0 B6R1.2 BrC1=CC=CO1 CDS020809 [0,0,0,0,0,0|4,0,0]=4 1 B6R1.2 BrC1=NOC=C1 CDS005417 [0,0,0,0,0,0|4,0,0]=4 2 B6R1.2 CC1=CC=NN1 CDS002430 [0,0,0,0,0,0|2,0,0]=2 3 B6R1.2 CC1=COC=C1 CDS019631 [0,0,0,0,0,0|2,0,0]=2 4 B6R1.2 CC1=NC=CS1 CDS000301 [0,0,0,0,0,0|4,0,0]=4 5 B6R1.2 CC1=NNC=N1 CDS020176 [0,0,0,0,0,0|3,0,0]=3 6 B6R1.2 CC1CCNC1 CDS003772 [0,0,0,0,0,0|1,0,3]=4 7 B6R1.2 C[C@@H]1CCNC1 CDS006861 [0,0,0,0,0,0|1,0,3]=4 8 B6R1.2 C[C@H]1CCNC1 CDS009158 [0,0,0,0,0,0|1,0,3]=4 9 B6R1.2 ClC1=CNN=C1 CDS019988 [0,0,0,0,0,0|1,0,0]=1 10 B6R1.2 ClC1=NN=CS1 CBR01805 [0,0,0,0,0,0|4,0,0]=4 11 B6R1.2 IC1=NNC=C1 BML00254 [0,0,0,0,0,0|3,0,0]=3 12 B6R1.2 NC1=CN=CS1 CDS008189 [0,0,0,0,0,0|3,0,0]=3 13 B6R1.2 NC1=CSC=C1 PHB00043 [0,0,0,0,0,0|3,0,0]=3 14 B6R1.2 NC1=NN=CN1 CDS019982 [0,0,0,0,0,0|4,0,0]=4 15 B6R1.2 NN1C=CC=C1 CDS000078 [0,0,0,0,0,0|4,0,0]=4 16 B6R1.2 OC1=NN=CS1 CBR01616 [0,0,0,0,0,0|4,0,0]=4 17 B6R1.2 OC1=NSC=C1 CDS008627 [0,0,0,0,0,0|4,0,0]=4 18 B5R1.1 C1=CCNC1 ANV00248 [1,0,0,0,0,0|1,0,1]=3 19 B5R1.1 C1=NNCC1 CDS000117 [1,0,0,0,0,0|0,0,2]=3 20 B7R1.1 BrCC1=CSC=C1 CDS022029 [0,1,0,0,0,0|2,0,0]=3 21 B7R1.1 C#CC1=CC=NN1 CDS015894 [0,1,0,0,0,0|2,0,1]=4 22 B7R1.1 CCC1=CNN=C1 CBR01738 [0,1,0,0,0,0|0,0,0]=1 23 B7R1.1 CSC1=CC=CS1 R436550 [0,1,0,0,0,0|3,0,0]=4 24 B7R1.1 ClCC1=CN=CS1 CBR02473 [0,1,0,0,0,0|2,0,0]=3 25 B7R1.1 ClCC1=CNC=N1 CBR00821 [0,1,0,0,0,0|2,0,0]=3 26 B7R1.1 ClCC1=CSC=N1 SYX00282 [0,1,0,0,0,0|3,0,0]=4 27 B7R1.1 Cl[Hg]C1=COC=C1 S814148 [0,1,0,0,0,0|3,0,0]=4 28 B7R1.1 N#CC1=CN=CN1 CDS006565 [0,1,0,0,0,0|2,0,1]=4 29 B7R1.1 N#CN1C=CN=C1 CDS017338 [0,1,0,0,0,0|2,0,1]=4 30 B7R1.1 NCC1=CN=CS1 CDS007657 [0,1,0,0,0,0|2,0,0]=3 31 B7R1.1 NCC1=COC=C1 CDS008929 [0,1,0,0,0,0|2,0,0]=3 32 B7R1.1 NCC1=CSN=N1 CDS019170 [0,1,0,0,0,0|2,0,0]=3 33 B7R1.1 O=CC1=CC=NN1 CDS003145 [0,1,0,0,0,0|2,0,1]=4 34 B7R1.1 O=CC1=CNN=N1 CDS009687 [0,1,0,0,0,0|1,0,1]=3 35 B7R1.1 O=CC1=NNC=C1 CDS009918 [0,1,0,0,0,0|2,0,1]=4 36 B7R1.1 OCC1=CC=CN1 CDS009556 [0,1,0,0,0,0|3,0,0]=4 37 B7R1.1 OCC1=CN=CS1 CDS004659 [0,1,0,0,0,0|2,0,0]=3 38 B7R1.1 OCC1=CNN=C1 CDS015812 [0,1,0,0,0,0|0,0,0]=1 39 B7R1.1 OCC1=NOC=C1 PHB00207 [0,1,0,0,0,0|3,0,0]=4 40 B7R1.1 SCC1=CC=CS1 CDS000069 [0,1,0,0,0,0|3,0,0]=4 41 B7R1.2 BrC1=COC(=C1)Br T266507 [0,1,0,0,0,0|3,0,0]=4 42 B7R1.2 CC1=CSC(=N1)Br CDS007616 [0,1,0,0,0,0|3,0,0]=4 43 B7R1.2 CC1=CSC(=N1)N S366536 [0,1,0,0,0,0|3,0,0]=4 44 B7R1.2 CC1=NC(=NO1)N CBR00048 [0,1,0,0,0,0|3,0,0]=4 45 B7R1.2 CC1=NC=C(N1)I ANV00066 [0,1,0,0,0,0|3,0,0]=4 46 B7R1.2 CC1=NN=C(N1)N CDS003576 [0,1,0,0,0,0|3,0,0]=4 47 B7R1.2 CC1=NN=C(O1)N PH010741 [0,1,0,0,0,0|3,0,0]=4 48 B7R1.2 CC1=NN=C(S1)Cl CBR01742 [0,1,0,0,0,0|3,0,0]=4 49 B7R1.2 CC1=NN=C(S1)O CBR01599 [0,1,0,0,0,0|3,0,0]=4 50 B7R1.2 CC1=NNC(=C1)N CDS004036 [0,1,0,0,0,0|2,0,0]=3 51 B7R1.2 CC1=NNC(=N1)N CDS020216 [0,1,0,0,0,0|3,0,0]=4 52 B7R1.2 CC1=NOC(=N1)C PH016136 [0,1,0,0,0,0|3,0,0]=4 53 B7R1.2 CN1C=C(C=N1)N CDS019978 [0,1,0,0,0,0|1,0,0]=2 54 B7R1.2 CN1C=CC(=N1)Br SYX00074 [0,1,0,0,0,0|3,0,0]=4 55 B7R1.2 CN1C=CC(=N1)N CDS013782 [0,1,0,0,0,0|3,0,0]=4 56 B7R1.2 CN1C=NC(=N1)Br CBR01814 [0,1,0,0,0,0|3,0,0]=4 57 B7R1.2 CN1C=NC(=N1)Cl CBR02195 [0,1,0,0,0,0|3,0,0]=4 58 B7R1.2 CN1C=NC(=N1)N CBR00751 [0,1,0,0,0,0|3,0,0]=4 59 B7R1.2 ClC1=NC=C(S1)Br SYX00075 [0,1,0,0,0,0|3,0,0]=4 60 B7R1.2 NC1=CC(=NO1)N CBR01619 [0,1,0,0,0,0|3,0,0]=4 61 B7R1.2 NC1=CC(=O)N=N1 S561037 [0,1,0,0,0,0|3,0,0]=4 62 B7R1.2 NC1=NC=C(S1)Cl CDS021716 [0,1,0,0,0,0|3,0,0]=4 63 B7R1.4 BrC1=C(NC=N1)Br S802263 [0,1,0,0,0,0|3,0,0]=4 