0 B6R0.6 CC\C=C/CCI 98107 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.2 C=CCCNC W16107 [1,0,0,0,0,0|1,0,2]=4 2 B7R0.3 COC(=O)\C=C\CCl AT12623 [0,1,0,0,0,0|2,0,1]=4 3 B7R0.3 COC(=O)\C=C\CN AT20770 [0,1,0,0,0,0|2,0,1]=4 4 B7R0.4 C\C=C/C=C/C(=O)O D86563 [0,1,0,0,0,0|0,0,0]=1 5 B7R1.1 C=CC1=CC=CS1 C10114 [0,0,0,1,0,0|0,1,1]=3 6 B7R1.1 C=CC1=CN=CN1 D82417 [0,0,0,1,0,0|2,0,1]=4 7 B7R1.1 C=CC1=NNC=C1 P13173 [0,0,0,1,0,0|2,0,1]=4 8 B7R1.1 CNC1=NC=CO1 71780 [0,0,0,1,0,0|2,0,1]=4 9 B7R1.1 CNC1=NC=CS1 26158 [0,0,0,1,0,0|2,1,0]=4 10 B7R1.1 CNC1=NNC=C1 72540 [0,0,0,1,0,0|3,0,0]=4 11 B7R1.1 CNC1=NOC=C1 72015 [0,0,0,1,0,0|3,0,0]=4 12 B7R1.1 CNC1=NOC=C1 72539 [0,0,0,1,0,0|3,0,0]=4 13 B7R1.1 COC1=NNC=C1 D79536 [0,0,0,1,0,0|3,0,0]=4 14 B7R1.1 CSC1=CN=CN1 W17049 [0,0,0,1,0,0|3,0,0]=4 15 B7R1.1 CSC1=NC=CN1 AC1458 [0,0,0,1,0,0|3,0,0]=4 16 B7R1.1 CSC1=NC=CO1 O10533 [0,0,0,1,0,0|2,0,1]=4 17 B7R1.1 ClCC1=CC=CS1 79790 [0,0,0,1,0,0|1,1,1]=4 18 B7R1.1 NCC1=CC=CN1 25931 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.1 O=CC1=CC=C[Se]1 T72165 [0,0,0,1,0,0|1,0,0]=2 20 B7R1.1 O=CC1=CC=NS1 62852 [0,0,0,1,0,0|2,0,0]=3 21 B7R1.1 O=CC1=CCC=C1 77835 [0,0,0,1,0,0|0,0,2]=3 22 B7R1.1 O=CC1=CCCC1 26227 [0,0,0,1,0,0|0,0,2]=3 23 B7R1.1 O=CC1=CCCO1 D79895 [0,0,0,1,0,0|1,0,2]=4 24 B7R1.1 O=CC1=CN=CO1 39069 [0,0,0,1,0,0|2,0,0]=3 25 B7R1.1 O=CC1=CNN=N1 F13257 [0,0,0,1,0,0|3,0,0]=4 26 B7R1.1 O=CC1=CON=C1 95893 [0,0,0,1,0,0|2,0,1]=4 27 B7R1.1 O=CC1=NOC=C1 P10400 [0,0,0,1,0,0|2,0,0]=3 28 B7R1.3 BrC1=NC=NC=C1 54642 [0,0,0,1,0,0|3,0,0]=4 29 B7R1.3 BrC1=NC=NC=C1 54644 [0,0,0,1,0,0|3,0,0]=4 30 B7R1.3 CC1=NC=CN=N1 C74235 [0,0,0,1,0,0|3,0,0]=4 31 B7R1.3 ClC1=CN=CC=C1 P19758 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.3 ClC1=NN=CC=C1 57588 [0,0,0,1,0,0|3,0,0]=4 33 B7R1.3 NC1=CC=CC=C1 T70935 [0,0,0,1,0,0|1,0,1]=3 34 B7R1.3 NC1=CC=CC=C1 T71037 [0,0,0,1,0,0|1,0,1]=3 35 B7R1.3 O=C1C=CCCN1 88830 [0,0,0,1,0,0|1,0,2]=4 36 B7R1.3 O=C1C=CCOC1 O10790 [0,0,0,1,0,0|1,0,1]=3 37 B7R1.3 O=C1C=CNN=C1 D87946 [0,0,0,1,0,0|2,0,1]=4 38 B7R1.3 SC1=NC=CN=C1 F16108 [0,0,0,1,0,0|2,1,0]=4 39 B7R1.4 BrC1=C(I)SC=C1 C75822 [0,0,0,1,0,0|3,0,0]=4 40 B7R1.4 CC1=C(Br)C=NO1 F19689 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.4 CC1=C(C)NC=C1 F20873 [0,0,0,1,0,0|2,0,0]=3 42 B7R1.4 CC1=C(C)NC=N1 SC3541 [0,0,0,1,0,0|3,0,0]=4 43 B7R1.4 CC1=C(Cl)NC=N1 P16604 [0,0,0,1,0,0|3,0,0]=4 44 B7R1.4 CC1=C(N)C=NO1 D82481 [0,0,0,1,0,0|3,0,0]=4 45 B7R1.4 CC1=C(N)N=CN1 31730 [0,0,0,1,0,0|3,0,0]=4 46 B7R1.4 CC1=C(N)ON=C1 C74807 [0,0,0,1,0,0|3,0,0]=4 47 B7R1.4 CC1=C(N)SC=N1 P18586 [0,0,0,1,0,0|3,0,0]=4 48 B7R1.4 CC1=CCOC1=O T72100 [0,0,0,1,0,0|1,0,1]=3 49 B7R1.4 CC1=CNN=C1N 52526 [0,0,0,1,0,0|3,0,0]=4 50 B7R1.4 CC1=CON=C1N 72247 [0,0,0,1,0,0|3,0,0]=4 51 B7R1.4 CC1=CSC=C1N P10841 [0,0,0,1,0,0|2,0,0]=3 52 B7R1.4 CC1=NOC=C1N O11036 [0,0,0,1,0,0|3,0,0]=4 53 B7R1.4 CC1=NSC=C1Br 20343 [0,0,0,1,0,0|3,0,0]=4 54 B7R1.4 CC1=NSC=C1N 75880 [0,0,0,1,0,0|3,0,0]=4 55 B7R1.4 CN1C=CN=C1I 23828 [0,0,0,1,0,0|3,0,0]=4 56 B7R1.4 CN1C=CNC1=O F12570 [0,0,0,1,0,0|2,0,0]=3 57 B7R1.4 CN1C=NC=C1N 27441 [0,0,0,1,0,0|3,0,0]=4 58 B7R1.4 CN1C=NC=C1N FD10512 [0,0,0,1,0,0|3,0,0]=4 59 B7R1.4 NC1=CSC=C1Br P15392 [0,0,0,1,0,0|3,0,0]=4 60 B4R0.2 C=C\C=C/C T71862 [2,0,0,0,0,0|0,0,0]=2 61 B4R0.2 N\C=C\C=O W10858 [2,0,0,0,0,0|1,0,0]=3 62 B6R0.1 C=C=CC(=O)OC F20885 [1,1,0,0,0,0|1,0,1]=4 63 B6R0.1 COC(=O)\C=C\I C10406 [1,1,0,0,0,0|2,0,0]=4 64 B6R0.4 C=CCCC(=O)Cl F16765 [1,1,0,0,0,0|0,0,2]=4 65 B6R0.4 CC(=O)CCC=O P17049 [1,1,0,0,0,0|0,0,2]=4 66 B6R0.4 COC=CC(=O)O D97266 [1,1,0,0,0,0|1,0,0]=3 67 B6R0.4 O=C(O)\C=C\CCl 11303 [1,1,0,0,0,0|1,0,1]=4 68 B6R0.4 O=C\C=C\B(O)O A50009 [1,1,0,0,0,0|2,0,0]=4 69 B8R0.6 COC\C=C\C(=O)OC P17071 [0,2,0,0,0,0|1,0,1]=4 70 B8R0.9 CCC(C)=CCC(=O)O C75612 [0,2,0,0,0,0|0,0,2]=4 71 B8R0.5 CCC\C(C)=C\C(=O)O A11778 [0,2,0,0,0,0|0,0,2]=4 72 B8R0.28 CC(C)=CCCC(=O)O F16793 [0,2,0,0,0,0|0,0,2]=4 73 B6R1.1 C1=CC=CC=C1 78158 [1,0,0,1,0,0|0,0,1]=3 74 B6R1.1 C1=CC=NC=C1 T72767 [1,0,0,1,0,0|1,0,0]=3 75 B6R1.1 C1=CN=NC=C1 