0 B13R1.165 CC(=O)C1=C(C=CC(=C1)Br)N(=O)=O MCULE-7933132664 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.165 CC(=O)C1=C(C=CC(=C1)C)N(=O)=O MCULE-6656115293 [0,0,0,0,0,0|2,0,2]=4 2 B13R1.165 CC(=O)C1=C(C=CC(=C1)Cl)N(=O)=O MCULE-5895339153 [0,0,0,0,0,0|2,0,2]=4 3 B13R1.165 CC(=O)C1=CC(=CC=C1N(=O)=O)F MCULE-9208428461 [0,0,0,0,0,0|2,0,2]=4 4 B13R1.165 CC(=O)C1=CC(=CC=C1N(=O)=O)N MCULE-5153553822 [0,0,0,0,0,0|2,0,2]=4 5 B13R1.165 CC(=O)C1=CC(=CC=C1N(=O)=O)O MCULE-9459328675 [0,0,0,0,0,0|1,1,2]=4 6 B13R1.165 CC(=O)C1=CC(=CC=C1S(=O)C)C MCULE-2837615289 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.165 CC(C)C1=C(C=C(C=C1)Cl)C(=O)O MCULE-7781528097 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.165 CC(C)C1=C(C=C(C=C1)F)C(=O)O MCULE-9298732765 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.165 CC1=CC(=C(C=C1)N(=O)=O)C(=O)N MCULE-5785440615 [0,0,0,0,0,0|2,0,2]=4 10 B13R1.165 CC1=CC(=C(C=N1)N(=O)=O)C(=O)O MCULE-8168143165 [0,0,0,0,0,0|2,0,2]=4 11 B13R1.165 CC1=CC(=C(N=C1)C(=O)O)C(=O)O MCULE-2462642756 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)B(O)O MCULE-2624096584 [0,0,0,0,0,0|2,0,2]=4 13 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)C(=O)O MCULE-6306537858 [0,0,0,0,0,0|2,0,1]=3 14 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)C(C)C MCULE-1322961778 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.165 CC1=CC=C(C(=C1)C(=O)O)N(=O)=O MCULE-4320923819 [0,0,0,0,0,0|1,0,2]=3 16 B13R1.165 CC1=CC=C(C(=N1)C(=O)O)C(=O)O MCULE-6013186120 [0,0,0,0,0,0|3,0,1]=4 17 B13R1.165 CC1=NC(=C(C=C1)N(=O)=O)C(=O)O MCULE-7491611479 [0,0,0,0,0,0|2,0,2]=4 18 B13R1.165 CN(C)C1=C(C=C(C=C1)Cl)C(=O)O MCULE-4904511239 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.165 CN(C)C1=C(C=C(C=C1)F)C(=O)O MCULE-6466914403 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.165 CN(C)C1=CC=C(C=C1C(=O)O)Br MCULE-5540134857 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.165 CN(C)C1=CC=C(C=C1C(=O)O)N MCULE-1221566905 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-6593215014 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-6651447325 [0,0,0,0,0,0|3,0,1]=4 24 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-3248870801 [0,0,0,0,0,0|3,0,1]=4 25 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-3749017305 [0,0,0,0,0,0|3,0,1]=4 26 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-1895540418 [0,0,0,0,0,0|2,1,1]=4 27 B13R1.165 C[C@@H](N)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-9969526556 [0,0,0,0,0,0|2,1,1]=4 28 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-3660508324 [0,0,0,0,0,0|3,0,1]=4 29 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-6401824355 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-2152199417 [0,0,0,0,0,0|3,0,1]=4 31 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-8433331160 [0,0,0,0,0,0|3,0,1]=4 32 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-2846164299 [0,0,0,0,0,0|2,1,1]=4 33 B13R1.165 C[C@H](N)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-9208243133 [0,0,0,0,0,0|2,1,1]=4 34 B13R1.165 NC(=O)C1=C(C=C(C=C1)Br)C(=O)N MCULE-6842624312 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.165 NC(=O)C1=C(C=C(C=C1)Cl)C(=O)N MCULE-2277696054 [0,0,0,0,0,0|4,0,0]=4 36 B13R1.165 NC(=O)C1=C(C=CC(=C1)Cl)N(=O)=O MCULE-5625007823 [0,0,0,0,0,0|2,0,2]=4 37 B13R1.165 NC(=O)C1=C(C=CC(=C1)F)N(=O)=O MCULE-4452374161 [0,0,0,0,0,0|2,0,2]=4 38 B13R1.165 NC(=O)C1=C(C=CC(=C1)N)N(=O)=O MCULE-8966493416 [0,0,0,0,0,0|2,0,2]=4 39 B13R1.165 NC(=O)C1=CC(=CC=C1N(=O)=O)Br MCULE-8048545789 [0,0,0,0,0,0|2,0,2]=4 40 B13R1.165 NC(=O)C1=CC=C(C=C1C(=O)O)F MCULE-3292757970 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.165 NC1=CC(=C(C=C1)C(=O)O)C(=O)O MCULE-2601095976 [0,0,0,0,0,0|2,0,1]=3 42 B13R1.165 NC1=CC(=C(C=C1)N(=O)=O)C(=O)O MCULE-8637395916 [0,0,0,0,0,0|1,0,2]=3 43 B13R1.165 NC1=CC(=C(C=N1)N(=O)=O)C(=O)O MCULE-1281236221 [0,0,0,0,0,0|2,0,2]=4 44 B13R1.165 NC1=CN=C(C(=C1)C(=O)O)C(=O)O MCULE-1799747072 [0,0,0,0,0,0|3,0,1]=4 45 B13R1.165 O=C(Cl)C1=C(C=CC(=C1)F)N(=O)=O MCULE-7724069287 [0,0,0,0,0,0|2,0,2]=4 46 B13R1.165 O=C(Cl)C1=CC(=CC=C1N(=O)=O)Cl MCULE-5293316149 [0,0,0,0,0,0|2,0,2]=4 47 B13R1.165 O=C(Cl)C1=CC(=CC=C1N(=O)=O)O MCULE-5074455938 [0,0,0,0,0,0|1,1,2]=4 48 B13R1.165 O=C(O)C1=C(C=C(C=C1)F)C(=O)O MCULE-7412243131 [0,0,0,0,0,0|2,0,1]=3 49 B13R1.165 O=C(O)C1=C(C=C(N=C1)Cl)C(=O)O MCULE-7218761342 [0,0,0,0,0,0|3,0,1]=4 50 B13R1.165 O=C(O)C1=C(C=CC(=C1)Br)C(F)F MCULE-8698937241 [0,0,0,0,0,0|4,0,0]=4 51 B13R1.165 O=C(O)C1=C(C=CC(=C1)Cl)B(O)O MCULE-1426656606 [0,0,0,0,0,0|2,0,2]=4 52 B13R1.165 O=C(O)C1=C(C=CC(=C1)Cl)N(=O)=O MCULE-7767195023 [0,0,0,0,0,0|1,0,2]=3 53 B13R1.165 O=C(O)C1=C(C=CC(=C1)F)C(F)F MCULE-1587019133 [0,0,0,0,0,0|4,0,0]=4 54 B13R1.165 O=C(O)C1=C(C=CC(=C1)F)N(=O)=O MCULE-5787126169 [0,0,0,0,0,0|1,0,2]=3 55 B13R1.165 O=C(O)C1=C(C=CC(=C1)I)N(=O)=O MCULE-5162803243 [0,0,0,0,0,0|1,0,2]=3 56 B13R1.165 O=C(O)C1=C(C=CC(=C1)S)N(=O)=O MCULE-1522173034 [0,0,0,0,0,0|0,0,2]=2 57 B13R1.165 