0 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 C=C(C)C1=CC=C(O)C=C1 5917AB [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,0,0,0,0,0|1,0,0]=1 3 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC(=O)C1=CN=C(C)N=C1 4912AJ [0,0,0,0,0,0|4,0,0]=4 5 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 CC(=O)C1=NC=C(C)N=C1 9503AH [0,0,0,0,0,0|4,0,0]=4 7 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 0919AB [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,0,0,0,0,0|3,0,1]=4 9 B10R1.13 CC(N)C1=CC=C(O)C=C1 3888AD [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC(O)C1=CC=C(N)C=C1 7206AA [0,0,0,0,0,0|1,0,1]=2 11 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,0,0,0,0,0|1,0,1]=2 12 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 O143 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 2564AB [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC1=CN=C(B(O)O)C=C1 X0752 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 CC1=CN=C(B([O-])O)C=C1 X1550 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.13 CC1=CN=C(C(=O)O)N=C1 Z5426 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 CC1=NC=C(B(O)O)C=C1 X0926 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 CC1=NC=C(B(O)O)C=C1 Z7105 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.13 CN(C)C1=NC=C(N)C=C1 Z8075 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 5861AC [0,0,0,0,0,0|3,0,0]=3 21 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.13 C[C@H](N)C1=CC=C(Cl)C=C1 8310AB [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [0,0,0,0,0,0|2,0,1]=3 25 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [0,0,0,0,0,0|2,0,1]=3 26 B10R1.13 C[N+]1=CC=C(B(O)O)C=C1 V5501 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2844AJ [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 N=C(N)C1=CC=C(N)C=C1 W8418 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 Z4383 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 NC(=O)C1=CN=C(N)C=C1 Z2495 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.13 NC(=O)C1=CN=C(N)C=N1 4750AC [0,0,0,0,0,0|3,0,0]=3 32 B10R1.13 NC(=O)C1=CN=C(O)C=C1 U983 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 NC(=O)C1=NC=C(N)C=N1 8288AB [0,0,0,0,0,0|3,0,0]=3 34 B10R1.13 NC(=O)C1=NN=C(O)C=C1 6449AJ [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 NC(=S)C1=CN=C(Cl)C=C1 3526AJ [0,0,0,0,0,0|3,1,0]=4 36 B10R1.13 NC(=S)C1=CN=C(N)C=C1 7552AB [0,0,0,0,0,0|2,1,0]=3 37 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [0,0,0,0,0,0|1,0,0]=1 38 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7848AF [0,0,0,0,0,0|0,0,1]=1 39 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.13 NC1=CC=C(C(F)F)N=C1 5273AC [0,0,0,0,0,0|3,0,1]=4 41 B10R1.13 NC1=CN=C(C(=O)O)N=C1 Z4892 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.13 O=C(O)C1=CC=C(Br)N=N1 9979AB [0,0,0,0,0,0|3,0,0]=3 43 B10R1.13 O=C([O-])C1=NN=C(Cl)C=C1 Y4602 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [0,0,0,0,0,0|2,0,0]=2 45 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [0,0,0,0,0,0|2,0,0]=2 46 B10R1.13 OB(O)C1=NC=C(F)C=C1 V9453 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.1 C#CC1=CC=C(I)C=C1 1951AC [1,0,0,0,0,0|2,0,1]=4 48 B9R1.1 C=CC1=CC=C(C)N=C1 Y1711 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,0,0,0,0,0|1,1,1]=4 51 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [1,0,0,0,0,0|2,0,1]=4 53 B9R1.1 CCC1=CC=C(S)C=C1 S243 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.1 CNC1=CC=C(I)C=C1 W7309 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 CNC1=CC=C(N)C=C1 F921 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [1,0,0,0,0,0|2,0,1]=4 57 B9R1.1 ClCC1=CC=C(I)C=C1 Y6287 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.1 N#CC1=CC=C(S)C=C1 V7013 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.1 NC1=CC=C(CO)C=N1 U962 [1,0,0,0,0,0|1,0,1]=3 60 B9R1.1 NCC1=CC=C(I)C=C1 5275AB [1,0,0,0,0,0|2,0,1]=4 61 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 O=CC1=NN=C(O)C=C1 V9271 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 OCC1=NC=C(F)C=C1 3321AB [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 CC(=O)C1=CC=NN=C1 W6606 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [1,0,0,0,0,0|3,0,0]=4 68 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,0,0,0,0,0|3,0,0]=4 69 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [1,0,0,0,0,0|2,0,1]=4 70 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [1,0,0,0,0,0|2,0,1]=4 71 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.6 N=C(N)C1=CC=NC=C1 4648AC [1,0,0,0,0,0|3,0,0]=4 74 B9R1.6 NC(=O)C1=CC=NN=C1 Z3384 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [1,0,0,0,0,0|2,0,0]=3 76 B9R1.6 NC(=O)C1=NC=CC=N1 Z3390 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.6 O=C(Br)C1=CC=CC=C1 9276AB [1,0,0,0,0,0|1,0,0]=2 78 B9R1.6 O=C(Cl)C1=NC=CN=C1 Y8139 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.6 O=C(O)C1C=CCC=C1 Y5447 [1,0,0,0,0,0|0,0,2]=3 80 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [1,0,0,0,0,0|1,1,0]=3 81 B9R1.6 O=C([O-])C1=CC=CC=C1 V1445 [1,0,0,0,0,0|0,0,1]=2 82 B9R1.6 O=C([O-])C1=CC=NC=N1 2020AH [1,0,0,0,0,0|2,0,1]=4 83 B9R1.6 O=S(O)C1=CC=CC=C1 9279AB [1,0,0,0,0,0|1,0,0]=2 84 B9R1.6 O=[N+]([O-])C1=CC=NC=C1 N230 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.6 O=[N+]([O-])C1=CN=CC=C1 X3371 [1,0,0,0,0,0|2,0,1]=4 86 B9R1.6 OB(O)C1=NC=CC=C1 X0604 [1,0,0,0,0,0|2,0,1]=4 87 B11R1.3 C#CC1=CC=C(B(O)O)C=C1 X0664 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 5858AB [0,1,0,0,0,0|2,0,0]=3 89 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 5524AD [0,1,0,0,0,0|3,0,0]=4 90 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 X2027 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.3 CCC1=CC=C(C(=O)O)N=C1 2011AC [0,1,0,0,0,0|2,0,0]=3 92 B11R1.3 CNC1=NC=C(C(=O)O)C=C1 2293AB [0,1,0,0,0,0|1,0,0]=2 93 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 7697AB [0,1,0,0,0,0|2,0,0]=3 94 B11R1.3 COC1=CN=C(C(C)=O)C=C1 V5184 [0,1,0,0,0,0|3,0,0]=4 95 B11R1.3 COC1=CN=C(C(N)=O)C=C1 V8588 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.3 COC1=NC=C(C(N)=O)C=C1 V7449 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [0,1,0,0,0,0|2,0,0]=3 98 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 0356AA [0,1,0,0,0,0|1,0,2]=4 99 B11R1.3 N#CC1=CC=C(C(=O)O)C=N1 X4351 [0,1,0,0,0,0|1,0,1]=3 100 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 1503AC [0,1,0,0,0,0|1,0,1]=3 101 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [0,1,0,0,0,0|2,0,0]=3 102 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 