0 B10R1.113 CC1=CC([C@H](C)N)=CC=C1 W3021 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.113 CC1=CC=CC(C(N)=S)=N1 7874AF [0,0,0,0,0,0|3,1,0]=4 2 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 W7854 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 7862AF [0,0,0,0,0,0|3,0,0]=3 4 B10R1.113 ClC1=CC(C(Br)Br)=CC=C1 6026AL [0,0,0,0,0,0|3,0,1]=4 5 B10R1.113 NC(=O)C1=NC(F)=CN=C1 1523AE [0,0,0,0,0,0|4,0,0]=4 6 B10R1.113 NC(=O)C1=NC=C[N+]([O-])=C1 1978AC [0,0,0,0,0,0|3,0,1]=4 7 B10R1.113 O=C(O)C1=CC(I)=CC=N1 6714AC [0,0,0,0,0,0|3,0,0]=3 8 B10R1.113 O=[N+]([O-])C1=CN=CC(Cl)=C1 W4604 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 0431AA [0,0,0,0,0,0|3,0,0]=3 10 B9R1.2 C=CC1=CC(N)=CC=C1 1464AC [1,0,0,0,0,0|1,0,1]=3 11 B9R1.2 C=CC1=CN=CC(C)=C1 2455AL [1,0,0,0,0,0|2,0,1]=4 12 B9R1.2 CC1=CC(NN)=CC=C1 7665AB [1,0,0,0,0,0|3,0,0]=4 13 B9R1.2 CCC1=CC=C[N+]([O-])=C1 7429AA [1,0,0,0,0,0|1,0,2]=4 14 B9R1.2 CNC1=NC=CC(I)=C1 Z1369 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.2 CSC1=CC(F)=NC=C1 Z1346 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.2 N#[N+]C1=CC(Cl)=CC=C1 T256 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.2 NC1=CC(C=O)=CC=C1 8788AA [1,0,0,0,0,0|1,0,0]=2 18 B9R1.2 NC1=NC=CC(C=O)=N1 8419AA [1,0,0,0,0,0|3,0,0]=4 19 B9R1.6 C=C(Br)C1=CC=CC=C1 V9920 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.6 C=C(Br)C1=NC=CC=C1 Y9784 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.6 CC(=O)C1=CC=NC=C1 7859AF [1,0,0,0,0,0|1,0,0]=2 22 B9R1.6 CC(I)C1=CC=CC=C1 7383AJ [1,0,0,0,0,0|1,0,1]=3 23 B9R1.6 CN(C)C1=CC=NC=C1 5677AH [1,0,0,0,0,0|3,0,0]=4 24 B9R1.6 CN(N)C1=CC=CC=C1 7753AF [1,0,0,0,0,0|2,0,0]=3 25 B9R1.6 CN(N)C1=CC=CC=C1 7754AF [1,0,0,0,0,0|2,0,0]=3 26 B9R1.6 C[PH](=O)C1=CC=CC=C1 0011AB [1,0,0,0,0,0|1,0,0]=2 27 B9R1.6 NC(=O)C1=NC=CC=C1 7986AJ [1,0,0,0,0,0|2,0,0]=3 28 B9R1.6 O=C(O)C1=CC=CN=C1 7629AF [1,0,0,0,0,0|2,0,0]=3 29 B9R1.6 O=C(O)C1=NC=CC=C1 5114AH [1,0,0,0,0,0|2,0,0]=3 30 B9R1.6 O=C([O-])C1=CC=CC=C1 M138 [1,0,0,0,0,0|1,0,0]=2 31 B9R1.6 O=C([O-])C1=CC=CC=C1 V1440 [1,0,0,0,0,0|1,0,0]=2 32 B9R1.6 O=C([O-])C1=CC=CC=C1 V1449 [1,0,0,0,0,0|1,0,0]=2 33 B9R1.6 O=C([O-])C1=CC=CC=C1 V1986 [1,0,0,0,0,0|1,0,0]=2 34 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 7667AH [1,0,0,0,0,0|3,0,0]=4 35 B9R1.6 O=[PH]([O-])C1=CC=CC=C1 C359 