O=C(O)C1=C(C=NC(=C1)Br)N(=O)=O MCULE-5899760451 [0,0,0,0,0,0|2,0,2]=4 58 B13R1.165 O=C(O)C1=CC(=CC=C1B(O)O)F MCULE-9854707295 [0,0,0,0,0,0|2,0,2]=4 59 B13R1.165 O=C(O)C1=CC(=CC=C1N(=O)=O)Br MCULE-3596729548 [0,0,0,0,0,0|1,0,2]=3 60 B13R1.165 O=C(O)C1=CC(=CC=C1N(=O)=O)O MCULE-4152972626 [0,0,0,0,0,0|0,1,2]=3 61 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)Br MCULE-9616265983 [0,0,0,0,0,0|3,0,1]=4 62 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)Cl MCULE-8518393821 [0,0,0,0,0,0|3,0,1]=4 63 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)F MCULE-1579389970 [0,0,0,0,0,0|3,0,1]=4 64 B13R1.165 O=C(O)C1=CC(=CN=C1C(=O)O)F MCULE-6502636799 [0,0,0,0,0,0|3,0,1]=4 65 B13R1.165 O=C(O)C1=CC(=NC=C1N(=O)=O)Cl MCULE-4076912616 [0,0,0,0,0,0|2,0,2]=4 66 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)Br MCULE-2688694133 [0,0,0,0,0,0|2,0,1]=3 67 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)Cl MCULE-5893378263 [0,0,0,0,0,0|2,0,1]=3 68 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)I MCULE-8511341128 [0,0,0,0,0,0|2,0,1]=3 69 B13R1.165 O=C(O)C1=CC=C(C=C1C(=O)O)O MCULE-6366909615 [0,0,0,0,0,0|1,1,1]=3 70 B13R1.165 O=C(O)C1=CC=C(N=C1C(=O)O)Cl MCULE-3110253642 [0,0,0,0,0,0|3,0,1]=4 71 B13R1.165 O=C(O)C1=C[N+](=CC=C1N(=O)=O)[O-] MCULE-2758368380 [0,0,0,0,0,0|1,1,2]=4 72 B13R1.165 O=C(O)C1=NC(=CC=C1N(=O)=O)Cl MCULE-9123379029 [0,0,0,0,0,0|2,0,2]=4 73 B13R1.165 O=C([O-])C1=C(C=C(C=N1)Br)C(=O)O MCULE-3775547550 [0,0,0,0,0,0|3,0,0]=3 74 B13R1.165 O=C([O-])C1=CC(=CC=C1C(=O)O)Cl MCULE-3930710419 [0,0,0,0,0,0|2,0,2]=4 75 B12R1.46 CC1=CC(=C(C=C1)C=O)C(=O)O MCULE-4742028324 [1,0,0,0,0,0|2,0,0]=3 76 B12R1.46 CC1=CC=C(C(=C1)C(=O)O)[IH2]=O MCULE-8633357510 [1,0,0,0,0,0|2,0,0]=3 77 B12R1.46 CCC1=C(C=C(C=C1)Br)C(=O)O MCULE-5810393840 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.46 CCC1=C(C=C(C=C1)F)C(=O)O MCULE-5768134144 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.46 CCC1=C(C=C(C=C1)I)C(=O)O MCULE-6419765423 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.46 CCC1=CC=C(C=C1C(=O)O)Cl MCULE-9576429172 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.46 CNC1=C(C=C(C=C1)Cl)C(=O)O MCULE-8825611158 [1,0,0,0,0,0|2,0,1]=4 82 B12R1.46 CNC1=C(C=C(C=C1)F)C(=O)O MCULE-6557290315 [1,0,0,0,0,0|2,0,1]=4 83 B12R1.46 CNC1=CC=C(C=C1C(=O)O)Br MCULE-1691569775 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.46 CNC1=CC=C(C=C1C(=O)O)C MCULE-4848176817 [1,0,0,0,0,0|2,0,1]=4 85 B12R1.46 CNC1=CC=C(C=C1C(=O)O)I MCULE-8141389960 [1,0,0,0,0,0|2,0,1]=4 86 B12R1.46 CNC1=CC=C(C=C1C(=O)O)N MCULE-6135898575 [1,0,0,0,0,0|2,0,1]=4 87 B12R1.46 COC1=C(C=C(C=C1)Br)C(=O)O MCULE-8260284189 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.46 COC1=C(C=C(C=C1)C)C(=O)O MCULE-2816314019 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.46 COC1=C(C=C(C=C1)Cl)C(=O)O MCULE-4487698118 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.46 COC1=C(C=C(C=C1)F)C(=O)O MCULE-9218621038 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.46 COC1=C(C=C(C=C1)I)C(=O)O MCULE-7864465132 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)O MCULE-3339201501 [1,0,0,0,0,0|2,1,0]=4 93 B12R1.46 COC1=CC=C(C=C1C(=O)O)N MCULE-1066466660 [1,0,0,0,0,0|3,0,0]=4 94 B12R1.46 COC1=CC=C(C=C1C(=O)O)N MCULE-8685395323 [1,0,0,0,0,0|3,0,0]=4 95 B12R1.46 CSC1=C(C=C(C=C1)F)C(=O)O MCULE-5074727087 [1,0,0,0,0,0|3,0,0]=4 96 B12R1.46 CSC1=C(C=C(C=C1)N)C(=O)O MCULE-1009101406 [1,0,0,0,0,0|3,0,0]=4 97 B12R1.46 CSC1=CC=C(C=C1C(=O)O)Br MCULE-8848974309 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.46 CSC1=CC=C(C=C1C(=O)O)Cl MCULE-8397505747 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.46 N#CC1=C(C=C(C=C1)N)C(=O)O MCULE-1301644942 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.46 N#CC1=CC=C(C=C1C(=O)O)Br MCULE-6895333947 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.46 N#CC1=CC=C(C=C1C(=O)O)F MCULE-1336207268 [1,0,0,0,0,0|3,0,0]=4 102 B12R1.46 N#CC1=CC=C(C=C1C(=O)O)I MCULE-8518984162 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.46 NNC1=C(C=C(C=C1)Br)C(=O)O MCULE-6723071223 [1,0,0,0,0,0|2,0,1]=4 104 B12R1.46 NNC1=CC=C(C=C1C(=O)O)Br MCULE-4053784708 [1,0,0,0,0,0|2,0,1]=4 105 B12R1.46 NNC1=CC=C(C=C1C(=O)O)F MCULE-5366806352 [1,0,0,0,0,0|2,0,1]=4 106 B12R1.46 NNC1=CC=C(C=C1C(=O)O)F MCULE-9191188764 [1,0,0,0,0,0|2,0,1]=4 107 B12R1.46 O=CC1=C(C=C(C=C1)Br)C(=O)O MCULE-3347116643 [1,0,0,0,0,0|2,0,0]=3 108 B12R1.46 O=CC1=C(C=C(C=C1)Cl)C(=O)O MCULE-4708405428 [1,0,0,0,0,0|2,0,0]=3 109 B12R1.46 O=CC1=C(C=C(C=C1)F)C(=O)O MCULE-2641944721 [1,0,0,0,0,0|2,0,0]=3 110 B12R1.46 O=CC1=CC=C(C=C1C(=O)O)I MCULE-3106354171 [1,0,0,0,0,0|2,0,0]=3 111 B12R1.57 CC1=CC(=C(C=C1)C(=O)O)C=O MCULE-4105101262 [1,0,0,0,0,0|2,0,1]=4 112 B12R1.57 CC1=CC=C(C(=C1)C=O)N(=O)=O MCULE-6001311629 [1,0,0,0,0,0|1,0,2]=4 113 B12R1.57 O=CC1=C(C=CC(=C1)Br)C(=O)O MCULE-5884992981 [1,0,0,0,0,0|2,0,1]=4 114 B12R1.57 O=CC1=C(C=CC(=C1)Br)N(=O)=O MCULE-4340495107 [1,0,0,0,0,0|1,0,2]=4 115 B12R1.57 O=CC1=C(C=CC(=C1)Cl)N(=O)=O MCULE-7805018273 [1,0,0,0,0,0|1,0,2]=4 116 B12R1.57 O=CC1=C(C=CC(=C1)F)C(=O)O MCULE-9943376771 [1,0,0,0,0,0|2,0,1]=4 117 B12R1.57 O=CC1=C(C=CC(=C1)I)N(=O)=O MCULE-4257817526 [1,0,0,0,0,0|1,0,2]=4 118 B12R1.57 O=CC1=CC(=CC=C1C(=O)O)Cl MCULE-9457881409 [1,0,0,0,0,0|2,0,1]=4 119 B12R1.57 O=CC1=CC(=CC=C1N(=O)=O)F MCULE-4438470345 [1,0,0,0,0,0|1,0,2]=4 120 B12R1.57 O=CC1=CC(=CC=C1N(=O)=O)O MCULE-2966837418 [1,0,0,0,0,0|0,1,2]=4 121 B12R1.261 CC(=O)C1=C(C=CC=C1)C(=O)C MCULE-8127457015 [1,0,0,0,0,0|3,0,0]=4 122 B12R1.261 CC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-5017248906 [1,0,0,0,0,0|1,0,2]=4 123 B12R1.261 CC(=O)C1=C(C=CC=N1)C(=O)O MCULE-6515097923 [1,0,0,0,0,0|3,0,0]=4 124 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)Cl MCULE-1765251115 [1,0,0,0,0,0|3,0,0]=4 125 B12R1.261 CC(=O)C1=CC=CC=C1C(=O)O MCULE-7363003448 [1,0,0,0,0,0|2,0,0]=3 126 B12R1.261 CC(=O)C1=CC=CN=C1C(=O)O MCULE-8161361642 [1,0,0,0,0,0|3,0,0]=4 127 B12R1.261 CC(C)C1=C(C=CC=C1)C(=O)O MCULE-6483894536 [1,0,0,0,0,0|3,0,0]=4 128 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-8650746123 [1,0,0,0,0,0|3,0,0]=4 129 B12R1.261 CC(N)C1=CC=CC=C1C(=O)O MCULE-9609008723 [1,0,0,0,0,0|3,0,0]=4 130 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)O MCULE-1846110939 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.261 CC(O)C1=C(C=CC=C1)C(=O)[O-] MCULE-3438709652 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-4355771481 [1,0,0,0,0,0|2,0,1]=4 133 B12R1.261 CN(C)C1=C(C=CC=C1)C(=O)O MCULE-5122962105 [1,0,0,0,0,0|2,0,1]=4 134 B12R1.261 CS(=O)C1=C(C=CC=C1)C(=O)O MCULE-3173889444 [1,0,0,0,0,0|2,0,0]=3 135 B12R1.261 C[C@@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-7674618423 [1,0,0,0,0,0|2,0,1]=4 136 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-6849862508 [1,0,0,0,0,0|3,0,0]=4 137 B12R1.261 C[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-9842865976 [1,0,0,0,0,0|3,0,0]=4 138 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3833287505 [1,0,0,0,0,0|2,0,1]=4 139 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-4322968779 [1,0,0,0,0,0|2,0,1]=4 140 B12R1.261 C[C@@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-7586456481 [1,0,0,0,0,0|2,0,1]=4 141 B12R1.261 C[C@@H](O)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-9278710855 [1,0,0,0,0,0|1,0,1]=3 142 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-3100033909 [1,0,0,0,0,0|2,0,1]=4 143 B12R1.261 C[C@H](N)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-8662462718 [1,0,0,0,0,0|2,0,1]=4 144 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-1164292262 [1,0,0,0,0,0|3,0,0]=4 145 B12R1.261 C[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7958697940 [1,0,0,0,0,0|3,0,0]=4 146 B12R1.261 C[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3260225616 [1,0,0,0,0,0|2,0,1]=4 147 B12R1.261 C[C@H](N)C1=CC=CC=C1[N+](=O)[O-] MCULE-3646504595 [1,0,0,0,0,0|2,0,1]=4 148 B12R1.261 C[C@H](O)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-4050015215 [1,0,0,0,0,0|1,0,1]=3 149 B12R1.261 N=C(N)C1=C(C=CC=C1)C(=O)O MCULE-9719518377 [1,0,0,0,0,0|3,0,0]=4 150 B12R1.261 N=C(N)C1=CC=CC=C1C(=O)O MCULE-9966971962 [1,0,0,0,0,0|3,0,0]=4 151 B12R1.261 NC(=O)C1=C(C=CC=C1)C(=O)N MCULE-9121420422 [1,0,0,0,0,0|3,0,0]=4 152 B12R1.261 NC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-3155069269 [1,0,0,0,0,0|1,0,2]=4 153 B12R1.261 NC(=O)C1=C(C=CC=N1)C(=O)O MCULE-1406870021 [1,0,0,0,0,0|3,0,0]=4 154 B12R1.261 NC(=O)C1=C(N=CC=C1)C(=O)O MCULE-3923055422 [1,0,0,0,0,0|3,0,0]=4 155 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O MCULE-4970133228 [1,0,0,0,0,0|2,0,0]=3 156 B12R1.261 NC(=O)C1=CC=NC=C1C(=O)O MCULE-7389852342 [1,0,0,0,0,0|3,0,0]=4 157 B12R1.261 O=C(Cl)C1=C(C=CC=C1)N(=O)=O MCULE-1428213268 [1,0,0,0,0,0|1,0,2]=4 158 B12R1.261 O=C(Cl)C1=CC=CC=C1C(=O)Cl MCULE-7523310459 [1,0,0,0,0,0|3,0,0]=4 159 B12R1.261 O=C(O)C1=C(C=CC=C1)S(=O)O MCULE-4903524306 [1,0,0,0,0,0|1,0,1]=3 160 B12R1.261 O=C(O)C1=C(C=CN=C1)N(=O)=O MCULE-7751395680 [1,0,0,0,0,0|1,0,2]=4 161 B12R1.261 O=C(O)C1=C(C=NC=C1)C(=O)O MCULE-9167973257 [1,0,0,0,0,0|2,0,1]=4 162 B12R1.261 O=C(O)C1=C(N=CC=C1)N(=O)=O MCULE-8440821375 [1,0,0,0,0,0|1,0,2]=4 163 B12R1.261 O=C(O)C1=CC=CC=C1B(O)O MCULE-2654185147 [1,0,0,0,0,0|1,0,2]=4 164 B12R1.261 O=C(O)C1=CC=CC=C1C(=O)O MCULE-4747891013 [1,0,0,0,0,0|1,0,1]=3 165 B12R1.261 O=C(O)C1=CC=CC=C1C(F)F MCULE-2495932834 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.261 O=C(O)C1=CC=CC=C1I(=O)=O MCULE-6964235236 [1,0,0,0,0,0|1,0,1]=3 167 B12R1.261 O=C(O)C1=CC=CC=C1N(=O)=O MCULE-3357987129 [1,0,0,0,0,0|0,0,2]=3 168 B12R1.261 O=C(O)C1=CC=CN=C1C(=O)O MCULE-7041185901 [1,0,0,0,0,0|2,0,1]=4 169 B12R1.261 O=C(O)C1=CC=NC=C1N(=O)=O MCULE-6986359806 [1,0,0,0,0,0|1,0,2]=4 170 B12R1.261 O=C(O)C1=NC=CC=C1N(=O)=O MCULE-8730357238 [1,0,0,0,0,0|1,0,2]=4 171 B12R1.261 O=C([O-])C1=C(C=CC=C1)C(=O)O MCULE-1944452251 [1,0,0,0,0,0|1,0,0]=2 172 B12R1.261 O=C([O-])C1=CC=CC=C1B(O)O MCULE-2281945209 [1,0,0,0,0,0|2,0,1]=4 173 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O