64 B7R1.4 BrC1=NNC=C1I PHB00279 [0,1,0,0,0,0|1,0,0]=2 65 B7R1.4 CC1=C(C=NN1)N CBR02396 [0,1,0,0,0,0|1,0,0]=2 66 B7R1.4 CC1=C(C=NO1)I CDS015521 [0,1,0,0,0,0|2,0,0]=3 67 B7R1.4 CC1=C(CCC1)Br T256854 [0,1,0,0,0,0|2,0,1]=4 68 B7R1.4 CC1=C(N=CN1)Br CDS022318 [0,1,0,0,0,0|2,0,0]=3 69 B7R1.4 CC1=CCCC1O T295310 [0,1,0,0,0,0|2,0,1]=4 70 B7R1.4 CC1=NNC=C1I BML00217 [0,1,0,0,0,0|1,0,0]=2 71 B7R1.4 CN1C=CN=C1Cl CDS018561 [0,1,0,0,0,0|2,0,0]=3 72 B7R1.4 CN1C=CN=C1I ANV00120 [0,1,0,0,0,0|2,0,0]=3 73 B7R1.4 CN1C=CN=C1I CDS005078 [0,1,0,0,0,0|2,0,0]=3 74 B7R1.4 CN1C=CN=C1N CBR02443 [0,1,0,0,0,0|2,0,0]=3 75 B7R1.4 CN1C=CSC1=N S945749 [0,1,0,0,0,0|3,0,0]=4 76 B7R1.4 CN1CCN=C1N S897663 [0,1,0,0,0,0|2,0,1]=4 77 B7R1.4 CN1CCNC1=O CDS006142 [0,1,0,0,0,0|2,0,1]=4 78 B7R1.4 CN1N=CC=C1Br CBR02073 [0,1,0,0,0,0|3,0,0]=4 79 B7R1.4 CN1N=CN=C1Br CBR01745 [0,1,0,0,0,0|3,0,0]=4 80 B7R1.4 CN1N=CN=C1Cl CBR02194 [0,1,0,0,0,0|3,0,0]=4 81 B7R1.4 CN1N=NN=C1I CBR00176 [0,1,0,0,0,0|2,0,1]=4 82 B7R1.4 CN1N=NN=C1S S240761 [0,1,0,0,0,0|2,0,1]=4 83 B7R1.4 IC1=CSC=C1I R254975 [0,1,0,0,0,0|3,0,0]=4 84 B7R1.4 NC1=C(NN=C1)N CBR02117 [0,1,0,0,0,0|1,0,0]=2 85 B5R0.1 C=C(C)CSC S866024 [0,0,1,0,0,0|2,0,1]=4 86 B5R0.1 CC(=O)/C=C\N S312274 [0,0,1,0,0,0|2,0,0]=3 87 B5R0.1 CC(=O)CCN OTV000740 [0,0,1,0,0,0|2,0,1]=4 88 B5R0.1 CC(C)C=NO S388378 [0,0,1,0,0,0|1,0,2]=4 89 B5R0.1 CNCC(=O)C CBR02406 [0,0,1,0,0,0|2,0,1]=4 90 B5R0.3 C/C(=C\Br)/CO S881295 [0,0,1,0,0,0|2,0,1]=4 91 B7R1.3 BrC1=CC=CN=N1 CDS023312 [0,0,0,0,0,1|3,0,0]=4 92 B7R1.3 BrC1=CN=CC=N1 CDS005022 [0,0,0,0,0,1|2,0,0]=3 93 B7R1.3 BrC1=CN=NC=C1 CDS022809 [0,0,0,0,0,1|1,0,1]=3 94 B7R1.3 CC1=CC=NC=C1 T256412 [0,0,0,0,0,1|1,0,0]=2 95 B7R1.3 CC1=CC=NC=C1 T330418 [0,0,0,0,0,1|1,0,0]=2 96 B7R1.3 