0 B11R1.16 CC(CCN)C1=CC=CC=C1 SY035468 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.16 CCCC(=O)C1=CC=CC=N1 SY005363 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.16 CCCC(N)C1=CC=NC=C1 SY014555 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.16 CCCC(N)C1=CN=CC=C1 SY014556 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.16 CCCC(N)C1=NC=CC=C1 SY014554 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.16 CCOC(=N)C1=CC=CC=C1 SY060984 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.16 CCOC(=O)C1=CC=NC=C1 SY001919 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.16 CCOC(=O)C1=CC=NC=N1 SY005565 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.16 CCOC(=O)C1=CC=NN=C1 SY015372 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.16 CCOC(=O)C1=CN=CC=N1 SY012364 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.16 CCOC(=O)C1=CN=CN=C1 SY004401 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.16 CCOC(=O)C1=COCCC1 SY060210 [0,0,0,0,0,0|1,0,3]=4 12 B11R1.16 CCOC(=O)C1=NC=CC=C1 SY020537 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.16 CCOC(=O)C1=NC=CC=N1 SY010066 [0,0,0,0,0,0|2,0,0]=2 14 B11R1.16 CCOC(=O)C1=NC=CN=N1 SY242551 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 SY257193 [0,0,0,0,0,0|1,0,0]=1 16 B11R1.16 CN(CCI)C1=CC=CC=C1 SY268256 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.16 CNNC(=O)C1=CC=CC=C1 SY294316 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 SY025161 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.16 COC[C@H](N)C1=CC=CC=C1 SY039587 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.16 ClCCC(Br)C1=CC=CC=C1 SY027094 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SY011838 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.16 N#CCC(=O)C1=CC=CN=C1 SY019571 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.16 N#CCC(=O)C1=CC=NC=C1 SY101520 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 SY095881 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.16 NC(CCO)C1=CC=CC=C1 SY013381 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.16 NCCC(=O)C1=CC=CC=C1 SY263195 [0,0,0,0,0,0|2,0,0]=2 27 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 SY033781 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 SY002040 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SY004650 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.16 O=C(NCO)C1=CN=CC=C1 SY051839 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.16 O=C(OCI)C1=CC=CC=C1 SY036475 [0,0,0,0,0,0|1,0,0]=1 32 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 SY018003 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.16 OC(CCCl)C1=CC=CC=C1 SY021671 [0,0,0,0,0,0|2,0,2]=4 34 B11R1.16 OCCC(O)C1=CC=CC=C1 SY271569 [0,0,0,0,0,0|2,0,2]=4 35 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 SY021625 [0,0,0,0,0,0|2,0,2]=4 36 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 SY021621 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [1,0,0,0,0,0|1,0,0]=2 38 B10R1.15 CCC(N)C1=CC=CN=C1 SY014378 [1,0,0,0,0,0|2,0,1]=4 39 B10R1.15 CCC(N)C1=CC=CN=C1 SY023048 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.15 CCC(N)C1=CC=NC=C1 SY011556 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.15 CCC(N)C1=NC=CC=C1 SY014377 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [1,0,0,0,0,0|0,0,2]=3 43 B10R1.15 CCN(C)C1=CC=CC=C1 SY032004 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.15 COC(=O)C1=CN=CC=N1 SY006191 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.15 COC(=O)C1=CN=CN=C1 SY096988 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.15 COC(=O)C1=CN=NC=C1 SY004472 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [1,0,0,0,0,0|1,0,0]=2 49 B10R1.15 COC(=O)C1=NC=CC=N1 SY006773 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.15 COC(=O)C1=NC=NC=C1 SY019964 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 SY017826 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.15 C[C@H](CO)C1=CC=CC=C1 SY036226 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SY057978 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.15 NC(=NO)C1=CC=CC=C1 SY057185 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.15 NC(CF)C1=CC=CC=C1 SY045869 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.15 NC(CO)C1=CC=CC=C1 SY002083 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.15 NCC(O)C1=CC=CC=C1 SY042533 [1,0,0,0,0,0|1,0,2]=4 60 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 SY013940 [1,0,0,0,0,0|1,0,2]=4 61 B10R1.15 NC[C@H](O)C1=CC=CC=C1 SY009089 [1,0,0,0,0,0|1,0,2]=4 62 B10R1.15 NNC(=O)C1=CC=NC=C1 SY010614 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.15 NNC(=O)C1=CN=CC=C1 SY033050 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.15 NNC(=O)C1=NC=CC=C1 SY021575 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 SY045870 [1,0,0,0,0,0|2,0,1]=4 66 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 SY003526 [1,0,0,0,0,0|2,0,1]=4 67 B10R1.15 N[C@H](CF)C1=CC=CC=C1 SY045868 [1,0,0,0,0,0|2,0,1]=4 68 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SY001952 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.15 O=C(CBr)C1=CC=CN=C1 SY023116 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY007962 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY226653 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.15 O=C(CCl)C1=CC=NC=C1 SY011676 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.15 O=C(CO)C1=CC=CN=C1 SY131032 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.15 O=C(CO)C1=CC=NC=C1 SY131033 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.15 O=C(CO)C1=NC=CC=C1 SY131031 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [1,0,0,0,0,0|1,0,1]=3 78 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 SY017542 [1,0,0,0,0,0|1,0,2]=4 79 B10R1.15 OC[C@H](O)C1=CC=CC=C1 SY017543 [1,0,0,0,0,0|1,0,2]=4 80 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SY101214 [1,0,0,0,0,0|1,0,2]=4 81 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [1,0,0,0,0,0|2,0,1]=4 82 B10R1.17 C=COCC1=CC=CC=C1 SY097145 [1,0,0,0,0,0|0,0,3]=4 83 B10R1.17 CCC#CC1=CC=CC=C1 SY049474 [1,0,0,0,0,0|1,0,1]=3 84 B10R1.17 CCCC[N+]1=CC=CC=C1 SY023279 [1,0,0,0,0,0|2,0,1]=4 85 B10R1.17 CCCC[N+]1=CC=CC=C1 SY033834 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.17 CCNCC1=CC=CN=C1 SY005910 [1,0,0,0,0,0|2,0,1]=4 87 B10R1.17 CCNCC1=CC=NC=C1 SY009304 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.17 CCNCC1=NC=CC=C1 SY005911 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [1,0,0,0,0,0|2,0,1]=4 90 