0 B9R1.35 CC(=O)C1=CC(N)=NN1 SPC-n888 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CN=C(N)S1 SPC-n879 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC(=O)C1=CSC(Cl)=C1 SPC-h825 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.35 CC1=CN=C(C(=O)[O-])O1 SPC-i906 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.35 CC1=CSC(C(=O)O)=C1 SPC-n156 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.35 CC1=NNC(C(=O)O)=C1 SPC-k758 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.35 CN1C=C(C(=O)O)C=N1 SPC-g547 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.35 CN1C=C([N+](=O)[O-])C=N1 SPC-g651 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.35 CN1C=CC(C(=O)O)=N1 SPC-t579 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CN1C=NC(C(=O)O)=C1 SPC-j762 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 C[C@H](O)C1=CSC(Cl)=C1 SPC-k870 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.35 NC(=O)C1=CC=C(Br)N1 SPC-m101 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.35 NC1=NC(C(=O)O)=CO1 SPC-k774 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SPC-g094 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.35 O=C(O)C1=CC=C(F)S1 SPC-j710 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.35 O=C(O)C1=CN=C(Br)S1 SPC-p181 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 O=C(O)C1=CSC(Br)=C1 SPC-t048 [0,0,0,0,0,0|1,0,0]=1 17 B9R1.35 O=C(O)C1=CSC(Cl)=C1 SPC-j712 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.35 O=C(O)C1=NC(Br)=CS1 SPC-k776 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.35 O=C(O)C1=NC=C(Br)S1 SPC-n181 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.1 CC1=CC(C=O)=CS1 SPC-k319 [1,0,0,0,0,0|0,0,0]=1 21 B8R1.1 CN1C=C(C=O)C=N1 SPC-g577 [1,0,0,0,0,0|2,0,0]=3 22 B8R1.1 CN1C=C(CO)C=N1 SPC-j412 [1,0,0,0,0,0|2,0,1]=4 23 B8R1.1 CN1C=NC(C=O)=C1 SPC-h471 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.1 N#CC1=CSC(Br)=C1 SPC-n209 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.1 N#CC1=CSC(Cl)=C1 SPC-j589 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.1 NCC1=CSC(Br)=C1 SPC-s699 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.1 NCC1=CSC(Cl)=C1 SPC-j590 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.1 O=CC1=CC(Br)=CS1 SPC-t562 [1,0,0,0,0,0|3,0,0]=4 29 B8R1.1 O=CC1=CN=C(Cl)S1 SPC-t705 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.1 O=CC1=CSC(Br)=C1 SPC-r371 [1,0,0,0,0,0|1,0,0]=2 31 B8R1.1 O=CC1=CSC(Cl)=C1 SPC-j711 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.7 CC(=O)C1=CNN=C1 SPC-h422 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.7 CC(=O)C1=CSC=C1 SPC-g143 [1,0,0,0,0,0|1,0,0]=2 34 B8R1.7 O=C(O)C1=CC=CN1 SPC-g146 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.7 O=C(O)C1=CNN=C1 SPC-g179 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.7 O=C(O)C1=COC=C1 SPC-n400 [1,0,0,0,0,0|0,1,0]=2 37 B8R1.7 O=C(O)C1=COC=N1 SPC-g687 [1,0,0,0,0,0|1,1,0]=3 38 B8R1.7 O=C(O)C1=COCC1 SPC-g480 [1,0,0,0,0,0|0,1,2]=4 39 B8R1.7 O=C(O)C1=CSN=C1 SPC-r366 [1,0,0,0,0,0|1,0,0]=2 40 B8R1.7 O=C(O)C1=NNC=C1 SPC-g199 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.14 COC(=O)C1=CC(Br)=CN1 SPC-g315 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.14 COC(=O)C1=CC(Br)=CS1 SPC-j659 [0,1,0,0,0,0|3,0,0]=4 43 B10R1.14 COC(=O)C1=CC(Cl)=CS1 SPC-k813 [0,1,0,0,0,0|3,0,0]=4 44 B10R1.14 COC(=O)C1=CC(I)=NN1 SPC-k716 [0,1,0,0,0,0|3,0,0]=4 45 B10R1.14 COC(=O)C1=CC(N)=NN1 SPC-k244 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.14 COC(=O)C1=CC=C(Br)S1 SPC-j660 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.14 COC(=O)C1=CC=C(N)O1 SPC-k486 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.14 