0 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 Z1255485389 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 Z31506242 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.36 CC(=O)N(C)C1=CC=NC=C1 Z1889797965 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.36 CC(=O)N(C)C1=CN=CC=C1 Z1203252645 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 Z223364322 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,0,0,0,0,0|2,0,1]=3 9 B11R1.36 CC(C(=O)O)C1=CN=CC=C1 Z792377268 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.36 CC(C(=O)O)C1=CN=CN=C1 Z1860991554 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.36 CC(C(=O)[O-])C1=CC=NC=C1 Z2408359395 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 Z513733918 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.36 CC(C)C(=O)C1=CN=CC=C1 Z513733850 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 Z199509008 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.36 CN(C(=O)N)C1=CN=CC=C1 Z1188339188 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.36 CN(O)C(=O)C1=CC=CC=C1 Z1416187404 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.36 C[C@@H](C(=O)O)C1=CN=CC=C1 Z5462337230 [0,0,0,0,0,0|2,0,1]=3 20 B11R1.36 C[C@H](C(=O)O)C1=CN=CC=C1 Z5462556304 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,0,0,0,0,0|1,0,1]=2 25 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 Z815264186 [0,0,0,0,0,0|2,0,1]=3 26 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,0,0,0,0,0|1,0,1]=2 27 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,0,0,0,0,0|1,0,1]=2 28 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 Z381360894 [0,0,0,0,0,0|0,0,0]=0 29 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,0,0,0,0,0|1,0,1]=2 30 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,0,0,0,0,0|1,0,1]=2 31 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,0,0,0,0,0|0,0,2]=2 32 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,0,0,0,0,0|0,1,1]=2 33 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,0,0,0,0,0|0,0,2]=2 34 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,0,0,0,0,0|0,0,2]=2 35 B11R1.36 O=C([O-])C(O)C1=NC=CC=C1 Z2357023524 [0,0,0,0,0,0|1,0,3]=4 36 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,0,0,0,0,0|1,0,2]=4 38 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,0,0,0,0,0|1,0,1]=3 39 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [1,0,0,0,0,0|1,0,1]=3 40 B10R1.15 CCC(=O)C1=CC=NC=C1 Z513733916 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.15 CNC(=N)C1=CC=CC=C1 Z2096088186 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.15 CNC(=O)C1=CC=CC=C1 Z32016410 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.15 CNC(=O)C1=NC=CC=C1 Z32016284 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.15 COC(=O)C1=CC=CC=C1 Z19825577 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.15 COC(=O)C1=CN=CC=C1 Z57036282 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.15 COC(=O)C1=NC=CC=C1 Z19673259 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.15 N/C(=N\O)/C1=CC=CC=C1 Z56827052 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.15 N/C(=N\O)/C1=CC=NC=C1 Z220383526 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.15 N/C(=N\O)/C1=CN=CC=C1 Z221503662 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.15 N/C(=N\O)/C1=NC=CC=C1 Z228474568 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [1,0,0,0,0,0|1,0,2]=4 53 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,0,0,0,0,0|1,0,1]=3 54 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.15 NNC(=O)C1=CC=NC=C1 Z58981801 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.15 NNC(=O)C1=CN=CC=C1 Z58981809 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.15 NNC(=O)C1=NC=CC=C1 Z56922131 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [1,0,0,0,0,0|1,0,2]=4 60 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [1,0,0,0,0,0|1,0,2]=4 61 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [1,0,0,0,0,0|1,0,1]=3 62 B10R1.15 O=C(CCl)C1=CC=NC=C1 Z1198181039 [1,0,0,0,0,0|2,0,1]=4 63 B10R1.15 O=C(CCl)C1=CN=CC=C1 Z2768198137 [1,0,0,0,0,0|2,0,1]=4 64 B10R1.15 O=C(CCl)C1=NC=CC=C1 Z1205657985 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [1,0,0,0,0,0|0,0,1]=2 66 B10R1.15 O=C(NO)C1=CC=CC=C1 Z56912029 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.15 O=C(NO)C1=CN=CC=C1 Z59181939 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [1,0,0,0,0,0|0,0,0]=1 69 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [1,0,0,0,0,0|1,0,2]=4 73 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [1,0,0,0,0,0|1,0,1]=3 75 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.18 NC(=O)NC1=NC=CC=C1 Z208358454 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [1,0,0,0,0,0|1,1,1]=4 79 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [1,0,0,0,0,0|2,1,0]=4 80 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [1,0,0,0,0,0|1,0,1]=3 81 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [1,0,0,0,0,0|1,0,1]=3 82 B10R1.18 O=C(O)CC1=CN=CN=C1 Z1889902548 [1,0,0,0,0,0|2,0,1]=4 83 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [1,0,0,0,0,0|1,0,1]=3 84 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [1,0,0,0,0,0|1,0,2]=4 85 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [1,0,0,0,0,0|1,0,2]=4 86 B12R1.20 C=C(C(=O)O)C1=CC=C(C=C1)Cl Z1255421681 [0,1,0,0,0,0|1,0,0]=2 87 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O Z1513599636 [0,1,0,0,0,0|2,0,0]=3 88 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [0,1,0,0,0,0|2,0,1]=4 89 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [0,1,0,0,0,0|2,0,1]=4 90 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N Z147641478 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [0,1,0,0,0,0|1,0,1]=3 93 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [0,1,0,0,0,0|1,0,1]=3 94 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [0,1,0,0,0,0|1,0,1]=3 95 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [0,1,0,0,0,0|1,0,1]=3 96 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [0,1,0,0,0,0|1,0,1]=3 97 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)Cl Z385417200 [0,1,0,0,0,0|2,0,1]=4 98 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)N Z1198162397 [0,1,0,0,0,0|2,0,1]=4 99 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O Z1198150713 [0,1,0,0,0,0|2,0,1]=4 100 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Br Z56928896 [0,1,0,0,0,0|2,0,1]=4 101 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)Cl Z85933873 [0,1,0,0,0,0|2,0,1]=4 102 B12R1.20 CC(Cl)C(=O)C1=CC=C(C=C1)F Z56968508 [0,1,0,0,0,0|2,0,1]=4 103 B12R1.20 CC(N)C(=O)C1=CC=C(C=C1)Cl Z3023980683 [0,1,0,0,0,0|2,0,1]=4 104 B12R1.20 CC1=CC=C(C=C1)C(=O)C(=O)O Z118430526 [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|2,0,1]=4 106 B12R1.20 CC1=CC=C(C=C1)C(=O)C(O)O Z1263714779 [0,1,0,0,0,0|0,0,2]=3 107 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [0,1,0,0,0,0|1,0,1]=3 108 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [0,1,0,0,0,0|1,0,1]=3 109 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,1,0,0,0,0|3,0,0]=4 110 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)Br Z32014422 [0,1,0,0,0,0|3,0,0]=4 111 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)Cl Z32014358 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)I Z32014382 [0,1,0,0,0,0|3,0,0]=4 113 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)N Z56979314 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)O Z68247175 [0,1,0,0,0,0|3,0,0]=4 115 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,1,0,0,0,0|2,0,1]=4 116 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,1,0,0,0,0|2,0,1]=4 117 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,1,0,0,0,0|2,0,1]=4 118 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,1,0,0,0,0|2,0,1]=4 119 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,1,0,0,0,0|2,0,1]=4 120 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [0,1,0,0,0,0|1,0,1]=3 121 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [0,1,0,0,0,0|1,0,1]=3 122 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [0,1,0,0,0,0|1,0,1]=3 123 B12R1.20 NC1=CC=C(C=C1)C(=O)C(F)F Z3211701572 [0,1,0,0,0,0|2,0,1]=4 124 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [0,1,0,0,0,0|1,0,1]=3 125 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [0,1,0,0,0,0|1,0,1]=3 126 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [0,1,0,0,0,0|1,0,1]=3 127 B12R1.20 O=C(C1=CC=C(C=C1)Br)C(Br)Br Z228591592 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.20 O=C(C1=CC=C(C=C1)F)C(O)O Z1263714872 [0,1,0,0,0,0|0,0,2]=3 129 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)Cl Z381360896 [0,1,0,0,0,0|0,0,0]=1 130 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)F Z381360860 [0,1,0,0,0,0|0,0,0]=1 131 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [0,1,0,0,0,0|0,0,0]=1 132 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [0,1,0,0,0,0|1,0,1]=3 133 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [0,1,0,0,0,0|0,0,2]=3 134 B12R1.34 C/C(=C(/N)\C1=CC=CC=C1)/C#N Z56759567 [0,1,0,0,0,0|3,0,0]=4 135 B12R1.34 C=CC(=O)N(C)C1=CC=CC=C1 Z440633576 [0,1,0,0,0,0|3,0,0]=4 136 B12R1.34 CC(CO)C(=O)C1=CC=CC=C1 Z1198183441 [0,1,0,0,0,0|1,0,1]=3 137 B12R1.34 CCC(=O)C(=O)C1=CC=CC=C1 Z1251352835 [0,1,0,0,0,0|1,0,0]=2 138 B12R1.34 CCC(=O)N(C)C1=CC=CC=C1 Z58322425 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 Z56896212 [0,1,0,0,0,0|3,0,0]=4 140 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 Z594038166 [0,1,0,0,0,0|2,0,1]=4 141 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 Z1203869997 [0,1,0,0,0,0|1,0,2]=4 142 B12R1.34 COC(=O)C(C)C1=CC=NC=C1 Z1143360472 [0,1,0,0,0,0|2,0,1]=4 143 B12R1.34 COC(=O)C(C)C1=CN=CC=C1 Z982129816 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.34 COC(=O)C(C)C1=NC=CC=C1 Z1143356350 [0,1,0,0,0,0|2,0,1]=4 145 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 Z57046237 [0,1,0,0,0,0|1,0,1]=3 146 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 Z56757232 [0,1,0,0,0,0|1,0,1]=3 147 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 Z19752945 [0,1,0,0,0,0|0,0,2]=3 148 B12R1.34 COC(=O)C(O)C1=CN=CC=C1 Z1250100620 [0,1,0,0,0,0|1,0,2]=4 149 B12R1.34 COC(=O)C(O)C1=NC=CC=C1 Z4130150180 [0,1,0,0,0,0|1,0,2]=4 150 B12R1.124 C=C(C(=O)O)C1=C(C=CC=C1)F Z1255374937 [0,1,0,0,0,0|1,0,0]=2 151 B12R1.124 CC(=O)C(N)C1=C(C=CC=C1)F Z2312540924 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)Cl Z982130746 [0,1,0,0,0,0|1,0,1]=3 153 B12R1.124 CC(C(=O)O)C1=C(C=CC=C1)F Z792377276 [0,1,0,0,0,0|1,0,1]=3 154 B12R1.124 CC(C)C(=O)C1=C(C=CC=C1)Br Z851790218 [0,1,0,0,0,0|2,0,1]=4 155 B12R1.124 CC(C)C(=O)C1=C(C=CC=C1)Cl Z733415220 [0,1,0,0,0,0|2,0,1]=4 156 B12R1.124 CC1=C(C=CC=C1)C(=O)C(C)C Z513734868 [0,1,0,0,0,0|2,0,1]=4 157 B12R1.124 CC1=C(C=CC=C1)C(C)C(=O)O