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.17 ClCCOC1=CC=CC=C1 SY033599 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.17 ClCOCC1=CC=CC=C1 SY003069 [1,0,0,0,0,0|1,0,1]=3 93 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [1,0,0,0,0,0|2,0,1]=4 94 B10R1.17 N#C\C=C\C1=CC=CC=C1 SY014969 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.17 NCCNC1=CC=CC=C1 SY009366 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.17 NCCOC1=CC=CC=C1 SY004523 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.17 NC\C=C\C1=CC=CC=C1 SY123671 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.17 OCC#CC1=CC=CC=C1 SY010793 [1,0,0,0,0,0|2,0,1]=4 100 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [1,0,0,0,0,0|2,0,1]=4 101 B10R1.17 OC\C=C/C1=CC=CC=C1 SY129813 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.17 OC\C=C\C1=CC=CN=C1 SY022168 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.17 OC\C=C\C1=CC=NC=C1 SY022167 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.17 OC\C=C\C1=NC=CC=C1 SY022169 [1,0,0,0,0,0|3,0,0]=4 105 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 SY103943 [0,1,0,0,0,0|1,0,0]=2 106 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 SY018273 [0,1,0,0,0,0|1,0,0]=2 107 B12R1.16 CCC[C@@H](N)C1=CC=C(C)C=C1 SY232219 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 SY013720 [0,1,0,0,0,0|0,0,0]=1 109 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 SY023174 [0,1,0,0,0,0|0,0,0]=1 110 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 SY007130 [0,1,0,0,0,0|2,0,0]=3 111 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 SY003268 [0,1,0,0,0,0|0,0,0]=1 112 B12R1.16 CCOC(=O)C1=CC=C(N)N=N1 SY006599 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 SY237823 [0,1,0,0,0,0|1,0,0]=2 114 B12R1.16 CCOC(=O)C1=CN=C(C)C=C1 SY023205 [0,1,0,0,0,0|1,0,0]=2 115 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 SY018316 [0,1,0,0,0,0|1,0,0]=2 116 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 SY019435 [0,1,0,0,0,0|2,0,0]=3 117 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 SY002470 [0,1,0,0,0,0|1,0,0]=2 118 B12R1.16 CCOC(=O)C1=CN=C(N)C=N1 SY007114 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.16 CCOC(=O)C1=CN=C(N)N=C1 SY014488 [0,1,0,0,0,0|2,0,0]=3 120 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 SY021521 [0,1,0,0,0,0|1,0,0]=2 121 B12R1.16 CCOC(=O)C1=NC=C(Br)C=N1 SY006807 [0,1,0,0,0,0|2,0,0]=3 122 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=N1 SY036157 [0,1,0,0,0,0|2,0,0]=3 123 B12R1.16 CCOC(=O)C1=NN=C(C)C=C1 SY007133 [0,1,0,0,0,0|2,0,0]=3 124 B12R1.16 N#CCC(=O)C1=CC=C(Br)C=C1 SY096654 [0,1,0,0,0,0|2,0,1]=4 125 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 SY011839 [0,1,0,0,0,0|2,0,1]=4 126 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 SY023307 [0,1,0,0,0,0|2,0,1]=4 127 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 SY030177 [0,1,0,0,0,0|2,0,0]=3 128 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 SY048486 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 SY028371 [0,1,0,0,0,0|2,0,0]=3 130 B12R1.16 O=C(CCO)C1=CC=C(O)C=C1 SY027114 [0,1,0,0,0,0|2,0,0]=3 131 B12R1.17 CCNC(=O)C1=CC=CC(Br)=C1 SY024855 [0,1,0,0,0,0|1,0,0]=2 132 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 SY013136 [0,1,0,0,0,0|1,0,0]=2 133 B12R1.17 CCOC(=O)C1=CC(O)=CN=C1 SY007196 [0,1,0,0,0,0|1,0,0]=2 134 B12R1.17 CCOC(=O)C1=CC=CC(Br)=C1 SY009069 [0,1,0,0,0,0|0,0,0]=1 135 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 SY021823 [0,1,0,0,0,0|0,0,0]=1 136 B12R1.17 CCOC(=O)C1=CC=CC(F)=C1 SY012474 [0,1,0,0,0,0|0,0,0]=1 137 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SY006048 [0,1,0,0,0,0|0,0,0]=1 138 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SY033468 [0,1,0,0,0,0|0,0,0]=1 139 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 SY016314 [0,1,0,0,0,0|0,0,0]=1 140 B12R1.17 CCOC(=O)C1=CC=NC(Cl)=C1 SY016470 [0,1,0,0,0,0|1,0,0]=2 141 B12R1.17 CCOC(=O)C1=CN=CC(Br)=C1 SY014061 [0,1,0,0,0,0|1,0,0]=2 142 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 SY004812 [0,1,0,0,0,0|1,0,0]=2 143 B12R1.17 CCOC(=O)C1=NC(Cl)=CC=C1 SY039716 [0,1,0,0,0,0|1,0,0]=2 144 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 SY053217 [0,1,0,0,0,0|1,0,0]=2 145 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 SY105014 [0,1,0,0,0,0|1,0,0]=2 146 B12R1.17 CCOC(=O)C1=NC=CC(Cl)=C1 SY028389 [0,1,0,0,0,0|1,0,0]=2 147 B12R1.17 CCOC(=O)C1=NC=CC(F)=C1 SY243495 [0,1,0,0,0,0|1,0,0]=2 148 B12R1.17 CCOC(=O)C1=NC=CC(N)=N1 SY106290 [0,1,0,0,0,0|2,0,0]=3 149 B12R1.17 CCOC(=O)C1=NC=NC(Cl)=C1 SY034552 [0,1,0,0,0,0|2,0,0]=3 150 B12R1.17 N#CCC(=O)C1=CC=CC(Br)=C1 SY020617 [0,1,0,0,0,0|2,0,1]=4 151 B12R1.17 N#CCC(=O)C1=CC=CC(Cl)=C1 SY037741 [0,1,0,0,0,0|2,0,1]=4 152 B12R1.17 N#CCC(=O)C1=CC=CC(F)=C1 SY026744 [0,1,0,0,0,0|2,0,1]=4 153 B12R1.17 N#CCC(=O)C1=CC=CC(I)=C1 SY041782 [0,1,0,0,0,0|2,0,1]=4 154 B12R1.30 CCCCC(=O)C1=CC=CC=C1 SY013718 [0,1,0,0,0,0|1,0,0]=2 155 B12R1.30 CCCOC(=O)C1=CN=CC=C1 SY273653 [0,1,0,0,0,0|1,0,0]=2 156 B12R1.30 CNCCC(O)C1=CC=CC=C1 SY050893 [0,1,0,0,0,0|1,0,2]=4 157 B12R1.30 O=C(NCCO)C1=CN=CC=C1 SY107943 [0,1,0,0,0,0|2,0,0]=3 158 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 SY042617 [0,1,0,0,0,0|0,0,0]=1 159 B12R1.30 [N-]=[N+]=NCC(=O)C1=CC=CC=C1 SY253973 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.34 CCC(C)C(N)C1=CC=CC=C1 SY040748 [0,1,0,0,0,0|2,0,1]=4 161 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 SY014788 [0,1,0,0,0,0|2,0,0]=3 162 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 SY052485 [0,1,0,0,0,0|2,0,0]=3 163 B12R1.39 CCOS(=O)(=O)C1=CC=CC=C1 SY053068 [0,1,0,0,0,0|1,0,0]=2 164 B12R1.39 CCOS(=O)(=O)C1=CC=CN=C1 SY293348 [0,1,0,0,0,0|2,0,0]=3 165 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 SY173698 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.39 NCCS(=O)(=O)C1=CC=CC=C1 SY177490 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SY011141 [0,1,0,0,0,0|1,0,1]=3 168 B12R1.107 CC(O)=CC(=O)C1=CC=CC=C1 SY266279 [0,1,0,0,0,0|1,0,1]=3 169 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SY045029 [0,1,0,0,0,0|2,0,1]=4 170 B12R1.308 CCOC(=N)C1=CC=CC=C1F SY129446 [0,1,0,0,0,0|1,0,0]=2 171 B12R1.308 CCOC(=O)C1=C(C)N=CN=C1 SY006265 [0,1,0,0,0,0|2,0,0]=3 172 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 SY005168 [0,1,0,0,0,0|1,0,0]=2 173 B12R1.308 CCOC(=O)C1=C(Cl)N=CN=C1 SY007107 [0,1,0,0,0,0|2,0,0]=3 174 B12R1.308 CCOC(=O)C1=C(Cl)N=NC=C1 SY006110 [0,1,0,0,0,0|2,0,0]=3 175 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 SY003267 [0,1,0,0,0,0|0,0,0]=1 176 