0 B11R1.40 C=CC(=O)NC1=CC=CC=C1 P38034 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P32241 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 P38171 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B49021 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B64861 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C38641 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 C=CCOC1=CC=CC=C1 A68573 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.17 C=COCC1=CC=CC=C1 B26636 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.17 O=CC#CC1=CC=CC=C1 P68152 [1,0,0,0,0,0|0,0,2]=3 11 B10R1.18 CC(=O)CC1=CC=NC=C1 P49256 [1,0,0,0,0,0|1,0,1]=3 12 B10R1.18 CC(=O)CC1=NC=CC=C1 P15826 [1,0,0,0,0,0|1,0,1]=3 13 B10R1.18 CC(=O)NC1=CC=CC=C1 A60649 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.18 CC(=O)NC1=CN=CC=C1 P63567 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.18 CC(=O)NC1=NC=CC=N1 P43093 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.18 CC(C)=CC1=CC=CC=C1 M52675 [1,0,0,0,0,0|0,0,1]=2 17 B10R1.18 CC(C)NC1=CC=CC=C1 P69278 [1,0,0,0,0,0|1,0,2]=4 18 B10R1.18 N=C(N)CC1=CC=CC=C1 P22633 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.18 N=C(N)NC1=CC=CC=C1 P49691 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [1,0,0,0,0,0|1,0,1]=3 21 B10R1.18 NC(=O)CC1=CN=CC=C1 P45977 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.18 O=C(O)CC1=CC=NC=C1 P46551 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.18 O=C(O)CC1=CN=CC=C1 P39426 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.18 O=C(O)CC1=NC=CC=C1 P18563 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.18 O=C(O)CC1=NC=CC=C1 P38331 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.18 S=C(Cl)OC1=CC=CC=C1 P37341 [1,0,0,0,0,0|2,1,0]=4 28 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 M61037 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 M50046 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B39587 [0,1,0,0,0,0|0,0,2]=3 31 B12R1.43 CC(=O)[C@@H](C)CC1=CC=CC=C1 M54757 [0,1,0,0,0,0|0,0,2]=3 32 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)Cl P51914 [0,1,0,0,0,0|1,0,1]=3 33 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O P69450 [0,1,0,0,0,0|1,0,1]=3 34 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O M62826 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 A67883 [0,1,0,0,0,0|1,0,2]=4 36 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O A52116 [0,1,0,0,0,0|1,0,2]=4 37 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O P69134 [0,1,0,0,0,0|1,0,2]=4 38 B12R1.43 O=C(Cl)[C@@H](Br)CC1=CC=CC=C1 B6285 [0,1,0,0,0,0|1,0,2]=4 39 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 B8639 [0,1,0,0,0,0|1,0,2]=4 40 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 H49929 [0,1,0,0,0,0|1,0,2]=4 41 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 H49928 [0,1,0,0,0,0|1,0,2]=4 42 B12R1.43 O=C([O-])N(O)CC1=CC=CC=C1 B49301 [0,1,0,0,0,0|2,0,1]=4 43 B12R1.50 C=CC(=O)NC1=CC(N)=CC=C1 A20644 [0,1,0,0,0,0|3,0,0]=4 44 B12R1.50 C=CC(=O)NC1=CC(O)=CC=C1 H51779 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.18 BrC1=C(Br)C2=C(C=CC=C2)S1 D47321 [0,0,0,1,0,0|3,0,0]=4 46 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)O1 B62060 [0,0,0,1,0,0|2,0,0]=3 47 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 B37673 [0,0,0,1,0,0|2,0,0]=3 48 B12R2.18 CC1=C(Br)C2=C(N=CC=C2)N1 B10560 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 D68340 [0,0,0,1,0,0|2,0,0]=3 50 B12R2.18 CC1=C(I)C2=C(N=CC=C2)N1 I11087 [0,0,0,1,0,0|3,0,0]=4 51 B12R2.18 CC1=CC2=C(C=CC=C2)N1C D26007 [0,0,0,1,0,0|2,0,0]=3 52 B12R2.18 CN1C(N)=CC2=C1C=CC=C2 M38994 [0,0,0,1,0,0|3,0,0]=4 53 B12R2.18 CN1N=C2C=CC=CC2=C1Br B14973 [0,0,0,1,0,0|3,0,0]=4 54 B12R2.18 CN1N=C2C=CC=CC2=C1I I14461 [0,0,0,1,0,0|3,0,0]=4 55 B12R2.18 C[C@H]1CC2=C(C=CC=C2)C1=O M4716 [0,0,0,1,0,0|0,0,2]=3 56 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O P9936 [0,0,0,1,0,0|3,0,0]=4 57 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 B39635 [0,0,0,1,0,0|2,0,0]=3 58 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 B3879 [0,0,0,1,0,0|3,0,0]=4 59 B12R2.24 BrC1=CC2=CC=CC=C2N=N1 B36929 [0,0,0,1,0,0|3,0,0]=4 60 B12R2.24 BrC1=CC2=CC=CN=C2C=C1 B4779 [0,0,0,1,0,0|3,0,0]=4 61 B12R2.24 BrC1=CC2=CC=NC=C2C=C1 B3878 [0,0,0,1,0,0|3,0,0]=4 62 B12R2.24 BrC1=CC2=CN=CC=C2C=C1 B4922 [0,0,0,1,0,0|3,0,0]=4 63 B12R2.24 BrC1=CC2=CN=CC=C2N=C1 B21923 [0,0,0,1,0,0|3,0,0]=4 64 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 B23905 [0,0,0,1,0,0|3,0,0]=4 65 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 B9209 [0,0,0,1,0,0|3,0,0]=4 66 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 B1013 [0,0,0,1,0,0|3,0,0]=4 67 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 B47545 [0,0,0,1,0,0|3,0,0]=4 68 B12R2.24 CC1=CC2=CC=CC=C2N=C1 M68883 [0,0,0,1,0,0|1,0,0]=2 69 B12R2.24 CC1=CC=C2N=CC=NC2=C1 M51337 [0,0,0,1,0,0|3,0,0]=4 70 B12R2.24 CC1=NC2=CC=CN=C2C=C1 M7647 [0,0,0,1,0,0|3,0,0]=4 71 B12R2.24 CC1=NC2=NC=CC=C2C=C1 M20466 [0,0,0,1,0,0|3,0,0]=4 