0 B11R1.509 CS(=O)(=O)NC1=CN=CC=C1 Z45654055 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.509 CS(=O)(=O)NC1=NC=CC=C1 Z45654195 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.509 NS(=O)(=O)CC1=CN=CC=C1 Z385450900 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.509 NS(=O)(=O)CC1=NC=CC=C1 Z385450902 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.509 NS(=O)(=O)NC1=CC=CC=C1 Z1425690842 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.509 NS(=O)(=O)OC1=CC=CC=C1 Z1255360895 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.509 O=P(O)(O)CC1=CN=CC=C1 Z1255418137 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 Z190630174 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.509 O=S(=O)(F)CC1=CC=NC=C1 Z3768480283 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.509 O=S(=O)(F)NC1=NC=CC=C1 Z3538501338 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.509 O=S(=O)([O-])CC1=CC=CC=C1 Z3206129658 [0,0,0,0,0,0|0,0,1]=1 12 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,0,0,0,0,0|2,1,0]=4 23 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.18 O=C(O)CC1=CN=CN=C1 Z1889902548 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,0,0,0,0|0,0,1]=2 27 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,0,0,0,0,0|1,0,1]=3 28 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,0,0,0,0,0|1,0,1]=3 29 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Br Z513707720 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.106 CC1=CN=C(C=C1)OS(=O)(=O)F Z3300781554 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Br Z416908782 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N Z732208132 [0,1,0,0,0,0|1,0,0]=2 33 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)Br Z45620035 [0,1,0,0,0,0|2,0,0]=3 34 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)N Z234901478 [0,1,0,0,0,0|2,0,0]=3 35 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)O Z45652935 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.106 CS(=O)(=O)NC1=CN=C(C=C1)N Z4951115188 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.106 CS(=O)(=O)NC1=NC=C(C=C1)O Z1255363181 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.106 NC1=CC=C(C=C1)CS(=O)(=O)N Z235340045 [0,1,0,0,0,0|1,0,0]=2 39 B12R1.106 NC1=CC=C(C=C1)OS(=O)(=O)F Z1262631479 [0,1,0,0,0,0|2,0,0]=3 40 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Br Z274591724 [0,1,0,0,0,0|1,0,0]=2 41 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)Cl Z274587950 [0,1,0,0,0,0|1,0,0]=2 42 B12R1.106 NS(=O)(=O)CC1=CC=C(C=C1)F Z241725866 [0,1,0,0,0,0|1,0,0]=2 43 B12R1.106 NS(=O)(=O)CC1=CN=C(C=C1)Cl Z425350076 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)Br Z295879634 [0,1,0,0,0,0|2,0,0]=3 45 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)Cl Z1612297151 [0,1,0,0,0,0|2,0,0]=3 46 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)F Z1612297177 [0,1,0,0,0,0|2,0,0]=3 47 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)O Z335810542 [0,1,0,0,0,0|2,0,0]=3 48 B12R1.106 O=S(=O)(F)CC1=CC=C(C=C1)Br Z2733515136 [0,1,0,0,0,0|1,0,0]=2 49 B12R1.106 O=S(=O)(F)CC1=CN=C(C=C1)Cl Z991789044 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.106 O=S(=O)(F)CC1=CN=C(C=C1)F Z3271509731 [0,1,0,0,0,0|2,0,0]=3 51 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)Cl Z271034376 [0,1,0,0,0,0|1,0,0]=2 52 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)F Z991703086 [0,1,0,0,0,0|1,0,0]=2 53 B12R1.119 CC1=CC(=CC=C1)CS(=O)(=O)N Z274590020 [0,1,0,0,0,0|1,0,0]=2 54 B12R1.119 CS(=O)(=O)CC1=CC(=CC=C1)N Z732207952 [0,1,0,0,0,0|1,0,0]=2 55 B12R1.119 CS(=O)(=O)NC1=CC(=CC=C1)I Z45691015 [0,1,0,0,0,0|2,0,0]=3 56 B12R1.119 CS(=O)(=O)NC1=CC(=CC=C1)N Z239122900 [0,1,0,0,0,0|2,0,0]=3 57 B12R1.119 CS(=O)(=O)NC1=CC(=CC=C1)O Z45637535 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.119 CS(=O)(=O)NC1=NC=CC(=C1)Br Z1783785942 [0,1,0,0,0,0|3,0,0]=4 59 B12R1.119 NC1=CC(=CC=C1)CS(=O)(=O)F Z3018074913 [0,1,0,0,0,0|1,0,0]=2 60 B12R1.119 NC1=CC(=CC=C1)CS(=O)(=O)N Z406717276 [0,1,0,0,0,0|1,0,0]=2 61 B12R1.119 NC1=CC(=CC=C1)NS(=O)(=O)N Z295879120 [0,1,0,0,0,0|2,0,0]=3 62 B12R1.119 NC1=CC(=CC=C1)OS(=O)(=O)F Z3919192866 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.119 NC1=CC(=CN=C1)OS(=O)(=O)F Z4309494893 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)Br Z734461516 [0,1,0,0,0,0|1,0,0]=2 65 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)Cl Z274588496 [0,1,0,0,0,0|1,0,0]=2 66 B12R1.119 NS(=O)(=O)CC1=CC(=CC=C1)F Z385450912 [0,1,0,0,0,0|1,0,0]=2 67 B12R1.119 O=S(=O)(F)OC1=CC(=CC=C1)Br Z3919190367 [0,1,0,0,0,0|2,0,0]=3 68 B12R1.119 O=S(=O)(F)OC1=CC(=CN=C1)Br Z2941211647 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.151 CC(C)(O)CC1=C(C=CC=C1)Br Z513707712 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.151 CC(C)(O)CC1=C(C=CC=C1)Cl Z513707752 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.151 CC1=C(C=CC=C1)CS(=O)(=O)N Z274590394 [0,1,0,0,0,0|1,0,0]=2 72 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)Br Z416894838 [0,1,0,0,0,0|1,0,0]=2 73 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)N Z732207950 [0,1,0,0,0,0|1,0,0]=2 74 B12R1.151 CS(=O)(=O)CC1=C(C=CC=C1)O Z1513868900 [0,1,0,0,0,0|1,0,0]=2 75 B12R1.151 CS(=O)(=O)NC1=C(C=CC=C1)Br Z45619895 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.151 CS(=O)(=O)NC1=C(C=CC=C1)F Z45639775 [0,1,0,0,0,0|2,0,0]=3 77 B12R1.151 CS(=O)(=O)NC1=C(C=CC=C1)I Z45635715 [0,1,0,0,0,0|2,0,0]=3 78 B12R1.151 CS(=O)(=O)NC1=C(C=CC=C1)N Z235362831 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.151 