B12R1.308 CCOC(=O)C1=C(N)C=CC=N1 SY005551 [0,1,0,0,0,0|1,0,0]=2 177 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 SY007491 [0,1,0,0,0,0|1,0,0]=2 178 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 SY012807 [0,1,0,0,0,0|2,0,0]=3 179 B12R1.308 CCOC(=O)C1=C(O)N=NC=C1 SY006111 [0,1,0,0,0,0|2,0,0]=3 180 B12R1.308 CCOC(=O)C1=CC=CC=C1Br SY004041 [0,1,0,0,0,0|0,0,0]=1 181 B12R1.308 CCOC(=O)C1=CC=CC=C1Cl SY048209 [0,1,0,0,0,0|0,0,0]=1 182 B12R1.308 CCOC(=O)C1=CC=CC=C1I SY037880 [0,1,0,0,0,0|0,0,0]=1 183 B12R1.308 CCOC(=O)C1=CC=CN=C1C SY004406 [0,1,0,0,0,0|1,0,0]=2 184 B12R1.308 CCOC(=O)C1=CC=CN=C1N SY007228 [0,1,0,0,0,0|1,0,0]=2 185 B12R1.308 CCOC(=O)C1=CC=NN=C1C SY028631 [0,1,0,0,0,0|2,0,0]=3 186 B12R1.308 CCOC(=O)C1=CC=NN=C1N SY011639 [0,1,0,0,0,0|2,0,0]=3 187 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl SY036078 [0,1,0,0,0,0|1,0,0]=2 188 B12R1.308 CCOC(=O)C1=CN=CN=C1N SY015021 [0,1,0,0,0,0|2,0,0]=3 189 B12R1.308 CCOC(=O)C1=NC=CC=C1Br SY025917 [0,1,0,0,0,0|1,0,0]=2 190 B12R1.308 CCOC(=O)C1=NC=CC=C1C SY013318 [0,1,0,0,0,0|1,0,0]=2 191 B12R1.308 CCOC(=O)C1=NC=CC=C1Cl SY253689 [0,1,0,0,0,0|1,0,0]=2 192 B12R1.308 CCOC(=O)C1=NC=CC=C1F SY014737 [0,1,0,0,0,0|1,0,0]=2 193 B12R1.308 CCOC(=O)C1=NC=CC=C1O SY047825 [0,1,0,0,0,0|1,0,0]=2 194 B12R1.308 CCOC(=O)C1=NC=CN=C1C SY029597 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.308 CCOC(=O)C1=NC=NC=C1Br SY022729 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.308 N#CCC(=O)C1=CC=CC=C1Br SY017192 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.308 N#CCC(=O)C1=CC=CC=C1Cl SY013582 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.308 N#CCC(=O)C1=CC=CC=C1I SY268457 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.308 N#CCC(=O)C1=CC=CC=C1O SY257790 [0,1,0,0,0,0|2,0,1]=4 200 B12R1.308 O=C(CCCl)C1=CC=CC=C1F SY096664 [0,1,0,0,0,0|2,0,0]=3 201 B12R1.308 O=C(CCCl)C1=CC=CC=C1O SY046373 [0,1,0,0,0,0|2,0,0]=3 202 B12R2.2 C1=CC=C(C2=NCCO2)C=C1 SY052471 [0,0,0,1,0,0|1,0,0]=2 203 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SY063719 [0,0,0,1,0,0|2,0,1]=4 204 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SY060796 [0,0,0,1,0,0|2,0,1]=4 205 B12R2.116 NC1(C2=CC=CC=C2)CCC1 SY006040 [0,0,0,1,0,0|2,0,1]=4 206 B12R2.116 NC1(C2=CC=CC=C2)CCC1 SY007956 [0,0,0,1,0,0|2,0,1]=4 207 B12R2.1081 CC1NCCC2=C1C=CC=C2 SY027949 [0,0,0,1,0,0|2,0,1]=4 208 B12R2.1081 NC1CCCC2=C1C=CC=C2 SY004141 [0,0,0,1,0,0|2,0,1]=4 209 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 SY045443 [0,0,0,1,0,0|2,0,1]=4 210 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 SY001972 [0,0,0,1,0,0|2,0,1]=4 211 B12R2.1081 O=C1C=COC2=C1C=CC=C2 SY020315 [0,0,0,1,0,0|2,0,1]=4 212 B12R2.1081 O=C1CCCC2=C1C=CC=C2 SY001538 [0,0,0,1,0,0|1,0,0]=2 213 B12R2.1081 O=C1CCCC2=C1C=CC=N2 SY042025 [0,0,0,1,0,0|2,0,0]=3 214 B12R2.1081 O=C1CCCC2=C1C=CN=C2 SY037550 [0,0,0,1,0,0|2,0,0]=3 215 B12R2.1081 O=C1CCCC2=C1N=CC=C2 SY002036 [0,0,0,1,0,0|2,0,0]=3 216 B12R2.1081 O=C1CCNC2=C1C=CC=C2 SY029732 [0,0,0,1,0,0|2,0,0]=3 217 B12R2.1081 O=C1CCOC2=C1C=CC=C2 SY003783 [0,0,0,1,0,0|2,0,0]=3 218 B12R2.1081 O=C1COCC2=C1C=CC=C2 SY030590 [0,0,0,1,0,0|2,0,0]=3 219 B12R2.1081 O=C1NCCC2=C1C=CC=C2 SY021304 [0,0,0,1,0,0|1,0,0]=2 220 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 SY026934 [0,0,0,1,0,0|2,0,1]=4 221 B12R2.1081 O=C1OCCC2=C1C=CC=C2 SY031574 [0,0,0,1,0,0|0,0,0]=1 222 B12R2.1081 OC1CCCC2=CC=CC=C21 SY009329 [0,0,0,1,0,0|1,0,2]=4 223 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 SY104799 [0,0,0,1,0,0|1,0,2]=4 224 B12R2.2028 CC1OB(O)C2=CC=CC=C21 SY274016 [0,0,0,1,0,0|1,0,1]=3 225 B12R2.2028 CN1N=C(I)C2=C1C=CC=C2 SY037066 [0,0,0,1,0,0|3,0,0]=4 226 B12R2.2028 O=C1C=C(Br)C2=C1C=CC=C2 SY268545 [0,0,0,1,0,0|2,0,1]=4 227 B12R2.2028 O=C1CC(=O)C2=C1C=CC=C2 SY014846 [0,0,0,1,0,0|2,0,1]=4 228 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 SY031995 [0,0,0,1,0,0|2,0,0]=3 229 B12R2.2028 O=C1OC(=O)C2=C1C=CN=C2 SY039488 [0,0,0,1,0,0|2,0,1]=4 230 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 SY036169 [0,0,0,1,0,0|1,0,0]=2 231 B12R2.2028 O=C1OC(O)C2=C1C=CC=C2 SY270554 [0,0,0,1,0,0|1,0,0]=2 232 B12R2.2028 O=C1O[IH2](O)C2=CC=CC=C12 SY041374 [0,0,0,1,0,0|2,0,0]=3 233 B12R2.2028 O=C1[N-]C(=O)C2=CC=CC=C12 SY001384 [0,0,0,1,0,0|2,0,1]=4 234 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 SY030000 [0,0,0,1,0,0|2,0,1]=4 235 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 SY042927 [0,0,0,1,0,0|2,0,1]=4 236 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 SY049565 [0,0,0,1,0,0|1,0,0]=2 237 B12R2.2075 O=C(C1=CC=CN=C1)C2CC2 SY016489 [0,0,0,1,0,0|2,0,0]=3 238 B12R2.2075 O=C(C1=CC=NC=C1)C2CC2 SY038710 [0,0,0,1,0,0|2,0,0]=3 239 B12R2.2075 O=C(C1=NC=CC=C1)C2CC2 SY016561 [0,0,0,1,0,0|2,0,0]=3 240 B10R1.11 CCNC(=O)N1C=CN=C1 SY027184 [0,0,0,0,1,0|3,0,0]=4 241 B10R1.11 CCOC(=O)C1=CC=CN1 SY006751 [0,0,0,0,1,0|1,0,0]=2 242 B10R1.11 CCOC(=O)C1=CC=CO1 SY013608 [0,0,0,0,1,0|1,0,0]=2 243 B10R1.11 CCOC(=O)C1=CN=CO1 SY025474 [0,0,0,0,1,0|2,0,0]=3 244 B10R1.11 CCOC(=O)C1=CN=CS1 SY033057 [0,0,0,0,1,0|2,0,0]=3 245 B10R1.11 CCOC(=O)C1=CNC=N1 SY009035 [0,0,0,0,1,0|2,0,0]=3 246 B10R1.11 CCOC(=O)C1=CNN=C1 SY008759 [0,0,0,0,1,0|2,0,0]=3 247 B10R1.11 CCOC(=O)C1=CNN=N1 SY111481 [0,0,0,0,1,0|3,0,0]=4 248 B10R1.11 CCOC(=O)C1=COC=C1 SY050805 [0,0,0,0,1,0|1,0,0]=2 249 B10R1.11 CCOC(=O)C1=COC=N1 SY020022 [0,0,0,0,1,0|2,0,0]=3 250 B10R1.11 CCOC(=O)C1=CSC=C1 SY020096 [0,0,0,0,1,0|1,0,0]=2 251 B10R1.11 CCOC(=O)C1=CSC=N1 SY007521 [0,0,0,0,1,0|2,0,0]=3 252 B10R1.11 CCOC(=O)C1=NC=CN1 SY008432 [0,0,0,0,1,0|2,0,0]=3 253 B10R1.11 CCOC(=O)C1=NC=CO1 SY015034 [0,0,0,0,1,0|2,0,0]=3 254 B10R1.11 CCOC(=O)C1=NC=CS1 SY006151 [0,0,0,0,1,0|2,0,0]=3 255 B10R1.11 CCOC(=O)C1=NC=NS1 SY130875 [0,0,0,0,1,0|3,0,0]=4 256 B10R1.11 CCOC(=O)C1=NN=CS1 SY218012 [0,0,0,0,1,0|3,0,0]=4 257 B10R1.11 CCOC(=O)C1=NNC=C1 SY012805 [0,0,0,0,1,0|2,0,0]=3 258 B10R1.11 CCOC(=O)C1=NOC=C1 SY066081 [0,0,0,0,1,0|2,0,0]=3 259 B10R1.11 CCOC(=O)C1=NOC=N1 SY033077 [0,0,0,0,1,0|3,0,0]=4 260 B10R1.11 CCOC(=O)N1C=CN=N1 SY129251 [0,0,0,0,1,0|3,0,0]=4 261 B12R1.32 CCOC(=O)CC1=CC=CN=C1 SY021549 [0,0,0,0,0,1|1,0,0]=2 262 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SY011574 [0,0,0,0,0,1|1,0,0]=2 263 B12R1.32 CCOC(=O)CC1=NC=CC=C1 SY001136 [0,0,0,0,0,1|1,0,0]=2 264 B12R1.32 CCOC(=O)CC1=NC=CC=N1 SY007015 [0,0,0,0,0,1|2,0,0]=3 265 B12R1.32 CCOC(=O)CC1=NC=CN=C1 SY240706 [0,0,0,0,0,1|2,0,0]=3 266 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [0,0,0,0,0,1|2,0,0]=3 267 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 SY043058 [0,0,0,0,0,1|2,0,1]=4 268 B9R0.5 