|0,1,0]=3 555 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [2,0,0,0,0,0|2,0,0]=4 556 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [2,0,0,0,0,0|2,0,0]=4 557 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [2,0,0,0,0,0|2,0,0]=4 558 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [2,0,0,0,0,0|1,0,0]=3 559 B10R2.7 C1=CC2=C(C=C1)OCC2 Z104505448 [2,0,0,0,0,0|1,0,1]=4 560 B10R2.7 C1=CC2=C(C=C1)ON=C2 Z220335556 [2,0,0,0,0,0|2,0,0]=4 561 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [2,0,0,0,0,0|1,0,0]=3 562 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [2,0,0,0,0,0|1,0,0]=3 563 B10R2.7 C1=CC2=C(C=C1)SN=N2 Z1198148806 [2,0,0,0,0,0|2,0,0]=4 564 B10R2.7 C1=CC2=C(C=CO2)N=C1 Z2831987589 [2,0,0,0,0,0|2,0,0]=4 565 B10R2.7 C1=CC2=C(C=CS2)C=N1 Z810507710 [2,0,0,0,0,0|2,0,0]=4 566 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,1,1,0,0,0|2,0,0]=4 567 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O Z274782844 [0,1,1,0,0,0|2,0,0]=4 568 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,1,1,0,0,0|2,0,0]=4 569 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [0,1,1,0,0,0|1,0,0]=3 570 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,1,1,0,0,0|2,0,0]=4 571 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,1,1,0,0,0|2,0,0]=4 572 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [0,1,1,0,0,0|1,1,0]=4 573 B12R1.4 COC1=CN=C(C=C1)CC(=O)O Z1913661249 [0,1,1,0,0,0|2,0,0]=4 574 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O Z1212966448 [0,1,1,0,0,0|1,1,0]=4 575 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)O Z362118788 [0,1,1,0,0,0|2,0,0]=4 576 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O Z1198269767 [0,1,1,0,0,0|1,0,1]=4 577 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,1,1,0,0,0|2,0,0]=4 578 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,1,1,0,0,0|2,0,0]=4 579 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Br Z1269160930 [0,1,1,0,0,0|2,0,0]=4 580 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)C Z56923286 [0,1,1,0,0,0|2,0,0]=4 581 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [0,1,1,0,0,0|2,0,0]=4 582 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [0,1,1,0,0,0|2,0,0]=4 583 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)Br Z1269233833 [0,1,1,0,0,0|2,0,0]=4 584 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,1,1,0,0,0|1,0,0]=3 585 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Br Z1269150510 [0,1,1,0,0,0|2,0,0]=4 586 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [0,1,1,0,0,0|2,0,0]=4 587 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)F Z1269111454 [0,1,1,0,0,0|2,0,0]=4 588 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [0,1,1,0,0,0|2,0,0]=4 589 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [0,1,1,0,0,0|2,0,0]=4 590 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Br Z285131564 [0,1,1,0,0,0|2,0,0]=4 591 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [0,1,1,0,0,0|2,0,0]=4 592 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)F Z362118708 [0,1,1,0,0,0|2,0,0]=4 593 B12R1.19 O=C(O)CC1=CC(=C(C=C1)I)Br Z1269147843 [0,1,1,0,0,0|2,0,0]=4 594 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,1,1,0,0,0|1,0,0]=3 595 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,1,1,0,0,0|1,0,0]=3 596 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,1,1,0,0,0|1,0,0]=3 597 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl Z1255421681 [0,1,1,0,0,0|2,0,0]=4 598 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,1,1,0,0,0|2,0,0]=4 599 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [0,1,1,0,0,0|2,0,0]=4 600 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [0,1,1,0,0,0|2,0,0]=4 601 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [0,1,1,0,0,0|2,0,0]=4 602 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [0,1,1,0,0,0|2,0,0]=4 603 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [0,1,1,0,0,0|2,0,0]=4 