COC(=O)C1=CN(C)C=N1 SPC-m489 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.14 COC(=O)C1=COC(N)=N1 SPC-q996 [0,1,0,0,0,0|2,1,0]=4 50 B10R1.14 COC(=O)C1=CSC(Cl)=C1 SPC-k869 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.14 COC(=O)C1=NC=C(C)O1 SPC-n447 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.14 COC(=O)C1=NN(C)C=C1 SPC-h234 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.14 COC(=O)C1=NNC(Cl)=C1 SPC-m488 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.58 CN1N=C(C(=O)O)C=C1N SPC-k111 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.59 CC(=O)C1=C(Cl)SC(Cl)=C1 SPC-k198 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 SPC-s483 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 SPC-g754 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.59 CC1=NN(C)C=C1C(=O)O SPC-m505 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.59 CN1C=C(F)C(C(=O)O)=N1 SPC-v129 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.59 CN1N=C(Cl)C=C1C(=O)O SPC-j832 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.194 CC1=C(C(=O)O)C=NN1C SPC-m905 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.194 CC1=CNC(C(=O)O)=C1C SPC-h485 [0,1,0,0,0,0|2,0,0]=3 63 B8R0.28 CN(C)C\C=C\C(=O)O SPC-m774 [0,0,1,0,0,0|2,0,1]=4 64 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 SPC-v154 [0,0,0,0,0,1|3,0,0]=4 65 B10R1.13 CC1=CN=C(C(=O)O)C=N1 SPC-h803 [0,0,0,0,0,1|1,0,0]=2 66 B10R1.13 CC1=CN=C(C(=O)O)N=C1 SPC-h567 [0,0,0,0,0,1|2,0,0]=3 67 B10R1.13 CC1=NC=C(B(O)O)C=N1 SPC-n693 [0,0,0,0,0,1|2,0,1]=4 68 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SPC-t870 [0,0,0,0,0,1|1,0,0]=2 69 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 SPC-g634 [0,0,0,0,0,1|2,0,1]=4 70 B10R1.13 NC(=O)C1=NC=C(O)C=C1 SPC-u527 [0,0,0,0,0,1|3,0,0]=4 71 B10R1.13 NC1=CN=C(C(=O)O)C=C1 SPC-g569 [0,0,0,0,0,1|2,0,0]=3 72 B10R1.13 NC1=CN=C(C(=O)O)N=C1 SPC-t633 [0,0,0,0,0,1|3,0,0]=4 73 B10R1.13 NC1=NC=C(C(=O)O)C=C1 SPC-j431 [0,0,0,0,0,1|2,0,0]=3 74 B10R1.13 NC1=NN=C(C(=O)O)C=C1 SPC-h063 [0,0,0,0,0,1|3,0,0]=4 75 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 SPC-k216 [0,0,0,0,0,1|2,0,0]=3 76 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 SPC-g051 [0,0,0,0,0,1|2,0,0]=3 77 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 SPC-g367 [0,0,0,0,0,1|2,0,0]=3 78 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 SPC-g701 [0,0,0,0,0,1|2,0,0]=3 79 B10R1.13 O=C(O)C1=CN=C(F)C=C1 SPC-p809 [0,0,0,0,0,1|2,0,0]=3 80 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 SPC-g079 [0,0,0,0,0,1|2,0,0]=3 81 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 SPC-t053 [0,0,0,0,0,1|2,0,0]=3 82 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 SPC-k975 [0,0,0,0,0,1|3,0,0]=4 83 B10R1.13 O=C(O)C1=NC=C(F)C=N1 SPC-h700 [0,0,0,0,0,1|3,0,0]=4 84 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SPC-g279 [0,0,0,0,0,1|2,0,0]=3 85 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 SPC-j945 [0,0,0,0,0,1|3,0,0]=4 86 B10R1.13 O=C(O)C1=NN=C(O)C=C1 SPC-g471 [0,0,0,0,0,1|3,0,0]=4 87 B10R1.13 O=C1C=CC(C(=O)O)=CO1 SPC-k150 [0,0,0,0,0,1|1,1,0]=3 88 B10R1.54 CN1C=NC(CC(=O)O)=C1 SPC-q884 [0,0,0,0,0,1|3,0,0]=4 89 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SPC-g746 [0,0,0,0,0,1|3,0,0]=4 90 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SPC-g513 [0,0,0,0,0,1|1,0,0]=2 91 B10R1.113 CC1=CC(C(=O)O)=CN=N1 SPC-v546 [0,0,0,0,0,1|1,0,0]=2 92 B10R1.113 CC1=CC(C(=O)O)=NC=N1 SPC-m029 [0,0,0,0,0,1|1,0,0]=2 93 B10R1.113 CC1=CC(C(=O)O)=NN=C1 SPC-m730 [0,0,0,0,0,1|2,0,0]=3 94 B10R1.113 CC1=CC=NC(C(=O)O)=N1 SPC-k969 [0,0,0,0,0,1|2,0,0]=3 95 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 