NC1=C(C=CC=C1)CS(=O)(=O)N Z2289799371 [0,1,0,0,0,0|1,0,0]=2 80 B12R1.151 NC1=C(C=CC=C1)OS(=O)(=O)F Z3919171891 [0,1,0,0,0,0|2,0,0]=3 81 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)Br Z734461494 [0,1,0,0,0,0|1,0,0]=2 82 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)Cl Z274590786 [0,1,0,0,0,0|1,0,0]=2 83 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)F Z274594156 [0,1,0,0,0,0|1,0,0]=2 84 B12R1.151 NS(=O)(=O)CC1=C(C=CC=C1)I Z3300771595 [0,1,0,0,0,0|1,0,0]=2 85 B12R1.151 O=S(=O)(F)CC1=C(C=CC=C1)Cl Z1362758794 [0,1,0,0,0,0|1,0,0]=2 86 B12R1.151 O=S(=O)(F)CC1=C(C=CC=C1)F Z991722582 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.151 O=S(=O)(F)OC1=C(C=CC=C1)Cl Z3919171831 [0,1,0,0,0,0|2,0,0]=3 88 B12R1.194 C=CS(=O)(=O)NC1=CC=CC=C1 Z1336450025 [0,1,0,0,0,0|2,0,0]=3 89 B12R1.194 C=CS(=O)(=O)OC1=CC=CC=C1 Z85923402 [0,1,0,0,0,0|2,0,0]=3 90 B12R1.194 CC(C)(C=O)CC1=CC=CC=C1 Z1188488760 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.194 CCS(=O)(=O)NC1=CN=CC=C1 Z53825126 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.194 CNS(=O)(=O)CC1=CC=CC=C1 Z133621020 [0,1,0,0,0,0|1,0,0]=2 93 B12R1.564 CC(C1=CC=CC=C1)C(C)(C)O Z2235789563 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.564 CC(C1=CC=CC=C1)S(=O)(=O)F Z1210120079 [0,1,0,0,0,0|1,0,0]=2 95 B12R1.564 CC(C1=CC=CC=C1)S(=O)(=O)N Z954606652 [0,1,0,0,0,0|1,0,0]=2 96 B12R1.564 CN(C1=CC=CC=C1)S(=O)(=O)C Z45619615 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.564 CN(C1=CC=CC=C1)S(=O)(=O)N Z300101164 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.564 CN(C1=NC=CC=C1)S(=O)(=O)C Z741558912 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.564 NC(C1=CC=CC=C1)P(=O)(O)O Z55625577 [0,1,0,0,0,0|1,0,1]=3 100 B12R2.92 CC1(OC1C2=CC=CC=C2)C Z1486033030 [0,0,0,1,0,0|3,0,0]=4 101 B12R2.95 O=S1(=O)CC2=C(N1)C=CC=C2 Z1171481793 [0,0,0,1,0,0|1,0,0]=2 102 B12R2.95 O=S1(=O)NC2=C(N1)C=CC=C2 Z321036532 [0,0,0,1,0,0|2,0,0]=3 103 B10R1.28 CS(=O)(=O)C1=CN=CC=C1 Z425810472 [0,0,0,0,1,0|2,0,0]=3 104 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 Z45415554 [0,0,0,0,1,0|1,0,0]=2 105 B10R1.28 NS(=O)(=O)C1=CN=CC=C1 Z223026200 [0,0,0,0,1,0|2,0,0]=3 106 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 Z854066590 [0,0,0,0,1,0|2,0,0]=3 107 B10R1.28 NS(=O)(=O)C1=NC=CC=N1 Z854066844 [0,0,0,0,1,0|3,0,0]=4 108 B10R1.28 NS(=O)(=O)C1=NC=CN=C1 Z854066840 [0,0,0,0,1,0|3,0,0]=4 109 B10R1.28 O=P(O)(O)C1=NC=CC=C1 Z1216814875 [0,0,0,0,1,0|2,0,1]=4 110 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 Z300074856 [0,0,0,0,1,0|2,0,0]=3 111 B10R1.28 O=S(=O)(F)C1=CC=CC=C1 Z1255364683 [0,0,0,0,1,0|1,0,0]=2 112 B10R1.28 O=S(=O)(F)C1=CC=NC=C1 Z2489421023 [0,0,0,0,1,0|2,0,0]=3 113 B10R1.28 O=S(=O)(F)C1=CN=CC=C1 Z1689029067 [0,0,0,0,1,0|2,0,0]=3 114 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 Z1255446838 [0,0,0,0,1,0|2,0,0]=3 115 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 Z104475570 [0,0,0,0,1,0|1,0,0]=2 116 B10R1.281 CS(=O)(=O)CC1=NNC=C1 Z2583442510 [0,0,0,0,1,0|3,0,0]=4 117 B10R1.281 CS(=O)(=O)CC1=NOC=C1 Z1254124754 [0,0,0,0,1,0|3,0,0]=4 118 B10R1.281 NS(=O)(=O)CC1=CC=CO1 Z954606436 [0,0,0,0,1,0|2,0,0]=3 119 B10R1.281 NS(=O)(=O)CC1=NOC=C1 Z1259157508 [0,0,0,0,1,0|3,0,0]=4 120 B10R1.281 O=S(=O)(F)CC1=CC=CS1 Z2895540219 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.281 O=S(=O)(F)CC1=CSC=C1 Z2901777193 [0,0,0,0,1,0|2,0,0]=3 122 B10R1.281 O=S(=O)([O-])CC1=CSC=C1 Z2213893337 [0,0,0,0,1,0|1,0,1]=3 123 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 Z513713254 [0,0,0,0,0,1|3,0,0]=4 124 B12R1.891 CC(C)(O)COC1=CC=CC=C1 Z600459798 [0,0,0,0,0,1|3,0,0]=4 125 B12R1.891 CS(=O)(=O)NCC1=CC=CC=C1 Z53825161 [0,0,0,0,0,1|1,0,0]=2 126 B12R1.891 CS(=O)(=O)NCC1=CC=NC=C1 Z812516908 [0,0,0,0,0,1|2,0,0]=3 127 B12R1.891 CS(=O)(=O)NCC1=NC=CC=C1 Z55017634 [0,0,0,0,0,1|2,0,0]=3 128 B12R1.891 CS(=O)(=O)NCC1=NN=CC=C1 Z1883825027 [0,0,0,0,0,1|3,0,0]=4 129 B12R1.891 NS(=O)(=O)/C=C/C1=CC=CC=C1 Z45415579 [0,0,0,0,0,1|1,0,1]=3 130 B12R1.891 NS(=O)(=O)C#CC1=CC=CC=C1 Z56915355 [0,0,0,0,0,1|1,0,1]=3 131 B12R1.891 NS(=O)(=O)CCC1=CC=CC=C1 Z57965898 [0,0,0,0,0,1|1,0,0]=2 132 B12R1.891 NS(=O)(=O)CCC1=NC=CN=C1 Z2432780870 [0,0,0,0,0,1|3,0,0]=4 133 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 Z300098430 [0,0,0,0,0,1|1,0,0]=2 134 B12R1.891 NS(=O)(=O)NCC1=CN=CC=C1 Z300110264 [0,0,0,0,0,1|2,0,0]=3 135 B12R1.891 NS(=O)(=O)NCC1=NC=CC=C1 Z300109946 [0,0,0,0,0,1|2,0,0]=3 136 B12R1.891 O=S(=O)(F)/C=C/C1=CC=CC=C1 Z1999520401 [0,0,0,0,0,1|1,0,1]=3 137 B12R1.891 O=S(=O)(F)C#CC1=CC=CC=C1 Z1354075704 [0,0,0,0,0,1|1,0,1]=3 138 B12R1.891 O=S(=O)(F)CCC1=CC=CC=C1 Z1258763618 [0,0,0,0,0,1|1,0,0]=2 139 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [2,0,0,0,0,0|1,1,0]=4 142 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|1,0,0]=3 144 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [2,0,0,0,0,0|2,0,0]=4 146 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [1,1,0,0,0,0|1,0,0]=3 148 B11R1.20 CC1=NC=C(C=C1)CC(=O)O Z424795892 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [1,1,0,0,0,0|2,0,0]=4 150 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [1,1,0,0,0,0|2,0,0]=4 151 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [1,1,0,0,0,0|1,0,0]=3 154 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [1,1,0,0,0,0|1,0,0]=3 156 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [1,1,0,0,0,0|1,0,0]=3 157 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.20 O=C(O)CC1=CN=C(C=C1)Cl Z1165304038 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 