CC1=CCCNC1 PHB00292 [0,0,0,0,0,1|1,0,1]=3 97 B7R1.3 CC1=CCNCC1 CBR01822 [0,0,0,0,0,1|1,0,1]=3 98 B7R1.3 NC1=CC=CC=C1 S698326 [0,0,0,0,0,1|3,0,0]=4 99 B7R1.3 NC1=CC=CC=N1 S822329 [0,0,0,0,0,1|3,0,0]=4 100 B7R1.3 NC1=CC=NN=C1 CDS006078 [0,0,0,0,0,1|1,0,1]=3 101 B7R1.3 O=C1C=CC=CN1 T160121 [0,0,0,0,0,1|3,0,0]=4 102 B7R1.3 O=C1C=CNC=C1 T161470 [0,0,0,0,0,1|2,0,0]=3 103 B7R1.3 O=C1C=CSC=C1 T162035 [0,0,0,0,0,1|3,0,0]=4 104 B7R1.3 OC1=CC=NC=C1 CDS013613 [0,0,0,0,0,1|2,0,0]=3 105 B7R1.3 S=C1C=CSC=C1 S874310 [0,0,0,0,0,1|3,0,0]=4 106 B7R1.3 [O-]C1=CC=CC=C1 CDS001581 [0,0,0,0,0,1|3,0,0]=4 107 B7R1.3 [O-]C1=CN=CC=N1 S451452 [0,0,0,0,0,1|2,0,0]=3 108 B7R1.3 [S-]C1=CC=CC=C1 S578991 [0,0,0,0,0,1|3,0,0]=4 109 B4R0.1 C=C(C)CN CDS003053 [1,0,1,0,0,0|0,0,1]=3 110 B4R0.1 CC(=O)CN CDS020585 [1,0,1,0,0,0|1,0,1]=4 111 B4R0.2 C=CCCN CDS021978 [1,0,1,0,0,0|1,0,1]=4 112 B6R0.2 CC(=CN(C)C)C S365297 [0,1,1,0,0,0|1,0,1]=4 113 B8R1.2 C#CC1=CC=NC=C1 CDS000023 [0,1,0,0,0,1|1,0,1]=4 114 B8R1.2 C(=O)C1=CN=CN=C1 CDS004733 [0,1,0,0,0,1|0,0,2]=4 115 B8R1.2 CSC1=NC=CN=N1 SYX00362 [0,1,0,0,0,1|2,0,0]=4 116 B8R1.2 NCC1=CC=CC=C1 S696684 [0,1,0,0,0,1|2,0,0]=4 117 B8R1.2 NCC1=CN=CC=C1 S763780 [0,1,0,0,0,1|1,0,0]=3 118 B8R1.2 NCC1=CN=CC=N1 CDS009594 [0,1,0,0,0,1|1,0,0]=3 119 B8R1.2 O=CC1=CN=CC=N1 CDS008587 [0,1,0,0,0,1|1,0,1]=4 120 B8R1.2 OCC1=CC=CN=N1 CDS015970 [0,1,0,0,0,1|2,0,0]=4 121 B8R1.3 CC1=CN=C(N=C1)N CDS009715 [0,1,0,0,0,1|0,0,1]=3 122 B8R1.3 CC1=CN=C(N=C1)O CBR01548 [0,1,0,0,0,1|0,0,1]=3 123 B8R1.3 CC1=CNC(=O)C=C1 T162647 [0,1,0,0,0,1|1,0,0]=3 124 B8R1.3 CC1=NC=C(C=N1)Br CDS022509 [0,1,0,0,0,1|1,0,1]=4 125 B8R1.3 CC1=NN=C(C=C1)N CDS005355 [0,1,0,0,0,1|2,0,0]=4 126 B8R1.3 CC1=NNC(=O)C=C1 CDS000691 [0,1,0,0,0,1|2,0,0]=4 127 B8R1.3 