SPC-m628 [0,0,0,0,0,1|3,0,0]=4 96 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SPC-g504 [0,0,0,0,0,1|2,0,0]=3 97 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SPC-g233 [0,0,0,0,0,1|3,0,0]=4 98 B10R1.113 NC1=NC=CC(C(=O)O)=C1 SPC-g225 [0,0,0,0,0,1|2,0,0]=3 99 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SPC-s846 [0,0,0,0,0,1|2,0,0]=3 100 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 SPC-g633 [0,0,0,0,0,1|2,0,0]=3 101 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 SPC-h274 [0,0,0,0,0,1|2,0,0]=3 102 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 SPC-m109 [0,0,0,0,0,1|2,0,0]=3 103 B10R1.113 O=C(O)C1=CC(F)=CN=C1 SPC-g694 [0,0,0,0,0,1|2,0,0]=3 104 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SPC-g630 [0,0,0,0,0,1|2,0,0]=3 105 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 SPC-t071 [0,0,0,0,0,1|3,0,0]=4 106 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 SPC-g340 [0,0,0,0,0,1|3,0,0]=4 107 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 SPC-m984 [0,0,0,0,0,1|3,0,0]=4 108 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 SPC-g574 [0,0,0,0,0,1|3,0,0]=4 109 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SPC-g433 [0,0,0,0,0,1|2,0,0]=3 110 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SPC-k816 [0,0,0,0,0,1|2,0,0]=3 111 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 SPC-t005 [0,0,0,0,0,1|2,0,0]=3 112 B10R1.113 O=C(O)C1=NC=CC(I)=C1 SPC-m662 [0,0,0,0,0,1|2,0,0]=3 113 B7R1.1 O=CC1=CC=NN1 SPC-p008 [2,0,0,0,0,0|2,0,0]=4 114 B7R1.1 O=CC1=CN=CS1 SPC-s113 [2,0,0,0,0,0|2,0,0]=4 115 B7R1.1 O=CC1=CNN=C1 SPC-g855 [2,0,0,0,0,0|2,0,0]=4 116 B7R1.1 O=CC1=CNN=C1 SPC-k121 [2,0,0,0,0,0|2,0,0]=4 117 B7R1.1 O=CC1=COC=N1 SPC-m897 [2,0,0,0,0,0|1,1,0]=4 118 B7R1.1 O=CC1=CSC=C1 SPC-g519 [2,0,0,0,0,0|0,0,0]=2 119 B7R1.2 CC1=NC(Br)=CS1 SPC-r369 [2,0,0,0,0,0|2,0,0]=4 120 B7R1.2 NC1=CSC(Cl)=C1 SPC-k871 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.132 CC1=CNC(C=O)=C1C SPC-m565 [1,1,0,0,0,0|2,0,0]=4 122 B9R1.11 COC(=O)C1=CC=CN1 SPC-g232 [1,1,0,0,0,0|2,0,0]=4 123 B9R1.11 COC(=O)C1=CNC=N1 SPC-k809 [1,1,0,0,0,0|2,0,0]=4 124 B9R1.11 COC(=O)C1=CNN=C1 SPC-g646 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.41 CC1=CSC=C1C(=O)O SPC-r375 [1,1,0,0,0,0|0,0,0]=2 126 B9R1.41 CN1C=NC=C1C(=O)O SPC-g435 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.41 CN1N=CC=C1C(=O)O SPC-g327 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.41 NC1=C(C(=O)O)C=CS1 SPC-t631 [1,1,0,0,0,0|0,0,0]=2 129 B9R1.41 NC1=NSN=C1C(=O)O SPC-r368 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.41 O=C(O)C1=C(Br)C=CS1 SPC-g312 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.41 O=C(O)C1=CSC=C1Br SPC-m027 [1,1,0,0,0,0|0,0,0]=2 132 B9R1.164 CC1(C)C=C(C(=O)O)C1 SPC-j758 [0,1,0,0,1,0|0,0,2]=4 133 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 SPC-t403 [0,1,0,0,0,1|1,0,1]=4 134 B11R1.3 C#CC1=NC=C(C(=O)O)C=C1 SPC-v365 [0,1,0,0,0,1|1,0,1]=4 135 B11R1.3 COC1=CN=C(C(=O)O)C=C1 SPC-k940 [0,1,0,0,0,1|1,0,0]=3 136 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SPC-t080 [0,1,0,0,0,1|1,0,0]=3 137 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 SPC-p216 [0,1,0,0,0,1|1,0,1]=4 138 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 SPC-j432 [0,1,0,0,0,1|2,0,0]=4 139 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 SPC-t672 [0,1,0,0,0,1|1,0,0]=3 140 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-h020 [0,1,0,0,0,1|2,0,0]=4 141 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-m758 [0,1,0,0,0,1|2,0,0]=4 142 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-t952 [0,1,0,0,0,1|2,0,0]=4 143 