Z792377258 [0,1,0,0,0,0|1,0,1]=3 158 B12R1.124 CC1=C(C=CC=C1)C(N)C(=O)O Z317024660 [0,1,0,0,0,0|1,0,1]=3 159 B12R1.124 CC1=C(C=CN=C1)C(C)C(=O)O Z3545523789 [0,1,0,0,0,0|2,0,1]=4 160 B12R1.124 CC1=C(N=CC=C1)C(O)C(=O)O Z1945984217 [0,1,0,0,0,0|1,0,2]=4 161 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)Br Z32014274 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)Cl Z32014275 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)F Z32014394 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)I Z32014519 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)N Z57825373 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.124 CN(C)C(=O)C1=C(C=CC=C1)O Z68247186 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)Br Z317024716 [0,1,0,0,0,0|1,0,1]=3 168 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)F Z317024726 [0,1,0,0,0,0|1,0,1]=3 169 B12R1.124 NC(C(=O)O)C1=C(C=CC=C1)I Z2941400819 [0,1,0,0,0,0|1,0,1]=3 170 B12R1.124 O=C(C1=C(C=CC=C1)O)C(F)F Z1255500375 [0,1,0,0,0,0|2,0,1]=4 171 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)Br Z788000812 [0,1,0,0,0,0|0,0,2]=3 172 B12R1.124 O=C(O)C(O)C1=C(C=CC=C1)I Z1269111466 [0,1,0,0,0,0|0,0,2]=3 173 B12R1.124 O=C(O)[C@H](O)C1=C(C=CC=C1)Cl Z1255488133 [0,1,0,0,0,0|0,0,2]=3 174 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [0,1,0,0,0,0|1,0,2]=4 175 B12R1.225 CC(=O)N(C)C1=CC(=CC=C1)N Z802628524 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.225 CC(Br)C(=O)C1=CC(=CC=C1)Cl Z56946912 [0,1,0,0,0,0|2,0,1]=4 177 B12R1.225 CC(C(=O)O)C1=CC(=CC=C1)F Z792377330 [0,1,0,0,0,0|1,0,1]=3 178 B12R1.225 CC(C)C(=O)C1=CC(=CC=C1)N Z3026469959 [0,1,0,0,0,0|2,0,1]=4 179 B12R1.225 CC(N)C(=O)C1=CC(=CC=C1)O Z3015076235 [0,1,0,0,0,0|2,0,1]=4 180 B12R1.225 CC1=CC(=CC=C1)C(=O)C(=O)O Z1255379743 [0,1,0,0,0,0|0,0,0]=1 181 B12R1.225 CC1=CC(=CC=C1)C(N)C(=O)O Z317024596 [0,1,0,0,0,0|1,0,1]=3 182 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [0,1,0,0,0,0|0,0,2]=3 183 B12R1.225 CC1=CC=CC(=C1)C(=O)N(C)C Z32014821 [0,1,0,0,0,0|3,0,0]=4 184 B12R1.225 CC1=CC=CC(=C1)C(C)C(=O)O Z802854000 [0,1,0,0,0,0|1,0,1]=3 185 B12R1.225 CN(C(=O)N)C1=CC(=CC=C1)N Z802629090 [0,1,0,0,0,0|3,0,0]=4 186 B12R1.225 CN(C)C(=O)C1=CC(=CC=C1)Br Z32014413 [0,1,0,0,0,0|3,0,0]=4 187 B12R1.225 CN(C)C(=O)C1=CC(=CC=C1)Cl Z32014375 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.225 CN(C)C(=O)C1=CC(=CC=C1)I Z32014543 [0,1,0,0,0,0|3,0,0]=4 189 B12R1.225 CN(C)C(=O)C1=CC(=CC=C1)N Z228584848 [0,1,0,0,0,0|3,0,0]=4 190 B12R1.225 CN(C)C(=O)C1=CC(=CC=C1)O Z32014356 [0,1,0,0,0,0|3,0,0]=4 191 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,1,0,0,0,0|2,0,1]=4 192 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Br Z317024672 [0,1,0,0,0,0|1,0,1]=3 193 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Cl Z317024654 [0,1,0,0,0,0|1,0,1]=3 194 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)F Z317024592 [0,1,0,0,0,0|1,0,1]=3 195 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)I Z3477438782 [0,1,0,0,0,0|1,0,1]=3 196 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [0,1,0,0,0,0|1,0,1]=3 197 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [0,1,0,0,0,0|0,0,2]=3 198 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [0,1,0,0,0,0|0,0,2]=3 199 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [0,1,0,0,0,0|0,0,2]=3 200 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [0,1,0,0,0,0|0,0,2]=3 201 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [0,1,0,0,0,0|0,0,2]=3 202 B12R1.253 CC(=O)C(C)(C)C1=CC=CC=C1 Z406676998 [0,1,0,0,0,0|2,0,1]=4 203 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 Z104493600 [0,1,0,0,0,0|1,0,1]=3 204 B12R1.253 CC(C)(C(=O)O)C1=CN=CC=C1 Z1582263901 [0,1,0,0,0,0|2,0,1]=4 205 B12R1.253 CC(N)(C(=O)N)C1=CC=CC=C1 Z1211228973 [0,1,0,0,0,0|2,0,1]=4 206 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 Z600397716 [0,1,0,0,0,0|1,0,1]=3 207 B12R1.253 CC(N)(C(=O)O)C1=CN=CC=C1 Z4079861885 [0,1,0,0,0,0|2,0,1]=4 208 B12R1.253 CC(O)(C(=O)O)C1=CC=CC=C1 Z336127660 [0,1,0,0,0,0|0,0,2]=3 209 B12R1.253 C[C@@](O)(C(=O)O)C1=CC=CC=C1 Z1154245575 [0,1,0,0,0,0|0,0,2]=3 210 B12R1.253 C[C@](O)(C(=O)O)C1=CC=CC=C1 Z1119104455 [0,1,0,0,0,0|0,0,2]=3 211 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 Z56757372 [0,1,0,0,0,0|2,0,1]=4 212 B12R1.253 O=C(O)C(F)(F)C1=CC=CC=C1 Z56770330 [0,1,0,0,0,0|1,0,1]=3 213 B12R1.478 CC(=O)/C(=C\1/C=CC=CN1)/C#N Z1262581996 [0,1,0,0,0,0|3,0,0]=4 214 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 Z104479150 [0,1,0,0,0,0|1,0,1]=3 215 B12R1.478 CCC(C(=O)O)C1=CN=CC=C1 Z982129822 [0,1,0,0,0,0|2,0,1]=4 216 B12R1.478 CCN(C(=O)C)C1=CC=CC=C1 Z58324632 [0,1,0,0,0,0|3,0,0]=4 217 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 Z1259273212 [0,1,0,0,0,0|1,0,1]=3 218 B12R1.478 COC(C(=O)C)C1=CC=CC=C1 Z1513595127 [0,1,0,0,0,0|1,0,2]=4 219 B12R1.478 COC(C(=O)O)C1=CC=CC=C1 Z316258914 [0,1,0,0,0,0|0,0,2]=3 220 B12R1.478 CSC(C(=O)O)C1=CC=CC=C1 Z732206604 [0,1,0,0,0,0|0,1,1]=3 221 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 Z1913661007 [0,1,0,0,0,0|1,0,1]=3 222 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 Z1080722424 [0,1,0,0,0,0|0,0,2]=3 223 B12R1.478 O=C(O)[C@H](CO)C1=CC=CC=C1 Z1262510670 [0,1,0,0,0,0|0,0,2]=3 224 B12R1.564 NC(C1=CC=CC=C1)P(=O)(O)O Z55625577 [0,1,0,0,0,0|2,0,1]=4 225 B12R1.564 O=C(C1=CC=CC=C1)C(F)(F)F Z649458352 [0,1,0,0,0,0|2,0,1]=4 226 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)Br Z361892264 [0,0,0,1,0,0|3,0,0]=4 227 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)C Z56867202 [0,0,0,1,0,0|3,0,0]=4 228 B12R2.18 CC1=C(C2=C(S1)C=CC=C2)Br Z1269212248 [0,0,0,1,0,0|2,1,0]=4 229 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,0,0,1,0,0|2,0,1]=4 230 B12R2.18 CC1CC2=C(C1=O)C=CC=C2 Z854042930 [0,0,0,1,0,0|2,0,1]=4 231 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,0,0,1,0,0|3,0,0]=4 232 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 Z57070418 [0,0,0,1,0,0|3,0,0]=4 233 B12R2.18 CN1NC2=C(C1=O)C=CC=C2 Z1255429786 [0,0,0,1,0,0|3,0,0]=4 234 B12R2.18 ClC1=C(C2=C(S1)C=CC=C2)Cl Z1269130316 [0,0,0,1,0,0|2,1,0]=4 235 B12R2.18 NC1CC2=C(C1=O)C=CC=C2 Z1551475987 [0,0,0,1,0,0|2,0,1]=4 236 B12R2.18 NN1CC2=C(C1=O)C=CC=C2 Z1953500024 [0,0,0,1,0,0|3,0,0]=4 237 B12R2.18 O=C1C2=C(C=CC=C2)CC1Cl Z854067258 [0,0,0,1,0,0|2,0,1]=4 238 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [0,0,0,1,0,0|1,0,0]=2 239 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,0,0,1,0,0|1,0,2]=4 240 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,0,0,1,0,0|2,0,1]=4 241 B12R2.18 O=C1SC2=C(C1=O)C=CC=C2 Z1198153623 [0,0,0,1,0,0|0,1,0]=2 242 B12R2.23 O=C1CCN1C2=CC=CC=C2 Z1198221109 [0,0,0,1,0,0|3,0,0]=4 243 B10R1.23 CC(C(=O)O)C1=CC=CO1 Z792377294 [0,0,0,0,1,0|2,0,1]=4 244 B10R1.23 CC(C(=O)O)C1=CSC=C1 Z954552432 [0,0,0,0,1,0|2,0,1]=4 245 B10R1.23 CC(C(=O)O)N1C=CC=C1 Z223656256 [0,0,0,0,1,0|2,0,1]=4 246 B10R1.23 NC(C(=O)O)C1=CC=CS1 Z803154920 [0,0,0,0,1,0|2,0,1]=4 247 B10R1.23 NC(C(=O)O)C1=CSC=C1 Z1696871277 [0,0,0,0,1,0|2,0,1]=4 248 B10R1.23 O=C(O)C(O)C1=CSC=C1 Z788000616 [0,0,0,0,1,0|1,0,2]=4 249 B12R1.43 C/C(=C\C1=CC=CC=C1)/C(=O)O Z2980228149 [0,0,0,0,0,1|1,0,0]=2 250 B12R1.43 C/C(=C\C1=CC=NC=C1)/C(=O)O Z2466682039 [0,0,0,0,0,1|2,0,0]=3 251 B12R1.43 C/C(=C\C1=CN=CC=C1)/C(=O)O Z2467131746 [0,0,0,0,0,1|2,0,0]=3 252 B12R1.43 C/C(=C\C1=NC=CC=C1)/C(=O)O Z2467234655 [0,0,0,0,0,1|2,0,0]=3 253 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 Z90124995 [0,0,0,0,0,1|2,0,1]=4 254 B12R1.43 CC(C)C(=O)NC1=CC=CC=C1 Z27782614 [0,0,0,0,0,1|2,0,1]=4 255 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O Z513624710 [0,0,0,0,0,1|1,0,1]=3 256 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Z3477804988 [0,0,0,0,0,1|2,0,1]=4 257 B12R1.43 CC(Cl)C(=O)CC1=CC=CC=C1 Z558478664 [0,0,0,0,0,1|2,0,1]=4 258 B12R1.43 CC(Cl)C(=O)NC1=CC=CC=C1 Z56921786 [0,0,0,0,0,1|2,0,1]=4 259 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 Z1262640515 [0,0,0,0,0,1|2,0,1]=4 260 B12R1.43 CC(N)C(=O)NC1=CC=CC=C1 Z1266933914 [0,0,0,0,0,1|2,0,1]=4 261 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O Z57982184 [0,0,0,0,0,1|1,0,1]=3 262 B12R1.43 CC(O)C(=O)NC1=CC=CC=C1 Z212044362 [0,0,0,0,0,1|1,0,1]=3 263 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O Z57825333 [0,0,0,0,0,1|1,0,1]=3 264 B12R1.43 CC(OC1=CN=CC=C1)C(=O)O Z336080820 [0,0,0,0,0,1|2,0,1]=4 265 B12R1.43 CC(OC1=NC=CC=C1)C(=O)O Z360507460 [0,0,0,0,0,1|2,0,1]=4 266 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,0,0,0,0,1|2,0,1]=4 267 B12R1.43 CC(SC1=CC=CC=C1)C(=O)O Z90122656 [0,0,0,0,0,1|1,0,1]=3 268 B12R1.43 CC(SC1=NC=CC=C1)C(=O)O Z31250551 [0,0,0,0,0,1|2,0,1]=4 269 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 Z55293723 [0,0,0,0,0,1|3,0,0]=4 270 B12R1.43 CN(CC1=CC=CC=C1)C(=O)N Z198194348 [0,0,0,0,0,1|3,0,0]=4 271 B12R1.43 CN(N)C(=O)NC1=CC=CC=C1 Z56855649 [0,0,0,0,0,1|3,0,0]=4 272 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O Z1262510261 [0,0,0,0,0,1|1,0,1]=3 273 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,0,0,0,0,1|2,0,1]=4 274 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,0,0,0,0,1|2,0,1]=4 275 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,0,0,0,0,1|2,0,1]=4 276 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O Z57127433 [0,0,0,0,0,1|1,0,1]=3 277 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O Z1675026076 [0,0,0,0,0,1|2,0,1]=4 278 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O Z3235906342 [0,0,0,0,0,1|2,0,1]=4 279 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O Z3235025558 [0,0,0,0,0,1|2,0,1]=4 280 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O Z756430566 [0,0,0,0,0,1|1,0,1]=3 281 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O Z933646062 [0,0,0,0,0,1|1,0,1]=3 282 B12R1.43 O=C(O)/C(=C/C1=CN=CC=C1)/F Z2081677235 [0,0,0,0,0,1|2,0,0]=3 283 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 Z285151774 [0,0,0,0,0,1|0,0,0]=1 284 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 Z362848468 [0,0,0,0,0,1|0,0,0]=1 285 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 Z788000648 [0,0,0,0,0,1|0,0,2]=3 286 B12R1.43 O=C(O)C(O)CC1=NC=CC=C1 Z3486862716 [0,0,0,0,0,1|1,0,2]=4 287 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 Z1255386695 [0,0,0,0,0,1|0,0,2]=3 288 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 Z1255364914 [0,0,0,0,0,1|0,0,2]=3 289 B12R1.107 C/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748396 [0,0,0,0,0,1|1,0,0]=2 290 B12R1.107 C/C(=C\C(=O)O)/C1=CC=NC=C1 Z352748124 [0,0,0,0,0,1|2,0,0]=3 291 B12R1.107 C/C(=C\C(=O)O)/C1=CN=CC=C1 Z352748104 [0,0,0,0,0,1|2,0,0]=3 292 B12R1.107 CC(=O)CC(=O)C1=CC=NC=C1 Z359504772 [0,0,0,0,0,1|2,0,0]=3 293 B12R1.107 CC(=O)CC(=O)C1=CN=CC=C1 Z57157128 [0,0,0,0,0,1|2,0,0]=3 294 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 Z104484314 [0,0,0,0,0,1|2,0,1]=4 295 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,0,0,0,0,1|2,0,1]=4 