2161AC [0,1,0,0,0,0|2,0,0]=3 103 B11R1.3 O=[N+]([O-])C1=CC=C(CS)C=C1 0403AQ [0,1,0,0,0,0|2,0,1]=4 104 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 0487AB [0,1,0,0,0,0|2,0,0]=3 106 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 1016AA [0,1,0,0,0,0|2,0,0]=3 107 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3478AC [0,1,0,0,0,0|2,0,0]=3 108 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5497AL [0,1,0,0,0,0|2,0,0]=3 109 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X3142 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 0063AQ [0,1,0,0,0,0|2,0,1]=4 111 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 8878AL [0,1,0,0,0,0|2,0,1]=4 112 B11R1.19 CS(=N)(=O)C1=CC=C(Cl)C=C1 9065AJ [0,1,0,0,0,0|3,0,0]=4 113 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 5137AJ [0,1,0,0,0,0|2,0,1]=4 114 B11R1.19 O=S(=O)(F)C1=CC=C(F)C=C1 N508 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.19 O=S(=O)([O-])C1=CC=C(Br)C=C1 L660 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.19 O=S(=O)([O-])C1=CC=C(Cl)C=C1 L693 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.19 O=S(=O)([O-])C1=CC=C(O)C=C1 5125AF [0,1,0,0,0,0|2,0,1]=4 118 B11R1.19 O=[As](O)(O)C1=CC=C(O)C=C1 7666AF [0,1,0,0,0,0|2,0,0]=3 119 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)N=C1 1001AD [0,1,0,0,0,0|3,0,0]=4 120 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,1,0,0,0,0|2,0,0]=3 121 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [0,1,0,0,0,0|2,0,1]=4 122 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [0,1,0,0,0,0|2,1,0]=4 123 B11R1.21 CC1=C(Cl)N=CC(C(N)=O)=C1 7444AE [0,1,0,0,0,0|3,0,0]=4 124 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 5832AD [0,1,0,0,0,0|2,1,0]=4 125 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Z0083 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.21 CC1=CC=C(B(O)O)C=C1O X0622 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [0,1,0,0,0,0|3,0,0]=4 128 B11R1.21 CC1=CC=C(C(=O)O)N=C1C 2856AC [0,1,0,0,0,0|2,0,0]=3 129 B11R1.21 CC1=CC=C(C(=O)O)NC1=O 2494AA [0,1,0,0,0,0|2,0,0]=3 130 B11R1.21 CC1=NC(C(=O)O)=CNC1=O 2046AC [0,1,0,0,0,0|3,0,0]=4 131 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br Y3916 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.21 CC1=NC=C(C(=O)O)N=C1C 6284AA [0,1,0,0,0,0|3,0,0]=4 133 B11R1.21 CN1N=C(C(=O)O)C=CC1=O 7070AC [0,1,0,0,0,0|3,0,0]=4 134 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 2235AJ [0,1,0,0,0,0|3,0,0]=4 135 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 5315AH [0,1,0,0,0,0|3,0,0]=4 136 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 Y4731 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 2075AJ [0,1,0,0,0,0|3,0,0]=4 138 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 Y6979 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [0,1,0,0,0,0|2,0,0]=3 140 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 Z8676 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [0,1,0,0,0,0|2,0,0]=3 142 B11R1.21 NC(=O)C1=CC=C(N)C(N)=C1 8382AE [0,1,0,0,0,0|1,0,0]=2 143 B11R1.21 NC(=O)C1=CN=C(Cl)C(Cl)=C1 9219AE [0,1,0,0,0,0|3,0,0]=4 144 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=N1 2971AE [0,1,0,0,0,0|1,0,0]=2 145 B11R1.21 NC1=C(Cl)N=CC(C(=O)O)=C1 V7497 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 5309AE [0,1,0,0,0,0|1,0,0]=2 147 B11R1.21 NC1=CC(B(O)O)=CC=C1F V8424 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.21 NC1=CC(C(=O)O)=CC=C1O D461 [0,1,0,0,0,0|1,0,0]=2 149 B11R1.21 NC1=CC([N+](=O)[O-])=CN=C1N Y8840 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.21 NC1=CC=C(B(O)O)C=C1F X1927 [0,1,0,0,0,0|1,0,1]=3 151 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 5955AB [0,1,0,0,0,0|2,0,0]=3 152 B11R1.21 O=C(O)C1=CC(F)=C(F)N=C1 Y4245 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 0275AP [0,1,0,0,0,0|1,0,0]=2 154 B11R1.21 O=C(O)C1=CC(O)=C(I)N=C1 8820AB [0,1,0,0,0,0|2,0,0]=3 155 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 0937AA [0,1,0,0,0,0|2,0,0]=3 156 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 1126AD [0,1,0,0,0,0|2,0,0]=3 157 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 Z4560 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 Y4247 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.21 O=C([O-])C1=CC=C(F)C(F)=C1 3820AL [0,1,0,0,0,0|1,0,1]=3 160 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(O)=C1 0160AB [0,1,0,0,0,0|2,0,1]=4 161 B11R1.21 OB(O)C1=CC=C(Br)C(Br)=C1 Z8666 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.21 OB(O)C1=CC=C(Cl)C(Br)=C1 V2870 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.21 OB(O)C1=CC=C(F)C(Br)=C1 Z7247 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,1,0,0,0,0|2,0,0]=3 165 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 P247 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,1,0,0,0,0|2,0,1]=4 167 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,1,0,0,0,0|2,0,1]=4 168 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,1,0,0,0,0|3,0,0]=4 169 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,1,0,0,0,0|3,0,0]=4 170 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 W5141 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.22 COC(=O)C1=NC=C(N)C=N1 3573AL [0,1,0,0,0,0|2,0,0]=3 172 B11R1.22 COC(=O)C1=NN=C(N)C=C1 V9902 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,1,0,0,0,0|2,0,1]=4 174 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [0,1,0,0,0,0|2,0,0]=3 175 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 2661AL [0,1,0,0,0,0|2,0,0]=3 176 B11R1.22 N#CC(=O)C1=CC=C(F)C=C1 7543AE [0,1,0,0,0,0|2,0,0]=3 177 B11R1.22 N=C(NO)C1=CC=C(N)N=C1 1482AH [0,1,0,0,0,0|2,0,0]=3 178 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,1,0,0,0,0|1,0,0]=2 179 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,1,0,0,0,0|2,0,0]=3 180 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 1817AC [0,1,0,0,0,0|2,0,1]=4 181 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 X4763 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 3000AE [0,1,0,0,0,0|2,0,1]=4 183 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,1,0,0,0,0|2,0,1]=4 184 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,1,0,0,0,0|2,0,1]=4 185 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,1,0,0,0,0|2,0,1]=4 186 B11R1.22 NNC(=O)C1=CC=C(Cl)C=N1 7212AA [0,1,0,0,0,0|3,0,0]=4 187 B11R1.22 NNC(=O)C1=CN=C(N)C=C1 Z3023 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.22 NNC(=O)C1=NC=C(O)C=C1 Z2983 [0,1,0,0,0,0|3,0,0]=4 189 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 