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.21 CC1=CC(C(=O)O)=CN=C1C 3056AJ [0,1,0,0,0,0|3,0,0]=4 37 B11R1.21 N=C(N)C1=CC(F)=C(Br)C=C1 2700AJ [0,1,0,0,0,0|3,0,0]=4 38 B11R1.21 NC(=O)C1=CC(Br)=C(N)N=C1 9821AC [0,1,0,0,0,0|3,0,0]=4 39 B11R1.21 NC(=S)C1=CC(Cl)=C(F)C=C1 3592AD [0,1,0,0,0,0|2,1,0]=4 40 B11R1.21 O=C(Cl)C1=CC=C(F)C(Br)=C1 V0688 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.23 CC1=CC(C(O)CN)=CC=C1 0300AA [0,1,0,0,0,0|1,0,2]=4 42 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 1452AJ [0,1,0,0,0,0|1,0,0]=2 43 B11R1.23 NCC(O)C1=CC=CC(F)=C1 3119AC [0,1,0,0,0,0|1,0,2]=4 44 B11R1.23 NC[C@@H](O)C1=CC(Cl)=CC=C1 2970AH [0,1,0,0,0,0|1,0,2]=4 45 B11R1.23 NC[C@H](O)C1=CC(Cl)=CC=C1 3951AA [0,1,0,0,0,0|1,0,2]=4 46 B11R1.23 O=CC(=O)C1=CC(Br)=CC=C1 1099AL [0,1,0,0,0,0|1,0,1]=3 47 B11R1.74 C[C@@H](N)C1=CC(F)=CC(F)=C1 W8376 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 8390AJ [0,1,0,0,0,0|2,0,0]=3 49 B11R1.155 CC(C)(O)C1=CC(O)=CC=C1 Z5119 [0,1,0,0,0,0|0,0,2]=3 50 B11R1.155 CS(=O)(=O)C1=NC=CC(N)=C1 X3608 [0,1,0,0,0,0|3,0,0]=4 51 B11R1.155 NC1=CC(S(=O)(=O)Cl)=CC=C1 Z2693 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.159 CC1=C(S)C(C(C)C)=CC=C1 Z2574 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.159 N=C(N)C1=CC=CC(F)=C1F 1344AJ [0,1,0,0,0,0|3,0,0]=4 54 B11R1.159 NC1=C(Br)C([N+](=O)[O-])=CC=C1 4476AB [0,1,0,0,0,0|3,0,0]=4 55 B11R1.159 NC1=CC=CC(C(=O)O)=C1N 9418AF [0,1,0,0,0,0|2,0,0]=3 56 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 3818AA [0,1,0,0,0,0|3,0,0]=4 57 B11R1.167 CC(=O)C1=CC(C)=CN=C1F Y3976 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.167 CC(=O)C1=NC(C)=CN=C1C 7816AB [0,1,0,0,0,0|3,0,0]=4 59 B11R1.167 CC(=O)C1=NC(Cl)=NC=C1C W9899 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.167 CC1=CC=C(C)C([C@H](C)N)=C1 W6200 [0,1,0,0,0,0|2,0,1]=4 61 B11R1.167 N=C(N)C1=CC(F)=CC=C1F 1400AJ [0,1,0,0,0,0|3,0,0]=4 62 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 7841AF [0,1,0,0,0,0|2,0,0]=3 63 B11R1.167 NC1=CC=C(N)C([N+](=O)[O-])=C1 P639 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.167 O=C(Cl)C1=CC(Cl)=CN=C1Cl 9755AE [0,1,0,0,0,0|3,0,0]=4 65 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=N1 9628AJ [0,1,0,0,0,0|3,0,0]=4 66 B11R1.266 CCC1=CC=CC(C(N)=S)=C1 2270AJ [0,1,0,0,0,0|2,1,0]=4 67 B11R1.266 CCC1=NC=CC(C(C)=O)=C1 9484AL [0,1,0,0,0,0|2,0,0]=3 