Z1198338224 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.20 O=C(O)CC1=NC=C(C=C1)F Z1945984141 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [1,1,0,0,0,0|1,0,1]=4 162 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.36 CC(C(=O)O)C1=CN=CC=C1 Z792377268 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 Z5462337230 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.36 C[C@H](C(=O)O)C1=CN=CC=C1 Z5462556304 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [1,1,0,0,0,0|1,0,0]=3 172 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 Z815264186 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [1,1,0,0,0,0|1,0,0]=3 174 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [1,1,0,0,0,0|1,0,0]=3 175 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 Z381360894 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [1,1,0,0,0,0|1,0,0]=3 177 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [1,1,0,0,0,0|1,0,0]=3 178 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [1,1,0,0,0,0|1,0,0]=3 179 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [1,1,0,0,0,0|1,0,0]=3 180 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [1,1,0,0,0,0|1,0,0]=3 181 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [1,1,0,0,0,0|1,0,0]=3 182 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [1,1,0,0,0,0|2,0,0]=4 187 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.40 COC(=O)CC1=CC=NC=C1 Z331473808 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.40 COC(=O)CC1=NC=CC=C1 Z147652450 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [1,1,0,0,0,0|2,0,0]=4 193 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,1,0,0,0,0|2,0,0]=4 194 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [1,1,0,0,0,0|2,0,0]=4 197 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.86 CC1=C(C=CC=N1)CC(=O)O Z2050687800 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.86 CC1=C(C=NC=C1)CC(=O)O Z1198264460 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [1,1,0,0,0,0|1,0,1]=4 207 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,1,0,0,0,0|2,0,0]=4 209 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.86 NC1=C(C=CC=N1)CC(=O)O Z1889710265 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [1,1,0,0,0,0|1,0,0]=3 214 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [1,1,0,0,0,0|1,0,0]=3 215 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl Z2096659743 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br Z1269238080 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.86 O=C(O)CN1C=CC=CC1=O Z57985357 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.86 O=[N+]([O-])CC1=C(C=CC=C1)F Z2182028452 [1,1,0,0,0,0|1,0,1]=4 222 B11R1.86 OB(O)CC1=C(C=CC=C1)Cl Z1147227737 [1,1,0,0,0,0|1,0,1]=4 223 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,1,0,0,0,0|1,0,1]=4 229 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.157 NC1=NC=CC(=C1)CC(=O)O Z1197888454 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,1,0,0,0,0|1,0,0]=3 235 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,1,0,0,0,0|1,0,0]=3 236 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,1,0,0,0,0|1,0,0]=3 237 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.157 O=C(O)CC1=CC(=CN=C1)Br Z1269198419 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.157 O=[N+]([O-])CC1=CC(=CC=C1)F Z2181775549 [1,1,0,0,0,0|1,0,1]=4 243 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 Z1020737978 [0,1,0,0,1,0|1,0,0]=3 244 B11R1.7 C=CS(=O)(=O)C1=CC=NC=C1 Z424784918 [0,1,0,0,1,0|2,0,0]=4 245 B11R1.7 C=CS(=O)(=O)C1=NC=CC=C1 Z424784990 [0,1,0,0,1,0|2,0,0]=4 246 B11R1.7 CNS(=O)(=O)C1=CC=CC=C1 Z45527650 [0,1,0,0,1,0|1,0,0]=3 247 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 Z45457929 [0,1,0,0,1,0|0,0,0]=2 248 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 Z203881850 [0,1,0,0,1,0|1,0,0]=3 249 B11R1.7 O=S(=O)(NO)C1=CC=CC=C1 Z45528441 [0,1,0,0,1,0|0,0,0]=2 250 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)F Z1255372425 [0,1,0,0,1,0|1,0,0]=3 251 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)N Z45415564 [0,1,0,0,1,0|1,0,0]=3 252 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O Z2218556278 [0,1,0,0,1,0|0,0,0]=2 253 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O Z2306780869 [0,1,0,0,1,0|0,0,0]=2 254 B11R1.19 CC1=CN=C(C=C1)S(=O)(=O)F Z1642148123 [0,1,0,0,1,0|2,0,0]=4 255 B11R1.19 CC1=NC=C(C=C1)S(=O)(=O)N Z1180069295 [0,1,0,0,1,0|2,0,0]=4 256 B11R1.19 CS(=N)(=O)C1=CC=C(C=C1)N Z1262638032 [0,1,0,0,1,0|2,0,0]=4 257 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)Br Z432550092 [0,1,0,0,1,0|1,0,0]=3 258 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)Cl Z56757032 [0,1,0,0,1,0|1,0,0]=3 259 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)F Z57475486 [0,1,0,0,1,0|1,0,0]=3 260 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)N Z85926241 [0,1,0,0,1,0|1,0,0]=3 261 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)O Z147646800 [0,1,0,0,1,0|1,0,0]=3 262 B11R1.19 CS(=O)(=O)C1=CN=C(C=C1)Br Z1258919374 [0,1,0,0,1,0|2,0,0]=4 263 B11R1.19 CS(=O)(=O)C1=CN=C(C=C1)Cl Z1504672482 [0,1,0,0,1,0|2,0,0]=4 264 B11R1.19 CS(=O)(=O)C1=CN=C(C=C1)N Z317054190 [0,1,0,0,1,0|2,0,0]=4 265 B11R1.19 CS(=O)(=O)C1=CNC(=O)C=C1 Z1258980300 [0,1,0,0,1,0|2,0,0]=4 266 B11R1.19 CS(=O)(=O)C1=NC=C(C=C1)N Z317047094 [0,1,0,0,1,0|2,0,0]=4 267 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)F Z1198147270 [0,1,0,0,1,0|1,0,0]=3 268 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)N