0 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y2027 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(O)C1=C(N)C=CC=N1 9430AH [0,0,0,0,0,0|3,0,1]=4 2 B10R1.61 N=C(N)C1=NC=CC=C1Cl 2233AJ [0,0,0,0,0,0|4,0,0]=4 3 B10R1.61 NC(=O)C1=C(N)N=CN=C1 Z2814 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.61 NC1=C(B(O)O)C=CC=N1 3540AA [0,0,0,0,0,0|3,0,1]=4 5 B10R1.61 NC1=CC=NC=C1C(=O)O Y7102 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.61 NC1=NC=NC=C1C(=O)O 5566AH [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 O=C(O)C1=C(F)C=CN=C1 7628AA [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 O=C([O-])C1=CC=CC=C1O M628 [0,0,0,0,0,0|0,0,1]=1 9 B10R1.61 O=C([O-])C1=CC=CC=C1O W0024 [0,0,0,0,0,0|0,0,1]=1 10 B9R1.6 C=C(Br)C1=CC=CC=C1 V9920 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.6 C=C(Br)C1=NC=CC=C1 Y9784 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.6 CC(=O)C1=CC=NC=C1 7859AF [1,0,0,0,0,0|2,0,0]=3 13 B9R1.6 CC(I)C1=CC=CC=C1 7383AJ [1,0,0,0,0,0|2,0,1]=4 14 B9R1.6 CN(N)C1=CC=CC=C1 7753AF [1,0,0,0,0,0|3,0,0]=4 15 B9R1.6 CN(N)C1=CC=CC=C1 7754AF [1,0,0,0,0,0|3,0,0]=4 16 B9R1.6 C[PH](=O)C1=CC=CC=C1 0011AB [1,0,0,0,0,0|2,0,0]=3 17 B9R1.6 NC(=O)C1=NC=CC=C1 7986AJ [1,0,0,0,0,0|2,0,0]=3 18 B9R1.6 O=C(O)C1=CC=CN=C1 7629AF [1,0,0,0,0,0|1,0,0]=2 19 B9R1.6 O=C(O)C1=NC=CC=C1 5114AH [1,0,0,0,0,0|1,0,0]=2 20 B9R1.6 O=C([O-])C1=CC=CC=C1 M138 [1,0,0,0,0,0|0,0,1]=2 21 B9R1.6 O=C([O-])C1=CC=CC=C1 V1440 [1,0,0,0,0,0|0,0,1]=2 22 B9R1.6 O=C([O-])C1=CC=CC=C1 V1449 [1,0,0,0,0,0|0,0,1]=2 23 B9R1.6 O=C([O-])C1=CC=CC=C1 V1986 [1,0,0,0,0,0|0,0,1]=2 24 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 7667AH [1,0,0,0,0,0|2,0,1]=4 25 B9R1.6 O=[PH]([O-])C1=CC=CC=C1 C359 [1,0,0,0,0,0|1,0,1]=3 26 B9R1.15 CC1=C(NN)C=CC=C1 1069AL [1,0,0,0,0,0|3,0,0]=4 27 B9R1.15 N#CC1=C(S)C=CC=C1 Y1771 [1,0,0,0,0,0|1,1,1]=4 28 B9R1.15 N#[N+]C1=CC=CC=C1Cl T270 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.15 OCC1=C(O)C=NC=C1 W7832 [1,0,0,0,0,0|1,0,1]=3 30 B11R1.53 CNC1=CC=CC=C1C(=O)O 8074AF [0,1,0,0,0,0|1,0,0]=2 31 B11R1.53 COC1=C(C(C)Br)C=CC=C1 1291AB [0,1,0,0,0,0|2,0,1]=4 32 B11R1.53 COC1=CC=CC=C1[C@@H](C)N W7850 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.53 COC1=CC=CC=C1[C@H](C)N W7851 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.53 COC1=CC=CN=C1B(O)O V6218 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.53 CSC1=NC=CC=C1C(=O)O Y9981 [0,1,0,0,0,0|1,1,0]=3 