68 B11R1.266 NC(=O)C1=CC=CC(N=O)=C1 E040 [0,1,0,0,0,0|1,0,1]=3 69 B11R1.266 NCC1=CC=CC(C(=O)O)=N1 8131AA [0,1,0,0,0,0|3,0,0]=4 70 B11R1.266 NNC1=CC(C(=O)O)=CC=C1 W5898 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.266 O=C(O)C1=CC(CBr)=NC=C1 1253AJ [0,1,0,0,0,0|3,0,0]=4 72 B11R2.35 ClC1=CC([C@H]2CO2)=CC=C1 N778 [0,0,0,1,0,0|1,0,2]=4 73 B9R1.35 CC(=O)C1=NC(C)=CS1 Y8372 [0,0,0,0,1,0|3,0,0]=4 74 B9R1.35 CC1=CSC(C(=O)Cl)=C1 Y2029 [0,0,0,0,1,0|3,0,0]=4 75 B9R1.41 CC(=O)C1=C(Cl)C=CS1 4837AC [0,0,0,0,1,0|2,0,0]=3 76 B9R1.41 CC(=O)C1=CNN=C1C X5410 [0,0,0,0,1,0|3,0,0]=4 77 B9R1.41 NC1=C(C(=O)O)C=CS1 W7009 [0,0,0,0,1,0|3,0,0]=4 78 B9R1.41 O=C(O)C1=C(F)SC=C1 1036AC [0,0,0,0,1,0|3,0,0]=4 79 B11R1.157 CC(C)OC1=CC(F)=CC=C1 Z0352 [0,0,0,0,0,1|2,0,1]=4 80 B11R1.157 CC(N)CC1=CC(O)=CC=C1 1936AJ [0,0,0,0,0,1|1,0,1]=3 81 B11R1.157 C[C@@H](N)CC1=CC=CC(O)=C1 1908AJ [0,0,0,0,0,1|1,0,1]=3 82 B11R1.157 NC(=O)NC1=CC(Br)=CC=C1 9396AD [0,0,0,0,0,1|2,0,0]=3 83 B11R1.157 NC(=S)NC1=CC=CC(Cl)=C1 X5300 [0,0,0,0,0,1|2,1,0]=4 84 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 5257AB [0,0,0,0,0,1|3,0,0]=4 85 B8R1.2 CNC1=CC=CC=C1 7883AF [2,0,0,0,0,0|1,0,0]=3 86 B8R1.2 NNC1=CC=CC=C1 5128AF [2,0,0,0,0,0|2,0,0]=4 87 B8R1.2 O=CC1=CC=NC=C1 7668AH [2,0,0,0,0,0|1,0,0]=3 88 B8R1.2 O=[IH2]C1=CC=CC=C1 X3757 [2,0,0,0,0,0|1,0,0]=3 89 B8R1.2 O[Hg]C1=CC=CC=C1 7647AF [2,0,0,0,0,0|1,0,1]=4 90 B8R1.4 CC1=CC(Br)=CC=N1 2699AJ [2,0,0,0,0,0|2,0,0]=4 91 B8R1.4 OC1=CC=CC(O)=C1 O780 [2,0,0,0,0,0|0,0,1]=3 92 B8R1.4 OC1=CC=CC(O)=N1 5119AF [2,0,0,0,0,0|1,0,1]=4 93 B10R1.2 CNC1=CC=CC(Br)=C1C 2219AJ [1,1,0,0,0,0|2,0,0]=4 94 B10R1.2 CSC1=C(O)C(F)=CC=C1 Z0334 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.2 O=CC1=C(Cl)C(F)=CN=C1 Y3601 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.8 CCC1=CC(F)=CC(F)=C1 X9203 [1,1,0,0,0,0|1,0,1]=4 97 B10R1.8 CSC1=CC(F)=CC(Br)=C1 Z0611 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.8 O=CC1=CC(Br)=NC(Br)=C1 3445AB [1,1,0,0,0,0|2,0,0]=4 99 B10R1.10 CC1=CC(CCN)=CC=C1 1118AJ [1,1,0,0,0,0|1,0,1]=4 100 B10R1.10 CC1=CC(CCN)=CC=C1 W6970 [1,1,0,0,0,0|1,0,1]=4 101 B10R1.10 NCCC1=CC(O)=CC=C1 1935AJ [1,1,0,0,0,0|0,0,1]=3 102 B10R1.30 C=CC1=CC(Cl)=CC=C1Cl 1914AL [1,1,0,0,0,0|1,0,1]=4 103 B10R1.30 CNC1=C(O)C=CC(N)=C1 9417AJ [1,1,0,0,0,0|2,0,0]=4 104 B10R1.30 COC1=CC(N)=CC=C1I X6495 [1,1,0,0,0,0|2,0,0]=4 105 B10R1.30 CSC1=CC(C)=CC=C1Cl Z1327 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.30 CSC1=CC(C)=CC=C1F Z1248 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.30 CSC1=CC(I)=CC=C1Br Y3558 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.30 NC1=NC=C(F)C=C1C=O 0669AD [1,1,0,0,0,0|2,0,0]=4 109 B10R1.172 COC1=CC(CBr)=CC=C1 B984 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.176 C=CC1=CC=C(O)C(O)=C1 9031AB [1,1,0,0,0,0|0,0,1]=3 111 B10R1.176 CNC1=CC=C(Cl)C(Cl)=C1 W6130 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.176 COC1=CC(C)=C(C)C=C1 6400AB [1,1,0,0,0,0|2,0,0]=4 113 B10R1.176 CSC1=CC=C(C)C(O)=C1 Y3611 [1,1,0,0,0,0|1,0,0]=3 114 B10R1.176 CSC1=CC=C(F)C(F)=C1 Z0048 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.176 CSC1=CC=C(F)C(O)=C1 Y3947 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.176 NC1=CC(C=O)=CC=C1Cl Y6396 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [1,1,0,0,0,0|1,0,1]=4 118 B10R1.13 CN(C)C1=CC=C(N)C=C1 8439AL [1,1,0,0,0,0|2,0,0]=4 119 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 Z1901 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.13 C[C@@H](N)C1=CC=C(N)C=C1 W7687 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 3889AD [1,1,0,0,0,0|1,0,1]=4 122 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 0105AB [1,1,0,0,0,0|2,0,0]=4 123 B10R1.13 N=C(N)C1=CC=C(F)C=C1 Y5354 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.13 NC1=CC=C(C(=O)O)C=C1 5560AH [1,1,0,0,0,0|1,0,0]=3 125 B10R1.13 NC1=CC=C(C(=O)O)C=N1 5387AH [1,1,0,0,0,0|2,0,0]=4 126 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 D232 [1,1,0,0,0,0|1,0,0]=3 127 B10R1.15 C=C=C(C)C1=NC=CC=C1 9561AF [1,1,0,0,0,0|2,0,0]=4 128 B10R1.15 CNC(=O)C1=NC=CN=C1 4419AJ [1,1,0,0,0,0|2,0,0]=4 129 B10R1.15 CSC(=N)C1=CC=CN=C1 0332AD [1,1,0,0,0,0|2,0,0]=4 130 B10R1.15 CSC(=N)C1=CC=NC=C1 0163AD [1,1,0,0,0,0|2,0,0]=4 131 B10R1.15 CSC(=N)C1=NC=CC=C1 4542AF [1,1,0,0,0,0|2,0,0]=4 132 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 0659AD [1,1,0,0,0,0|0,0,2]=4 133 B10R1.15 C[C@H](NO)C1=CC=CC=C1 9770AE [1,1,0,0,0,0|0,0,2]=4 134 B10R1.15 N=C(NN)C1=CC=CC=C1 Y8569 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.15 NCC(=O)C1=CC=CC=C1 L191 [1,1,0,0,0,0|0,0,0]=2 136 B10R1.28 C[Ge](C)(C)C1=CC=CC=C1 Y1379 [1,1,0,0,0,0|1,1,0]=4 137 