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-u837 [0,1,0,0,0,1|2,0,0]=4 144 B11R1.21 CC1=NC=C(C(=O)O)C=C1N SPC-m181 [0,1,0,0,0,1|1,0,0]=3 145 B11R1.21 CN1C=C(C(=O)O)C=CC1=O SPC-j150 [0,1,0,0,0,1|2,0,0]=4 146 B11R1.21 CN1C=CC(C(=O)O)=CC1=O SPC-g869 [0,1,0,0,0,1|2,0,0]=4 147 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 SPC-n109 [0,1,0,0,0,1|2,0,0]=4 148 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br SPC-j257 [0,1,0,0,0,1|2,0,0]=4 149 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 SPC-t585 [0,1,0,0,0,1|2,0,0]=4 150 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 SPC-t067 [0,1,0,0,0,1|2,0,0]=4 151 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 SPC-m316 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 SPC-g326 [0,1,0,0,0,1|2,0,0]=4 153 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 SPC-h297 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.22 COC(=O)C1=CNC(=O)C=C1 SPC-g661 [0,1,0,0,0,1|2,0,0]=4 155 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 SPC-g129 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.22 COC(=O)C1=NC=C(C)C=N1 SPC-j807 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.22 COC(=O)C1=NC=C(F)C=C1 SPC-n445 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.22 COC(=O)C1=NC=C(N)C=C1 SPC-g909 [0,1,0,0,0,1|2,0,0]=4 159 B11R1.22 COC(=O)C1=NC=C(N)N=C1 SPC-h355 [0,1,0,0,0,1|2,0,0]=4 160 B11R1.22 COC(=O)C1=NC=C(O)C=C1 SPC-j676 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 SPC-k301 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O SPC-p660 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 SPC-p379 [0,1,0,0,0,1|1,0,0]=3 164 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 SPC-g171 [0,1,0,0,0,1|1,0,0]=3 165 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 SPC-j816 [0,1,0,0,0,1|1,0,0]=3 166 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 SPC-g789 [0,1,0,0,0,1|2,0,0]=4 167 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O SPC-j138 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O SPC-k826 [0,1,0,0,0,1|2,0,0]=4 169 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O SPC-n110 [0,1,0,0,0,1|2,0,0]=4 170 B11R1.166 NC1=CC(F)=CN=C1C(=O)O SPC-t445 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.166 NC1=CC(F)=NC=C1C(=O)O SPC-p489 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SPC-k263 [0,1,0,0,0,1|2,0,0]=4 173 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 SPC-r421 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br SPC-s216 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl SPC-n021 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl SPC-g590 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F SPC-h201 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl SPC-m047 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 SPC-j998 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.39 COC(=O)CC1=CN(C)N=C1 SPC-q091 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.39 COC(=O)CC1=NNC(C)=C1 SPC-t419 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 SPC-m420 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.23 COC(=O)C1=CC(=O)NC=C1 SPC-g578 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 SPC-g200 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 SPC-h440 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.23 COC(=O)C1=CC(F)=CN=C1 SPC-n446 [0,1,0,0,0,1|2,0,0]=4 187 B11R1.23 COC(=O)C1=NC(C)=CC=N1 SPC-k581 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 SPC-g575 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SPC-g180 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.23 COC(=O)C1=NC=CC(F)=C1 SPC-r207 