X6771 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 W7901 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.22 O=C(CBr)C1=CC=C(Br)N=C1 Y6042 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 Y4820 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 5935AC [0,1,0,0,0,0|2,0,0]=3 194 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,1,0,0,0,0|2,0,0]=3 195 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,1,0,0,0,0|1,0,0]=2 197 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 A976 [0,1,0,0,0,0|1,0,1]=3 198 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,1,0,0,0,0|1,0,1]=3 199 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,1,0,0,0,0|2,0,1]=4 200 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 9497AJ [0,1,0,0,0,0|2,0,0]=3 201 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 2731AB [0,1,0,0,0,0|2,0,0]=3 202 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [0,1,0,0,0,0|2,0,0]=3 203 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [0,1,0,0,0,0|2,0,0]=3 204 B11R1.166 CC(=O)C1=C(C)NC(=O)C=C1 4868AE [0,1,0,0,0,0|3,0,0]=4 205 B11R1.166 CC(=O)C1=CC=C(I)C=C1O 5230AB [0,1,0,0,0,0|2,0,0]=3 206 B11R1.166 CC(=O)C1=CC=C(N)C=C1C 4920AB [0,1,0,0,0,0|1,0,0]=2 207 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 2069AF [0,1,0,0,0,0|3,0,0]=4 208 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F Z7758 [0,1,0,0,0,0|3,0,0]=4 209 B11R1.166 CC1=C(C(=N)N)C=CC(Cl)=C1 1883AF [0,1,0,0,0,0|3,0,0]=4 210 B11R1.166 CC1=C(C(N)=S)C=CC(Cl)=C1 8169AD [0,1,0,0,0,0|2,1,0]=4 211 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O V3028 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 Y8311 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 1357AA [0,1,0,0,0,0|2,0,0]=3 214 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 1620AJ [0,1,0,0,0,0|2,0,0]=3 215 B11R1.166 CC1=CC=C(C(=O)O)C(I)=C1 2096AL [0,1,0,0,0,0|1,0,0]=2 216 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 Y9176 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 2277AJ [0,1,0,0,0,0|2,0,0]=3 218 B11R1.166 CC1=CN=C(C(=O)O)C(N)=N1 0411AC [0,1,0,0,0,0|3,0,0]=4 219 B11R1.166 CC1=NC(Cl)=NC=C1C(=O)O Y5325 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.166 CC1=NC(N)=CC=C1C(=O)O 0478AC [0,1,0,0,0,0|1,0,0]=2 221 B11R1.166 CC1=NC(N)=NC=C1C(=O)O Y4052 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.166 CC1=NC=C(C(=O)O)C(Cl)=N1 5812AC [0,1,0,0,0,0|3,0,0]=4 223 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 X9715 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.166 CN(C)C1=CC=C(N)C=C1Br V8153 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl 6600AE [0,1,0,0,0,0|3,0,0]=4 226 B11R1.166 N=C(N)C1=C(F)C=C(F)C=C1 1881AF [0,1,0,0,0,0|3,0,0]=4 227 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F 3281AH [0,1,0,0,0,0|3,0,0]=4 228 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 1384AJ [0,1,0,0,0,0|3,0,0]=4 229 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 4921AH [0,1,0,0,0,0|3,0,0]=4 230 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1F 5593AH [0,1,0,0,0,0|3,0,0]=4 231 B11R1.166 N=C(N)C1=CC=C(F)C=C1Cl 5020AH [0,1,0,0,0,0|3,0,0]=4 232 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 1045AA [0,1,0,0,0,0|2,0,0]=3 233 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=N1 2582AB [0,1,0,0,0,0|3,0,0]=4 234 B11R1.166 NC(=O)C1=CN=C(O)C=C1O 6041AJ [0,1,0,0,0,0|3,0,0]=4 235 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N W7761 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.166 NC1=C(B(O)O)C=CC(Cl)=C1 6294AC [0,1,0,0,0,0|2,0,1]=4 237 B11R1.166 NC1=CC(O)=NC=C1C(=O)O Z5190 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.166 NC1=CC=C([N+](=O)[O-])C(N)=N1 1923AL [0,1,0,0,0,0|2,0,1]=4 239 B11R1.166 NC1=NC(Br)=C([N+](=O)[O-])C=C1 2979AC [0,1,0,0,0,0|2,0,1]=4 240 B11R1.166 NC1=NC(Cl)=NC=C1C(=O)O 2075AC [0,1,0,0,0,0|3,0,0]=4 241 B11R1.166 O=C(O)C1=C(Br)C=C(Br)N=C1 1337AC [0,1,0,0,0,0|2,0,0]=3 242 B11R1.166 O=C(O)C1=C(Cl)N=C(F)C=C1 3712AA [0,1,0,0,0,0|2,0,0]=3 243 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 3121AC [0,1,0,0,0,0|2,0,0]=3 244 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl 1385AA [0,1,0,0,0,0|2,0,0]=3 245 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br 1384AA [0,1,0,0,0,0|2,0,0]=3 246 B11R1.166 O=C(O)C1=CC=C(I)C=C1O 8615AA [0,1,0,0,0,0|1,0,0]=2 247 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O 2655AA [0,1,0,0,0,0|2,0,0]=3 248 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F Y8203 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.166 O=C(O)C1=NC=C(F)C=C1Cl 5397AA [0,1,0,0,0,0|2,0,0]=3 250 B11R1.166 O=[N+]([O-])C1=C(I)C=C(Br)C=C1 4127AB [0,1,0,0,0,0|2,0,1]=4 251 B11R1.166 O=[N+]([O-])C1=CC=C(I)C=C1F V5003 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.166 OB(O)C1=CC=C(Br)C=C1Cl Y3588 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.166 OB(O)C1=CC=C(F)C=C1O V1926 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.166 OB(O)C1=CC=C(O)C=C1F Z0159 [0,1,0,0,0,0|2,0,1]=4 255 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [0,0,0,1,0,0|2,0,1]=4 256 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [0,0,0,0,1,0|3,0,0]=4 257 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [0,0,0,0,1,0|3,0,0]=4 258 B9R1.35 CC(=O)C1=CSC(Cl)=C1 Z0709 [0,0,0,0,1,0|3,0,0]=4 259 B9R1.35 CC1=CN=C(C(=O)O)O1 X6429 [0,0,0,0,1,0|3,0,0]=4 260 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [0,0,0,0,1,0|2,0,0]=3 261 B9R1.35 CC1=CNC(C(=O)O)=N1 Y9876 [0,0,0,0,1,0|3,0,0]=4 262 B9R1.35 CC1=NC(C(=O)O)=CO1 V4541 [0,0,0,0,1,0|3,0,0]=4 263 B9R1.35 CC1=NSC(C(=O)O)=C1 7851AE [0,0,0,0,1,0|3,0,0]=4 264 B9R1.35 NC(=O)C1=CC=C(Br)O1 6684AE [0,0,0,0,1,0|3,0,0]=4 265 B9R1.35 NC(=O)C1=CN=C(N)S1 V6386 [0,0,0,0,1,0|3,0,0]=4 266 B9R1.35 NC(=O)C1=CSC(N)=N1 Z3939 [0,0,0,0,1,0|3,0,0]=4 267 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [0,0,0,0,1,0|1,0,0]=2 268 B9R1.35 NC1=NN=C(C(=O)O)S1 9637AB [0,0,0,0,1,0|3,0,0]=4 269 B9R1.35 N[C@@H]1C=C[C@H](C(=O)O)C1 Y6706 [0,0,0,0,1,0|0,0,3]=4 270 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 0632AA [0,0,0,0,1,0|0,0,3]=4 271 B9R1.35 O=C(O)C1=CC(Cl)=NO1 0612AB [0,0,0,0,1,0|3,0,0]=4 272 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [0,0,0,0,1,0|2,0,0]=3 273 B9R1.35 O=C(O)C1=CC(I)=CN1 2020AB [0,0,0,0,1,0|2,0,0]=3 274 B9R1.35 O=C(O)C1=CC=C(Br)N1 2776AB [0,0,0,0,1,0|2,0,0]=3 275 B9R1.35 O=C(O)C1=CC=C(F)S1 W6292 [0,0,0,0,1,0|2,0,0]=3 276 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [0,0,0,0,1,0|2,0,0]=3 277 B9R1.35 O=C(O)C1=COC(I)=N1 4876AA [0,0,0,0,1,0|3,0,0]=4 278 B9R1.35 O=C(O)C1=NC(Br)=CO1 