0 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 Z1255485389 [0,0,0,0,0,0|1,0,3]=4 1 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 Z31506242 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 Z513733918 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.36 CC(C)C(=O)C1=CN=CC=C1 Z513733850 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.36 CC(C)C(N)C1=CC=NC=C1 Z513796098 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.36 CC(C)C(N)C1=NC=CC=C1 Z513795924 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.36 CC(C)C(O)C1=NC=CC=C1 Z513749462 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 Z199509008 [0,0,0,0,0,0|1,0,2]=3 11 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,0,0,0,0,0|1,0,0]=1 12 B11R1.36 CC(N)C(O)C1=CC=NC=C1 Z1263602353 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,0,0,0,0,0|2,0,0]=2 14 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.36 CN(O)C(=O)C1=CC=CC=C1 Z1416187404 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,0,0,0,0,0|2,0,1]=3 17 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,0,0,0,0,0|2,0,1]=3 26 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,0,0,0,0,0|2,1,1]=4 27 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,0,0,0,0,0|2,0,1]=3 29 B11R1.36 O=C([O-])C(O)C1=NC=CC=C1 Z2357023524 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,0,0,0,0,0|1,0,1]=3 31 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,0,0,0,0,0|0,0,2]=3 32 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,0,0,0,0,0|0,0,2]=3 36 B10R1.15 CCC(=O)C1=CC=NC=C1 Z513733916 [1,0,0,0,0,0|1,0,2]=4 37 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [1,0,0,0,0,0|1,0,0]=2 38 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [1,0,0,0,0,0|0,0,0]=1 40 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [1,0,0,0,0,0|1,0,0]=2 41 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [1,0,0,0,0,0|1,0,2]=4 47 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,0,0,0,0,0|1,0,0]=2 48 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [1,0,0,0,0,0|1,0,2]=4 49 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,0,0,0,0,0|0,0,2]=3 52 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [1,0,0,0,0,0|1,0,2]=4 53 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,0,0,0,0,0|1,0,0]=2 54 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,0,0,0,0,0|0,0,0]=1 55 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [1,0,0,0,0,0|1,0,0]=2 57 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,0,0,0,0,0|1,0,2]=4 58 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,0,0,0,0,0|1,0,2]=4 61 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,0,0,0,0,0|1,0,2]=4 62 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,0,0,0,0|2,0,1]=4 66 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [1,0,0,0,0,0|1,0,0]=2 73 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,0,0,0,0,0|1,0,1]=3 79 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [1,0,0,0,0,0|2,0,1]=4 80 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [1,0,0,0,0,0|2,0,1]=4 81 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,0,0,0,0|1,0,1]=3 82 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,0,0,0,0,0|2,0,1]=4 83 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,0,0,0,0|2,0,1]=4 84 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,0,0,0,0,0|1,0,1]=3 85 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,1,0,0,0,0|2,0,1]=4 90 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,1,0,0,0,0|2,0,1]=4 91 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)Cl Z385417200 [0,1,0,0,0,0|1,0,2]=4 92 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)N Z1198162397 [0,1,0,0,0,0|1,0,2]=4 93 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O Z1198150713 [0,1,0,0,0,0|1,0,2]=4 94 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Br Z3211605350 [0,1,0,0,0,0|2,0,0]=3 95 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Cl Z221528970 [0,1,0,0,0,0|2,0,0]=3 96 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)F Z99598998 [0,1,0,0,0,0|2,0,0]=3 97 B12R1.20 CC(C)C(O)C1=CC=C(C=C1)Cl Z513748660 [0,1,0,0,0,0|1,0,0]=2 98 B12R1.20 CC(C)C(O)C1=NC=C(C=C1)Br Z1649738214 [0,1,0,0,0,0|2,0,0]=3 99 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Br Z56928896 [0,1,0,0,0,0|1,0,2]=4 100 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Cl Z85933873 [0,1,0,0,0,0|1,0,2]=4 101 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)F Z56968508 [0,1,0,0,0,0|1,0,2]=4 102 B12R1.20 CC(N)C(=O)C1=CC=C(C=C1)Cl Z3023980683 [0,1,0,0,0,0|0,0,2]=3 103 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)Br Z336086694 [0,1,0,0,0,0|0,0,0]=1 104 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)F Z336086696 [0,1,0,0,0,0|0,0,0]=1 105 B12R1.20 CC1=CC=C(C=C1)C(=O)C(C)Cl Z56921784 [0,1,0,0,0,0|1,0,2]=4 106 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,1,0,0,0,0|2,0,1]=4 109 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,1,0,0,0,0|2,0,1]=4 110 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,1,0,0,0,0|2,0,1]=4 111 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [0,1,0,0,0,0|2,0,1]=4 112 B12R1.34 C=C(C#N)C(O)C1=CC=CC=C1 Z320966940 [0,1,0,0,0,0|0,0,3]=4 113 B12R1.34 CC(C1=CC=CC=C1)C(N)CO Z1262398547 [0,1,0,0,0,0|1,0,0]=2 114 B12R1.34 CC(CN)N(C)C1=CC=CC=C1 Z228572562 [0,1,0,0,0,0|2,0,0]=3 115 B12R1.34 CC(CO)C(=O)C1=CC=CC=C1 Z1198183441 [0,1,0,0,0,0|1,0,2]=4 116 B12R1.34 CCC(N)C(C)C1=CC=CC=C1 Z1318372590 [0,1,0,0,0,0|1,0,0]=2 117 B12R1.34 CCC(N)C(O)C1=CC=CC=C1 Z1695783907 [0,1,0,0,0,0|0,0,0]=1 118 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 Z594038166 [0,1,0,0,0,0|2,0,1]=4 119 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 Z1203869997 [0,1,0,0,0,0|1,0,1]=3 120 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 Z57046237 [0,1,0,0,0,0|2,0,1]=4 121 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 Z56757232 [0,1,0,0,0,0|2,0,1]=4 122 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 Z19752945 [0,1,0,0,0,0|1,0,1]=3 123 B12R1.34 COC(=O)C(O)C1=CN=CC=C1 Z1250100620 [0,1,0,0,0,0|2,0,1]=4 124 B12R1.34 COC(=O)C(O)C1=NC=CC=C1 Z4130150180 [0,1,0,0,0,0|2,0,1]=4 125 B12R1.34 NC(CO)C(O)C1=CC=NC=C1 Z2696777507 [0,1,0,0,0,0|1,0,0]=2 126 B12R1.34 NC(CO)C(O)C1=NC=CC=C1 Z2694807446 [0,1,0,0,0,0|1,0,0]=2 127 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.124 CC(C)C(=O)C1=C(C=CC=C1)Br Z851790218 [0,1,0,0,0,0|1,0,2]=4 129 B12R1.124 CC(C)C(=O)C1=C(C=CC=C1)Cl Z733415220 [0,1,0,0,0,0|1,0,2]=4 130 B12R1.124 CC(C)C(N)C1=C(C=CC=C1)Cl Z733415566 [0,1,0,0,0,0|2,0,0]=3 131 B12R1.124 CC(C)C(N)C1=C(C=CC=C1)N Z1198748043 [0,1,0,0,0,0|2,0,0]=3 132 B12R1.124 CC(C)N(C)C1=C(C=CC=C1)N Z1993522745 [0,1,0,0,0,0|3,0,0]=4 133 