72 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 C9355 [0,0,0,1,0,0|3,0,0]=4 73 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 C50850 [0,0,0,1,0,0|2,0,0]=3 74 B12R2.24 ClC1=CC2=CC=CC=C2N=N1 C47551 [0,0,0,1,0,0|3,0,0]=4 75 B12R2.24 ClC1=CC2=CC=CN=C2C=C1 C50851 [0,0,0,1,0,0|3,0,0]=4 76 B12R2.24 ClC1=CC2=CC=CN=C2N=C1 C38369 [0,0,0,1,0,0|3,0,0]=4 77 B12R2.24 ClC1=CC2=CC=NC=C2C=C1 C9357 [0,0,0,1,0,0|3,0,0]=4 78 B12R2.24 ClC1=CC2=CN=CC=C2C=C1 C9358 [0,0,0,1,0,0|3,0,0]=4 79 B12R2.24 ClC1=CC2=NC=CC=C2C=C1 C50852 [0,0,0,1,0,0|3,0,0]=4 80 B12R2.24 ClC1=NC2=CC=CC=C2N=C1 C19911 [0,0,0,1,0,0|3,0,0]=4 81 B12R2.24 FC1=CC2=CC=CC=C2C=C1 F53501 [0,0,0,1,0,0|2,0,0]=3 82 B12R2.24 FC1=CC2=CC=CC=C2C=N1 F38996 [0,0,0,1,0,0|3,0,0]=4 83 B12R2.24 FC1=CC2=CC=CN=C2C=C1 F50853 [0,0,0,1,0,0|3,0,0]=4 84 B12R2.24 FC1=CC2=CN=CC=C2C=C1 F9904 [0,0,0,1,0,0|3,0,0]=4 85 B12R2.24 IC1=CC2=CC=CC=C2C=C1 I38722 [0,0,0,1,0,0|2,0,0]=3 86 B12R2.24 IC1=CC2=CC=CN=C2C=C1 K18700 [0,0,0,1,0,0|3,0,0]=4 87 B12R2.24 IC1=CC2=NC=CC=C2N=C1 K61674 [0,0,0,1,0,0|3,0,0]=4 88 B12R2.24 NC1=CC2=CC=CC=C2C=C1 N65553 [0,0,0,1,0,0|2,0,0]=3 89 B12R2.24 NC1=CC2=CC=CC=C2C=N1 Q51338 [0,0,0,1,0,0|3,0,0]=4 90 B12R2.24 NC1=CC2=CC=NC=C2N=C1 N64656 [0,0,0,1,0,0|3,0,0]=4 91 B12R2.24 NC1=CC=C2C=CC=NC2=C1 Q51336 [0,0,0,1,0,0|3,0,0]=4 92 B12R2.24 NC1=CC=C2C=CC=NC2=C1 Q52219 [0,0,0,1,0,0|3,0,0]=4 93 B12R2.24 NC1=CC=C2C=CN=CC2=C1 A3873 [0,0,0,1,0,0|3,0,0]=4 94 B12R2.24 NC1=CC=C2C=NC=CC2=C1 A3872 [0,0,0,1,0,0|3,0,0]=4 95 B12R2.24 NC1=CC=C2N=CC=CC2=C1 A67851 [0,0,0,1,0,0|3,0,0]=4 96 B12R2.24 NC1=NC2=CC=CC=C2C=C1 Q9616 [0,0,0,1,0,0|3,0,0]=4 97 B12R2.24 OC1=CC2=CC=CC=C2C=N1 H8153 [0,0,0,1,0,0|3,0,0]=4 98 B12R2.24 OC1=CC2=CC=CC=C2N=C1 H32203 [0,0,0,1,0,0|2,0,0]=3 99 B12R2.24 OC1=CC2=CC=NC=C2C=C1 H3875 [0,0,0,1,0,0|3,0,0]=4 100 B12R2.24 OC1=CC2=CN=CC=C2C=C1 Q3876 [0,0,0,1,0,0|3,0,0]=4 101 B12R2.24 OC1=CC2=NC=CC=C2C=C1 Q67940 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.24 [Mg+]C1=CC2=CC=CC=C2C=C1 N31715 [0,0,0,1,0,0|2,0,0]=3 103 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 E52501 [0,0,0,1,0,0|2,0,1]=4 104 B12R2.32 N#CC1=CC2=C(C=CC=C2)N1 K50792 [0,0,0,1,0,0|2,0,1]=4 105 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 B50747 [0,0,0,1,0,0|2,0,1]=4 106 B12R2.32 N#CC1=CC2=C(C=CC=C2)S1 B50760 [0,0,0,1,0,0|2,0,1]=4 107 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 K22314 [0,0,0,1,0,0|2,0,1]=4 108 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 I38005 [0,0,0,1,0,0|1,0,0]=2 109 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 B50964 [0,0,0,1,0,0|1,0,0]=2 110 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 B37929 [0,0,0,1,0,0|1,0,0]=2 111 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 F10728 [0,0,0,1,0,0|2,0,0]=3 112 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 P24641 [0,0,0,1,0,0|2,0,0]=3 113 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 P1530 [0,0,0,1,0,0|2,0,0]=3 114 B12R2.32 O=CC1=CC2=CC=CN=C2S1 T47760 [0,0,0,1,0,0|2,0,0]=3 115 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 B23090 [0,0,0,1,0,0|2,0,0]=3 116 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 B9216 [0,0,0,1,0,0|2,0,0]=3 117 B12R2.32 O=CC1=NN2C=CC=CC2=N1 T44871 [0,0,0,1,0,0|3,0,0]=4 118 B12R2.32 OCC1=CC2=C(C=CC=C2)N1 M9932 [0,0,0,1,0,0|1,0,2]=4 119 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 B51662 [0,0,0,1,0,0|1,0,2]=4 120 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 B64382 [0,0,0,0,1,0|1,0,2]=4 121 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [0,0,0,0,1,0|1,0,2]=4 122 B10R1.15 C=C[S@](=O)C1=CC=CC=C1 V62500 [0,0,0,0,1,0|3,0,0]=4 123 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M50312 [0,0,0,0,1,0|2,0,1]=4 124 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M52164 [0,0,0,0,1,0|2,0,1]=4 125 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P37912 [0,0,0,0,1,0|1,0,2]=4 126 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P39584 [0,0,0,0,1,0|1,0,2]=4 127 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P60945 [0,0,0,0,1,0|1,0,2]=4 128 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 P10845 [0,0,0,0,1,0|1,0,2]=4 129 B10R1.15 C\C(=N\O)C1=NC=CC=C1 M66365 [0,0,0,0,1,0|2,0,1]=4 130 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [0,0,0,0,1,0|3,0,0]=4 131 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [0,0,0,0,1,0|1,0,2]=4 132 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [0,0,0,0,1,0|1,0,0]=2 133 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 B52541 [0,0,0,0,0,1|2,0,1]=4 134 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 B52417 [0,0,0,0,0,1|2,0,1]=4 135 B9R1.8 CC#CC1=CC=CC=C1 P68608 [2,0,0,0,0,0|0,0,2]=4 136 B9R1.8 CNNC1=CC=CC=C1 M46459 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [2,0,0,0,0,0|0,0,0]=2 138 B9R1.8 O=COC1=CC=CC=C1 P45508 [2,0,0,0,0,0|1,0,0]=3 139 B9R1.8 O\N=C\C1=CC=CC=C1 B61148 [2,0,0,0,0,0|1,0,1]=4 140 B11R1.1 CC1=CC=C(\C=C\C=O)C=C1 T52412 [1,1,0,0,0,0|0,0,0]=2 141 B11R1.1 O=CC=CC1=CC=C(F)C=C1 F51323 [1,1,0,0,0,0|0,0,0]=2 142 B11R1.1 