Z56851240 [0,1,0,0,1,0|1,0,0]=3 269 B11R1.19 NC1=CC=C(C=C1)S(=O)(=O)O Z104473374 [0,1,0,0,1,0|0,0,0]=2 270 B11R1.19 NC1=CN=C(C=C1)S(=O)(=O)F Z2466681954 [0,1,0,0,1,0|2,0,0]=4 271 B11R1.19 NC1=NC=C(C=C1)S(=O)(=O)N Z147646914 [0,1,0,0,1,0|2,0,0]=4 272 B11R1.19 NC1=NC=C(C=C1)S(=O)(=O)O Z56767047 [0,1,0,0,1,0|1,0,0]=3 273 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)Br Z45415551 [0,1,0,0,1,0|1,0,0]=3 274 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)Cl Z45415550 [0,1,0,0,1,0|1,0,0]=3 275 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)F Z45415567 [0,1,0,0,1,0|1,0,0]=3 276 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)I Z300170034 [0,1,0,0,1,0|1,0,0]=3 277 B11R1.19 NS(=O)(=O)C1=CC=C(C=C1)O Z360053740 [0,1,0,0,1,0|1,0,0]=3 278 B11R1.19 NS(=O)(=O)C1=CN=C(C=C1)Br Z1269147950 [0,1,0,0,1,0|2,0,0]=4 279 B11R1.19 NS(=O)(=O)C1=CN=C(C=C1)Cl Z45415626 [0,1,0,0,1,0|2,0,0]=4 280 B11R1.19 NS(=O)(=O)C1=CN=C(C=C1)S Z237737960 [0,1,0,0,1,0|2,0,0]=4 281 B11R1.19 NS(=O)(=O)C1=NC=C(C=C1)Br Z854066834 [0,1,0,0,1,0|2,0,0]=4 282 B11R1.19 NS(=O)(=O)C1=NC=C(C=C1)Cl Z854066742 [0,1,0,0,1,0|2,0,0]=4 283 B11R1.19 O=P(O)(O)C1=CC=C(C=C1)I Z1416158416 [0,1,0,0,1,0|1,0,1]=4 284 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)Br Z56823552 [0,1,0,0,1,0|1,0,0]=3 285 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)Cl Z104472128 [0,1,0,0,1,0|1,0,0]=3 286 B11R1.19 O=S(=O)(Cl)C1=CC=C(C=C1)F Z56940934 [0,1,0,0,1,0|1,0,0]=3 287 B11R1.19 O=S(=O)(Cl)C1=CN=C(C=C1)Br Z2238506596 [0,1,0,0,1,0|2,0,0]=4 288 B11R1.19 O=S(=O)(Cl)C1=CN=C(C=C1)Cl Z56941078 [0,1,0,0,1,0|2,0,0]=4 289 B11R1.19 O=S(=O)(Cl)C1=CN=C(C=C1)F Z1448546138 [0,1,0,0,1,0|2,0,0]=4 290 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)Br Z1416159100 [0,1,0,0,1,0|1,0,0]=3 291 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)Cl Z1198157369 [0,1,0,0,1,0|1,0,0]=3 292 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)F Z1198164091 [0,1,0,0,1,0|1,0,0]=3 293 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)I Z1269193258 [0,1,0,0,1,0|1,0,0]=3 294 B11R1.19 O=S(=O)(F)C1=CC=C(C=C1)O Z1513807665 [0,1,0,0,1,0|1,0,0]=3 295 B11R1.19 O=S(=O)(F)C1=CN=C(C=C1)O Z3327849368 [0,1,0,0,1,0|2,0,0]=4 296 B11R1.19 O=S(=O)(F)C1=NC=C(C=C1)Br Z1207150985 [0,1,0,0,1,0|2,0,0]=4 297 B11R1.19 O=S(=O)(F)C1=NC=C(C=C1)Cl Z2732725623 [0,1,0,0,1,0|2,0,0]=4 298 B11R1.19 O=S(=O)(F)C1=NC=C(C=C1)F Z1238543538 [0,1,0,0,1,0|2,0,0]=4 299 B11R1.19 O=S(=O)(F)C1=NC=C(C=C1)O Z3678887634 [0,1,0,0,1,0|2,0,0]=4 300 B11R1.19 O=S(=O)(O)C1=CC=C(C=C1)O Z2583059497 [0,1,0,0,1,0|0,0,0]=2 301 B11R1.19 O=S(=O)(O)C1=CN=C(C=C1)Cl Z1198164209 [0,1,0,0,1,0|1,0,0]=3 302 B11R1.87 CC1=C(C=CC=C1)S(=O)(=O)F Z1486020661 [0,1,0,0,1,0|1,0,0]=3 303 B11R1.87 CC1=C(C=CC=C1)S(=O)(=O)N Z57902803 [0,1,0,0,1,0|1,0,0]=3 304 B11R1.87 CC1=C(C=CC=C1)S(=O)(=O)O Z1198149968 [0,1,0,0,1,0|0,0,0]=2 305 B11R1.87 CC1=C(C=CC=N1)S(=O)(=O)F Z2732527160 [0,1,0,0,1,0|2,0,0]=4 306 B11R1.87 CC1=C(C=CN=C1)S(=O)(=O)F Z2895332384 [0,1,0,0,1,0|2,0,0]=4 307 B11R1.87 CC1=C(C=NC=C1)S(=O)(=O)F Z2907428493 [0,1,0,0,1,0|2,0,0]=4 308 B11R1.87 CC1=C(C=NC=C1)S(=O)(=O)N Z1198154408 [0,1,0,0,1,0|2,0,0]=4 309 B11R1.87 CC1=C(N=CC=C1)S(=O)(=O)F Z2432909602 [0,1,0,0,1,0|2,0,0]=4 310 B11R1.87 CS(=O)(=O)C1=C(C=CC=C1)Br Z432564044 [0,1,0,0,1,0|1,0,0]=3 311 B11R1.87 CS(=O)(=O)C1=C(C=CC=C1)F Z126944608 [0,1,0,0,1,0|1,0,0]=3 312 B11R1.87 CS(=O)(=O)C1=C(C=CC=C1)N Z210801860 [0,1,0,0,1,0|1,0,0]=3 313 B11R1.87 CS(=O)(=O)C1=C(C=CC=C1)O Z815289314 [0,1,0,0,1,0|1,0,0]=3 314 B11R1.87 CS(=O)(=O)C1=C(C=CC=N1)N Z317047098 [0,1,0,0,1,0|2,0,0]=4 315 B11R1.87 CS(=O)(=O)C1=C(C=NC=C1)N Z1347572745 [0,1,0,0,1,0|2,0,0]=4 316 B11R1.87 CS(=O)(=O)C1=C(N=CC=C1)Cl Z1255452931 [0,1,0,0,1,0|2,0,0]=4 317 B11R1.87 CS(=O)(=O)C1=C(N=CC=C1)N Z1262680404 [0,1,0,0,1,0|2,0,0]=4 318 B11R1.87 NC1=C(C=CC=C1)P(=O)(O)O Z1198157927 [0,1,0,0,1,0|1,0,1]=4 319 B11R1.87 NC1=C(C=CC=C1)S(=O)(=O)F Z1255485353 [0,1,0,0,1,0|1,0,0]=3 320 B11R1.87 NC1=C(C=CC=C1)S(=O)(=O)N Z278052056 [0,1,0,0,1,0|1,0,0]=3 321 B11R1.87 NC1=C(N=CC=C1)S(=O)(=O)F Z2467210975 [0,1,0,0,1,0|2,0,0]=4 322 B11R1.87 NC1=C(N=CC=C1)S(=O)(=O)N Z1216838238 [0,1,0,0,1,0|2,0,0]=4 323 B11R1.87 NS(=O)(=O)C1=C(C=CC=C1)Br Z45415642 [0,1,0,0,1,0|1,0,0]=3 324 B11R1.87 NS(=O)(=O)C1=C(C=CC=C1)Cl Z45415618 [0,1,0,0,1,0|1,0,0]=3 325 B11R1.87 NS(=O)(=O)C1=C(C=CC=C1)F Z45415581 [0,1,0,0,1,0|1,0,0]=3 326 B11R1.87 NS(=O)(=O)C1=C(C=CC=C1)I Z235542804 [0,1,0,0,1,0|1,0,0]=3 327 B11R1.87 NS(=O)(=O)C1=C(C=CC=C1)O Z1255467781 [0,1,0,0,1,0|1,0,0]=3 328 B11R1.87 NS(=O)(=O)C1=C(C=CC=N1)F Z997724900 [0,1,0,0,1,0|2,0,0]=4 329 B11R1.87 NS(=O)(=O)C1=C(C=CC=N1)O Z1255501486 [0,1,0,0,1,0|2,0,0]=4 330 B11R1.87 NS(=O)(=O)C1=C(N=CC=C1)Cl Z271312234 [0,1,0,0,1,0|2,0,0]=4 331 B11R1.87 NS(=O)(=O)C1=C(N=CC=C1)O Z1612248361 [0,1,0,0,1,0|2,0,0]=4 332 B11R1.87 O=S(=O)(Cl)C1=C(C=CC=C1)Br Z56970121 [0,1,0,0,1,0|1,0,0]=3 333 B11R1.87 O=S(=O)(Cl)C1=C(C=CC=C1)Cl Z56931877 [0,1,0,0,1,0|1,0,0]=3 334 B11R1.87 O=S(=O)(Cl)C1=C(N=CC=C1)Br Z1269173131 [0,1,0,0,1,0|2,0,0]=4 335 B11R1.87 O=S(=O)(Cl)C1=C(N=CC=C1)Cl Z255149920 [0,1,0,0,1,0|2,0,0]=4 336 B11R1.87 O=S(=O)(Cl)C1=C(N=CC=C1)F Z1198320908 [0,1,0,0,1,0|2,0,0]=4 337 B11R1.87 O=S(=O)(F)C1=C(C=CC=C1)Br Z1618011881 [0,1,0,0,1,0|1,0,0]=3 338 B11R1.87 O=S(=O)(F)C1=C(C=CC=C1)F Z1255453477 [0,1,0,0,1,0|1,0,0]=3 339 B11R1.87 O=S(=O)(F)C1=C(C=CC=C1)I Z3016190841 [0,1,0,0,1,0|1,0,0]=3 340 B11R1.87 O=S(=O)(F)C1=C(C=CC=C1)O Z1513874585 [0,1,0,0,1,0|1,0,0]=3 341 B11R1.87 O=S(=O)(F)C1=C(C=CC=N1)Br Z2238704499 [0,1,0,0,1,0|2,0,0]=4 342 B11R1.87 