B12R1.124 CC(N)C(C)C1=C(C=CC=C1)Cl Z3185477902 [0,1,0,0,0,0|1,0,0]=2 134 B12R1.124 CC(N)C(O)C1=C(C=CC=C1)F Z1272096622 [0,1,0,0,0,0|0,0,0]=1 135 B12R1.124 CC1=C(C=CC=C1)C(=O)C(C)C Z513734868 [0,1,0,0,0,0|1,0,2]=4 136 B12R1.124 CC1=C(C=CC=C1)C(N)C(C)C Z513797128 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.124 CC1=C(N=CC=C1)C(N)C(C)C Z852750962 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [0,1,0,0,0,0|2,0,1]=4 139 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [0,1,0,0,0,0|2,0,1]=4 140 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [0,1,0,0,0,0|1,0,1]=3 142 B12R1.225 CC(Br)C(=O)C1=CC(=CC=C1)Cl Z56946912 [0,1,0,0,0,0|1,0,2]=4 143 B12R1.225 CC(C)C(=O)C1=CC(=CC=C1)N Z3026469959 [0,1,0,0,0,0|1,0,2]=4 144 B12R1.225 CC(C)N(C)C1=CC(=CC=C1)N Z376447164 [0,1,0,0,0,0|3,0,0]=4 145 B12R1.225 CC(C1=CC(=CC=C1)O)N(C)C Z1176485649 [0,1,0,0,0,0|3,0,0]=4 146 B12R1.225 CC(N)C(=O)C1=CC(=CC=C1)O Z3015076235 [0,1,0,0,0,0|0,0,2]=3 147 B12R1.225 CC(N)C(O)C1=CC(=CC=C1)F Z1695740794 [0,1,0,0,0,0|0,0,0]=1 148 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [0,1,0,0,0,0|2,0,1]=4 149 B12R1.225 C[C@@H](C1=CC(=CC=C1)O)N(C)C Z1198169241 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.225 C[C@H](N)[C@H](O)C1=CC(=CC=C1)O Z2050038784 [0,1,0,0,0,0|0,0,0]=1 151 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [0,1,0,0,0,0|2,0,1]=4 154 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [0,1,0,0,0,0|2,0,1]=4 156 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [0,1,0,0,0,0|2,0,1]=4 157 B12R1.253 CC(=O)C(C)(C)C1=CC=CC=C1 Z406676998 [0,1,0,0,0,0|2,0,1]=4 158 B12R1.253 CC(N)(C(=O)N)C1=CC=CC=C1 Z1211228973 [0,1,0,0,0,0|2,0,1]=4 159 B12R1.253 CC(N)C(C)(C)C1=CC=CC=C1 Z406677008 [0,1,0,0,0,0|1,0,0]=2 160 B12R1.253 CC(N)C(C)(O)C1=CC=CC=C1 Z2466617796 [0,1,0,0,0,0|0,0,0]=1 161 B12R1.253 CC(O)(C(=N)N)C1=CC=CC=C1 Z1723549308 [0,1,0,0,0,0|1,0,1]=3 162 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=C1 Z336127660 [0,1,0,0,0,0|2,0,1]=4 163 B12R1.253 C[C@@](O)(C(=O)O)C1=CC=CC=C1 Z1154245575 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.253 C[C@](O)(C(=O)O)C1=CC=CC=C1 Z1119104455 [0,1,0,0,0,0|2,0,1]=4 165 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 Z56757372 [0,1,0,0,0,0|2,0,1]=4 166 B12R1.478 CC(C)C(C#N)C1=CC=CC=C1 Z1097112643 [0,1,0,0,0,0|2,0,0]=3 167 B12R1.478 CC(C)C(C=O)C1=CC=CC=C1 Z1255439670 [0,1,0,0,0,0|1,0,1]=3 168 B12R1.478 CC(C)C(CN)C1=CC=CC=C1 Z366424654 [0,1,0,0,0,0|2,0,0]=3 169 B12R1.478 CC(C)C(CN)C1=CN=CC=C1 Z1322784254 [0,1,0,0,0,0|3,0,0]=4 170 B12R1.478 CNC(C1=CC=CC=C1)C(C)C Z164151714 [0,1,0,0,0,0|2,0,0]=3 171 B12R1.478 CNC(C1=CN=CC=C1)C(C)C Z513800220 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.478 COC(C(=O)C)C1=CC=CC=C1 Z1513595127 [0,1,0,0,0,0|1,0,1]=3 173 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 Z316258914 [0,1,0,0,0,0|2,0,1]=4 174 B12R1.478 NCC(C1=CC=CC=C1)C(F)F Z1269176627 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 Z1080722424 [0,1,0,0,0,0|2,0,1]=4 176 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 Z1262510670 [0,1,0,0,0,0|2,0,1]=4 177 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 Z255149938 [0,1,0,0,0,0|2,0,0]=3 178 B12R1.564 CC(C)(N)C(O)C1=CC=CC=C1 Z1198157843 [0,1,0,0,0,0|0,0,0]=1 179 B12R1.564 CC(C1=CC=CC=C1)C(C)(C)N Z2681235948 [0,1,0,0,0,0|1,0,0]=2 180 B12R1.564 CC(C1=CC=CC=C1)C(C)(C)O Z2235789563 [0,1,0,0,0,0|2,0,0]=3 181 B12R1.564 CC(C1=CC=CC=C1)S(=O)(=O)N Z954606652 [0,1,0,0,0,0|3,0,0]=4 182 B12R1.564 CC(F)(F)C(N)C1=CC=CC=C1 Z3889917141 [0,1,0,0,0,0|2,0,0]=3 183 B12R1.564 NC(C1=CC=CC=C1)C(F)(F)F Z1262398374 [0,1,0,0,0,0|3,0,0]=4 184 B12R1.564 OC(C1=CC=CC=C1)C(Cl)(Cl)Cl Z838925896 [0,1,0,0,0,0|2,0,0]=3 185 B12R1.564 OC(C1=CC=NC=C1)C(F)(F)F Z1255463694 [0,1,0,0,0,0|3,0,0]=4 186 B12R1.564 OC(C1=CN=CC=C1)C(F)(F)F Z838950560 [0,1,0,0,0,0|3,0,0]=4 187 B12R1.564 OC(C1=NC=CC=C1)C(F)(F)F Z1255459980 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.564 O[C@@H](C1=CC=CC=C1)C(F)(F)F Z1198169138 [0,1,0,0,0,0|2,0,0]=3 189 B12R1.564 O[C@H](C1=CC=CC=C1)C(F)(F)F Z1255399129 [0,1,0,0,0,0|2,0,0]=3 190 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)Br Z361892264 [0,0,0,1,0,0|1,0,2]=4 191 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)C Z56867202 [0,0,0,1,0,0|1,0,2]=4 192 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,0,0,1,0,0|2,0,1]=4 193 B12R2.18 CC1C2=C(C=CC=C2)CC1N Z1203580431 [0,0,0,1,0,0|1,0,0]=2 194 B12R2.18 CC1C2=C(C=CC=C2)CC1O Z1349231024 [0,0,0,1,0,0|2,0,0]=3 195 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,0,0,1,0,0|1,0,2]=4 196 B12R2.18 CC1CC2=C(C1N)C=CC=C2 Z1182328130 [0,0,0,1,0,0|2,0,0]=3 197 B12R2.18 CC1OC2=C(C1N)C=CC=C2 Z2160887371 [0,0,0,1,0,0|2,0,0]=3 198 B12R2.18 CN1NC2=C(C1=O)C=CC=C2 Z1255429786 [0,0,0,1,0,0|1,0,2]=4 199 B12R2.18 C[C@@H]1CC2=C([C@H]1N)C=CC=C2 Z4993149521 [0,0,0,1,0,0|2,0,0]=3 200 B12R2.18 C[C@H]1C2=C(C=CC=C2)C[C@H]1N Z2514551594 [0,0,0,1,0,0|1,0,0]=2 201 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,0,0,1,0,0|0,0,2]=3 202 B12R2.18 NC1CC2=C(C1O)C=CC=C2 Z1431905060 [0,0,0,1,0,0|0,0,0]=1 203 B12R2.18 NN1CC2=C(C1=O)C=CC=C2 Z1953500024 [0,0,0,1,0,0|1,0,2]=4 204 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O Z784894996 [0,0,0,1,0,0|2,0,0]=3 205 B12R2.18 N[C@@H]1CC2=C([C@H]1O)C=CC=C2 Z2307327484 [0,0,0,1,0,0|0,0,0]=1 206 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O Z4663003875 [0,0,0,1,0,0|2,0,0]=3 207 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1N Z4749736623 [0,0,0,1,0,0|1,0,0]=2 208 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O Z803127638 [0,0,0,1,0,0|2,0,0]=3 209 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,0,0,1,0,0|1,0,2]=4 210 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,0,0,1,0,0|1,0,1]=3 211 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,0,0,1,0,0|2,0,1]=4 212 B12R2.18 OC1C2=C(C=CC=C2)CC1Br Z104485720 [0,0,0,1,0,0|1,0,0]=2 213 B12R2.18 OC1C2=C(C=CC=C2)CC1F Z1509011291 [0,0,0,1,0,0|1,0,0]=2 214 B12R2.23 CC1CNC1C2=CC=CC=C2 Z1268458216 [0,0,0,1,0,0|2,0,0]=3 215 B12R2.23 NC1CCC1C2=CC=CC=C2 Z1203589614 [0,0,0,1,0,0|1,0,0]=2 216 B12R2.23 N[C@@H]1CC[C@@H]1C2=CC=CC=C2 Z2489138864 [0,0,0,1,0,0|1,0,0]=2 217 B12R2.92 CC1(OC1C2=CC=CC=C2)C Z1486033030 [0,0,0,1,0,0|1,0,0]=2 218 B12R2.235 CC1(CC1N)C2=CC=CC=C2 Z1259335890 [0,0,0,1,0,0|1,0,0]=2 219 B12R2.2075 CC(C1=CC=CC=C1)C2CO2 Z1020679814 [0,0,0,1,0,0|2,0,0]=3 220 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 Z203239488 [0,0,0,1,0,0|2,0,0]=3 221 B12R2.2075 OC(C1=NC=CC=N1)C2CC2 Z1233200988 [0,0,0,1,0,0|3,0,0]=4 222 B12R2.3190 N=C(N)C1CC2=C1C=CC=C2 Z1613477992 [0,0,0,1,0,0|2,0,1]=4 223 B10R1.23 CC(C)C(O)C1=NC=CN1 Z4957133876 [0,0,0,0,1,0|3,0,0]=4 224 B10R1.23 CC(N)C(C)N1C=CC=N1 Z803066292 [0,0,0,0,1,0|3,0,0]=4 225 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,0,0,0,0,1|2,0,1]=4 226 B12R1.43 CC(C)C(=O)NC1=CC=CC=C1 Z27782614 [0,0,0,0,0,1|1,0,2]=4 227 B12R1.43 CC(C)C(C)NC1=CC=CC=C1 Z334878086 [0,0,0,0,0,1|2,0,0]=3 228 B12R1.43 CC(Cl)C(=O)CC1=CC=CC=C1 Z558478664 [0,0,0,0,0,1|1,0,2]=4 229 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 Z56921786 [0,0,0,0,0,1|1,0,2]=4 230 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 Z1262640515 [0,0,0,0,0,1|0,0,2]=3 231 B12R1.43 CC(N)C(=O)NC1=CC=CC=C1 Z1266933914 [0,0,0,0,0,1|0,0,2]=3 232 B12R1.43 CC(N)C(C)OC1=CC=CC=C1 Z803066446 [0,0,0,0,0,1|1,0,0]=2 233 B12R1.43 CC(N)C(O)CC1=CC=CC=C1 Z1483956878 [0,0,0,0,0,1|0,0,0]=1 234 B12R1.43 CC(O)C(=O)NC1=CC=CC=C1 Z212044362 [0,0,0,0,0,1|1,0,2]=4 235 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,0,0,0,0,1|2,0,1]=4 236 B12R1.43 CN(N)C(=O)NC1=CC=CC=C1 Z56855649 [0,0,0,0,0,1|1,0,2]=4 237 B12R1.43 CN(N)C(=S)NC1=CC=CC=C1 Z56844976 [0,0,0,0,0,1|1,1,1]=4 238 B12R1.43 C[C@@H](N)C(=O)NC1=CN=CC=C1 Z829934968 [0,0,0,0,0,1|1,0,2]=4 239 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,0,0,0,0,1|2,0,1]=4 240 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,0,0,0,0,1|2,0,1]=4 241 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,0,0,0,0,1|2,0,1]=4 242 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,0,0,0,0,1|2,0,1]=4 243 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,0,0,0,0,1|2,0,1]=4 244 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,0,0,0,0,1|2,0,1]=4 245 B12R1.107 C=C(C)CC(N)C1=CC=CC=C1 Z4497189696 [0,0,0,0,0,1|2,0,1]=4 246 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 Z104484314 [0,0,0,0,0,1|1,0,2]=4 247 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 Z85929891 [0,0,0,0,0,1|2,0,0]=3 248 B12R1.107 CC(C)CC(N)C1=NC=CC=C1 Z513795936 [0,0,0,0,0,1|3,0,0]=4 249 B12R1.107 CC(C)CC(O)C1=NC=CC=C1 Z513749474 [0,0,0,0,0,1|2,0,0]=3 250 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,0,0,0,0,1|2,0,1]=4 251 B12R1.107 CC(N)CC(=O)C1=CC=CC=C1 Z1413780437 [0,0,0,0,0,1|0,0,2]=3 252 B12R1.107 CC(N)CC(O)C1=CC=CC=C1 Z1262623600 [0,0,0,0,0,1|0,0,0]=1 253 B12R1.107 CC(N)CN(C)C1=CC=CC=C1 Z815264124 [0,0,0,0,0,1|2,0,0]=3 254 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 Z1089996260 [0,0,0,0,0,1|2,0,1]=4 255 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,0,0,0,0,1|2,0,1]=4 256 B12R1.107 CC(NC(=S)N)C1=CC=CC=C1 Z56913099 [0,0,0,0,0,1|2,0,1]=4 257 B12R1.107 CS(=O)CC(N)C1=CC=CC=C1 Z1238793494 [0,0,0,0,0,1|3,0,0]=4 258 B12R1.107 NC(CC(F)F)C1=CC=CC=C1 Z2327568967 [0,0,0,0,0,1|3,0,0]=4 259 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [0,0,0,0,0,1|2,0,1]=4 260 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [2,0,0,0,0,0|0,0,2]=4 261 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [2,0,0,0,0,0|1,0,0]=3 263 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [2,0,0,0,0,0|0,0,0]=2 266 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [2,0,0,0,0,0|1,0,0]=3 267 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [2,0,0,0,0,0|1,0,0]=3 268 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [2,0,0,0,0,0|1,0,0]=3 269 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [2,0,0,0,0,0|1,0,0]=3 272 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [2,0,0,0,0,0|0,0,0]=2 274 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [2,0,0,0,0,0|1,0,0]=3 275 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [2,0,0,0,0,0|0,0,0]=2 277 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [2,0,0,0,0,0|1,0,1]=4 278 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [2,0,0,0,0,0|0,1,1]=4 279 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [2,0,0,0,0,0|1,0,1]=4 280 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [2,0,0,0,0,0|0,0,0]=2 282 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [2,0,0,0,0,0|1,0,0]=3 283 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [2,0,0,0,0,0|1,0,0]=3 285 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [2,0,0,0,0,0|1,0,0]=3 293 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [2,0,0,0,0,0|1,0,0]=3 295 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [2,0,0,0,0,0|1,0,0]=3 298 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|1,0,1]=4 301 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|1,0,0]=3 302 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [2,0,0,0,0,0|2,0,0]=4 304 B11R1.7 CC(C)(CN)C1=CC=CC=C1 Z291234238 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [1,1,0,0,0,0|2,0,0]=4 306 B11R1.7 CC(C)(CO)C1=CC=CC=C1 Z397587218 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.7 CC(F)(CN)C1=CC=CC=C1 Z2768234774 [1,1,0,0,0,0|1,0,0]=3 308 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Z734150992 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.7 CC(O)(CN)C1=CC=CC=C1 Z979721628 [1,1,0,0,0,0|0,0,0]=2 310 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [1,1,0,0,0,0|1,0,0]=3 311 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [1,1,0,0,0,0|0,0,0]=2 312 B11R1.7 CNC(C)(C)C1=CC=CC=C1 Z991114970 [1,1,0,0,0,0|2,0,0]=4 313 B11R1.7 NCC(F)(F)C1=CC=CC=C1 Z2168499583 [1,1,0,0,0,0|1,0,0]=3 314 B11R1.7 NCC(F)(F)C1=NC=CC=C1 Z1198184449 [1,1,0,0,0,0|2,0,0]=4 315 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [1,1,0,0,0,0|0,0,1]=3 316 B11R1.12 CCC(CC)C1=CC=NC=C1 Z104493650 [1,1,0,0,0,0|2,0,0]=4 317 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [1,1,0,0,0,0|1,0,0]=3 318 B11R1.12 CCC(CO)C1=CC=CC=C1 Z397587442 [1,1,0,0,0,0|0,0,0]=2 319 B11R1.12 CCC(NC)C1=CC=NC=C1 Z513800486 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.12 CCN(C#N)C1=CC=CC=C1 Z1374910132 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.12 CCN(CC)C1=CC=CC=C1 Z57770738 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.12 CNC(CO)C1=CC=CC=C1 Z734147276 [1,1,0,0,0,0|1,0,0]=3 323 B11R1.12 COC(CN)C1=CC=CC=C1 Z285139084 [1,1,0,0,0,0|0,0,0]=2 324 B11R1.12 NCC(CO)C1=CC=CC=C1 Z1198168251 [1,1,0,0,0,0|0,0,0]=2 325 B11R1.12 OCC(CO)C1=CC=CC=C1 Z1255395467 [1,1,0,0,0,0|1,0,0]=3 326 B11R1.16 C#CCC(O)C1=CC=CC=C1 Z932373338 [1,1,0,0,0,0|0,0,1]=3 327 B11R1.16 CC(CC#N)C1=CC=CC=C1 Z1251357056 [1,1,0,0,0,0|1,0,1]=4 328 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [1,1,0,0,0,0|1,0,1]=4 329 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [1,1,0,0,0,0|0,0,2]=4 330 B11R1.16 CCCC(N)C1=NC=CC=C1 Z513795928 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [1,1,0,0,0,0|0,0,0]=2 332 B11R1.16 CCNC(C)C1=CC=NC=C1 Z1695709422 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.16 CCNC(C)C1=CN=CC=C1 Z163548568 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.16 CCOC(=O)C1=CC=CC=C1 Z53835169 [1,1,0,0,0,0|0,0,2]=4 335 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.16 