X6341 [0,0,0,0,1,0|3,0,0]=4 279 B9R1.35 O=C(O)C1=NC=C(Br)S1 Y4853 [0,0,0,0,1,0|3,0,0]=4 280 B9R1.35 O=C(O)C1=NC=C(Cl)S1 Y6782 [0,0,0,0,1,0|3,0,0]=4 281 B9R1.35 O=C1C=C(C(=O)O)CC1 Y5171 [0,0,0,0,1,0|1,0,2]=4 282 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,0,0,0,0,1|3,0,0]=4 283 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,0,0,0,0,1|3,0,0]=4 284 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N473 [0,0,0,0,0,1|3,0,0]=4 285 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,0,0,0,0,1|2,0,1]=4 286 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,0,0,0,0,1|2,0,0]=3 287 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,0,0,0,0,1|3,0,0]=4 288 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,0,0,0,0,1|3,0,0]=4 289 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,0,0,0,0,1|2,0,0]=3 290 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,0,0,0,0,1|3,0,0]=4 291 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [0,0,0,0,0,1|1,0,0]=2 292 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [0,0,0,0,0,1|2,0,0]=3 293 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 X9387 [0,0,0,0,0,1|3,0,0]=4 294 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 6457AL [0,0,0,0,0,1|2,1,0]=4 295 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [2,0,0,0,0,0|2,0,0]=4 296 B8R1.2 NCC1=CC=CC=C1 7149AL [2,0,0,0,0,0|1,0,1]=4 297 B8R1.2 O=CC1=CN=NC=C1 7044AB [2,0,0,0,0,0|2,0,0]=4 298 B8R1.2 O=CC1=NC=CC=N1 Y3220 [2,0,0,0,0,0|2,0,0]=4 299 B8R1.2 O=CC1=NC=CN=C1 X7048 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.3 NC1=CN=C(N)C=C1 X9372 [2,0,0,0,0,0|2,0,0]=4 301 B8R1.3 NC1=NC=C(O)C=C1 V8126 [2,0,0,0,0,0|1,0,0]=3 302 B8R1.3 NC1=NC=C(O)C=C1 X4178 [2,0,0,0,0,0|1,0,0]=3 303 B8R1.3 NC1=NNC(=O)C=C1 0249AA [2,0,0,0,0,0|2,0,0]=4 304 B8R1.3 [O-]C1=CC=C(Cl)C=C1 3305AA [2,0,0,0,0,0|1,0,1]=4 305 B10R1.1 C=CCC1=CC=C(Br)C=C1 7818AD [1,1,0,0,0,0|2,0,0]=4 306 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [1,1,0,0,0,0|2,0,0]=4 307 B10R1.1 C=CCC1=CC=C(F)C=C1 0990AQ [1,1,0,0,0,0|2,0,0]=4 308 B10R1.1 CC1=CC=C(CCO)C=C1 X8365 [1,1,0,0,0,0|1,0,1]=4 309 B10R1.1 CC1=CC=C(NC=O)C=C1 6608AL [1,1,0,0,0,0|1,0,0]=3 310 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [1,1,0,0,0,0|1,0,1]=4 311 B10R1.1 NOCC1=CC=C(Br)C=C1 5547AB [1,1,0,0,0,0|1,0,1]=4 312 B10R1.1 NOCC1=CC=C(Cl)C=C1 X4802 [1,1,0,0,0,0|1,0,1]=4 313 B10R1.1 O\N=C\C1=CC=C(O)C=C1 6494AE [1,1,0,0,0,0|1,0,0]=3 314 B10R1.3 C#CC1=CC=C(CN)C=C1 0181AB [1,1,0,0,0,0|1,0,1]=4 315 B10R1.3 C=CC1=CC=C(C#N)C=C1 8141AJ [1,1,0,0,0,0|1,0,1]=4 316 B10R1.3 C=CC1=CC=C(CN)C=C1 X4444 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.3 CCC1=CC=C(CN)C=C1 9087AE [1,1,0,0,0,0|1,0,1]=4 318 B10R1.3 CCC1=CC=C(NN)C=C1 8775AH [1,1,0,0,0,0|1,0,1]=4 319 B10R1.3 CNC1=NC=C(C=O)C=C1 8681AE [1,1,0,0,0,0|1,0,0]=3 320 B10R1.3 CNC1=NC=C(C=O)C=N1 7888AE [1,1,0,0,0,0|2,0,0]=4 321 B10R1.3 CSC1=CC=C(NN)C=C1 1474AE [1,1,0,0,0,0|2,0,0]=4 322 B10R1.3 CSC1=NC=C(C=O)C=C1 Z0204 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.25 C(=O)C1=CNC(C)=CC1=O KMA0017 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.25 C(O)C1=C(Cl)C=C(Br)C=C1 KMA0152 [1,1,0,0,0,0|1,0,1]=4 325 B10R1.25 C=CC1=CC=C(F)C=C1F 5271AB [1,1,0,0,0,0|2,0,0]=4 326 B10R1.25 CC1=C(C=O)C=CC(N)=N1 3414AJ [1,1,0,0,0,0|1,0,0]=3 327 B10R1.25 CC1=C(C=O)C=NC(Br)=C1 5663AC [1,1,0,0,0,0|2,0,0]=4 328 B10R1.25 CC1=CC(Br)=NC=C1C=O Z0096 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.25 CC1=CC(C)=C(CO)C=C1 7829AJ [1,1,0,0,0,0|1,0,1]=4 330 B10R1.25 CC1=CC(N)=CC=C1CO 6079AJ [1,1,0,0,0,0|0,0,1]=3 331 B10R1.25 CC1=CN=C(C=O)C(C)=C1 Z0771 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.25 CC1=NC(Br)=CC=C1C=O Y4718 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.25 CC1=NC(F)=CC=C1C=O Z0986 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.25 COC1=CC=C(N)C=C1C 0301AD [1,1,0,0,0,0|2,0,0]=4 335 B10R1.25 COC1=CC=C(N)C=C1Cl 5846AJ [1,1,0,0,0,0|2,0,0]=4 336 B10R1.25 COC1=CC=C(N)C=C1N 5296AL [1,1,0,0,0,0|2,0,0]=4 337 B10R1.25 CSC1=C(Cl)C=C(N)C=C1 2234AJ [1,1,0,0,0,0|2,0,0]=4 338 B10R1.25 N#CC1=CC=C(N)C=C1Br W6777 [1,1,0,0,0,0|1,0,1]=4 339 B10R1.25 NC1=CC=C(C=O)C(Br)=C1 X5129 [1,1,0,0,0,0|0,0,0]=2 340 B10R1.25 NC1=CC=C(N=O)C(N)=N1 2266AF [1,1,0,0,0,0|2,0,0]=4 341 B10R1.25 NC1=NC=C(C=O)C(N)=N1 Y8201 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 Z3894 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.25 O=CC1=CC=C(Br)C=C1I 2692AJ [1,1,0,0,0,0|1,0,0]=3 344 B10R1.25 O=CC1=CC=C(Br)N=C1Br Z0686 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.25 O=CC1=CN=C(Br)C=C1Br 3733AA [1,1,0,0,0,0|2,0,0]=4 346 B10R1.25 O=CC1=CN=C(Cl)C=C1Br 1353AA [1,1,0,0,0,0|2,0,0]=4 347 B10R1.25 O=CC1=CN=C(F)C=C1Cl 4845AA [1,1,0,0,0,0|2,0,0]=4 348 B10R1.25 O=CC1=NC=C(Br)C=C1Br 4900AC [1,1,0,0,0,0|2,0,0]=4 349 B10R1.25 O=CC1=NC=C(Cl)C=C1Br Y3906 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.25 O=CC1=NC=C(Cl)C=C1Cl W6408 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.176 CC1=C(O)C=CC(CO)=C1 9583AA [1,1,0,0,0,0|1,0,1]=4 352 B10R1.176 CC1=CC(C=O)=CN=C1Br Z0993 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.176 CC1=CC(CO)=CC=C1Cl Z0082 [1,1,0,0,0,0|1,0,1]=4 354 B10R1.176 CC1=CC(CO)=CC=C1N 2117AF [1,1,0,0,0,0|0,0,1]=3 355 B10R1.176 CC1=CC=C(C=O)C=C1I 8694AB [1,1,0,0,0,0|1,0,0]=3 356 B10R1.176 CC1=NC(C=O)=CC=C1F 4137AC [1,1,0,0,0,0|2,0,0]=4 357 B10R1.176 CCC1=CC(F)=C(N)C=C1 3498AA [1,1,0,0,0,0|1,0,1]=4 358 B10R1.176 CCC1=CC(N)=C(N)C=C1 2716AA [1,1,0,0,0,0|1,0,1]=4 359 B10R1.176 CCC1=CC=C(N)C(O)=C1 1522AJ [1,1,0,0,0,0|1,0,1]=4 360 B10R1.176 N#CC1=CC=C(N)C(O)=C1 Z4880 [1,1,0,0,0,0|1,0,1]=4 361 B10R1.176 NC1=C(N)C=C(CO)C=C1 7078AE [1,1,0,0,0,0|0,0,1]=3 362 B10R1.176 NC1=CC=C(CO)C=C1Cl 1122AL [1,1,0,0,0,0|0,0,1]=3 363 B10R1.176 O=CC1=CC(Br)=C(Cl)N=C1 8633AE [1,1,0,0,0,0|2,0,0]=4 364 B10R1.176 OCC1=CC(O)=C(O)C=C1 5062AB [1,1,0,0,0,0|1,0,1]=4 365 B10R1.176 OCC1=CC=C(Cl)C(O)=C1 Y3989 [1,1,0,0,0,0|1,0,1]=4 366 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [1,1,0,0,0,0|1,0,1]=4 367 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [1,1,0,0,0,0|1,0,1]=4 368 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [1,1,0,0,0,0|2,0,0]=4 369 B10R1.15 C=CC(=O)C1=CC=CC=C1 1968AC [1,1,0,0,0,0|1,0,0]=3 370 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [1,1,0,0,0,0|1,0,1]=4 371 B10R1.15 CC[C@H](O)C1=CC=CC=C1 7483AJ [1,1,0,0,0,0|1,0,1]=4 372 B10R1.15 COC(=N)C1=CC=NC=C1 4422AB [1,1,0,0,0,0|2,0,0]=4 373 B10R1.15 COC(=O)C1=CC=NN=C1 W5569 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.15 COC(=O)C1=CN=CN=C1 4090AB [1,1,0,0,0,0|2,0,0]=4 375 