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.23 COC(=O)C1=NC=CC(N)=C1 SPC-j118 [0,1,0,0,0,1|2,0,0]=4 192 B11R1.23 COC(=O)C1=NC=NC(C)=C1 SPC-t667 [0,1,0,0,0,1|1,0,0]=3 193 B11R1.23 COC(=O)C1=NC=NC(N)=C1 SPC-n449 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.23 COC(=O)C1=NN=CC(C)=C1 SPC-q154 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 SPC-s862 [0,1,0,0,0,1|1,0,0]=3 196 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 SPC-m595 [0,1,0,0,0,1|1,0,0]=3 197 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 SPC-m327 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=N1 SPC-t774 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O SPC-u228 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.159 CN1C=CC=C(C(=O)O)C1=O SPC-p035 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O SPC-p488 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 SPC-k299 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.167 CC1=CC(C(=O)O)=C(C)C=N1 SPC-u756 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 SPC-g542 [0,1,0,0,0,1|1,0,0]=3 205 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 SPC-j717 [0,1,0,0,0,1|1,0,0]=3 206 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 SPC-p323 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 SPC-n052 [0,1,0,0,0,1|2,0,0]=4 208 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 SPC-v649 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 SPC-p680 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 SPC-j633 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O SPC-g923 [0,1,0,0,0,1|2,0,0]=4 212 B11R1.167 NC1=CN=C(F)C=C1C(=O)O SPC-t026 [0,1,0,0,0,1|2,0,0]=4 213 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O SPC-j139 [0,1,0,0,0,1|2,0,0]=4 214 B11R1.167 NC1=NC=C(F)C=C1C(=O)O SPC-p162 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 SPC-g237 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl SPC-p650 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.167 O=C(O)C1=CC(Br)=CN=C1F SPC-t586 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O SPC-h714 [0,1,0,0,0,1|2,0,0]=4 219 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl SPC-m616 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F SPC-s841 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1Cl SPC-g528 [0,1,0,0,0,1|2,0,0]=4 222 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl SPC-g236 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.266 COC1=CC(C(=O)O)=CN=N1 SPC-p817 [0,1,0,0,0,1|1,0,0]=3 224 B11R1.15 CCOC(=O)C1=CN(C)N=C1 SPC-g811 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 SPC-g387 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.49 CCN1N=C(C)C=C1C(=O)O SPC-h084 [0,2,0,0,0,0|2,0,0]=4 227 B9R1.6 O=C(O)C1=CN=CN=C1 SPC-g357 [0,0,1,1,0,0|2,0,0]=4 228 B9R1.2 CC1=CC(CO)=CN=C1 SPC-j744 [1,0,0,0,0,1|1,0,1]=4 229 B9R1.2 CC1=CC(CO)=NC=N1 SPC-k988 [1,0,0,0,0,1|1,0,1]=4 230 B9R1.2 CC1=CC=NC(C=O)=N1 SPC-t698 [1,0,0,0,0,1|2,0,0]=4 231 B9R1.2 O=CC1=CC(Cl)=CN=C1 SPC-t054 [1,0,0,0,0,1|2,0,0]=4 232 B9R1.2 O=CC1=CC(Cl)=NC=C1 SPC-g523 [1,0,0,0,0,1|2,0,0]=4 233 B9R1.2 O=CC1=CC(F)=CN=C1 SPC-m553 [1,0,0,0,0,1|2,0,0]=4 234 B9R1.2 O=CC1=NC=CC(Br)=C1 SPC-p520 [1,0,0,0,0,1|2,0,0]=4 235 B9R1.2 O=CC1=NC=CC(Cl)=C1 SPC-g681 [1,0,0,0,0,1|2,0,0]=4 236 B9R1.13 O=C(O)CC1=CC=NN1 SPC-v144 [1,0,0,0,0,1|2,0,0]=4 237 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SPC-j674 [0,0,0,0,0,2|2,0,0]=4 238 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SPC-m376 [0,0,0,0,0,2|2,0,0]=4 239 B11R1.157 CC1=CC(CC(=O)O)=CN=C1 SPC-r232 [0,0,0,0,0,2|1,0,0]=3 240 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 SPC-m551 [0,0,0,0,0,2|2,0,0]=4