CN(CCO)C1=CC=CC=C1 Z138702688 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [1,1,0,0,0,0|1,0,0]=3 338 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [1,1,0,0,0,0|1,0,0]=3 339 B11R1.16 CSCC(=O)C1=CC=CC=C1 Z732208586 [1,1,0,0,0,0|0,0,2]=4 340 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.16 N#CCC(N)C1=CC=CC=C1 Z1415893991 [1,1,0,0,0,0|1,0,1]=4 342 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [1,1,0,0,0,0|1,0,0]=3 343 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [1,1,0,0,0,0|0,0,0]=2 344 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [1,1,0,0,0,0|1,0,1]=4 345 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [1,1,0,0,0,0|0,0,2]=4 346 B11R1.16 O=S(CCCl)C1=CC=CC=C1 Z421771494 [1,1,0,0,0,0|1,0,1]=4 347 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [1,1,0,0,0,0|0,0,0]=2 348 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [1,1,0,0,0,0|0,0,0]=2 349 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [1,1,0,0,0,0|1,0,0]=3 350 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [1,1,0,0,0,0|1,0,0]=3 351 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [1,1,0,0,0,0|0,0,2]=4 353 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [1,1,0,0,0,0|1,0,0]=3 354 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [1,1,0,0,0,0|0,0,0]=2 357 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [1,1,0,0,0,0|0,0,0]=2 358 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [1,1,0,0,0,0|0,0,2]=4 359 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [1,1,0,0,0,0|0,0,2]=4 360 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [1,1,0,0,0,0|0,0,2]=4 361 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [1,1,0,0,0,0|0,0,2]=4 362 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [1,1,0,0,0,0|0,0,2]=4 363 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [1,1,0,0,0,0|0,0,2]=4 364 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [1,1,0,0,0,0|1,0,0]=3 365 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [1,1,0,0,0,0|1,0,0]=3 366 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [1,1,0,0,0,0|1,0,0]=3 367 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [1,1,0,0,0,0|1,0,0]=3 368 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [1,1,0,0,0,0|0,0,0]=2 369 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [1,1,0,0,0,0|0,0,0]=2 370 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [1,1,0,0,0,0|0,0,0]=2 371 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [1,1,0,0,0,0|0,0,0]=2 372 B11R1.22 CCC(O)C1=NC=C(C=C1)F Z1341678257 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.22 CCS(=O)C1=CC=C(C=C1)F Z1154828228 [1,1,0,0,0,0|1,0,1]=4 374 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [1,1,0,0,0,0|1,0,0]=3 376 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl Z159528172 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.22 CNC(C)C1=CC=C(C=C1)F Z166605480 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [1,1,0,0,0,0|0,0,2]=4 384 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [1,1,0,0,0,0|0,0,2]=4 385 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [1,1,0,0,0,0|0,0,2]=4 386 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [1,1,0,0,0,0|0,0,2]=4 387 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [1,1,0,0,0,0|0,0,0]=2 388 B11R1.23 CC(CN)C1=CC(=CC=C1)Br Z5094147873 [1,1,0,0,0,0|1,0,0]=3 389 B11R1.23 CC(CN)C1=CC(=CC=C1)F Z415654914 [1,1,0,0,0,0|1,0,0]=3 390 B11R1.23 CC(CN)C1=CC=CC(=O)N1 Z4656721256 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.23 CC(CO)C1=CC(=CC=C1)Br Z1269177166 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.23 CC(CO)C1=CC(=CC=C1)Cl Z1222424631 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [1,1,0,0,0,0|0,0,2]=4 394 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [1,1,0,0,0,0|0,0,0]=2 395 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [1,1,0,0,0,0|0,0,2]=4 396 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [1,1,0,0,0,0|0,0,2]=4 397 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [1,1,0,0,0,0|0,0,2]=4 398 B11R1.23 CCC(N)C1=CC(=CC=C1)Cl Z239627026 [1,1,0,0,0,0|1,0,0]=3 399 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [1,1,0,0,0,0|1,0,0]=3 400 B11R1.23 CCC(N)C1=NC(=CC=C1)C Z4457910024 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.23 CCC(O)C1=CC(=CC=C1)Br Z228586280 [1,1,0,0,0,0|0,0,0]=2 402 B11R1.23 CCC(O)C1=CC(=CC=C1)Cl Z335245132 [1,1,0,0,0,0|0,0,0]=2 403 B11R1.23 CCC(O)C1=CC(=CC=C1)N Z1262626036 [1,1,0,0,0,0|0,0,0]=2 404 B11R1.23 CNC(C)C1=CC(=CC=C1)Cl Z159528162 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.23 COC(C)C1=CC(=CC=C1)N Z801781454 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.23 CSC(C)C1=CC(=CC=C1)N Z801781922 [1,1,0,0,0,0|2,0,0]=4 408 B11R1.23 NC(CF)C1=CC(=CC=C1)Br Z3210128314 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.23 NC(CF)C1=CC(=CC=C1)Cl Z3445798142 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.23 NC(CF)C1=CC(=CC=C1)F Z3681214901 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.23 NC(CO)C1=CC(=CC=C1)Br Z1438483917 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.23 NC(CO)C1=CC(=CC=C1)Cl Z1695784092 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.23 NC(CO)C1=CC(=CC=C1)F Z1268152384 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.23 NC(CO)C1=CC(=CC=C1)I Z3605387233 [1,1,0,0,0,0|2,0,0]=4 415 B11R1.23 NC(CO)C1=CC(=CC=C1)O Z3247611804 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.23 NC1=CC(=CC=C1)C(O)CO Z970072128 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [1,1,0,0,0,0|0,0,2]=4 418 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [1,1,0,0,0,0|0,0,2]=4 419 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [1,1,0,0,0,0|0,0,2]=4 420 B11R1.23 NCC(O)C1=CC(=CC=C1)Cl Z330910384 [1,1,0,0,0,0|0,0,0]=2 421 B11R1.23 NCC(O)C1=CC(=CC=C1)O Z3041501762 [1,1,0,0,0,0|0,0,0]=2 422 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [1,1,0,0,0,0|0,0,2]=4 423 B11R1.222 CC1=C(C=CC=C1)C(N)CF Z3092528504 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.222 CC1=C(C=CC=C1)C(N)CO Z385458414 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.222 CC1=C(C=CC=C1)C(O)CN Z336086534 [1,1,0,0,0,0|0,0,0]=2 426 B11R1.222 CCC(=O)C1=C(C=CC=C1)Br Z851790216 [1,1,0,0,0,0|0,0,2]=4 427 B11R1.222 CCC(=O)C1=C(C=CC=C1)N Z1201617664 [1,1,0,0,0,0|0,0,2]=4 428 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.222 CCN(C)C1=C(C=CC=C1)N Z409023630 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.222 CCS(=O)C1=C(C=CC=C1)N Z808592520 [1,1,0,0,0,0|1,0,1]=4 432 B11R1.222 CNC(C)C1=C(C=CC=C1)Br Z1497158706 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.222 CNC(C)C1=C(C=CC=C1)Cl Z138106016 