MCULE-6292903963 [1,0,0,0,0,0|1,0,0]=2 174 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)O MCULE-7154530233 [1,0,0,0,0,0|1,0,0]=2 175 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)[O-] MCULE-4658064312 [1,0,0,0,0,0|1,0,1]=3 176 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)[O-] MCULE-5372933453 [1,0,0,0,0,0|1,0,1]=3 177 B12R1.261 O=C([O-])C1=CC=CC=C1N(=O)=O MCULE-7211229453 [1,0,0,0,0,0|0,0,3]=4 178 B12R1.261 O=N(=O)C1=CC=CC=C1S(=O)[O-] MCULE-7544733406 [1,0,0,0,0,0|2,0,1]=4 179 B12R1.261 O=N(=O)C1=CC=CC=C1S(=O)[O-] MCULE-9391367613 [1,0,0,0,0,0|2,0,1]=4 180 B14R1.104 C#CC1=CC=C(C(=C1)C(=O)O)C(=O)O MCULE-6034336644 [0,1,0,0,0,0|2,0,1]=4 181 B14R1.104 COC1=CC(=C(C=C1)C(=O)O)C(=O)O MCULE-1044438929 [0,1,0,0,0,0|1,1,1]=4 182 B14R1.104 COC1=CC(=C(C=C1)N(=O)=O)C(=O)O MCULE-8399808603 [0,1,0,0,0,0|0,1,2]=4 183 B14R1.104 CSC1=CC(=C(C=C1)N(=O)=O)C(=O)O MCULE-5616159038 [0,1,0,0,0,0|0,0,2]=3 184 B14R1.104 O=C(O)C1=C(C=CC(=C1)CBr)N(=O)=O MCULE-1798373836 [0,1,0,0,0,0|1,0,2]=4 185 B14R1.707 COC(=O)C1=C(C=CC(=C1)Cl)C(=O)C MCULE-1811202290 [0,1,0,0,0,0|3,0,0]=4 186 B14R1.707 COC(=O)C1=C(C=CC(=C1)Cl)N(=O)=O MCULE-9707277387 [0,1,0,0,0,0|1,0,2]=4 187 B14R1.707 COC(=O)C1=C(C=CC(=C1)F)C(=O)O MCULE-9514888465 [0,1,0,0,0,0|2,0,1]=4 188 B14R1.707 COC(=O)C1=C(C=CC(=C1)F)N(=O)=O MCULE-9290646411 [0,1,0,0,0,0|1,0,2]=4 189 B14R1.707 COC(=O)C1=C(C=CC(=C1)O)N(=O)=O MCULE-3364628038 [0,1,0,0,0,0|0,1,2]=4 190 B14R1.707 COC(=O)C1=CC(=CC=C1C(=O)N)F MCULE-7892236166 [0,1,0,0,0,0|3,0,0]=4 191 B14R1.707 COC(=O)C1=CC(=CC=C1C(=O)O)N MCULE-7013917945 [0,1,0,0,0,0|2,0,1]=4 192 B14R1.707 COC(=O)C1=CC(=CC=C1N(=O)=O)Br MCULE-6220124546 [0,1,0,0,0,0|1,0,2]=4 193 B14R1.707 COC(=O)C1=CC(=CC=C1N(=O)=O)C MCULE-9539064287 [0,1,0,0,0,0|1,0,2]=4 194 B14R1.707 COC(=O)C1=CC(=CC=C1N(=O)=O)I MCULE-7077996229 [0,1,0,0,0,0|1,0,2]=4 195 B14R1.707 COC(=O)C1=CC(=CC=C1N(=O)=O)N MCULE-3726405826 [0,1,0,0,0,0|1,0,2]=4 196 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-1374961558 [0,1,0,0,0,0|2,0,1]=4 197 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-5068408300 [0,1,0,0,0,0|2,0,1]=4 198 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-6831376299 [0,1,0,0,0,0|2,0,1]=4 199 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-7646446844 [0,1,0,0,0,0|2,0,1]=4 200 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-2338375080 [0,1,0,0,0,0|1,1,1]=4 201 B14R1.707 N[C@@H](CO)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-2796945001 [0,1,0,0,0,0|1,1,1]=4 202 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-2532166215 [0,1,0,0,0,0|2,0,1]=4 203 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)Cl)[N+](=O)[O-] MCULE-3154174042 [0,1,0,0,0,0|2,0,1]=4 204 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-3814832000 [0,1,0,0,0,0|2,0,1]=4 205 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)F)[N+](=O)[O-] MCULE-6988146133 [0,1,0,0,0,0|2,0,1]=4 206 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-6438854179 [0,1,0,0,0,0|1,1,1]=4 207 B14R1.707 N[C@H](CO)C1=C(C=CC(=C1)O)[N+](=O)[O-] MCULE-7211955432 [0,1,0,0,0,0|1,1,1]=4 208 B14R1.1126 COC(=O)C1=C(C=C(C=C1)F)C(=O)O MCULE-4695400256 [0,1,0,0,0,0|2,0,1]=4 209 B14R1.3146 CC1=C(C(=CC(=C1)F)C(=O)O)N(=O)=O MCULE-3079494013 [0,1,0,0,0,0|1,0,2]=4 210 B14R1.3146 CC1=C(C(=CC(=C1)O)C(=O)O)N(=O)=O MCULE-2165851779 [0,1,0,0,0,0|0,1,2]=4 211 B14R1.3146 CC1=CC(=C(C(=C1)C(=O)O)N(=O)=O)C MCULE-7692465540 [0,1,0,0,0,0|1,0,2]=4 212 B14R1.3146 NC1=C(C(=CC(=C1)Cl)C(=O)O)N(=O)=O MCULE-3296376056 [0,1,0,0,0,0|1,0,2]=4 213 B14R1.3146 O=C(O)C1=C(C(=CC(=C1)F)F)N(=O)=O MCULE-4852325977 [0,1,0,0,0,0|1,0,2]=4 214 B14R1.3146 O=C(O)C1=CC(=CC(=C1C(=O)O)Cl)Cl MCULE-4384344278 [0,1,0,0,0,0|2,0,1]=4 215 B14R1.3146 O=C(O)C1=CC(=CC(=C1C(=O)O)F)Br MCULE-4750437357 [0,1,0,0,0,0|2,0,1]=4 216 B14R1.3146 O=C(O)C1=CC(=CC(=C1N(=O)=O)Br)F MCULE-2126154447 [0,1,0,0,0,0|1,0,2]=4 217 B14R1.3146 O=C(O)C1=CC(=CC(=C1N(=O)=O)Cl)Cl MCULE-7632516222 [0,1,0,0,0,0|1,0,2]=4 218 B14R1.3146 O=C(O)C1=CC(=CC(=C1N(=O)=O)O)F MCULE-7019258607 [0,1,0,0,0,0|1,0,2]=4 219 B14R1.6027 CC1=C(C=C(C(=C1)C(=O)O)N(=O)=O)Br MCULE-4676624150 [0,1,0,0,0,0|1,0,2]=4 220 B14R1.6027 CC1=C(C=C(C(=C1)C(=O)O)N(=O)=O)F MCULE-4006280088 [0,1,0,0,0,0|1,0,2]=4 221 B14R1.6027 CC1=C(C=C(C(=C1)N(=O)=O)C(=O)O)Cl MCULE-3405286736 [0,1,0,0,0,0|1,0,2]=4 222 B14R1.6027 CC1=C(C=C(C(=C1)N(=O)=O)C(=O)O)F MCULE-3906048098 [0,1,0,0,0,0|1,0,2]=4 223 B14R1.6027 CC1=C(C=C(C(=C1)N(=O)=O)C(=O)O)N MCULE-8644432948 [0,1,0,0,0,0|1,0,2]=4 224 B14R1.6027 CC1=CC(=C(C=C1C)C(=O)O)C(=O)O MCULE-6490961170 [0,1,0,0,0,0|2,0,1]=4 225 B14R1.6027 CC1=CC(=C(C=C1C)N(=O)=O)C(=O)O MCULE-6008882219 [0,1,0,0,0,0|1,0,2]=4 226 B14R1.6027 NC(=O)C1=C(C=C(C(=C1)F)F)C(=O)O MCULE-6456075908 [0,1,0,0,0,0|3,0,0]=4 227 B14R1.6027 NC(=O)C1=CC(=C(C=C1C(=O)O)Br)Br MCULE-1365276768 [0,1,0,0,0,0|3,0,0]=4 228 B14R1.6027 NC(=O)C1=CC(=C(C=C1C(=O)O)Cl)Cl MCULE-6619357384 [0,1,0,0,0,0|3,0,0]=4 229 B14R1.6027 NC1=C(C=C(C(=C1)C(=O)O)N(=O)=O)F MCULE-7991478266 [0,1,0,0,0,0|1,0,2]=4 230 B14R1.6027 NC1=CC(=C(C=C1Cl)N(=O)=O)C(=O)O MCULE-5422182543 [0,1,0,0,0,0|1,0,2]=4 231 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)Br)Br)C(=O)O MCULE-6277688743 [0,1,0,0,0,0|2,0,1]=4 232 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)Br)Cl)N(=O)=O MCULE-5853978284 [0,1,0,0,0,0|1,0,2]=4 233 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)Cl)F)N(=O)=O MCULE-6308964514 [0,1,0,0,0,0|1,0,2]=4 234 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)F)Cl)N(=O)=O MCULE-8007226994 [0,1,0,0,0,0|1,0,2]=4 235 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)F)F)C(=O)O MCULE-3727504979 [0,1,0,0,0,0|2,0,1]=4 236 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)F)F)N(=O)=O MCULE-7643379220 [0,1,0,0,0,0|1,0,2]=4 237 B14R1.6027 O=C(O)C1=C(C=C(C(=C1)O)Br)N(=O)=O MCULE-7607575578 [0,1,0,0,0,0|0,1,2]=4 238 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)Br)Cl MCULE-5140081638 [0,1,0,0,0,0|2,0,1]=4 239 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)Cl)Cl MCULE-5676741485 [0,1,0,0,0,0|2,0,1]=4 240 B14R1.6027 O=C(O)C1=CC(=C(C=C1C(=O)O)I)I MCULE-5236084359 [0,1,0,0,0,0|2,0,1]=4 241 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)Br)Cl MCULE-3374706580 [0,1,0,0,0,0|1,0,2]=4 242 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)Br)F MCULE-1285171180 [0,1,0,0,0,0|1,0,2]=4 243 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)Cl)Cl MCULE-9765247630 [0,1,0,0,0,0|1,0,2]=4 244 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)Cl)O MCULE-8435585752 [0,1,0,0,0,0|0,1,2]=4 245 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)F)Br MCULE-3687658580 [0,1,0,0,0,0|1,0,2]=4 246 B14R1.6027 O=C(O)C1=CC(=C(C=C1N(=O)=O)F)O MCULE-2841521661 [0,1,0,0,0,0|0,1,2]=4 247 B14R1.6051 CC1=CC(=C(C=C1)S(=O)(=O)N)C(=O)O MCULE-4550717137 [0,1,0,0,0,0|2,0,1]=4 248 B14R1.6051 CC1=CC=C(C(=C1)C(=O)O)S(=O)(=O)C MCULE-2421751093 [0,1,0,0,0,0|2,0,1]=4 249 B14R1.6051 CS(=O)(=O)C1=C(C=C(C=C1)Cl)C(=O)O MCULE-1576585466 [0,1,0,0,0,0|2,0,1]=4 250 B14R1.6051 CS(=O)(=O)C1=CC=C(C=C1C(=O)O)Br MCULE-6023296766 [0,1,0,0,0,0|2,0,1]=4 251 B14R1.6051 CS(=O)(=O)C1=CC=C(C=C1C(=O)O)F MCULE-5627513009 [0,1,0,0,0,0|2,0,1]=4 252 B14R1.6060 CC1=C(C(=C(C=C1)N(=O)=O)C(=O)O)Br MCULE-2015435591 [0,1,0,0,0,0|1,0,2]=4 253 B14R1.6060 CC1=C(C(=C(C=C1)N(=O)=O)C(=O)O)C MCULE-8689175662 [0,1,0,0,0,0|1,0,2]=4 254 B14R1.6060 CC1=C(C(=CC=C1Br)N(=O)=O)C(=O)O MCULE-8685389299 [0,1,0,0,0,0|1,0,2]=4 255 B14R1.6060 CC1=C(C(=CC=C1Cl)N(=O)=O)C(=O)O MCULE-6493399861 [0,1,0,0,0,0|1,0,2]=4 256 B14R1.6060 CC1=C(C(=CC=C1F)N(=O)=O)C(=O)O MCULE-4676012062 [0,1,0,0,0,0|1,0,2]=4 257 B14R1.6060 CC1=C(C=CC(=C1C(=O)O)N(=O)=O)N MCULE-8118149896 [0,1,0,0,0,0|1,0,2]=4 258 B14R1.6060 O=C(O)C1=C(C=CC(=C1Br)F)N(=O)=O MCULE-9413639234 [0,1,0,0,0,0|1,0,2]=4 259 B14R1.6060 O=C(O)C1=C(C=CC(=C1Cl)F)N(=O)=O MCULE-2442334254 [0,1,0,0,0,0|1,0,2]=4 260 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)Br)F MCULE-3234449004 [0,1,0,0,0,0|2,0,1]=4 261 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)Cl)Cl MCULE-3153924625 [0,1,0,0,0,0|2,0,1]=4 262 B14R1.6060 O=C(O)C1=CC=C(C(=C1C(=O)O)F)Br MCULE-4943817004 [0,1,0,0,0,0|2,0,1]=4 263 B14R1.164 CC1=CC=C(C(=C1)CC(=O)O)N(=O)=O MCULE-6276927587 [0,0,0,0,0,1|1,0,2]=4 264 B14R1.164 O=C(O)CC1=C(C=CC(=C1)F)N(=O)=O MCULE-3363151616 [0,0,0,0,0,1|1,0,2]=4 265 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)Br MCULE-7217904832 [0,0,0,0,0,1|2,0,1]=4 266 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)Cl MCULE-3311524524 [0,0,0,0,0,1|2,0,1]=4 267 B14R1.164 O=C(O)CC1=CC(=CC=C1C(=O)O)F MCULE-6609053292 [0,0,0,0,0,1|2,0,1]=4 268 B14R1.164 O=C(O)CC1=CC(=CC=C1N(=O)=O)Br MCULE-2582011805 [0,0,0,0,0,1|1,0,2]=4 269 B14R1.164 O=C(O)CC1=CC(=CC=C1N(=O)=O)Cl MCULE-5199787051 [0,0,0,0,0,1|1,0,2]=4 270 B14R1.164 O=C(O)CC1=CC(=CC=C1N(=O)=O)I MCULE-6046310465 [0,0,0,0,0,1|1,0,2]=4 271 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)O MCULE-7964554961 [0,0,0,0,0,1|3,0,0]=4 272 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)F)C(=O)O MCULE-2874482161 [0,0,0,0,0,1|3,0,0]=4 273 B14R1.6074 CC(=O)NC1=C(C=C(C=C1)I)C(=O)O MCULE-3438849269 [0,0,0,0,0,1|3,0,0]=4 274 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)Br MCULE-2116317707 [0,0,0,0,0,1|3,0,0]=4 275 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)C MCULE-5382012989 [0,0,0,0,0,1|3,0,0]=4 276 B14R1.6074 CC(=O)NC1=CC=C(C=C1C(=O)O)O MCULE-5874430744 [0,0,0,0,0,1|2,1,0]=4 277 B14R1.6074 CC(=O)OC1=C(C=C(C=C1)Br)C(=O)O MCULE-4103590957 [0,0,0,0,0,1|3,0,0]=4 278 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)Cl MCULE-5240299802 [0,0,0,0,0,1|3,0,0]=4 279 B14R1.6074 CC(=O)OC1=CC=C(C=C1C(=O)O)O MCULE-4585002140 [0,0,0,0,0,1|2,1,0]=4 280 B14R1.6074 CC(=O)SC1=C(C=C(C=C1)Br)C(=O)O MCULE-9173042927 [0,0,0,0,0,1|3,0,0]=4 281 B14R1.6074 CC1=CC=C(C(=C1)C(=O)O)CC(=O)O MCULE-7627589049 [0,0,0,0,0,1|2,0,1]=4 282 B14R1.6074 NC(=O)NC1=C(C=C(C=C1)Br)C(=O)O MCULE-1250978576 [0,0,0,0,0,1|3,0,0]=4 283 B14R1.6074 NC1=CC=C(C(=C1)C(=O)O)CC(=O)O