C75894 [1,0,0,1,0,0|2,0,0]=4 76 B6R1.2 CC1=CC=CN1 23756 [1,0,0,1,0,0|1,0,0]=3 77 B6R1.2 CC1=CNC=C1 59365 [1,0,0,1,0,0|1,0,0]=3 78 B6R1.2 CC1=CNN=C1 AT22811 [1,0,0,1,0,0|2,0,0]=4 79 B6R1.2 CC1=COC=C1 W18310 [1,0,0,1,0,0|1,0,0]=3 80 B6R1.2 CC1=NOC=C1 35767 [1,0,0,1,0,0|2,0,0]=4 81 B6R1.2 NC1=CNC=C1 D82737 [1,0,0,1,0,0|2,0,0]=4 82 B6R1.2 NC1=CSC=C1 D77326 [1,0,0,1,0,0|2,0,0]=4 83 B6R1.2 O=C1C=CCN1 AC1277 [1,0,0,1,0,0|1,0,1]=4 84 B6R1.2 SC1=CC=CS1 23061 [1,0,0,1,0,0|1,1,0]=4 85 B6R1.2 SC1=CSC=C1 79297 [1,0,0,1,0,0|1,1,0]=4 86 B8R1.2 BrCC1=NC=CN=C1 31757 [0,1,0,1,0,0|2,0,0]=4 87 B8R1.2 BrCC1=NC=NC=C1 Y10744 [0,1,0,1,0,0|2,0,0]=4 88 B8R1.2 BrCC1=NN=CC=C1 27114 [0,1,0,1,0,0|2,0,0]=4 89 B8R1.2 CCC1=NC=NC=C1 F17281 [0,1,0,1,0,0|1,0,1]=4 90 B8R1.2 CNC1=NC=NC=C1 W10133 [0,1,0,1,0,0|2,0,0]=4 91 B8R1.2 COC1=NC=NC=C1 T72699 [0,1,0,1,0,0|2,0,0]=4 92 B8R1.2 ClCC1=NC=CN=C1 37060 [0,1,0,1,0,0|2,0,0]=4 93 B8R1.2 ClCC1=NN=CC=C1 37063 [0,1,0,1,0,0|2,0,0]=4 94 B8R1.2 N#CC1=NC=CC=C1 D77869 [0,1,0,1,0,0|1,0,1]=4 95 B8R1.2 NCC1=CC=CC=C1 RB3068 [0,1,0,1,0,0|1,0,0]=3 96 B8R1.2 NCC1=CC=CN=N1 36976 [0,1,0,1,0,0|2,0,0]=4 97 B8R1.2 NCC1=CC=CN=N1 AT13034 [0,1,0,1,0,0|2,0,0]=4 98 B8R1.2 NCC1=CC=CN=N1 P15536 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.2 NCC1=CC=NC=C1 35876 [0,1,0,1,0,0|2,0,0]=4 100 B8R1.2 NCC1=NC=CN=C1 67569 [0,1,0,1,0,0|2,0,0]=4 101 B8R1.2 O=CC1=NC=NC=C1 26359 [0,1,0,1,0,0|1,0,0]=3 102 B8R1.2 SCC1=CC=NC=C1 F18336 [0,1,0,1,0,0|2,0,0]=4 103 B8R1.2 SCC1=CN=CC=C1 F18343 [0,1,0,1,0,0|2,0,0]=4 104 B8R1.2 SCC1=NC=CC=C1 Y10072 [0,1,0,1,0,0|1,0,0]=3 105 B8R1.2 [C-]#[N+]C1=CC=CC=C1 AB1473 [0,1,0,1,0,0|1,0,1]=4 106 B8R1.5 BrC1=C(I)C=NC=C1 C76998 [0,1,0,1,0,0|2,0,0]=4 107 B8R1.5 CC1=C(Cl)C=NC=N1 F17326 [0,1,0,1,0,0|2,0,0]=4 108 B8R1.5 CC1=C(F)C=CN=C1 F19730 [0,1,0,1,0,0|1,0,0]=3 109 B8R1.5 CC1=C(I)C=CC=N1 F19761 [0,1,0,1,0,0|1,0,0]=3 110 B8R1.5 CC1=C(I)C=NC=C1 C74973 [0,1,0,1,0,0|1,0,0]=3 111 B8R1.5 CC1=C(I)C=NC=N1 27820 [0,1,0,1,0,0|2,0,0]=4 112 B8R1.5 CC1=CC=NN=C1Br N13316 [0,1,0,1,0,0|2,0,0]=4 113 B8R1.5 CC1=CC=NN=C1Cl 38744 [0,1,0,1,0,0|2,0,0]=4 114 B8R1.5 CC1=CN=CN=C1Br 27819 [0,1,0,1,0,0|2,0,0]=4 115 B8R1.5 CC1=CN=CN=C1O 25833 [0,1,0,1,0,0|1,0,1]=4 116 B8R1.5 CC1=NC=CN=C1Br 26975 [0,1,0,1,0,0|2,0,0]=4 117 B8R1.5 CC1=NC=NC=C1N 25415 [0,1,0,1,0,0|2,0,0]=4 118 B8R1.5 CC1=NNC=NC1=O D79535 [0,1,0,1,0,0|2,0,0]=4 119 B8R1.5 ClC1=CC=CN=C1I 68801 [0,1,0,1,0,0|2,0,0]=4 120 B8R1.5 NC1=C(S)C=CN=C1 AT18151 [0,1,0,1,0,0|1,1,0]=4 121 B8R1.5 NC1=CC=CN=C1I RB1070 [0,1,0,1,0,0|2,0,0]=4 122 B8R1.5 NC1=[N+]([O-])C=CC=C1 T70263 [0,1,0,1,0,0|1,0,1]=4 123 B8R1.5 O=C1NC=CNC1=O W18441 [0,1,0,1,0,0|2,0,0]=4 124 B8R1.5 O=C1NC=NC=C1O 25860 [0,1,0,1,0,0|2,0,0]=4 125 B8R1.5 O=C1NC=NC=C1O C73082 [0,1,0,1,0,0|2,0,0]=4 126 B8R1.5 OC1=C(I)C=CC=N1 CS1389 [0,1,0,1,0,0|1,0,1]=4 127 B8R1.5 OC1=C(I)C=CN=C1 25190 [0,1,0,1,0,0|1,0,1]=4 128 B8R1.5 OC1=C(O)C=NC=C1 C14003 [0,1,0,1,0,0|1,0,1]=4 129 B8R1.5 SC1=C(Br)C=NC=C1 C12894 [0,1,0,1,0,0|1,1,0]=4 130 B8R1.8 NCCC1=CC=CN1 31556 [0,1,0,1,0,0|1,0,1]=4 131 B8R1.8 NCCC1=CC=CN1 F10331 [0,1,0,1,0,0|1,0,1]=4 132 B8R1.8 OCCC1=CC=CN1 AB10351 [0,1,0,1,0,0|1,0,1]=4 133 B8R1.8 OCCC1=CC=CO1 W10532 [0,1,0,1,0,0|0,0,2]=4 134 B8R1.11 C=CC1=NC=CN1C D84862 [0,1,0,1,0,0|2,0,0]=4 135 B8R1.11 CC1=C(C=O)N=CS1 F12255 [0,1,0,1,0,0|1,0,0]=3 136 B8R1.11 CC1=C(C=O)OC=N1 AT18679 [0,1,0,1,0,0|1,0,0]=3 137 B8R1.11 CC1=C(CO)C=CO1 30727 [0,1,0,1,0,0|0,0,2]=4 138 B8R1.11 CC1=CON=C1C=O W10337 [0,1,0,1,0,0|1,0,0]=3 139 B8R1.11 CC1=CSC=C1C#N D76347 [0,1,0,1,0,0|1,0,1]=4 140 B8R1.11 CC1=CSC=C1C=O P16095 [0,1,0,1,0,0|0,0,0]=2 141 B8R1.11 CC1=CSC=C1CO 57803 [0,1,0,1,0,0|0,0,2]=4 142 B8R1.11 CN1C=CC=C1CN 88916 [0,1,0,1,0,0|1,0,1]=4 143 B8R1.11 CN1C=CC=C1CO D82110 [0,1,0,1,0,0|0,0,2]=4 144 B8R1.11 CN1N=CN=C1C=O 97733 [0,1,0,1,0,0|2,0,0]=4 145 B8R1.11 CN1N=NC=C1C=O 92411 [0,1,0,1,0,0|2,0,0]=4 146 B8R1.11 ClC1=C(CBr)C=CS1 24714 [0,1,0,1,0,0|2,0,0]=4 147 B8R1.11 NC1=C(CO)SC=C1 70866 [0,1,0,1,0,0|2,0,0]=4 148 B8R1.11 NCC1=C(Cl)C=CS1 38405 [0,1,0,1,0,0|2,0,0]=4 149 