B10R1.15 COC(=O)N1C=CC=CC1 3960AB [1,1,0,0,0,0|1,0,1]=4 376 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [1,1,0,0,0,0|2,0,0]=4 377 B10R1.15 NCC(=O)C1=CC=CN=C1 1930AJ [1,1,0,0,0,0|2,0,0]=4 378 B10R1.15 NCC(=O)C1=CC=NC=C1 7230AB [1,1,0,0,0,0|2,0,0]=4 379 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [1,1,0,0,0,0|2,0,0]=4 380 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [1,1,0,0,0,0|2,0,0]=4 381 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [1,1,0,0,0,0|2,0,0]=4 382 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [1,1,0,0,0,0|0,0,1]=3 383 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.15 O\N=C(\Cl)C1=CC=CC=C1 O705 [1,1,0,0,0,0|1,0,0]=3 385 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 Y9394 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 5121AF [1,1,0,0,0,0|1,0,1]=4 387 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 X6787 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.61 C=C(C)C1=C(C)C=CC=C1 5671AL [1,1,0,0,0,0|2,0,0]=4 389 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 2023AA [1,1,0,0,0,0|2,0,0]=4 390 B10R1.61 CC(=O)C1=C(N)C=CC=N1 4526AH [1,1,0,0,0,0|2,0,0]=4 391 B10R1.61 CC(=O)C1=C(O)C=NC=C1 Z4577 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.61 CC(=O)C1=CC=NC=C1N 7556AJ [1,1,0,0,0,0|2,0,0]=4 393 B10R1.61 CC(=O)C1=CN=CC=C1C 7123AB [1,1,0,0,0,0|2,0,0]=4 394 B10R1.61 CC(=O)C1=NC=CC=C1O Z4085 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.61 CC1=CC=CC=C1[C@@H](C)O Y1501 [1,1,0,0,0,0|1,0,1]=4 396 B10R1.61 CC1=CC=CC=C1[C@H](C)O Y1500 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.61 CS(=O)C1=CC=CC=C1Br 8910AE [1,1,0,0,0,0|2,0,0]=4 398 B10R1.61 CS(=O)C1=CC=CC=C1O Z7171 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 1622AJ [1,1,0,0,0,0|2,0,0]=4 400 B10R1.61 N=C(N)C1=CC=CC=C1Cl 6297AB [1,1,0,0,0,0|2,0,0]=4 401 B10R1.61 N=C(N)C1=CC=CC=C1F 1049AC [1,1,0,0,0,0|2,0,0]=4 402 B10R1.61 NC1=CN=CN=C1C(=O)O 8941AB [1,1,0,0,0,0|2,0,0]=4 403 B10R1.61 NC1=NN=CC=C1C(=O)O W4411 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 Y9704 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.61 O=C(O)C1=C(I)N=CC=C1 1745AJ [1,1,0,0,0,0|1,0,0]=3 406 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 3551AC [1,1,0,0,0,0|2,0,0]=4 407 B10R1.113 CC(=O)C1=CC(F)=CN=C1 3535AA [1,1,0,0,0,0|2,0,0]=4 408 B10R1.113 CC(=O)C1=CC(F)=CN=C1 4092AB [1,1,0,0,0,0|2,0,0]=4 409 B10R1.113 CC1=CC(C(=O)O)=NC=N1 6686AA [1,1,0,0,0,0|2,0,0]=4 410 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [1,1,0,0,0,0|2,0,0]=4 411 B10R1.113 CC1=CC=CC(C(C)O)=C1 8099AF [1,1,0,0,0,0|1,0,1]=4 412 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 5245AA [1,1,0,0,0,0|1,0,1]=4 413 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 6013AL [1,1,0,0,0,0|2,0,0]=4 414 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 2211AJ [1,1,0,0,0,0|2,0,0]=4 415 B10R1.113 NC(=O)C1=CN=CC(F)=C1 V7403 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.113 NC(=O)C1=NC(N)=CC=C1 3423AJ [1,1,0,0,0,0|2,0,0]=4 417 B10R1.113 NC(=S)C1=CC=CC(I)=C1 8330AC [1,1,0,0,0,0|1,1,0]=4 418 B10R1.113 NC1=CC(C(=O)[O-])=CC=C1 5988AL [1,1,0,0,0,0|0,0,1]=3 419 B10R1.113 NC1=NC=CC(C(=O)O)=N1 W4491 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.113 NC1=NC=NC(C(=O)O)=C1 W5896 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 J70037 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 Z2563 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.113 O=C(O)C1=NC(I)=CC=C1 5470AE [1,1,0,0,0,0|1,0,0]=3 424 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 6772AE [1,1,0,0,0,0|1,0,1]=4 426 B10R1.113 O=S([O-])C1=CC=CC(Br)=C1 V8824 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.14 COC(=O)C1=CC(Cl)=CN1 0733AD [0,1,0,0,1,0|2,0,0]=4 428 B10R1.14 COC(=O)C1=CC=C(N)O1 3572AL [0,1,0,0,1,0|1,0,0]=3 429 B10R1.31 CCC1=CC(C(=O)O)=CS1 Y1108 [0,1,0,0,1,0|2,0,0]=4 430 B10R1.31 CCC1=CC=C(C(=O)O)O1 8236AB [0,1,0,0,1,0|2,0,0]=4 431 B10R1.31 CCC1=CC=C(C(=O)O)S1 Z2977 [0,1,0,0,1,0|2,0,0]=4 432 B10R1.31 CNC1=NC(C(=O)O)=CS1 0818AD [0,1,0,0,1,0|2,0,0]=4 433 B10R1.31 COC1=CC=C(C(=O)O)O1 3836AF [0,1,0,0,1,0|2,0,0]=4 434 B10R1.31 N#CC1=CC=C(C(=O)O)O1 0820AB [0,1,0,0,1,0|1,0,1]=4 435 B10R1.31 N#CC1=CC=C(C(=O)O)S1 6438AE [0,1,0,0,1,0|1,0,1]=4 436 B10R1.31 N#CC1=CNC(C(=O)O)=C1 X5552 [0,1,0,0,1,0|1,0,1]=4 437 B10R1.31 O=CC1=CC(C(=O)O)=CO1 8998AB [0,1,0,0,1,0|2,0,0]=4 438 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 2990AB [0,1,0,0,1,0|2,0,0]=4 439 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 5554AB [0,1,0,0,1,0|2,0,0]=4 440 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 4819AC [0,1,0,0,1,0|1,0,0]=3 441 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 4820AC [0,1,0,0,1,0|1,0,0]=3 442 B10R1.58 O=C(O)C1=CC(Br)=C(Br)N1 1031AE [0,1,0,0,1,0|2,0,0]=4 443 B10R1.59 CC1=C(C(=O)O)C=C(Br)S1 3123AJ [0,1,0,0,1,0|2,0,0]=4 444 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 W7876 [0,1,0,0,1,0|2,0,0]=4 445 B10R1.59 CN1N=C(N)C=C1C(=O)O 0018AD [0,1,0,0,1,0|2,0,0]=4 446 B10R1.59 O=C(O)C1=C(Br)OC(Br)=C1 3630AB [0,1,0,0,1,0|2,0,0]=4 447 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 2939AC [0,1,0,0,1,0|2,0,0]=4 448 B10R1.194 CC1=CSC(C(=O)O)=C1C 4849AC [0,1,0,0,1,0|2,0,0]=4 449 B12R1.4 CC(=O)CC1=CC=C(C#N)C=C1 8757AB [0,1,0,0,0,1|1,0,1]=4 450 B12R1.4 CC(=O)OC1=CC=C(CCl)C=C1 X4658 [0,1,0,0,0,1|2,0,0]=4 451 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 7067AA [0,1,0,0,0,1|1,0,0]=3 452 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 2717AL [0,1,0,0,0,1|2,0,0]=4 453 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 3012AB [0,1,0,0,0,1|0,0,0]=2 454 B12R1.4 NNC1=CC=C(CC(=O)O)C=C1 7496AE [0,1,0,0,0,1|0,0,0]=2 455 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 4244AB [0,1,0,0,0,1|1,0,0]=3 456 B12R1.19 CC(=O)NC1=CC=C(Cl)C(O)=C1 V4906 [0,1,0,0,0,1|2,0,0]=4 457 B12R1.19 CC(=O)NC1=NC=C(N)C(C)=C1 N471 [0,1,0,0,0,1|2,0,0]=4 458 B12R1.19 CC1=CC(CC(=O)O)=CC=C1N 5220AJ [0,1,0,0,0,1|0,0,0]=2 459 B12R1.19 NC1=CC(CC(=O)O)=CC=C1O 2074AE [0,1,0,0,0,1|1,0,0]=3 460 B12R1.20 CC(=O)C(Br)C1=CC=C(O)C=C1 6547AC [0,1,0,0,0,1|2,0,0]=4 461 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 W8302 [0,1,0,0,0,1|1,0,0]=3 462 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 5426AJ [0,1,0,0,0,1|1,0,0]=3 463 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 5933AE [0,1,0,0,0,1|2,0,0]=4 464 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 5090AE [0,1,0,0,0,1|2,0,0]=4 465 B12R1.49 CC1=CC=C(NC(=O)CN)C=C1 5390AE [0,1,0,0,0,1|2,0,0]=4 466 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 0275AE [0,1,0,0,0,1|1,0,0]=3 467 