36 B11R1.53 N#[N+]C1=C([N+](=O)[O-])C=CC=C1 T274 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.53 NCC1=CC=CC=C1B(O)O 1023AP [0,1,0,0,0,0|2,0,1]=4 38 B11R1.53 NNC1=CC=CC=C1C(=O)O Z1609 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.53 O=C(O)C1=C(CO)C=CN=C1 Y9926 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.53 O=C(O)C1=C([Hg]O)C=CC=C1 7844AF [0,1,0,0,0,0|0,0,0]=1 41 B11R1.87 CC1=CC=CC=C1S(N)(=O)=O R226 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.87 NC1=C(S(=O)(=O)O)C=NC=C1 2655AJ [0,1,0,0,0,0|3,0,0]=4 43 B11R1.87 NC1=CC=CC=C1S(=O)(=O)Cl Z2505 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.87 O=S(=O)(O)C1=C(O)C=CC=C1 7663AF [0,1,0,0,0,0|1,0,0]=2 45 B11R1.87 O=S(=O)(O)C1=CC=CC=C1Br Z2521 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.87 O=S(=O)([O-])C1=C(O)C=CC=C1 5302AF [0,1,0,0,0,0|1,0,1]=3 47 B11R1.87 O=S(=O)([O-])C1=C(O)C=CC=C1 5303AF [0,1,0,0,0,0|1,0,1]=3 48 B11R1.156 CC1=C(C(=O)O)C(N)=NC=C1 4903AB [0,1,0,0,0,0|2,0,0]=3 49 B11R1.156 CC1=NC=CC(C)=C1C(N)=O 1274AC [0,1,0,0,0,0|3,0,0]=4 50 B11R1.156 C[C@@H](O)C1=C(Cl)C=CC=C1Cl 8928AH [0,1,0,0,0,0|2,0,1]=4 51 B11R1.156 C[C@H](O)C1=C(Cl)C=CC=C1Cl 8393AH [0,1,0,0,0,0|2,0,1]=4 52 B11R1.156 O=C(O)C1=C(O)N=CC=C1O X5042 [0,1,0,0,0,0|1,0,0]=2 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|2,0,1]=4 55 B11R1.159 NC1=CC=CC(C(=O)O)=C1N 9418AF [0,1,0,0,0,0|1,0,0]=2 56 B11R1.159 O=C(O)C1=C(Br)C(Cl)=NC=C1 3818AA [0,1,0,0,0,0|2,0,0]=3 57 B11R1.159 OB(O)C1=CC=CC(I)=C1Br Z1306 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.166 CC1=C(C(N)=S)C=CC(Br)=C1 2489AE [0,1,0,0,0,0|2,1,0]=4 59 B11R1.166 CC1=CC(Cl)=C(C(=N)N)C=C1 1656AJ [0,1,0,0,0,0|3,0,0]=4 60 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 2171AB [0,1,0,0,0,0|1,0,1]=3 61 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 Q197 [0,1,0,0,0,0|0,0,0]=1 62 B11R1.166 N=C(N)C1=C(F)C=C(Cl)C=C1 2757AJ [0,1,0,0,0,0|3,0,0]=4 63 B11R1.166 NC(=S)C1=CC=C(F)C=C1F 9148AA [0,1,0,0,0,0|2,1,0]=4 64 B11R1.166 NC1=CC(N)=C(C(=O)O)C=C1 5297AL [0,1,0,0,0,0|1,0,0]=2 65 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 7684AH [0,1,0,0,0,0|0,0,0]=1 66 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 Q822 [0,1,0,0,0,0|0,0,1]=2 67 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 7354AF [0,1,0,0,0,0|2,0,1]=4 68 B11R1.166 OB(O)C1=CC=C(Br)C=C1O Z1485 [0,1,0,0,0,0|1,0,1]=3 69 B11R1.166 OB(O)C1=CC=C(I)C=C1F 4789AB [0,1,0,0,0,0|2,0,1]=4 70 