MCULE-8784666821 [0,0,0,0,0,1|2,0,1]=4 284 B14R1.6074 O=C(O)CC1=C(C=C(C=C1)Br)C(=O)O MCULE-4986008206 [0,0,0,0,0,1|2,0,1]=4 285 B14R1.6074 O=C(O)CC1=CC=C(C=C1C(=O)O)F MCULE-2248916450 [0,0,0,0,0,1|2,0,1]=4 286 B11R1.37 CC1=CC(=C(C=C1)C=O)C=O MCULE-6694975606 [2,0,0,0,0,0|2,0,0]=4 287 B11R1.37 O=CC1=CC=C(C=C1C=O)Br MCULE-7069005202 [2,0,0,0,0,0|2,0,0]=4 288 B11R1.53 C#CC1=CC=CC=C1C(=O)O MCULE-2225406631 [2,0,0,0,0,0|2,0,0]=4 289 B11R1.53 C=CC1=CC=CC=C1C(=O)O MCULE-7536191019 [2,0,0,0,0,0|2,0,0]=4 290 B11R1.53 CC(=O)C1=CC=CC=C1C=O MCULE-5332635055 [2,0,0,0,0,0|2,0,0]=4 291 B11R1.53 CCC1=CC=CC=C1C(=O)O MCULE-5345503463 [2,0,0,0,0,0|2,0,0]=4 292 B11R1.53 CNC1=CC=CC=C1C(=O)O MCULE-5834002880 [2,0,0,0,0,0|1,0,1]=4 293 B11R1.53 COC1=C(C=CC=C1)C(=O)O MCULE-8358316345 [2,0,0,0,0,0|2,0,0]=4 294 B11R1.53 CSC1=C(C=CC=C1)C(=O)O MCULE-9467769240 [2,0,0,0,0,0|2,0,0]=4 295 B11R1.53 N#CC1=C(C=CC=C1)C(=O)O MCULE-8028564477 [2,0,0,0,0,0|2,0,0]=4 296 B11R1.53 NC(=O)C1=C(C=CC=C1)C=O MCULE-1125511731 [2,0,0,0,0,0|2,0,0]=4 297 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-3951040853 [2,0,0,0,0,0|2,0,0]=4 298 B11R1.53 NCC1=CC=CC=C1C(=O)O MCULE-7214993753 [2,0,0,0,0,0|2,0,0]=4 299 B11R1.53 NNC1=C(C=CC=C1)C(=O)O MCULE-6710058167 [2,0,0,0,0,0|1,0,1]=4 300 B11R1.53 NNC1=CC=CC=C1C(=O)O MCULE-9681705772 [2,0,0,0,0,0|1,0,1]=4 301 B11R1.53 O=C(O)C1=C(C=CC=C1)CBr MCULE-3916838805 [2,0,0,0,0,0|2,0,0]=4 302 B11R1.53 O=C(O)C1=C(C=CC=C1)CCl MCULE-9961828053 [2,0,0,0,0,0|2,0,0]=4 303 B11R1.53 O=C(O)C1=C(C=CC=C1)CO MCULE-4795775601 [2,0,0,0,0,0|1,0,1]=4 304 B11R1.53 O=C(O)C1=C(C=CC=C1)NO MCULE-6356954782 [2,0,0,0,0,0|0,0,2]=4 305 B11R1.53 O=C(O)C1=C(C=CC=C1)OI MCULE-3097266245 [2,0,0,0,0,0|2,0,0]=4 306 B11R1.53 O=CC1=C(C=CC=C1)C(=O)Cl MCULE-3471711409 [2,0,0,0,0,0|2,0,0]=4 307 B11R1.53 O=CC1=C(C=CC=N1)C(=O)O MCULE-5630434791 [2,0,0,0,0,0|2,0,0]=4 308 B11R1.53 O=CC1=C(N=CC=C1)C(=O)O MCULE-6919546171 [2,0,0,0,0,0|2,0,0]=4 309 B11R1.53 O=CC1=CC=CC=C1C(=O)O MCULE-7642820980 [2,0,0,0,0,0|1,0,0]=3 310 B11R1.53 O=CC1=CC=CC=C1N(=O)=O MCULE-1037843730 [2,0,0,0,0,0|0,0,2]=4 311 B11R1.53 O=CC1=CC=NC=C1C(=O)O MCULE-7629200205 [2,0,0,0,0,0|2,0,0]=4 312 B11R1.53 O=NC1=CC=CC=C1C(=O)O MCULE-4180896401 [2,0,0,0,0,0|0,0,1]=3 313 B11R1.53 O=[IH2]C1=C(C=CC=C1)C(=O)O MCULE-9514632532 [2,0,0,0,0,0|1,0,0]=3 314 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O MCULE-3772908609 [2,0,0,0,0,0|2,0,0]=4 315 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)O MCULE-8272991618 [2,0,0,0,0,0|2,0,0]=4 316 B11R1.167 CC1=C(C=C(C=C1)I)C(=O)O MCULE-8500654995 [2,0,0,0,0,0|2,0,0]=4 317 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)O MCULE-2831330137 [2,0,0,0,0,0|1,1,0]=4 318 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)O MCULE-1885016168 [2,0,0,0,0,0|2,0,0]=4 319 B11R1.167 CC1=CC(=C(C=C1)Cl)C(=O)O MCULE-6194147933 [2,0,0,0,0,0|2,0,0]=4 320 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O MCULE-5865108835 [2,0,0,0,0,0|2,0,0]=4 321 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O MCULE-7218132638 [2,0,0,0,0,0|2,0,0]=4 322 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)O MCULE-5696684135 [2,0,0,0,0,0|1,0,1]=4 323 B11R1.167 CC1=CC=C(C(=C1)C(=O)O)Br MCULE-4902542779 [2,0,0,0,0,0|2,0,0]=4 324 B11R1.167 CC1=CC=C(C(=C1)C(=O)O)N MCULE-6817114383 [2,0,0,0,0,0|1,0,1]=4 325 B11R1.167 CC1=CC=C(C(=C1)C(=O)O)S MCULE-3992888737 [2,0,0,0,0,0|1,1,0]=4 326 B11R1.167 CC1=CC=C(C=C1C(=O)O)Cl MCULE-5749182426 [2,0,0,0,0,0|2,0,0]=4 327 B11R1.167 CC1=CC=C(C=C1C(=O)O)N MCULE-5228532934 [2,0,0,0,0,0|2,0,0]=4 328 B11R1.167 CN1C=CC(=O)C(=C1)C(=O)O MCULE-3859813564 [2,0,0,0,0,0|2,0,0]=4 329 B11R1.167 NC1=C(C=C(C=C1)Br)C(=O)O MCULE-1805491017 [2,0,0,0,0,0|1,0,1]=4 330 B11R1.167 NC1=C(C=C(C=C1)Cl)C(=O)O MCULE-1413441672 [2,0,0,0,0,0|1,0,1]=4 331 B11R1.167 NC1=C(C=C(C=C1)O)C(=O)O MCULE-2088622210 [2,0,0,0,0,0|0,1,1]=4 332 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O MCULE-8824867438 [2,0,0,0,0,0|2,0,0]=4 333 B11R1.167 NC1=CC(=C(C=C1)Cl)C(=O)O MCULE-7035710598 [2,0,0,0,0,0|2,0,0]=4 334 B11R1.167 NC1=CC(=C(C=C1)F)C(=O)O MCULE-8295660791 [2,0,0,0,0,0|2,0,0]=4 335 B11R1.167 NC1=CC(=C(C=C1)N)C(=O)O MCULE-4011981203 [2,0,0,0,0,0|1,0,1]=4 336 B11R1.167 NC1=CC(=C(C=C1)S)C(=O)O MCULE-3576119861 [2,0,0,0,0,0|1,1,0]=4 337 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)F MCULE-7401968356 [2,0,0,0,0,0|2,0,0]=4 338 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)I MCULE-5864301036 [2,0,0,0,0,0|2,0,0]=4 339 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)I MCULE-7628311403 [2,0,0,0,0,0|2,0,0]=4 340 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)N MCULE-8675171268 [2,0,0,0,0,0|1,0,1]=4 341 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)N MCULE-8705725820 [2,0,0,0,0,0|1,0,1]=4 342 B11R1.167 NC1=CC=C(C(=C1)C(=O)O)O MCULE-5752745805 [2,0,0,0,0,0|1,0,1]=4 343 B11R1.167 NC1=CC=C(C=C1C(=O)O)F MCULE-7418599583 [2,0,0,0,0,0|1,0,1]=4 344 B11R1.167 NC1=CC=C(C=C1C(=O)O)I MCULE-5345446533 [2,0,0,0,0,0|1,0,1]=4 345 B11R1.167 