C\C=C\C=C\C(=O)OCC SY048320 [1,0,1,0,0,0|0,0,1]=3 269 B9R1.6 C1=CC=C(B(O)O)C=C1 SY257095 [2,0,0,0,0,0|1,0,1]=4 270 B9R1.6 C=C(Br)C1=CC=CC=C1 SY011143 [2,0,0,0,0,0|1,0,1]=4 271 B9R1.6 C=C(C)C1=NC=CC=C1 SY225338 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.6 CC(=O)C1=CC=NC=C1 SY005519 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.6 CC(=O)C1=CN=CC=N1 SY004986 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.6 CC(=O)C1=CN=CN=C1 SY005489 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.6 CC(=O)C1=NC=CC=N1 SY004966 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.6 C[C@@H](O)C1=CC=CC=C1 SY007833 [2,0,0,0,0,0|0,0,2]=4 277 B9R1.6 N=C(N)C1=CC=CC=C1 SY018319 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.6 N=C(N)C1=CC=CC=C1 SY035738 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.6 NC(=O)C1=CC=CC=C1 SY047098 [2,0,0,0,0,0|1,0,0]=3 280 B9R1.6 NC(=O)C1=CC=NC=C1 SY018471 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.6 NC(=O)C1=CN=CC=C1 SY024804 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.6 NC(=O)C1=NC=CC=C1 SY048638 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.6 O=C(O)C1=CC=CC=C1 SY009192 [2,0,0,0,0,0|0,0,0]=2 284 B9R1.6 O=C(O)C1=CC=CN=N1 SY013220 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.6 O=C(O)C1=CC=NC=C1 SY002246 [2,0,0,0,0,0|1,0,0]=3 286 B9R1.6 O=C(O)C1=CC=NN=C1 SY004681 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.6 O=C(O)C1=CN=CC=C1 SY011111 [2,0,0,0,0,0|1,0,0]=3 288 B9R1.6 O=C(O)C1=CN=CN=C1 SY004100 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.6 O=C(O)C1=NC=CC=C1 SY001169 [2,0,0,0,0,0|1,0,0]=3 290 B9R1.6 O=C(O)C1=NC=CC=N1 SY004101 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.6 O=C(O)C1=NC=CN=C1 SY001166 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.6 O=C(O)C1=NC=NC=C1 SY005548 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.6 O=C([O-])C1=CC=CC=C1 SY010134 [2,0,0,0,0,0|0,0,1]=3 294 B9R1.6 O=C([O-])C1=NC=CC=C1 SY037125 [2,0,0,0,0,0|1,0,1]=4 295 B9R1.6 OB(O)C1=CC=CC=C1 SY001599 [2,0,0,0,0,0|1,0,1]=4 296 B9R1.8 CC#CC1=CC=CC=C1 SY048557 [2,0,0,0,0,0|0,0,2]=4 297 B9R1.8 CCCC1=NC=CC=C1 SY035538 [2,0,0,0,0,0|1,0,1]=4 298 B9R1.8 COCC1=CC=CC=C1 SY049310 [2,0,0,0,0,0|0,0,1]=3 299 B9R1.8 N#COC1=CC=CC=C1 SY139763 [2,0,0,0,0,0|1,0,1]=4 300 B9R1.8 NOCC1=CC=CC=C1 SY005671 [2,0,0,0,0,0|1,0,1]=4 301 B9R1.8 NOCC1=CC=CC=C1 SY018100 [2,0,0,0,0,0|1,0,1]=4 302 B9R1.8 O=COC1=CC=CC=C1 SY106351 [2,0,0,0,0,0|1,0,1]=4 303 B9R1.8 O\N=C\C1=CC=CC=C1 SY112944 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.8 SCCC1=CC=CC=C1 SY039368 [2,0,0,0,0,0|1,0,1]=4 305 B11R1.7 COP(C)(=O)C1=CC=CC=C1 SY300619 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.7 COS(=O)(=O)C1=CC=CN=C1 SY284287 [1,1,0,0,0,0|2,0,0]=4 307 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 SY043367 [1,1,0,0,0,0|1,1,0]=4 308 B11R1.7 O=S(=O)(O[Na])C1=CC=CC=C1 SY004063 [1,1,0,0,0,0|2,0,0]=4 309 B11R1.12 C1=CC=C(N(CC)CC)C=C1 SY246295 [1,1,0,0,0,0|2,0,0]=4 310 B11R1.12 CO[C@H](CN)C1=CC=CC=C1 SY286579 [1,1,0,0,0,0|1,0,1]=4 311 B11R1.22 C=C(CBr)C1=CC=C(F)C=C1 SY274281 [1,1,0,0,0,0|2,0,0]=4 312 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 SY283036 [1,1,0,0,0,0|1,0,1]=4 313 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SY022605 [1,1,0,0,0,0|1,0,0]=3 314 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 SY026844 [1,1,0,0,0,0|1,0,0]=3 315 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SY048426 [1,1,0,0,0,0|2,0,0]=4 316 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SY001608 [1,1,0,0,0,0|0,0,0]=2 317 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SY049111 [1,1,0,0,0,0|0,0,0]=2 318 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SY002144 [1,1,0,0,0,0|0,0,0]=2 319 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SY003666 [1,1,0,0,0,0|0,0,0]=2 320 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SY020021 [1,1,0,0,0,0|1,0,0]=3 321 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SY005511 [1,1,0,0,0,0|1,0,0]=3 322 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 SY107933 [1,1,0,0,0,0|2,0,0]=4 323 B11R1.22 CNC(=S)C1=CC=C(Br)C=C1 SY262030 [1,1,0,0,0,0|1,1,0]=4 324 B11R1.22 COC(=N)C1=CC=C(Br)C=C1 SY028781 [1,1,0,0,0,0|1,0,0]=3 325 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SY001702 [1,1,0,0,0,0|0,0,0]=2 326 B11R1.22 COC(=O)C1=CC=C(Br)C=N1 SY009344 [1,1,0,0,0,0|1,0,0]=3 327 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SY017140 [1,1,0,0,0,0|0,0,0]=2 328 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 SY007129 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.22 COC(=O)C1=CC=C(F)N=C1 SY022281 [1,1,0,0,0,0|1,0,0]=3 330 B11R1.22 COC(=O)C1=CC=C(N)N=N1 SY006049 [1,1,0,0,0,0|2,0,0]=4 331 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SY006626 [1,1,0,0,0,0|0,0,0]=2 332 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 SY009097 [1,1,0,0,0,0|1,0,0]=3 333 B11R1.22 COC(=O)C1=CN=C(C)C=C1 SY002953 [1,1,0,0,0,0|1,0,0]=3 334 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 SY006706 [1,1,0,0,0,0|1,0,0]=3 335 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 SY019433 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.22 COC(=O)C1=CN=C(I)C=C1 SY026656 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.22 COC(=O)C1=CN=C(N)C=C1 SY006453 [1,1,0,0,0,0|1,0,0]=3 338 B11R1.22 COC(=O)C1=CN=C(N)C=N1 SY006678 [1,1,0,0,0,0|2,0,0]=4 339 B11R1.22 COC(=O)C1=CN=C(N)N=C1 SY014367 [1,1,0,0,0,0|2,0,0]=4 340 B11R1.22 COC(=O)C1=CN=C(O)C=C1 SY032672 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.22 COC(=O)C1=CN=C(O)N=C1 SY041468 [1,1,0,0,0,0|2,0,0]=4 342 B11R1.22 COC(=O)C1=COC(=O)C=C1 SY018974 [1,1,0,0,0,0|1,0,0]=3 343 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 SY006806 [1,1,0,0,0,0|2,0,0]=4 344 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 SY018538 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.22 COC(=O)C1=NC=C(C)C=C1 SY046550 [1,1,0,0,0,0|1,0,0]=3 346 B11R1.22 COC(=O)C1=NC=C(C)C=N1 SY040125 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SY024382 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 SY031483 [1,1,0,0,0,0|1,0,0]=3 349 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 SY124516 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SY018612 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.22 COC(=O)C1=NC=C(F)C=C1 SY096916 [1,1,0,0,0,0|1,0,0]=3 352 B11R1.22 COC(=O)C1=NC=C(F)C=N1 SY036635 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.22 COC(=O)C1=NC=C(N)C=C1 SY031871 [1,1,0,0,0,0|1,0,0]=3 354 B11R1.22 COC(=O)C1=NC=C(N)N=C1 SY098745 