B11R1.167 CC(=O)C1=CC(C)=CN=C1F Y3976 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.167 CC1=CN=C(O)C(B(O)O)=C1 W9945 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.167 N=C(N)C1=CC(F)=CC=C1F 1400AJ [0,1,0,0,0,0|3,0,0]=4 73 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 7841AF [0,1,0,0,0,0|1,0,0]=2 74 B11R1.167 NC1=CC=C(N)C([N+](=O)[O-])=C1 P639 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 6311AB [0,1,0,0,0,0|3,0,0]=4 76 B11R1.167 O=C(Cl)C1=CC(Cl)=CN=C1Cl 9755AE [0,1,0,0,0,0|3,0,0]=4 77 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=N1 9628AJ [0,1,0,0,0,0|2,0,0]=3 78 B11R1.222 NC[C@H](O)C1=CC=CC=C1Cl 3166AC [0,1,0,0,0,0|2,0,1]=4 79 B11R1.222 NC[C@H](O)C1=CC=CC=C1Cl 6826AC [0,1,0,0,0,0|2,0,1]=4 80 B11R1.222 O=C(CBr)C1=NC=CC=C1F 1583AJ [0,1,0,0,0,0|3,0,0]=4 81 B11R1.222 O\N=C(/Cl)C1=CC=CC=C1Cl 9353AD [0,1,0,0,0,0|2,0,0]=3 82 B11R2.1 CC1=NOC2=C1C=CC=N2 8579AB [0,0,0,1,0,0|3,0,0]=4 83 B11R2.1 IC1=CNC2=C1C=CC=C2 2307AJ [0,0,0,1,0,0|3,0,0]=4 84 B11R2.1 NC1=CNC2=C1C=CC=C2 8737AE [0,0,0,1,0,0|3,0,0]=4 85 B11R2.1 OC1=CSC2=CC=CC=C12 Z5532 [0,0,0,1,0,0|1,1,0]=3 86 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 V1332 [0,0,0,1,0,0|2,0,1]=4 87 B9R1.41 CC(=O)C1=C(Cl)C=CS1 4837AC [0,0,0,0,1,0|3,0,0]=4 88 B9R1.41 NC1=C(C(=O)O)C=CS1 W7009 [0,0,0,0,1,0|2,0,0]=3 89 B9R1.41 O=C(O)C1=C(F)SC=C1 1036AC [0,0,0,0,1,0|2,0,0]=3 90 B9R1.41 O=C(O)C1=CSN=C1Cl 5806AC [0,0,0,0,1,0|3,0,0]=4 91 B11R1.86 N=C(N)NC1=C(Cl)C=CC=C1 4355AJ [0,0,0,0,0,1|3,0,0]=4 92 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl 1026AP [0,0,0,0,0,1|2,0,0]=3 93 B11R1.86 O=C(O)CC1=CNC=CC1=O X3979 [0,0,0,0,0,1|1,0,1]=3 94 B11R1.86 O=C(O)CC1=NC=CC=C1Cl Z5258 [0,0,0,0,0,1|2,0,0]=3 95 B8R1.2 CNC1=CC=CC=C1 7883AF [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 NNC1=CC=CC=C1 5128AF [2,0,0,0,0,0|2,0,0]=4 97 B8R1.2 O=CC1=CC=NC=C1 7668AH [2,0,0,0,0,0|1,0,0]=3 98 B8R1.2 O=[IH2]C1=CC=CC=C1 X3757 [2,0,0,0,0,0|1,0,0]=3 99 B8R1.2 O[Hg]C1=CC=CC=C1 7647AF [2,0,0,0,0,0|1,0,0]=3 100 B8R1.5 ClC1=CC=CC=C1Cl 9816AF [2,0,0,0,0,0|2,0,0]=4 101 B8R1.5 OC1=C(F)C=CN=C1 1350AA [2,0,0,0,0,0|2,0,0]=4 102 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 0105AB [1,1,0,0,0,0|2,0,0]=4 103 B10R1.13 N=C(N)C1=CC=C(F)C=C1 Y5354 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.13 NC1=CC=C(B(O)O)C=C1 9495AJ [1,1,0,0,0,0|1,0,1]=4 105 B10R1.13 NC1=CC=C(C(=O)O)C=C1 5560AH [1,1,0,0,0,0|0,0,0]=2 106 B10R1.13 