296 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 Z56899204 [0,0,0,0,0,1|1,0,1]=3 297 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 Z352782496 [0,0,0,0,0,1|2,0,1]=4 298 B12R1.107 CC(N)CC(=O)C1=CC=CC=C1 Z1413780437 [0,0,0,0,0,1|2,0,1]=4 299 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,0,0,0,0,1|2,0,1]=4 300 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [0,0,0,0,0,1|3,0,0]=4 301 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [0,0,0,0,0,1|2,0,0]=3 302 B12R1.107 CN(CC(=O)O)C1=CC=NC=C1 Z317257814 [0,0,0,0,0,1|3,0,0]=4 303 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 Z1198149259 [0,0,0,0,0,1|2,0,0]=3 304 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 Z94601171 [0,0,0,0,0,1|1,0,1]=3 305 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 Z317027344 [0,0,0,0,0,1|2,0,1]=4 306 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 Z756925772 [0,0,0,0,0,1|1,0,1]=3 307 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 Z1696091779 [0,0,0,0,0,1|1,0,1]=3 308 B12R1.107 O=C(O)/C=C(\F)/C1=CN=CC=C1 Z4602486084 [0,0,0,0,0,1|2,0,0]=3 309 B12R1.107 O=C(O)/C=C(\I)/C1=CC=CC=C1 Z3379426714 [0,0,0,0,0,1|1,0,0]=2 310 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 Z982132010 [0,0,0,0,0,1|0,0,2]=3 311 B12R1.107 O=C(O)NC(=O)C1=CC=CC=C1 Z56928966 [0,0,0,0,0,1|0,0,0]=1 312 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [2,0,0,0,0,0|0,0,1]=3 313 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [2,0,0,0,0,0|1,0,1]=4 314 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [2,0,0,0,0,0|1,0,1]=4 315 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [2,0,0,0,0,0|1,0,1]=4 316 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [2,0,0,0,0,0|1,0,1]=4 317 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [2,0,0,0,0,0|1,0,1]=4 318 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [2,0,0,0,0,0|1,1,0]=4 322 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [2,0,0,0,0,0|0,0,0]=2 323 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [2,0,0,0,0,0|1,0,0]=3 324 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [2,0,0,0,0,0|1,0,0]=3 325 B9R1.6 O=C(O)C1=CN=CN=C1 Z336079948 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.6 O=C(O)C1=CN=NC=C1 Z1182328443 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [2,0,0,0,0,0|1,0,0]=3 328 B9R1.6 O=C(O)C1=NC=CC=N1 Z1259341107 [2,0,0,0,0,0|2,0,0]=4 329 B9R1.6 O=C(O)C1=NC=CN=C1 Z104476002 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.6 O=C(O)C1=NC=NC=C1 Z57064900 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.6 O=C(O)C1=NN=CC=C1 Z1201621268 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [2,0,0,0,0,0|1,0,0]=3 333 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [2,0,0,0,0,0|1,0,1]=4 334 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [2,0,0,0,0,0|0,0,1]=3 335 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [2,0,0,0,0,0|0,0,2]=4 336 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 Z1020737978 [1,1,0,0,0,0|2,0,0]=4 337 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 Z1079442604 [1,1,0,0,0,0|1,0,1]=4 338 B11R1.7 O=S(=O)(NO)C1=CC=CC=C1 Z45528441 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [1,1,0,0,0,0|1,0,1]=4 340 B11R1.12 N#CC(C=O)C1=CC=CC=C1 Z57912400 [1,1,0,0,0,0|1,0,1]=4 341 B11R1.16 C/C=C/C(=O)C1=CC=CC=C1 Z2259130553 [1,1,0,0,0,0|1,0,0]=3 342 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [1,1,0,0,0,0|1,0,1]=4 343 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [1,1,0,0,0,0|1,0,1]=4 344 B11R1.16 CCOC(=O)C1=CC=CC=C1 Z53835169 [1,1,0,0,0,0|1,0,1]=4 345 B11R1.16 CSCC(=O)C1=CC=CC=C1 Z732208586 [1,1,0,0,0,0|0,1,1]=4 346 B11R1.16 N#C/C=C(\Cl)/C1=CC=CC=C1 Z56912627 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.16 N#C/C=C(\N)/C1=CC=CC=C1 Z2259146567 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.16 N#CCC(=O)C1=CC=CC=C1 Z56899088 [1,1,0,0,0,0|1,0,1]=4 349 B11R1.16 N#CNC(=O)C1=CC=CC=C1 Z276572712 [1,1,0,0,0,0|1,0,1]=4 350 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [1,1,0,0,0,0|1,0,1]=4 351 B11R1.16 O=C(NCO)C1=CC=CC=C1 Z56799838 [1,1,0,0,0,0|0,0,1]=3 352 B11R1.16 O=C(NCO)C1=CN=CC=C1 Z57472937 [1,1,0,0,0,0|1,0,1]=4 353 B11R1.22 C#CC(=O)C1=CC=C(C=C1)Cl Z1266856320 [1,1,0,0,0,0|1,0,1]=4 354 B11R1.22 C=C(CO)C1=CC=C(C=C1)C Z1896562587 [1,1,0,0,0,0|1,0,1]=4 355 B11R1.22 C=CC(=O)C1=CC=C(C=C1)O Z1416178613 [1,1,0,0,0,0|1,0,0]=3 356 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [1,1,0,0,0,0|1,0,1]=4 357 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [1,1,0,0,0,0|1,0,1]=4 358 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [1,1,0,0,0,0|1,0,1]=4 359 B11R1.22 CC1=CC=C(C=C1)/C(=N/O)/N Z57626985 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr Z104481640 [1,1,0,0,0,0|1,0,1]=4 361 B11R1.22 CC1=CC=C(C=C1)C(=O)CCl Z56886309 [1,1,0,0,0,0|1,0,1]=4 362 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [1,1,0,0,0,0|1,0,1]=4 363 B11R1.22 CC1=CC=C(C=C1)C(=O)CO Z228585628 [1,1,0,0,0,0|0,0,1]=3 364 B11R1.22 CC1=CC=C(C=C1)C(=O)NO Z59182007 [1,1,0,0,0,0|1,0,0]=3 365 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [1,1,0,0,0,0|1,0,1]=4 366 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br Z104485724 [1,1,0,0,0,0|1,0,1]=4 367 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl Z104477486 [1,1,0,0,0,0|1,0,1]=4 368 B11R1.22 CCC(=O)C1=CC=C(C=C1)F Z104477898 [1,1,0,0,0,0|1,0,1]=4 369 B11R1.22 CCC(=O)C1=CC=C(C=C1)I Z285137052 [1,1,0,0,0,0|1,0,1]=4 370 B11R1.22 CCC(=O)C1=CC=C(C=C1)N Z1203578051 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.22 CCC(=O)C1=CC=C(C=C1)O Z104499156 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br Z30272262 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.22 CNC(=O)C1=CC=C(C=C1)C Z32016517 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.22 CNC(=O)C1=CC=C(C=C1)Cl Z32016366 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.22 CNC(=O)C1=CC=C(C=C1)I Z30272273 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.22 CNC(=O)C1=CC=C(C=C1)N Z56985799 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.22 CNC(=O)C1=CC=C(C=C1)O Z183855140 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.22 COC(=O)C1=CC=C(C=C1)Br Z19682625 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.22 COC(=O)C1=CC=C(C=C1)I Z19776689 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.22 COC(=O)C1=CC=C(C=C1)N Z54178705 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.22 COC(=O)C1=CC=C(C=C1)O Z19674820 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)Cl Z57627739 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.22 N/C(=N\O)/C1=CC=C(C=C1)O Z156964722 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.22 NC1=CC=C(C=C1)/C(=N/O)/N Z364003706 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [1,1,0,0,0,0|1,0,1]=4 386 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [1,1,0,0,0,0|1,0,1]=4 387 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [1,1,0,0,0,0|1,0,1]=4 388 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.22 NNC(=O)C1=CC=C(C=C1)Br Z56899079 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.22 NNC(=O)C1=CC=C(C=C1)F Z56862389 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.22 NNC(=O)C1=CC=C(C=C1)N Z57199627 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.22 NNC(=O)C1=CC=C(C=C1)O Z57036327 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Br Z57708731 [1,1,0,0,0,0|1,0,1]=4 394 B11R1.22 O=C(CBr)C1=CC=C(C=C1)Cl Z104484576 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.22 O=C(CBr)C1=CC=C(C=C1)F Z104495742 [1,1,0,0,0,0|1,0,1]=4 396 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Br Z56886257 [1,1,0,0,0,0|1,0,1]=4 397 B11R1.22 O=C(CCl)C1=CC=C(C=C1)Cl Z104477840 [1,1,0,0,0,0|1,0,1]=4 398 B11R1.22 O=C(CCl)C1=CC=C(C=C1)F Z104478978 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.22 O=C(CCl)C1=CC=C(C=C1)I Z57046985 [1,1,0,0,0,0|1,0,1]=4 400 B11R1.22 O=C(CCl)C1=CC=C(C=C1)O Z104378296 [1,1,0,0,0,0|1,0,1]=4 401 B11R1.22 O=C(CO)C1=CC=C(C=C1)Cl Z906206720 [1,1,0,0,0,0|0,0,1]=3 402 B11R1.22 O=C(NO)C1=CC=C(C=C1)Br Z59181930 [1,1,0,0,0,0|1,0,0]=3 403 B11R1.22 O=C(NO)C1=CC=C(C=C1)Cl Z59181938 [1,1,0,0,0,0|1,0,0]=3 404 B11R1.22 O=C(NO)C1=CC=C(C=C1)I Z59181951 [1,1,0,0,0,0|1,0,0]=3 405 B11R1.22 O=C(NO)C1=CN=C(C=C1)Br Z1776118638 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.22 O=CC(=O)C1=CC=C(C=C1)Br Z1269163105 [1,1,0,0,0,0|0,0,0]=2 407 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [1,1,0,0,0,0|1,0,1]=4 408 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [1,1,0,0,0,0|1,0,1]=4 409 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [1,1,0,0,0,0|1,0,1]=4 410 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [1,1,0,0,0,0|1,0,1]=4 411 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [1,1,0,0,0,0|1,0,1]=4 412 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.23 CNC(=O)C1=CC(=CC=C1)Cl Z32016383 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.23 CNC(=O)C1=CC(=CC=C1)F Z32016733 [1,1,0,0,0,0|2,0,0]=4 417 B11R1.23 CNC(=O)C1=CC(=CC=C1)N Z57040519 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.23 CNC(=O)C1=CC(=CC=C1)O Z32016364 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.23 COC(=O)C1=CC(=CC=C1)C Z18750812 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.23 COC(=O)C1=CC(=CC=C1)N Z57032594 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Br Z57741780 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Cl Z90662858 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)F Z381355872 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)O Z359513480 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.23 NC1=CC=CC(=C1)/C(=N/O)/N Z364003720 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [1,1,0,0,0,0|1,0,1]=4 428 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [1,1,0,0,0,0|1,0,1]=4 429 B11R1.23 NNC(=O)C1=CC(=CC=C1)Cl Z56899158 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.23 NNC(=O)C1=CC(=CC=C1)N Z56922179 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.23 NNC(=O)C1=CC(=CC=C1)O Z56930730 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.23 O=C(CBr)C1=CC=CC(=C1)Cl Z104482040 [1,1,0,0,0,0|1,0,1]=4 433 B11R1.23 O=C(CBr)C1=CC=CC(=C1)F Z111411220 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.23 O=C(NO)C1=CC(=CC=C1)Br Z59181977 [1,1,0,0,0,0|1,0,0]=3 435 B11R1.23 O=C(NO)C1=CC(=CC=C1)Cl Z59181969 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.23 O=C(NO)C1=CC(=CC=C1)O Z317038072 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.23 O=CC(=O)C1=CC=CC(=C1)Br Z2472857402 [1,1,0,0,0,0|0,0,0]=2 438 B11R1.23 O=CC(=O)C1=CC=CC(=C1)O Z1255357387 [1,1,0,0,0,0|0,0,0]=2 439 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [1,1,0,0,0,0|1,0,1]=4 440 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.222 CC1=C(C=CC=C1)/C(=N/O)/N Z56881213 