O=S(=O)(F)C1=C(C=CC=N1)Cl Z3016191962 [0,1,0,0,1,0|2,0,0]=4 343 B11R1.87 O=S(=O)(F)C1=C(C=CC=N1)F Z1435995408 [0,1,0,0,1,0|2,0,0]=4 344 B11R1.87 O=S(=O)(F)C1=C(C=CN=C1)F Z4081436971 [0,1,0,0,1,0|2,0,0]=4 345 B11R1.87 O=S(=O)(F)C1=C(C=NC=C1)Br Z3271510006 [0,1,0,0,1,0|2,0,0]=4 346 B11R1.87 O=S(=O)(F)C1=C(C=NC=C1)Cl Z2471488261 [0,1,0,0,1,0|2,0,0]=4 347 B11R1.87 O=S(=O)(F)C1=C(C=NC=C1)F Z2784647169 [0,1,0,0,1,0|2,0,0]=4 348 B11R1.87 O=S(=O)(F)C1=C(N=CC=C1)O Z2907455200 [0,1,0,0,1,0|2,0,0]=4 349 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)F Z1862003147 [0,1,0,0,1,0|1,0,0]=3 350 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)N Z45415578 [0,1,0,0,1,0|1,0,0]=3 351 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)O Z1222423483 [0,1,0,0,1,0|0,0,0]=2 352 B11R1.155 CC1=CC(=CN=C1)S(=O)(=O)F Z2937408411 [0,1,0,0,1,0|2,0,0]=4 353 B11R1.155 CC1=CC(=CN=C1)S(=O)(=O)N Z1255417183 [0,1,0,0,1,0|2,0,0]=4 354 B11R1.155 CC1=CC(=NC=C1)S(=O)(=O)F Z3033607625 [0,1,0,0,1,0|2,0,0]=4 355 B11R1.155 CC1=CC(=NC=C1)S(=O)(=O)N Z854066780 [0,1,0,0,1,0|2,0,0]=4 356 B11R1.155 CC1=NC(=CC=C1)S(=O)(=O)F Z2761044379 [0,1,0,0,1,0|2,0,0]=4 357 B11R1.155 CC1=NC(=CC=C1)S(=O)(=O)N Z854066740 [0,1,0,0,1,0|2,0,0]=4 358 B11R1.155 CC1=NC=CC(=C1)S(=O)(=O)F Z3015835173 [0,1,0,0,1,0|2,0,0]=4 359 B11R1.155 CS(=O)(=O)C1=CC(=CC=C1)N Z104346634 [0,1,0,0,1,0|1,0,0]=3 360 B11R1.155 CS(=O)(=O)C1=CC(=CC=C1)O Z415743792 [0,1,0,0,1,0|1,0,0]=3 361 B11R1.155 CS(=O)(=O)C1=CC(=CN=C1)N Z1509473574 [0,1,0,0,1,0|2,0,0]=4 362 B11R1.155 CS(=O)(=O)C1=CC(=NC=C1)Cl Z1822349645 [0,1,0,0,1,0|2,0,0]=4 363 B11R1.155 CS(=O)(=O)C1=CC(=NC=C1)N Z1262648380 [0,1,0,0,1,0|2,0,0]=4 364 B11R1.155 CS(=O)(=O)C1=CC(=O)NC=C1 Z1198728920 [0,1,0,0,1,0|2,0,0]=4 365 B11R1.155 CS(=O)(=O)C1=NC(=CC=C1)Br Z1269179297 [0,1,0,0,1,0|2,0,0]=4 366 B11R1.155 CS(=O)(=O)C1=NC(=CC=C1)Cl Z1255365315 [0,1,0,0,1,0|2,0,0]=4 367 B11R1.155 CS(=O)(=O)C1=NC(=CC=C1)F Z1258977279 [0,1,0,0,1,0|2,0,0]=4 368 B11R1.155 CS(=O)(=O)C1=NC(=CC=C1)N Z1262635036 [0,1,0,0,1,0|2,0,0]=4 369 B11R1.155 NC1=CC(=CC=C1)S(=O)(=O)F Z1198148868 [0,1,0,0,1,0|1,0,0]=3 370 B11R1.155 NC1=CC(=CC=C1)S(=O)(=O)N Z56792385 [0,1,0,0,1,0|1,0,0]=3 371 B11R1.155 NC1=CC(=CC=C1)S(=O)(=O)O Z104474954 [0,1,0,0,1,0|0,0,0]=2 372 B11R1.155 NC1=CC(=CN=C1)S(=O)(=O)F Z2141645684 [0,1,0,0,1,0|2,0,0]=4 373 B11R1.155 NC1=CC(=CN=C1)S(=O)(=O)N Z1198315197 [0,1,0,0,1,0|2,0,0]=4 374 B11R1.155 NC1=CC(=NC=C1)S(=O)(=O)F Z2756505975 [0,1,0,0,1,0|2,0,0]=4 375 B11R1.155 NC1=NC(=CC=C1)S(=O)(=O)F Z5935066789 [0,1,0,0,1,0|2,0,0]=4 376 B11R1.155 NC1=NC(=CC=C1)S(=O)(=O)N Z3244948697 [0,1,0,0,1,0|2,0,0]=4 377 B11R1.155 NC1=NC=CC(=C1)S(=O)(=O)F Z5579404715 [0,1,0,0,1,0|2,0,0]=4 378 B11R1.155 NC1=NC=CC(=C1)S(=O)(=O)N Z2944610006 [0,1,0,0,1,0|2,0,0]=4 379 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)Br Z45415621 [0,1,0,0,1,0|1,0,0]=3 380 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)Cl Z45415583 [0,1,0,0,1,0|1,0,0]=3 381 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)F Z45415568 [0,1,0,0,1,0|1,0,0]=3 382 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)I Z385450656 [0,1,0,0,1,0|1,0,0]=3 383 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)O Z1255464009 [0,1,0,0,1,0|1,0,0]=3 384 B11R1.155 NS(=O)(=O)C1=CC(=CN=C1)Br Z838881858 [0,1,0,0,1,0|2,0,0]=4 385 B11R1.155 NS(=O)(=O)C1=CC(=CN=C1)Cl Z1238511500 [0,1,0,0,1,0|2,0,0]=4 386 B11R1.155 NS(=O)(=O)C1=CC(=NC=C1)Br Z4478175584 [0,1,0,0,1,0|2,0,0]=4 387 B11R1.155 NS(=O)(=O)C1=CC(=NC=C1)Cl Z728814030 [0,1,0,0,1,0|2,0,0]=4 388 B11R1.155 NS(=O)(=O)C1=NC(=CC=C1)Br Z1269164758 [0,1,0,0,1,0|2,0,0]=4 389 B11R1.155 NS(=O)(=O)C1=NC(=CC=C1)Cl Z1172231220 [0,1,0,0,1,0|2,0,0]=4 390 B11R1.155 NS(=O)(=O)C1=NC(=CC=C1)F Z1216838252 [0,1,0,0,1,0|2,0,0]=4 391 B11R1.155 O=S(=O)(Cl)C1=CC(=CC=C1)Br Z56933874 [0,1,0,0,1,0|1,0,0]=3 392 B11R1.155 O=S(=O)(Cl)C1=CC=CC(=C1)Cl Z56862786 [0,1,0,0,1,0|1,0,0]=3 393 B11R1.155 O=S(=O)(Cl)C1=CC=CC(=N1)F Z1198277879 [0,1,0,0,1,0|2,0,0]=4 394 B11R1.155 O=S(=O)(F)C1=CC(=CC=C1)Br Z1416188176 [0,1,0,0,1,0|1,0,0]=3 395 B11R1.155 O=S(=O)(F)C1=CC(=CN=C1)Br Z2738688408 [0,1,0,0,1,0|2,0,0]=4 396 B11R1.155 O=S(=O)(F)C1=CC(=NC=C1)O Z3489696413 [0,1,0,0,1,0|2,0,0]=4 397 B11R1.155 O=S(=O)(F)C1=CC=CC(=C1)F Z1198321511 [0,1,0,0,1,0|1,0,0]=3 398 B11R1.155 O=S(=O)(F)C1=CC=CC(=C1)O Z1618008040 [0,1,0,0,1,0|1,0,0]=3 399 B11R1.155 O=S(=O)(F)C1=CC=CC(=N1)O Z4607488463 [0,1,0,0,1,0|2,0,0]=4 400 B11R1.155 O=S(=O)(F)C1=NC=CC(=C1)Br Z3326604124 [0,1,0,0,1,0|2,0,0]=4 401 B11R1.155 O=S(=O)(F)C1=NC=CC(=C1)Cl Z3271510307 [0,1,0,0,1,0|2,0,0]=4 402 B11R1.155 O=S(=O)(F)C1=NC=CC(=C1)F Z3072398594 [0,1,0,0,1,0|2,0,0]=4 403 B11R1.105 O=S(=O)(F)CC1=C(C=CS1)Br Z2907459720 [0,1,0,0,1,0|2,0,0]=4 404 B13R1.157 CC1=C(C=CC=C1)CNS(=O)(=O)C Z133734958 [0,1,0,0,0,1|1,0,0]=3 405 B13R1.157 CC1=C(N=CC=C1)CNS(=O)(=O)C Z1130340537 [0,1,0,0,0,1|2,0,0]=4 406 B13R1.157 CS(=O)(=O)NCC1=C(C=CC=C1)Cl Z54814038 [0,1,0,0,0,1|1,0,0]=3 407 B13R1.157 CS(=O)(=O)NCC1=C(C=CC=C1)N Z905157986 [0,1,0,0,0,1|1,0,0]=3 408 B13R1.157 NS(=O)(=O)/C=C/C1=C(C=CC=C1)Cl Z2312957338 [0,1,0,0,0,1|1,0,1]=4 409 B13R1.157 NS(=O)(=O)CCC1=C(C=CC=C1)Br Z2106010033 [0,1,0,0,0,1|1,0,0]=3 410 B13R1.157 NS(=O)(=O)CCC1=C(C=CC=C1)F Z1622956560 [0,1,0,0,0,1|1,0,0]=3 411 B13R1.157 NS(=O)(=O)CCC1=C(C=NC=C1)Br Z3989668253 [0,1,0,0,0,1|2,0,0]=4 412 B13R1.157 O=S(=O)(F)CCC1=C(N=CC=C1)F Z3183222839 [0,1,0,0,0,1|2,0,0]=4 413 B13R1.254 C=CS(=O)(=O)NCC1=CC=CC=C1 Z1725963165 [0,1,0,0,0,1|1,0,0]=3 414 B13R1.254 CCS(=O)(=O)NCC1=CN=CC=C1 Z53825214 [0,1,0,0,0,1|2,0,0]=4 415 B13R1.254 