NC1=CNC(=O)C(=C1)C(=O)O MCULE-6170089668 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)Br MCULE-6630259679 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)Cl MCULE-2420683949 [2,0,0,0,0,0|2,0,0]=4 348 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)F MCULE-6943653899 [2,0,0,0,0,0|2,0,0]=4 349 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)I MCULE-7810321504 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)Br MCULE-2611256993 [2,0,0,0,0,0|2,0,0]=4 351 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)I MCULE-6815209576 [2,0,0,0,0,0|2,0,0]=4 352 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)S MCULE-9014062225 [2,0,0,0,0,0|1,1,0]=4 353 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)Br MCULE-4257142037 [2,0,0,0,0,0|2,0,0]=4 354 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)I MCULE-1573738206 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)O MCULE-4408592799 [2,0,0,0,0,0|1,0,1]=4 356 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)S MCULE-3021221659 [2,0,0,0,0,0|1,1,0]=4 357 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)Cl MCULE-9480490610 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)F MCULE-6547291325 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)O MCULE-9277488598 [2,0,0,0,0,0|1,0,1]=4 360 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)Br MCULE-9690857120 [2,0,0,0,0,0|1,1,0]=4 361 B11R1.167 O=C(O)C1=C(C=CC(=C1)S)Br MCULE-4547032123 [2,0,0,0,0,0|1,0,0]=3 362 B11R1.167 O=C(O)C1=C(C=CC(=C1)S)Cl MCULE-4683536624 [2,0,0,0,0,0|1,0,0]=3 363 B11R1.167 O=C(O)C1=C(C=CC(=C1)S)F MCULE-2040747704 [2,0,0,0,0,0|1,0,0]=3 364 B11R1.167 O=C(O)C1=CC(=CC=C1Br)I MCULE-5694320957 [2,0,0,0,0,0|2,0,0]=4 365 B11R1.167 O=C(O)C1=CC(=CC=C1Cl)Cl MCULE-6843789690 [2,0,0,0,0,0|2,0,0]=4 366 B11R1.167 O=C(O)C1=CC(=CC=C1Cl)F MCULE-6329447269 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.167 O=C(O)C1=CC(=CC=C1Cl)O MCULE-8095921204 [2,0,0,0,0,0|1,1,0]=4 368 B11R1.167 O=C(O)C1=CC(=CC=C1F)Cl MCULE-9232760938 [2,0,0,0,0,0|2,0,0]=4 369 B11R1.167 O=C(O)C1=CC(=CC=C1F)F MCULE-4244861678 [2,0,0,0,0,0|2,0,0]=4 370 B11R1.167 O=C(O)C1=CC(=CC=C1F)O MCULE-7422472216 [2,0,0,0,0,0|1,1,0]=4 371 B11R1.167 O=C(O)C1=CC(=CC=C1I)I MCULE-7467153636 [2,0,0,0,0,0|2,0,0]=4 372 B11R1.167 O=C(O)C1=CC(=CC=C1I)O MCULE-5572220045 [2,0,0,0,0,0|1,1,0]=4 373 B11R1.167 O=C(O)C1=CC(=CC=C1O)Br MCULE-5716573708 [2,0,0,0,0,0|1,0,1]=4 374 B11R1.167 O=C(O)C1=CC(=CC=C1O)Cl MCULE-1986250484 [2,0,0,0,0,0|1,0,1]=4 375 B11R1.167 O=C(O)C1=CC(=CC=C1O)O MCULE-7171470745 [2,0,0,0,0,0|0,1,1]=4 376 B11R1.167 O=C(O)C1=CC(=CC=C1S)Br MCULE-3686114204 [2,0,0,0,0,0|1,1,0]=4 377 B11R1.167 O=C(O)C1=CC(=CNC1=O)Cl MCULE-6391425584 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.166 NC1=CC(=C(C=C1)C(=O)[O-])O MCULE-2080421419 [2,0,0,0,0,0|2,0,0]=4 379 B11R1.166 NC1=CC=C(C(=C1)O)C(=O)[O-] MCULE-8313817847 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.166 O=C([O-])C1=C(C=C(C=C1)O)O MCULE-1623982025 [2,0,0,0,0,0|1,1,0]=4 381 B13R1.141 O=CNC1=C(C=C(C=C1)Br)C(=O)O MCULE-2357073463 [1,1,0,0,0,0|1,0,1]=4 382 B13R1.2209 COC(=O)C1=C(C=CC(=C1)C)C=O MCULE-1637849590 [1,1,0,0,0,0|2,0,0]=4 383 B13R1.2209 COC(=O)C1=C(C=CC(=C1)F)C=O MCULE-9340830446 [1,1,0,0,0,0|2,0,0]=4 384 B13R1.2209 COC(=O)C1=C(C=CC(=C1)O)C=O MCULE-3253315450 [1,1,0,0,0,0|1,1,0]=4 385 B13R1.2209 COC(=O)C1=CC(=CC=C1C=O)Br MCULE-7680904030 [1,1,0,0,0,0|2,0,0]=4 386 B13R1.2209 COC(=O)C1=CC(=CC=C1C=O)Cl MCULE-8102258429 [1,1,0,0,0,0|2,0,0]=4 387 B13R1.2279 O=CC1=C(C(=C(C=C1)Cl)F)C(=O)O MCULE-6538846256 [1,1,0,0,0,0|2,0,0]=4 388 B13R1.2398 COC1=CC(=C(C=C1C(=O)O)S)C MCULE-6517245326 [1,1,0,0,0,0|2,0,0]=4 389 B13R1.2398 O=CC1=CC(=C(C=C1C(=O)O)F)F MCULE-9552114280 [1,1,0,0,0,0|2,0,0]=4 390 B13R1.2430 COC1=CC=C(C(=C1)C(=O)O)C=O MCULE-1235261556 [1,1,0,0,0,0|1,1,0]=4 391 B13R1.3255 CC1=CC(=C(C(=C1)C(=O)O)C=O)F MCULE-9481558382 [1,1,0,0,0,0|2,0,0]=4 392 B13R1.3255 O=CC1=C(C=C(C=C1F)Cl)C(=O)O MCULE-9797687317 [1,1,0,0,0,0|2,0,0]=4 393 B13R1.295 CC1=C(C(=CC=C1)C(=O)O)C(=O)O MCULE-4941517810 [1,1,0,0,0,0|1,0,1]=4 394 B13R1.295 CC1=C(C(=CC=C1)C(=O)O)N(=O)=O MCULE-7346938921 [1,1,0,0,0,0|0,0,2]=4 395 B13R1.295 CC1=C(C(=CC=C1)N(=O)=O)C(=O)O MCULE-1416023209 [1,1,0,0,0,0|0,0,2]=4 396 B13R1.295 NC1=C(C(=CC=C1)C(=O)O)C(=O)O MCULE-1472462304 [1,1,0,0,0,0|1,0,1]=4 397 B13R1.295 NC1=C(C(=CC=C1)C(=O)O)N(=O)=O MCULE-4267842294 [1,1,0,0,0,0|0,0,2]=4 398 B13R1.295 NC1=C(C(=CC=C1)N(=O)=O)C(=O)O MCULE-8408819089 [1,1,0,0,0,0|0,0,2]=4 399 B13R1.295 NC1=CC=CC(=C1C(=O)O)C(=O)O MCULE-3815428212 [1,1,0,0,0,0|1,0,1]=4 400 B13R1.295 O=C(O)C1=C(C(=CC=C1)Br)C(=O)O MCULE-2987291944 [1,1,0,0,0,0|1,0,1]=4 401 B13R1.295 O=C(O)C1=C(C(=CC=C1)Br)N(=O)=O MCULE-5575271565 [1,1,0,0,0,0|0,0,2]=4 402 B13R1.295 O=C(O)C1=C(C(=CC=C1)Cl)N(=O)=O MCULE-8112793088 [1,1,0,0,0,0|0,0,2]=4 403 B13R1.295 O=C(O)C1=C(C(=CC=C1)F)N(=O)=O MCULE-4365988818 [1,1,0,0,0,0|0,0,2]=4 404 B13R1.295 O=C(O)C1=C(C=CC=C1Cl)N(=O)=O MCULE-5155184712 [1,1,0,0,0,0|0,0,2]=4 405 