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.222 CC1=C(C=CC=C1)C(=O)C=O Z2472857037 [1,1,0,0,0,0|0,0,0]=2 444 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [1,1,0,0,0,0|1,0,1]=4 445 B11R1.222 CC1=C(C=CC=C1)C(=O)NN Z56347320 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [1,1,0,0,0,0|1,0,1]=4 447 B11R1.222 CCC(=O)C1=C(C=CC=C1)Br Z851790216 [1,1,0,0,0,0|1,0,1]=4 448 B11R1.222 CCC(=O)C1=C(C=CC=C1)N Z1201617664 [1,1,0,0,0,0|1,0,1]=4 449 B11R1.222 CNC(=O)C1=C(C=CC=C1)F Z32016402 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.222 CNC(=O)C1=C(C=CC=C1)N Z57124070 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.222 CNC(=O)C1=C(C=CC=C1)O Z57148963 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.222 COC(=O)C1=C(C=CC=C1)Br Z19670137 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.222 COC(=O)C1=C(C=CC=C1)C Z18382338 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.222 COC(=O)C1=C(C=CC=C1)F Z19798265 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.222 COC(=O)C1=C(C=CC=C1)I Z18327644 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.222 COC(=O)C1=C(C=CC=C1)O Z19703590 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.222 N/C(=N\O)/C1=C(C=CC=C1)Cl Z56867911 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.222 N=C\1C=CC=C/C1=C(/N)\NO Z193450698 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [1,1,0,0,0,0|1,0,1]=4 461 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [1,1,0,0,0,0|1,0,1]=4 462 B11R1.222 NNC(=O)C1=C(C=CC=C1)Br Z56899129 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.222 NNC(=O)C1=C(C=CC=C1)Cl Z57248585 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.222 NNC(=O)C1=C(C=CC=C1)F Z56896291 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.222 NNC(=O)C1=C(C=CC=C1)N Z104472510 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.222 NNC(=O)C1=C(C=CC=C1)O Z57241860 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.222 O=C(CBr)C1=C(C=CC=C1)F Z94602027 [1,1,0,0,0,0|1,0,1]=4 468 B11R1.222 O=C(CCl)C1=C(C=CC=C1)F Z854066970 [1,1,0,0,0,0|1,0,1]=4 469 B11R1.222 O=C(CO)C1=C(C=CC=C1)Cl Z906206760 [1,1,0,0,0,0|0,0,1]=3 470 B11R1.222 O=C(NO)C1=C(C=CC=C1)Br Z59181924 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.222 O=C(NO)C1=C(C=CC=C1)O Z57842350 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.222 O=CC(=O)C1=C(C=CC=C1)Br Z1516173728 [1,1,0,0,0,0|0,0,0]=2 473 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,1,0,0,0,0|1,0,1]=4 474 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [1,1,0,0,0,0|0,0,1]=3 483 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.20 CC1=NC=C(C=C1)CC(=O)O Z424795892 [1,1,0,0,0,0|1,0,1]=4 485 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [1,1,0,0,0,0|1,0,1]=4 486 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [1,1,0,0,0,0|1,0,1]=4 487 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [1,1,0,0,0,0|1,0,1]=4 488 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [1,1,0,0,0,0|1,0,1]=4 489 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [1,1,0,0,0,0|2,0,0]=4 490 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [1,1,0,0,0,0|2,0,0]=4 494 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [1,1,0,0,0,0|0,0,1]=3 495 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [1,1,0,0,0,0|1,0,1]=4 496 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [1,1,0,0,0,0|0,0,1]=3 497 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [1,1,0,0,0,0|0,0,1]=3 498 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [1,1,0,0,0,0|0,0,1]=3 499 B11R1.20 O=C(O)CC1=CN=C(C=C1)Cl Z1165304038 [1,1,0,0,0,0|1,0,1]=4 500 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 Z1198338224 [1,1,0,0,0,0|1,0,1]=4 501 B11R1.20 O=C(O)CC1=NC=C(C=C1)F Z1945984141 [1,1,0,0,0,0|1,0,1]=4 502 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [1,1,0,0,0,0|1,0,1]=4 503 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O Z3219847417 [1,1,0,0,0,0|1,0,0]=3 504 B11R1.40 C=CC(=O)NC1=CC=CC=C1 Z440633536 [1,1,0,0,0,0|2,0,0]=4 505 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.40 COC(=O)CC1=CC=NC=C1 Z331473808 [1,1,0,0,0,0|1,0,1]=4 507 B11R1.40 COC(=O)CC1=NC=CC=C1 Z147652450 [1,1,0,0,0,0|1,0,1]=4 508 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,1,0,0,0,0|1,0,1]=4 511 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [1,1,0,0,0,0|2,0,0]=4 512 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [1,1,0,0,0,0|1,0,1]=4 513 B11R1.40 O=C(CCl)NC1=CC=CC=C1 Z56889119 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [1,1,0,0,0,0|1,0,0]=3 515 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Br Z2312942099 [1,1,0,0,0,0|1,0,0]=3 516 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Cl Z104475950 [1,1,0,0,0,0|1,0,0]=3 517 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [1,1,0,0,0,0|1,0,1]=4 518 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [1,1,0,0,0,0|1,0,1]=4 519 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [1,1,0,0,0,0|1,0,1]=4 520 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [1,1,0,0,0,0|1,0,1]=4 521 B11R1.86 CC(=O)NC1=C(C=CC=C1)N Z239120544 [1,1,0,0,0,0|2,0,0]=4 522 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [1,1,0,0,0,0|2,0,0]=4 524 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [1,1,0,0,0,0|1,0,1]=4 525 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [1,1,0,0,0,0|0,0,1]=3 526 B11R1.86 CC1=C(C=CC=N1)CC(=O)O Z2050687800 [1,1,0,0,0,0|1,0,1]=4 527 B11R1.86 CC1=C(C=NC=C1)CC(=O)O Z1198264460 [1,1,0,0,0,0|1,0,1]=4 528 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [1,1,0,0,0,0|1,0,1]=4 529 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [1,1,0,0,0,0|1,0,1]=4 530 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [1,1,0,0,0,0|1,0,1]=4 531 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [1,1,0,0,0,0|1,0,1]=4 532 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [1,1,0,0,0,0|2,0,0]=4 533 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.86 NC1=C(C=CC=N1)CC(=O)O Z1889710265 [1,1,0,0,0,0|1,0,1]=4 536 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [1,1,0,0,0,0|0,0,1]=3 537 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [1,1,0,0,0,0|0,0,1]=3 538 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [1,1,0,0,0,0|0,0,1]=3 539 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [1,1,0,0,0,0|0,0,1]=3 540 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [1,1,0,0,0,0|0,0,1]=3 541 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl Z2096659743 [1,1,0,0,0,0|1,0,1]=4 542 B11R1.86 O=C(O)CC1=C(C=CN=C1)O Z1255444750 [1,1,0,0,0,0|1,0,1]=4 543 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br Z1269238080 [1,1,0,0,0,0|1,0,1]=4 544 B11R1.86 O=C(O)CN1C=CC=CC1=O Z57985357 [1,1,0,0,0,0|1,0,1]=4 545 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,1,0,0,0,0|1,0,1]=4 546 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,1,0,0,0,0|1,0,1]=4 547 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,1,0,0,0,0|1,0,1]=4 548 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [1,1,0,0,0,0|2,0,0]=4 549 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [1,1,0,0,0,0|2,0,0]=4 550 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [1,1,0,0,0,0|2,0,0]=4 551 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [1,1,0,0,0,0|2,0,0]=4 552 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,1,0,0,0,0|1,0,1]=4 553 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,1,0,0,0,0|1,0,1]=4 554 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,1,0,0,0,0|1,0,1]=4 555 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,1,0,0,0,0|1,0,1]=4 556 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [1,1,0,0,0,0|2,0,0]=4 557 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [1,1,0,0,0,0|2,0,0]=4 558 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [1,1,0,0,0,0|2,0,0]=4 559 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [1,1,0,0,0,0|2,0,0]=4 560 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,1,0,0,0,0|2,0,0]=4 561 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,1,0,0,0,0|0,0,1]=3 562 B11R1.157 NC1=NC=CC(=C1)CC(=O)O Z1197888454 [1,1,0,0,0,0|1,0,1]=4 563 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,1,0,0,0,0|0,0,1]=3 564 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,1,0,0,0,0|0,0,1]=3 565 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,1,0,0,0,0|0,0,1]=3 566 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,1,0,0,0,0|0,0,1]=3 567 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,1,0,0,0,0|0,0,1]=3 568 B11R1.157 O=C(O)CC1=CC(=CN=C1)Br Z1269198419 [1,1,0,0,0,0|1,0,1]=4 569 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [1,1,0,0,0,0|1,0,1]=4 570 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [1,1,0,0,0,0|1,0,1]=4 571 B11R1.314 CN1C=C(C=N1)C(=O)C(=O)O Z316122458 [0,1,0,0,1,0|2,0,0]=4 572 B11R1.314 O=C(O)C(=O)C1=CC=C(S1)Cl Z381360936 [0,1,0,0,1,0|1,0,0]=3 573 B13R1.133 C/C(=C\C1=CC=C(C=C1)F)/C(=O)O Z1350606414 [0,1,0,0,0,1|1,0,0]=3 574 B13R1.133 CC(CC1=CC=C(C=C1)Br)C(=O)O Z513659390 [0,1,0,0,0,1|1,0,1]=4 575 B13R1.133 CC(CC1=CC=C(C=C1)Cl)C(=O)O Z513659166 [0,1,0,0,0,1|1,0,1]=4 576 B13R1.133 CC(CC1=CC=C(C=C1)F)C(=O)O Z513658938 [0,1,0,0,0,1|1,0,1]=4 577 B13R1.133 CC(CC1=CC=C(C=C1)N)C(=O)O Z1262515083 [0,1,0,0,0,1|1,0,1]=4 578 B13R1.133 CC(OC1=CC=C(C=C1)Br)C(=O)O Z56347385 [0,1,0,0,0,1|1,0,1]=4 579 B13R1.133 CC(OC1=CC=C(C=C1)Cl)C(=O)O Z56922097 [0,1,0,0,0,1|1,0,1]=4 580 B13R1.133 CC(OC1=CC=C(C=C1)F)C(=O)O Z90662162 [0,1,0,0,0,1|1,0,1]=4 581 B13R1.133 CC(SC1=CC=C(C=C1)Br)C(=O)O Z56278798 [0,1,0,0,0,1|1,0,1]=4 582 B13R1.133 CC(SC1=CC=C(C=C1)Cl)C(=O)O Z55179957 [0,1,0,0,0,1|1,0,1]=4 583 B13R1.133 CC(SC1=CC=C(C=C1)F)C(=O)O Z56279369 [0,1,0,0,0,1|1,0,1]=4 584 B13R1.133 CC1=CC=C(C=C1)CC(=O)C(=O)O Z271004544 [0,1,0,0,0,1|0,0,0]=2 585 B13R1.133 CC1=CC=C(C=C1)CC(C)C(=O)O Z513658700 [0,1,0,0,0,1|1,0,1]=4 586 B13R1.133 CC1=CC=C(C=C1)NC(=O)C(=O)O Z57984667 [0,1,0,0,0,1|0,0,0]=2 587 B13R1.133 CC1=CC=C(C=C1)OC(C)C(=O)O Z56915889 [0,1,0,0,0,1|1,0,1]=4 588 B13R1.133 CC1=CC=C(C=C1)SC(C)C(=O)O Z56278800 [0,1,0,0,0,1|1,0,1]=4 589 B13R1.133 C[C@H](OC1=CC=C(C=C1)Cl)C(=O)O Z1508916088 [0,1,0,0,0,1|1,0,1]=4 590 B13R1.133 NC(CC1=CC=C(C=C1)Cl)C(=O)O Z317024982 [0,1,0,0,0,1|1,0,1]=4 591 B13R1.133 NC(CC1=CC=C(C=C1)F)C(=O)O Z57969728 [0,1,0,0,0,1|1,0,1]=4 592 B13R1.133 NC(CC1=CC=C(C=C1)I)C(=O)O Z1263631851 [0,1,0,0,0,1|1,0,1]=4 593 B13R1.133 NC(CC1=CC=C(C=C1)O)C(=O)O Z57127380 [0,1,0,0,0,1|1,0,1]=4 594 B13R1.133 N[C@@H](CC1=CC=C(C=C1)F)C(=O)O Z995228058 [0,1,0,0,0,1|1,0,1]=4 595 B13R1.133 N[C@@H](CC1=CC=C(C=C1)I)C(=O)O Z1269142887 [0,1,0,0,0,1|1,0,1]=4 596 B13R1.133 N[C@@H](CC1=CC=C(C=C1)O)C(=O)O Z756440046 [0,1,0,0,0,1|1,0,1]=4 597 B13R1.133 N[C@H](CC1=CC=C(C=C1)Cl)C(=O)O Z995228428 [0,1,0,0,0,1|1,0,1]=4 598 B13R1.133 N[C@H](CC1=CC=C(C=C1)F)C(=O)O Z995228438 [0,1,0,0,0,1|1,0,1]=4 599 B13R1.133 