B8R1.11 O=C1CCC=C1CO E70389 [0,1,0,1,0,0|0,0,2]=4 150 B8R1.11 O=CC1=C(Br)C=CN1 P11326 [0,1,0,1,0,0|1,0,0]=3 151 B8R1.11 O=CC1=C(Br)C=NN1 F13682 [0,1,0,1,0,0|2,0,0]=4 152 B8R1.11 O=CC1=C(Br)N=CS1 88252 [0,1,0,1,0,0|2,0,0]=4 153 B8R1.11 O=CC1=C(Br)NC=N1 C75380 [0,1,0,1,0,0|2,0,0]=4 154 B8R1.11 O=CC1=C(Br)SC=C1 57105 [0,1,0,1,0,0|1,0,0]=3 155 B8R1.11 O=CC1=C(Cl)C=NN1 D86408 [0,1,0,1,0,0|2,0,0]=4 156 B8R1.11 O=CC1=C(Cl)N=CS1 27650 [0,1,0,1,0,0|2,0,0]=4 157 B8R1.11 O=CC1=C(Cl)SC=C1 A11316 [0,1,0,1,0,0|1,0,0]=3 158 B8R1.11 O=CC1=C(I)SC=C1 C73596 [0,1,0,1,0,0|1,0,0]=3 159 B8R1.11 O=CC1=NSC=C1Br AT21087 [0,1,0,1,0,0|2,0,0]=4 160 B8R1.49 C1=CCCC=CCC1 A11943 [0,1,0,1,0,0|1,0,1]=4 161 B8R1.49 C1=CCCC=CCC1 C10709 [0,1,0,1,0,0|1,0,1]=4 162 B8R1.49 C1=CCCC=CCC1 D94664 [0,1,0,1,0,0|1,0,1]=4 163 B8R1.49 C1=CCCC=CCC1 F16608 [0,1,0,1,0,0|1,0,1]=4 164 B8R1.49 C1=CCCC=CCC1 F16639 [0,1,0,1,0,0|1,0,1]=4 165 B8R1.49 C1=CCCC=CCC1 H10532 [0,1,0,1,0,0|1,0,1]=4 166 B8R1.49 C1=CCCC=CCC1 O11699 [0,1,0,1,0,0|1,0,1]=4 167 B8R1.49 C1=CCCC=CCC1 S12179 [0,1,0,1,0,0|1,0,1]=4 168 B8R1.49 C1=CCCC=CCC1 T72889 [0,1,0,1,0,0|1,0,1]=4 169 B8R1.1 CC1=CC(C=O)=CS1 P15425 [0,1,0,1,0,0|1,0,0]=3 170 B8R1.1 CC1=CC=C(C=O)N1 29847 [0,1,0,1,0,0|0,0,0]=2 171 B8R1.1 CC1=CC=C(CN)S1 71266 [0,1,0,1,0,0|1,0,1]=4 172 B8R1.1 CC1=CC=C(CO)S1 W10513 [0,1,0,1,0,0|0,0,2]=4 173 B8R1.1 CC1=CN=C(C=O)S1 25174 [0,1,0,1,0,0|1,0,0]=3 174 B8R1.1 CC1=CNC(C=O)=C1 D84258 [0,1,0,1,0,0|1,0,0]=3 175 B8R1.1 CC1=CNC(C=O)=N1 23109 [0,1,0,1,0,0|1,0,0]=3 176 B8R1.1 CC1=COC(C=O)=N1 P10997 [0,1,0,1,0,0|1,0,0]=3 177 B8R1.1 CC1=NC(C=O)=NO1 F13848 [0,1,0,1,0,0|2,0,0]=4 178 B8R1.1 CC1=NC=C(C=O)O1 C10143 [0,1,0,1,0,0|1,0,0]=3 179 B8R1.1 CC1=NN=C(C=O)N1 AC2083 [0,1,0,1,0,0|2,0,0]=4 180 B8R1.1 CC1=NN=C(C=O)S1 Y10085 [0,1,0,1,0,0|2,0,0]=4 181 B8R1.1 CCC1=CC=C(C)O1 A12137 [0,1,0,1,0,0|0,0,2]=4 182 B8R1.1 CN1C=CC(C=O)=C1 AT16322 [0,1,0,1,0,0|1,0,0]=3 183 B8R1.1 CN1C=NC(C=O)=N1 D82935 [0,1,0,1,0,0|2,0,0]=4 184 B8R1.1 O=CC1=CC(Br)=NO1 69281 [0,1,0,1,0,0|2,0,0]=4 