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.22 COC(=O)C1=NC=C(O)C=C1 SY021663 [1,1,0,0,0,0|1,0,0]=3 356 B11R1.22 COC(=O)C1=NC=C(O)C=N1 SY037102 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SY031016 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 SY043175 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.22 COC(=O)C1=NN=C(C)C=C1 SY007132 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.22 COC(=O)C1=NNC(=O)C=C1 SY008390 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SY028321 [1,1,0,0,0,0|1,0,0]=3 362 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SY039916 [1,1,0,0,0,0|1,0,0]=3 363 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 SY020165 [1,1,0,0,0,0|1,0,0]=3 364 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 SY001789 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 SY035573 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 SY007335 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 SY036768 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 SY009530 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 SY041321 [1,1,0,0,0,0|1,0,0]=3 370 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 SY096724 [1,1,0,0,0,0|1,0,0]=3 371 B11R1.22 O=C(CCl)C1=NC=C(F)C=C1 SY031219 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 SY130953 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 SY130959 [1,1,0,0,0,0|1,0,0]=3 374 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 SY130961 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.23 CC1=CC(C(=O)CO)=CC=C1 SY130975 [1,1,0,0,0,0|1,0,0]=3 376 B11R1.23 CCC(=O)C1=CC(Br)=NC=C1 SY301439 [1,1,0,0,0,0|1,0,0]=3 377 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 SY004012 [1,1,0,0,0,0|0,0,0]=2 378 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 SY018227 [1,1,0,0,0,0|0,0,0]=2 379 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SY016989 [1,1,0,0,0,0|0,0,0]=2 380 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 SY047086 [1,1,0,0,0,0|0,0,0]=2 381 B11R1.23 CNC(=O)C1=CC(Cl)=CC=N1 SY007502 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 SY051152 [1,1,0,0,0,0|1,0,0]=3 383 B11R1.23 COC(=N)C1=CC=CC(Br)=C1 SY028780 [1,1,0,0,0,0|1,0,0]=3 384 B11R1.23 COC(=O)C1=CC(=O)NC=C1 SY027263 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.23 COC(=O)C1=CC(N)=CN=C1 SY013226 [1,1,0,0,0,0|1,0,0]=3 386 B11R1.23 COC(=O)C1=CC(N)=NC=C1 SY003259 [1,1,0,0,0,0|1,0,0]=3 387 B11R1.23 COC(=O)C1=CC(O)=CN=C1 SY003383 [1,1,0,0,0,0|1,0,0]=3 388 B11R1.23 COC(=O)C1=CC(O)=NC=N1 SY016732 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.23 COC(=O)C1=CC=CC(=O)N1 SY043112 [1,1,0,0,0,0|1,0,0]=3 390 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 SY002781 [1,1,0,0,0,0|0,0,0]=2 391 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 SY033868 [1,1,0,0,0,0|0,0,0]=2 392 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 SY007550 [1,1,0,0,0,0|1,0,0]=3 393 B11R1.23 COC(=O)C1=CC=CC(N)=C1 SY031535 [1,1,0,0,0,0|0,0,0]=2 394 B11R1.23 COC(=O)C1=CC=CC(O)=C1 SY001617 [1,1,0,0,0,0|0,0,0]=2 395 B11R1.23 COC(=O)C1=CC=CC(S)=C1 SY124895 [1,1,0,0,0,0|0,0,0]=2 396 B11R1.23 COC(=O)C1=CC=NC(Br)=C1 SY016338 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.23 COC(=O)C1=CC=NC(C)=C1 SY104461 [1,1,0,0,0,0|1,0,0]=3 398 B11R1.23 COC(=O)C1=CC=NC(Cl)=C1 SY016465 [1,1,0,0,0,0|1,0,0]=3 399 B11R1.23 COC(=O)C1=CC=NC(F)=C1 SY047621 [1,1,0,0,0,0|1,0,0]=3 400 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 SY005317 [1,1,0,0,0,0|1,0,0]=3 401 B11R1.23 COC(=O)C1=CN=CC(C)=C1 SY004562 [1,1,0,0,0,0|1,0,0]=3 402 B11R1.23 COC(=O)C1=CN=CC(O)=C1 SY005899 [1,1,0,0,0,0|1,0,0]=3 403 B11R1.23 COC(=O)C1=C[N+](C)=CC=C1 SY281801 [1,1,0,0,0,0|1,0,0]=3 404 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 SY009096 [1,1,0,0,0,0|1,0,0]=3 405 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 SY011898 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 SY242088 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.23 COC(=O)C1=NC(C)=CC=C1 SY030535 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.23 COC(=O)C1=NC(C)=CN=C1 SY023907 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 SY014086 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 SY019317 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.23 COC(=O)C1=NC(N)=CC=C1 SY017264 [1,1,0,0,0,0|1,0,0]=3 412 B11R1.23 COC(=O)C1=NC(N)=CN=C1 SY017454 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 SY019236 [1,1,0,0,0,0|1,0,0]=3 414 B11R1.23 COC(=O)C1=NC=CC(C)=C1 SY284479 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SY003263 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.23 COC(=O)C1=NC=CC(F)=C1 SY240688 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.23 COC(=O)C1=NC=CC(I)=C1 SY027672 [1,1,0,0,0,0|1,0,0]=3 418 B11R1.23 COC(=O)C1=NC=CC(N)=C1 SY026101 [1,1,0,0,0,0|1,0,0]=3 419 B11R1.23 COC(=O)C1=NC=CC(O)=C1 SY011047 [1,1,0,0,0,0|1,0,0]=3 420 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 SY015373 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 SY019239 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 SY040432 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 SY078945 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 SY004172 [1,1,0,0,0,0|1,0,0]=3 425 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 SY008152 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 SY014721 [1,1,0,0,0,0|1,0,0]=3 427 B11R1.23 O=C(CBr)C1=CC=CC(F)=C1 SY031402 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 SY130965 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.23 O=C(CO)C1=CC=CC(Cl)=C1 SY130969 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 SY130967 [1,1,0,0,0,0|1,0,0]=3 431 B11R1.23 O=C(CO)C1=CC=CC(I)=C1 SY130987 [1,1,0,0,0,0|1,0,0]=3 432 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SY036428 [1,1,0,0,0,0|0,0,1]=3 433 B11R1.36 CC(C)C(=O)C1=CC=CN=C1 SY129311 [1,1,0,0,0,0|1,0,0]=3 434 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 SY004992 [1,1,0,0,0,0|1,0,0]=3 435 B11R1.36 CN(C)C(=O)C1=CC=CC=C1 SY048849 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.36 O=C(C1=CC=CC=C1)C(F)F SY061919 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.36 O=C(C1=NC=CC=C1)C(F)F SY110119 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SY004129 [1,1,0,0,0,0|1,0,1]=4 439 B11R1.222 C=C(CBr)C1=CC=CC=C1F SY278021 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.222 CC1=CC=CC=C1C(=O)CO SY130976 [1,1,0,0,0,0|1,0,0]=3 441 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 SY015244 [1,1,0,0,0,0|0,0,0]=2 442 B11R1.222 