604 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O Z118430526 [0,1,1,0,0,0|2,0,0]=4 605 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [0,1,1,0,0,0|2,0,0]=4 606 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [0,1,1,0,0,0|2,0,0]=4 607 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,1,1,0,0,0|2,0,0]=4 608 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [0,1,1,0,0,0|2,0,0]=4 609 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [0,1,1,0,0,0|2,0,0]=4 610 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [0,1,1,0,0,0|2,0,0]=4 611 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,1,1,0,0,0|1,0,0]=3 612 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [0,1,1,0,0,0|2,0,0]=4 613 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,1,1,0,0,0|1,0,0]=3 614 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl Z381360896 [0,1,1,0,0,0|2,0,0]=4 615 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F Z381360860 [0,1,1,0,0,0|2,0,0]=4 616 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [0,1,1,0,0,0|1,0,0]=3 617 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [0,1,1,0,0,0|2,0,0]=4 618 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [0,1,1,0,0,0|2,0,0]=4 619 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [0,1,1,0,0,0|2,0,0]=4 620 B12R1.49 CC1=CC=C(C=C1)NC(=O)CO Z228585410 [0,1,1,0,0,0|2,0,0]=4 621 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,1,1,0,0,0|2,0,0]=4 622 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,1,1,0,0,0|2,0,0]=4 623 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [0,1,1,0,0,0|2,0,0]=4 624 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [0,1,1,0,0,0|2,0,0]=4 625 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [0,1,1,0,0,0|2,0,0]=4 626 B12R1.49 COC(=O)NC1=CC=C(C=C1)Br Z56758690 [0,1,1,0,0,0|2,0,0]=4 627 B12R1.49 COC(=O)NC1=CC=C(C=C1)N Z319610150 [0,1,1,0,0,0|2,0,0]=4 628 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,1,1,0,0,0|1,0,0]=3 629 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,1,1,0,0,0|2,0,0]=4 630 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [0,1,1,0,0,0|2,0,0]=4 631 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [0,1,1,0,0,0|2,0,0]=4 632 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [0,1,1,0,0,0|2,0,0]=4 633 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,1,1,0,0,0|1,0,0]=3 634 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,1,1,0,0,0|2,0,0]=4 635 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [0,1,1,0,0,0|2,0,0]=4 636 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl Z228585484 [0,1,1,0,0,0|2,0,0]=4 637 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O Z1269213926 [0,1,1,0,0,0|2,0,0]=4 638 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O Z982130478 [0,1,1,0,0,0|2,0,0]=4 639 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br Z1269232519 [0,1,1,0,0,0|2,0,0]=4 640 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)F Z1198183551 [0,1,1,0,0,0|2,0,0]=4 641 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl Z1269137680 [0,1,1,0,0,0|2,0,0]=4 642 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I Z1269231484 [0,1,1,0,0,0|2,0,0]=4 643 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O Z1269204929 [0,1,1,0,0,0|2,0,0]=4 644 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br Z1187934893 [0,1,1,0,0,0|2,0,0]=4 645 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl Z104477206 [0,1,1,0,0,0|2,0,0]=4 646 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br Z285184632 [0,1,1,0,0,0|2,0,0]=4 647 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Cl Z285184620 [0,1,1,0,0,0|2,0,0]=4 648 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F Z362118706 [0,1,1,0,0,0|2,0,0]=4 649 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [0,1,1,0,0,0|1,0,0]=3 650 B12R1.114 COC1=CC(=C(C=C1)CC=O)C Z1198313230 [0,1,1,0,0,0|2,0,0]=4 651 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [0,1,1,0,0,0|2,0,0]=4 