B12R1.49 COC(=O)NC1=NC=C(Br)C=C1 V4263 [0,1,0,0,0,1|2,0,0]=4 468 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 E021 [0,1,0,0,0,1|2,0,0]=4 469 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 8505AD [0,1,0,0,0,1|2,0,0]=4 470 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 8448AE [0,1,0,0,0,1|1,1,0]=4 471 B12R1.106 NC1=CC=C(OS(=O)(=O)O)C=C1 I723 [0,1,0,0,0,1|1,0,0]=3 472 B12R1.106 O=P(O)(O)CC1=CC=C(Br)C=C1 1129AQ [0,1,0,0,0,1|2,0,0]=4 473 B12R1.233 CC(=O)CC1=CC=C(Cl)C=C1Br 5576AA [0,1,0,0,0,1|2,0,0]=4 474 B12R1.233 CC(=O)NC1=NC=C(N)C=C1Br V8830 [0,1,0,0,0,1|2,0,0]=4 475 B12R1.233 NC1=CC(Br)=CN=C1CC(=O)O W9147 [0,1,0,0,0,1|2,0,0]=4 476 B12R1.233 NC1=NC=C(CC(=O)O)C(=O)N1 0747AF [0,1,0,0,0,1|2,0,0]=4 477 B12R1.233 O=C(O)CC1=C(Br)C=C(O)C=C1 5009AH [0,1,0,0,0,1|1,0,0]=3 478 B12R1.233 O=C(O)CC1=NC=C(Cl)C=C1F Z8302 [0,1,0,0,0,1|2,0,0]=4 479 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 X6515 [0,2,0,0,0,0|1,0,0]=3 480 B12R1.5 CCC(=O)C1=CC=C(C#N)C=C1 X3648 [0,2,0,0,0,0|1,0,1]=4 481 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 X9190 [0,2,0,0,0,0|1,0,1]=4 482 B12R1.5 CCC1=CC=C(C(=O)CBr)C=C1 2323AB [0,2,0,0,0,0|2,0,0]=4 483 B12R1.5 CCC1=CC=C(C(=O)NN)C=C1 Y9705 [0,2,0,0,0,0|2,0,0]=4 484 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 V3654 [0,2,0,0,0,0|1,0,0]=3 485 B12R1.5 CNC(=O)C1=CC=C(SC)C=C1 7628AB [0,2,0,0,0,0|2,0,0]=4 486 B12R1.5 COC(=O)C1=CC=C(C#N)N=C1 4894AC [0,2,0,0,0,0|1,0,1]=4 487 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 Y7491 [0,2,0,0,0,0|1,0,0]=3 488 B12R1.5 COC(=O)C1=CC=C(NN)C=C1 X3533 [0,2,0,0,0,0|0,0,0]=2 489 B12R1.5 COC(=O)C1=CC=C(SC)C=C1 4870AB [0,2,0,0,0,0|1,0,0]=3 490 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 5893AA [0,2,0,0,0,0|2,0,0]=4 491 B12R1.5 COC(=O)C1=NC=C(C#N)C=C1 1849AC [0,2,0,0,0,0|1,0,1]=4 492 B12R1.5 COC1=CC=C(C(=O)C#N)C=C1 8793AH [0,2,0,0,0,0|2,0,0]=4 493 B12R1.5 COC1=CC=C(C(=O)ON)C=C1 1197AF [0,2,0,0,0,0|1,0,0]=3 494 B12R1.5 CSC1=CC=C(C(=O)C=O)C=C1 7517AB [0,2,0,0,0,0|1,0,1]=4 495 B12R1.5 CSC1=CC=C(C(=O)CBr)C=C1 5495AH [0,2,0,0,0,0|2,0,0]=4 496 B12R1.5 N#CC1=CC=C(C(=O)C=O)C=C1 W4089 [0,2,0,0,0,0|0,0,2]=4 497 B12R1.5 NCC1=CC=C(C(=O)NN)C=C1 4284AB [0,2,0,0,0,0|1,0,0]=3 498 B12R1.48 CC1=CC(C(=O)O)=CC=C1C=O V4609 [0,2,0,0,0,0|1,0,0]=3 499 B12R1.48 CCC1=CC=C(C(=O)O)C=C1O Q690 [0,2,0,0,0,0|1,0,0]=3 500 B12R1.48 COC1=C(Br)C=C(C(N)=O)C=C1 6775AD [0,2,0,0,0,0|2,0,0]=4 501 B12R1.48 COC1=NC=C(C(=O)O)C=C1C Y3819 [0,2,0,0,0,0|2,0,0]=4 502 B12R1.48 O=CC1=CC=C(C(=O)O)C=C1O W7396 [0,2,0,0,0,0|1,0,0]=3 503 B12R1.113 CC(=O)C1=CC=C(CCBr)C=C1 5439AB [0,2,0,0,0,0|2,0,0]=4 504 B12R1.113 CC(=O)C1=CC=C(CCCl)C=C1 8308AE [0,2,0,0,0,0|2,0,0]=4 505 B12R1.113 CCNC1=CC=C([N+](=O)[O-])C=C1 1722AE [0,2,0,0,0,0|1,0,1]=4 506 B12R1.113 CCNC1=NN=C(C(=O)O)C=C1 6412AJ [0,2,0,0,0,0|2,0,0]=4 507 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 6886AC [0,2,0,0,0,0|2,0,0]=4 508 B12R1.113 CCSC1=CC=C(C(=O)O)C=C1 A952 [0,2,0,0,0,0|1,0,0]=3 509 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 4511AF [0,2,0,0,0,0|0,0,0]=2 510 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 Z6667 [0,2,0,0,0,0|0,0,0]=2 511 B12R1.113 NC(=O)C1=CC=C(N=C=S)C=C1 Z2884 [0,2,0,0,0,0|1,0,1]=4 512 B12R1.113 NCCC1=CC=C(C(=O)O)C=C1 3466AA [0,2,0,0,0,0|0,0,0]=2 513 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 X8079 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.256 CC(=O)C1=CN=C(C(=O)O)C=C1 Y9735 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 2416AJ [0,2,0,0,0,0|0,0,0]=2 516 B12R1.256 CN(C)C1=CC=C(C(=N)N)C=C1 8179AB [0,2,0,0,0,0|2,0,0]=4 517 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=N1 6047AD [0,2,0,0,0,0|2,0,0]=4 518 B12R1.256 CS(=O)C1=CC=C(C(=O)O)C=C1 4031AB [0,2,0,0,0,0|1,0,0]=3 519 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2000AA [0,2,0,0,0,0|0,0,0]=2 520 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2927AH [0,2,0,0,0,0|0,0,0]=2 521 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 1165AB [0,2,0,0,0,0|1,0,1]=4 522 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 9180AH [0,2,0,0,0,0|0,0,0]=2 523 B12R1.256 C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1 5765AB [0,2,0,0,0,0|1,0,1]=4 524 B12R1.256 NC(=O)C1=CC=C(C(N)=O)C=C1 9023AL [0,2,0,0,0,0|1,0,0]=3 525 B12R1.256 NC(=O)C1=CN=C(C(N)=O)C=C1 4036AE [0,2,0,0,0,0|2,0,0]=4 526 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=N1 Y4672 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.452 CC(=O)C1=CC=C(C#N)C=C1C 5552AH [0,2,0,0,0,0|1,0,1]=4 528 B12R1.452 CNC1=CC=C(C(=O)O)C(O)=C1 0735AC [0,2,0,0,0,0|0,0,0]=2 529 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 R458 [0,2,0,0,0,0|1,0,0]=3 530 B12R1.452 COC1=CC=C(C(=O)O)C(C)=N1 Y7274 [0,2,0,0,0,0|2,0,0]=4 531 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 Y9249 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.452 COC1=CC=C(C(N)=O)C(N)=C1 4987AB [0,2,0,0,0,0|2,0,0]=4 533 B12R1.452 COC1=CN=C(C(=O)O)C(Cl)=C1 5399AA [0,2,0,0,0,0|2,0,0]=4 534 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 1537AJ [0,2,0,0,0,0|2,0,0]=4 535 B12R1.452 N#CC1=CC=C(C(=O)O)C(I)=C1 4996AA [0,2,0,0,0,0|0,0,1]=3 536 B12R1.452 O=C(O)C1=CC=C(CO)C=C1F Y8250 [0,2,0,0,0,0|1,0,0]=3 537 B12R1.9 CCS(=O)(=O)C1=CC=C(N)C=C1 V7024 [0,2,0,0,0,0|1,0,1]=4 538 B12R1.9 COS(=O)(=O)C1=CC=C(Cl)C=C1 Z3759 [0,2,0,0,0,0|2,0,0]=4 539 B12R1.23 CC1=CC=C(S(=O)(=O)O)C=C1N I641 [0,2,0,0,0,0|2,0,0]=4 540 B12R1.23 CS(=O)(=O)C1=CC(Cl)=C(N)C=C1 5972AA [0,2,0,0,0,0|1,0,1]=4 541 B12R1.23 NC1=C(F)C=CC(S(=O)(=O)O)=C1 1124AE [0,2,0,0,0,0|2,0,0]=4 542 B12R1.126 CC1=C(S(=O)(=O)O)C=CC(N)=C1 8294AL [0,2,0,0,0,0|1,0,0]=3 543 B12R1.126 CC1=CC(C)=C(S(=O)(=O)O)C=C1 E559 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 2271AJ [0,2,0,0,0,0|1,0,0]=3 545 B12R1.56 CC(=O)C1=CC(C#N)=C(N)C=C1 3962AB [0,2,0,0,0,0|1,0,0]=3 546 B12R1.56 CC1=C(C=O)C=C(C(=O)O)C=C1 5888AJ [0,2,0,0,0,0|1,0,0]=3 547 B12R1.56 CC1=CC=C(C(=O)O)C=C1NN V6890 [0,2,0,0,0,0|1,0,0]=3 548 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=N1 X9489 [0,2,0,0,0,0|2,0,0]=4 549 B12R1.56 COC1=C(I)C=CC(C(=O)O)=C1 9083AD [0,2,0,0,0,0|1,0,0]=3 550 B12R1.56 COC1=CC(C(N)=O)=CC=C1Br V3839 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.56 COC1=NC(C(=O)O)=CC=C1Br 3836AA [0,2,0,0,0,0|2,0,0]=4 552 B12R1.56 CSC1=CC(C(=O)O)=CC=C1F Z0258 [0,2,0,0,0,0|1,0,0]=3 553 B12R1.232 CC1=C(C)NC(=O)C(C(=O)O)=C1 7229AB [0,2,0,0,0,0|2,0,0]=4 554 B12R1.232 CC1=C(I)C=C(C(=O)O)C(O)=C1 Z1826 [0,2,0,0,0,0|1,0,0]=3 555 B12R1.232 CC1=CC(C)=C(C)C=C1C(=O)O P326 [0,2,0,0,0,0|1,0,0]=3 556 B12R1.232 CC1=CC(C)=C(I)C=C1C(=O)O 1531AC [0,2,0,0,0,0|1,0,0]=3 557 