O=CCCC1=CC=C(Br)C=C1 B52022 [1,1,0,0,0,0|0,0,2]=4 143 B11R1.1 O=CCCC1=CC=C(O)C=C1 H60513 [1,1,0,0,0,0|0,0,2]=4 144 B11R1.1 O=C\C=C\C1=CC=C(Br)C=C1 B51314 [1,1,0,0,0,0|0,0,0]=2 145 B11R1.1 O=C\C=C\C1=CC=C(Cl)C=C1 C51321 [1,1,0,0,0,0|0,0,0]=2 146 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P68339 [1,1,0,0,0,0|1,0,0]=3 147 B11R1.17 O=C\C=C\C1=C(Cl)C=CC=C1 C51320 [1,1,0,0,0,0|0,0,0]=2 148 B11R1.24 O=CCCC1=CC=CC(Br)=C1 B64250 [1,1,0,0,0,0|0,0,2]=4 149 B11R1.24 O=C\C=C\C1=CC=CC(Br)=C1 B51313 [1,1,0,0,0,0|0,0,0]=2 150 B11R1.24 O=C\C=C\C1=CC=CC(Cl)=C1 C51317 [1,1,0,0,0,0|0,0,0]=2 151 B11R1.28 O=CCCOC1=CC=CC=C1 P49880 [1,1,0,0,0,0|0,0,2]=4 152 B11R1.28 O=CCOCC1=CC=CC=C1 B24494 [1,1,0,0,0,0|0,0,2]=4 153 B11R1.91 CC(=O)NNC1=CC=CC=C1 P69088 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 P68564 [1,1,0,0,0,0|0,0,0]=2 155 B11R1.91 NC(=O)CSC1=CC=CC=C1 P10024 [1,1,0,0,0,0|1,0,1]=4 156 B11R1.91 NC(=O)OCC1=CC=CC=C1 B37832 [1,1,0,0,0,0|1,0,1]=4 157 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 C61979 [1,1,0,0,0,0|0,0,0]=2 158 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 H52037 [1,1,0,0,0,0|0,0,2]=4 159 B11R1.91 O=C(O)C#CC1=CC=CC=C1 P67832 [1,1,0,0,0,0|0,0,2]=4 160 B11R1.91 O=C(O)C=CC1=CN=CC=C1 P48460 [1,1,0,0,0,0|1,0,0]=3 161 B11R1.91 O=C(O)C=CC1=NC=CC=C1 P48456 [1,1,0,0,0,0|1,0,0]=3 162 B11R1.91 O=C(O)CNC1=CC=CC=C1 P68874 [1,1,0,0,0,0|1,0,1]=4 163 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C37831 [1,1,0,0,0,0|0,0,0]=2 164 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 P69501 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 P48463 [1,1,0,0,0,0|1,0,0]=3 166 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P4986 [1,1,0,0,0,0|1,0,1]=4 167 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 B52021 [1,1,0,0,0,0|0,0,1]=3 168 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 C52036 [1,1,0,0,0,0|0,0,1]=3 169 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 F52043 [1,1,0,0,0,0|0,0,1]=3 170 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 H46009 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 B45690 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 H46008 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 A66708 [1,1,0,0,0,0|1,0,0]=3 174 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 A64153 [1,1,0,0,0,0|1,0,0]=3 175 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T37815 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 C49035 [1,1,0,0,0,0|1,0,1]=4 177 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 C37226 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 A69139 [1,1,0,0,0,0|1,0,1]=4 179 B11R1.20 O=C(Cl)OC1=CC=C(F)C=C1 F44593 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B7856 [1,1,0,0,0,0|1,0,1]=4 181 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C68318 [1,1,0,0,0,0|1,0,1]=4 182 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 F67433 [1,1,0,0,0,0|1,0,1]=4 183 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A51548 [1,1,0,0,0,0|1,0,0]=3 184 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 P69231 [1,1,0,0,0,0|0,0,0]=2 185 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 B39601 [1,1,0,0,0,0|0,0,2]=4 186 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 P49885 [1,1,0,0,0,0|1,0,1]=4 187 B11R1.36 C[C@H](Br)C(=O)C1=CC=CC=C1 B52026 [1,1,0,0,0,0|1,0,1]=4 188 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 P36930 [1,1,0,0,0,0|1,0,1]=4 189 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 A69457 [1,1,0,0,0,0|1,0,1]=4 190 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 A69199 [1,1,0,0,0,0|1,0,1]=4 191 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 A68336 [1,1,0,0,0,0|1,0,1]=4 192 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 A69083 [1,1,0,0,0,0|1,0,1]=4 193 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M64934 [1,1,0,0,0,0|1,0,1]=4 194 B11R1.36 O=C(O)[C@H](Cl)C1=CC=CC=C1 C48589 [1,1,0,0,0,0|1,0,1]=4 195 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 B52020 [1,1,0,0,0,0|0,0,1]=3 196 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 C52039 [1,1,0,0,0,0|0,0,1]=3 197 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 F52044 [1,1,0,0,0,0|0,0,1]=3 198 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 K63586 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 A46655 [1,1,0,0,0,0|1,0,0]=3 200 B11R1.86 CC(=O)NC1=NC=CC=C1O H46007 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 T69090 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.86 NC(=O)CC1=C(Cl)C=CC=C1 C49033 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 B39490 [1,1,0,0,0,0|1,0,1]=4 204 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 F39494 [1,1,0,0,0,0|1,0,1]=4 205 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 K48630 [1,1,0,0,0,0|1,0,1]=4 206 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 B64129 [1,1,0,0,0,0|0,0,1]=3 207 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 C52040 [1,1,0,0,0,0|0,0,1]=3 208 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F52045 [1,1,0,0,0,0|0,0,1]=3 209 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 C3776 [1,1,0,0,0,0|2,0,0]=4 210 B11R1.157 CC(=O)NC1=CC=CC(Br)=N1 B45691 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 F2848 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 A46342 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 B45689 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 C45700 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 F48608 [1,1,0,0,0,0|1,0,0]=3 216 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 K48628 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [1,1,0,0,0,0|1,0,1]=4 218 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 A46654 [1,1,0,0,0,0|1,0,1]=4 219 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 C49034 [1,1,0,0,0,0|1,0,1]=4 220 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 B67653 [1,1,0,0,0,0|1,0,1]=4 221 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 C68317 [1,1,0,0,0,0|1,0,1]=4 222 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F23088 [1,1,0,0,0,0|1,0,1]=4 223 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 K48631 [1,1,0,0,0,0|1,0,1]=4 224 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 P46415 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 X51560 [0,1,0,0,1,0|1,0,0]=3 226 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 C67180 [0,1,0,0,1,0|1,0,1]=4 227 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 B47769 [0,1,0,0,1,0|1,0,0]=3 228 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 C47781 [0,1,0,0,1,0|1,0,0]=3 229 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 F63112 [0,1,0,0,1,0|1,0,0]=3 230 B13R1.351 C[C@@H](OCC1=CC=CC=C1)C(=O)O B67100 [0,1,0,0,0,1|0,0,2]=4 231 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O B52822 [0,1,0,0,0,1|0,0,2]=4 232 B13R1.351 C[C@H](OCC1=CC=CC=C1)C(=O)O B65085 [0,1,0,0,0,1|0,0,2]=4 233 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 X52456 [0,1,0,0,0,1|1,0,1]=4 234 B13R1.1327 CC(C)(CC=O)SC1=CC=CC=C1 M64695 [0,2,0,0,0,0|1,0,1]=4 235 B13R1.152 CC(=O)[C@H](C)C(=O)C1=CC=CC=C1 M54555 [0,2,0,0,0,0|0,0,1]=3 236 B13R1.133 C[C@@H](OC1=CC=C(O)C=C1)C(=O)O H69720 [0,2,0,0,0,0|1,0,1]=4 237 B13R1.133 C\C(=C/C1=CC=C(Br)C=C1)[N+](=O)[O-] B51470 [0,2,0,0,0,0|1,0,0]=3 238 B13R1.133 NC1=CC=C(CC(=O)C(=O)O)C=C1 A52242 [0,2,0,0,0,0|1,0,1]=4 239 B13R1.148 C\C(=C/C1=CC=CC(Br)=C1)[N+](=O)[O-] B65526 [0,2,0,0,0,0|1,0,0]=3 240 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O M37956 [0,2,0,0,0,0|0,0,2]=4 241 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O A52956 [0,2,0,0,0,0|0,0,2]=4 242 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O A54162 [0,2,0,0,0,0|0,0,2]=4 243 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O D54779 [0,2,0,0,0,0|0,0,2]=4 244 B11R2.1 BrC1=COC2=C1C=CC=C2 B47829 [1,0,0,1,0,0|2,0,0]=4 245 B11R2.1 BrC1=CSC2=C1C=CC=C2 B47535 [1,0,0,1,0,0|2,0,0]=4 246 B11R2.1 CC1=CCC2=C1C=CC=C2 M52270 [1,0,0,1,0,0|1,0,1]=4 247 B11R2.1 CC1=CNC2=C1C=CC=C2 M13894 [1,0,0,1,0,0|2,0,0]=4 248 B11R2.1 CN1C=CC2=C1C=CC=C2 M68120 [1,0,0,1,0,0|2,0,0]=4 249 B11R2.1 NN1C=CC2=C1C=CC=C2 K64885 [1,0,0,1,0,0|2,0,0]=4 250 B11R2.1 O=C1NCC2=C1C=CC=C2 I12007 [1,0,0,1,0,0|1,0,1]=4 251 B11R2.1 O=[S@]1C=NC2=C1C=CC=C2 B45069 [1,0,0,1,0,0|2,0,0]=4 252 B11R2.20 C1=CC2=CN=CC=C2N=C1 N68351 [1,0,0,1,0,0|2,0,0]=4 253 B11R2.20 C1=CC=C2C=NC=CC2=C1 Q68586 [1,0,0,1,0,0|2,0,0]=4 254 B11R2.20 C1=CC=C2N=CC=NC2=C1 Q69216 [1,0,0,1,0,0|2,0,0]=4 255 B11R2.20 C1=CN=C2C=CC=NC2=C1 N47854 [1,0,0,1,0,0|2,0,0]=4 256 B11R2.20 C1=CN=C2N=CC=CC2=C1 D38003 [1,0,0,1,0,0|2,0,0]=4 257 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 B51041 [1,0,0,1,0,0|1,0,0]=3 258 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 B47828 [1,0,0,1,0,0|1,0,1]=4 259 B11R2.10 BrC1=CC2=C(C=CC=C2)S1 B47534 [1,0,0,1,0,0|1,1,0]=4 260 B11R2.10 CC1=CC2=C(C=CC=C2)C1 M38071 [1,0,0,1,0,0|0,0,1]=3 261 B11R2.10 CC1=CC2=C(C=CC=C2)N1 M13893 [1,0,0,1,0,0|1,0,0]=3 262 B11R2.10 CC1=CC2=C(C=CC=C2)S1 M51663 [1,0,0,1,0,0|0,1,0]=3 263 B11R2.10 CC1=CC2=C(C=CN=C2)N1 M14784 [1,0,0,1,0,0|2,0,0]=4 264 B11R2.10 CC1=CC2=C(C=NC=C2)N1 M12631 [1,0,0,1,0,0|2,0,0]=4 265 B11R2.10 CC1=CC2=CC=CN=C2N1 M0598 [1,0,0,1,0,0|2,0,0]=4 266 B11R2.10 CC1=CC2=NC=CC=C2N1 M25103 [1,0,0,1,0,0|2,0,0]=4 267 B11R2.10 CC1=NC2=C(C=CC=C2)O1 M63131 [1,0,0,1,0,0|1,0,1]=4 268 B11R2.10 CC1=NC2=C(C=CC=C2)S1 M39486 [1,0,0,1,0,0|1,1,0]=4 269 B11R2.10 CN1C=C2C=CC=CC2=N1 M14460 [1,0,0,1,0,0|2,0,0]=4 270 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 C47956 [1,0,0,1,0,0|2,0,0]=4 271 B11R2.10 IC1=CC2=C(C=CC=C2)N1 K47983 [1,0,0,1,0,0|2,0,0]=4 272 B11R2.10 NC1=CC2=C(C=CC=C2)S1 B39092 [1,0,0,1,0,0|1,1,0]=4 273 B11R2.10 O=C1C=C2C=CC=CN2N1 P45223 [1,0,0,1,0,0|2,0,0]=4 274 B11R2.10 O=C1CC2=C(C=CC=C2)C1 K24552 [1,0,0,1,0,0|0,0,1]=3 275 B11R2.10 O=C1CC2=C(C=CC=N2)N1 D0382 [1,0,0,1,0,0|2,0,0]=4 276 B11R2.10 O=C1CC2=C(C=CN=C2)N1 D0077 [1,0,0,1,0,0|2,0,0]=4 277 B11R2.10 O=C1CC2=C(C=NC=C2)N1 D0383 [1,0,0,1,0,0|2,0,0]=4 278 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D0034 [1,0,0,1,0,0|2,0,0]=4 279 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D15765 [1,0,0,1,0,0|2,0,0]=4 280 B11R2.10 O=C1CN2C=CC=CC2=N1 K46529 [1,0,0,1,0,0|2,0,0]=4 281 B11R2.10 O=C1NC2=C(C=CC=C2)N1 H67954 [1,0,0,1,0,0|2,0,0]=4 282 B11R2.10 O=C1OC2=C(C=CC=C2)O1 B44621 [1,0,0,1,0,0|2,0,0]=4 283 B11R2.15 O=CC1=CC2=C(C=CS2)S1 T44688 [0,0,0,1,1,0|2,0,0]=4 284 B11R2.36 CC1=CC2=C(C=C1)NC=C2 M2329 [0,0,0,1,1,0|2,0,0]=4 285 B11R2.36 CC1=CC2=C(C=C1)SC=C2 M51665 [0,0,0,1,1,0|2,0,0]=4 286 B11R2.36 CC1=CC2=C(C=CN2)C=C1 M2330 [0,0,0,1,1,0|2,0,0]=4 287 B11R2.36 CC1=CC2=C(C=CS2)C=C1 M51666 [0,0,0,1,1,0|2,0,0]=4 288 B11R2.36 CC1=CNC2=NC=CC2=C1 M25539 [0,0,0,1,1,0|2,0,0]=4 289 B13R2.10 BrC1=CC=C(C2=CC=CC=C2)S1 B53499 [0,0,0,1,0,1|2,0,0]=4 290 B13R2.10 BrC1=CN(C2=CC=CC=C2)N=C1 B51062 [0,0,0,1,0,1|2,0,0]=4 291 B13R2.10 BrC1=CN=C(C2=CC=CC=C2)O1 B36883 [0,0,0,1,0,1|2,0,0]=4 292 B13R2.10 BrC1=COC(C2=CC=CC=C2)=N1 B50912 [0,0,0,1,0,1|1,0,1]=4 293 B13R2.10 CC1=CNC(C2=CC=CC=C2)=N1 M52284 [0,0,0,1,0,1|1,0,0]=3 294 B13R2.10 CC1=NC(C2=CC=CC=C2)=CN1 M52283 [0,0,0,1,0,1|2,0,0]=4 295 B13R2.10 CC1=NN(C2=CC=CC=C2)C=C1 M52280 [0,0,0,1,0,1|2,0,0]=4 296 B13R2.10 CC1=NNC(C2=CC=CC=C2)=C1 M52281 [0,0,0,1,0,1|2,0,0]=4 297 B13R2.10 IC1=CC=C(C2=CC=CC=C2)S1 K53503 [0,0,0,1,0,1|2,0,0]=4 298 B13R2.10 IC1=CN(C2=CC=CC=C2)N=C1 K68498 [0,0,0,1,0,1|2,0,0]=4 299 B13R2.32 CC1=C(Br)C=NC2=CC=CC=C21 B53702 [0,0,0,1,0,1|2,0,0]=4 300 B13R2.32 CC1=C(Cl)C2=CC=CC=C2N=C1 C24644 [0,0,0,1,0,1|1,0,0]=3 301 B13R2.32 CC1=C(O)C2=CC=CN=C2C=C1 M53899 [0,0,0,1,0,1|1,0,1]=4 302 B13R2.32 CC1=C(O)C=NC2=CC=CC=C21 M53894 [0,0,0,1,0,1|2,0,0]=4 303 B13R2.32 CC1=C([Mg+])C2=CC=CC=C2C=C1 M31716 [0,0,0,1,0,1|1,0,0]=3 304 B13R2.32 CN1C=CC2=C(C=CC=C2)C1=O M53906 [0,0,0,1,0,1|1,0,0]=3 305 B13R2.32 C[C@H]1CCC2=C(C=CC=C2)C1=O M54547 [0,0,0,1,0,1|0,0,2]=4 306 B13R2.32 ClC1=C(Br)C=NC2=CC=CC=C21 B38667 [0,0,0,1,0,1|2,0,0]=4 307 B13R2.32 ClC1=C(I)C=NC2=CC=CC=C21 C6470 [0,0,0,1,0,1|2,0,0]=4 308 B13R2.32 NC1=C(Br)C=NC2=CC=CC=C21 A51052 [0,0,0,1,0,1|2,0,0]=4 309 B13R2.32 NC1=C(Cl)C2=CC=CC=C2N=C1 C62029 [0,0,0,1,0,1|2,0,0]=4 310 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 C51078 [0,0,0,1,0,1|2,0,0]=4 311 B13R2.32 NC1=C(N)C2=CC=CC=C2N=C1 Q66279 [0,0,0,1,0,1|2,0,0]=4 312 B13R2.32 NC1=C(O)C2=CC=CC=C2N=C1 A51341 [0,0,0,1,0,1|1,0,1]=4 313 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 B39639 [0,0,0,1,0,1|2,0,0]=4 314 B13R2.32 OC1=C(Br)C=CC2=CC=CC=C21 B67708 [0,0,0,1,0,1|1,0,1]=4 315 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 C38681 [0,0,0,1,0,1|2,0,0]=4 316 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 K53627 [0,0,0,1,0,1|2,0,0]=4 317 B13R2.32 OC1=C(I)C=NC2=CC=CC=C21 I6887 [0,0,0,1,0,1|1,0,1]=4 318 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 V55310 [0,0,0,1,0,1|2,0,0]=4 319 B13R2.57 O=CC1=CC2=CC=CC=C2C=C1 N64900 [0,0,0,1,0,1|0,0,1]=3 320 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 I3896 [0,0,0,1,0,1|0,0,1]=3 321 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 Q1105 [0,0,0,1,0,1|1,0,1]=4 322 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 F1406 [0,0,0,1,0,1|1,0,0]=3 323 B13R2.15 BrC1=C(C2=CC=CC=C2)OC=N1 B50913 [0,1,0,1,0,0|1,0,1]=4 324 B13R2.15 BrC1=CNN=C1C2=CC=CC=C2 B51063 [0,1,0,1,0,0|2,0,0]=4 325 B13R2.15 CC1=CC=NN1C2=CC=CC=C2 M62966 [0,1,0,1,0,0|2,0,0]=4 326 B13R2.15 CC1=CNN=C1C2=CC=CC=C2 M52282 [0,1,0,1,0,0|1,0,0]=3 327 B13R2.31 O=C1CC(OC2=CC=CC=C2)C1 P13335 [0,1,0,1,0,0|1,0,1]=4 328 B13R2.135 CC1=C(C#N)C2=C(C=CC=C2)N1 M38858 [0,1,0,1,0,0|2,0,0]=4 329 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)N1 M53912 [0,1,0,1,0,0|1,0,0]=3 330 B13R2.135 CC1=C(C=O)C2=C(N=CC=C2)N1 M25752 [0,1,0,1,0,0|2,0,0]=4 331 B13R2.135 CCN1C(C)=CC2=C1C=CC=C2 E54600 [0,1,0,1,0,0|1,0,1]=4 332 B13R2.135 O=CC1=C(Br)SC2=C1C=CC=C2 B50785 [0,1,0,1,0,0|2,0,0]=4 333 B13R2.135 O=CC1=C(Cl)NC2=C1C=CC=C2 C50937 [0,1,0,1,0,0|2,0,0]=4 334 B13R2.135 O=C[C@@H]1C(=O)NC2=C1C=CC=C2 X51176 [0,1,0,1,0,0|2,0,0]=4 335 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=N1 D9735 [0,1,0,1,0,0|2,0,0]=4 336 B13R2.328 CC1=CC(=O)C2=C(C=CC=C2)N1 M53903 [0,1,0,1,0,0|1,0,0]=3 337 B13R2.328 CC1=CC(C)=NC2=CC=CC=C12 D54369 [0,1,0,1,0,0|2,0,0]=4 338 B13R2.328 CC1=CC2=CC=CN=C2C(Cl)=C1 C53729 [0,1,0,1,0,0|2,0,0]=4 339 B13R2.328 CC1=CC2=CC=CN=C2C(O)=C1 M53900 [0,1,0,1,0,0|1,0,1]=4 340 B13R2.328 CC1=CC2=NC=CC=C2C(Br)=C1 B37209 [0,1,0,1,0,0|2,0,0]=4 341 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)O1 M51186 [0,1,0,1,0,0|1,0,0]=3 342 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 B53703 [0,1,0,1,0,0|2,0,0]=4 343 B13R2.328 CC1=NC2=CC=CC=C2C(C)=N1 D52275 [0,1,0,1,0,0|2,0,0]=4 344 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=C1 C53725 [0,1,0,1,0,0|2,0,0]=4 345 B13R2.328 CC1=NC2=CC=CC=C2C(Cl)=N1 C51086 [0,1,0,1,0,0|2,0,0]=4 346 B13R2.328 CC1=NC2=CC=CC=C2C(N)=C1 M69060 [0,1,0,1,0,0|2,0,0]=4 347 B13R2.328 CC1=NC2=CC=CC=C2C(O)=C1 M60829 [0,1,0,1,0,0|1,0,1]=4 348 B13R2.328 CC1=NC2=CC=CC=C2C(O)=N1 M61591 [0,1,0,1,0,0|1,0,1]=4 349 B13R2.328 