652 B12R1.50 CNC(=O)OC1=CC(=CC=C1)O Z1509352023 [0,1,1,0,0,0|1,0,0]=3 653 B12R1.50 COC(=O)CC1=CC(=CC=C1)O Z816010254 [0,1,1,0,0,0|1,1,0]=4 654 B12R1.50 COC(=O)NC1=CC(=CC=C1)O Z335810160 [0,1,1,0,0,0|1,1,0]=4 655 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [0,1,1,0,0,0|1,1,0]=4 656 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)Br Z1269195529 [0,1,1,0,0,0|1,1,0]=4 657 B12R1.127 O=C(O)CC1=C(C=CC(=C1)O)Br Z1269121921 [0,1,1,0,0,0|1,1,0]=4 658 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [0,1,1,0,0,0|1,1,0]=4 659 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,1,1,0,0,0|1,1,0]=4 660 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [0,1,1,0,0,0|2,0,0]=4 661 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [0,1,1,0,0,0|2,0,0]=4 662 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [0,1,1,0,0,0|1,1,0]=4 663 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [0,1,1,0,0,0|2,0,0]=4 664 B12R2.18 CC1=C(C2=C(S1)C=CC=C2)Br Z1269212248 [1,1,0,0,0,0|2,0,0]=4 665 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [1,1,0,0,0,0|2,0,0]=4 666 B12R2.18 CN1C(=N)SC2=C1C=CC=C2 Z56812812 [1,1,0,0,0,0|2,0,0]=4 667 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [1,1,0,0,0,0|2,0,0]=4 668 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 Z57070418 [1,1,0,0,0,0|2,0,0]=4 669 B12R2.18 ClC1=C(C2=C(S1)C=CC=C2)Cl Z1269130316 [1,1,0,0,0,0|2,0,0]=4 670 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [1,1,0,0,0,0|2,0,0]=4 671 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [1,1,0,0,0,0|2,0,0]=4 672 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [1,1,0,0,0,0|2,0,0]=4 673 B12R2.18 O=C1SC2=C(C1=O)C=CC=C2 Z1198153623 [1,1,0,0,0,0|1,0,0]=3 674 B12R2.32 CNC1=NC2=C(O1)C=CC=C2 Z235341203 [1,1,0,0,0,0|2,0,0]=4 675 B12R2.32 CNC1=NC2=C(S1)C=CC=C2 Z235344695 [1,1,0,0,0,0|2,0,0]=4 676 B12R2.32 N#CC1=CC2=C(O1)C=CC=C2 Z381355152 [1,1,0,0,0,0|2,0,0]=4 677 B12R2.32 N#CC1=NC2=C(O1)C=CC=C2 Z1198309541 [1,1,0,0,0,0|2,0,0]=4 678 B12R2.32 NCC1=CC2=C(S1)C=CC=C2 Z57206121 [1,1,0,0,0,0|2,0,0]=4 679 B12R2.32 NCC1=NC2=C(O1)C=CC=C2 Z2106602610 [1,1,0,0,0,0|2,0,0]=4 680 B12R2.32 NCC1=NC2=C(S1)C=CC=C2 Z166630948 [1,1,0,0,0,0|2,0,0]=4 681 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [1,1,0,0,0,0|2,0,0]=4 682 B12R2.32 NNC1=NC2=C(S1)C=CC=C2 Z56756340 [1,1,0,0,0,0|2,0,0]=4 683 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [1,1,0,0,0,0|2,0,0]=4 684 B12R2.32 O=CC1=CC2=C(O1)C=CC=C2 Z147641868 [1,1,0,0,0,0|1,0,0]=3 685 B12R2.32 O=CC1=CC2=C(O1)C=CC=N2 Z1198330026 [1,1,0,0,0,0|2,0,0]=4 686 B12R2.32 O=CC1=CC2=C(O1)C=CN=C2 Z1255417643 [1,1,0,0,0,0|2,0,0]=4 687 B12R2.32 O=CC1=CC2=C(O1)N=CC=C2 Z1255505540 [1,1,0,0,0,0|2,0,0]=4 688 B12R2.32 O=CC1=CC2=C(S1)C=CC=C2 Z1741961424 [1,1,0,0,0,0|1,0,0]=3 689 B12R2.32 O=CC1=CC2=C(S1)C=CC=N2 Z1216823029 [1,1,0,0,0,0|2,0,0]=4 690 B12R2.32 O=CC1=CC2=C(S1)C=NC=C2 Z1198309374 [1,1,0,0,0,0|2,0,0]=4 691 B12R2.32 O=CC1=CC2=C(S1)N=CC=C2 Z1160905957 [1,1,0,0,0,0|2,0,0]=4 692 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [1,1,0,0,0,0|2,0,0]=4 693 B12R2.32 O=CC1=NC2=C(O1)C=CC=C2 Z1198162173 [1,1,0,0,0,0|1,0,0]=3 694 B12R2.32 O=CC1=NC2=C(S1)C=CC=C2 Z276151160 [1,1,0,0,0,0|1,0,0]=3 695 B12R2.32 O=CC1=NC2=C(S1)C=CN=C2 Z1352941603 [1,1,0,0,0,0|2,0,0]=4 696 B12R2.32 O=CC1=NC2=C(S1)N=CC=C2 Z1352941599 [1,1,0,0,0,0|2,0,0]=4 697 B12R2.32 OCC1=CC2=C(O1)C=CC=C2 Z164677912 [1,1,0,0,0,0|1,0,1]=4 698 B12R2.32 OCC1=CC2=C(S1)C=CC=C2 Z816841922 [1,1,0,0,0,0|1,0,1]=4 699 B12R2.32 OCC1=NC2=C(O1)C=CC=C2 Z431953250 [1,1,0,0,0,0|1,0,1]=4 700 B12R2.32 OCC1=NC2=C(S1)C=CC=C2 Z56899191 [1,1,0,0,0,0|1,0,1]=4 701 B12R2.202 BrC1=C2C=C(SC2=CC=C1)I Z3073514295 [1,1,0,0,0,0|2,0,0]=4 702 B12R2.202 BrC1=CC2=C(S1)C=CC=C2Br Z4063649916 [1,1,0,0,0,0|2,0,0]=4 703 B12R2.202 CC1=C2N=C(SC2=CC=C1)N Z56174289 [1,1,0,0,0,0|2,0,0]=4 704 B12R2.202 CC1=C2N=C(SC2=CC=C1)O Z1198163380 [1,1,0,0,0,0|1,0,1]=4 705 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [1,1,0,0,0,0|2,0,0]=4 