N[C@H](CC1=CC=C(C=C1)I)C(=O)O Z1269112635 [0,1,0,0,0,1|1,0,1]=4 600 B13R1.133 N[C@H](CC1=CC=C(C=C1)O)C(=O)O Z969739284 [0,1,0,0,0,1|1,0,1]=4 601 B13R1.133 O=C(O)C(=O)NC1=CC=C(C=C1)Cl Z90122505 [0,1,0,0,0,1|0,0,0]=2 602 B13R1.133 O=C(O)C(Br)CC1=CC=C(C=C1)F Z57388220 [0,1,0,0,0,1|1,0,1]=4 603 B13R1.133 O=C(O)C(O)CC1=CC=C(C=C1)F Z1255373692 [0,1,0,0,0,1|0,0,2]=4 604 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 Z56867313 [0,1,0,0,0,1|1,0,1]=4 605 B13R1.135 NNC(=O)C(=O)NC1=NC=CC=C1 Z1203154712 [0,1,0,0,0,1|2,0,0]=4 606 B13R1.148 CC(CC1=CC(=CC=C1)Cl)C(=O)O Z513660282 [0,1,0,0,0,1|1,0,1]=4 607 B13R1.148 CC(CC1=CC(=CC=C1)F)C(=O)O Z513660066 [0,1,0,0,0,1|1,0,1]=4 608 B13R1.148 CC(OC1=CC(=CC=C1)Br)C(=O)O Z228583330 [0,1,0,0,0,1|1,0,1]=4 609 B13R1.148 CC(OC1=CC(=CC=C1)Cl)C(=O)O Z57042071 [0,1,0,0,0,1|1,0,1]=4 610 B13R1.148 CC(OC1=CC(=CC=C1)F)C(=O)O Z228583338 [0,1,0,0,0,1|1,0,1]=4 611 B13R1.148 CC(OC1=CC(=CC=C1)N)C(=O)O Z274525908 [0,1,0,0,0,1|1,0,1]=4 612 B13R1.148 CC1=CC(=CC=C1)CC(N)C(=O)O Z2470414651 [0,1,0,0,0,1|1,0,1]=4 613 B13R1.148 CC1=CC=CC(=C1)OC(C)C(=O)O Z56917379 [0,1,0,0,0,1|1,0,1]=4 614 B13R1.148 NC(CC1=CC(=CC=C1)Br)C(=O)O Z1770192944 [0,1,0,0,0,1|1,0,1]=4 615 B13R1.148 NC(CC1=CC(=CC=C1)Cl)C(=O)O Z1374884687 [0,1,0,0,0,1|1,0,1]=4 616 B13R1.148 NC(CC1=CC(=CC=C1)O)C(=O)O Z317025828 [0,1,0,0,0,1|1,0,1]=4 617 B13R1.148 N[C@@H](CC1=CC(=CC=C1)O)C(=O)O Z995228186 [0,1,0,0,0,1|1,0,1]=4 618 B13R1.148 N[C@H](CC1=CC(=CC=C1)O)C(=O)O Z995228562 [0,1,0,0,0,1|1,0,1]=4 619 B13R1.148 O=C(O)C(O)CC1=CC(=CC=C1)Cl Z1269030667 [0,1,0,0,0,1|0,0,2]=4 620 B13R1.152 CC(C(=O)O)C(N)C1=CC=CC=C1 Z1272096620 [0,1,0,0,0,1|1,0,1]=4 621 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O Z802846100 [0,1,0,0,0,1|1,0,1]=4 622 B13R1.152 CC(C1=CC=CC=C1)C(O)C(=O)O Z802846688 [0,1,0,0,0,1|0,0,2]=4 623 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 Z1649893051 [0,1,0,0,0,1|1,0,1]=4 624 B13R1.202 CC(CC1=C(C=CC=C1)Cl)C(=O)O Z513661398 [0,1,0,0,0,1|1,0,1]=4 625 B13R1.202 CC(CC1=C(C=CC=C1)F)C(=O)O Z513661176 [0,1,0,0,0,1|1,0,1]=4 626 B13R1.202 CC(OC1=C(C=CC=C1)Br)C(=O)O Z228583522 [0,1,0,0,0,1|1,0,1]=4 627 B13R1.202 CC(OC1=C(C=CC=C1)Cl)C(=O)O Z65532924 [0,1,0,0,0,1|1,0,1]=4 628 B13R1.202 CC(OC1=C(C=CC=C1)F)C(=O)O Z65532537 [0,1,0,0,0,1|1,0,1]=4 629 B13R1.202 CC(SC1=C(C=CC=C1)Cl)C(=O)O Z56278782 [0,1,0,0,0,1|1,0,1]=4 630 B13R1.202 CC1=C(C=CC=C1)CC(C)C(=O)O Z513660952 [0,1,0,0,0,1|1,0,1]=4 631 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O Z2217033050 [0,1,0,0,0,1|1,0,1]=4 632 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O Z1065645436 [0,1,0,0,0,1|1,0,1]=4 633 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Cl Z1269030424 [0,1,0,0,0,1|0,0,2]=4 634 B13R1.418 CCC(CC1=CC=CC=C1)C(=O)O Z513624620 [0,1,0,0,0,1|1,0,1]=4 635 B13R1.418 CCC(NC1=CC=CC=C1)C(=O)O Z274534828 [0,1,0,0,0,1|1,0,1]=4 636 B13R1.418 CCC(OC1=CC=CC=C1)C(=O)O Z104484470 [0,1,0,0,0,1|1,0,1]=4 637 B13R1.418 CCC(SC1=CC=CC=C1)C(=O)O Z149157470 [0,1,0,0,0,1|1,0,1]=4 638 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O Z446011606 [0,1,0,0,0,1|1,0,1]=4 639 B13R1.418 COC(CC1=CC=CC=C1)C(=O)O Z1258977185 [0,1,0,0,0,1|0,0,2]=4 640 B13R1.418 N#C/C(=C/C1=CC=CC=C1)/C(=O)O Z44303374 [0,1,0,0,0,1|1,0,0]=3 641 B13R1.418 NC(=O)N(CC1=CC=CC=C1)N=O Z1262622772 [0,1,0,0,0,1|2,0,0]=4 642 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O Z1258578382 [0,1,0,0,0,1|1,0,1]=4 643 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O Z995179618 [0,1,0,0,0,1|1,0,1]=4 644 B13R1.1073 CC(C)(NC1=CC=CC=C1)C(=O)O Z274535156 [0,1,0,0,0,1|1,0,1]=4 645 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O Z640389616 [0,1,0,0,0,1|1,0,1]=4 646 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O Z2680629352 [0,1,0,0,0,1|1,0,1]=4 647 B13R1.1073 CC(O)(CC1=CC=CC=C1)C(=O)O Z1079110682 [0,1,0,0,0,1|0,0,2]=4 648 B13R1.1073 C[C@@](O)(CC1=CC=CC=C1)C(=O)O Z1198165765 [0,1,0,0,0,1|0,0,2]=4 649 B13R1.1073 C[C@](O)(CC1=CC=CC=C1)C(=O)O Z1198165764 [0,1,0,0,0,1|0,0,2]=4 650 B13R1.1073 O=C(O)C(F)(F)OC1=CC=CC=C1 Z445134424 [0,1,0,0,0,1|1,0,1]=4 651 B13R1.11 CCC(=O)CC(=O)C1=CC=CC=C1 Z359504792 [0,1,0,0,0,1|1,0,0]=3 652 B13R1.11 CCC(=O)CC(=O)C1=CN=CC=C1 Z359504704 [0,1,0,0,0,1|2,0,0]=4 653 B13R1.11 COC(=O)/C=C(\C)/C1=CN=CC=C1 Z1408942492 [0,1,0,0,0,1|2,0,0]=4 654 B13R1.11 COC(=O)/C=C(\C)/C1=NC=CC=C1 Z1464062623 [0,1,0,0,0,1|2,0,0]=4 655 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 Z336079818 [0,1,0,0,0,1|1,0,0]=3 656 B13R1.11 COC(=O)CC(N)C1=CC=CC=C1 Z139720848 [0,1,0,0,0,1|1,0,1]=4 657 B13R1.11 O=C(CCl)NC(=O)C1=CC=CC=C1 Z56907603 [0,1,0,0,0,1|1,0,0]=3 658 B13R1.132 C/C(=C\C(=O)O)/C1=CC=C(C=C1)F Z352747294 [0,1,0,0,0,1|1,0,0]=3 659 B13R1.132 CC(=CC(=O)C1=CC=C(C=C1)F)C Z1313486101 [0,1,0,0,0,1|2,0,0]=4 660 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Br Z56941083 [0,1,0,0,0,1|1,0,0]=3 661 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)C Z56941082 [0,1,0,0,0,1|1,0,0]=3 662 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)Cl Z56876401 [0,1,0,0,0,1|1,0,0]=3 663 B13R1.132 CC(=O)CC(=O)C1=CC=C(C=C1)F Z56911911 [0,1,0,0,0,1|1,0,0]=3 664 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)Br Z1269234118 [0,1,0,0,0,1|1,0,1]=4 665 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)F Z352782250 [0,1,0,0,0,1|1,0,1]=4 666 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)N Z1262514048 [0,1,0,0,0,1|1,0,1]=4 667 B13R1.132 CC1=CC=C(C=C1)C(C)CC(=O)O Z352782406 [0,1,0,0,0,1|1,0,1]=4 668 B13R1.132 CC1=CC=C(C=C1)C(N)CC(=O)O Z56912034 [0,1,0,0,0,1|1,0,1]=4 669 B13R1.132 NC(=S)NC(=O)C1=CC=C(C=C1)Cl Z85924860 [0,1,0,0,0,1|1,1,0]=4 670 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Br Z147647162 [0,1,0,0,0,1|1,0,1]=4 671 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)Cl Z56899122 [0,1,0,0,0,1|1,0,1]=4 672 B13R1.132 NC(CC(=O)O)C1=CC=C(C=C1)F Z56921163 [0,1,0,0,0,1|1,0,1]=4 673 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)Br Z1696824108 [0,1,0,0,0,1|1,0,1]=4 674 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(C=C1)F Z4935533100 [0,1,0,0,0,1|1,0,1]=4 675 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)Cl Z982132070 [0,1,0,0,0,1|0,0,2]=4 676 B13R1.132 O=C(O)CC(O)C1=CC=C(C=C1)F Z982132094 [0,1,0,0,0,1|0,0,2]=4 677 B13R1.132 O=C(O)CS(=O)C1=CC=C(C=C1)Cl Z802568764 [0,1,0,0,0,1|1,0,0]=3 678 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)Br Z352748382 [0,1,0,0,0,1|1,0,0]=3 679 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)Cl Z352746932 [0,1,0,0,0,1|1,0,0]=3 680 B13R1.147 C/C(=C\C(=O)O)/C1=CC(=CC=C1)F Z352748162 [0,1,0,0,0,1|1,0,0]=3 681 B13R1.147 CC(=O)CC(=O)C1=CC(=CC=C1)Cl Z228582718 [0,1,0,0,0,1|1,0,0]=3 682 B13R1.147 CC(CC(=O)O)C1=CC(=CC=C1)F Z352781822 [0,1,0,0,0,1|1,0,1]=4 683 B13R1.147 CC1=CC(=CC=C1)C(N)CC(=O)O Z317027260 [0,1,0,0,0,1|1,0,1]=4 684 B13R1.147 N=C(N)NC(=O)C1=CC(=CC=C1)Cl Z3270320661 [0,1,0,0,0,1|2,0,0]=4 685 B13R1.147 NC(=O)NC(=O)C1=CC(=CC=C1)N Z1262625087 [0,1,0,0,0,1|1,0,0]=3 686 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)Br Z56899123 [0,1,0,0,0,1|1,0,1]=4 687 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)Cl Z317027314 [0,1,0,0,0,1|1,0,1]=4 688 B13R1.147 NC(CC(=O)O)C1=CC(=CC=C1)O Z352252742 [0,1,0,0,0,1|1,0,1]=4 689 B13R1.147 NC1=CC=CC(=C1)C(N)CC(=O)O Z1198161215 [0,1,0,0,0,1|1,0,1]=4 690 B13R1.147 O=C(O)CC(O)C1=CC(=CC=C1)F Z982132016 [0,1,0,0,0,1|0,0,2]=4 691 B13R1.201 C/C(=C\C(=O)O)/C1=C(C=CC=C1)F Z352747962 [0,1,0,0,0,1|1,0,0]=3 692 B13R1.201 CC(=O)CC(=O)C1=C(C=CC=C1)Cl Z228582702 [0,1,0,0,0,1|1,0,0]=3 693 B13R1.201 CC(CC(=O)O)C1=C(C=CC=C1)Br Z729841796 [0,1,0,0,0,1|1,0,1]=4 694 B13R1.201 CC(CC(=O)O)C1=C(C=CC=C1)F Z352782394 [0,1,0,0,0,1|1,0,1]=4 695 B13R1.201 CC1=C(C=CC=C1)/C(=C/C(=O)O)/C Z352748716 [0,1,0,0,0,1|1,0,0]=3 696 B13R1.201 CC1=C(C=CC=C1)C(C)CC(=O)O Z352782580 [0,1,0,0,0,1|1,0,1]=4 697 B13R1.201 CC1=C(C=CC=C1)C(N)CC(=O)O Z317027322 [0,1,0,0,0,1|1,0,1]=4 698 B13R1.201 CC1=C(C=CC=C1)[C@@H](N)CC(=O)O Z1270399998 [0,1,0,0,0,1|1,0,1]=4 699 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)Cl Z56854346 [0,1,0,0,0,1|1,0,1]=4 700 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)F Z56782527 [0,1,0,0,0,1|1,0,1]=4 701 B13R1.347 CC(=O)CS(=O)(=O)C1=CC=CC=C1 Z57066885 [0,1,0,0,0,1|2,0,0]=4 702 B13R1.347 CC(C)(CC(=O)O)C1=CC=CC=C1 Z752371312 [0,1,0,0,0,1|1,0,1]=4 703 B13R1.347 CC(O)(CC(=O)O)C1=CC=CC=C1 Z982131900 [0,1,0,0,0,1|0,0,2]=4 704 B13R1.347 NC(=O)CS(=O)(=O)C1=CC=CC=C1 Z19128437 [0,1,0,0,0,1|2,0,0]=4 705 B13R1.352 CS(=O)(=O)CC(=O)C1=CC=CC=C1 Z957336744 [0,1,0,0,0,1|1,0,1]=4 706 B13R1.713 C=CC(CC(=O)O)C1=CC=CC=C1 Z1262511239 [0,1,0,0,0,1|1,0,1]=4 707 B13R1.713 CC/C(=C\C(=O)O)/C1=CC=CC=C1 Z352748324 [0,1,0,0,0,1|1,0,0]=3 708 B13R1.713 CCC(CC(=O)O)C1=CC=CC=C1 Z352782018 [0,1,0,0,0,1|1,0,1]=4 709 B13R1.713 CCN(CC(=O)O)C1=CC=CC=C1 Z763029850 [0,1,0,0,0,1|2,0,0]=4 710 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 Z1255487817 [0,1,0,0,0,1|1,0,1]=4 711 B13R1.21 C/C(=N\O)/C(=O)C1=CC=C(C=C1)F Z166626756 [0,2,0,0,0,0|1,0,0]=3 712 B13R1.21 COC(=O)C(Br)C1=CC=C(C=C1)F Z198750882 [0,2,0,0,0,0|1,0,1]=4 713 B13R1.21 COC(=O)C(C)C1=CC=C(C=C1)Br Z1269137336 [0,2,0,0,0,0|1,0,1]=4 714 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)Br Z935140730 [0,2,0,0,0,0|1,0,1]=4 715 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)C Z477336198 [0,2,0,0,0,0|1,0,1]=4 716 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)Cl Z1297773503 [0,2,0,0,0,0|1,0,1]=4 717 B13R1.21 COC(=O)C(N)C1=CC=C(C=C1)I Z4541682932 [0,2,0,0,0,0|1,0,1]=4 718 B13R1.21 COC(=O)C(O)C1=CC=C(C=C1)F Z847296298 [0,2,0,0,0,0|0,0,2]=4 719 B13R1.21 COC(=O)N(C)C1=CC=C(C=C1)N Z359383836 [0,2,0,0,0,0|2,0,0]=4 720 B13R1.21 COC(=O)N(C)C1=CC=C(C=C1)O Z335809972 [0,2,0,0,0,0|2,0,0]=4 721 B13R1.21 CON(C)C(=O)C1=CC=C(C=C1)F Z54739555 [0,2,0,0,0,0|2,0,0]=4 722 B13R1.21 CON(C)C(=O)C1=CC=C(C=C1)N Z234896801 [0,2,0,0,0,0|2,0,0]=4 723 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)C=O Z1198177006 [0,2,0,0,0,0|1,0,1]=4 724 B13R1.36 CCC1=CC=C(C=C1)C(C)C(=O)O Z792377226 [0,2,0,0,0,0|1,0,1]=4 725 B13R1.36 CCC1=CC=C(C=C1)C(N)C(=O)O Z317024600 [0,2,0,0,0,0|1,0,1]=4 726 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O Z792377298 [0,2,0,0,0,0|1,0,1]=4 727 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O Z56755722 [0,2,0,0,0,0|1,0,1]=4 728 B13R1.36 N#CC1=CC=C(C=C1)C(O)C(=O)O Z1262556648 [0,2,0,0,0,0|0,0,2]=4 729 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO Z2510296391 [0,2,0,0,0,0|1,0,1]=4 730 B13R1.163 CC(C(=O)O)C1=C(C=C(C=C1)Br)F Z1558353210 [0,2,0,0,0,0|1,0,1]=4 731 B13R1.163 CC(C(=O)O)C1=C(C=C(C=C1)F)F Z792377188 [0,2,0,0,0,0|1,0,1]=4 732 B13R1.163 CC1=C(C=CC(=C1)F)C(O)C(=O)O Z959357232 [0,2,0,0,0,0|0,0,2]=4 733 B13R1.163 NC(C(=O)O)C1=C(C=C(C=C1)Cl)Cl Z317024702 [0,2,0,0,0,0|1,0,1]=4 734 B13R1.163 NC(C(=O)O)C1=C(C=C(C=C1)F)F Z317024642 [0,2,0,0,0,0|1,0,1]=4 735 B13R1.163 O=C(O)C(O)C1=C(C=C(C=C1)Cl)F Z1269228399 [0,2,0,0,0,0|0,0,2]=4 