ClC1=CC2=CC=CC=C2C(Cl)=N1 D5656 [0,1,0,1,0,0|2,0,0]=4 350 B13R2.328 NC1=NC(Cl)=CC2=CC=CC=C21 C51077 [0,1,0,1,0,0|2,0,0]=4 351 B13R2.328 O=C1CC(=O)C2=C(C=CC=C2)N1 Q51171 [0,1,0,1,0,0|2,0,0]=4 352 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 Q67745 [0,1,0,1,0,0|1,0,1]=4 353 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)O1 C68327 [0,1,0,1,0,0|1,0,1]=4 354 B13R2.328 O=C1NC(=S)NC2=C1C=CC=C2 T62223 [0,1,0,1,0,0|2,0,0]=4 355 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 B65464 [0,1,0,1,0,0|2,0,0]=4 356 B13R2.328 OC1=CC(Br)=CC2=CC=CC=C12 B61353 [0,1,0,1,0,0|1,0,1]=4 357 B13R2.328 OC1=CC2=CC=CC=C2C(Br)=C1 B53616 [0,1,0,1,0,0|2,0,0]=4 358 B13R2.328 OC1=CC2=CC=CC=C2C(O)=C1 N60644 [0,1,0,1,0,0|1,0,1]=4 359 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 M61458 [0,1,0,1,0,0|1,0,0]=3 360 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 M53796 [0,1,0,1,0,0|1,0,0]=3 361 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 M53907 [0,1,0,1,0,0|0,0,0]=2 362 B13R2.45 CN1C(C=O)=CC2=C1N=CC=C2 M19102 [0,1,0,1,0,0|1,0,0]=3 363 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 M28682 [0,1,0,1,0,0|1,0,0]=3 364 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 M61712 [0,1,0,1,0,0|2,0,0]=4 365 B13R2.3085 NN1C(=O)C2=C(C=CC=C2)C1=O A67668 [0,1,0,1,0,0|2,0,0]=4 366 B13R2.3085 O=C1C(=O)C2=C(C=CC=C2)C1=O T69116 [0,1,0,1,0,0|1,0,0]=3 367 B13R2.3085 O=C1C2=C(C=CC=C2)C(=O)N1Cl C39456 [0,1,0,1,0,0|2,0,0]=4 368 B13R2.3085 O=C1C2=C(C=CC=C2)C(=O)N1O H37816 [0,1,0,1,0,0|2,0,0]=4 369 B13R2.369 BrC1=CC2=CC=CC=C2C=C1Br D11891 [0,1,0,1,0,0|2,0,0]=4 370 B13R2.369 BrC1=CC2=CC=CC=C2N=C1Br D12593 [0,1,0,1,0,0|2,0,0]=4 371 B13R2.369 CC1=C(N)C=C2N=CC=CC2=C1 M52277 [0,1,0,1,0,0|2,0,0]=4 372 B13R2.369 CC1=CC2=CC=CC=C2N=C1Cl C53724 [0,1,0,1,0,0|1,0,0]=3 373 B13R2.369 CC1=CC2=NC=CC=C2C=C1Br B53708 [0,1,0,1,0,0|2,0,0]=4 374 B13R2.369 CC1=NC2=CC=CC=C2C=C1Br B60030 [0,1,0,1,0,0|2,0,0]=4 375 B13R2.369 CC1=NC2=CC=CC=C2C=C1N M38253 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.369 CC1=NC2=CC=CC=C2N=C1Cl C51083 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.369 C[C@@H]1NC2=C(C=CC=C2)NC1=O M0672 [0,1,0,1,0,0|1,0,1]=4 378 B13R2.369 C[C@@H]1OC2=C(C=CC=C2)NC1=O M51787 [0,1,0,1,0,0|1,0,1]=4 379 B13R2.369 ClC1=CC2=CC=CC=C2N=C1Cl D50728 [0,1,0,1,0,0|2,0,0]=4 380 B13R2.369 ClC1=NC2=CC=CC=C2C=C1Br B0520 [0,1,0,1,0,0|2,0,0]=4 381 B13R2.369 NC1=CC2=CC=CC=C2C=C1I K53740 [0,1,0,1,0,0|2,0,0]=4 382 B13R2.369 NC1=NC2=C(C=CC=C2)OC1=O A7976 [0,1,0,1,0,0|2,0,0]=4 383 B13R2.369 NC1=NC2=CC=CC=C2C=C1Br B38777 [0,1,0,1,0,0|2,0,0]=4 384 B13R2.369 O=C1NC2=C(C=CC=C2)N=C1Cl C11394 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1O H47728 [0,1,0,1,0,0|2,0,0]=4 386 B13R2.369 OC1=CC2=CC=CC=C2N=C1Cl C18445 [0,1,0,1,0,0|2,0,0]=4 387 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 P38188 [0,1,0,1,0,0|0,0,2]=4 388 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 P30012 [0,1,0,1,0,0|0,0,2]=4 389 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 P30011 [0,1,0,1,0,0|0,0,2]=4 390 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)N1 K53902 [0,1,0,1,0,0|1,0,0]=3 391 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)O1 B61955 [0,1,0,1,0,0|1,0,0]=3 392 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)S1 A64883 [0,1,0,1,0,0|1,0,0]=3 393 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 B51360 [0,1,0,1,0,0|2,0,0]=4 394 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)O1 B51183 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.435 NC(=O)C1=CC2=CC=CNC2=N1 P29771 [0,1,0,1,0,0|2,0,0]=4 396 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)N1 B48396 [0,1,0,1,0,0|2,0,0]=4 397 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 B38556 [0,1,0,1,0,0|1,0,0]=3 398 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 B36620 [0,1,0,1,0,0|1,0,0]=3 399 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)N1 A12533 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 T0447 [0,1,0,1,0,0|2,0,0]=4 401 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 P9023 [0,1,0,1,0,0|2,0,0]=4 402 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 F8714 [0,1,0,1,0,0|2,0,0]=4 403 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)N1 P0055 [0,1,0,1,0,0|2,0,0]=4 404 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 T12732 [0,1,0,1,0,0|2,0,0]=4 405 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 K3713 [0,1,0,1,0,0|2,0,0]=4 406 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 B22825 [0,1,0,1,0,0|2,0,0]=4 407 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 B13965 [0,1,0,1,0,0|2,0,0]=4 408 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 P47887 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)C1 D22647 [0,1,0,1,0,0|0,0,2]=4 410 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 K9534 [0,1,0,1,0,0|1,0,1]=4 411 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)O1 D9444 [0,1,0,1,0,0|1,0,1]=4 412 B13R2.435 O=C([O-])C1=NC2=C(C=CC=C2)O1 B37604 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.43 