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 9417AF [1,1,0,0,0,0|1,1,0]=4 138 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 X2233 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 7631AF [1,1,0,0,0,0|2,0,0]=4 140 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 7632AF [1,1,0,0,0,0|2,0,0]=4 141 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 9805AJ [1,1,0,0,0,0|2,0,0]=4 142 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y2027 [1,1,0,0,0,0|1,0,0]=3 143 B10R1.61 NC1=CC=NC=C1C(=O)O Y7102 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.61 O=C(O)C1=C(F)C=CN=C1 7628AA [1,1,0,0,0,0|2,0,0]=4 145 B10R1.61 O=C([O-])C1=CC=CC=C1O M628 [1,1,0,0,0,0|1,0,0]=3 146 B10R1.61 O=C([O-])C1=CC=CC=C1O W0024 [1,1,0,0,0,0|1,0,0]=3 147 B10R1.14 CCC(=O)C1=CC=C(Cl)S1 0225AE [0,1,0,0,1,0|2,0,0]=4 148 B10R1.14 COC(=O)C1=CC=C(I)O1 9757AL [0,1,0,0,1,0|2,0,0]=4 149 B10R1.31 O=C(O)C1=CC(CO)=CO1 Y6581 [0,1,0,0,1,0|2,0,0]=4 150 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 0035AP [0,1,0,0,0,1|0,0,0]=2 151 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 1952AB [0,1,0,0,0,1|0,0,0]=2 152 B12R1.19 CC(=O)NC1=NC=C(F)C(C)=C1 N472 [0,1,0,0,0,1|2,0,0]=4 153 B12R1.50 CCC(=O)NC1=NC=CC(Cl)=C1 Y6474 [0,1,0,0,0,1|2,0,0]=4 154 B12R1.50 CN[C@@H](C)CC1=CC=CC(O)=C1 9146AH [0,1,0,0,0,1|1,0,1]=4 155 B12R1.224 CC(=O)NC1=CC=CC(N)=C1F Y6271 [0,1,0,0,0,1|1,0,0]=3 156 B12R1.225 C[C@H](N)[C@H](O)C1=CC=CC(O)=C1 2539AH [0,1,0,0,0,1|1,0,1]=4 157 B12R1.225 NC1=CC(C(N)C(=O)O)=CC=C1 Z5992 [0,1,0,0,0,1|2,0,0]=4 158 B12R1.225 O=C(O)C(O)C1=CC(Br)=CC=C1 4295AE [0,1,0,0,0,1|2,0,0]=4 159 B12R1.438 CC(=O)NC1=NC(C=O)=CC=C1 T338 [0,1,0,0,0,1|1,0,1]=4 160 B12R1.23 NC1=CC=C(S(=O)(=O)O)C=C1O 2172AB [0,2,0,0,0,0|2,0,0]=4 161 B12R1.48 CNC1=C(C)C=C(C(=O)O)C=C1 2341AJ [0,2,0,0,0,0|2,0,0]=4 162 B12R1.48 CSC1=CC=C(C(=O)O)C=C1Cl Y3816 [0,2,0,0,0,0|2,0,0]=4 163 B12R1.48 N#CC1=CC=C(C(=O)O)C=C1Br Y9535 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.56 CC(=O)C1=CC=C(O)C(C#N)=C1 5077AB [0,2,0,0,0,0|1,0,0]=3 165 B12R1.56 COC1=C(N)C=CC(C(C)=O)=C1 7565AD [0,2,0,0,0,0|0,0,0]=2 166 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1[O-] 0628AP [0,2,0,0,0,0|2,0,0]=4 167 B12R1.232 CC(=O)C1=CC(Cl)=C(C)C=C1N Y9468 [0,2,0,0,0,0|1,0,0]=3 168 B12R1.232 O=C(Cl)C1=CC(F)=C(Cl)C=C1Cl F205 [0,2,0,0,0,0|2,0,0]=4 169 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Br 