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)Br MCULE-4666580066 [1,1,0,0,0,0|0,0,2]=4 406 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)F MCULE-9324018001 [1,1,0,0,0,0|0,0,2]=4 407 B13R1.295 O=C(O)C1=C(C=CC=C1N(=O)=O)I MCULE-6043813960 [1,1,0,0,0,0|0,0,2]=4 408 B13R1.295 O=C(O)C1=C(C=CC=C1O)N(=O)=O MCULE-6942651523 [1,1,0,0,0,0|0,0,2]=4 409 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)Cl MCULE-9559389453 [1,1,0,0,0,0|1,0,1]=4 410 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)F MCULE-7732883800 [1,1,0,0,0,0|1,0,1]=4 411 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)I MCULE-5657824424 [1,1,0,0,0,0|1,0,1]=4 412 B13R1.295 O=C(O)C1=CC=CC(=C1C(=O)O)O MCULE-2125757137 [1,1,0,0,0,0|1,0,1]=4 413 B13R1.295 O=C(O)C1=CC=CC(=C1N(=O)=O)O MCULE-1899116810 [1,1,0,0,0,0|0,0,2]=4 414 B13R1.349 CP(=O)(C)C1=C(C=CC=C1)C(=O)O MCULE-8561135633 [1,1,0,0,0,0|1,1,0]=4 415 B13R1.349 CS(=O)(=O)C1=C(C=CC=C1)C(=O)O MCULE-6380177013 [1,1,0,0,0,0|1,0,1]=4 416 B13R1.349 NS(=O)(=O)C1=CC=CC=C1C(=O)O MCULE-2793669822 [1,1,0,0,0,0|1,0,1]=4 417 B13R1.349 O=C(O)C1=C(C=CC=C1)S(=O)(=O)Cl MCULE-6209736734 [1,1,0,0,0,0|1,0,1]=4 418 B13R1.349 O=C(O)C1=C(C=CC=C1)S(=O)(=O)O MCULE-3721052746 [1,1,0,0,0,0|1,0,1]=4 419 B13R1.349 O=C([O-])C1=CC=CC=C1S(=O)(=O)O MCULE-3282855595 [1,1,0,0,0,0|2,0,0]=4 420 B13R1.547 CCC(=O)C1=CC=CC=C1C(=O)O MCULE-8857715556 [1,1,0,0,0,0|2,0,0]=4 421 B13R1.547 CCS(=O)C1=C(C=CC=C1)C(=O)O MCULE-9408058966 [1,1,0,0,0,0|2,0,0]=4 422 B13R1.547 COC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-4421008798 [1,1,0,0,0,0|0,0,2]=4 423 B13R1.547 COC(=O)C1=C(C=CC=C1)S(=O)C MCULE-4096864674 [1,1,0,0,0,0|2,0,0]=4 424 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)C MCULE-6297416373 [1,1,0,0,0,0|2,0,0]=4 425 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)Cl MCULE-9936711468 [1,1,0,0,0,0|2,0,0]=4 426 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)N MCULE-9145284532 [1,1,0,0,0,0|2,0,0]=4 427 B13R1.547 COC(=O)C1=CC=CC=C1C(=O)O MCULE-2559625268 [1,1,0,0,0,0|1,0,1]=4 428 B13R1.547 N[C@@H](CO)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-2635153368 [1,1,0,0,0,0|1,0,1]=4 429 B13R1.547 N[C@@H](CO)C1=CC=CC=C1[N+](=O)[O-] MCULE-2996598563 [1,1,0,0,0,0|1,0,1]=4 430 B13R1.547 N[C@H](CO)C1=C(C=CC=C1)[N+](=O)[O-] MCULE-4971941244 [1,1,0,0,0,0|1,0,1]=4 431 B13R1.547 N[C@H](CO)C1=CC=CC=C1[N+](=O)[O-] MCULE-4382662018 [1,1,0,0,0,0|1,0,1]=4 432 B13R1.547 O=C(CO)C1=C(C=CC=C1)N(=O)=O MCULE-4645124163 [1,1,0,0,0,0|0,0,2]=4 433 B13R1.547 O=C(O)C1=C(C=CC=C1)C(=O)OO MCULE-6120306346 [1,1,0,0,0,0|1,0,1]=4 434 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)CBr MCULE-4728185281 [1,1,0,0,0,0|2,0,0]=4 435 B13R1.547 O=[N+]([O-])C1=C(C=CC=C1)C(=NO)Cl MCULE-7645628162 [1,1,0,0,0,0|1,0,0]=3 436 B15R1.597 N#CSC1=CC(=C(C=C1)N(=O)=O)C(=O)O MCULE-7495129521 [0,2,0,0,0,0|0,0,2]=4 437 B15R1.1862 COC1=CC(=C(C=C1)S(=O)(=O)[O-])C(=O)O MCULE-6504335059 [0,2,0,0,0,0|1,1,0]=4 438 B13R1.1985 O=C(O)/C=C/C1=CC=C(S1)N(=O)=O MCULE-6075127382 [0,0,1,1,0,0|0,0,2]=4 439 B13R1.1985 O=C(O)C=CC1=CC=C(O1)[N+](=O)[O-] MCULE-6903611173 [0,0,1,1,0,0|0,1,0]=3 440 B13R1.1985 O=C(O)C=CC1=CC=C(S1)[N+](=O)[O-] MCULE-1564775970 [0,0,1,1,0,0|0,0,0]=2 441 B13R2.5187 CC1=CC=C2C(=O)OC(=O)C2=C1 MCULE-2227588260 [1,0,0,1,0,0|2,0,0]=4 442 B13R2.5187 NC1=CC2=C(C=C1)C(=O)OC2=O MCULE-6605521162 [1,0,0,1,0,0|2,0,0]=4 443 B13R2.5187 O=C1OC(=O)C2=C1C=CC(=C2)Br MCULE-1292626980 [1,0,0,1,0,0|2,0,0]=4 444 B13R2.5187 O=C1OC(=O)C2=C1C=CC(=C2)Cl MCULE-6374248261 [1,0,0,1,0,0|2,0,0]=4 445 B13R2.5187 O=C1OC(=O)C2=C1C=CC(=C2)I MCULE-8739162017 [1,0,0,1,0,0|2,0,0]=4 446 B13R2.5187 O=C1OC(=O)C2=CC(=CC=C12)F MCULE-7183904591 [1,0,0,1,0,0|2,0,0]=4 447 B13R2.5187 O=C1OC(=O)C2=CC(=CC=C12)O MCULE-3427428269 [1,0,0,1,0,0|1,1,0]=4 448 B13R2.371 O=C1COC(=O)C2=C1C=CC=C2 MCULE-9148401423 [1,0,0,1,0,0|2,0,0]=4 449 B13R2.12159 O=C1OI(=O)(C2=CC=CC=C12)O MCULE-1032859726 [1,0,0,1,0,0|1,0,1]=4 450 B13R2.12159 O=C1OS(=O)(=O)C2=C1C=CC=C2 MCULE-3338526108 [1,0,0,1,0,0|1,0,1]=4 451 B13R1.589 CC(=O)CC1=CC=CC=C1C(=O)O MCULE-9138117669 [1,0,0,0,0,1|2,0,0]=4 452 B13R1.589 CC(=O)NC1=CC=CC=C1C(=O)O MCULE-5493843354 [1,0,0,0,0,1|2,0,0]=4 453 B13R1.589 CC(=O)OC1=C(C=CC=C1)C(=O)O MCULE-3199019536 [1,0,0,0,0,1|2,0,0]=4 454 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)[O-] MCULE-1298755950 [1,0,0,0,0,1|2,0,0]=4 455 B13R1.589 CC(=O)SC1=CC=CC=C1C(=O)O MCULE-5814875567 [1,0,0,0,0,1|2,0,0]=4 456 B13R1.589 CS(=O)C1=C(C=CC=C1)CC(=O)O MCULE-9403002843 [1,0,0,0,0,1|2,0,0]=4 457 B13R1.589 NC(=O)C1=C(C=CC=C1)CC(=O)O MCULE-9735756944 [1,0,0,0,0,1|2,0,0]=4 458 B13R1.589 NC(=O)CC1=CC=CC=C1C(=O)O MCULE-9127524097 [1,0,0,0,0,1|2,0,0]=4 459 B13R1.589 NC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-1350021651 [1,0,0,0,0,1|2,0,0]=4 460 B13R1.589 O=C(O)CC1=C(C=CC=C1)C(=O)O MCULE-3233814444 [1,0,0,0,0,1|1,0,1]=4 461 B13R1.589 O=C(O)CC1=CC=CC=C1N(=O)=O MCULE-3522722427 [1,0,0,0,0,1|0,0,2]=4 462 B15R1.8435 O=C(O)C=CC1=CC(=CC=C1[N+](=O)[O-])Cl MCULE-9961250183 [0,0,0,0,0,2|1,0,0]=3