B12R1.232 CC1=CC(O)=C(C)C=C1C(=O)O 6178AJ [0,2,0,0,0,0|1,0,0]=3 558 B12R1.232 NC1=C(Br)C=C([N+](=O)[O-])C(Br)=C1 1909AL [0,2,0,0,0,0|1,0,1]=4 559 B12R1.232 NC1=C(Cl)C=C(O)C(C(=O)O)=C1 V1240 [0,2,0,0,0,0|1,0,0]=3 560 B12R1.232 NC1=CC(F)=C([N+](=O)[O-])C=C1F 7742AA [0,2,0,0,0,0|1,0,1]=4 561 B12R1.232 NC1=NC(N)=C(Br)N=C1C(=O)O 2095AJ [0,2,0,0,0,0|2,0,0]=4 562 B12R1.232 NC1=NC(N)=C(Cl)N=C1C(=O)O X6980 [0,2,0,0,0,0|2,0,0]=4 563 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1O 8358AA [0,2,0,0,0,0|1,0,0]=3 564 B12R1.232 O=C(O)C1=CC(O)=C(Br)C=C1Br W3127 [0,2,0,0,0,0|1,0,0]=3 565 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 4488AE [0,2,0,0,0,0|2,0,0]=4 566 B12R1.367 CC1=CC(C(=O)CBr)=CC=C1Cl W4314 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1C 2008AL [0,2,0,0,0,0|2,0,0]=4 568 B12R1.367 CC1=CC=C(C(=O)NN)C=C1Cl 8698AE [0,2,0,0,0,0|2,0,0]=4 569 B12R1.367 CC1=CC=C(C(=O)NN)C=C1N 0486AF [0,2,0,0,0,0|2,0,0]=4 570 B12R1.367 CCC(=O)C1=CC(Cl)=C(F)C=C1 0087AB [0,2,0,0,0,0|2,0,0]=4 571 B12R1.367 COC(=O)C1=CC(C)=C(C)N=C1 4295AJ [0,2,0,0,0,0|2,0,0]=4 572 B12R1.367 COC(=O)C1=CC(N)=C(O)N=C1 V4477 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.367 COC(=O)C1=CC=C(Cl)C(=O)N1 3888AA [0,2,0,0,0,0|2,0,0]=4 574 B12R1.367 COC(=O)C1=CN=C(Br)C(Cl)=C1 2321AC [0,2,0,0,0,0|2,0,0]=4 575 B12R1.367 COC(=O)C1=CN=C(F)C(Cl)=C1 2806AA [0,2,0,0,0,0|2,0,0]=4 576 B12R1.367 COC(=O)C1=CN=C(O)C(Cl)=C1 1162AD [0,2,0,0,0,0|2,0,0]=4 577 B12R1.367 COC(=O)C1=CNC(=O)C(Cl)=C1 0022AE [0,2,0,0,0,0|2,0,0]=4 578 B12R1.367 COC(=O)C1=NC(Br)=C(C)C=C1 Z3978 [0,2,0,0,0,0|2,0,0]=4 579 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 4637AA [0,2,0,0,0,0|2,0,0]=4 580 B12R1.367 COC(=O)C1=NC(N)=C(N)C=C1 5190AE [0,2,0,0,0,0|1,0,0]=3 581 B12R1.367 COC(=O)C1=NC=C(C)C(Cl)=C1 X8939 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 5784AB [0,2,0,0,0,0|2,0,0]=4 583 B12R1.367 O=C(CBr)C1=CC=C(Br)C(F)=C1 0190AA [0,2,0,0,0,0|2,0,0]=4 584 B12R1.367 O=C(CO)C1=CC(Cl)=C(Cl)C=C1 9016AC [0,2,0,0,0,0|1,0,0]=3 585 B12R1.367 O\N=C(/Cl)C1=CC(Cl)=C(Cl)C=C1 8237AC [0,2,0,0,0,0|2,0,0]=4 586 B12R1.893 CC(=O)C1=CC=C(O)C(C)=C1C 7691AB [0,2,0,0,0,0|2,0,0]=4 587 B12R1.893 CC1=C(Br)C(N)=C(C(=O)O)C=C1 3541AB [0,2,0,0,0,0|1,0,0]=3 588 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1N 2623AJ [0,2,0,0,0,0|0,0,0]=2 589 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C 2119AF [0,2,0,0,0,0|2,0,0]=4 590 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1F 1503AJ [0,2,0,0,0,0|1,0,0]=3 591 B12R1.893 NC1=C(Cl)C(N)=C([N+](=O)[O-])C=C1 2270AB [0,2,0,0,0,0|1,0,1]=4 592 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(Cl)N=C1 4802AD [0,2,0,0,0,0|2,0,0]=4 593 B12R1.893 O=C(O)C1=CC=C(F)C(O)=C1F X4333 [0,2,0,0,0,0|1,0,0]=3 594 B12R1.893 O=C(O)C1=CC=C(O)C(F)=C1F R194 [0,2,0,0,0,0|1,0,0]=3 595 B12R1.1005 CC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 8744AA [0,2,0,0,0,0|2,0,0]=4 596 B12R1.1005 CC(=O)C1=CC(F)=C(O)C(F)=C1 3797AD [0,2,0,0,0,0|2,0,0]=4 597 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1I 3470AC [0,2,0,0,0,0|1,0,0]=3 598 B12R1.1005 CC1=C(O)C=C(C(=O)O)C=C1F Z1821 [0,2,0,0,0,0|1,0,0]=3 599 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1C 1589AA [0,2,0,0,0,0|1,0,0]=3 600 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Cl Z1063 [0,2,0,0,0,0|1,0,0]=3 601 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1O 6672AB [0,2,0,0,0,0|1,0,0]=3 602 B12R1.1005 CC1=CC(C(=O)O)=CC(Cl)=C1N 4941AD [0,2,0,0,0,0|0,0,0]=2 603 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1I 3580AA [0,2,0,0,0,0|2,0,0]=4 604 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1N 0906AA [0,2,0,0,0,0|1,0,0]=3 605 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(C)=C1N 8680AA [0,2,0,0,0,0|1,0,1]=4 606 B12R1.1005 NC1=C(Cl)C=C(C(=O)O)C=C1Br 1248AF [0,2,0,0,0,0|0,0,0]=2 607 B12R1.1005 NC1=CC(C(=O)O)=CC(Br)=C1F Z9454 [0,2,0,0,0,0|1,0,0]=3 608 B12R1.1005 NC1=CC(C(=O)O)=CC(Cl)=C1Cl 7049AB [0,2,0,0,0,0|1,0,0]=3 609 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 Y3753 [0,2,0,0,0,0|1,0,0]=3 610 B12R1.1005 O=C(O)C1=CC(F)=C(Cl)C(F)=C1 A739 [0,2,0,0,0,0|1,0,0]=3 611 B12R1.1005 O=C(O)C1=CC(F)=C(O)C(F)=C1 Z1805 [0,2,0,0,0,0|1,0,0]=3 612 B12R1.1005 O=C(O)C1=CC(I)=C(Br)C(I)=C1 3451AC [0,2,0,0,0,0|1,0,0]=3 613 B12R1.1005 O=C(O)C1=CC(I)=C(I)C(I)=C1 1545AB [0,2,0,0,0,0|1,0,0]=3 614 B12R1.12 CCC(NO)=C1C=CC(=O)C=C1 3821AD [0,2,0,0,0,0|2,0,0]=4 615 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 5727AB [0,2,0,0,0,0|2,0,0]=4 616 B12R1.16 CCOC(=O)C1=CC=C(F)N=C1 2670AA [0,2,0,0,0,0|2,0,0]=4 617 B12R1.16 CCOC(=O)C1=CC=C(N)C=N1 3426AA [0,2,0,0,0,0|1,0,0]=3 618 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 4591AD [0,2,0,0,0,0|2,0,0]=4 619 B12R1.16 CCOC(=O)C1=NC=C(F)C=C1 4575AD [0,2,0,0,0,0|2,0,0]=4 620 B12R1.16 CCOC(=O)C1=NN=C(N)C=C1 V9915 [0,2,0,0,0,0|2,0,0]=4 621 B12R1.16 CN(CCO)C1=CC=C(N)C=C1 5889AD [0,2,0,0,0,0|2,0,0]=4 622 B12R1.16 NC1=CC=C(C(N)CCO)C=C1 2347AL [0,2,0,0,0,0|1,0,1]=4 623 B12R1.16 NC1=CC=C([C@@H](N)CCO)C=C1 1318AL [0,2,0,0,0,0|1,0,1]=4 624 B12R1.16 O=C(CCO)C1=CC=C(O)C=C1 5738AJ [0,2,0,0,0,0|1,0,0]=3 625 B12R1.16 O=C(\C=N\O)C1=CC=C(Br)C=C1 9214AJ [0,2,0,0,0,0|1,0,0]=3 626 B12R1.16 O=C\C=C(/Cl)C1=CC=C(Cl)C=C1 V8620 [0,2,0,0,0,0|2,0,0]=4 627 B12R1.1703 C=C(CO)C1=CC=C(F)C=C1F 1023AJ [0,2,0,0,0,0|2,0,0]=4 628 B12R1.1703 CC1=C(\C(N)=N/O)C=CC(Cl)=C1 2698AL [0,2,0,0,0,0|2,0,0]=4 629 B12R1.1703 CCC(=O)C1=C(F)C=C(F)C=C1 L067 [0,2,0,0,0,0|2,0,0]=4 630 B12R1.1703 CCC(=O)C1=CC=C(Cl)C=C1O 8970AC [0,2,0,0,0,0|2,0,0]=4 631 B12R1.1703 COC(=O)C1=C(C)NC(=O)C=C1 6966AJ [0,2,0,0,0,0|2,0,0]=4 632 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)C=N1 7851AB [0,2,0,0,0,0|2,0,0]=4 633 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=N1 1067AD [0,2,0,0,0,0|2,0,0]=4 634 B12R1.1703 COC(=O)C1=C(N)C=C(F)C=C1 6069AB [0,2,0,0,0,0|1,0,0]=3 635 B12R1.1703 COC(=O)C1=C(N)N=C(N)C=N1 4245AJ [0,2,0,0,0,0|2,0,0]=4 636 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1Cl 2363AA [0,2,0,0,0,0|2,0,0]=4 637 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Br Y4513 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.1703 COC(=O)C1=CC=C(C)N=C1C 1416AJ [0,2,0,0,0,0|2,0,0]=4 639 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1Br 3837AA [0,2,0,0,0,0|2,0,0]=4 640 B12R1.1703 COC(=O)C1=CC=C(I)C=C1C 0826AA [0,2,0,0,0,0|1,0,0]=3 641 B12R1.1703 COC(=O)C1=CC=C(I)C=C1Cl 4922AD [0,2,0,0,0,0|1,0,0]=3 642 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl 0202AA [0,2,0,0,0,0|1,0,0]=3 643 B12R1.1703 COC(=O)C1=CN=C(C)C=C1Cl 4512AC [0,2,0,0,0,0|2,0,0]=4 644 B12R1.1703 COC(=O)C1=CN=C(N)N=C1C 7630AC [0,2,0,0,0,0|2,0,0]=4 645 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br 3863AA [0,2,0,0,0,0|2,0,0]=4 646 B12R1.1703 C\C(=N/O)C1=C(O)C=C(O)C=C1 9189AB [0,2,0,0,0,0|2,0,0]=4 647 B12R1.1703 NCC(=O)C1=CC=C(Cl)C=C1Cl L157 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.1703 NCC(=O)C1=CC=C(F)C=C1F 2319AC [0,2,0,0,0,0|2,0,0]=4 649 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1O 7557AE [0,2,0,0,0,0|2,0,0]=4 650 B12R1.1703 N\C(=N/O)C1=C(Cl)C=C(Cl)C=C1 1246AB [0,2,0,0,0,0|2,0,0]=4 651 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 5007AH [0,2,0,0,0,0|2,0,0]=4 652 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F Z6528 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.1703 O=C(CCl)C1=CC=C(F)C=C1O 5512AJ [0,2,0,0,0,0|2,0,0]=4 654 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O 8362AD [0,2,0,0,0,0|2,0,0]=4 655 B12R1.1703 O=C(NO)C1=C(O)C=C(Br)C=C1 6761AE [0,2,0,0,0,0|1,0,0]=3 656 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 1358AA [0,2,0,0,0,0|2,0,0]=4 657 B12R1.57 COC1=CC(F)=CC=C1C(N)=O 3860AC [0,2,0,0,0,0|2,0,0]=4 658 B12R1.57 COC1=CC(O)=CC=C1C(=O)O X8080 [0,2,0,0,0,0|1,0,0]=3 659 B12R1.57 COC1=NC(C)=CC=C1C(=O)O 8851AE [0,2,0,0,0,0|2,0,0]=4 660 B12R1.57 NC1=CC(CO)=C([N+](=O)[O-])C=C1 2097AC [0,2,0,0,0,0|1,0,1]=4 661 B12R1.1000 CC(=O)C1=C(C)C=C(C)C=C1O 8146AA [0,2,0,0,0,0|2,0,0]=4 662 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O V1897 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.1000 CC1=C(C(=O)O)C(Cl)=CC(Br)=C1 Z0970 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.1000 CC1=C(C(=O)O)C(Cl)=CC(Cl)=C1 7482AE [0,2,0,0,0,0|1,0,0]=3 665 B12R1.1000 CC1=C(C(N)=O)C(Cl)=CC(Cl)=C1 9176AA [0,2,0,0,0,0|2,0,0]=4 666 B12R1.1000 CC1=CC(=O)C(C(=O)O)=C(C)N1 3858AB [0,2,0,0,0,0|2,0,0]=4 667 B12R1.1000 CC1=CC(Cl)=C(C(=O)O)C(Cl)=C1 Z1217 [0,2,0,0,0,0|1,0,0]=3 668 B12R1.1000 CC1=CC(N)=C(C(=O)O)C(C)=C1 1500AJ [0,2,0,0,0,0|1,0,0]=3 669 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 5059AH [0,2,0,0,0,0|1,0,0]=3 670 B12R1.1000 NC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 5719AC [0,2,0,0,0,0|2,0,0]=4 671 B12R1.1000 NC1=CC(Br)=CC(Br)=C1C(=O)O Z5150 [0,2,0,0,0,0|1,0,0]=3 672 B12R1.1000 O=C(O)C1=C(Br)C=C(F)C=C1Br 9899AL [0,2,0,0,0,0|1,0,0]=3 673 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)N=C1Cl 0721AC [0,2,0,0,0,0|2,0,0]=4 674 B12R1.1000 O=C(O)C1=C(Cl)C=C(F)C=C1Cl 1528AB [0,2,0,0,0,0|1,0,0]=3 675 B12R1.1000 O=C(O)C1=C(Cl)C=C(I)C=C1Cl 3258AD [0,2,0,0,0,0|1,0,0]=3 676 B12R2.606 CC1=CC2=C(C=CC(N)=C2)O1 8094AD [0,0,0,1,0,1|2,0,0]=4 677 B12R2.606 CC1=CC2=CC=C(O)C=C2O1 7905AB [0,0,0,1,0,1|2,0,0]=4 678 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 7799AD [0,0,0,1,0,1|1,0,0]=3 679 B12R2.606 FC1=CC2=C(C=C1)NC(=S)O2 Y2874 [0,0,0,1,0,1|1,1,0]=4 680 B12R2.606 NC1=CC2=C(C=C1)SC(N)=N2 6947AB [0,0,0,1,0,1|2,0,0]=4 681 B12R2.606 NC1=CN=C2NC(=O)CC2=C1 3319AH [0,0,0,1,0,1|2,0,0]=4 682 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)O1 1748AA [0,0,0,1,0,1|2,0,0]=4 683 B12R2.606 NC1=NC2=CC=C(F)C=C2O1 3455AA [0,0,0,1,0,1|2,0,0]=4 684 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 V2187 [0,0,0,1,0,1|2,0,0]=4 685 B12R2.606 O=C1CC2=CC=C(O)C=C2O1 W1997 [0,0,0,1,0,1|1,0,0]=3 686 B12R2.606 O=C1NC2=C(C=C(I)C=C2)O1 6712AD [0,0,0,1,0,1|1,0,0]=3 687 B12R2.606 O=C1NC2=C(C=C(O)C=C2)O1 5997AH [0,0,0,1,0,1|1,0,0]=3 688 B12R2.606 O=C1OC2=C(C=C(O)C=C2)S1 2094AC [0,0,0,1,0,1|1,1,0]=4 689 B12R2.606 S=C1NC2=CC=C(Br)C=C2O1 W4787 [0,0,0,1,0,1|1,1,0]=4 690 B12R2.612 CC1=CC=C2C(=O)OCC2=C1 3272AJ [0,1,0,1,0,0|1,0,0]=3 691 B12R2.612 CC1=NOC2=CC(Cl)=CC=C21 V7165 [0,1,0,1,0,0|2,0,0]=4 692 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 4591AA [0,1,0,1,0,0|2,0,0]=4 693 B12R2.612 ClC1=NOC2=CC(Br)=CC=C21 SYNMC0812 [0,1,0,1,0,0|2,0,0]=4 694 B12R2.612 FC1=CC=C2C(=C1)ON=C2Cl W5831 [0,1,0,1,0,0|2,0,0]=4 695 B12R2.612 NC1=CC2=C(C=C1)C(Cl)=NN2 Y8246 [0,1,0,1,0,0|2,0,0]=4 696 B12R2.612 NC1=CC2=C(C=C1)C(I)=NN2 Y5631 [0,1,0,1,0,0|2,0,0]=4 697 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 6424AJ [0,1,0,1,0,0|1,0,0]=3 698 B12R2.612 NC1=NOC2=CC(Cl)=CC=C21 V8834 [0,1,0,1,0,0|2,0,0]=4 699 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 2906AL [0,1,0,1,0,0|1,0,0]=3 700 B8R1.1 O=CC1=CC(Cl)=CS1 8472AB [1,0,0,0,1,0|2,0,0]=4 701 B8R1.1 O=CC1=CC=C(I)S1 7666AB [1,0,0,0,1,0|2,0,0]=4 702 B8R1.1 O=CC1=CSC(Br)=C1 9797AA [1,0,0,0,1,0|2,0,0]=4 703 B8R1.1 O=CC1=CSC(Cl)=C1 4568AB [1,0,0,0,1,0|2,0,0]=4 704 B8R1.7 CC(=O)C1=COC=C1 7011AA [1,0,0,0,1,0|2,0,0]=4 705 B8R1.7 NC(=O)C1=CNC=C1 1113AC [1,0,0,0,1,0|2,0,0]=4 706 B8R1.7 NC(=O)C1=CSC=C1 4677AE [1,0,0,0,1,0|2,0,0]=4 707 B8R1.7 O=C(O)C1=CON=C1 V2366 [1,0,0,0,1,0|2,0,0]=4 708 B8R1.7 O=C(O)C1=NC=CO1 Z1844 [1,0,0,0,1,0|2,0,0]=4 709 B8R1.7 O=C(O)C1=NSC=C1 6302AB [1,0,0,0,1,0|2,0,0]=4 710 B10R1.18 BrC(Br)=CC1=CC=CC=C1 1551AC [1,0,0,0,0,1|2,0,0]=4 711 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [1,0,0,0,0,1|2,0,0]=4 712 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [1,0,0,0,0,1|2,0,0]=4 713 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [1,0,0,0,0,1|1,0,1]=4 714 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [1,0,0,0,0,1|2,0,0]=4 715 B10R1.18 O=C(O)CC1=CC=NC=N1 W5433 [1,0,0,0,0,1|2,0,0]=4 716 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [1,0,0,0,0,1|1,0,0]=3 717 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [1,0,0,0,0,1|1,1,0]=4 718 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 2186AC [0,0,0,0,0,2|2,0,0]=4 719 B12R1.21 CC(=O)CCC1=CC=C(Cl)C=C1 1146AE [0,0,0,0,0,2|2,0,0]=4 720 B12R1.21 CC(=O)NCC1=CC=C(F)C=C1 0915AF [0,0,0,0,0,2|2,0,0]=4 721 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 8152AA [0,0,0,0,0,2|2,0,0]=4 722 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7457AD [0,0,0,0,0,2|1,0,0]=3 723 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 7458AD [0,0,0,0,0,2|1,0,0]=3 724 B12R1.21 CC1=CC=C(\C=C\C(=O)Cl)C=C1 3924AD [0,0,0,0,0,2|2,0,0]=4 725 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 W4673 [0,0,0,0,0,2|0,0,0]=2 726 B12R1.21 NC1=CC=C(SCC(=O)O)C=C1 8075AF [0,0,0,0,0,2|0,0,0]=2 727 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 7761AB [0,0,0,0,0,2|0,0,0]=2 728 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Cl)C=C1 4346AF [0,0,0,0,0,2|2,0,0]=4 729 B12R1.21 O=C(O)C=CC1=CC=C(S)C=C1 2914AB [0,0,0,0,0,2|1,0,0]=3 730 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 O075 [0,0,0,0,0,2|1,0,0]=3 731 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 8063AF [0,0,0,0,0,2|1,0,0]=3 732 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)N=C1 2985AA [0,0,0,0,0,2|2,0,0]=4