185 B8R1.1 O=CC1=CC(I)=CS1 Y10451 [0,1,0,1,0,0|1,0,0]=3 186 B8R1.1 O=CC1=CC=C(Br)N1 O11353 [0,1,0,1,0,0|1,0,0]=3 187 B8R1.1 O=CC1=CC=C(Cl)N1 D95169 [0,1,0,1,0,0|1,0,0]=3 188 B8R1.1 O=CC1=CNC(Br)=C1 F13792 [0,1,0,1,0,0|1,0,1]=4 189 B8R1.1 O=CC1=COC(Br)=N1 AT11059 [0,1,0,1,0,0|2,0,0]=4 190 B8R1.1 O=CC1=CSC(Br)=C1 P10686 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.1 O=CC1=CSC(Cl)=C1 37628 [0,1,0,1,0,0|1,0,1]=4 192 B8R1.1 O=CC1=CSC(Cl)=N1 25211 [0,1,0,1,0,0|2,0,0]=4 193 B8R1.1 O=CC1=NC=C(Cl)S1 38230 [0,1,0,1,0,0|2,0,0]=4 194 B8R1.3 CC1=CC=C(C)N=N1 S11370 [0,1,0,1,0,0|2,0,0]=4 195 B8R1.3 CC1=CN=C(Br)C=N1 88781 [0,1,0,1,0,0|2,0,0]=4 196 B8R1.3 CC1=CN=C(I)C=N1 W17940 [0,1,0,1,0,0|2,0,0]=4 197 B8R1.3 CC1=CN=C(N)C=N1 52044 [0,1,0,1,0,0|2,0,0]=4 198 B8R1.3 CC1=CN=C(O)C=N1 84954 [0,1,0,1,0,0|2,0,0]=4 199 B8R1.3 CC1=NC=C(F)C=N1 O11437 [0,1,0,1,0,0|2,0,0]=4 200 B8R1.3 CC1=NC=C(I)C=C1 C10582 [0,1,0,1,0,0|1,0,0]=3 201 B8R1.3 CC1=NC=C(O)C=N1 25911 [0,1,0,1,0,0|2,0,0]=4 202 B8R1.3 C[C@@H]1C=CC(=O)CC1 P17313 [0,1,0,1,0,0|0,0,2]=4 203 B8R1.3 NC1=CC=C(O)C=C1 C75965 [0,1,0,1,0,0|0,0,2]=4 204 B8R1.3 NC1=NC=C(O)C=C1 BL008086 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.3 NC1=NNC(=O)C=C1 A11691 [0,1,0,1,0,0|2,0,0]=4 206 B8R1.3 O=C1C=C[C@@H](O)OC1 SC1227 [0,1,0,1,0,0|1,0,1]=4 207 B8R1.3 SC1=CC=C(I)C=C1 F20637 [0,1,0,1,0,0|0,1,1]=4 208 B8R1.50 CC1=C(Br)COC1=O W19136 [0,1,0,1,0,0|1,0,1]=4 209 B8R1.50 CC1=CSC(C)=C1N AT16742 [0,1,0,1,0,0|2,0,0]=4 210 B8R1.4 CC1=CC(=S)NC=C1 I11274 [0,1,0,1,0,0|1,1,0]=4 211 B8R1.4 CC1=CC(=S)NC=N1 C75430 [0,1,0,1,0,0|2,0,0]=4 212 B8R1.4 CC1=CC=CC(I)=N1 S10876 [0,1,0,1,0,0|1,0,0]=3 213 B8R1.4 CC1=CN=NC(=O)C1 78530 [0,1,0,1,0,0|2,0,0]=4 214 B8R1.4 CC1=NC=CC(I)=C1 25628 [0,1,0,1,0,0|1,0,0]=3 215 B8R1.4 CC1=NC=CC(N)=N1 25050 [0,1,0,1,0,0|2,0,0]=4 216 B8R1.4 ClC1=CC(I)=NC=C1 O11208 [0,1,0,1,0,0|2,0,0]=4 217 B8R1.4 NC1=CC(=O)COC1 P18321 [0,1,0,1,0,0|1,0,1]=4 218 B8R1.4 NC1=CC(N)=NC=C1 25421 [0,1,0,1,0,0|2,0,0]=4 219 B8R1.4 NC1=CC=CC(I)=N1 76368 [0,1,0,1,0,0|2,0,0]=4 220 B8R1.4 O=C1C=C(Br)NC=N1 F10443 [0,1,0,1,0,0|2,0,0]=4 221 B8R1.4 O=C1N=C(Br)C=CN1 D96558 [0,1,0,1,0,0|2,0,0]=4 222 B8R1.4 OC1=CC(F)=NC=C1 26765 [0,1,0,1,0,0|2,0,0]=4 223 B8R1.4 OC1=NC=CC(F)=C1 22624 [0,1,0,1,0,0|1,0,1]=4 224 B8R1.7 CC(=O)C1=CC=NO1 I11392 [0,1,0,1,0,0|1,0,1]=4 225 B8R1.7 CC(=O)C1=CC=NO1 Y10704 [0,1,0,1,0,0|1,0,1]=4 226 B8R1.7 CC(=O)C1=CC=NS1 62850 [0,1,0,1,0,0|1,1,0]=4 227 B8R1.7 CC(=O)C1=CN=CS1 66660 [0,1,0,1,0,0|1,1,0]=4 228 B8R1.7 CC(=O)C1=NC=CO1 33464 [0,1,0,1,0,0|1,0,1]=4 229 B8R1.7 CC(=O)C1=NOC=C1 33729 [0,1,0,1,0,0|2,0,0]=4 230 B8R1.7 CC(C)C1=CC=CO1 81450 [0,1,0,1,0,0|0,0,2]=4 231 B8R1.7 C[C@H](N)C1=CC=CO1 Y10899 [0,1,0,1,0,0|0,0,2]=4 232 B8R1.7 C[C@H](N)C1=CC=CO1 Y12106 [0,1,0,1,0,0|0,0,2]=4 233 B8R1.7 C[C@H](N)C1=CC=CS1 82880 [0,1,0,1,0,0|0,1,1]=4 234 B8R1.7 C[C@H](N)C1=CC=CS1 D81260 [0,1,0,1,0,0|0,1,1]=4 235 B8R1.7 C[C@H](N)C1=CC=CS1 N11134 [0,1,0,1,0,0|0,1,1]=4 236 B8R1.7 C[C@H](N)C1=CC=CS1 N12970 [0,1,0,1,0,0|0,1,1]=4 237 B8R1.7 C[C@H](N)C1=CC=CS1 Y10683 [0,1,0,1,0,0|0,1,1]=4 238 B8R1.7 N=C(N)C1=CC=CS1 C15965 [0,1,0,1,0,0|1,1,0]=4 239 B8R1.7 NC(=O)C1=CC=NO1 F30843 [0,1,0,1,0,0|2,0,0]=4 240 B8R1.7 NC(=O)C1=CN=CO1 78451 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.7 NC(=O)C1=CN=CS1 D79735 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.7 NC(=O)C1=COC=N1 35847 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.7 NC(=O)C1=NC=CS1 A10602 [0,1,0,1,0,0|2,0,0]=4 244 B8R1.7 NC(=O)C1=NSC=C1 F14137 [0,1,0,1,0,0|2,0,0]=4 245 B8R1.7 O=C(Cl)N1C=CC=N1 72878 [0,1,0,1,0,0|2,0,0]=4 246 B8R1.7 O=C(O)C1=NSC=C1 83207 [0,1,0,1,0,0|2,0,0]=4 247 B8R1.7 O=[N+]([O-])C1=CC=CN1 26912 [0,1,0,1,0,0|2,0,0]=4 248 B8R1.18 CC1=CC(Br)=C(C)S1 AT16738 [0,1,0,1,0,0|2,0,0]=4 249 B8R1.18 CC1=CC(C)=C(C)S1 T71950 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.18 CC1=CC(N)=C(C)S1 86689 [0,1,0,1,0,0|2,0,0]=4 251 B8R1.18 CC1=C[C@@H](O)OC1=O C77517 [0,1,0,1,0,0|1,0,1]=4 252 B8R1.18 CC1=C[C@H](Cl)OC1=O F17135 [0,1,0,1,0,0|1,0,1]=4