CCC(=O)C1=CC=CC=C1Cl SY031881 [1,1,0,0,0,0|0,0,0]=2 443 B11R1.222 CCC(=O)C1=CC=CC=C1F SY003995 [1,1,0,0,0,0|0,0,0]=2 444 B11R1.222 CNC(=O)C1=CC=CC=C1Br SY025140 [1,1,0,0,0,0|1,0,0]=3 445 B11R1.222 CNC(=O)C1=CC=CC=C1N SY005082 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.222 CNC(=O)C1=CC=CC=C1O SY034205 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.222 COC(=N)C1=CC=CC=C1Br SY028779 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 SY005700 [1,1,0,0,0,0|1,0,0]=3 449 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 SY013223 [1,1,0,0,0,0|1,0,0]=3 450 B11R1.222 COC(=O)C1=C(C)C=CC=N1 SY005197 [1,1,0,0,0,0|1,0,0]=3 451 B11R1.222 COC(=O)C1=C(C)C=NC=C1 SY097021 [1,1,0,0,0,0|1,0,0]=3 452 B11R1.222 COC(=O)C1=C(C)C=NN=C1 SY098406 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 SY009666 [1,1,0,0,0,0|0,0,0]=2 454 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 SY043110 [1,1,0,0,0,0|1,0,0]=3 455 B11R1.222 COC(=O)C1=C(F)C=CC=C1 SY017085 [1,1,0,0,0,0|0,0,0]=2 456 B11R1.222 COC(=O)C1=C(N)C=CC=N1 SY005552 [1,1,0,0,0,0|1,0,0]=3 457 B11R1.222 COC(=O)C1=C(N)C=CN=C1 SY007632 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.222 COC(=O)C1=C(N)C=NC=C1 SY007492 [1,1,0,0,0,0|1,0,0]=3 459 B11R1.222 COC(=O)C1=C(N)N=CC=C1 SY007227 [1,1,0,0,0,0|1,0,0]=3 460 B11R1.222 COC(=O)C1=C(N)N=CC=N1 SY005164 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.222 COC(=O)C1=C(O)C=CC=C1 SY008800 [1,1,0,0,0,0|0,0,0]=2 462 B11R1.222 COC(=O)C1=C(O)C=NC=C1 SY005796 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.222 COC(=O)C1=CC=CC=C1Br SY001469 [1,1,0,0,0,0|0,0,0]=2 464 B11R1.222 COC(=O)C1=CC=CC=C1I SY002220 [1,1,0,0,0,0|0,0,0]=2 465 B11R1.222 COC(=O)C1=CC=CN=C1C SY014898 [1,1,0,0,0,0|1,0,0]=3 466 B11R1.222 COC(=O)C1=CC=CN=C1Cl SY018350 [1,1,0,0,0,0|1,0,0]=3 467 B11R1.222 COC(=O)C1=CC=CN=C1F SY022292 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.222 COC(=O)C1=CC=CN=C1N SY298758 [1,1,0,0,0,0|1,0,0]=3 469 B11R1.222 COC(=O)C1=CC=COC1=O SY035712 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.222 COC(=O)C1=CC=NC=C1F SY035895 [1,1,0,0,0,0|1,0,0]=3 471 B11R1.222 COC(=O)C1=CC=NC=C1I SY097031 [1,1,0,0,0,0|1,0,0]=3 472 B11R1.222 COC(=O)C1=CC=NN=C1N SY011640 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.222 COC(=O)C1=CN=CC=C1C SY030816 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.222 COC(=O)C1=CN=CN=C1O SY018263 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.222 COC(=O)C1=NC=CC=C1F SY014689 [1,1,0,0,0,0|1,0,0]=3 476 B11R1.222 COC(=O)C1=NC=CC=C1O SY028348 [1,1,0,0,0,0|1,0,0]=3 477 B11R1.222 COC(=O)C1=NC=CN=C1Br SY021286 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.222 COC(=O)C1=NC=CN=C1C SY036007 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.222 COC(=O)C1=NC=CN=C1Cl SY017459 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.222 COC(=O)C1=NC=CN=C1I SY023923 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.222 COC(=O)C1=NC=CN=C1O SY020956 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.222 COC(=O)C1=NC=NC=C1N SY274674 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.222 NNC(=O)C1=CC=CC=C1N SY040605 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.222 O=C(CBr)C1=CC=CC=C1Br SY041192 [1,1,0,0,0,0|1,0,0]=3 485 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl SY004173 [1,1,0,0,0,0|1,0,0]=3 486 B11R1.222 O=C(CBr)C1=CC=CC=C1F SY022607 [1,1,0,0,0,0|1,0,0]=3 487 B11R1.222 O=C(CO)C1=CC=CC=C1Br SY130966 [1,1,0,0,0,0|1,0,0]=3 488 B11R1.222 O=C(CO)C1=CC=CC=C1Cl SY032642 [1,1,0,0,0,0|1,0,0]=3 489 B11R1.222 O=C(CO)C1=CC=CC=C1F SY130968 [1,1,0,0,0,0|1,0,0]=3 490 B11R1.222 O=C(CO)C1=CC=CC=C1I SY130988 [1,1,0,0,0,0|1,0,0]=3 491 B11R1.222 O=C(NO)C1=CC=CC=C1O SY046520 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.1 CCCCC1=CC=C(Br)C=C1 SY013489 [1,1,0,0,0,0|1,0,1]=4 493 B11R1.1 CCCCC1=CC=C(I)C=C1 SY029294 [1,1,0,0,0,0|1,0,1]=4 494 B11R1.1 CCCOC1=CC=C(O)C=C1 SY036399 [1,1,0,0,0,0|2,0,0]=4 495 B11R1.1 CCNCC1=CC=C(Br)C=C1 SY002622 [1,1,0,0,0,0|1,0,1]=4 496 B11R1.1 CCNCC1=CC=C(C)C=C1 SY045939 [1,1,0,0,0,0|1,0,1]=4 497 B11R1.1 CCNCC1=CC=C(Cl)C=C1 SY002523 [1,1,0,0,0,0|1,0,1]=4 498 B11R1.1 CCNCC1=CC=C(F)C=C1 SY002625 [1,1,0,0,0,0|1,0,1]=4 499 B11R1.1 CCNCC1=CC=C(N)C=C1 SY003699 [1,1,0,0,0,0|1,0,1]=4 500 B11R1.1 CCNCC1=CC=C(O)C=C1 SY018668 [1,1,0,0,0,0|1,0,1]=4 501 B11R1.1 OC\C=C\C1=CC=C(O)C=C1 SY203874 [1,1,0,0,0,0|2,0,0]=4 502 B11R1.17 CCCOC1=C(N)C=CC=C1 SY023299 [1,1,0,0,0,0|2,0,0]=4 503 B11R1.17 CCCOC1=CC=CC=C1N SY027786 [1,1,0,0,0,0|2,0,0]=4 504 B11R1.17 CCNCC1=CC=CC=C1O SY018670 [1,1,0,0,0,0|1,0,1]=4 505 B11R1.24 CCNCC1=CC=CC(Br)=C1 SY002525 [1,1,0,0,0,0|1,0,1]=4 506 B11R1.24 CCNCC1=CC=CC(Cl)=C1 SY045903 [1,1,0,0,0,0|1,0,1]=4 507 B11R1.24 CCNCC1=CC=CC(F)=C1 SY002642 [1,1,0,0,0,0|1,0,1]=4 508 B11R1.24 CCNCC1=CC=CC(O)=C1 SY018672 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.28 BrCCCCC1=CC=CC=C1 SY036816 [1,1,0,0,0,0|1,0,1]=4 510 B11R1.28 BrCCCOC1=CC=CC=C1 SY020995 [1,1,0,0,0,0|2,0,0]=4 511 B11R1.28 BrCCOCC1=CC=CC=C1 SY021677 [1,1,0,0,0,0|0,0,1]=3 512 B11R1.28 C#CCOCC1=CC=CC=C1 SY025593 [1,1,0,0,0,0|0,0,2]=4 513 B11R1.28 C=CCOCC1=CC=CC=C1 SY052476 [1,1,0,0,0,0|0,0,2]=4 514 B11R1.28 CCNCCC1=CC=CC=C1 SY248623 [1,1,0,0,0,0|1,0,1]=4 515 B11R1.28 ClCCNCC1=CC=CC=C1 SY239742 [1,1,0,0,0,0|1,0,1]=4 516 B11R1.28 ICCOCC1=CC=CC=C1 SY260861 [1,1,0,0,0,0|0,0,1]=3 517 B11R1.28 N#CCOCC1=CC=CC=C1 SY129386 [1,1,0,0,0,0|0,0,2]=4 518 B11R1.28 NCCOCC1=CC=CC=C1 SY018893 [1,1,0,0,0,0|0,0,1]=3 519 B11R1.28 OCCCCC1=CC=CC=C1 SY015871 [1,1,0,0,0,0|1,0,1]=4 520 B11R1.28 OCCNCC1=CC=CC=C1 SY001172 [1,1,0,0,0,0|1,0,1]=4 521 B11R1.28 OCCOCC1=CC=CC=C1 SY015814 [1,1,0,0,0,0|0,0,1]=3 522 B11R1.91 CC(C)NCC1=CC=CC=C1 SY032809 [1,1,0,0,0,0|1,0,1]=4 523 B11R1.15 CCOC(=O)C1=CC(=O)CC1 SY257880 [0,1,0,0,1,0|0,0,2]=4 524 B11R1.15 CCOC(=O)C1=CC(Br)=CN1 SY006963 [0,1,0,0,1,0|1,0,0]=3 525 B11R1.15 CCOC(=O)C1=CC(Br)=NO1 SY109792 [0,1,0,0,1,0|2,0,0]=4 526 B11R1.15 CCOC(=O)C1=CC(C)=NN1 SY003120 [0,1,0,0,1,0|2,0,0]=4 527 B11R1.15 CCOC(=O)C1=CC(N)=CN1 SY027703 [0,1,0,0,1,0|1,0,0]=3 528 B11R1.15 CCOC(=O)C1=CC(N)=NN1 SY125967 [0,1,0,0,1,0|2,0,0]=4 529 B11R1.15 CCOC(=O)C1=CC(N)=NO1 SY249518 [0,1,0,0,1,0|2,0,0]=4 530 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 SY003035 [0,1,0,0,1,0|1,0,0]=3 531 B11R1.15 CCOC(=O)C1=CC=C(C)N1 SY005566 [0,1,0,0,1,0|1,0,0]=3 532 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 SY020097 [0,1,0,0,1,0|1,0,0]=3 533 B11R1.15 CCOC(=O)C1=CC=C(N)N1 SY035524 [0,1,0,0,1,0|1,0,0]=3 534 B11R1.15 CCOC(=O)C1=CN(C)C=C1 SY224497 [0,1,0,0,1,0|1,0,0]=3 535 B11R1.15 CCOC(=O)C1=CN(C)C=N1 