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [1,1,0,0,0,0|2,0,0]=4 436 B11R1.222 NC(CF)C1=C(C=CC=C1)Br Z4444282330 [1,1,0,0,0,0|2,0,0]=4 437 B11R1.222 NC(CO)C1=C(C=CC=C1)F Z1268152413 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.222 NC(CO)C1=C(C=CC=C1)I Z2941400807 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [1,1,0,0,0,0|0,0,2]=4 440 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [1,1,0,0,0,0|0,0,2]=4 441 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [1,1,0,0,0,0|0,0,2]=4 442 B11R1.222 NCC(O)C1=C(C=CC=C1)Cl Z1255523275 [1,1,0,0,0,0|0,0,0]=2 443 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [1,1,0,0,0,0|1,0,0]=3 445 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [1,1,0,0,0,0|0,0,0]=2 451 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [1,1,0,0,0,0|1,0,1]=4 452 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [1,1,0,0,0,0|1,0,1]=4 456 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [1,1,0,0,0,0|1,0,1]=4 457 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [1,1,0,0,0,0|1,0,1]=4 458 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [1,1,0,0,0,0|1,0,1]=4 459 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [1,1,0,0,0,0|1,0,1]=4 461 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [1,1,0,0,0,0|1,0,1]=4 462 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [1,1,0,0,0,0|0,0,1]=3 463 B11R1.40 CC(C#N)OC1=CC=CC=C1 Z54191740 [1,1,0,0,0,0|1,0,1]=4 464 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [1,1,0,0,0,0|1,0,0]=3 465 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [1,1,0,0,0,0|0,0,0]=2 466 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [1,1,0,0,0,0|1,0,0]=3 467 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [1,1,0,0,0,0|1,0,0]=3 469 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [1,1,0,0,0,0|0,0,0]=2 470 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [1,1,0,0,0,0|1,0,0]=3 473 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.40 CN(C#N)CC1=CC=CC=C1 Z1255506511 [1,1,0,0,0,0|1,0,1]=4 475 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [1,1,0,0,0,0|1,0,1]=4 476 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [1,1,0,0,0,0|1,0,1]=4 477 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [1,1,0,0,0,0|0,0,0]=2 478 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [1,1,0,0,0,0|1,0,0]=3 479 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,1,0,0,0,0|1,0,1]=4 480 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [1,1,0,0,0,0|1,0,0]=3 481 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [1,1,0,0,0,0|0,0,0]=2 482 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,1,0,0,0,0|1,0,1]=4 484 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [1,1,0,0,0,0|0,0,0]=2 485 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [1,1,0,0,0,0|0,0,0]=2 486 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [1,1,0,0,0,0|1,0,1]=4 487 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,1,0,0,0,0|1,0,1]=4 488 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,1,0,0,0,0|1,0,1]=4 489 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,1,0,0,0,0|1,0,1]=4 490 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,1,0,0,0,0|1,0,1]=4 491 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [1,1,0,0,0,0|1,0,0]=3 492 B11R1.86 CC(C)NC1=C(C=CC=C1)Br Z334939134 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.86 CC(C)NC1=C(C=CC=C1)I Z362774390 [1,1,0,0,0,0|2,0,0]=4 494 B11R1.86 CC(C)OC1=C(C=CC=C1)Br Z54690481 [1,1,0,0,0,0|2,0,0]=4 495 B11R1.86 CC(C)OC1=C(C=CC=C1)Cl Z53833775 [1,1,0,0,0,0|2,0,0]=4 496 B11R1.86 CC(C)OC1=C(C=CC=C1)N Z239604736 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.86 CC(C)SC1=C(C=CC=C1)N Z316174692 [1,1,0,0,0,0|2,0,0]=4 498 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [1,1,0,0,0,0|0,0,0]=2 499 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [1,1,0,0,0,0|0,0,0]=2 500 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [1,1,0,0,0,0|1,0,1]=4 501 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,1,0,0,0,0|1,0,1]=4 502 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [1,1,0,0,0,0|0,0,0]=2 503 B11R1.86 CC1=C(C=CC=C1)NC(C)C Z267168760 [1,1,0,0,0,0|2,0,0]=4 504 B11R1.86 CC1=C(C=CN=C1)CC(C)N Z4926043046 [1,1,0,0,0,0|1,0,0]=3 505 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [1,1,0,0,0,0|2,0,0]=4 507 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [1,1,0,0,0,0|1,0,1]=4 510 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,1,0,0,0,0|1,0,1]=4 511 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,1,0,0,0,0|1,0,1]=4 512 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,1,0,0,0,0|1,0,1]=4 513 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,1,0,0,0,0|1,0,1]=4 514 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,1,0,0,0,0|1,0,1]=4 515 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,1,0,0,0,0|1,0,1]=4 516 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,1,0,0,0,0|1,0,1]=4 517 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [1,1,0,0,0,0|1,0,0]=3 518 B11R1.157 CC(C)CC1=CC(=NC=C1)N Z1197889925 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [1,1,0,0,0,0|2,0,0]=4 522 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [1,1,0,0,0,0|2,0,0]=4 524 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [1,1,0,0,0,0|0,0,0]=2 526 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [1,1,0,0,0,0|0,0,0]=2 527 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,1,0,0,0,0|0,0,0]=2 528 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,1,0,0,0,0|1,0,0]=3 529 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [1,1,0,0,0,0|2,0,0]=4 530 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,1,0,0,0,0|2,0,0]=4 531 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,1,0,0,0,0|1,0,1]=4 532 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,1,0,0,0,0|1,0,1]=4 533 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|1,0,1]=4 534 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|1,0,1]=4 535 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|1,0,1]=4 536 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [1,1,0,0,0,0|2,0,0]=4 537 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [1,1,0,0,0,0|2,0,0]=4 538 B13R1.133 CC(C)C(N)CC1=CC=C(C=C1)Cl Z513796444 [0,1,0,0,0,1|2,0,0]=4 539 B13R1.133 CC(C)C(N)CC1=CC=C(C=C1)F Z513796714 [0,1,0,0,0,1|2,0,0]=4 540 B13R1.133 CC(C)C(O)CC1=CC=C(C=C1)F Z513750262 [0,1,0,0,0,1|1,0,0]=3 541 B13R1.133 CC(N)C(=O)NC1=CC=C(C=C1)Cl Z1449749895 [0,1,0,0,0,1|0,0,2]=4 542 B13R1.133 CC1=CC=C(C=C1)NC(=O)C(C)N Z1449748761 [0,1,0,0,0,1|0,0,2]=4 543 B13R1.148 CC1=CC=CC(=C1)NC(=O)C(C)N Z1449747159 [0,1,0,0,0,1|0,0,2]=4 544 B13R1.152 CC(C)C(N)C(=O)C1=CC=CC=C1 