CC1=CN2C=C(C=O)N=C2C=C1 M51366 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 B5218 [0,1,0,1,0,0|1,0,0]=3 415 B13R2.43 O=CC1=CC2=C(C=C(Cl)C=C2)N1 C50939 [0,1,0,1,0,0|1,0,0]=3 416 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 B64748 [0,1,0,1,0,0|1,0,0]=3 417 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)S1 B63212 [0,1,0,1,0,0|1,0,0]=3 418 B13R2.43 O=CC1=CC2=C(C=CC(Cl)=C2)N1 C50938 [0,1,0,1,0,0|1,0,0]=3 419 B13R2.43 O=CC1=CN2C=C(Br)C=CC2=N1 B14166 [0,1,0,1,0,0|2,0,0]=4 420 B13R2.43 O=CC1=CN2C=CC(Br)=CC2=N1 B7939 [0,1,0,1,0,0|2,0,0]=4 421 B13R2.43 O=CC1=NC2=C(C=C(F)C=C2)N1 F47620 [0,1,0,1,0,0|2,0,0]=4 422 B13R2.3028 CC1=C(C)C2=C(C=CC(Br)=C2)N1 B52353 [0,1,0,1,0,0|2,0,0]=4 423 B13R2.3028 CC1=C(C)C2=C(C=CC(Cl)=C2)N1 C52359 [0,1,0,1,0,0|2,0,0]=4 424 B13R2.3028 CC1=C(C)C2=C(C=CC(F)=C2)N1 F52361 [0,1,0,1,0,0|2,0,0]=4 425 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O M68330 [0,1,0,1,0,0|2,0,0]=4 426 B13R2.3028 CN1CC2=C(C=C(Br)C=C2)C1=O B51512 [0,1,0,1,0,0|1,0,1]=4 427 B13R2.3028 CN1CC2=C(C=C(N)C=C2)C1=O A0013 [0,1,0,1,0,0|1,0,1]=4 428 B13R2.3028 CN1CC2=C(C=C(O)C=C2)C1=O H51782 [0,1,0,1,0,0|1,0,1]=4 429 B13R2.3028 C[C@H]1CC2=C(C=C(Cl)C=C2)C1=O C54054 [0,1,0,1,0,0|0,0,2]=4 430 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O B67844 [0,1,0,1,0,0|2,0,0]=4 431 B13R2.3028 O=C1NC2=C(C=C(Cl)C=C2)C1=O C64901 [0,1,0,1,0,0|2,0,0]=4 432 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O F28487 [0,1,0,1,0,0|2,0,0]=4 433 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O K61448 [0,1,0,1,0,0|2,0,0]=4 434 B13R2.3683 BrC1=CC=C2C=C(Br)C=CC2=C1 D53419 [0,1,0,1,0,0|2,0,0]=4 435 B13R2.3683 BrC1=CC=C2C=C(I)C=CC2=C1 B61001 [0,1,0,1,0,0|2,0,0]=4 436 B13R2.3683 BrC1=CN=C2C=C(I)C=CC2=C1 B32308 [0,1,0,1,0,0|2,0,0]=4 437 B13R2.3683 CC1=CC=C2C=C(Br)C=CC2=N1 B38532 [0,1,0,1,0,0|2,0,0]=4 438 B13R2.3683 CC1=CC=C2C=C(Cl)N=CC2=C1 C37650 [0,1,0,1,0,0|2,0,0]=4 439 B13R2.3683 CC1=CC=C2C=C(F)C=CC2=N1 F53735 [0,1,0,1,0,0|2,0,0]=4 440 B13R2.3683 CC1=CC=C2N=C(Br)C=CC2=C1 B53701 [0,1,0,1,0,0|2,0,0]=4 441 B13R2.3683 CC1=CC=C2N=C(C)C=CC2=C1 D68332 [0,1,0,1,0,0|2,0,0]=4 442 B13R2.3683 CC1=CN=C2C=C(Br)C=CC2=C1 B53709 [0,1,0,1,0,0|1,0,0]=3 443 B13R2.3683 CC1=NC=C2C=C(Br)C=CC2=C1 B36715 [0,1,0,1,0,0|2,0,0]=4 444 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 B25671 [0,1,0,1,0,0|2,0,0]=4 445 B13R2.3683 ClC1=CN=C2C=C(Br)C=CC2=C1 B50715 [0,1,0,1,0,0|2,0,0]=4 446 B13R2.3683 FC1=CC=C2C=C(Br)C=CC2=C1 B53420 [0,1,0,1,0,0|2,0,0]=4 447 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 B0908 [0,1,0,1,0,0|2,0,0]=4 448 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 B53721 [0,1,0,1,0,0|2,0,0]=4 449 B13R2.3683 NC1=CC=C2C=C(Br)C=NC2=C1 B61770 [0,1,0,1,0,0|2,0,0]=4 450 B13R2.3683 NC1=CC=C2C=C(F)C=CC2=C1 F53736 [0,1,0,1,0,0|2,0,0]=4 451 B13R2.3683 NC1=CC=C2C=C(O)C=NC2=C1 A51342 [0,1,0,1,0,0|2,0,0]=4 452 B13R2.3683 NC1=CN=C2C=C(Br)C=CC2=C1 B51050 [0,1,0,1,0,0|2,0,0]=4 453 B13R2.3683 NC1=CN=C2C=C(Cl)C=CC2=C1 C51073 [0,1,0,1,0,0|2,0,0]=4 454 B13R2.3683 OC1=CC=C2C=C(Br)C=CC2=C1 B67431 [0,1,0,1,0,0|2,0,0]=4 455 B13R2.3683 OC1=CC=C2C=C(Br)C=NC2=C1 B50906 [0,1,0,1,0,0|2,0,0]=4 456 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 C63906 [0,1,0,1,0,0|2,0,0]=4 457 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 F53620 [0,1,0,1,0,0|2,0,0]=4 458 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2N1 B32055 [0,1,0,1,0,0|1,0,0]=3 459 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2S1 B63343 [0,1,0,1,0,0|1,0,0]=3 460 B13R2.54 O=CC1=CC2=NC=CC(Cl)=C2S1 C12672 [0,1,0,1,0,0|2,0,0]=4 461 B13R2.54 O=CC1=CN2C(Br)=CC=CC2=N1 B7536 [0,1,0,1,0,0|2,0,0]=4 462 B13R2.54 O=CC1=CN2C(Cl)=CC=CC2=N1 C63625 [0,1,0,1,0,0|2,0,0]=4 463 B13R2.54 O=CC1=CN2C=CC=C(Br)C2=N1 B14167 [0,1,0,1,0,0|2,0,0]=4 464 B13R2.155 BrC1=CC=C2C=CC(Br)=CC2=C1 D38459 [0,1,0,1,0,0|2,0,0]=4 465 B13R2.155 BrC1=CN=C2C=CC(I)=CC2=C1 B50726 [0,1,0,1,0,0|2,0,0]=4 466 B13R2.155 CC1=CC2=C(C=CC(=O)O2)C=C1 M61105 [0,1,0,1,0,0|2,0,0]=4 467 B13R2.155 CC1=CC=C2C=CC(Br)=CC2=N1 B23904 [0,1,0,1,0,0|2,0,0]=4 468 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 D55696 [0,1,0,1,0,0|1,0,0]=3 469 B13R2.155 CC1=CC=C2C=CC(Cl)=CC2=N1 C69390 [0,1,0,1,0,0|2,0,0]=4 470 B13R2.155 CC1=CN=C2C=CC(Br)=CC2=C1 B63923 [0,1,0,1,0,0|1,0,0]=3 471 B13R2.155 CC1=NC=C2C=CC(Cl)=CC2=C1 C53732 [0,1,0,1,0,0|2,0,0]=4 472 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 A54232 [0,1,0,1,0,0|2,0,0]=4 473 B13R2.155 NC1=CC=C2N=CC(Br)=CC2=C1 B25009 [0,1,0,1,0,0|2,0,0]=4 474 B13R2.155 NC1=CN=C2C=CC(Cl)=CC2=C1 C60946 [0,1,0,1,0,0|2,0,0]=4 475 B13R2.155 OC1=CC=C2C=CC(Br)=CC2=C1 B53613 [0,1,0,1,0,0|2,0,0]=4 476 B13R2.155 OC1=CC=C2N=CC(Br)=CC2=C1 B50905 [0,1,0,1,0,0|2,0,0]=4 477 B13R2.155 OC1=CC=C2N=CC(I)=CC2=C1 K50958 [0,1,0,1,0,0|2,0,0]=4 478 B13R2.155 OC1=CN=C2C=CC(Cl)=CC2=C1 C50924 [0,1,0,1,0,0|2,0,0]=4 479 B13R2.4856 CN1CC2=CC=CC(N)=C2C1=O A14680 [0,1,0,1,0,0|1,0,1]=4 480 B13R2.4856 O=C1NC2=CC=CC(Br)=C2C1=O B47382 [0,1,0,1,0,0|2,0,0]=4 481 B13R2.4856 O=C1NC2=CC=CC(Cl)=C2C1=O C47390 [0,1,0,1,0,0|2,0,0]=4 482 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O F69164 [0,1,0,1,0,0|2,0,0]=4 483 B13R2.5179 CC1=CC2=CC=CC(N)=C2N=C1 M61364 [0,1,0,1,0,0|1,0,0]=3 484 B13R2.5179 CC1=CC=C2C(Cl)=CC=CC2=N1 C53726 [0,1,0,1,0,0|2,0,0]=4 485 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 M54373 [0,1,0,1,0,0|1,0,0]=3 486 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 M67755 [0,1,0,1,0,0|2,0,0]=4 487 B13R2.5179 ClC1=C2N=CC(Br)=CC2=CC=C1 B38411 [0,1,0,1,0,0|2,0,0]=4 488 B13R2.5179 ClC1=C2N=CC(I)=CC2=CC=C1 C50742 [0,1,0,1,0,0|2,0,0]=4 489 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 F63858 [0,1,0,1,0,0|2,0,0]=4 490 B13R2.5179 NC1=C2N=CC(Br)=CC2=CC=C1 B51047 [0,1,0,1,0,0|2,0,0]=4 491 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 B36899 [0,1,0,1,0,0|2,0,0]=4 492 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 F53619 [0,1,0,1,0,0|2,0,0]=4 493 B13R2.5179 OC1=CC=C2C(O)=CC=CC2=C1 D69657 [0,1,0,1,0,0|2,0,0]=4 494 B13R2.5190 CC1=CC2=C(C=CC(O)=C2)N1C D63491 [0,1,0,1,0,0|2,0,0]=4 495 B13R2.5190 CN1CC2=C(C=CC(Br)=C2)C1=O B51511 [0,1,0,1,0,0|1,0,1]=4 496 B13R2.5190 CN1CC2=C(C=CC(N)=C2)C1=O A0245 [0,1,0,1,0,0|1,0,1]=4 497 B13R2.5190 C[C@H]1CC2=C(C=CC(Cl)=C2)C1=O C54053 [0,1,0,1,0,0|0,0,2]=4 498 B13R2.5190 C[C@H]1CC2=C(C=CC(F)=C2)C1=O F54060 [0,1,0,1,0,0|0,0,2]=4 499 B13R2.5190 O=C1NC2=C(C=CC(Br)=C2)C1=O B9750 [0,1,0,1,0,0|2,0,0]=4 500 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O C38431 [0,1,0,1,0,0|2,0,0]=4 501 B13R2.5190 O=C1NC2=C(C=CC(F)=C2)C1=O F47400 [0,1,0,1,0,0|2,0,0]=4 502 B13R2.5190 O=C1NC2=C(C=CC(I)=C2)C1=O K47409 [0,1,0,1,0,0|2,0,0]=4 503 B13R2.162 CC1=CC2=C(C=C1)OC=CC2=O M63713 [0,1,0,1,0,0|2,0,0]=4 504 B13R2.162 CC1=CC=C2C=CC=C(Br)C2=N1 B53712 [0,1,0,1,0,0|2,0,0]=4 505 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 C53731 [0,1,0,1,0,0|2,0,0]=4 506 B13R2.162 CC1=CC=C2C=NC=C(Br)C2=C1 B9347 [0,1,0,1,0,0|2,0,0]=4 507 B13R2.162 CC1=CC=C2N=CC=C(O)C2=C1 M53898 [0,1,0,1,0,0|2,0,0]=4 508 B13R2.162 CC1=CN=C2C=CC=C(Br)C2=C1 B67826 [0,1,0,1,0,0|1,0,0]=3 509 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 D54370 [0,1,0,1,0,0|2,0,0]=4 510 B13R2.162 CC1=NC2=C(N)C=CC=C2C=C1 M37877 [0,1,0,1,0,0|2,0,0]=4 511 B13R2.162 ClC1=C2C=C(Br)C=NC2=CC=C1 B62347 [0,1,0,1,0,0|2,0,0]=4 512 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 B62031 [0,1,0,1,0,0|2,0,0]=4 513 B13R2.162 NC1=C2C=C(Br)C=NC2=CC=C1 B16895 [0,1,0,1,0,0|2,0,0]=4 514 B13R2.162 NC1=C2C=C(O)C=CC2=CC=C1 A66652 [0,1,0,1,0,0|2,0,0]=4 515 B13R2.162 NC1=CC=C2C=CC=C(Br)C2=C1 B53713 [0,1,0,1,0,0|2,0,0]=4 516 B13R2.162 NC1=CN=C2C=CC=C(Br)C2=C1 B37104 [0,1,0,1,0,0|2,0,0]=4 517 B13R2.162 OC1=C2C=C(Br)C=CC2=CC=C1 B53612 [0,1,0,1,0,0|2,0,0]=4 518 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 B50904 [0,1,0,1,0,0|2,0,0]=4 519 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 F53621 [0,1,0,1,0,0|2,0,0]=4 520 B13R2.162 OC1=C2C=C(F)C=NC2=CC=C1 F50943 [0,1,0,1,0,0|2,0,0]=4 521 B13R2.162 OC1=CC=C2C=CC=C(Br)C2=C1 B53615 [0,1,0,1,0,0|2,0,0]=4 522 B13R2.162 OC1=CC=C2C=CC=C(F)C2=C1 F64850 [0,1,0,1,0,0|2,0,0]=4 523 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O M37436 [0,1,0,1,0,0|2,0,0]=4 524 B13R2.4825 CN1CC2=C(Br)C=CC=C2C1=O B51510 [0,1,0,1,0,0|1,0,1]=4 525 B13R2.4825 CN1CC2=C(C=CC=C2N)C1=O A11582 [0,1,0,1,0,0|1,0,1]=4 526 B13R2.4825 C[C@H]1CC2=C(Br)C=CC=C2C1=O B54047 [0,1,0,1,0,0|0,0,2]=4 527 B13R2.4825 O=C1NC2=C(Br)C=CC=C2C1=O B47383 [0,1,0,1,0,0|2,0,0]=4 528 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O C47391 [0,1,0,1,0,0|2,0,0]=4 529 B9R1.12 O=CC=CC1=CC=CO1 F45509 [1,0,0,0,1,0|1,0,0]=3 530 B9R1.12 O=C\C=C\C1=CC=CO1 F45510 [1,0,0,0,1,0|1,0,0]=3 531 B9R1.6 CC(=O)C1=CN=CN=C1 A7446 [1,0,0,0,1,0|2,0,0]=4 532 B9R1.6 CC(=O)C1=CN=NC=C1 A10222 [1,0,0,0,1,0|2,0,0]=4 533 B9R1.6 CC(=O)C1=NC=CC=N1 A8017 [1,0,0,0,1,0|2,0,0]=4 534 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [1,0,0,0,1,0|2,0,0]=4 535 B9R1.6 CC(=O)C1=NC=NC=C1 A12246 [1,0,0,0,1,0|2,0,0]=4 536 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [1,0,0,0,1,0|2,0,0]=4 537 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [1,0,0,0,1,0|1,0,1]=4 538 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [1,0,0,0,1,0|0,0,2]=4 539 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [1,0,0,0,1,0|1,0,1]=4 540 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [1,0,0,0,1,0|1,0,1]=4 541 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [1,0,0,0,1,0|0,0,2]=4 542 B9R1.6 C[S@](=O)C1=CC=CC=C1 M61814 [1,0,0,0,1,0|1,0,0]=3 543 B9R1.6 C[S@](=O)C1=NC=CC=C1 M43172 [1,0,0,0,1,0|2,0,0]=4 544 B9R1.6 N=C(N)C1=CC=CC=C1 B39428 [1,0,0,0,1,0|2,0,0]=4 545 B9R1.6 NC(=O)C1=CC=CC=C1 B69845 [1,0,0,0,1,0|1,0,0]=3 546 B9R1.6 NC(=O)C1=NC=CC=C1 P60877 [1,0,0,0,1,0|2,0,0]=4 547 B9R1.6 O=C(Cl)C1=CC=NC=C1 N39246 [1,0,0,0,1,0|2,0,0]=4 548 B9R1.6 O=C(Cl)C1=NC=CC=C1 P42299 [1,0,0,0,1,0|2,0,0]=4 549 B9R1.6 O=C(O)C1=NC=CC=C1 P62145 [1,0,0,0,1,0|2,0,0]=4 550 B9R1.6 O=[S@]([O-])C1=CC=CC=C1 S68689 [1,0,0,0,1,0|2,0,0]=4 551 B9R1.13 CC(=O)NC1=CSC=C1 T43173 [1,0,0,0,1,0|2,0,0]=4