SY003889 [0,1,0,0,1,0|2,0,0]=4 536 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 SY006696 [0,1,0,0,1,0|2,0,0]=4 537 B11R1.15 CCOC(=O)C1=CN=C(C)S1 SY033439 [0,1,0,0,1,0|2,0,0]=4 538 B11R1.15 CCOC(=O)C1=CN=C(Cl)O1 SY019145 [0,1,0,0,1,0|2,0,0]=4 539 B11R1.15 CCOC(=O)C1=CN=C(Cl)S1 SY007665 [0,1,0,0,1,0|2,0,0]=4 540 B11R1.15 CCOC(=O)C1=CN=C(N)N1 SY023476 [0,1,0,0,1,0|2,0,0]=4 541 B11R1.15 CCOC(=O)C1=CN=C(N)O1 SY025019 [0,1,0,0,1,0|2,0,0]=4 542 B11R1.15 CCOC(=O)C1=CN=C(N)S1 SY002708 [0,1,0,0,1,0|2,0,0]=4 543 B11R1.15 CCOC(=O)C1=CNC(Br)=N1 SY032322 [0,1,0,0,1,0|2,0,0]=4 544 B11R1.15 CCOC(=O)C1=COC(C)=N1 SY013321 [0,1,0,0,1,0|2,0,0]=4 545 B11R1.15 CCOC(=O)C1=COC(Cl)=N1 SY019420 [0,1,0,0,1,0|2,0,0]=4 546 B11R1.15 CCOC(=O)C1=COC(N)=N1 SY019431 [0,1,0,0,1,0|2,0,0]=4 547 B11R1.15 CCOC(=O)C1=CSC(Br)=C1 SY059739 [0,1,0,0,1,0|1,0,0]=3 548 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 SY004498 [0,1,0,0,1,0|2,0,0]=4 549 B11R1.15 CCOC(=O)C1=CSC(C)=N1 SY007185 [0,1,0,0,1,0|2,0,0]=4 550 B11R1.15 CCOC(=O)C1=CSC(Cl)=N1 SY039949 [0,1,0,0,1,0|2,0,0]=4 551 B11R1.15 CCOC(=O)C1=CSC(F)=N1 SY023346 [0,1,0,0,1,0|2,0,0]=4 552 B11R1.15 CCOC(=O)C1=CSC(N)=N1 SY003333 [0,1,0,0,1,0|2,0,0]=4 553 B11R1.15 CCOC(=O)C1=NC=C(Br)N1 SY028598 [0,1,0,0,1,0|2,0,0]=4 554 B11R1.15 CCOC(=O)C1=NC=C(Br)S1 SY006143 [0,1,0,0,1,0|2,0,0]=4 555 B11R1.15 CCOC(=O)C1=NC=C(C)O1 SY037007 [0,1,0,0,1,0|2,0,0]=4 556 B11R1.15 CCOC(=O)C1=NC=C(N)S1 SY140217 [0,1,0,0,1,0|2,0,0]=4 557 B11R1.15 CCOC(=O)C1=NNC(Br)=C1 SY103428 [0,1,0,0,1,0|2,0,0]=4 558 B11R1.15 CCOC(=O)C1=NNC(I)=C1 SY259629 [0,1,0,0,1,0|2,0,0]=4 559 B11R1.15 CCOC(=O)C1=NNC(N)=C1 SY017433 [0,1,0,0,1,0|2,0,0]=4 560 B11R1.15 CCOC(=O)C1=NNC(O)=C1 SY042930 [0,1,0,0,1,0|2,0,0]=4 561 B11R1.15 CCOC(=O)C1=NOC(Br)=C1 SY307840 [0,1,0,0,1,0|2,0,0]=4 562 B11R1.31 CCC(=O)C(=O)C1=CSC=C1 SY253162 [0,1,0,0,1,0|2,0,0]=4 563 B11R1.199 CCOC(=O)C1=C(Br)N=CO1 SY107710 [0,1,0,0,1,0|2,0,0]=4 564 B11R1.199 CCOC(=O)C1=C(Br)SC=N1 SY007520 [0,1,0,0,1,0|2,0,0]=4 565 B11R1.199 CCOC(=O)C1=C(C)C=CN1 SY013400 [0,1,0,0,1,0|1,0,0]=3 566 B11R1.199 CCOC(=O)C1=C(C)N=CS1 SY032681 [0,1,0,0,1,0|2,0,0]=4 567 B11R1.199 CCOC(=O)C1=C(C)NC=C1 SY015706 [0,1,0,0,1,0|1,0,0]=3 568 B11R1.199 CCOC(=O)C1=C(C)NC=N1 SY022376 [0,1,0,0,1,0|2,0,0]=4 569 B11R1.199 CCOC(=O)C1=C(C)OC=C1 SY025556 [0,1,0,0,1,0|1,0,0]=3 570 B11R1.199 CCOC(=O)C1=C(C)OC=N1 SY020015 [0,1,0,0,1,0|2,0,0]=4 571 B11R1.199 CCOC(=O)C1=C(C)ON=C1 SY062282 [0,1,0,0,1,0|2,0,0]=4 572 B11R1.199 CCOC(=O)C1=C(F)C=CN1 SY016063 [0,1,0,0,1,0|1,0,0]=3 573 B11R1.199 CCOC(=O)C1=C(N)C=CN1 SY009083 [0,1,0,0,1,0|1,0,0]=3 574 B11R1.199 CCOC(=O)C1=C(N)C=CN1 SY107721 [0,1,0,0,1,0|1,0,0]=3 575 B11R1.199 CCOC(=O)C1=C(N)NC=C1 SY023497 [0,1,0,0,1,0|1,0,0]=3 576 B11R1.199 CCOC(=O)C1=C(N)NC=N1 SY032345 [0,1,0,0,1,0|2,0,0]=4 577 B11R1.199 CCOC(=O)C1=C(N)ON=C1 SY011025 [0,1,0,0,1,0|2,0,0]=4 578 B11R1.199 CCOC(=O)C1=C(N)SC=C1 SY003505 [0,1,0,0,1,0|1,0,0]=3 579 B11R1.199 CCOC(=O)C1=CN=CN1C SY003890 [0,1,0,0,1,0|2,0,0]=4 580 B11R1.199 CCOC(=O)C1=CNN=C1Br SY034693 [0,1,0,0,1,0|2,0,0]=4 581 B11R1.199 CCOC(=O)C1=CNN=C1C SY010183 [0,1,0,0,1,0|2,0,0]=4 582 B11R1.199 CCOC(=O)C1=CNN=C1I SY041373 [0,1,0,0,1,0|2,0,0]=4 583 B11R1.199 CCOC(=O)C1=CNNC1=O SY018525 [0,1,0,0,1,0|2,0,0]=4 584 B11R1.199 CCOC(=O)C1=NC=CN1C SY003874 [0,1,0,0,1,0|2,0,0]=4 585 B11R1.199 CCOC(=O)C1=NNC=C1Br SY034539 [0,1,0,0,1,0|2,0,0]=4 586 B11R1.199 CCOC(=O)C1=NNC=C1C SY008322 [0,1,0,0,1,0|2,0,0]=4 587 B11R1.199 CCOC(=O)C1=NNC=C1I SY035881 [0,1,0,0,1,0|2,0,0]=4 588 B11R1.199 CCOC(=O)C1=NNC=C1N SY109595 [0,1,0,0,1,0|2,0,0]=4 589 B11R1.199 CCOC(=O)N1C=CC=C1Br SY019747 [0,1,0,0,1,0|1,0,0]=3 590 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 SY002712 [0,1,0,0,0,1|0,0,0]=2 591 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 SY043330 [0,1,0,0,0,1|0,0,0]=2 592 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 SY030471 [0,1,0,0,0,1|0,0,0]=2 593 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 SY021383 [0,1,0,0,0,1|0,0,0]=2 594 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 SY041746 [0,1,0,0,0,1|0,0,0]=2 595 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 SY020920 [0,1,0,0,0,1|0,0,0]=2 596 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 SY015387 [0,1,0,0,0,1|0,0,0]=2 597 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 SY059530 [0,1,0,0,0,1|1,0,0]=3 598 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 SY097190 [0,1,0,0,0,1|1,0,0]=3 599 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=N1 SY009334 [0,1,0,0,0,1|2,0,0]=4 600 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 SY258263 [0,1,0,0,0,1|1,0,0]=3 601 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 SY043113 [0,1,0,0,0,1|1,0,0]=3 602 B13R1.19 CCOC(=O)CC1=NC=C(N)C=N1 SY024379 [0,1,0,0,0,1|2,0,0]=4 603 B13R1.19 CCOC(=O)NC1=CC=C(Cl)N=C1 SY039251 [0,1,0,0,0,1|1,0,0]=3 604 B13R1.20 CCOC(=O)CC1=CC(Br)=CC=C1 SY004525 [0,1,0,0,0,1|0,0,0]=2 605 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 SY238207 [0,1,0,0,0,1|1,0,0]=3 606 B13R1.20 CCOC(=O)CC1=CC(Cl)=NC=N1 SY253606 [0,1,0,0,0,1|2,0,0]=4 607 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 SY108732 [0,1,0,0,0,1|1,0,0]=3 608 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 SY038447 [0,1,0,0,0,1|1,0,0]=3 609 B13R1.47 CCOC(=O)C(Br)C1=NC=CC=C1 SY279015 [0,1,0,0,0,1|1,0,0]=3 610 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 SY211257 [0,1,0,0,0,1|0,0,0]=2 611 B13R1.47 CCOC(=O)C(N)C1=CC=CN=C1 SY284563 [0,1,0,0,0,1|1,0,0]=3 612 B13R1.47 CCOC(=O)C(N)C1=CC=NC=C1 SY007583 [0,1,0,0,0,1|1,0,0]=3 613 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 SY007582 [0,1,0,0,0,1|1,0,0]=3 614 B13R1.47 CCOC(=O)[C@@H](O)C1=CC=CC=C1 SY017476 [0,1,0,0,0,1|0,0,0]=2 615 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 SY104927 [0,1,0,0,0,1|0,0,0]=2 616 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 SY017475 [0,1,0,0,0,1|0,0,0]=2 617 B13R1.135 CCC(O)C(=O)NC1=CC=NC=C1 SY278570 [0,1,0,0,0,1|2,0,0]=4 618 B13R1.135 CON(C)C(=O)CC1=CC=CC=C1 SY201708 [0,1,0,0,0,1|2,0,0]=4 619 B13R1.470 CCOC(=O)CC1=CC=CC=C1C SY048389 [0,1,0,0,0,1|0,0,0]=2 620 B13R1.470 CCOC(=O)CC1=CC=CC=C1Cl SY108409 [0,1,0,0,0,1|0,0,0]=2 621 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl SY097610 [0,1,0,0,0,1|1,0,0]=3 622 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br SY025618 [0,1,0,0,0,1|1,0,0]=3 623 B13R1.470 CCOC(=O)CC1=NC=CC=C1F SY267155 [0,1,0,0,0,1|1,0,0]=3 624 B13R1.470 CCOC(=O)CC1=NC=CN=C1Cl SY247691 [0,1,0,0,0,1|2,0,0]=4 625 B13R1.398 CCC[C@@H](N=C=O)C1=CC=CC=C1 SY291833 [0,2,0,0,0,0|1,0,1]=4 