706 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [1,1,0,0,0,0|2,0,0]=4 707 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [1,1,0,0,0,0|2,0,0]=4 708 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [1,1,0,0,0,0|1,0,0]=3 709 B12R2.202 CC1=C2SC(=NC2=CC=C1)N Z1262621975 [1,1,0,0,0,0|2,0,0]=4 710 B12R2.202 CC1=C2SC(=O)NC2=CC=C1 Z1198222422 [1,1,0,0,0,0|1,0,0]=3 711 B12R2.202 CC1=CC2=C(O1)C(=CC=C2)Br Z1269204422 [1,1,0,0,0,0|2,0,0]=4 712 B12R2.202 CC1=CC2=C(S1)C(=CC=C2)Br Z1269210790 [1,1,0,0,0,0|2,0,0]=4 713 B12R2.202 CC1=NC2=C(O1)C=CC=C2N Z1201624543 [1,1,0,0,0,0|2,0,0]=4 714 B12R2.202 FC1=C2N=C(OC2=CC=C1)S Z1869902596 [1,1,0,0,0,0|1,1,0]=4 715 B12R2.202 FC1=C2SC(=NC2=CC=C1)S Z1255424549 [1,1,0,0,0,0|1,1,0]=4 716 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [1,1,0,0,0,0|2,0,0]=4 717 B12R2.202 NC1=C2NC(=O)NC2=CC=C1 Z1741972722 [1,1,0,0,0,0|2,0,0]=4 718 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [1,1,0,0,0,0|1,0,0]=3 719 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [1,1,0,0,0,0|2,0,0]=4 720 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [1,1,0,0,0,0|2,0,0]=4 721 B12R2.202 NC1=NC2=C(S1)C(=CC=C2)Br Z1269131394 [1,1,0,0,0,0|2,0,0]=4 722 B12R2.202 NC1=NC2=C(S1)C=CC=C2Br Z2092369020 [1,1,0,0,0,0|2,0,0]=4 723 B12R2.202 NC1=NC2=C(S1)C=CC=C2Cl Z57607000 [1,1,0,0,0,0|2,0,0]=4 724 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [1,1,0,0,0,0|2,0,0]=4 725 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [1,1,0,0,0,0|2,0,0]=4 726 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [1,1,0,0,0,0|2,0,0]=4 727 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [1,1,0,0,0,0|1,0,0]=3 728 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [1,1,0,0,0,0|1,0,0]=3 729 B12R2.202 O=C1NC2=CC=CC(=C2N1)Br Z1269197007 [1,1,0,0,0,0|2,0,0]=4 730 B12R2.202 O=C1NC2=CC=CC(=C2N1)F Z1575308465 [1,1,0,0,0,0|2,0,0]=4 731 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [1,1,0,0,0,0|2,0,0]=4 732 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [1,1,0,0,0,0|1,0,0]=3 733 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [1,1,0,0,0,0|1,0,0]=3 734 B12R2.202 O=C1NC2=CC=CC(=C2S1)F Z1198222418 [1,1,0,0,0,0|1,0,0]=3 735 B12R2.202 OC1=C2C=C(SC2=CC=C1)Br Z2582394723 [1,1,0,0,0,0|2,0,0]=4 736 B12R2.202 OC1=C2N=C(OC2=CC=C1)S Z3235037659 [1,1,0,0,0,0|1,1,0]=4 737 B12R2.202 OC1=CC=CC2=C1N=C(O2)O Z1322795564 [1,1,0,0,0,0|1,0,1]=4 738 B12R2.202 SC1=NC2=C(O1)C(=CC=C2)Cl Z1720684812 [1,1,0,0,0,0|1,1,0]=4 739 B12R2.202 SC1=NC2=C(S1)C(=CC=C2)Br Z1269230329 [1,1,0,0,0,0|1,1,0]=4 740 B12R2.202 SC1=NC2=C(S1)C=CC=C2Br Z1269173262 [1,1,0,0,0,0|1,1,0]=4 741 B12R2.44 COC1=CC2=C(C=C1)NC=C2 Z104507276 [1,1,0,0,0,0|2,0,0]=4 742 B12R2.44 COC1=CC2=C(C=C1)OC=N2 Z1198314976 [1,1,0,0,0,0|1,1,0]=4 743 B12R2.44 COC1=CC2=C(C=C1)SC=N2 Z1198169594 [1,1,0,0,0,0|1,0,0]=3 744 B12R2.44 N#CC1=CC2=C(C=C1)SC=C2 Z1198165874 [1,1,0,0,0,0|2,0,0]=4 745 B12R2.44 N#CC1=CC2=C(C=C1)SC=N2 Z1198169595 [1,1,0,0,0,0|2,0,0]=4 746 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 Z1198323676 [1,1,0,0,0,0|2,0,0]=4 747 B12R2.44 NCC1=CC2=C(C=C1)SC=N2 Z5067435523 [1,1,0,0,0,0|2,0,0]=4 748 B12R2.44 NCC1=CC2=C(C=CO2)C=C1 Z965074230 [1,1,0,0,0,0|2,0,0]=4 749 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 Z1201623148 [1,1,0,0,0,0|1,0,1]=4 750 B12R2.44 O=CC1=CC2=C(C=C1)SC=N2 Z1255396184 [1,1,0,0,0,0|1,0,1]=4 751 B12R2.44 OCC1=CC2=C(C=C1)NC=C2 Z1201621651 [1,1,0,0,0,0|2,0,0]=4 752 B12R2.44 OCC1=CC2=C(C=C1)OC=C2 Z1201622887 [1,1,0,0,0,0|1,1,0]=4 753 B12R2.44 OCC1=CC2=C(C=C1)OCO2 Z104477372 [1,1,0,0,0,0|0,1,1]=4 754 B12R2.82 CC1=C2OC=NC2=CC=C1O Z3243446285 [1,1,0,0,0,0|1,0,0]=3 755 B12R2.82 ClC1=C(C2=C(C=CO2)C=C1)Br Z1681348708 [1,1,0,0,0,0|2,0,0]=4 756 B12R2.82 FC1=C(C2=C(C=C1)SC=C2)Br Z1681382899 [1,1,0,0,0,0|2,0,0]=4 757 B12R2.82 FC1=C2OC=NC2=CC=C1Br Z1862021518 [1,1,0,0,0,0|2,0,0]=4 758 B12R2.82 NC1=C(C2=C(C=C1)SC=N2)Br Z1269146869 [1,1,0,0,0,0|2,0,0]=4 759 B12R2.82 NC1=C2N=CSC2=CC=C1Cl