8946AA [0,2,0,0,0,0|2,0,0]=4 170 B12R1.367 COC(=O)C1=CC=C(Br)C(Br)=C1 X5465 [0,2,0,0,0,0|1,0,0]=3 171 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 V1638 [0,2,0,0,0,0|0,0,2]=4 172 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 4663AE [0,2,0,0,0,0|0,0,2]=4 173 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 2595AH [0,2,0,0,0,0|0,0,2]=4 174 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 2825AH [0,2,0,0,0,0|0,0,2]=4 175 B12R1.367 O=C(CBr)C1=CC=C(Cl)C(Br)=C1 4999AH [0,2,0,0,0,0|1,0,0]=3 176 B12R1.367 O=C(CBr)C1=CC=C(F)C(F)=C1 Y9035 [0,2,0,0,0,0|1,0,0]=3 177 B12R1.367 OCC(O)C1=CC(O)=C(O)C=C1 W2004 [0,2,0,0,0,0|0,0,2]=4 178 B12R1.893 CC(=O)C1=CC=C(C)C(C)=C1N Y7597 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.893 CC1=C(O)C(O)=C(C(C)C)C=C1 5722AF [0,2,0,0,0,0|1,0,1]=4 180 B12R1.893 CC1=C(O)C(O)=CC=C1C(=O)O 8636AA [0,2,0,0,0,0|1,0,0]=3 181 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Cl)C=C1 7028AB [0,2,0,0,0,0|2,0,0]=4 182 B12R1.1005 NC1=C(I)C=C(C(=O)O)C=C1Br X5454 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.17 CC1=CC(C(=O)N=C=S)=CC=C1 9071AD [0,2,0,0,0,0|1,0,1]=4 184 B12R1.17 CCOC(=O)C1=NC(O)=CC=C1 7589AB [0,2,0,0,0,0|1,0,0]=3 185 B12R1.17 CNCC(=O)C1=CC(F)=CC=C1 5553AC [0,2,0,0,0,0|1,0,0]=3 186 B12R1.17 CNCC(=O)C1=CC(O)=CC=C1 4658AA [0,2,0,0,0,0|0,0,0]=2 187 B12R1.17 CNCC(=O)C1=CC(O)=CC=C1 Y1218 [0,2,0,0,0,0|0,0,0]=2 188 B12R1.17 CONC(=O)C1=CC(Br)=CN=C1 Y3702 [0,2,0,0,0,0|2,0,0]=4 189 B12R1.17 O=C(N=C=S)C1=CC(Cl)=CC=C1 7587AE [0,2,0,0,0,0|1,0,1]=4 190 B12R1.24 CNC(=O)C1=C(Cl)C(Cl)=NC=C1 Z0519 [0,2,0,0,0,0|2,0,0]=4 191 B12R1.354 CNC(=O)C1=C(F)N=CC(Br)=C1 Z0070 [0,2,0,0,0,0|2,0,0]=4 192 B12R1.354 COC(=O)C1=C(F)N=CC(Cl)=C1 Y3826 [0,2,0,0,0,0|2,0,0]=4 193 B12R1.354 C\C(=N\O)C1=CC(O)=CC=C1O X5143 [0,2,0,0,0,0|0,0,1]=3 194 B12R1.358 COC(=O)C1=CC(Cl)=NC(Br)=C1 Y0527 [0,2,0,0,0,0|2,0,0]=4 195 B12R1.358 NCC(=O)C1=CC(F)=CC(F)=C1 1450AJ [0,2,0,0,0,0|1,0,0]=3 196 B12R1.435 COC(=O)C1=CC(CBr)=CN=C1 Y4447 [0,2,0,0,0,0|2,0,0]=4 197 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 X2835 [0,2,0,0,0,0|1,0,0]=3 198 B12R1.435 COC(=O)C1=CC=CC(NN)=C1 Y6246 [0,2,0,0,0,0|1,0,0]=3 199 B12R1.435 COC(=O)C1=NC=CC(CBr)=C1 3465AB [0,2,0,0,0,0|2,0,0]=4 200 B12R1.435 COC1=CC(\C(N)=N\O)=CC=C1 Y9950 [0,2,0,0,0,0|1,0,1]=4 201 B12R1.11 