CNS(=O)(=O)/C=C/C1=CC=CC=C1 Z45527675 [0,1,0,0,0,1|1,0,1]=4 416 B13R1.254 O=S(=O)(CBr)NCC1=CC=CC=C1 Z1269111608 [0,1,0,0,0,1|1,0,0]=3 417 B13R1.352 CC(CS(=O)(=O)N)C1=CC=CC=C1 Z954606858 [0,1,0,0,0,1|1,0,0]=3 418 B13R1.352 CC(NS(=O)(=O)C)C1=CC=CC=C1 Z53825003 [0,1,0,0,0,1|1,0,0]=3 419 B13R1.352 CC(NS(=O)(=O)C)C1=CC=NC=C1 Z133742558 [0,1,0,0,0,1|2,0,0]=4 420 B13R1.352 CC(NS(=O)(=O)C)C1=CN=CC=C1 Z133804144 [0,1,0,0,0,1|2,0,0]=4 421 B13R1.352 CS(=O)(=O)CC(=O)C1=CC=CC=C1 Z957336744 [0,1,0,0,0,1|1,0,0]=3 422 B13R1.352 CS(=O)(=O)CC(N)C1=CC=CC=C1 Z1333043359 [0,1,0,0,0,1|1,0,0]=3 423 B13R1.352 CS(=O)(=O)CC(O)C1=CC=CC=C1 Z822382694 [0,1,0,0,0,1|1,0,0]=3 424 B13R1.353 CN(CC1=CC=CC=C1)S(=O)(=O)N Z234894283 [0,1,0,0,0,1|1,0,0]=3 425 B13R1.353 CN(CC1=NC=CC=C1)S(=O)(=O)F Z2234630891 [0,1,0,0,0,1|2,0,0]=4 426 B13R1.353 O=S(=O)([O-])C(O)CC1=CC=CC=C1 Z1836638623 [0,1,0,0,0,1|0,0,1]=3 427 B13R1.512 CC1=CC=C(C=C1)/C=C/S(=O)(=O)F Z2289722684 [0,1,0,0,0,1|1,0,1]=4 428 B13R1.512 CC1=CC=C(C=C1)CCS(=O)(=O)N Z1255386626 [0,1,0,0,0,1|1,0,0]=3 429 B13R1.512 CS(=O)(=O)CCC1=CC=C(C=C1)N Z732208102 [0,1,0,0,0,1|1,0,0]=3 430 B13R1.512 CS(=O)(=O)NCC1=CC=C(C=C1)F Z53860763 [0,1,0,0,0,1|1,0,0]=3 431 B13R1.512 CS(=O)(=O)NCC1=CC=C(C=C1)N Z439707094 [0,1,0,0,0,1|1,0,0]=3 432 B13R1.512 NC1=CC=C(C=C1)CCS(=O)(=O)N Z56761663 [0,1,0,0,0,1|1,0,0]=3 433 B13R1.512 NS(=O)(=O)/C=C/C1=CC=C(C=C1)F Z431513220 [0,1,0,0,0,1|1,0,1]=4 434 B13R1.512 NS(=O)(=O)CCC1=CC=C(C=C1)Br Z1622956442 [0,1,0,0,0,1|1,0,0]=3 435 B13R1.512 NS(=O)(=O)CCC1=CC=C(C=C1)Cl Z1269139968 [0,1,0,0,0,1|1,0,0]=3 436 B13R1.512 O=S(=O)(F)/C=C/C1=CC=C(C=C1)Cl Z2568739587 [0,1,0,0,0,1|1,0,1]=4 437 B13R1.512 O=S(=O)(F)/C=C/C1=CC=C(C=C1)F Z2512959244 [0,1,0,0,0,1|1,0,1]=4 438 B13R1.512 O=S(=O)(F)C#CC1=CC=C(C=C1)F Z4450333368 [0,1,0,0,0,1|1,0,1]=4 439 B13R1.512 O=S(=O)(F)CCC1=CN=C(C=C1)F Z3182764106 [0,1,0,0,0,1|2,0,0]=4 440 B13R1.838 CC1=CC(=CC=C1)CCS(=O)(=O)N Z1622956963 [0,1,0,0,0,1|1,0,0]=3 441 B13R1.838 CS(=O)(=O)NCC1=CC(=CC=C1)Br Z818728940 [0,1,0,0,0,1|1,0,0]=3 442 B13R1.838 CS(=O)(=O)NCC1=CC(=CC=C1)Cl Z53825310 [0,1,0,0,0,1|1,0,0]=3 443 B13R1.838 CS(=O)(=O)NCC1=CC(=CC=C1)F Z369327462 [0,1,0,0,0,1|1,0,0]=3 444 B13R1.838 CS(=O)(=O)NCC1=CC(=NC=C1)O Z1591876038 [0,1,0,0,0,1|2,0,0]=4 445 B13R1.838 NS(=O)(=O)/C=C/C1=CC(=CC=C1)Br Z431513240 [0,1,0,0,0,1|1,0,1]=4 446 B13R1.838 NS(=O)(=O)CCC1=CC(=CC=C1)Cl Z1622956480 [0,1,0,0,0,1|1,0,0]=3 447 B13R1.838 NS(=O)(=O)CCC1=CC(=CC=C1)F Z1622956736 [0,1,0,0,0,1|1,0,0]=3 448 B13R1.4 CCC1=CC=C(C=C1)CS(=O)(=O)N Z905070786 [0,2,0,0,0,0|1,0,0]=3 449 B13R1.4 CNC1=CC=C(C=C1)NS(=O)(=O)C Z4951115187 [0,2,0,0,0,0|2,0,0]=4 450 B13R1.4 COC1=CC=C(C=C1)CS(=O)(=O)F Z2732843735 [0,2,0,0,0,0|1,0,0]=3 451 B13R1.4 CS(=O)(=O)CC1=CC=C(C=C1)CN Z234897389 [0,2,0,0,0,0|1,0,0]=3 452 B13R1.4 CS(=O)(=O)NC1=CC=C(C=C1)CN Z426041412 [0,2,0,0,0,0|2,0,0]=4 453 B13R1.4 N#CC1=CC=C(C=C1)CS(=O)(=O)Cl Z132909014 [0,2,0,0,0,0|1,0,0]=3 454 B13R1.4 N#CC1=CC=C(C=C1)CS(=O)(=O)N Z132909012 [0,2,0,0,0,0|1,0,0]=3 455 B13R1.4 N#CC1=CC=C(C=C1)NS(=O)(=O)N Z295879602 [0,2,0,0,0,0|2,0,0]=4 456 B13R1.4 N#CC1=CC=C(C=C1)OS(=O)(=O)F Z2311221859 [0,2,0,0,0,0|2,0,0]=4 457 B13R1.4 NCC1=CC=C(C=C1)CS(=O)(=O)F Z3481793872 [0,2,0,0,0,0|1,0,0]=3 458 B13R1.4 NCC1=CC=C(C=C1)CS(=O)(=O)N Z169852200 [0,2,0,0,0,0|1,0,0]=3 459 B13R1.4 NS(=O)(=O)CC1=CC=C(C=C1)CO Z1267897781 [0,2,0,0,0,0|1,0,0]=3 460 B13R1.4 O=S(=O)(F)OC1=CC=C(C=C1)CBr Z4061271648 [0,2,0,0,0,0|2,0,0]=4 461 B13R1.249 CCS(=O)(=O)CC1=CC=C(C=C1)I Z1587466067 [0,2,0,0,0,0|1,0,0]=3 462 B13R1.249 CCS(=O)(=O)CC1=CC=C(C=C1)N Z424777372 [0,2,0,0,0,0|1,0,0]=3 463 B13R1.249 CCS(=O)(=O)NC1=CC=C(C=C1)N Z239122842 [0,2,0,0,0,0|2,0,0]=4 464 B13R1.518 CC1=C(C=C(C=C1)CS(=O)(=O)N)F Z1143279263 [0,2,0,0,0,0|1,0,0]=3 465 B13R1.518 CC1=C(C=C(C=C1)NS(=O)(=O)C)Br Z299687088 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.518 CC1=C(C=C(C=C1)NS(=O)(=O)C)Cl Z45634875 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.518 CC1=C(C=CC(=C1)NS(=O)(=O)C)Br Z45683595 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.518 CS(=O)(=O)CC1=CC(=C(C=C1)N)F Z1389032807 [0,2,0,0,0,0|1,0,0]=3 469 B13R1.518 CS(=O)(=O)NC1=CC(=C(C=C1)Cl)N Z239123212 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.518 CS(=O)(=O)NC1=CC(=C(C=C1)O)Cl Z56919053 [0,2,0,0,0,0|2,0,0]=4 471 B13R1.518 NS(=O)(=O)CC1=CC(=C(C=C1)Br)F Z1450934866 [0,2,0,0,0,0|1,0,0]=3 472 B13R1.518 NS(=O)(=O)CC1=CC(=C(C=C1)Cl)F Z954606250 [0,2,0,0,0,0|1,0,0]=3 473 B13R1.525 CC(C1=CC=C(C=C1)Br)S(=O)(=O)C Z1322792819 [0,2,0,0,0,0|1,0,0]=3 474 B13R1.525 CC(C1=CC=C(C=C1)F)S(=O)(=O)F Z3016380851 [0,2,0,0,0,0|1,0,0]=3 475 B13R1.525 CN(C1=CC=C(C=C1)F)S(=O)(=O)C Z738406244 [0,2,0,0,0,0|2,0,0]=4 476 B13R1.525 CN(C1=CC=C(C=C1)O)S(=O)(=O)C Z57472865 [0,2,0,0,0,0|2,0,0]=4 477 B13R1.883 CC1=C(C=CC(=C1)Br)NS(=O)(=O)C Z45620595 [0,2,0,0,0,0|2,0,0]=4 478 B13R1.883 CC1=C(C=CC(=C1)F)NS(=O)(=O)C Z45583075 [0,2,0,0,0,0|2,0,0]=4 479 B13R1.883 CC1=C(C=CC(=C1)N)NS(=O)(=O)C Z56754132 [0,2,0,0,0,0|2,0,0]=4 480 B13R1.883 CC1=CC(=C(C=C1)CS(=O)(=O)F)C Z2900722955 [0,2,0,0,0,0|1,0,0]=3 481 B13R1.883 CC1=CC(=C(C=C1)CS(=O)(=O)N)Br Z1513695834 [0,2,0,0,0,0|1,0,0]=3 482 B13R1.883 CC1=CC(=C(C=C1)NS(=O)(=O)C)N Z407894218 [0,2,0,0,0,0|2,0,0]=4 483 B13R1.883 CS(=O)(=O)CC1=C(C=C(C=C1)Cl)N Z955149516 [0,2,0,0,0,0|1,0,0]=3 484 B13R1.883 CS(=O)(=O)CC1=C(C=C(C=C1)F)Cl Z416899486 [0,2,0,0,0,0|1,0,0]=3 485 B13R1.883 CS(=O)(=O)CC1=C(C=C(C=C1)N)Cl Z905076298 [0,2,0,0,0,0|1,0,0]=3 486 B13R1.883 CS(=O)(=O)CC1=C(C=C(C=C1)N)F Z1250078787 [0,2,0,0,0,0|1,0,0]=3 487 B13R1.883 