Z382701610 [1,1,0,0,0,0|2,0,0]=4 760 B12R2.82 OC1=C(C2=C(C=C1)SC=C2)Br Z3243494650 [1,1,0,0,0,0|1,0,0]=3 761 B12R2.82 OC1=C(C2=C(C=C1)SC=C2)Cl Z1513914425 [1,1,0,0,0,0|1,0,0]=3 762 B12R2.82 OC1=C2C=CSC2=CC=C1Br Z1269129531 [1,1,0,0,0,0|2,0,0]=4 763 B12R2.100 CC1=C(C=C2N=CSC2=C1)Br Z3300754374 [1,1,0,0,0,0|2,0,0]=4 764 B12R2.100 ClC1=C(C=C2OC=CC2=C1)Br Z1681348707 [1,1,0,0,0,0|2,0,0]=4 765 B12R2.100 FC1=C(C=C2C=COC2=C1)Br Z1681355433 [1,1,0,0,0,0|2,0,0]=4 766 B12R2.100 FC1=C(C=C2OC=CC2=C1)Br Z1551956538 [1,1,0,0,0,0|2,0,0]=4 767 B12R2.100 OC1=C(C=C2OCOC2=C1)Cl Z1416158322 [1,1,0,0,0,0|0,1,1]=4 768 B12R2.132 CC1=CSC2=C1C=C(C=C2)Br Z1269161739 [1,1,0,0,0,0|2,0,0]=4 769 B12R2.132 CC1=CSC2=C1C=C(C=C2)Cl Z1201618278 [1,1,0,0,0,0|2,0,0]=4 770 B12R2.132 CN1C=CC2=C1C=C(C=C2)O Z1255447420 [1,1,0,0,0,0|2,0,0]=4 771 B12R2.132 ClC1=CC2=C(C=C1)SC=C2Br Z1269194561 [1,1,0,0,0,0|2,0,0]=4 772 B12R2.132 OC1=CC2=C(C=C1)OC=C2O Z1216838816 [1,1,0,0,0,0|1,1,0]=4 773 B12R2.132 OC1=CC2=C(C=C1)SC=C2Br Z1269146168 [1,1,0,0,0,0|1,0,0]=3 774 B12R2.246 CC1=C2N=CNC2=CC(=C1)O Z1509345768 [1,1,0,0,0,0|2,0,0]=4 775 B12R2.246 CC1=C2NC=CC2=CC(=C1)O Z1203832444 [1,1,0,0,0,0|2,0,0]=4 776 B12R2.246 CC1=C2SC=CC2=CC(=C1)N Z4956162368 [1,1,0,0,0,0|2,0,0]=4 777 B12R2.246 OC1=CC(=C2OCOC2=C1)Cl Z2681245806 [1,1,0,0,0,0|0,1,1]=4 778 B12R2.612 CC1=CNC2=C1C=CC(=C2)O Z1203731448 [1,1,0,0,0,0|2,0,0]=4 779 B12R2.612 CN1C=NC2=C1C=CC(=C2)O Z275242686 [1,1,0,0,0,0|2,0,0]=4 780 B12R2.612 O=C1COC2=C1C=CC(=C2)O Z111875098 [1,1,0,0,0,0|1,0,1]=4 781 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)C2 Z1255485170 [0,1,0,0,0,1|2,0,0]=4 782 B14R2.134 COC1=CC2=C(C=C1)CCC(=O)N2 Z1255498178 [0,1,0,0,0,1|2,0,0]=4 783 B14R2.134 COC1=CC2=C(C=C1)OCC(=O)N2 Z1198176733 [0,1,0,0,0,1|1,1,0]=4 784 B14R2.134 COC1=CC2=C(C=CC(=O)O2)C=C1 Z53852417 [0,1,0,0,0,1|1,0,0]=3 785 B14R2.8239 NC1=C(C=C2NC(=O)CCC2=C1)O Z425351774 [0,1,0,0,0,1|2,0,0]=4 786 B14R2.29365 CC1=CC(=O)NC2=C1C=CC(=C2)O Z1255365163 [0,1,0,0,0,1|2,0,0]=4 787 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(=C2)N Z57024337 [0,1,0,0,0,1|2,0,0]=4 788 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(=C2)O Z56763041 [0,1,0,0,0,1|1,0,0]=3 789 B14R2.29365 CC1CC(=O)OC2=C1C=CC(=C2)O Z1513808003 [0,1,0,0,0,1|1,0,0]=3 790 B14R2.29365 O=C1C=C(C2=C(O1)C=C(C=C2)F)O Z1255458510 [0,1,0,0,0,1|2,0,0]=4 791 B14R2.29365 O=C1NC(=O)C2=C(O1)C=C(C=C2)Cl Z1262692545 [0,1,0,0,0,1|2,0,0]=4 792 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CC2 Z1197664819 [0,1,0,0,0,1|2,0,0]=4 793 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CN2 Z1255425647 [0,1,0,0,0,1|2,0,0]=4 794 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)CO2 Z1198168486 [0,1,0,0,0,1|1,0,0]=3 795 B14R2.2332 O=CC1=CC2=C(C=C1)C=C(C=C2)O Z1201622334 [0,1,0,0,0,1|2,0,0]=4 796 B14R2.2332 O=CC1=CC2=C(C=C1)NC(=O)CO2 Z1255380142 [0,1,0,0,0,1|1,0,1]=4 797 B14R2.8235 CC1=C2NC(=O)CCC2=CC(=C1)O Z1509334164 [0,1,0,0,0,1|2,0,0]=4 798 B14R2.8235 CC1=CC(=O)OC2=C1C=C(C=C2)O Z1255438517 [0,1,0,0,0,1|1,1,0]=4 799 B14R2.8235 CC1=CC2=C(C=C1)NC(=O)OC2=O Z111834306 [0,1,0,0,0,1|2,0,0]=4 800 B14R2.8235 CC1=NC2=C(C=C(C=C2)O)C(=O)O1 Z1263715042 [0,1,0,0,0,1|2,0,0]=4 801 B14R2.8235 CC1CC(=O)OC2=C1C=C(C=C2)O Z1513898194 [0,1,0,0,0,1|1,1,0]=4 802 B14R2.8235 NC1=C2NC(=O)COC2=CC(=C1)Br Z2805897410 [0,1,0,0,0,1|2,0,0]=4 803 B14R2.8235 O=C1NC2=C(C=C(C=C2)Br)C(=O)O1 Z111834302 [0,1,0,0,0,1|2,0,0]=4 804 B14R2.8235 O=C1NC2=C(C=C(C=C2)I)C(=O)O1 Z1094720940 [0,1,0,0,0,1|2,0,0]=4 805 B14R2.8235 O=C1NC2=C(C=C(C=C2)O)C(=O)O1 Z1201620590 [0,1,0,0,0,1|1,0,0]=3 806 B14R2.29369 CN1C(=O)COC2=C1C=CC(=C2)N Z1065664910 [0,1,0,0,0,1|2,0,0]=4 807 B14R2.29369 O=C1COC2=C(N1)C=CC(=C2F)F Z1255445330 [0,1,0,0,0,1|2,0,0]=4 808 B14R2.3304 COC1=CC2=C(C=C1)C=C(N2)C=O Z1198157017 [0,2,0,0,0,0|2,0,0]=4 809 B14R2.3304 COC1=CC2=C(C=C1)C=C(O2)C=O Z1255424065 [0,2,0,0,0,0|1,0,0]=3 810 B14R2.3304 COC1=CC2=C(C=C1)N=C(O2)C=O Z1198182541 [0,2,0,0,0,0|1,0,0]=3 811 B14R2.3304 