ClC1=CC=C(N=C1)Br T138401 [0,1,0,0,0,1|2,0,0]=4 128 B8R1.3 ClC1=CN=C(C=C1)I SYX00319 [0,1,0,0,0,1|2,0,0]=4 129 B8R1.3 ClC1=CN=C(N=C1)I SYX00017 [0,1,0,0,0,1|1,0,1]=4 130 B8R1.3 ClC1=NC=C(C=N1)I SYX00335 [0,1,0,0,0,1|1,0,1]=4 131 B8R1.3 FC1=NC=C(C=N1)Br CDS004432 [0,1,0,0,0,1|1,0,1]=4 132 B8R1.3 FC1=NC=C(C=N1)Br SYX00292 [0,1,0,0,0,1|1,0,1]=4 133 B8R1.3 N1C=C(C=CC1=O)N ANV00289 [0,1,0,0,0,1|2,0,0]=4 134 B8R1.3 NC1=CC=C(N=C1)O CDS014034 [0,1,0,0,0,1|2,0,0]=4 135 B8R1.3 NC1=CN=C(C=N1)Cl CDS005437 [0,1,0,0,0,1|2,0,0]=4 136 B8R1.3 NC1=CN=C(N=C1)Cl CDS009800 [0,1,0,0,0,1|1,0,1]=4 137 B8R1.3 O=C1C=CC(=CN1)Cl T166464 [0,1,0,0,0,1|2,0,0]=4 138 B8R1.4 BrC1=CC(=NC=N1)Br BCH00053 [0,1,0,0,0,1|2,0,0]=4 139 B8R1.4 CC1=CC(=O)NC=C1 T162655 [0,1,0,0,0,1|1,0,0]=3 140 B8R1.4 CC1=CC=CC(=C1)N R647047 [0,1,0,0,0,1|2,0,0]=4 141 B8R1.4 CC1=CC=CC(=O)N1 S766364 [0,1,0,0,0,1|2,0,0]=4 142 B8R1.4 CC1=CC=NC(=O)C1 S681601 [0,1,0,0,0,1|1,0,0]=3 143 B8R1.4 CC1=CCCC(=O)C1 PH000095 [0,1,0,0,0,1|2,0,0]=4 144 B8R1.4 CC1=C[N+](=CC=C1)C S619396 [0,1,0,0,0,1|1,0,1]=4 145 B8R1.4 CC1=NC(=CC=N1)Cl PHB00236 [0,1,0,0,0,1|2,0,0]=4 146 B8R1.4 CC1=NC(=CC=N1)N CDS014871 [0,1,0,0,0,1|2,0,0]=4 147 B8R1.4 CC1=NC(=CN=C1)Cl ANV00028 [0,1,0,0,0,1|1,0,0]=3 148 B8R1.4 CC1=NC(=CN=C1)Cl CDS013631 [0,1,0,0,0,1|1,0,0]=3 149 B8R1.4 CC1=NC=NC(=C1)S R901148 [0,1,0,0,0,1|1,0,0]=3 150 B8R1.4 ClC1=CC(=CN=C1)I ADE000367 [0,1,0,0,0,1|2,0,0]=4 151 B8R1.4 ClC1=CN=CC(=N1)Br ANV00065 [0,1,0,0,0,1|2,0,0]=4 152 B8R1.4 ClC1=CN=NC(=C1)Cl MNO000179 [0,1,0,0,0,1|1,0,1]=4 153 B8R1.4 FC1=CC(=NC=N1)F CDS002862 [0,1,0,0,0,1|2,0,0]=4 154 B8R1.4 IC1=CC(=NC=N1)I SYX00025 [0,1,0,0,0,1|2,0,0]=4 155 B8R1.4 IC1=CN=CC(=N1)I SYX00011 [0,1,0,0,0,1|2,0,0]=4 156 B8R1.4 NC1=CC(=CN=C1)Cl ANV00078 [0,1,0,0,0,1|2,0,0]=4 157 B8R1.4 NC1=CC(=CN=C1)I ADE000379 [0,1,0,0,0,1|2,0,0]=4 158 B8R1.4 NC1=CC(=O)N=CN1 ANV00026 [0,1,0,0,0,1|2,0,0]=4 159 B8R1.4 NC1=CC=NC(=C1)O CDS020248 [0,1,0,0,0,1|2,0,0]=4 160 B8R1.4 NC1=NC(=CN=C1)Cl CDS013619 [0,1,0,0,0,1|2,0,0]=4 161 B8R1.4 O=C1C=C(C=CN1)I KOB0152 [0,1,0,0,0,1|2,0,0]=4 162 B8R1.4 O=C1C=C(C=NN1)Cl CDS021192 [0,1,0,0,0,1|1,0,0]=3 163 B8R1.4 O=C1C=C(C=NN1)I SYX00367 [0,1,0,0,0,1|1,0,0]=3 164 B8R1.4 OC1=CN=CC(=C1)F CDS006721 [0,1,0,0,0,1|2,0,0]=4 165 B8R1.4 OC1=CN=CC(=C1)I ADE000435 [0,1,0,0,0,1|2,0,0]=4 166 B8R1.4 OC1=NC(=CN=C1)Cl CBR01733 [0,1,0,0,0,1|2,0,0]=4 167 B8R1.5 CC1=C(C=NC=C1)Cl T161152 [0,1,0,0,0,1|1,0,0]=3 168 B8R1.5 CC1=CC=NN=C1Cl PHB00234 [0,1,0,0,0,1|0,0,1]=3 169 B8R1.5 CC1=CN=CC=C1N CDS003217 [0,1,0,0,0,1|1,0,0]=3 170 B8R1.5 CC1=NC=CN=C1Cl CDS013629 [0,1,0,0,0,1|1,0,0]=3 171 B8R1.5 CC1=NC=CN=C1S PH014228 [0,1,0,0,0,1|1,0,0]=3 172 B8R1.5 C[N+]1=CC=CN=C1N S142433 [0,1,0,0,0,1|2,0,0]=4 173 B8R1.5 ClC1=CC=NC=C1Br CDS003116 [0,1,0,0,0,1|2,0,0]=4 174 B8R1.5 FC1=CC=CN=C1I ADE000285 [0,1,0,0,0,1|2,0,0]=4 175 B8R1.5 FC1=CN=CN=C1S S217271 [0,1,0,0,0,1|1,0,1]=4 176 B8R1.5 IC1=CC=CN=C1I ADE000256 [0,1,0,0,0,1|2,0,0]=4 177 B8R1.5 NC1=C(C=CN=C1)O CDS004728 [0,1,0,0,0,1|2,0,0]=4 178 B8R1.5 NC1=C(C=NC=C1)O ADE000632 [0,1,0,0,0,1|2,0,0]=4 179 B8R1.5 NC1=C(C=NC=N1)Br CDS020752 [0,1,0,0,0,1|1,0,1]=4 180 B8R1.5 NC1=CC=CN=C1O CDS007860 [0,1,0,0,0,1|2,0,0]=4 181 B8R1.5 NC1=CC=NC=C1Cl CDS010711 [0,1,0,0,0,1|2,0,0]=4 182 B8R1.5 O=C1NC=CC=C1Cl T161063 [0,1,0,0,0,1|2,0,0]=4 183 B8R1.5 OC1=C(C=CN=C1)Cl ADE000654 [0,1,0,0,0,1|2,0,0]=4 184 B8R1.5 OC1=C(C=NC=C1)I ADE000434 [0,1,0,0,0,1|2,0,0]=4 185 B8R1.5 OC1=CN=CC=C1Br CDS021897 [0,1,0,0,0,1|2,0,0]=4 186 B8R1.5 OC1=NC=CC=C1F