CS(=O)(=O)NC1=C(C=C(C=C1)Br)Cl Z45582655 [0,2,0,0,0,0|2,0,0]=4 488 B13R1.883 CS(=O)(=O)NC1=C(C=C(C=C1)Cl)F Z45686255 [0,2,0,0,0,0|2,0,0]=4 489 B13R1.883 CS(=O)(=O)NC1=C(C=C(C=C1)N)Cl Z239123092 [0,2,0,0,0,0|2,0,0]=4 490 B13R1.883 NS(=O)(=O)CC1=C(C=C(C=C1)Br)Br Z1947253724 [0,2,0,0,0,0|1,0,0]=3 491 B13R1.883 NS(=O)(=O)CC1=C(C=C(C=C1)Br)F Z734461548 [0,2,0,0,0,0|1,0,0]=3 492 B13R1.883 NS(=O)(=O)CC1=C(C=C(C=C1)Cl)Br Z1463324413 [0,2,0,0,0,0|1,0,0]=3 493 B13R1.883 NS(=O)(=O)CC1=C(C=C(C=C1)F)F Z954606344 [0,2,0,0,0,0|1,0,0]=3 494 B13R1.883 O=S(=O)(F)CC1=C(C=C(C=C1)Br)F Z993078974 [0,2,0,0,0,0|1,0,0]=3 495 B13R1.883 O=S(=O)(F)OC1=C(C=C(C=C1)Cl)F Z3919193524 [0,2,0,0,0,0|2,0,0]=4 496 B13R1.80 COC1=CC(=CC=C1)CS(=O)(=O)N Z954606354 [0,2,0,0,0,0|1,0,0]=3 497 B13R1.80 CS(=O)(=O)CC1=CC(=CC=C1)CN Z875026002 [0,2,0,0,0,0|1,0,0]=3 498 B13R1.80 CS(=O)(=O)NC1=CC(=CC=C1)C#N Z45702495 [0,2,0,0,0,0|2,0,0]=4 499 B13R1.80 CS(=O)(=O)NC1=CC(=CC=C1)C=O Z1065768476 [0,2,0,0,0,0|2,0,0]=4 500 B13R1.80 CS(=O)(=O)NC1=CC(=CC=C1)CN Z234815910 [0,2,0,0,0,0|2,0,0]=4 501 B13R1.80 CSC1=CC(=CC=C1)OS(=O)(=O)F Z3919190844 [0,2,0,0,0,0|2,0,0]=4 502 B13R1.80 N#CC1=CC=CC(=C1)CS(=O)(=O)Cl Z316120018 [0,2,0,0,0,0|1,0,0]=3 503 B13R1.80 N#CC1=CC=CC(=C1)CS(=O)(=O)N Z374753998 [0,2,0,0,0,0|1,0,0]=3 504 B13R1.80 N#CC1=CC=CC(=C1)NS(=O)(=O)N Z295879604 [0,2,0,0,0,0|2,0,0]=4 505 B13R1.80 N#CC1=CC=CC(=C1)OS(=O)(=O)F Z3919172339 [0,2,0,0,0,0|2,0,0]=4 506 B13R1.80 NCC1=CC(=CC=C1)CS(=O)(=O)N Z666675130 [0,2,0,0,0,0|1,0,0]=3 507 B13R1.80 NCC1=CC(=CC=C1)NS(=O)(=O)N Z235361239 [0,2,0,0,0,0|2,0,0]=4 508 B13R1.151 CC1=C(C=CC=C1Br)CS(=O)(=O)N Z1622956620 [0,2,0,0,0,0|1,0,0]=3 509 B13R1.151 CC1=C(C=CC=C1N)CS(=O)(=O)C Z732208096 [0,2,0,0,0,0|1,0,0]=3 510 B13R1.151 CS(=O)(=O)NC1=C(C(=CC=C1)Cl)Br Z1837233661 [0,2,0,0,0,0|2,0,0]=4 511 B13R1.151 NC1=C(C(=CC=C1)OS(=O)(=O)F)F Z3919187657 [0,2,0,0,0,0|2,0,0]=4 512 B13R1.151 NS(=O)(=O)CC1=C(C(=CC=C1)Br)Br Z3013883003 [0,2,0,0,0,0|1,0,0]=3 513 B13R1.151 NS(=O)(=O)CC1=C(C(=CC=C1)Cl)Br Z2755858328 [0,2,0,0,0,0|1,0,0]=3 514 B13R1.151 NS(=O)(=O)CC1=C(C(=CC=C1)Cl)F Z1622956385 [0,2,0,0,0,0|1,0,0]=3 515 B13R1.151 NS(=O)(=O)CC1=C(C(=CC=C1)F)Br Z1460728593 [0,2,0,0,0,0|1,0,0]=3 516 B13R1.151 NS(=O)(=O)CC1=C(C(=CC=C1)F)F Z734461558 [0,2,0,0,0,0|1,0,0]=3 517 B13R1.151 O=S(=O)(F)OC1=C(C(=CC=C1)Cl)Cl Z3919193310 [0,2,0,0,0,0|2,0,0]=4 518 B13R1.250 CCS(=O)(=O)NC1=CC(=CC=C1)O Z56116124 [0,2,0,0,0,0|2,0,0]=4 519 B13R1.894 CC1=C(C=C(C=C1)N)NS(=O)(=O)C Z239123020 [0,2,0,0,0,0|2,0,0]=4 520 B13R1.894 CC1=CC(=C(C=C1)Br)CS(=O)(=O)N Z1622956050 [0,2,0,0,0,0|1,0,0]=3 521 B13R1.894 CS(=O)(=O)CC1=C(C=CC(=C1)F)N Z732208108 [0,2,0,0,0,0|1,0,0]=3 522 B13R1.894 CS(=O)(=O)NC1=C(C=CC(=C1)Cl)Cl Z45633755 [0,2,0,0,0,0|2,0,0]=4 523 B13R1.894 CS(=O)(=O)NC1=C(C=CC(=C1)F)N Z1105578640 [0,2,0,0,0,0|2,0,0]=4 524 B13R1.894 CS(=O)(=O)NC1=C(C=CC(=C1)N)Cl Z431587684 [0,2,0,0,0,0|2,0,0]=4 525 B13R1.894 CS(=O)(=O)NC1=C(C=CC(=C1)N)F Z235351189 [0,2,0,0,0,0|2,0,0]=4 526 B13R1.894 NC1=CC(=C(C=C1)F)CS(=O)(=O)F Z2690411871 [0,2,0,0,0,0|1,0,0]=3 527 B13R1.894 NC1=CC(=C(C=C1)F)OS(=O)(=O)F Z3919189519 [0,2,0,0,0,0|2,0,0]=4 528 B13R1.894 NS(=O)(=O)CC1=C(C=CC(=C1)Cl)Br Z1270391469 [0,2,0,0,0,0|1,0,0]=3 529 B13R1.894 NS(=O)(=O)CC1=C(C=CC(=C1)Cl)F Z1379440997 [0,2,0,0,0,0|1,0,0]=3 530 B13R1.894 NS(=O)(=O)CC1=C(C=CC(=C1)F)Cl Z1783094274 [0,2,0,0,0,0|1,0,0]=3 531 B13R1.3421 CC1=CC(=CC(=C1)CS(=O)(=O)N)C Z733373938 [0,2,0,0,0,0|1,0,0]=3 532 B13R1.3421 NC1=CC(=CC(=C1)Br)OS(=O)(=O)F Z3919179150 [0,2,0,0,0,0|2,0,0]=4 533 B13R1.3421 NS(=O)(=O)CC1=CC(=CC(=C1)Cl)Cl Z954606128 [0,2,0,0,0,0|1,0,0]=3 534 B13R1.3492 CC(C1=CC(=CC=C1)Cl)S(=O)(=O)N Z954606516 [0,2,0,0,0,0|1,0,0]=3 535 B13R1.276 CC(C1=C(C=CC=C1)F)S(=O)(=O)C Z736241034 [0,2,0,0,0,0|1,0,0]=3 536 B13R1.276 CC(C1=C(C=CC=C1)F)S(=O)(=O)N Z954606626 [0,2,0,0,0,0|1,0,0]=3 537 B13R1.276 CN(C1=C(C=CC=C1)N)S(=O)(=O)C Z905156774 [0,2,0,0,0,0|2,0,0]=4 538 B13R1.622 CCC1=C(C=CC=C1)CS(=O)(=O)[O-] Z4924257141 [0,2,0,0,0,0|0,0,1]=3 539 B13R1.622 COC1=C(C=CC=C1)CS(=O)(=O)F Z2732843737 [0,2,0,0,0,0|1,0,0]=3 540 B13R1.622 COC1=C(C=CC=C1)CS(=O)(=O)N Z839114522 [0,2,0,0,0,0|1,0,0]=3 541 B13R1.622 CS(=O)(=O)CC1=C(C=CC=C1)CN Z1245645619 [0,2,0,0,0,0|1,0,0]=3 542 B13R1.622 CS(=O)(=O)NC1=C(C=CC=C1)C#N Z45696615 [0,2,0,0,0,0|2,0,0]=4 543 B13R1.622 CS(=O)(=O)NC1=C(C=CC=C1)CN Z415636826 [0,2,0,0,0,0|2,0,0]=4 544 B13R1.622 N#CC1=C(C=CC=C1)CS(=O)(=O)Cl Z115458456 [0,2,0,0,0,0|1,0,0]=3 545 B13R1.622 N#CC1=C(C=CC=C1)CS(=O)(=O)N Z132909010 [0,2,0,0,0,0|1,0,0]=3 546 B13R1.622 NCC1=C(C=CC=C1)CS(=O)(=O)N Z3064010645 [0,2,0,0,0,0|1,0,0]=3 547 B13R1.3788 CC1=CC=CC(=C1CS(=O)(=O)N)C Z1525491547 [0,2,0,0,0,0|1,0,0]=3 548 B13R1.3788 CS(=O)(=O)CC1=C(C=CC=C1N)F Z1124525646 [0,2,0,0,0,0|1,0,0]=3 549 B13R1.3788 CS(=O)(=O)CC1=C(C=NC=C1Cl)Cl Z2763044434 [0,2,0,0,0,0|2,0,0]=4 550 B13R1.3788 NS(=O)(=O)CC1=C(C=CC=C1Br)Br Z3013882997 [0,2,0,0,0,0|1,0,0]=3 551 B13R1.3788 NS(=O)(=O)CC1=C(C=CC=C1F)Cl Z274593624 [0,2,0,0,0,0|1,0,0]=3 552 B13R1.3788 NS(=O)(=O)CC1=C(C=CC=C1F)F Z954606384 [0,2,0,0,0,0|1,0,0]=3 553 B13R1.263 CNS(=O)(=O)C(C)C1=CC=CC=C1 Z2105185528 [0,2,0,0,0,0|1,0,0]=3 554 B13R1.1073 CC(C)S(=O)(=O)CC1=CC=CC=C1 Z2442616664 [0,2,0,0,0,0|1,0,0]=3 555 B13R1.1073 CC(O)(CC1=CC=CC=C1)C(=O)O Z1079110682 [0,2,0,0,0,0|2,0,0]=4 556 B13R1.1073 C[C@@](O)(CC1=CC=CC=C1)C(=O)O Z1198165765 [0,2,0,0,0,0|2,0,0]=4 557 B13R1.1073 C[C@](O)(CC1=CC=CC=C1)C(=O)O Z1198165764 [0,2,0,0,0,0|2,0,0]=4 558 B13R1.1327 NCCS(=O)(=O)CC1=CC=CC=C1 Z425449646 [0,2,0,0,0,0|1,0,0]=3 559 B13R1.1327 NCCS(=O)(=O)NC1=CC=CC=C1 