COC1=CC2=C(C=C1)N=C(S2)C=O Z1255373724 [0,2,0,0,0,0|1,1,0]=4 812 B14R2.3304 COC1=CC2=C(C=C1)NC(=C2)C=O Z1198153197 [0,2,0,0,0,0|2,0,0]=4 813 B14R2.3304 COC1=CC2=C(C=C1)OC(=C2)C=O Z1197664683 [0,2,0,0,0,0|1,1,0]=4 814 B14R2.3304 COC1=CC2=C(C=C1)SC(=C2)C=O Z1198311276 [0,2,0,0,0,0|1,0,0]=3 815 B14R2.3304 COC1=CC2=C(C=C1)SC(=N2)C=O Z1255448839 [0,2,0,0,0,0|1,0,0]=3 816 B14R2.4529 CC(=O)C1=CC2=C(O1)C=C(C=C2)C Z1198335259 [0,2,0,0,0,0|2,0,0]=4 817 B14R2.4529 CC(=O)C1=CC2=C(S1)C=CC(=C2)O Z1513833562 [0,2,0,0,0,0|1,0,0]=3 818 B14R2.4529 CC1=CC2=C(C=C1)SC(=C2)C(=O)O Z1201623026 [0,2,0,0,0,0|2,0,0]=4 819 B14R2.4529 NC(=O)C1=NC2=C(O1)C=CC(=C2)O Z2311082108 [0,2,0,0,0,0|1,1,0]=4 820 B14R2.4529 NC1=CC2=C(C=C1)SC(=C2)C(=O)O Z406715302 [0,2,0,0,0,0|2,0,0]=4 821 B14R2.4529 O=C(O)C1=CC2=C(N1)C=CC(=C2)O Z2894427530 [0,2,0,0,0,0|2,0,0]=4 822 B14R2.4529 O=C(O)C1=CC2=C(O1)C=C(C=C2)Cl Z1262517550 [0,2,0,0,0,0|2,0,0]=4 823 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)Br Z1269202680 [0,2,0,0,0,0|2,0,0]=4 824 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)Cl Z1269192627 [0,2,0,0,0,0|2,0,0]=4 825 B14R2.4529 O=C(O)C1=CC2=C(S1)C=CC(=C2)F Z90663383 [0,2,0,0,0,0|2,0,0]=4 826 B14R2.4529 O=C([O-])C1=NC2=C(S1)C=CC(=C2)Cl Z2168541804 [0,2,0,0,0,0|2,0,0]=4 827 B14R2.38360 CC1=C(C=C2OC(=CC2=C1)C=O)C Z1332305267 [0,2,0,0,0,0|2,0,0]=4 828 B14R2.601 CC(=O)C1=CC2=C(C=C1)NC(=O)O2 Z381350958 [0,2,0,0,0,0|1,0,1]=4 829 B14R2.601 CC(N)C1=CC2=C(C=C1)NC(=O)O2 Z2739025457 [0,2,0,0,0,0|2,0,0]=4 830 B14R2.601 CC(O)C1=CC2=C(C=C1)NC(=O)C2 Z756132996 [0,2,0,0,0,0|2,0,0]=4 831 B14R2.601 CC1=CC2=C(O1)C=C(C=C2)C(=O)O Z1262519623 [0,2,0,0,0,0|2,0,0]=4 832 B14R2.601 CC1=CC2=C(S1)C=CC(=C2)C(=O)O Z1255363025 [0,2,0,0,0,0|2,0,0]=4 833 B14R2.601 CC1=NC2=C(O1)C=C(C=C2)C(=O)O Z1198175088 [0,2,0,0,0,0|2,0,0]=4 834 B14R2.601 NC1=NC2=C(O1)C=C(C=C2)C(=O)O Z1203897063 [0,2,0,0,0,0|2,0,0]=4 835 B14R2.601 O=C(O)C1=CC2=C(C=C1)N=C(O2)S Z1198187090 [0,2,0,0,0,0|1,1,0]=4 836 B14R2.601 O=C1CC2=C(N1)C=CC(=C2)C(=O)O Z285150648 [0,2,0,0,0,0|2,0,0]=4 837 B14R2.601 O=C1NC2=C(N1)C=C(C=C2)C(=O)O Z234895459 [0,2,0,0,0,0|2,0,0]=4 838 B14R2.601 O=C1NC2=C(O1)C=C(C=C2)C(=O)O Z381350966 [0,2,0,0,0,0|1,0,0]=3 839 B14R2.601 O=C1NC2=C(O1)C=C(C=C2)[N+](=O)[O-] Z802845554 [0,2,0,0,0,0|1,0,1]=4 840 B14R2.601 O=C1NC2=C(O1)C=CC(=C2)B(O)O Z1509312102 [0,2,0,0,0,0|1,1,0]=4 841 B14R2.601 O=C1NC2=C(O1)C=CC(=C2)C(=O)O Z1198175164 [0,2,0,0,0,0|1,1,0]=4 842 B14R2.601 O=C1NC2=C(S1)C=CC(=C2)C(=O)O Z1262528069 [0,2,0,0,0,0|1,0,0]=3 843 B14R2.601 O=C1NC2=C(S1)C=CC(=C2)[N+](=O)[O-] Z1198222424 [0,2,0,0,0,0|1,0,1]=4 844 B14R2.1197 COC1=C(C=C2SC(=NC2=C1)C)N Z424968040 [0,2,0,0,0,0|2,0,0]=4 845 B14R2.1197 COC1=C(C=C2SC(=NC2=C1)N)Br Z1365405459 [0,2,0,0,0,0|2,0,0]=4 846 B14R2.1815 CN1C(=O)OC2=C1C=CC(=C2)C=O Z1190318868 [0,2,0,0,0,0|1,0,1]=4 847 B14R2.1815 CN1C(=O)OC2=C1C=CC(=C2)CO Z1190319487 [0,2,0,0,0,0|1,0,0]=3 848 B14R2.1815 COC1=CC2=C(C=C1)C(=O)C(=O)N2 Z362600670 [0,2,0,0,0,0|2,0,0]=4 849 B14R2.1815 COC1=CC2=C(C=C1)C(C(=O)N2)N Z3244908643 [0,2,0,0,0,0|2,0,0]=4 850 B14R2.1815 COC1=CC2=C(C=C1)C(C(=O)N2)O Z808167656 [0,2,0,0,0,0|2,0,0]=4 851 B14R2.1815 COC1=CC2=C(C=C1)N(C(=O)C2)C Z168882264 [0,2,0,0,0,0|2,0,0]=4 852 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O Z56899037 [0,2,0,0,0,0|2,0,0]=4 853 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2N Z3244908644 [0,2,0,0,0,0|2,0,0]=4 854 B14R2.3302 CC1=C2OC(=O)OC2=CC=C1C=O Z1511810804 [0,2,0,0,0,0|0,1,1]=4 855 B14R2.645 CC1=C(C=C2SC(=O)N(C2=C1)C)N Z1262647390 [0,2,0,0,0,0|2,0,0]=4 856 B14R2.645 CN1C(=O)OC2=C1C=C(C(=C2)Br)N Z5359975912 [0,2,0,0,0,0|2,0,0]=4 857 B14R2.645 CN1C(=O)OC2=C1C=C(C(=C2)Cl)N Z5341395499 [0,2,0,0,0,0|2,0,0]=4 858 B14R2.645 CN1C(=O)OC2=C1C=C(C(=C2)N)F Z1416180423 [0,2,0,0,0,0|2,0,0]=4 859 B14R2.645 O=C1NC2=CC(=C(C=C2C1=O)Br)O Z2235407292 [0,2,0,0,0,0|2,0,0]=4 860 B14R2.645 O=C1NC2=CC(=C(C=C2C1=O)Cl)O Z1509203613 [0,2,0,0,0,0|2,0,0]=4 861 B14R2.645 O=C1NC2=CC(=C(C=C2C1=O)F)O Z2235810195 [0,2,0,0,0,0|2,0,0]=4 862 B14R2.4507 CC1(C(=O)OC2=C1C=C(C=C2)O)C Z1513821827 [0,2,0,0,0,0|1,1,0]=4 863 B14R2.8716 CN1C(=O)N(C2=C1C=CC(=C2)O)C Z1251363079 [0,2,0,0,0,0|2,0,0]=4 864 B14R2.8737 O=C1NC2=C(C1=O)C=CC(=C2F)O Z1551937121 [0,2,0,0,0,0|2,0,0]=4 865 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [0,0,1,0,1,0|2,0,0]=4 866 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [0,0,1,0,1,0|2,0,0]=4 867 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [0,0,1,0,1,0|2,0,0]=4 868 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [0,0,1,0,1,0|2,0,0]=4 869 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [0,0,1,0,1,0|2,0,0]=4 870 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [0,0,1,0,1,0|2,0,0]=4 871 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [0,0,1,0,1,0|1,0,0]=3 872 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [0,0,1,0,1,0|1,0,0]=3 873 B10R1.13 CC1=CN=C(C=C1)C(=O)O Z1511494596 [0,0,1,0,1,0|2,0,0]=4 874 B10R1.13 CC1=NC=C(C=C1)C(=O)O Z235485476 [0,0,1,0,1,0|2,0,0]=4 875 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [0,0,1,0,1,0|2,0,0]=4 876 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [0,0,1,0,1,0|2,0,0]=4 877 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [0,0,1,0,1,0|2,0,0]=4 878 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [0,0,1,0,1,0|2,0,0]=4 879 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [0,0,1,0,1,0|2,0,0]=4 880 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [0,0,1,0,1,0|1,0,0]=3 881 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [0,0,1,0,1,0|1,1,0]=4 882 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [0,0,1,0,1,0|1,0,0]=3 883 B10R1.13 NC1=CN=C(C=C1)C(=O)O Z1649677869 [0,0,1,0,1,0|2,0,0]=4 884 B10R1.13 NC1=NC=C(C=C1)C(=O)O Z90122558 [0,0,1,0,1,0|2,0,0]=4 885 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [0,0,1,0,1,0|1,0,0]=3 886 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [0,0,1,0,1,0|1,0,0]=3 887 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [0,0,1,0,1,0|1,0,0]=3 888 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [0,0,1,0,1,0|1,0,0]=3 889 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [0,0,1,0,1,0|0,0,0]=2 890 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [0,0,1,0,1,0|0,1,0]=3 891 B10R1.13 O=C(O)C1=CN=C(C=C1)Br Z1258919772 [0,0,1,0,1,0|2,0,0]=4 892 B10R1.13 O=C(O)C1=CN=C(C=C1)Cl Z104476110 [0,0,1,0,1,0|2,0,0]=4 893 B10R1.13 O=C(O)C1=CN=C(C=C1)F Z1182395505 [0,0,1,0,1,0|2,0,0]=4 894 B10R1.13 O=C(O)C1=CN=C(C=C1)O Z104500708 [0,0,1,0,1,0|1,0,0]=3 895 B10R1.13 O=C(O)C1=NC=C(C=C1)Br Z972791012 [0,0,1,0,1,0|2,0,0]=4 896 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl Z1201622823 [0,0,1,0,1,0|2,0,0]=4 897 B10R1.13 O=C(O)C1=NC=C(C=C1)I Z1069125846 [0,0,1,0,1,0|2,0,0]=4 898 B10R1.13 O=C1C=CC(=CO1)C(=O)O Z104472302 [0,0,1,0,1,0|1,0,1]=4 899 B10R1.13 O=P(O)C1=CC=C(C=C1)Cl Z56798029 [0,0,1,0,1,0|2,0,0]=4 900 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [0,0,1,0,1,0|1,0,1]=4 901 B10R1.13 OB(O)C1=CC=C(C=C1)O Z336080006 [0,0,1,0,1,0|1,0,1]=4 902 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [0,0,1,0,1,0|2,0,0]=4 903 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [0,0,1,0,1,0|2,0,0]=4 904 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [0,0,1,0,1,0|2,0,0]=4 905 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [0,0,1,0,1,0|2,0,0]=4 906 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [0,0,1,0,1,0|2,0,0]=4 907 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [0,0,1,0,1,0|1,1,0]=4 908 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [0,0,1,0,1,0|2,0,0]=4 909 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [0,0,1,0,1,0|2,0,0]=4 910 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [0,0,1,0,1,0|2,0,0]=4 911 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [0,0,1,0,1,0|2,0,0]=4 912 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [0,0,1,0,1,0|2,0,0]=4 913 