CDS019950 [0,1,0,0,0,1|2,0,0]=4 187 B8R1.1 CC1=CC(=CS1)CO TMT00554 [0,2,0,0,0,0|2,0,0]=4 188 B8R1.1 CC1=CC(=NO1)CO L482684 [0,2,0,0,0,0|2,0,0]=4 189 B8R1.1 CC1=CN=C(O1)CN CDS008557 [0,2,0,0,0,0|2,0,0]=4 190 B8R1.1 CC1=CN=C(S1)C=O CDS011813 [0,2,0,0,0,0|2,0,0]=4 191 B8R1.1 CC1=CN=C(S1)CN CDS011809 [0,2,0,0,0,0|2,0,0]=4 192 B8R1.1 CC1=NNC(=C1)CN CBR01017 [0,2,0,0,0,0|2,0,0]=4 193 B8R1.1 CC1=NOC(=C1)CN CBR00041 [0,2,0,0,0,0|2,0,0]=4 194 B8R1.1 CCC1=NNC(=C1)N CDS019625 [0,2,0,0,0,0|2,0,0]=4 195 B8R1.1 CCN1C=C(C=N1)Br CDS003673 [0,2,0,0,0,0|1,0,0]=3 196 B8R1.1 CN1C=C(C=N1)CCl CBR01696 [0,2,0,0,0,0|0,0,0]=2 197 B8R1.1 CN1C=CC(=C1)C#N CBR01777 [0,2,0,0,0,0|1,0,1]=4 198 B8R1.1 CN1C=NC(=C1)CN CDS017640 [0,2,0,0,0,0|2,0,0]=4 199 B8R1.1 CN1C=NC(=C1)CO CDS017610 [0,2,0,0,0,0|2,0,0]=4 200 B8R1.1 COC1=CN=C(S1)N CDS021689 [0,2,0,0,0,0|2,0,0]=4 201 B8R1.1 N#CC1=CC(=CN1)Br CBR01780 [0,2,0,0,0,0|2,0,0]=4 202 B8R1.1 OCC1=CN=C(S1)Br SYX00336 [0,2,0,0,0,0|2,0,0]=4 203 B8R1.1 OCC1=CN=C(S1)Cl CDS013997 [0,2,0,0,0,0|2,0,0]=4 204 B8R1.7 CC(=O)C1=CNC=C1 CDS015198 [0,2,0,0,0,0|1,0,0]=3 205 B8R1.7 CC(C)C1=CNN=C1 CBR01677 [0,2,0,0,0,0|0,0,0]=2 206 B8R1.7 CC(N)C1=CSC=C1 CBR01452 [0,2,0,0,0,0|2,0,0]=4 207 B8R1.7 O=C(O)C1=CNN=N1 CDS008829 [0,2,0,0,0,0|1,0,1]=4 208 B8R1.7 O=C(O)C1=CON=C1 CDS009962 [0,2,0,0,0,0|1,0,1]=4 209 B8R1.7 O=C(O)C1=CSN=C1 T312894 [0,2,0,0,0,0|1,0,1]=4 210 B8R1.7 OB(O)C1=CON=C1 CDS007044 [0,2,0,0,0,0|2,0,0]=4 211 B8R1.8 BrCCN1C=NN=C1 CBR02437 [0,2,0,0,0,0|1,0,1]=4 212 B8R1.8 CNCC1=CSC=C1 PH015792 [0,2,0,0,0,0|2,0,0]=4 213 B8R1.8 ClCCC1=CNN=C1 CBR00809 [0,2,0,0,0,0|0,0,0]=2 214 B8R1.11 C(=O)C1=C(C=CN1)Cl T266418 [0,2,0,0,0,0|2,0,0]=4 215 B8R1.11 CC1=C(C=CO1)CN CDS019848 [0,2,0,0,0,0|2,0,0]=4 216 B8R1.11 