Z3303000834 [0,1,0,0,0,1|2,0,0]=4 545 B13R1.152 CC(C)C(O)C(N)C1=CC=CC=C1 Z385458472 [0,1,0,0,0,1|1,0,0]=3 546 B13R1.152 CC(N)C(N)C(O)C1=CC=CC=C1 Z2724405896 [0,1,0,0,0,1|1,0,0]=3 547 B13R1.202 CC(C)C(O)CC1=C(C=CC=C1)Br Z513750644 [0,1,0,0,0,1|1,0,0]=3 548 B13R1.202 CC(N)C(C)OC1=C(C=CC=C1)F Z803066430 [0,1,0,0,0,1|1,0,0]=3 549 B13R1.353 CC(C)(C)C(N)CC1=CC=CC=C1 Z1268152326 [0,1,0,0,0,1|2,0,0]=4 550 B13R1.353 CC(C)(C)C(O)CC1=CC=CC=C1 Z513751754 [0,1,0,0,0,1|1,0,0]=3 551 B13R1.353 CC(C)(N)C(=O)NC1=CC=CC=C1 Z801827142 [0,1,0,0,0,1|0,0,2]=4 552 B13R1.418 CC(C)C(C#N)NC1=CC=CC=C1 Z235344711 [0,1,0,0,0,1|2,0,0]=4 553 B13R1.418 CC(C)C(CN)CC1=CC=CC=C1 Z1809367550 [0,1,0,0,0,1|2,0,0]=4 554 B13R1.418 CC(C)C(CN)NC1=CC=CC=C1 Z238918440 [0,1,0,0,0,1|2,0,0]=4 555 B13R1.418 COC(CC1=CC=CC=C1)C(=O)N Z2233706113 [0,1,0,0,0,1|1,0,1]=4 556 B13R1.1073 CC(C)C(C)(N)CC1=CC=CC=C1 Z2690366626 [0,1,0,0,0,1|2,0,0]=4 557 B13R1.132 CC(C)CC(N)C1=CC=C(C=C1)Cl Z291232734 [0,1,0,0,0,1|2,0,0]=4 558 B13R1.132 CC(N)CC(=O)C1=CC=C(C=C1)F Z1431002692 [0,1,0,0,0,1|0,0,2]=4 559 B13R1.132 CC(N)CC(O)C1=CC=C(C=C1)F Z1424669539 [0,1,0,0,0,1|0,0,0]=2 560 B13R1.201 CC1=C(C=CC=C1)C(N)CC(C)C Z3069282331 [0,1,0,0,0,1|2,0,0]=4 561 B13R1.347 CC(N)CC(C)(C)C1=CC=CC=C1 Z446020882 [0,1,0,0,0,1|1,0,0]=3 562 B13R1.347 CC(O)CC(C)(C)C1=CC=CC=C1 Z445987050 [0,1,0,0,0,1|2,0,0]=4 563 B13R1.352 CC(C)(C)CC(N)C1=CC=CC=C1 Z291232396 [0,1,0,0,0,1|2,0,0]=4 564 B13R1.352 CS(=O)(=O)CC(O)C1=CC=CC=C1 Z822382694 [0,1,0,0,0,1|2,0,0]=4 565 B13R1.713 CC(=O)NC(CO)C1=CC=CC=C1 Z1097082934 [0,1,0,0,0,1|1,0,1]=4 566 B13R1.713 CC(C)CC(C=O)C1=CC=CC=C1 Z1268606424 [0,1,0,0,0,1|1,0,1]=4 567 B13R1.713 CC(C)OC(C=O)C1=CC=CC=C1 Z1511825565 [0,1,0,0,0,1|1,0,1]=4 568 B13R1.713 CC(C)OC(CO)C1=CC=CC=C1 Z1896186657 [0,1,0,0,0,1|1,0,0]=3 569 B13R1.713 CC(O)CC(CN)C1=CC=CC=C1 Z1410955907 [0,1,0,0,0,1|2,0,0]=4 570 B13R1.21 CCC(C)C(N)C1=CC=C(C=C1)Cl Z291232760 [0,2,0,0,0,0|2,0,0]=4 571 B13R1.21 CNC(C)C(C)C1=CC=C(C=C1)Cl Z1262590480 [0,2,0,0,0,0|1,0,0]=3 572 B13R1.21 COC(=O)C(O)C1=CC=C(C=C1)F Z847296298 [0,2,0,0,0,0|1,0,1]=4 573 B13R1.21 NC(CO)C(O)C1=CC=C(C=C1)Cl Z2670838766 [0,2,0,0,0,0|0,0,0]=2 574 B13R1.36 CCC1=CC=C(C=C1)C(N)C(C)C Z90121786 [0,2,0,0,0,0|2,0,0]=4 575 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)C Z99599002 [0,2,0,0,0,0|2,0,0]=4 576 B13R1.36 COC1=CC=C(C=C1)C(N)C(C)O Z3037763603 [0,2,0,0,0,0|2,0,0]=4 577 B13R1.36 COC1=CC=C(C=C1)C(O)C(C)N Z1526453885 [0,2,0,0,0,0|0,0,0]=2 578 B13R1.163 CC(C)C(N)C1=C(C=C(C=C1)Cl)F Z1082849232 [0,2,0,0,0,0|2,0,0]=4 579 B13R1.163 CC(C)C(N)C1=C(C=C(C=C1)F)F Z335236612 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.163 CC(N)C(=O)C1=C(C=C(C=C1)F)F Z3333649153 [0,2,0,0,0,0|0,0,2]=4 581 B13R1.163 CC(N)C(O)C1=C(C=C(C=C1)Cl)Cl Z1695797889 [0,2,0,0,0,0|0,0,0]=2 582 B13R1.510 CC(C)C(N)C1=CC(=C(C=C1)F)F Z335235556 [0,2,0,0,0,0|2,0,0]=4 583 B13R1.510 CC(N)C(O)C1=CC(=C(C=C1)F)F Z1342208384 [0,2,0,0,0,0|0,0,0]=2 584 B13R1.510 CC1=C(C=CC(=C1)C(O)C(C)N)F Z4133752082 [0,2,0,0,0,0|0,0,0]=2 585 B13R1.525 CC(C)(C)C(N)C1=CC=C(C=C1)F Z234894925 [0,2,0,0,0,0|2,0,0]=4 586 B13R1.525 CC1=CC=C(C=C1)C(O)C(F)(F)F Z188898086 [0,2,0,0,0,0|2,0,0]=4 587 B13R1.525 NC1=CC=C(C=C1)C(O)C(F)(F)F Z1262623728 [0,2,0,0,0,0|2,0,0]=4 588 B13R1.525 OC(C1=CC=C(C=C1)Br)C(F)(F)F Z756121412 [0,2,0,0,0,0|2,0,0]=4 589 B13R1.706 CC(C)C(C#N)C1=CC=C(C=C1)Cl Z1198148456 [0,2,0,0,0,0|2,0,0]=4 590 B13R1.706 CC(C)C(CN)C1=CC=C(C=C1)Cl Z1198338118 [0,2,0,0,0,0|2,0,0]=4 591 B13R1.706 CNC(C1=CC=C(C=C1)F)C(C)C Z164181938 [0,2,0,0,0,0|2,0,0]=4 592 B13R1.706 COC(C1=CC=C(C=C1)F)C(C)N Z1592042577 [0,2,0,0,0,0|0,0,0]=2 593 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)C Z965047474 [0,2,0,0,0,0|1,0,1]=4 594 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)Cl Z965047532 [0,2,0,0,0,0|1,0,1]=4 595 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)I Z2031668793 [0,2,0,0,0,0|1,0,1]=4 596 B13R1.47 CCCC(N)C(=O)C1=CC=CC=C1 Z1507357367 [0,2,0,0,0,0|0,0,2]=4 597 B13R1.263 NCC(F)(F)C(O)C1=CC=CC=C1 Z5524788105 [0,2,0,0,0,0|1,0,0]=3 598 B13R1.696 CCC(N)C(O)C1=C(C=CC=C1)F Z1297758289 [0,2,0,0,0,0|0,0,0]=2 599 B13R1.708 CC(CN)S(=O)(=O)C1=CC=CC=C1 Z4052355319 [0,2,0,0,0,0|1,0,1]=4 600 B13R1.708 CCC(N)C(C)(C)C1=CC=CC=C1 Z1082245218 [0,2,0,0,0,0|1,0,0]=3 601 B13R1.708 CCC(O)C(C)(C)C1=CC=CC=C1 Z1082244996 [0,2,0,0,0,0|2,0,0]=4 602 B13R1.708 COC(=O)C(C)(O)C1=CC=CC=C1 Z965047342 [0,2,0,0,0,0|1,0,1]=4 603 B13R1.708 NCC(O)C(F)(F)C1=CC=CC=C1 Z4443065812 [0,2,0,0,0,0|2,0,0]=4 604 B13R1.89 COC1=C(C=CC=C1)C(N)C(C)N Z3765855804 [0,2,0,0,0,0|1,0,0]=3 605 B13R1.276 CC1=C(C=CC=C1)C(N)C(C)(C)C Z513798274 [0,2,0,0,0,0|2,0,0]=4 606 B13R1.276 CC1=C(C=CC=C1)C(O)C(F)(F)F Z188898084 [0,2,0,0,0,0|2,0,0]=4 607 B13R1.720 CC1=C(C=CC=C1)C(C#N)C(C)C Z1255452397 [0,2,0,0,0,0|2,0,0]=4 608 B13R1.720 CNC(C1=C(C=CC=C1)C)C(C)C Z513803350 [0,2,0,0,0,0|2,0,0]=4 609 B13R1.720 CNC(C1=C(C=CC=C1)Cl)C(C)C Z1267881694 [0,2,0,0,0,0|2,0,0]=4 610 B13R1.720 COC(C1=C(C=CC=C1)F)C(C)N Z1623872298 [0,2,0,0,0,0|0,0,0]=2 611 B13R1.3789 CC(C)C(O)C1=C(C=CC=C1Cl)Cl Z1171205847 [0,2,0,0,0,0|1,0,0]=3 612 B13R1.3789 CC(N)C(O)C1=C(C=CC=C1Cl)Cl Z1695729041 [0,2,0,0,0,0|0,0,0]=2 613 B13R1.3789 CC(N)C(O)C1=C(C=CC=C1F)Cl Z1695729023 [0,2,0,0,0,0|0,0,0]=2 614 B13R1.3789 CC(N)C(O)C1=C(C=CC=C1F)F Z336086624 [0,2,0,0,0,0|0,0,0]=2 615 B13R1.3492 CC(C)(C)C(N)C1=CC(=CC=C1)F Z513798266 [0,2,0,0,0,0|2,0,0]=4 616 B13R1.3492 CC1=CC(=CC=C1)C(N)C(C)(C)C Z513798256 [0,2,0,0,0,0|2,0,0]=4 617 B13R1.3492 CC1=CC(=CC=C1)C(O)C(F)(F)F Z1603855707 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.3492 OC(C1=CC(=CC=C1)Br)C(F)(F)F Z838950512 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.3492 OC(C1=CC(=CC=C1)Cl)C(F)(F)F Z838950482 [0,2,0,0,0,0|2,0,0]=4 620 B13R1.155 CC(C)(O)C(C)(C)C1=CC=CC=C1 Z2235778653 [0,2,0,0,0,0|2,0,0]=4 621 B13R1.719 CC(F)(F)C(CN)C1=CC=CC=C1 Z3300334946 [0,2,0,0,0,0|2,0,0]=4 622 B13R1.1111 CC(C)C(C(=O)O)C1=CC=CC=C1 Z982130186 [0,2,0,0,0,0|1,0,0]=3 623 B13R1.1111 CC(C)C(C(=O)O)C1=CN=CC=C1 Z982129826 [0,2,0,0,0,0|2,0,0]=4 624 B13R1.1111 CN(C)C(C(=O)O)C1=CC=CC=C1 Z1118274869 [0,2,0,0,0,0|2,0,0]=4 625 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [1,0,0,1,0,0|1,0,0]=3 626 B11R2.1 CC1CNC2=C1C=CN=C2 Z3400245703 [1,0,0,1,0,0|2,0,0]=4 627 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [1,0,0,1,0,0|2,0,0]=4 628 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [1,0,0,1,0,0|2,0,0]=4 629 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [1,0,0,1,0,0|1,0,0]=3 630 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [1,0,0,1,0,0|2,0,0]=4 631 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [1,0,0,1,0,0|1,0,0]=3 632 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [1,0,0,1,0,0|0,0,2]=4 