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [0,0,1,0,1,0|1,0,0]=3 914 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [0,0,1,0,1,0|1,1,0]=4 915 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [0,0,1,0,1,0|2,0,0]=4 916 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [0,0,1,0,1,0|1,1,0]=4 917 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [0,0,1,0,1,0|1,1,0]=4 918 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [0,0,1,0,1,0|1,1,0]=4 919 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [0,0,1,0,1,0|1,1,0]=4 920 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [0,0,1,0,1,0|1,1,0]=4 921 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [0,0,1,0,1,0|0,1,0]=3 922 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [0,0,1,0,1,0|0,2,0]=4 923 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [0,0,1,0,1,0|1,1,0]=4 924 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [0,0,1,0,1,0|1,1,0]=4 925 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [0,0,1,0,1,0|1,1,0]=4 926 B12R1.21 CC1=CC=C(C=C1)/C=C/C(=O)O Z2942851512 [0,0,1,0,0,1|2,0,0]=4 927 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [0,0,1,0,0,1|2,0,0]=4 928 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O Z56812739 [0,0,1,0,0,1|1,1,0]=4 929 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [0,0,1,0,0,1|2,0,0]=4 930 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O Z55903478 [0,0,1,0,0,1|1,0,0]=3 931 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,0,1,0,0,1|1,1,0]=4 932 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [0,0,1,0,0,1|2,0,0]=4 933 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [0,0,1,0,0,1|2,0,0]=4 934 B12R1.21 NC1=CC=C(C=C1)/C=C/C(=O)O Z56762319 [0,0,1,0,0,1|2,0,0]=4 935 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [0,0,1,0,0,1|2,0,0]=4 936 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O Z3241275736 [0,0,1,0,0,1|1,1,0]=4 937 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Br Z2237493681 [0,0,1,0,0,1|2,0,0]=4 938 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)Cl Z56989206 [0,0,1,0,0,1|2,0,0]=4 939 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)F Z2942851074 [0,0,1,0,0,1|2,0,0]=4 940 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [0,0,1,0,0,1|1,0,0]=3 941 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [0,0,1,0,0,1|2,0,0]=4 942 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [0,0,1,0,0,1|2,0,0]=4 943 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [0,0,1,0,0,1|2,0,0]=4 944 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [0,0,1,0,0,1|1,0,0]=3 945 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br Z274534708 [0,0,1,0,0,1|2,0,0]=4 946 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl Z274534702 [0,0,1,0,0,1|2,0,0]=4 947 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,0,1,0,0,1|1,0,0]=3 948 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br Z56812736 [0,0,1,0,0,1|1,1,0]=4 949 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl Z57181989 [0,0,1,0,0,1|1,1,0]=4 950 B12R1.21 O=C(O)COC1=CC=C(C=C1)F Z56978034 [0,0,1,0,0,1|1,1,0]=4 951 B12R1.21 O=C(O)COC1=CC=C(C=C1)I Z56943814 [0,0,1,0,0,1|1,1,0]=4 952 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [0,0,1,0,0,1|0,1,0]=3 953 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br Z55903477 [0,0,1,0,0,1|1,0,0]=3 954 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl Z55179956 [0,0,1,0,0,1|1,0,0]=3 955 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F Z55903650 [0,0,1,0,0,1|1,0,0]=3 956 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [0,0,1,0,0,1|0,0,0]=2 957 B14R2.380 O=C1CC2=C(C=CC(=C2)O)CCN1 Z1509152364 [0,0,0,0,0,2|2,0,0]=4 958 B14R2.380 O=C1CSCC2=C(N1)C=C(C=C2)Br Z5336175958 [0,0,0,0,0,2|2,0,0]=4 959 B14R2.7974 O=C1CCCC2=C(N1)C=CC(=C2)O Z1509164164 [0,0,0,0,0,2|2,0,0]=4 960 B14R2.7974 O=C1CCOC2=C(C1)C=CC(=C2)Br Z2471604345 [0,0,0,0,0,2|2,0,0]=4 961 B14R2.7974 O=C1COCC2=C(N1)C=CC(=C2)Br Z1269199928 [0,0,0,0,0,2|2,0,0]=4