736 B13R1.510 CC(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z992423142 [0,2,0,0,0,0|1,0,1]=4 737 B13R1.510 CC(C(=O)O)C1=CC(=C(C=C1)F)F Z792377186 [0,2,0,0,0,0|1,0,1]=4 738 B13R1.510 CC1=C(C=C(C=C1)C(C)C(=O)O)Br Z1813162631 [0,2,0,0,0,0|1,0,1]=4 739 B13R1.510 CC1=C(C=CC(=C1)C(=O)C(=O)O)F Z1255356879 [0,2,0,0,0,0|0,0,0]=2 740 B13R1.510 CC1=C(C=CC(=C1)C(C)C(=O)O)Br Z1813181647 [0,2,0,0,0,0|1,0,1]=4 741 B13R1.510 CC1=C(C=CC(=C1)C(N)C(=O)O)Cl Z1198640890 [0,2,0,0,0,0|1,0,1]=4 742 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z317024644 [0,2,0,0,0,0|1,0,1]=4 743 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)Cl)F Z1696091766 [0,2,0,0,0,0|1,0,1]=4 744 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)F)Cl Z1269179754 [0,2,0,0,0,0|1,0,1]=4 745 B13R1.510 O=C(O)C(=O)C1=CC(=C(C=C1)F)F Z381360892 [0,2,0,0,0,0|0,0,0]=2 746 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)Br Z1269204407 [0,2,0,0,0,0|0,0,2]=4 747 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)Cl Z788000702 [0,2,0,0,0,0|0,0,2]=4 748 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)F Z838972312 [0,2,0,0,0,0|0,0,2]=4 749 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)F)Cl Z1269153543 [0,2,0,0,0,0|0,0,2]=4 750 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)F)F Z788000624 [0,2,0,0,0,0|0,0,2]=4 751 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)Br Z415660212 [0,2,0,0,0,0|1,0,1]=4 752 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)Cl Z606339610 [0,2,0,0,0,0|1,0,1]=4 753 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)F Z725146444 [0,2,0,0,0,0|1,0,1]=4 754 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)N Z1235993363 [0,2,0,0,0,0|1,0,1]=4 755 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)O Z1258981351 [0,2,0,0,0,0|1,0,1]=4 756 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)Br Z317024914 [0,2,0,0,0,0|1,0,1]=4 757 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)Cl Z317024852 [0,2,0,0,0,0|1,0,1]=4 758 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)F Z317024742 [0,2,0,0,0,0|1,0,1]=4 759 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)O Z1255523384 [0,2,0,0,0,0|1,0,1]=4 760 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)Cl Z788000388 [0,2,0,0,0,0|0,0,2]=4 761 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)F Z788000970 [0,2,0,0,0,0|0,0,2]=4 762 B13R1.522 CC1=CC=C(C=C1)C(C)(C)C(=O)O Z725146466 [0,2,0,0,0,0|1,0,1]=4 763 B13R1.522 O=C(O)C(F)(F)C1=CC=C(C=C1)Cl Z335859722 [0,2,0,0,0,0|1,0,1]=4 764 B13R1.522 O=C(O)C(F)(F)C1=CC=C(C=C1)F Z335859720 [0,2,0,0,0,0|1,0,1]=4 765 B13R1.706 CCC(C(=O)O)C1=CC=C(C=C1)Cl Z982129852 [0,2,0,0,0,0|1,0,1]=4 766 B13R1.706 CCC(C(=O)O)C1=CC=C(C=C1)F Z792377316 [0,2,0,0,0,0|1,0,1]=4 767 B13R1.706 CNC(C(=O)O)C1=CC=C(C=C1)F Z446011670 [0,2,0,0,0,0|1,0,1]=4 768 B13R1.706 COC(C(=O)O)C1=CC=C(C=C1)O Z1262556696 [0,2,0,0,0,0|0,0,2]=4 769 B13R1.706 NCC(C(=O)O)C1=CC=C(C=C1)Cl Z3244719959 [0,2,0,0,0,0|1,0,1]=4 770 B13R1.706 NCC(C(=O)O)C1=CC=C(C=C1)F Z3244719948 [0,2,0,0,0,0|1,0,1]=4 771 B13R1.706 O=C(O)C(CO)C1=CC=C(C=C1)Cl Z1508925263 [0,2,0,0,0,0|0,0,2]=4 772 B13R1.22 COC(=O)C(C)C1=CC(=CC=C1)Br Z1269138350 [0,2,0,0,0,0|1,0,1]=4 773 B13R1.22 COC(=O)C(C)C1=CC(=CC=C1)N Z2301438517 [0,2,0,0,0,0|1,0,1]=4 774 B13R1.22 COC(=O)C(N)C1=CC(=CC=C1)I Z3485465447 [0,2,0,0,0,0|1,0,1]=4 775 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)C Z965047474 [0,2,0,0,0,0|0,0,2]=4 776 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)Cl Z965047532 [0,2,0,0,0,0|0,0,2]=4 777 B13R1.22 COC(=O)C(O)C1=CC(=CC=C1)I Z2031668793 [0,2,0,0,0,0|0,0,2]=4 778 B13R1.22 CON(C)C(=O)C1=CC(=CC=C1)C Z54739006 [0,2,0,0,0,0|2,0,0]=4 779 B13R1.22 CON(C)C(=O)C1=CC(=CC=C1)F Z54739369 [0,2,0,0,0,0|2,0,0]=4 780 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 Z94598662 [0,2,0,0,0,0|0,0,0]=2 781 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 Z2755013956 [0,2,0,0,0,0|1,0,1]=4 782 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 Z1274177321 [0,2,0,0,0,0|1,0,1]=4 783 B13R1.47 COCC(=O)N(C)C1=CC=CC=C1 Z31506650 [0,2,0,0,0,0|2,0,0]=4 784 B13R1.532 CNC(C(=O)OC)C1=CC=CC=C1 Z1250089986 [0,2,0,0,0,0|1,0,1]=4 785 B13R1.532 COC(=O)C(CN)C1=CC=CC=C1 Z1262398527 [0,2,0,0,0,0|1,0,1]=4 786 B13R1.696 C/C(=C(/Cl)\C1=C(C=CC=C1)F)/C=O Z1625737160 [0,2,0,0,0,0|2,0,0]=4 787 B13R1.696 COC(=O)C(Br)C1=C(C=CC=C1)Cl Z203888402 [0,2,0,0,0,0|1,0,1]=4 788 B13R1.696 COC(=O)C(N)C1=C(C=CC=C1)Cl Z1297773506 [0,2,0,0,0,0|1,0,1]=4 789 B13R1.696 COC(=O)C(N)C1=C(C=CC=C1)F Z1416282604 [0,2,0,0,0,0|1,0,1]=4 790 B13R1.696 COC(=O)C(N)C1=C(C=CC=C1)I Z2941379076 [0,2,0,0,0,0|1,0,1]=4 791 B13R1.696 COC(=O)C(N)C1=C(C=CC=C1)O Z1222424539 [0,2,0,0,0,0|1,0,1]=4 792 B13R1.696 CON(C)C(=O)C1=C(C=CC=C1)C Z54740153 [0,2,0,0,0,0|2,0,0]=4 793 B13R1.696 CON(C)C(=O)C1=C(C=CC=C1)F Z54739602 [0,2,0,0,0,0|2,0,0]=4 794 B13R1.696 CON(C)C(=O)C1=C(C=CC=C1)O Z253321546 [0,2,0,0,0,0|2,0,0]=4 795 B13R1.708 CC(C)(C(=O)NO)C1=CC=CC=C1 Z59183852 [0,2,0,0,0,0|1,0,1]=4 796 B13R1.708 COC(=O)C(C)(N)C1=CC=CC=C1 Z1263529567 [0,2,0,0,0,0|1,0,1]=4 797 B13R1.708 COC(=O)C(C)(O)C1=CC=CC=C1 Z965047342 [0,2,0,0,0,0|0,0,2]=4 798 B13R1.89 COC1=C(C=CC=C1)C(=O)C(=O)O Z1255489035 [0,2,0,0,0,0|0,0,0]=2 799 B13R1.89 COC1=C(C=CC=C1)C(N)C(=O)O Z317024652 [0,2,0,0,0,0|1,0,1]=4 800 B13R1.720 CNC(C(=O)O)C1=C(C=CC=C1)C Z446011654 [0,2,0,0,0,0|1,0,1]=4 801 B13R1.720 CNC(C(=O)O)C1=C(C=CC=C1)Cl Z1160899454 [0,2,0,0,0,0|1,0,1]=4 802 B13R1.720 COC(C(=O)O)C1=C(C=CC=C1)Br Z1592680739 [0,2,0,0,0,0|0,0,2]=4 803 B13R1.897 NC(C(=O)O)C1=C(C=CC(=C1)F)F Z415636520 [0,2,0,0,0,0|1,0,1]=4 804 B13R1.897 O=C(O)C(=O)C1=C(C=CC(=C1)F)F Z381360846 [0,2,0,0,0,0|0,0,0]=2 805 B13R1.3768 CC1=C(C(=CC=C1)C(N)C(=O)O)C Z1744691758 [0,2,0,0,0,0|1,0,1]=4 806 B13R1.3768 NC(C(=O)O)C1=C(C(=CC=C1)Cl)Cl Z317024582 [0,2,0,0,0,0|1,0,1]=4 807 B13R1.3768 NC(C(=O)O)C1=C(C(=CC=C1)F)F Z1147192955 [0,2,0,0,0,0|1,0,1]=4 808 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1Cl)Cl Z992202056 [0,2,0,0,0,0|1,0,1]=4 809 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1F)F Z1188090603 [0,2,0,0,0,0|1,0,1]=4 810 B13R1.3789 NC(C(=O)O)C1=C(C=CC=C1Cl)Cl Z317024586 [0,2,0,0,0,0|1,0,1]=4 811 B13R1.3802 CC(C)(C(=O)O)C1=C(C=CC=C1)Br Z1020847950 [0,2,0,0,0,0|1,0,1]=4 812 B13R1.3802 CC(C)(C(=O)O)C1=C(C=CC=C1)Cl Z858031346 [0,2,0,0,0,0|1,0,1]=4 813 B13R1.3802 CC(C)(C(=O)O)C1=C(C=CC=C1)F Z825741292 [0,2,0,0,0,0|1,0,1]=4 814 B13R1.3802 CC(F)(C(=O)O)C1=C(C=CC=C1)F Z1509054567 [0,2,0,0,0,0|1,0,1]=4 815 B13R1.3802 CC(N)(C(=O)O)C1=C(C=CC=C1)Br Z1259339920 [0,2,0,0,0,0|1,0,1]=4 816 B13R1.3802 CC(N)(C(=O)O)C1=C(C=CC=C1)Cl Z317024842 [0,2,0,0,0,0|1,0,1]=4 817 B13R1.3802 CC(N)(C(=O)O)C1=C(C=CC=C1)F Z317024932 [0,2,0,0,0,0|1,0,1]=4 818 B13R1.3802 CC1=C(C=CC=C1)C(C)(C)C(=O)O Z725146330 [0,2,0,0,0,0|1,0,1]=4 819 B13R1.3802 CC1=C(C=CC=C1)C(F)(F)C(=O)O Z982129398 [0,2,0,0,0,0|1,0,1]=4 820 B13R1.3802 O=C(O)C(F)(F)C1=C(C=CC=C1)Br Z1284998422 [0,2,0,0,0,0|1,0,1]=4 821 B13R1.642 CC(C(=O)O)C1=CC(=CC=C1)C#N Z982130148 [0,2,0,0,0,0|1,0,1]=4 822 B13R1.642 COC1=CC(=CC=C1)C(C)C(=O)O Z784767752 [0,2,0,0,0,0|1,0,1]=4 823 B13R1.642 COC1=CC(=CC=C1)C(N)C(=O)O Z317024678 [0,2,0,0,0,0|1,0,1]=4 824 B13R1.716 CCC(C(=O)O)C1=CC(=CC=C1)Cl Z982130900 [0,2,0,0,0,0|1,0,1]=4 825 B13R1.716 CNC(C(=O)O)C1=CC(=CC=C1)Br Z1552027510 [0,2,0,0,0,0|1,0,1]=4 826 B13R1.716 CNC(C(=O)O)C1=CC(=CC=C1)F Z5105547779 [0,2,0,0,0,0|1,0,1]=4 827 B13R1.3423 CC(C(=O)O)C1=CC(=CC(=C1)F)F Z982129998 [0,2,0,0,0,0|1,0,1]=4 828 B13R1.3423 CC1=CC(=CC(=C1)C(N)C(=O)O)C Z838975722 [0,2,0,0,0,0|1,0,1]=4 829 B13R1.3423 NC(C(=O)O)C1=CC(=CC(=C1)O)O Z3014398879 [0,2,0,0,0,0|1,0,1]=4 830 B13R1.3423 O=C(O)C(=O)C1=CC(=CC(=C1)F)Cl Z1269140151 [0,2,0,0,0,0|0,0,0]=2 831 B13R1.3423 O=C(O)C(O)C1=CC(=CC(=C1)Cl)Cl Z788000918 [0,2,0,0,0,0|0,0,2]=4 832 B13R1.3423 O=C(O)C(O)C1=CC(=CC(=C1)F)F Z1203161883 [0,2,0,0,0,0|0,0,2]=4 833 B13R1.3493 CC(C)(C(=O)O)C1=CC(=CC=C1)Br Z725146472 [0,2,0,0,0,0|1,0,1]=4 834 B13R1.3493 CC(C)(C(=O)O)C1=CC(=CC=C1)Cl Z725146336 [0,2,0,0,0,0|1,0,1]=4 835 B13R1.3493 CC(C)(C(=O)O)C1=CC(=CC=C1)F Z725146400 [0,2,0,0,0,0|1,0,1]=4 836 B13R1.3493 CC(C)(C(=O)O)C1=CC(=CC=C1)O Z1258979084 [0,2,0,0,0,0|1,0,1]=4 837 B13R1.3493 CC(N)(C(=O)O)C1=CC(=CC=C1)Br Z317024850 [0,2,0,0,0,0|1,0,1]=4 838 B13R1.3493 CC(N)(C(=O)O)C1=CC(=CC=C1)F Z317024954 [0,2,0,0,0,0|1,0,1]=4 839 B13R1.3493 CC(O)(C(=O)O)C1=CC(=CC=C1)F Z788000530 [0,2,0,0,0,0|0,0,2]=4 840 B13R1.3493 CC1=CC(=CC=C1)C(F)(F)C(=O)O Z335859730 [0,2,0,0,0,0|1,0,1]=4 841 B13R1.3493 O=C(O)C(F)(F)C1=CC(=CC=C1)Br Z335859736 [0,2,0,0,0,0|1,0,1]=4 842 B13R1.3493 O=C(O)C(F)(F)C1=CC(=CC=C1)Cl Z335859734 [0,2,0,0,0,0|1,0,1]=4 843 B13R1.3085 CCC(N)(C(=O)O)C1=CC=CC=C1 Z317024888 [0,2,0,0,0,0|1,0,1]=4 844 B13R1.3085 CCC(O)(C(=O)O)C1=CC=CC=C1 Z788000464 [0,2,0,0,0,0|0,0,2]=4 845 B13R1.3085 COC(C)(C(=O)O)C1=CC=CC=C1 Z803492240 [0,2,0,0,0,0|0,0,2]=4 846 B13R1.405 CCCC(C(=O)O)C1=CC=CC=C1 Z56896771 [0,2,0,0,0,0|1,0,1]=4 847 B13R1.405 CCNC(C(=O)O)C1=CC=CC=C1 Z1849006528 [0,2,0,0,0,0|1,0,1]=4 848 B13R1.405 CCOC(C(=O)O)C1=CC=CC=C1 Z316258952 [0,2,0,0,0,0|0,0,2]=4 849 B13R1.405 CSCC(C(=O)O)C1=CC=CC=C1 Z1080732130 [0,2,0,0,0,0|0,1,1]=4 850 B13R1.1111 CC(=C(C(=O)O)C1=CC=CC=C1)C Z1262510971 [0,2,0,0,0,0|1,0,0]=3 851 B13R1.1111 CC(C)C(C(=O)O)C1=CC=CC=C1 Z982130186 [0,2,0,0,0,0|1,0,1]=4 852 B13R1.1111 CN(C)C(C(=O)O)C1=CC=CC=C1 Z1118274869 [0,2,0,0,0,0|1,0,1]=4 853 B13R1.1111 O=C(O)C(C(=O)O)C1=CC=CC=C1 Z277558324 [0,2,0,0,0,0|0,0,1]=3 854 B11R1.53 O=CC1=C(C=CC=C1)C(=O)O Z104478340 [0,0,1,1,0,0|2,0,0]=4 855 B11R1.53 O=CC1=C(N=CC=C1)C(=O)O Z1198311039 [0,0,1,1,0,0|2,0,0]=4 856 B11R1.35 C/C(=C\C1=CC=CO1)/C(=O)O Z2492774531 [0,0,1,1,0,0|2,0,0]=4 857 B11R1.35 C/C(=C\C1=CC=CS1)/C(=O)O Z1198150490 [0,0,1,1,0,0|2,0,0]=4 858 B11R1.35 O=C(O)C(=O)CC1=CC=CS1 Z271004562 [0,0,1,1,0,0|1,0,1]=4 859 B11R1.266 O=CC1=CC=CC(=C1)C(=O)O Z1065768480 [0,0,1,1,0,0|2,0,0]=4 860 B11R1.266 O=CC1=CC=CC(=N1)C(=O)O Z1198307200 [0,0,1,1,0,0|2,0,0]=4 861 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [1,0,0,1,0,0|2,0,0]=4 862 B11R2.1 CC1=COC2=C1C=CC=C2 Z1203161674 [1,0,0,1,0,0|1,0,0]=3 863 B11R2.1 CC1=NOC2=C1C=CC=C2 Z104341886 [1,0,0,1,0,0|2,0,0]=4 864 B11R2.1 ClC1=CNC2=C1C=CC=C2 Z1020823312 [1,0,0,1,0,0|2,0,0]=4 865 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [1,0,0,1,0,0|2,0,0]=4 866 B11R2.1 O=C1CCC2=C1C=CC=C2 Z104495974 [1,0,0,1,0,0|1,0,1]=4 867 B11R2.1 O=C1COC2=C1C=CC=C2 Z57101103 [1,0,0,1,0,0|0,0,1]=3 868 B11R2.1 O=C1COC2=C1C=CN=C2 Z1255373514 [1,0,0,1,0,0|1,0,1]=4 869 B11R2.1 O=C1CSC2=C1C=CC=C2 Z1117911699 [1,0,0,1,0,0|0,1,1]=4 870 B11R2.1 O=C1NCC2=C1C=CC=C2 Z362519344 [1,0,0,1,0,0|2,0,0]=4 871 B11R2.1 O=C1NNC2=C1C=CC=C2 Z586248764 [1,0,0,1,0,0|2,0,0]=4 872 B11R2.1 O=C1NOC2=C1C=CC=C2 Z1592042113 [1,0,0,1,0,0|1,0,0]=3 873 B11R2.1 O=C1NSC2=C1C=CC=C2 Z56983154 [1,0,0,1,0,0|1,1,0]=4 874 B11R2.1 O=C1OCC2=C1C=CC=C2 Z211309000 [1,0,0,1,0,0|2,0,0]=4 875 B11R2.1 