NC1=CC=C(C(=O)O)C=N1 5387AH [1,1,0,0,0,0|1,0,0]=3 107 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 D232 [1,1,0,0,0,0|1,0,0]=3 108 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 0659AD [1,1,0,0,0,0|1,0,1]=4 109 B10R1.15 C[C@H](NO)C1=CC=CC=C1 9770AE [1,1,0,0,0,0|1,0,1]=4 110 B10R1.15 N#C[C@H](O)C1=CC=CC=C1 0124AA [1,1,0,0,0,0|1,0,1]=4 111 B10R1.15 N=C(NN)C1=CC=CC=C1 Y8569 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.15 NCC(=O)C1=CC=CC=C1 L191 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 X2233 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 7631AF [1,1,0,0,0,0|1,0,1]=4 115 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 7632AF [1,1,0,0,0,0|1,0,1]=4 116 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 9805AJ [1,1,0,0,0,0|1,0,1]=4 117 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 7862AF [1,1,0,0,0,0|1,0,1]=4 118 B10R1.113 O=C(O)C1=CC(I)=CC=N1 6714AC [1,1,0,0,0,0|1,0,0]=3 119 B10R1.2 CC1=C(Cl)C=CC=C1CO Z1056 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.2 CSC1=C(O)C(F)=CC=C1 Z0334 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.2 O=CC1=C(Cl)C(F)=CN=C1 Y3601 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.4 C[N+]1=CC=CC=C1\C=N\O 7885AF [1,1,0,0,0,0|2,0,0]=4 123 B10R1.20 COC1=CC=CC=C1NN 6140AD [1,1,0,0,0,0|2,0,0]=4 124 B10R1.20 CSC1=CC=CC=C1C=O I066 [1,1,0,0,0,0|0,1,0]=3 125 B10R1.25 CC1=C(N=O)C=CC(O)=C1 7860AF [1,1,0,0,0,0|2,0,0]=4 126 B10R1.25 O=CC1=CN=C(Cl)C=C1O 3514AJ [1,1,0,0,0,0|1,0,0]=3 127 B10R1.30 C=CC1=CC(Cl)=CC=C1Cl 1914AL [1,1,0,0,0,0|2,0,0]=4 128 B10R1.30 CNC1=C(O)C=CC(N)=C1 9417AJ [1,1,0,0,0,0|2,0,0]=4 129 B10R1.30 NC1=NC=C(F)C=C1C=O 0669AD [1,1,0,0,0,0|2,0,0]=4 130 B10R1.245 C=CC1=C(C)C=CC=C1C Y8170 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.245 CC1=C(C=O)C(Br)=CC=N1 X3721 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.245 NC1=CC=NC(F)=C1C=O 2626AJ [1,1,0,0,0,0|2,0,0]=4 133 B10R1.39 C=CN1C=CC=C1C(=O)O 1021AE [0,1,0,0,1,0|2,0,0]=4 134 B10R1.39 CSC1=C(C(=O)O)C=CS1 Z0803 [0,1,0,0,1,0|1,1,0]=4 135 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 W7073 [0,1,0,0,1,0|2,0,0]=4 136 B10R1.59 CC1=CC(C(=O)O)=C(Cl)S1 N670 [0,1,0,0,1,0|2,0,0]=4 137 B10R1.192 CC1=CSC(N)=C1C(=O)O 4534AD [0,1,0,0,1,0|2,0,0]=4 138 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O W4840 [0,1,0,0,0,1|0,0,0]=2 139 B12R1.224 CC(=O)NC1=CC=CC(N)=C1F Y6271 [0,1,0,0,0,1|2,0,0]=4 140 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Cl