Z445129434 [0,2,0,0,0,0|2,0,0]=4 560 B13R1.719 CCC(C1=CC=CC=C1)S(=O)(=O)N Z954606670 [0,2,0,0,0,0|1,0,0]=3 561 B13R1.719 CCN(C1=CC=CC=C1)S(=O)(=O)N Z300101262 [0,2,0,0,0,0|2,0,0]=4 562 B13R1.719 NCC(C1=CC=CC=C1)S(=O)(=O)O Z1509515000 [0,2,0,0,0,0|0,0,0]=2 563 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [1,0,0,1,0,0|2,0,0]=4 564 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,1,0,0|2,0,0]=4 565 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,1,0,0|2,0,0]=4 566 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [1,0,0,1,0,0|2,0,0]=4 567 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [1,0,0,1,0,0|2,0,0]=4 568 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [1,0,0,1,0,0|2,0,0]=4 569 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [1,0,0,1,0,0|2,0,0]=4 570 B13R2.222 O=S1(=O)CCC2=C(N1)C=CC=C2 Z1862025194 [0,0,0,1,0,1|1,0,0]=3 571 B13R2.3051 NC1=CC2=C(C=C1)CS(=O)(=O)C2 Z1198151701 [0,1,0,1,0,0|1,0,0]=3 572 B13R2.3051 O=S1(=O)CC2=C(N1)C=CC(=C2)Cl Z1171508993 [0,1,0,1,0,0|1,0,0]=3 573 B13R2.4826 O=S1(=O)CC2=C(C=CC=C2N1)Br Z2616651998 [0,1,0,1,0,0|1,0,0]=3 574 B13R2.4826 O=S1(=O)CC2=CC=CC(=C2N1)Br Z3007097474 [0,1,0,1,0,0|1,0,0]=3 575 B13R2.243 CN1C2=C(C=CC=C2)NS1(=O)=O Z1198163788 [0,1,0,1,0,0|2,0,0]=4 576 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,0,0,0,1,0|2,0,0]=4 577 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,0,0,0,1,0|2,0,0]=4 578 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,0,0,0,1,0|2,0,0]=4 579 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,0,0,0,1,0|2,0,0]=4 580 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [1,0,0,0,1,0|1,0,0]=3 581 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [1,0,0,0,1,0|2,0,0]=4 582 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [1,0,0,0,1,0|2,0,0]=4 583 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [1,0,0,0,1,0|2,0,0]=4 584 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [1,0,0,0,1,0|0,0,1]=3 585 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [1,0,0,0,1,0|1,0,1]=4 586 B9R1.13 O=C(O)CC1=CC=CO1 Z1179936226 [1,0,0,0,1,0|2,0,0]=4 587 B9R1.13 O=C(O)CC1=CC=CS1 Z104473344 [1,0,0,0,1,0|2,0,0]=4 588 B9R1.13 O=C(O)CC1=CNC=C1 Z1154253211 [1,0,0,0,1,0|2,0,0]=4 589 B9R1.13 O=C(O)CC1=COC=C1 Z1179936188 [1,0,0,0,1,0|2,0,0]=4 590 B9R1.13 O=C(O)CC1=CSC=C1 Z56922167 [1,0,0,0,1,0|2,0,0]=4 591 B9R1.13 O=C(O)CN1C=CC=C1 Z245326698 [1,0,0,0,1,0|2,0,0]=4 592 B9R1.19 CS(=O)(=O)C1=CC=CS1 Z1201618320 [0,0,0,0,2,0|2,0,0]=4 593 B9R1.19 CS(=O)(=O)C1=CSC=C1 Z1198151683 [0,0,0,0,2,0|2,0,0]=4 594 B9R1.19 NS(=O)(=O)C1=CC=CS1 Z45415560 [0,0,0,0,2,0|2,0,0]=4 595 B9R1.19 NS(=O)(=O)C1=CSC=C1 Z1198162755 [0,0,0,0,2,0|2,0,0]=4 596 B9R1.19 O=S(=O)(Cl)C1=CC=CO1 Z1180060459 [0,0,0,0,2,0|2,0,0]=4 597 B9R1.19 O=S(=O)(Cl)C1=CC=CS1 Z96092279 [0,0,0,0,2,0|2,0,0]=4 598 B9R1.19 O=S(=O)(Cl)C1=COC=C1 Z1180060297 [0,0,0,0,2,0|2,0,0]=4 599 B9R1.19 O=S(=O)(Cl)C1=CSC=C1 Z1201621835 [0,0,0,0,2,0|2,0,0]=4 600 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [1,0,0,0,0,1|2,0,0]=4 601 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [1,0,0,0,0,1|2,0,0]=4 602 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [1,0,0,0,0,1|2,0,0]=4 603 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [1,0,0,0,0,1|2,0,0]=4 604 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [1,0,0,0,0,1|2,0,0]=4 605 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [1,0,0,0,0,1|2,0,0]=4 606 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [1,0,0,0,0,1|2,0,0]=4 607 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [1,0,0,0,0,1|2,0,0]=4 608 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [1,0,0,0,0,1|2,0,0]=4 609 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [1,0,0,0,0,1|2,0,0]=4 610 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 Z104474406 [1,0,0,0,0,1|1,0,1]=4 611 B11R1.91 O=C(O)C#CC1=CC=CC=C1 Z271128592 [1,0,0,0,0,1|1,0,1]=4 612 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [1,0,0,0,0,1|1,0,0]=3 613 B11R1.91 O=C(O)CCC1=CC=NC=C1 Z317037982 [1,0,0,0,0,1|2,0,0]=4 614 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [1,0,0,0,0,1|2,0,0]=4 615 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [1,0,0,0,0,1|2,0,0]=4 616 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [1,0,0,0,0,1|1,0,0]=3 617 B11R1.91 O=C(O)CNC1=CC=NC=C1 Z2350906909 [1,0,0,0,0,1|2,0,0]=4 618 B11R1.91 O=C(O)CNC1=CN=CC=C1 Z3058782338 [1,0,0,0,0,1|2,0,0]=4 619 B11R1.91 O=C(O)CNC1=NC=CC=C1 Z2470036492 [1,0,0,0,0,1|2,0,0]=4 620 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [1,0,0,0,0,1|1,0,0]=3 621 B11R1.91 O=C(O)COC1=CN=CC=C1 Z1171978878 [1,0,0,0,0,1|2,0,0]=4 622 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [1,0,0,0,0,1|1,0,0]=3 623 B11R1.91 O=C(O)CSC1=CC=NC=C1 Z104479390 [1,0,0,0,0,1|2,0,0]=4 624 B11R1.91 O=C(O)CSC1=NC=CC=C1 Z31205663 [1,0,0,0,0,1|2,0,0]=4 625 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 Z995234780 [1,0,0,0,0,1|1,0,1]=4 626 B11R1.91 O=[N+]([O-])CSC1=CC=CC=C1 Z1255375331 [1,0,0,0,0,1|1,0,1]=4 627 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [1,0,0,0,0,1|1,0,1]=4 628 B13R1.3523 CS(=O)(=O)NCCC1=CC=NC=C1 Z1238654249 [0,0,0,0,0,2|2,0,0]=4 629 B13R1.3523 CS(=O)(=O)NCCC1=CN=CC=C1 Z300622420 [0,0,0,0,0,2|2,0,0]=4 630 B13R1.3523 NS(=O)(=O)CCCC1=CC=CC=C1 Z820117348 [0,0,0,0,0,2|1,0,0]=3 631 B13R1.3523 NS(=O)(=O)CCOC1=CC=CC=C1 Z839122596 [0,0,0,0,0,2|1,0,0]=3 632 B13R1.3523 NS(=O)(=O)CCSC1=CC=CC=C1 Z1251373183 [0,0,0,0,0,2|1,0,0]=3 633 B13R1.3523 O=S(=O)(Cl)CCSC1=CC=CC=C1 Z1203133316 [0,0,0,0,0,2|1,0,0]=3