CC1=C(NC=N1)CN CBR01683 [0,2,0,0,0,0|2,0,0]=4 217 B8R1.11 CC1=C(OC=C1)C=O CDS023087 [0,2,0,0,0,0|2,0,0]=4 218 B8R1.11 CC1=C(SC=C1)CN CDS015230 [0,2,0,0,0,0|2,0,0]=4 219 B8R1.11 CC1=NON=C1CN CDS002297 [0,2,0,0,0,0|2,0,0]=4 220 B8R1.11 CCN1C=CN=C1Br CBR01693 [0,2,0,0,0,0|2,0,0]=4 221 B8R1.11 CCN1C=NN=C1S CDS013450 [0,2,0,0,0,0|1,0,1]=4 222 B8R1.11 CN1C=CN=C1CN CDS002678 [0,2,0,0,0,0|2,0,0]=4 223 B8R1.11 CN1C=CN=C1CO CDS014909 [0,2,0,0,0,0|2,0,0]=4 224 B8R1.11 CN1C=NN=C1CCl CBR02431 [0,2,0,0,0,0|1,0,1]=4 225 B8R1.11 CN1C=NN=C1CO CBR02167 [0,2,0,0,0,0|1,0,1]=4 226 B8R1.11 CN1N=CC=C1CBr CDS023901 [0,2,0,0,0,0|2,0,0]=4 227 B8R1.11 COC1=NON=C1N CBR00076 [0,2,0,0,0,0|2,0,0]=4 228 B8R1.11 N#CC1=CON=C1N PH018438 [0,2,0,0,0,0|1,0,1]=4 229 B8R1.18 CC1=C(SC(=N1)N)C S139696 [0,2,0,0,0,0|2,0,0]=4 230 B8R1.18 CC1=C(SC(=N1)S)C PH009931 [0,2,0,0,0,0|2,0,0]=4 231 B8R1.18 CC1=CC(=O)NC1=O PH010527 [0,2,0,0,0,0|1,0,0]=3 232 B8R1.18 CC1=NC(=CN1C)Br CDS007637 [0,2,0,0,0,0|2,0,0]=4 233 B8R1.18 CC1=NN(C(=C1)Br)C PHB00168 [0,2,0,0,0,0|2,0,0]=4 234 B8R1.18 CC1=NN(C(=C1)Cl)C R435937 [0,2,0,0,0,0|2,0,0]=4 235 B8R1.18 CC1=NN(C=C1N)C CDS015732 [0,2,0,0,0,0|1,0,0]=3 236 B8R1.18 CN1C=C(C(=N1)N)N CBR01718 [0,2,0,0,0,0|1,0,0]=3 237 B8R1.50 CC1=C(C(=NN1)Br)Br S939463 [0,2,0,0,0,0|1,0,0]=3 238 B8R1.50 CC1=C(C(=NO1)N)C SYX00035 [0,2,0,0,0,0|1,0,0]=3 239 B8R1.50 CC1=NNC(=C1C)C CBR00071 [0,2,0,0,0,0|0,0,0]=2 240 B8R1.50 CC1=NNC(=C1N)C L203173 [0,2,0,0,0,0|1,0,0]=3 241 B8R1.50 CC1=NNC(=C1O)C S720429 [0,2,0,0,0,0|1,0,0]=3 242 B8R1.50 CC1=NOC(=O)C1C PH007712 [0,2,0,0,0,0|1,0,1]=4 243 B8R1.50 CN1C(=CN=C1I)I SYX00402 [0,2,0,0,0,0|2,0,0]=4 244 B8R1.50 N1N=C(C(=C1Br)Br)Br S940429 [0,2,0,0,0,0|1,0,0]=3 245 B6R1.1 C1=CC=NC=C1 S503533 [0,0,1,1,0,0|1,0,1]=4