X2678 [0,1,0,0,0,1|1,0,0]=3 141 B12R1.233 O=C(O)CC1=CC=C(O)C=C1O W1999 [0,1,0,0,0,1|0,0,0]=2 142 B12R1.371 N\C(CC1=C(Cl)C=CC=C1)=N/O 3353AF [0,1,0,0,0,1|2,0,0]=4 143 B12R1.1009 CC(=O)NC1=C(O)N=CC=C1O 8861AJ [0,1,0,0,0,1|2,0,0]=4 144 B12R1.46 CNC1=C(C(N)=O)C=C(Cl)C=C1 0067AE [0,2,0,0,0,0|2,0,0]=4 145 B12R1.57 CC1=CC=C(B(O)O)C(CO)=C1 Z1358 [0,2,0,0,0,0|1,0,1]=4 146 B12R1.57 COC1=C(C(=N)N)C=CC(Br)=C1 2694AJ [0,2,0,0,0,0|2,0,0]=4 147 B12R1.57 NCC1=CC(Br)=CC=C1C(=O)O 5023AA [0,2,0,0,0,0|1,0,0]=3 148 B12R1.77 N#CC1=C(C(=O)CBr)C=CC=C1 X2068 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.87 CSC1=C(Br)C=CC=C1C(=O)O Z0641 [0,2,0,0,0,0|0,1,0]=3 150 B12R1.87 OCC1=C(Cl)C=CC=C1B(O)O Z1421 [0,2,0,0,0,0|1,0,1]=4 151 B12R1.261 CC(=O)C1=C(C(=O)O)C=CC=N1 I178 [0,2,0,0,0,0|1,0,1]=4 152 B12R1.261 CC(N)C1=C(C(=O)O)C=CC=C1 9994AH [0,2,0,0,0,0|1,0,0]=3 153 B12R1.261 O=C([O-])C1=CC=CC=C1C(=O)[O-] S430 [0,2,0,0,0,0|0,0,2]=4 154 B12R1.283 CCSC1=C(C(=O)O)C=CC=N1 Y8538 [0,2,0,0,0,0|1,1,0]=4 155 B12R1.283 NCCC1=CC=CC=C1C(=O)O 1770AC [0,2,0,0,0,0|1,0,0]=3 156 B12R1.437 CC1=C(C(=O)Br)C(CBr)=CC=C1 Q342 [0,2,0,0,0,0|2,0,0]=4 157 B12R1.437 COC1=CC=CC(F)=C1C(N)=O 7496AB [0,2,0,0,0,0|1,0,0]=3 158 B12R1.894 CC1=C(Cl)C(C(=O)O)=C(Br)C=C1 Z1573 [0,2,0,0,0,0|1,0,0]=3 159 B12R1.894 CC1=C(F)C(C(=O)O)=C(Cl)C=C1 3723AB [0,2,0,0,0,0|1,0,0]=3 160 B12R1.894 CC1=CC=C(F)C(C(=O)Cl)=C1F 8672AD [0,2,0,0,0,0|2,0,0]=4 161 B12R1.894 O=C(Cl)C1=C(F)C(Cl)=CC=C1F 8632AD [0,2,0,0,0,0|2,0,0]=4 162 B12R1.1000 CC1=CC(=O)OC(C)=C1C(=O)O 4167AE [0,2,0,0,0,0|2,0,0]=4 163 B12R1.1000 CC1=CC(Br)=CC(C)=C1C(N)=O Y6009 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.1000 CC1=CC(C)=NC(N)=C1C(=O)O 8335AC [0,2,0,0,0,0|2,0,0]=4 165 B12R1.1000 NC(=O)C1=C(F)C=C(Br)C=C1Br Z1059 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.1000 O=C(Cl)C1=C(F)C=C(F)C=C1F N588 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.3441 COC(=O)C1=[N+]([O-])C=CC=C1C 2335AJ [0,2,0,0,0,0|1,0,1]=4 168 B12R1.440 CNC1=CC=CC(C(=O)O)=C1O 0089AP [0,2,0,0,0,0|0,0,0]=2 169 B12R1.440 O=C(O)C1=CC=CC(CO)=C1F Y9195 [0,2,0,0,0,0|1,0,0]=3 170 B12R1.440 O=CC1=C(O)C(C(=O)O)=CC=C1 X7924 [0,2,0,0,0,0|0,0,0]=2 171 B12R1.511 NC1=C(C(=O)O)C=C(Cl)C=C1F 1517AJ [0,2,0,0,0,0|1,0,0]=3 172 B12R1.511 NC1=CC(N)=C(O)C(C(=O)O)=C1 2213AA [0,2,0,0,0,0|0,0,0]=2 173 B12R1.511 O=C(O)C1=CC(Br)=CC(O)=C1O 1242AC [0,2,0,0,0,0|0,0,0]=2 174 B12R1.511 O=C([O-])C1=C(O)C(I)=CC(I)=C1 