633 B11R2.1 OB1OCC2=C1C=CC=C2 Z1255356609 [1,0,0,1,0,0|2,0,0]=4 634 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [1,0,0,1,0,0|1,0,0]=3 635 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [1,0,0,1,0,0|1,0,0]=3 636 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [1,0,0,1,0,0|1,0,0]=3 637 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [1,0,0,1,0,0|1,0,0]=3 638 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [1,0,0,1,0,0|1,0,0]=3 639 B11R2.40 CC1(CO1)C2=CC=CC=C2 Z813010616 [1,0,0,1,0,0|2,0,0]=4 640 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [1,0,0,1,0,0|1,0,0]=3 641 B11R2.40 NC1(CC1)C2=CC=NC=C2 Z3244521572 [1,0,0,1,0,0|2,0,0]=4 642 B11R2.40 NC1(CC1)C2=CN=CC=C2 Z3241265434 [1,0,0,1,0,0|2,0,0]=4 643 B11R2.40 NC1(CC1)C2=NC=CC=C2 Z995042286 [1,0,0,1,0,0|2,0,0]=4 644 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [1,0,0,1,0,0|1,0,0]=3 645 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [1,0,0,1,0,0|1,0,0]=3 646 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [1,0,0,1,0,0|1,0,1]=4 647 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [1,0,0,1,0,0|0,0,0]=2 648 B11R2.10 CC1CC2=C(N1)C=CN=C2 Z1203822742 [1,0,0,1,0,0|1,0,0]=3 649 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [1,0,0,1,0,0|1,0,0]=3 650 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [1,0,0,1,0,0|1,0,1]=4 651 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [1,0,0,1,0,0|0,0,0]=2 652 B11R2.10 NC1CC2=C(C1)C=NC=C2 Z2238944796 [1,0,0,1,0,0|1,0,0]=3 653 B11R2.10 NC1CC2=C(C1)N=CC=C2 Z3069017080 [1,0,0,1,0,0|1,0,0]=3 654 B11R2.10 NC1CC2=C(C1)N=CC=N2 Z4953585301 [1,0,0,1,0,0|2,0,0]=4 655 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,1,0,0|1,0,1]=4 656 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,1,0,0|1,0,1]=4 657 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [1,0,0,1,0,0|1,0,0]=3 658 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [1,0,0,1,0,0|1,0,0]=3 659 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [1,0,0,1,0,0|1,0,0]=3 660 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [1,0,0,1,0,0|2,0,0]=4 661 B13R2.197 C[C@@H]1C[C@@]1(N)CC2=CC=CC=C2 Z3487486148 [0,0,0,1,0,1|2,0,0]=4 662 B13R2.359 CC1(C2=C(C=CC=C2)CC1N)C Z5181794095 [0,0,0,1,0,1|2,0,0]=4 663 B13R2.359 CC1NC2=C(C1(C)C)C=CC=C2 Z1262562152 [0,0,0,1,0,1|2,0,0]=4 664 B13R2.369 CC1NC2=C(C=CC=C2)NC1=O Z1201619874 [0,0,0,1,0,1|0,0,2]=4 665 B13R2.369 CC1NC2=C(C=CC=C2)SC1C Z1345173180 [0,0,0,1,0,1|1,0,0]=3 666 B13R2.369 NC1CC2=C(C=CC=C2)NC1=O Z2692093571 [0,0,0,1,0,1|0,0,2]=4 667 B13R2.369 O=C1NC2=C(C=CC=C2)OC1O Z984801448 [0,0,0,1,0,1|1,0,1]=4 668 B13R2.369 OC1OC2=C(C=CC=C2)OC1O Z56761861 [0,0,0,1,0,1|2,0,0]=4 669 B13R2.373 CC1C(CC1C2=CC=CC=C2)N Z1430540182 [0,0,0,1,0,1|1,0,0]=3 670 B13R2.373 NC1CN(C1=O)C2=CC=CC=C2 Z1891776032 [0,0,0,1,0,1|0,0,2]=4 671 B13R2.435 CC(N)C1=CC2=C(O1)C=CC=C2 Z90664473 [0,0,0,1,0,1|0,0,1]=3 672 B13R2.435 CC(N)C1=NC2=C(N1)C=CC=C2 Z56795976 [0,0,0,1,0,1|1,0,1]=4 673 B13R2.435 CC(N)C1=NC2=C(S1)C=CC=C2 Z105197348 [0,0,0,1,0,1|0,1,1]=4 674 B13R2.435 C[C@@H](O)C1=CC2=C(O1)C=CC=C2 Z959151760 [0,0,0,1,0,1|1,0,1]=4 675 B13R2.435 C[C@H](N)C1=CC2=C(O1)C=CC=C2 Z1795817788 [0,0,0,1,0,1|0,0,1]=3 676 B13R2.435 NC(=O)C1CC2=C(O1)C=CC=C2 Z116821856 [0,0,0,1,0,1|1,0,1]=4 677 B13R2.444 NC(CC1=CC=CC=C1)C2CC2 Z1695784318 [0,0,0,1,0,1|2,0,0]=4 678 B13R2.10 CC1CC(CN1)C2=CC=CC=C2 Z1203620755 [0,0,0,1,0,1|1,0,0]=3 679 B13R2.10 FC1CNC(C1)C2=CC=CC=C2 Z2732815726 [0,0,0,1,0,1|2,0,0]=4 680 B13R2.10 NC1CCC(C1)C2=CC=CC=C2 Z1947438117 [0,0,0,1,0,1|1,0,0]=3 681 B13R2.10 NC1CCN(C1)C2=CC=CC=C2 Z415647888 [0,0,0,1,0,1|2,0,0]=4 682 B13R2.10 NC1COC(C1)C2=CC=CC=C2 Z4657508784 [0,0,0,1,0,1|0,0,0]=2 683 B13R2.10 OC1CNC(C1)C2=CC=CC=C2 Z2298064173 [0,0,0,1,0,1|2,0,0]=4 684 B13R2.238 CC1(CC(C1)N)C2=CC=CC=C2 Z1126749018 [0,0,0,1,0,1|1,0,0]=3 685 B13R2.238 CC1CC(C1)(N)C2=CC=CC=C2 Z4631703126 [0,0,0,1,0,1|2,0,0]=4 686 B13R2.238 N[C@@]1(C[C@@H](C1)O)C2=CC=CC=C2 Z2791095871 [0,0,0,1,0,1|2,0,0]=4 687 B13R2.238 N[C@H]1C[C@](C1)(O)C2=CC=NC=C2 Z5229156075 [0,0,0,1,0,1|1,0,0]=3 688 B13R2.238 N[C@H]1C[C@](C1)(O)C2=CN=CC=C2 Z5219131819 [0,0,0,1,0,1|1,0,0]=3 689 B13R2.328 CN1CC(CC2=C1C=CC=C2)N Z2310670953 [0,0,0,1,0,1|2,0,0]=4 690 B13R2.382 CC1CC1C(N)C2=CC=CC=C2 Z1695797918 [0,0,0,1,0,1|2,0,0]=4 691 B13R2.690 CC(NC1CC1)C2=CC=CC=C2 Z2065464367 [0,0,0,1,0,1|2,0,0]=4 692 B13R2.690 NC(CC1CC1)C2=CC=CC=C2 Z826524146 [0,0,0,1,0,1|2,0,0]=4 693 B13R2.690 OC(CC1CO1)C2=CC=CC=C2 Z1400655261 [0,0,0,1,0,1|1,0,0]=3 694 B13R2.12159 CC1(OB(C2=C1C=CC=C2)O)C Z1255432716 [0,0,0,1,0,1|2,0,0]=4 695 B13R2.520 CC1=CC=C(C=C1)C(N)C2CC2 Z212051920 [0,1,0,1,0,0|2,0,0]=4 696 B13R2.520 NC(C1=CC=C(C=C1)Cl)C2CC2 Z336481690 [0,1,0,1,0,0|2,0,0]=4 697 B13R2.520 NC(C1=CC=C(C=C1)F)C2CC2 Z291232556 [0,1,0,1,0,0|2,0,0]=4 698 B13R2.520 OC(C1=CC=C(C=C1)Br)C2CC2 Z756121470 [0,1,0,1,0,0|1,0,0]=3 699 B13R2.2987 CC1(CC1N)C2=CC=C(C=C2)F Z1695926070 [0,1,0,1,0,0|1,0,0]=3 700 B13R2.5190 CC1CC2=C(C1C)C=CC(=C2)O Z1513871470 [0,1,0,1,0,0|2,0,0]=4 701 B13R2.5190 CC1CC2=C(C1N)C=CC(=C2)Br Z5129562645 [0,1,0,1,0,0|2,0,0]=4 702 B13R2.5190 CC1OC2=C(C1N)C=CC(=C2)Br Z5090873656 [0,1,0,1,0,0|2,0,0]=4 703 B13R2.5190 O=C1NC2=C(C1O)C=CC(=C2)Br Z235448248 [0,1,0,1,0,0|1,0,1]=4 704 B13R2.5190 O=C1NC2=C(C1O)C=CC(=C2)F Z335245186 [0,1,0,1,0,0|1,0,1]=4 705 B13R2.15 CC1NCCC1C2=CC=CC=C2 Z979418782 [0,1,0,1,0,0|1,0,0]=3 706 B13R2.15 F[C@@H]1CNC[C@@H]1C2=CC=CC=C2 Z3222118152 [0,1,0,1,0,0|2,0,0]=4 707 B13R2.15 NC1CCCC1C2=CC=CC=C2 Z993058900 [0,1,0,1,0,0|1,0,0]=3 708 B13R2.15 N[C@@H]1CCO[C@H]1C2=CC=CC=C2 Z2690083974 [0,1,0,1,0,0|0,0,0]=2 709 B13R2.15 N[C@@H]1CCO[C@H]1C2=CN=CC=C2 Z2327884249 [0,1,0,1,0,0|1,0,0]=3 710 B13R2.15 O[C@@H]1CCC[C@H]1C2=CC=CC=C2 Z2306832376 [0,1,0,1,0,0|2,0,0]=4 711 B13R2.15 O[C@@H]1CCN[C@@H]1C2=CC=CC=C2 Z4203073787 [0,1,0,1,0,0|2,0,0]=4 712 B13R2.32 CC1CCC2=C(C1N)C=CC=C2 Z1539988085 [0,1,0,1,0,0|2,0,0]=4 713 B13R2.32 CC1CNC2=C(C1=O)C=CC=C2 Z1262564894 [0,1,0,1,0,0|0,0,2]=4 714 B13R2.32 CC1CNC2=C(S1=O)C=CC=C2 Z1827893688 [0,1,0,1,0,0|1,0,1]=4 715 B13R2.32 CC1COC2=C(C1O)C=CC=C2 Z1255453699 [0,1,0,1,0,0|1,0,0]=3 716 B13R2.32 NC1C2=C(C=CC=C2)CCC1F Z2791719028 [0,1,0,1,0,0|2,0,0]=4 717 B13R2.32 NC1C2=C(C=CC=C2)OCC1F Z2830459792 [0,1,0,1,0,0|2,0,0]=4 718 B13R2.32 NC1CCC2=C(C1=O)C=CC=C2 Z1815149197 [0,1,0,1,0,0|0,0,2]=4 719 B13R2.32 NC1COC2=C(C1=O)C=CC=C2 Z1526503390 [0,1,0,1,0,0|0,0,2]=4 720 B13R2.32 NC1COC2=C(C1O)C=CC=C2 Z2146515656 [0,1,0,1,0,0|0,0,0]=2 721 B13R2.32 NC1CSC2=C(C1=O)C=CC=C2 Z3243691901 [0,1,0,1,0,0|0,0,2]=4 722 B13R2.32 N[C@@H]1COC2=C([C@H]1O)C=CC=C2 Z4354027077 [0,1,0,1,0,0|0,0,0]=2 723 B13R2.32 N[C@H]1C2=C(C=CC=C2)CC[C@@H]1O Z3070471251 [0,1,0,1,0,0|2,0,0]=4 724 B13R2.32 N[C@H]1C2=C(C=CC=C2)CC[C@H]1O Z2901813806 [0,1,0,1,0,0|2,0,0]=4 725 B13R2.32 N[C@H]1C2=C(C=CC=C2)OC[C@H]1O Z3212210130 [0,1,0,1,0,0|2,0,0]=4 726 B13R2.45 CN[C@@H]1CC2=C([C@@H]1O)C=CC=C2 Z4657916171 [0,1,0,1,0,0|0,0,0]=2 727 B13R2.45 CO[C@@H]1CC2=C([C@H]1N)C=CC=C2 Z4661669768 [0,1,0,1,0,0|2,0,0]=4 728 B13R2.45 C[C@H]1C2=C(C=CC=C2)O[C@H]1CN Z2755724050 [0,1,0,1,0,0|2,0,0]=4 729 B13R2.56 NCC1CCC1C2=CC=CC=C2 Z4003034803 [0,1,0,1,0,0|1,0,0]=3 730 B13R2.56 O=CC1CCC1C2=CC=CC=C2 Z1509045454 [0,1,0,1,0,0|2,0,0]=4 731 B13R2.56 OC[C@@H]1NC[C@H]1C2=CC=CC=C2 Z3691037314 [0,1,0,1,0,0|1,0,0]=3 732 B13R2.98 C[C@@]1(C[C@@H]1C2=CC=CC=C2)C=O Z2289709429 [0,1,0,1,0,0|2,0,0]=4 733 B13R2.98 C[C@]1(C[C@H]1C2=CC=CC=C2)CN Z2216303059 [0,1,0,1,0,0|1,0,0]=3 734 B13R2.98 C[C@]1(C[C@H]1C2=CC=CC=C2)CO Z2467454648 [0,1,0,1,0,0|2,0,0]=4 735 B13R2.413 CC1(CCC1N)C2=CC=CC=C2 Z1813195198 [0,1,0,1,0,0|1,0,0]=3 736 B13R2.3085 CN1C(=O)C2=C(C1O)C=CC=C2 Z108567058 [0,1,0,1,0,0|2,0,0]=4 737 B13R2.8137 NC(C1=CC=CC=C1)C2CCC2 Z3244520377 [0,1,0,1,0,0|2,0,0]=4 738 B13R2.8138 CC(C1=CC=CC=C1)C2(CC2)N Z3576390632 [0,1,0,1,0,0|1,0,0]=3 739 B13R2.72 CC(N)C1=CSC2=C1C=CC=C2 Z370714584 [0,1,0,1,0,0|0,1,1]=4 740 B13R2.72 CC(N)C1COC2=C1C=CC=C2 Z1493816383 [0,1,0,1,0,0|0,0,0]=2 741 B13R2.215 NC1CCC1C2=C(C=CC=C2)Cl Z1695906760 [0,1,0,1,0,0|1,0,0]=3 742 B13R2.243 CC1(CC2=C(C1N)C=CC=C2)C Z4167757602 [0,1,0,1,0,0|2,0,0]=4 743 B13R2.243 CC1(NC2=C(C1=O)C=CC=C2)C Z1255381565 [0,1,0,1,0,0|0,0,2]=4 744 B13R2.243 CC1(NC2=C(C1N)C=CC=C2)C Z2739157113 [0,1,0,1,0,0|1,0,0]=3 745 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)Cl Z1250132353 [0,1,0,1,0,0|1,0,0]=3 746 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)F Z1259162122 [0,1,0,1,0,0|1,0,0]=3 747 B13R2.3570 CC1=C(C=CC=C1)C2(CC2N)C Z1259162043 [0,1,0,1,0,0|1,0,0]=3 748 B13R2.4856 CC1=C2C(=CC=C1)NC(=O)C2O Z2240823115 [0,1,0,1,0,0|1,0,1]=4 749 B13R2.3019 CC1(CC1N)C2=CC(=CC=C2)F Z1695926124 [0,1,0,1,0,0|1,0,0]=3 750 B13R2.3028 CC1=CC2=C(C=C1)CC(C2N)C Z1625822273 [0,1,0,1,0,0|2,0,0]=4 751 B13R2.3028 CC1CC2=C(C1N)C=C(C=C2)F Z1398462002 [0,1,0,1,0,0|2,0,0]=4 752 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)Br Z235447292 [0,1,0,1,0,0|1,0,1]=4 753 B13R2.3028 O=C1NC2=C(C1O)C=C(C=C2)F Z335244996 [0,1,0,1,0,0|1,0,1]=4 754 B13R2.4825 CC1OC2=C(C=CC=C2C1N)F Z1436181401 [0,1,0,1,0,0|2,0,0]=4 755 B13R2.4825 C[C@@H]1CC2=C(C=CC=C2[C@@H]1N)Cl Z3172815917 [0,1,0,1,0,0|2,0,0]=4 756 B13R2.439 CC(C)C1(CO1)C2=CC=CC=C2 Z1020684114 [0,1,0,1,0,0|1,0,0]=3 757 B13R2.135 CN[C@H]1C2=C(C=CC=C2)C[C@@H]1O Z4716420151 [0,1,0,1,0,0|2,0,0]=4 758 B13R2.679 N#CC(C1=CC=CC=C1)C2CC2 Z1198339353 [0,1,0,1,0,0|2,0,0]=4 759 B13R2.679 NCC(C1=CC=CC=C1)C2CC2 Z2205958644 [0,1,0,1,0,0|2,0,0]=4 760 B13R2.679 O=CC(C1=CC=CC=C1)C2CC2 Z1255459771 [0,1,0,1,0,0|1,0,1]=4 761 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [1,0,0,0,1,0|2,0,0]=4 762 B9R1.11 CCC(N)C1=CC=CS1 Z744593088 [1,0,0,0,1,0|2,0,0]=4 763 B9R1.11 CCC(O)C1=NC=CN1 Z1889917109 [1,0,0,0,1,0|2,0,0]=4 764 B9R1.11 NCC(O)C1=CN=CS1 Z2310732372 [1,0,0,0,1,0|2,0,0]=4 765 B9R1.11 NCC(O)C1=CNC=N1 Z2310707384 [1,0,0,0,1,0|2,0,0]=4 766 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [1,0,0,0,1,0|1,0,0]=3 767 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [1,0,0,0,1,0|1,0,0]=3 768 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [1,0,0,0,1,0|1,0,0]=3 769 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [1,0,0,0,1,0|1,0,0]=3 770 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [1,0,0,0,1,0|2,0,0]=4 771 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [1,0,0,0,1,0|1,0,0]=3 772 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [1,0,0,0,1,0|2,0,0]=4 773 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [1,0,0,0,1,0|2,0,0]=4 774 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [1,0,0,0,0,1|1,0,1]=4 775 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [1,0,0,0,0,1|1,0,1]=4 776 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [1,0,0,0,0,1|1,0,1]=4 777 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [1,0,0,0,0,1|1,0,0]=3 778 B11R1.91 CC(C)COC1=CN=CC=C1 Z1606818727 [1,0,0,0,0,1|2,0,0]=4 779 B11R1.91 CC(C)NCC1=CN=CC=C1 Z90502194 [1,0,0,0,0,1|2,0,0]=4 780 B11R1.91 CC(C)NCC1=NC=CC=C1 Z90502192 [1,0,0,0,0,1|2,0,0]=4 781 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [1,0,0,0,0,1|0,0,0]=2 782 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [1,0,0,0,0,1|0,0,0]=2 783 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [1,0,0,0,0,1|1,0,0]=3 784 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [1,0,0,0,0,1|2,0,0]=4 785 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [1,0,0,0,0,1|0,0,0]=2 786 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [1,0,0,0,0,1|2,0,0]=4 787 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [1,0,0,0,0,1|1,0,1]=4 788 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [1,0,0,0,0,1|1,0,1]=4 789 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [1,0,0,0,0,1|1,0,1]=4 790 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [1,0,0,0,0,1|1,0,1]=4 791 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [1,0,0,0,0,1|1,0,1]=4 792 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [1,0,0,0,0,1|1,0,1]=4 793 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [1,0,0,0,0,1|1,0,1]=4 794 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [1,0,0,0,0,1|1,0,1]=4 795 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [1,0,0,0,0,1|1,0,1]=4 796 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [1,0,0,0,0,1|1,0,1]=4 797 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [1,0,0,0,0,1|1,0,1]=4 798 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [1,0,0,0,0,1|1,0,1]=4 799 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [1,0,0,0,0,1|1,0,1]=4 800 B11R1.77 CC(N)CC(O)C1=CC=CO1 Z1407654390 [0,0,0,0,1,1|1,0,0]=3 801 B11R1.77 CC(N)CC(O)C1=CC=CS1 Z1488857996 [0,0,0,0,1,1|1,0,0]=3 802 B13R1.348 CC(C)CC(N)CC1=CC=CC=C1 Z3214214500 [0,0,0,0,0,2|2,0,0]=4 803 B13R1.348 CC(N)CC(=O)NC1=CC=CC=C1 Z594220260 [0,0,0,0,0,2|0,0,2]=4 804 B13R1.351 CC(C)C(O)CCC1=CC=CC=C1 Z513750674 [0,0,0,0,0,2|1,0,0]=3 805 B13R1.351 CC(C)C(O)CSC1=CC=CC=C1 Z1258791042 [0,0,0,0,0,2|1,0,0]=3 806 B13R1.351 CC(N)C(=O)NCC1=CC=CC=C1 Z234893901 [0,0,0,0,0,2|0,0,2]=4 807 B13R1.351 CC(N)C(=O)OCC1=CC=CC=C1 Z2472775311 [0,0,0,0,0,2|0,0,2]=4 808 B13R1.351 CC(O)C(C)OCC1=CC=CC=C1 Z854223056 [0,0,0,0,0,2|2,0,0]=4 809 B13R1.45 CC(=O)NCC(O)C1=CC=CC=C1 Z255306774 [0,0,0,0,0,2|1,0,1]=4 810 B13R1.45 CC(C)CNC(C)C1=CC=CC=C1 Z4926664046 [0,0,0,0,0,2|2,0,0]=4 811 B13R1.45 CN(C)CCC(O)C1=CC=CC=C1 Z56755627 [0,0,0,0,0,2|2,0,0]=4 812 B13R1.45 NC(=O)NCC(O)C1=CC=CC=C1 Z198194916 [0,0,0,0,0,2|1,0,1]=4 813 B13R1.45 NC(=O)OCC(O)C1=CC=CC=C1 Z1198155491 [0,0,0,0,0,2|1,0,1]=4