O=C1SNC2=C1C=CC=C2 Z992282928 [1,0,0,1,0,0|2,0,0]=4 876 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [1,0,0,1,0,0|2,0,0]=4 877 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [1,0,0,1,0,0|1,0,0]=3 878 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [1,0,0,1,0,0|2,0,0]=4 879 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [1,0,0,1,0,0|2,0,0]=4 880 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [1,0,0,1,0,0|1,0,1]=4 881 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [1,0,0,1,0,0|1,0,1]=4 882 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [1,0,0,1,0,0|2,0,0]=4 883 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [1,0,0,1,0,0|1,0,0]=3 884 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [1,0,0,1,0,0|2,0,0]=4 885 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [1,0,0,1,0,0|1,1,0]=4 886 B11R2.10 OC1=CN2C=CC=CC2=N1 Z3305157547 [1,0,0,1,0,0|2,0,0]=4 887 B11R2.10 OC1=NN2C=CC=CC2=C1 Z1198235676 [1,0,0,1,0,0|2,0,0]=4 888 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [1,0,0,1,0,0|1,1,0]=4 889 B13R2.359 CC1(C(=O)NC2=C1C=CC=C2)O Z1198279633 [0,0,0,1,0,1|1,0,1]=4 890 B13R2.369 CC1=C(C=C2C=CC=CC2=N1)O Z1198159959 [0,0,0,1,0,1|2,0,0]=4 891 B13R2.369 CC1=C(N=C2C=CC=CC2=N1)O Z57254350 [0,0,0,1,0,1|2,0,0]=4 892 B13R2.369 CC1=CC2=C(C=CC=C2)NC1=O Z1198181962 [0,0,0,1,0,1|2,0,0]=4 893 B13R2.369 CC1OC2=C(C=CC=C2)NC1=O Z164680268 [0,0,0,1,0,1|1,0,1]=4 894 B13R2.369 CN1CC2=C(C=CC=C2)OC1=O Z1862014448 [0,0,0,1,0,1|2,0,0]=4 895 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1Br Z3038092306 [0,0,0,1,0,1|2,0,0]=4 896 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1F Z1216824451 [0,0,0,1,0,1|2,0,0]=4 897 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O Z199538190 [0,0,0,1,0,1|1,0,0]=3 898 B13R2.369 O=C1NC2=C(C=CC=C2)OC1O Z984801448 [0,0,0,1,0,1|0,0,2]=4 899 B13R2.373 C=C1CN(C1=O)C2=CC=CC=C2 Z1861994427 [0,0,0,1,0,1|2,0,0]=4 900 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 Z1198162290 [0,0,0,1,0,1|1,0,1]=4 901 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 Z2235584851 [0,0,0,1,0,1|1,0,1]=4 902 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 Z1235967724 [0,0,0,1,0,1|1,0,1]=4 903 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 Z1262510970 [0,0,0,1,0,1|1,0,1]=4 904 B13R2.435 CC(=O)C1=CC2=C(N1)C=CC=C2 Z1198159037 [0,0,0,1,0,1|2,0,0]=4 905 B13R2.435 CC(=O)C1=CC2=C(O1)C=CC=C2 Z57054215 [0,0,0,1,0,1|1,0,1]=4 906 B13R2.435 CC(=O)C1=CC2=C(S1)C=CC=C2 Z337709350 [0,0,0,1,0,1|1,1,0]=4 907 B13R2.435 CC(=O)C1=NC2=C(N1)C=CC=C2 Z90124730 [0,0,0,1,0,1|2,0,0]=4 908 B13R2.435 CC(=O)C1=NC2=C(S1)C=CC=C2 Z57218968 [0,0,0,1,0,1|1,1,0]=4 909 B13R2.435 NC(=O)C1=CC2=C(N1)C=CC=C2 Z101185700 [0,0,0,1,0,1|2,0,0]=4 910 B13R2.435 NC(=O)C1=NC2=C(N1)C=CC=C2 Z276687202 [0,0,0,1,0,1|2,0,0]=4 911 B13R2.435 NC(=O)C1=NC2=C(O1)C=CC=C2 Z1198221051 [0,0,0,1,0,1|1,0,1]=4 912 B13R2.435 O=C(O)C1=CC2=C(C1)C=CC=C2 Z1255423596 [0,0,0,1,0,1|1,0,0]=3 913 B13R2.435 O=C(O)C1=CC2=C(N1)C=CC=C2 Z56347139 [0,0,0,1,0,1|1,0,0]=3 914 B13R2.435 O=C(O)C1=CC2=C(N1)C=CC=N2 Z1198266663 [0,0,0,1,0,1|2,0,0]=4 915 B13R2.435 O=C(O)C1=CC2=C(N1)C=NC=C2 Z1198323516 [0,0,0,1,0,1|2,0,0]=4 916 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=C2 Z56839706 [0,0,0,1,0,1|0,0,1]=3 917 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=N2 Z2670715454 [0,0,0,1,0,1|1,0,1]=4 918 B13R2.435 O=C(O)C1=CC2=C(O1)C=CN=C2 Z1255443420 [0,0,0,1,0,1|1,0,1]=4 919 B13R2.435 O=C(O)C1=CC2=C(S1)C=CC=C2 Z89265777 [0,0,0,1,0,1|0,1,0]=3 920 B13R2.435 O=C(O)C1=CC2=C(S1)C=NC=C2 Z1255380800 [0,0,0,1,0,1|1,1,0]=4 921 B13R2.435 O=C(O)C1=NC2=C(N1)C=CC=C2 Z274592454 [0,0,0,1,0,1|1,0,0]=3 922 B13R2.435 O=C(O)C1=NC2=C(S1)C=CC=C2 Z56899149 [0,0,0,1,0,1|0,1,0]=3 923 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 Z1171753366 [0,0,0,1,0,1|2,0,0]=4 924 B13R2.435 O=C(O)C1CC2=C(C1)C=CC=C2 Z607808530 [0,0,0,1,0,1|1,0,1]=4 925 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 Z343211224 [0,0,0,1,0,1|1,0,1]=4 926 B13R2.435 O=C(O)C1CC2=C(O1)C=CC=C2 Z104377952 [0,0,0,1,0,1|0,0,2]=4 927 B13R2.435 O=C(O)C1CC2=C(S1)C=CC=C2 Z221583708 [0,0,0,1,0,1|0,1,1]=4 928 B13R2.435 O=C(O)[C@@H]1CC2=C(N1)C=CC=C2 Z335079490 [0,0,0,1,0,1|1,0,1]=4 929 B13R2.10 CC1=NC(=NO1)C2=CC=CC=C2 Z57791725 [0,0,0,1,0,1|2,0,0]=4 930 B13R2.10 NC1=CC(=NO1)C2=CC=CC=C2 Z164676856 [0,0,0,1,0,1|2,0,0]=4 931 B13R2.10 NC1=NC(=CO1)C2=CC=CC=C2 Z939904558 [0,0,0,1,0,1|2,0,0]=4 932 B13R2.10 NC1=NC(=NO1)C2=CC=CC=C2 Z57454949 [0,0,0,1,0,1|2,0,0]=4 933 B13R2.10 O=C1C=C(CC1)C2=CC=CC=C2 Z1255492482 [0,0,0,1,0,1|2,0,0]=4 934 B13R2.10 O=C1C=C(CO1)C2=CC=CC=C2 Z1862024981 [0,0,0,1,0,1|1,0,0]=3 935 B13R2.10 O=C1CC(=NN1)C2=CC=CC=C2 Z50145997 [0,0,0,1,0,1|2,0,0]=4 936 B13R2.10 O=C1CC(=NO1)C2=CC=CC=C2 Z1255364654 [0,0,0,1,0,1|1,0,0]=3 937 B13R2.10 O=C1CC(=NO1)C2=CN=CC=C2 Z1255458714 [0,0,0,1,0,1|2,0,0]=4 938 B13R2.10 O=C1CC(CO1)C2=CC=CC=C2 Z1551943626 [0,0,0,1,0,1|1,0,1]=4 939 B13R2.10 O=C1N=C(NN1)C2=CC=CC=C2 Z1737940654 [0,0,0,1,0,1|2,0,0]=4 940 B13R2.10 O=C1N=C(ON1)C2=CC=CC=C2 Z1898665972 [0,0,0,1,0,1|1,0,1]=4 941 B13R2.10 O=C1NC(=NO1)C2=CC=CC=C2 Z685594006 [0,0,0,1,0,1|1,0,0]=3 942 B13R2.10 O=C1NC(=NO1)C2=CC=NC=C2 Z685594018 [0,0,0,1,0,1|2,0,0]=4 943 B13R2.10 O=C1NC(=NO1)C2=CN=CC=C2 Z685594020 [0,0,0,1,0,1|2,0,0]=4 944 B13R2.10 O=C1NC(=NO1)C2=NC=CC=C2 Z685594044 [0,0,0,1,0,1|2,0,0]=4 945 B13R2.10 O=C1NC(CO1)C2=CC=CC=C2 Z57199626 [0,0,0,1,0,1|1,0,1]=4 946 B13R2.10 O=C1NN=C(S1)C2=CC=CC=C2 Z1486022130 [0,0,0,1,0,1|2,0,0]=4 947 B13R2.10 OC1=NN=C(O1)C2=CC=CC=C2 Z57663553 [0,0,0,1,0,1|2,0,0]=4 948 B13R2.10 OC1=NOC(=C1)C2=CC=CC=C2 Z1255465500 [0,0,0,1,0,1|1,0,1]=4 949 B13R2.10 SC1=NC(=CO1)C2=CC=CC=C2 Z1198224385 [0,0,0,1,0,1|1,1,0]=4 950 B13R2.328 CC1=CC(=O)C2=C(N1)C=CC=C2 Z445211720 [0,0,0,1,0,1|2,0,0]=4 951 B13R2.328 CC1=CC(=O)NC2=C1C=CC=C2 Z56893183 [0,0,0,1,0,1|2,0,0]=4 952 B13R2.328 CC1=CC(=S)OC2=C1C=CC=C2 Z56755530 [0,0,0,1,0,1|1,1,0]=4 953 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 Z56895688 [0,0,0,1,0,1|2,0,0]=4 954 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)O1 Z96091926 [0,0,0,1,0,1|2,0,0]=4 955 B13R2.328 NC1=CC(=O)NC2=C1C=CC=C2 Z1198165933 [0,0,0,1,0,1|2,0,0]=4 956 B13R2.328 NC1=CC2=C(C=CC=C2)C(=O)N1 Z278202458 [0,0,0,1,0,1|2,0,0]=4 957 B13R2.328 NC1=NC(=O)C2=C(S1)C=CC=C2 Z57161505 [0,0,0,1,0,1|1,1,0]=4 958 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)N1 Z840267872 [0,0,0,1,0,1|2,0,0]=4 959 B13R2.328 NC1=NC2=C(C=CC=C2)C(=O)O1 Z1198176566 [0,0,0,1,0,1|2,0,0]=4 960 B13R2.328 O=C1C=C(C2=C(N1)C=CC=C2)Cl Z3227104016 [0,0,0,1,0,1|2,0,0]=4 961 B13R2.328 O=C1C=C(C2=C(N1)C=CC=C2)O Z56781882 [0,0,0,1,0,1|1,0,1]=4 962 B13R2.328 O=C1C=C(C2=C(O1)C=CC=C2)Cl Z1198153642 [0,0,0,1,0,1|1,0,0]=3 963 B13R2.328 O=C1C=C(C2=C(O1)C=CC=C2)O Z56922074 [0,0,0,1,0,1|0,0,1]=3 964 B13R2.328 O=C1C=C(NC2=C1N=CC=C2)O Z2211231693 [0,0,0,1,0,1|2,0,0]=4 965 B13R2.328 O=C1CC(=O)N2C=CC=CC2=N1 Z56758546 [0,0,0,1,0,1|2,0,0]=4 966 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 Z133528266 [0,0,0,1,0,1|1,0,0]=3 967 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)O1 Z104508708 [0,0,0,1,0,1|1,0,0]=3 968 B13R2.328 O=C1NC(=CC2=C1C=CC=C2)Cl Z325999716 [0,0,0,1,0,1|2,0,0]=4 969 B13R2.328 O=C1NC(=NC2=C1C=CC=C2)S Z56998592 [0,0,0,1,0,1|1,1,0]=4 970 B13R2.328 O=C1NC(=O)C2=C(N1)C=CC=C2 Z57177786 [0,0,0,1,0,1|1,0,0]=3 971 B13R2.328 O=C1NC(=O)C2=C(N1)C=CC=N2 Z1201626990 [0,0,0,1,0,1|2,0,0]=4 972 B13R2.328 O=C1NC(=O)C2=C(N1)C=NC=C2 Z1198173337 [0,0,0,1,0,1|2,0,0]=4 973 B13R2.328 O=C1NC(=O)C2=C(O1)C=CC=C2 Z1255365144 [0,0,0,1,0,1|0,0,0]=2 974 B13R2.328 O=C1NC(=O)C2=C(S1)C=CC=C2 Z1649390235 [0,0,0,1,0,1|0,1,0]=3 975 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 Z104472968 [0,0,0,1,0,1|1,0,0]=3 976 B13R2.328 O=C1OC(=CC2=C1C=CC=C2)Cl Z1198723772 [0,0,0,1,0,1|2,0,0]=4 977 B13R2.328 OC1=NC2=C(C=CC=C2)C(=C1)Br Z1269205008 [0,0,0,1,0,1|2,0,0]=4 978 B13R2.12159 CS1(=NC(=O)C2=C1C=CC=C2)=O Z3072622612 [0,0,0,1,0,1|2,0,0]=4 979 B13R2.12159 N=S1(=O)NC(=O)C2=C1C=CC=C2 Z3717675699 [0,0,0,1,0,1|2,0,0]=4 980 B13R2.12159 O=C1NS(=O)(=O)C2=C1C=CC=C2 Z256708526 [0,0,0,1,0,1|1,0,1]=4 981 B13R2.5190 CC1=CC2=C(C=C1)C(=O)C(=O)N2 Z274364524 [0,1,0,1,0,0|1,0,0]=3 982 B13R2.5190 CC1OC2=C(C1=O)C=CC(=C2)F Z1362956333 [0,1,0,1,0,0|1,0,1]=4 983 B13R2.5190 CN1C(=O)OC2=C1C=CC(=C2)Br Z952016252 [0,1,0,1,0,0|2,0,0]=4 984 B13R2.5190 CN1C(=O)OC2=C1C=CC(=C2)N Z802845692 [0,1,0,1,0,0|2,0,0]=4 985 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)Br Z199464140 [0,1,0,1,0,0|1,0,0]=3 986 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)Cl Z440599648 [0,1,0,1,0,0|1,0,0]=3 987 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)F Z104511010 [0,1,0,1,0,0|1,0,0]=3 988 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)I Z1269200560 [0,1,0,1,0,0|1,0,0]=3 989 B13R2.5190 O=C1NC2=C(C1=O)C=CC(=C2)O Z432087574 [0,1,0,1,0,0|1,0,0]=3 990 B13R2.15 BrC1=C(N=CO1)C2=CC=CC=C2 Z2044827743 [0,1,0,1,0,0|2,0,0]=4 991 B13R2.15 CC1=NON=C1C2=CC=CC=C2 Z1238570891 [0,1,0,1,0,0|2,0,0]=4 992 B13R2.15 NC1=C(C=NO1)C2=CC=CC=C2 Z815305358 [0,1,0,1,0,0|2,0,0]=4 993 B13R2.15 NC1=CON=C1C2=CC=CC=C2 Z3305978063 [0,1,0,1,0,0|2,0,0]=4 994 B13R2.15 NC1=NON=C1C2=CC=CC=C2 Z275367794 [0,1,0,1,0,0|2,0,0]=4 995 B13R2.15 O=C1OCCC1C2=CC=CC=C2 Z1198158252 [0,1,0,1,0,0|1,0,1]=4 996 B13R2.15 O=C1OCCN1C2=CC=CC=C2 Z235352409 [0,1,0,1,0,0|2,0,0]=4 997 B13R2.15 OC1=CNN=C1C2=CC=CC=C2 Z4464308114 [0,1,0,1,0,0|2,0,0]=4 998 B13R2.15 OC1=NNC=C1C2=CC=CC=C2 Z1216819909 [0,1,0,1,0,0|2,0,0]=4 999 B13R2.32 CC1=COC2=C(C1=O)C=CC=C2 Z425469204 [0,1,0,1,0,0|1,0,0]=3 1000 B13R2.32 NC1COC2=C(C1=O)C=CC=C2 Z1526503390 [0,1,0,1,0,0|1,0,1]=4 1001 B13R2.32 O=C1C(=COC2=C1C=CC=C2)I Z1269128046 [0,1,0,1,0,0|1,0,0]=3 1002 B13R2.32 O=C1C(=NNC2=C1C=CC=C2)Br Z1695922867 [0,1,0,1,0,0|2,0,0]=4 1003 B13R2.32 O=C1C2=C(C=CC=C2)OCC1O Z1513597915 [0,1,0,1,0,0|0,0,2]=4 1004 B13R2.32 O=C1C=CC2=C(C1=O)C=CC=C2 Z324553598 [0,1,0,1,0,0|1,0,0]=3 1005 B13R2.32 OC1=C(C2=C(C=CC=C2)C=C1)Br Z56913130 [0,1,0,1,0,0|2,0,0]=4 1006 B13R2.45 CC1=C(OC2=C1C=CC=C2)C#N Z56931886 [0,1,0,1,0,0|2,0,0]=4 1007 B13R2.45 CC1=C(OC2=C1C=CC=C2)C=O Z1198156949 [0,1,0,1,0,0|1,0,0]=3 1008 B13R2.45 CC1=C(OC2=C1C=CC=C2)CO Z1202142721 [0,1,0,1,0,0|1,0,1]=4 1009 B13R2.45 CC1=C(SC2=C1C=CC=C2)C=O Z1255486176 [0,1,0,1,0,0|1,1,0]=4 1010 B13R2.45 CCC1=C(C2=C(O1)C=CC=C2)Br Z1269149730 [0,1,0,1,0,0|2,0,0]=4 1011 B13R2.45 N#CC1=C(C2=C(O1)C=CC=C2)N Z56983749 [0,1,0,1,0,0|2,0,0]=4 1012 B13R2.45 O=CC1=C(C2=C(N1)C=CC=C2)Br Z1269191622 [0,1,0,1,0,0|2,0,0]=4 1013 B13R2.45 O=CC1=C(C2=C(O1)C=CC=C2)Br Z1269215699 [0,1,0,1,0,0|1,0,0]=3 1014 B13R2.45 O=CC1=C(C2=C(O1)C=CC=C2)Cl Z335442446 [0,1,0,1,0,0|1,0,0]=3 1015 B13R2.45 O=CC1=C(C2=C(S1)C=CC=C2)Br Z1269136159 [0,1,0,1,0,0|1,1,0]=4 1016 B13R2.45 O=CC1=C(C2=C(S1)C=CC=C2)Cl Z90122764 [0,1,0,1,0,0|1,1,0]=4 1017 B13R2.45 OCC1=C(C2=C(S1)C=CC=C2)Cl Z166631690 [0,1,0,1,0,0|1,1,0]=4 1018 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 