5933AL [0,2,0,0,0,0|0,0,1]=3 175 B12R1.893 CC(=O)C1=CC=C(C)C(C)=C1N Y7597 [0,2,0,0,0,0|2,0,0]=4 176 B12R1.893 CC1=C(O)C(O)=CC=C1C(=O)O 8636AA [0,2,0,0,0,0|1,0,0]=3 177 B12R1.893 O=C(O)C1=C(Cl)C(Cl)=C(Cl)C=C1 7028AB [0,2,0,0,0,0|1,0,0]=3 178 B12R1.232 CC(=O)C1=CC(Cl)=C(C)C=C1N Y9468 [0,2,0,0,0,0|2,0,0]=4 179 B12R1.232 CC1=C(C)NC(=O)C(C(=O)O)=C1 Y9297 [0,2,0,0,0,0|1,0,1]=4 180 B12R1.232 O=C(Cl)C1=CC(F)=C(Cl)C=C1Cl F205 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Br 8946AA [0,2,0,0,0,0|1,0,0]=3 182 B12R1.452 COC1=CC=C(C(C)=O)C(N)=C1 9388AH [0,2,0,0,0,0|2,0,0]=4 183 B12R1.1703 NCC(=O)C1=CC=C(F)C=C1F L158 [0,2,0,0,0,0|2,0,0]=4 184 B12R1.1703 N[C@@H](CO)C1=CC=C(F)C=C1O X6902 [0,2,0,0,0,0|1,0,1]=4 185 B12R1.1703 O=C(NO)C1=CC=C(Cl)C=C1O 6760AE [0,2,0,0,0,0|0,0,0]=2 186 B12R1.354 COC(=O)C1=C(F)N=CC(Cl)=C1 Y3826 [0,2,0,0,0,0|2,0,0]=4 187 B12R1.354 C\C(=N\O)C1=CC(O)=CC=C1O X5143 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.453 CC1=CC=C(C#N)C=C1C(=O)O 3202AJ [0,2,0,0,0,0|1,0,0]=3 189 B12R1.453 CSC1=NC(C(=O)O)=C(O)C=N1 3228AJ [0,2,0,0,0,0|2,0,0]=4 190 B12R1.453 NCC1=CC(C(=O)O)=C(O)C=C1 2746AB [0,2,0,0,0,0|0,0,0]=2 191 B12R1.308 CCOC(=O)C1=CC=NC=C1C 8767AB [0,2,0,0,0,0|2,0,0]=4 192 B12R1.308 O=C(\C=N\O)C1=CC=CC=C1Cl 9208AJ [0,2,0,0,0,0|1,0,0]=3 193 B10R1.23 NC(C(=O)O)C1=CC=CO1 X7306 [0,0,1,1,0,0|1,0,1]=4 194 B10R1.23 O=C(O)C(=O)C1=CC=CO1 Y3293 [0,0,1,1,0,0|1,0,0]=3 195 B10R2.7 C1=CC2=CNC=C2C=C1 0763AP [1,0,0,1,0,0|2,0,0]=4 196 B10R2.7 C1=CN=C2OC=CC2=C1 Y8520 [1,0,0,1,0,0|2,0,0]=4 197 B12R2.24 OC1=CC2=CC=CC=C2C=N1 W8331 [0,0,0,1,0,1|2,0,0]=4 198 B12R2.95 O=P1(Cl)OC2=C(C=CC=C2)O1 7483AA [0,0,0,1,0,1|2,0,0]=4 199 B12R2.1081 O=C1CNCC2=C1C=CC=C2 1368AJ [0,1,0,1,0,0|2,0,0]=4 200 B12R2.2028 N=C1NC(=O)C2=C1C=CC=C2 Z6021 [0,1,0,1,0,0|2,0,0]=4 201 B12R2.196 NC1=C2OC=C(Cl)C2=CC=C1 Y8928 [0,1,0,1,0,0|2,0,0]=4 202 B12R2.132 O=C1CNC2=CC=C(Br)C=C12 9806AB [0,1,0,1,0,0|2,0,0]=4 203 B12R2.1 OCC1=CNC2=CC=CC=C12 2717AD [0,1,0,1,0,0|2,0,0]=4 204 B12R2.1 OCC1=CSC2=CC=CC=C12 Y9385 [0,1,0,1,0,0|1,1,0]=4 205 B12R2.18 BrC1=C(Br)C2=CC=CC=C2O1 Z2437 [0,1,0,1,0,0|2,0,0]=4 206 B12R2.18 O=C1OC2=C(C=CC=C2)C1=O 6525AJ [0,1,0,1,0,0|0,0,1]=3 207 B12R1.125 CC(=O)OCC1=C(C)C=CC=C1 5689AF [0,0,0,0,0,2|2,0,0]=4 208 B12R1.125 CC1=CC=CC=C1NCC(=O)O 7454AD [0,0,0,0,0,2|1,0,0]=3 209 B12R1.125 NC1=C(\C=C\C(=O)O)C=CC=C1 8179AF [0,0,0,0,0,2|1,0,0]=3 210 B12R1.125 O=C(Cl)OCC1=CC=CC=C1Cl 5179AB [0,0,0,0,0,2|2,0,0]=4