CSC1=CC(Br)=CC(C(=O)O)=C1 Z0610 [0,2,0,0,0,0|1,1,0]=4 202 B12R1.11 CSC1=CC(F)=CC(C(=O)O)=C1 Z0609 [0,2,0,0,0,0|1,1,0]=4 203 B12R1.511 NC1=C(C(=O)O)C=C(Cl)C=C1F 1517AJ [0,2,0,0,0,0|2,0,0]=4 204 B12R1.511 NC1=CC(N)=C(O)C(C(=O)O)=C1 2213AA [0,2,0,0,0,0|2,0,0]=4 205 B12R1.511 O=C(O)C1=CC(Br)=CC(O)=C1O 1242AC [0,2,0,0,0,0|1,0,0]=3 206 B12R1.511 O=C([O-])C1=C(O)C(I)=CC(I)=C1 5933AL [0,2,0,0,0,0|2,0,0]=4 207 B12R1.128 CS(=O)(=O)C1=CC(F)=CC=C1F 8007AD [0,2,0,0,0,0|2,0,0]=4 208 B12R1.436 COC1=CC=CC(C(C)(C)N)=C1 1782AA [0,2,0,0,0,0|1,0,1]=4 209 B12R1.87 CSC1=C(Br)C=CC=C1C(=O)O Z0641 [0,2,0,0,0,0|2,0,0]=4 210 B12R1.440 CNC1=CC=CC(C(=O)O)=C1O 0089AP [0,2,0,0,0,0|2,0,0]=4 211 B12R1.440 O=C(O)C1=CC=CC(CO)=C1F Y9195 [0,2,0,0,0,0|1,0,0]=3 212 B12R1.440 O=CC1=C(O)C(C(=O)O)=CC=C1 X7924 [0,2,0,0,0,0|1,0,1]=4 213 B12R1.894 CC1=C(Cl)C(C(=O)O)=C(Br)C=C1 Z1573 [0,2,0,0,0,0|2,0,0]=4 214 B12R1.894 CC1=C(F)C(C(=O)O)=C(Cl)C=C1 3723AB [0,2,0,0,0,0|2,0,0]=4 215 B12R1.894 CC1=CC=C(F)C(C(=O)Cl)=C1F 8672AD [0,2,0,0,0,0|2,0,0]=4 216 B12R1.894 O=C(Cl)C1=C(F)C(Cl)=CC=C1F 8632AD [0,2,0,0,0,0|2,0,0]=4 217 B12R1.46 CNC1=C(C(N)=O)C=C(Cl)C=C1 0067AE [0,2,0,0,0,0|2,0,0]=4 218 B12R1.46 CSC1=NC=C(F)C=C1C(C)=O Y5004 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.453 CC1=CC=C(C#N)C=C1C(=O)O 3202AJ [0,2,0,0,0,0|2,0,0]=4 220 B12R1.453 NCC1=CC(C(=O)O)=C(O)C=C1 2746AB [0,2,0,0,0,0|2,0,0]=4 221 B12R1.258 CN(C)C1=CC(B(O)O)=CC=C1 N812 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.258 C[C@H](N)C1=CC=CC(C(=O)O)=C1 9144AH [0,2,0,0,0,0|1,0,1]=4 223 B12R1.279 CCOC1=CC=CC(C(=O)O)=N1 5938AB [0,2,0,0,0,0|2,0,0]=4 224 B12R1.279 CCOC1=CN=CC(C(=O)O)=C1 9936AL [0,2,0,0,0,0|2,0,0]=4 225 B12R1.279 CNCC1=CC=CC(C(=O)O)=C1 2350AJ [0,2,0,0,0,0|2,0,0]=4 226 B12R1.279 NCCC1=CC=CC(C(=O)O)=C1 1690AB [0,2,0,0,0,0|2,0,0]=4 227 B10R1.23 O=C(O)C(=O)C1=CC=CO1 Y3293 [0,0,1,1,0,0|2,0,0]=4 228 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 8732AD [0,0,0,1,0,1|1,0,1]=4 229 B12R2.132 O=C1CNC2=CC=C(Br)C=C12 9806AB [0,1,0,1,0,0|1,0,0]=3 230 B8R1.7 CC(=O)C1=CC=NN1 9154AA [1,0,0,0,1,0|2,0,0]=4 231 B10R1.18 CC(=O)CC1=NC=CC=N1 1768AC [1,0,0,0,0,1|2,0,0]=4 232 B10R1.18 NC(N)=NC1=CC=CC=C1 Y8090 [1,0,0,0,0,1|2,0,0]=4 233 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 9362AB [1,0,0,0,0,1|2,0,0]=4 234 B12R1.226 CC(=O)OCC1=CC(Br)=CC=N1 9997AA [0,0,0,0,0,2|2,0,0]=4