Z56869450 [0,1,0,1,0,0|1,0,0]=3 1019 B13R2.3085 CN1C(=O)C2=C(C1O)C=CC=C2 Z108567058 [0,1,0,1,0,0|2,0,0]=4 1020 B13R2.3085 NN1C(=O)C2=C(C1=O)C=CC=C2 Z56922077 [0,1,0,1,0,0|2,0,0]=4 1021 B13R2.72 CC(=O)C1=COC2=C1C=CC=C2 Z1066258200 [0,1,0,1,0,0|1,0,1]=4 1022 B13R2.72 CC(=O)C1=CSC2=C1C=CC=C2 Z370714364 [0,1,0,1,0,0|1,1,0]=4 1023 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 Z1198176576 [0,1,0,1,0,0|2,0,0]=4 1024 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 Z87615024 [0,1,0,1,0,0|2,0,0]=4 1025 B13R2.72 NC(=O)C1=NSC2=C1C=CC=C2 Z1255488848 [0,1,0,1,0,0|1,1,0]=4 1026 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 Z1201621664 [0,1,0,1,0,0|0,0,1]=3 1027 B13R2.72 O=C(O)C1=C2C=CC=CC2=NS1 Z1198233085 [0,1,0,1,0,0|0,1,0]=3 1028 B13R2.72 O=C(O)C1=C2C=CC=CN2C=N1 Z1255387817 [0,1,0,1,0,0|2,0,0]=4 1029 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 Z1143452918 [0,1,0,1,0,0|2,0,0]=4 1030 B13R2.72 O=C(O)C1=C2C=CC=CN2N=N1 Z1262526874 [0,1,0,1,0,0|2,0,0]=4 1031 B13R2.72 O=C(O)C1=CN=C2N1C=CC=C2 Z1201621330 [0,1,0,1,0,0|2,0,0]=4 1032 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 Z89283908 [0,1,0,1,0,0|1,0,0]=3 1033 B13R2.72 O=C(O)C1=CNC2=C1C=CC=N2 Z385370186 [0,1,0,1,0,0|2,0,0]=4 1034 B13R2.72 O=C(O)C1=CNC2=C1C=NC=C2 Z4185705011 [0,1,0,1,0,0|2,0,0]=4 1035 B13R2.72 O=C(O)C1=CNC2=C1N=CC=C2 Z1945708062 [0,1,0,1,0,0|2,0,0]=4 1036 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 Z897816312 [0,1,0,1,0,0|0,0,1]=3 1037 B13R2.72 O=C(O)C1=CSC2=C1C=CC=C2 Z199507040 [0,1,0,1,0,0|0,1,0]=3 1038 B13R2.72 O=C(O)C1=CSC2=C1C=CN=C2 Z4925961941 [0,1,0,1,0,0|1,1,0]=4 1039 B13R2.72 O=C(O)C1=CSC2=C1C=NC=C2 Z4010561587 [0,1,0,1,0,0|1,1,0]=4 1040 B13R2.72 O=C(O)C1=CSC2=C1N=CC=C2 Z1486016114 [0,1,0,1,0,0|1,1,0]=4 1041 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 Z104497388 [0,1,0,1,0,0|1,0,0]=3 1042 B13R2.72 O=C(O)C1=NNC2=C1C=CC=N2 Z1198305721 [0,1,0,1,0,0|2,0,0]=4 1043 B13R2.72 O=C(O)C1=NOC2=C1C=CC=N2 Z1813172822 [0,1,0,1,0,0|1,0,1]=4 1044 B13R2.72 O=C(O)C1=NSC2=C1C=CC=C2 Z1198157386 [0,1,0,1,0,0|0,1,0]=3 1045 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 Z792377300 [0,1,0,1,0,0|1,0,1]=4 1046 B13R2.72 O=C(O)C1COC2=C1C=CC=C2 Z897815480 [0,1,0,1,0,0|0,0,2]=4 1047 B13R2.72 O=C(O)C1CSC2=C1C=CC=C2 Z1222331919 [0,1,0,1,0,0|0,1,1]=4 1048 B13R2.4856 O=C1NC2=CC=CC(=C2C1=O)Br Z169511486 [0,1,0,1,0,0|1,0,0]=3 1049 B13R2.4856 O=C1NC2=CC=CC(=C2C1=O)Cl Z759291598 [0,1,0,1,0,0|1,0,0]=3 1050 B13R2.4856 O=C1NC2=CC=CC(=C2C1=O)I Z1269221394 [0,1,0,1,0,0|1,0,0]=3 1051 B13R2.3028 BrC1=CC2=C(C=C1)OC(=C2Br)Br Z4109523989 [0,1,0,1,0,0|2,0,0]=4 1052 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O Z56899023 [0,1,0,1,0,0|1,0,0]=3 1053 B13R2.3028 CN1C(=O)OC2=C1C=C(C=C2)I Z1343941255 [0,1,0,1,0,0|2,0,0]=4 1054 B13R2.3028 CN1C(=O)OC2=C1C=C(C=C2)N Z424795770 [0,1,0,1,0,0|2,0,0]=4 1055 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Br Z57833927 [0,1,0,1,0,0|1,0,0]=3 1056 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)Cl Z56899110 [0,1,0,1,0,0|1,0,0]=3 1057 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)F Z56837144 [0,1,0,1,0,0|1,0,0]=3 1058 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)I Z247609704 [0,1,0,1,0,0|1,0,0]=3 1059 B13R2.3028 O=C1NC2=C(C1=O)C=C(C=C2)O Z1198280387 [0,1,0,1,0,0|1,0,0]=3 1060 B13R2.4825 CC1=C2NC(=O)C(=O)C2=CC=C1 Z56891319 [0,1,0,1,0,0|1,0,0]=3 1061 B13R2.4825 CN1C(=O)OC2=C1C=CC=C2N Z1507502330 [0,1,0,1,0,0|2,0,0]=4 1062 B13R2.4825 O=C1NC2=C(C=CC=C2C1=O)Br Z56887738 [0,1,0,1,0,0|1,0,0]=3 1063 B13R2.4825 O=C1NC2=C(C=CC=C2C1=O)Cl Z57127979 [0,1,0,1,0,0|1,0,0]=3 1064 B13R2.4825 O=C1NC2=C(C=CC=C2C1=O)I Z247609672 [0,1,0,1,0,0|1,0,0]=3 1065 B13R2.4852 O=C(O)C1CC2=C(C=CC=C12)Cl Z1262515365 [0,1,0,1,0,0|1,0,1]=4 1066 B13R2.4930 CC1=CC2=C(C=C1)CC2C(=O)O Z2719072266 [0,1,0,1,0,0|1,0,1]=4 1067 B13R2.4930 O=C(O)C1CC2=C1C=C(C=C2)Cl Z1262559583 [0,1,0,1,0,0|1,0,1]=4 1068 B13R2.439 O=C(O)C1(CC1)C2=CC=CC=C2 Z104485900 [0,1,0,1,0,0|1,0,1]=4 1069 B13R2.135 CC1=C(C2=C(N1)C=CC=C2)C=O Z57197606 [0,1,0,1,0,0|2,0,0]=4 1070 B13R2.135 CC1=C(C2=C(O1)C=CC=C2)C#N Z56763674 [0,1,0,1,0,0|2,0,0]=4 1071 B13R2.135 CC1=C(C2=C(O1)C=CC=C2)C=O Z56767617 [0,1,0,1,0,0|1,0,0]=3 1072 B13R2.135 CC1=C(C2=C(O1)C=CC=C2)CO Z1198320599 [0,1,0,1,0,0|1,0,1]=4 1073 B13R2.135 CC1=C(C2=C(S1)C=CC=C2)C=O Z1162445919 [0,1,0,1,0,0|1,1,0]=4 1074 B13R2.135 N#CC1=C(NC2=C1C=CC=C2)O Z440730498 [0,1,0,1,0,0|2,0,0]=4 1075 B13R2.135 N/N=C\1/C(=O)NC2=C1C=CC=C2 Z56788834 [0,1,0,1,0,0|2,0,0]=4 1076 B13R2.135 O=CC1=C(NC2=C1C=CC=C2)Cl Z89264872 [0,1,0,1,0,0|2,0,0]=4 1077 B13R2.135 O=CC1=C(OC2=C1C=CC=C2)Cl Z336080876 [0,1,0,1,0,0|1,0,0]=3 1078 B13R2.135 O=CC1=C(SC2=C1C=CC=C2)Br Z1939450369 [0,1,0,1,0,0|1,1,0]=4 1079 B13R2.135 O=C\1NC2=C(/C1=N\O)C=CC=C2 Z49568307 [0,1,0,1,0,0|1,0,1]=4 1080 B9R1.11 O=C(NO)C1=CC=CS1 Z56912619 [1,0,0,0,1,0|2,0,0]=4 1081 B9R1.11 O=CC(=O)C1=CSC=C1 Z1511750329 [1,0,0,0,1,0|1,0,0]=3 1082 B9R1.13 O=C(O)CC1=CC=CO1 Z1179936226 [1,0,0,0,1,0|1,0,1]=4 1083 B9R1.13 O=C(O)CC1=CC=CS1 Z104473344 [1,0,0,0,1,0|1,0,1]=4 1084 B9R1.13 O=C(O)CC1=CNC=C1 Z1154253211 [1,0,0,0,1,0|1,0,1]=4 1085 B9R1.13 O=C(O)CC1=COC=C1 Z1179936188 [1,0,0,0,1,0|1,0,1]=4 1086 B9R1.13 O=C(O)CC1=CSC=C1 Z56922167 [1,0,0,0,1,0|1,0,1]=4 1087 B9R1.13 O=C(O)CN1C=CC=C1 Z245326698 [1,0,0,0,1,0|1,0,1]=4 1088 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 Z2582847786 [1,0,0,0,0,1|1,0,0]=3 1089 B11R1.91 CC(=O)/C=C/C1=NC=CC=C1 Z2004564056 [1,0,0,0,0,1|2,0,0]=4 1090 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [1,0,0,0,0,1|1,0,1]=4 1091 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [1,0,0,0,0,1|1,0,1]=4 1092 B11R1.91 CC(=O)NNC1=CC=CC=C1 Z27767717 [1,0,0,0,0,1|2,0,0]=4 1093 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [1,0,0,0,0,1|1,0,1]=4 1094 B11R1.91 NC(=O)/C=C/C1=CN=CC=C1 Z284112150 [1,0,0,0,0,1|2,0,0]=4 1095 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [1,0,0,0,0,1|1,0,1]=4 1096 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [1,0,0,0,0,1|1,0,1]=4 1097 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [1,0,0,0,0,1|1,0,1]=4 1098 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [1,0,0,0,0,1|1,0,1]=4 1099 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [1,0,0,0,0,1|1,0,1]=4 1100 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [1,0,0,0,0,1|1,0,1]=4 1101 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 Z104474406 [1,0,0,0,0,1|0,0,0]=2 1102 B11R1.91 O=C(O)/C=C/C1=CC=NC=C1 Z2315575398 [1,0,0,0,0,1|1,0,0]=3 1103 B11R1.91 O=C(O)/C=C/C1=CN=CC=C1 Z2315575379 [1,0,0,0,0,1|1,0,0]=3 1104 B11R1.91 O=C(O)/C=C/C1=NC=CC=C1 Z57069085 [1,0,0,0,0,1|1,0,0]=3 1105 B11R1.91 O=C(O)/C=C/C1=NC=CN=C1 Z445220894 [1,0,0,0,0,1|2,0,0]=4 1106 B11R1.91 O=C(O)/C=C/C1=NC=NC=C1 Z1184882069 [1,0,0,0,0,1|2,0,0]=4 1107 B11R1.91 O=C(O)C#CC1=CC=CC=C1 Z271128592 [1,0,0,0,0,1|0,0,1]=3 1108 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [1,0,0,0,0,1|0,0,1]=3 1109 B11R1.91 O=C(O)CCC1=CC=NC=C1 Z317037982 [1,0,0,0,0,1|1,0,1]=4 1110 B11R1.91 O=C(O)CCC1=CN=CC=C1 Z89264892 [1,0,0,0,0,1|1,0,1]=4 1111 B11R1.91 O=C(O)CCC1=NC=CC=C1 Z317037998 [1,0,0,0,0,1|1,0,1]=4 1112 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [1,0,0,0,0,1|0,0,1]=3 1113 B11R1.91 O=C(O)CNC1=CC=NC=C1 Z2350906909 [1,0,0,0,0,1|1,0,1]=4 1114 B11R1.91 O=C(O)CNC1=CN=CC=C1 Z3058782338 [1,0,0,0,0,1|1,0,1]=4 1115 B11R1.91 O=C(O)CNC1=NC=CC=C1 Z2470036492 [1,0,0,0,0,1|1,0,1]=4 1116 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [1,0,0,0,0,1|0,0,1]=3 1117 B11R1.91 O=C(O)COC1=CN=CC=C1 Z1171978878 [1,0,0,0,0,1|1,0,1]=4 1118 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [1,0,0,0,0,1|0,0,1]=3 1119 B11R1.91 O=C(O)CSC1=CC=NC=C1 Z104479390 [1,0,0,0,0,1|1,0,1]=4 1120 B11R1.91 O=C(O)CSC1=NC=CC=C1 Z31205663 [1,0,0,0,0,1|1,0,1]=4 1121 B11R1.91 OB(O)/C=C/C1=CC=CC=C1 Z2315575087 [1,0,0,0,0,1|1,0,1]=4 1122 B11R1.77 C/C(=C\C(=O)O)/C1=CC=CS1 Z352748066 [0,0,0,0,1,1|2,0,0]=4 1123 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 Z1198148922 [0,0,0,0,0,2|1,0,0]=3 1124 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 Z56968279 [0,0,0,0,0,2|1,0,0]=3 1125 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 Z1259040954 [0,0,0,0,0,2|2,0,0]=4 1126 B13R1.348 NC(=S)CC(=O)NC1=CC=CC=C1 Z89264865 [0,0,0,0,0,2|1,1,0]=4 1127 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 Z1318516262 [0,0,0,0,0,2|1,0,1]=4 1128 B13R1.348 O=C(CC1=CC=CC=C1)C[N+](=O)[O-] Z57032633 [0,0,0,0,0,2|1,0,1]=4 1129 B13R1.348 O=C(O)CC(O)CC1=CC=CC=C1 Z982132054 [0,0,0,0,0,2|0,0,2]=4 1130 B13R1.351 C=C(C)C(=O)NNC1=CC=CC=C1 Z56757944 [0,0,0,0,0,2|2,0,0]=4 1131 B13R1.351 C=C(COC1=CC=CC=C1)C(=O)O Z1197868054 [0,0,0,0,0,2|1,0,0]=3 1132 B13R1.351 CC(/C=C/C1=CC=CC=C1)C(=O)O Z3241898772 [0,0,0,0,0,2|1,0,1]=4 1133 B13R1.351 CC(COC1=CC=CC=C1)C(=O)O Z425469932 [0,0,0,0,0,2|1,0,1]=4 1134 B13R1.351 CC(CSC1=CC=CC=C1)C(=O)O Z431541708 [0,0,0,0,0,2|1,0,1]=4 1135 B13R1.351 CC(NCC1=CC=CC=C1)C(=O)O Z426041612 [0,0,0,0,0,2|1,0,1]=4 1136 B13R1.351 CC(O)C(=O)NCC1=CC=CC=C1 Z798740028 [0,0,0,0,0,2|1,0,1]=4 1137 B13R1.351 CC(OCC1=CC=CC=C1)C(=O)O Z316258798 [0,0,0,0,0,2|1,0,1]=4 1138 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O Z18753939 [0,0,0,0,0,2|1,0,1]=4 1139 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O Z1255498772 [0,0,0,0,0,2|1,0,1]=4 1140 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O Z317025074 [0,0,0,0,0,2|1,0,1]=4 1141 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O Z1255434715 [0,0,0,0,0,2|1,0,1]=4 1142 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O Z1255399095 [0,0,0,0,0,2|1,0,1]=4 1143 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 Z1201620725 [0,0,0,0,0,2|0,0,0]=2 1144 B13R1.351 O=C(O)C(O)CCC1=CC=CC=C1 Z1259340035 [0,0,0,0,0,2|0,0,2]=4 1145 B13R1.45 CC(=NNC(=O)C1=CC=CC=C1)C Z57101751 [0,0,0,0,0,2|2,0,0]=4 1146 B13R1.45 CC(CCC(=O)O)C1=CC=CC=C1 Z1198150373 [0,0,0,0,0,2|1,0,1]=4 1147 B13R1.45 CN(CCC(=O)O)C1=CC=CC=C1 Z1259273310 [0,0,0,0,0,2|2,0,0]=4 1148 B13R1.45 NC(=O)COC(=O)C1=CC=CC=C1 Z19825583 [0,0,0,0,0,2|1,0,0]=3 1149 B13R1.45 NC(=S)CNC(=O)C1=CC=CC=C1 Z211300040 [0,0,0,0,0,2|1,1,0]=4 1150 B13R1.45 NC(CCC(=O)O)C1=CC=CC=C1 Z2213893322 [0,0,0,0,0,2|1,0,1]=4 1151 B13R1.45 O=C(NC=C(Cl)Cl)C1=CC=CC=C1 Z57088260 [0,0,0,0,0,2|2,0,0]=4 1152 B13R1.45 O=C(O)/C=C/C(=O)C1=CC=CC=C1 Z2895088074 [0,0,0,0,0,2|0,0,0]=2 1153 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 Z57127328 [0,0,0,0,0,2|0,0,0]=2 1154 B13R1.45 O=C(O)CCC(=O)C1=CC=NC=C1 Z1255488500 [0,0,0,0,0,2|1,0,0]=3 1155 B13R1.45 O=C(O)CCC(=O)C1=CN=CC=C1 Z838955798 [0,0,0,0,0,2|1,0,0]=3 1156 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 Z56771024 [0,0,0,0,0,2|0,0,0]=2 1157 B13R1.45 O=C(O)CNC(=O)C1=CC=NC=C1 Z239129814 [0,0,0,0,0,2|1,0,0]=3 1158 B13R1.45 O=C(O)CNC(=O)C1=CN=CC=C1 Z239129822 [0,0,0,0,0,2|1,0,0]=3 1159 B13R1.45 O=C(O)CNC(=O)C1=NC=CC=C1 Z228588744 [0,0,0,0,0,2|1,0,0]=3