626 B13R1.405 CCOC(C(=O)O)C1=CC=CC=C1 SY057655 [0,2,0,0,0,0|0,0,1]=3 627 B13R1.17 CCCCC(=O)C1=CC=C(Br)C=C1 SY016944 [0,2,0,0,0,0|1,0,0]=3 628 B13R1.17 CCCCC(=O)C1=CC=C(Cl)C=C1 SY036871 [0,2,0,0,0,0|1,0,0]=3 629 B13R1.17 CCCCC(=O)C1=CC=C(O)C=C1 SY009664 [0,2,0,0,0,0|1,0,0]=3 630 B13R1.17 O=C(CCCCl)C1=CC=C(F)C=C1 SY016889 [0,2,0,0,0,0|1,0,0]=3 631 B13R1.17 O=C(CCCI)C1=CC=C(F)C=C1 SY266247 [0,2,0,0,0,0|1,0,0]=3 632 B13R1.21 COC(=O)C(=O)C1=CC=C(Cl)C=C1 SY156486 [0,2,0,0,0,0|2,0,0]=4 633 B13R1.21 CON(C)C(=O)C1=CC=C(Cl)C=C1 SY227014 [0,2,0,0,0,0|2,0,0]=4 634 B13R1.21 CON(C)C(=O)C1=CC=C(F)C=C1 SY022915 [0,2,0,0,0,0|2,0,0]=4 635 B13R1.29 CC1=CC=C(S(=O)(=O)OCF)C=C1 SY115211 [0,2,0,0,0,0|2,0,0]=4 636 B13R1.452 C#CC1=CC=C(C(=O)OCC)C=C1 SY013309 [0,2,0,0,0,0|0,0,0]=2 637 B13R1.452 C=CC1=CC=C(C(=O)OCC)C=C1 SY268513 [0,2,0,0,0,0|0,0,0]=2 638 B13R1.452 CCOC(=O)C1=CC=C(C#N)C=C1 SY005785 [0,2,0,0,0,0|0,0,0]=2 639 B13R1.452 CCOC(=O)C1=CC=C(C=O)N=C1 SY116615 [0,2,0,0,0,0|1,0,0]=3 640 B13R1.452 CCOC(=O)C1=CC=C(OC)C=C1 SY015619 [0,2,0,0,0,0|0,0,0]=2 641 B13R1.452 CCOC(=O)C1=CN=C(C#N)N=C1 SY039700 [0,2,0,0,0,0|2,0,0]=4 642 B13R1.452 CCOC(=O)C1=CN=C(CO)C=C1 SY232889 [0,2,0,0,0,0|1,0,0]=3 643 B13R1.452 CCOC(=O)C1=NN=C(NC)C=C1 SY028791 [0,2,0,0,0,0|2,0,0]=4 644 B13R1.452 COC1=CC=C(C(=O)CCCl)C=C1 SY055250 [0,2,0,0,0,0|2,0,0]=4 645 B13R1.466 CCOC(=O)C1=CC=C(Br)C(C)=C1 SY053289 [0,2,0,0,0,0|0,0,0]=2 646 B13R1.466 CCOC(=O)C1=CC=C(C)C(N)=C1 SY035549 [0,2,0,0,0,0|0,0,0]=2 647 B13R1.466 CCOC(=O)C1=CC=C(F)C(Br)=C1 SY023541 [0,2,0,0,0,0|0,0,0]=2 648 B13R1.466 CCOC(=O)C1=CC=C(F)C(Cl)=C1 SY043369 [0,2,0,0,0,0|0,0,0]=2 649 B13R1.466 CCOC(=O)C1=CC=C(F)C(F)=C1 SY021829 [0,2,0,0,0,0|0,0,0]=2 650 B13R1.466 CCOC(=O)C1=CC=C(F)C(N)=C1 SY047006 [0,2,0,0,0,0|0,0,0]=2 651 B13R1.466 CCOC(=O)C1=CC=C(N)C(Br)=C1 SY022571 [0,2,0,0,0,0|0,0,0]=2 652 B13R1.466 CCOC(=O)C1=CC=C(O)C(N)=C1 SY028369 [0,2,0,0,0,0|0,0,0]=2 653 B13R1.466 CCOC(=O)C1=CC=C(O)C(O)=C1 SY017737 [0,2,0,0,0,0|0,0,0]=2 654 B13R1.466 CCOC(=O)C1=NC(C)=C(Br)C=C1 SY033342 [0,2,0,0,0,0|1,0,0]=3 655 B13R1.466 CCOC(=O)C1=NC=C(Br)C(F)=C1 SY271377 [0,2,0,0,0,0|1,0,0]=3 656 B13R1.466 CCOC(=O)C1=NC=C(F)C(N)=C1 SY225210 [0,2,0,0,0,0|1,0,0]=3 657 B13R1.1511 CCCC(=O)C1=CC=C(Cl)C=C1Cl SY015391 [0,2,0,0,0,0|1,0,0]=3 658 B13R1.1511 CCOC(=O)C1=C(C)N=C(Cl)C=C1 SY123701 [0,2,0,0,0,0|1,0,0]=3 659 B13R1.1511 CCOC(=O)C1=C(C)NC(=O)C=C1 SY097061 [0,2,0,0,0,0|1,0,0]=3 660 B13R1.1511 CCOC(=O)C1=C(Cl)C=C(Cl)N=C1 SY008961 [0,2,0,0,0,0|1,0,0]=3 661 B13R1.1511 CCOC(=O)C1=C(Cl)N=C(Cl)C=C1 SY102722 [0,2,0,0,0,0|1,0,0]=3 662 B13R1.1511 CCOC(=O)C1=C(O)N=C(C)N=C1 SY015990 [0,2,0,0,0,0|2,0,0]=4 663 B13R1.1511 CCOC(=O)C1=CC=C(Br)C=C1F SY114529 [0,2,0,0,0,0|0,0,0]=2 664 B13R1.1511 CCOC(=O)C1=CC=C(Br)C=C1O SY233353 [0,2,0,0,0,0|0,0,0]=2 665 B13R1.1511 CCOC(=O)C1=CC=C(C)C=C1C SY003392 [0,2,0,0,0,0|0,0,0]=2 666 B13R1.1511 CCOC(=O)C1=CN=C(C)N=C1Cl SY098645 [0,2,0,0,0,0|2,0,0]=4 667 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1C SY021662 [0,2,0,0,0,0|2,0,0]=4 668 B13R1.1511 CCOC(=O)C1=CN=C(Cl)N=C1Cl SY003394 [0,2,0,0,0,0|2,0,0]=4 669 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1Cl SY060978 [0,2,0,0,0,0|2,0,0]=4 670 B13R1.1511 CCOC(=O)C1=CN=C(N)N=C1N SY021721 [0,2,0,0,0,0|2,0,0]=4 671 B13R1.1511 CCOC(=O)C1=CN=C(O)C=C1O SY012325 [0,2,0,0,0,0|1,0,0]=3 672 B13R1.1511 CCOC(=O)C1=CN=C(O)N=C1C SY065573 [0,2,0,0,0,0|2,0,0]=4 673 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O SY003624 [0,2,0,0,0,0|2,0,0]=4 674 B13R1.1511 CCOC(=O)C1=CNC(=O)NC1=O SY026834 [0,2,0,0,0,0|2,0,0]=4 675 B13R1.1511 CCOC(=O)C1=NN=C(Cl)C=C1Cl SY102386 [0,2,0,0,0,0|2,0,0]=4 676 B13R1.1511 CCOC(=O)C1=NN=C(O)C=C1O SY108710 [0,2,0,0,0,0|2,0,0]=4 677 B13R1.1511 O=C(CCCl)C1=C(F)C=C(Br)C=C1 SY020444 [0,2,0,0,0,0|2,0,0]=4 678 B13R1.12 CCOC(=O)C1=C(C)C(F)=CC=C1 SY020037 [0,2,0,0,0,0|0,0,0]=2 679 B13R1.12 CCOC(=O)C1=C(O)C(Br)=NC=C1 SY280164 [0,2,0,0,0,0|1,0,0]=3 680 B13R1.12 CCOC(=O)C1=CC=CC(Br)=C1C SY240035 [0,2,0,0,0,0|0,0,0]=2 681 B13R1.12 CCOC(=O)C1=CC=CC(C)=C1C SY004804 [0,2,0,0,0,0|0,0,0]=2 682 B13R1.12 CCOC(=O)C1=CC=NC(Cl)=C1C SY019019 [0,2,0,0,0,0|1,0,0]=3 683 B13R1.12 CCOC(=O)C1=CN=CC(Br)=C1C SY263615 [0,2,0,0,0,0|1,0,0]=3 684 B13R1.12 CCOC(=O)C1=NC=NC(Cl)=C1Br SY291861 [0,2,0,0,0,0|2,0,0]=4 685 B13R1.22 CON(C)C(=O)C1=CC=CC(F)=C1 SY108464 [0,2,0,0,0,0|2,0,0]=4 686 B13R1.446 CCOC(=O)C1=C(C)N=CC(Br)=C1 SY020654 [0,2,0,0,0,0|1,0,0]=3 687 B13R1.446 CCOC(=O)C1=C(C)N=CC(N)=C1 SY123729 [0,2,0,0,0,0|1,0,0]=3 688 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 SY012257 [0,2,0,0,0,0|0,0,0]=2 689 B13R1.446 CCOC(=O)C1=C(Cl)C=NC(Cl)=C1 SY022258 [0,2,0,0,0,0|1,0,0]=3 690 B13R1.446 CCOC(=O)C1=CC(C)=CC=C1F SY017650 [0,2,0,0,0,0|0,0,0]=2 691 B13R1.446 CCOC(=O)C1=CC(C)=CC=C1N SY104722 [0,2,0,0,0,0|0,0,0]=2 692 B13R1.446 CCOC(=O)C1=CC(Cl)=NN=C1Cl SY108514 [0,2,0,0,0,0|2,0,0]=4 693 B13R1.446 CCOC(=O)C1=CC(Cl)=NNC1=O SY017201 [0,2,0,0,0,0|2,0,0]=4 694 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1Br SY023646 [0,2,0,0,0,0|0,0,0]=2 695 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1F SY039194 [0,2,0,0,0,0|0,0,0]=2 696 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1N SY096690 [0,2,0,0,0,0|0,0,0]=2 697 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1N SY106802 [0,2,0,0,0,0|0,0,0]=2 698 B13R1.446 CCOC(=O)C1=NC(Br)=CC=C1N SY100545 [0,2,0,0,0,0|1,0,0]=3 699 B13R1.446 CCOC(=O)C1=NC(Cl)=CC=C1Cl SY224315 [0,2,0,0,0,0|1,0,0]=3 700 B13R1.446 CCOC(=O)C1=NC(Cl)=NC=C1Br SY247631 [0,2,0,0,0,0|2,0,0]=4 701 B13R1.446 CCOC(=O)C1=NC(Cl)=NC=C1F SY059733 [0,2,0,0,0,0|2,0,0]=4 702 B13R1.446 CCOC(=O)C1=NC(I)=CC=C1Cl SY224333 [0,2,0,0,0,0|1,0,0]=3 703 B13R1.446 O=C(CCCl)C1=CC(F)=CC=C1Br SY292635 [0,2,0,0,0,0|2,0,0]=4 704 B13R1.450 CCOC(=O)C1=CC(Br)=CC(N)=C1 SY035162 [0,2,0,0,0,0|0,0,0]=2 705 B13R1.450 CCOC(=O)C1=CC(C)=CC(Br)=C1 SY025861 [0,2,0,0,0,0|0,0,0]=2 706 B13R1.450 CCOC(=O)C1=CC(Cl)=CC(Cl)=C1 SY047602 [0,2,0,0,0,0|0,0,0]=2 707 B13R1.450 CCOC(=O)C1=CC(Cl)=CC(N)=C1 SY012239 [0,2,0,0,0,0|0,0,0]=2 708 B13R1.450 CCOC(=O)C1=CC(Cl)=NC(C)=C1 SY006034 [0,2,0,0,0,0|1,0,0]=3 709 B13R1.450 CCOC(=O)C1=CC(O)=NC(C)=N1 SY264995 [0,2,0,0,0,0|2,0,0]=4 710 B13R1.450 CCOC(=O)C1=NC(C)=NC(Cl)=C1 SY114001 [0,2,0,0,0,0|2,0,0]=4 711 B13R1.450 CCOC(=O)C1=NC(Cl)=NC(Cl)=C1 SY030797 [0,2,0,0,0,0|2,0,0]=4 712 B13R1.450 O=C(CCCl)C1=CC(F)=CC(F)=C1 SY253587 [0,2,0,0,0,0|2,0,0]=4 713 B13R1.460 CCOC(=O)C1=CC=CC(CCl)=C1 SY032679 [0,2,0,0,0,0|0,0,0]=2 714 B13R1.460 CCOC(=O)C1=CC=CC(CN)=C1 SY161686 [0,2,0,0,0,0|0,0,0]=2 715 B13R1.460 CCOC(=O)C1=CC=CC(NN)=C1 SY038148 [0,2,0,0,0,0|0,0,0]=2 716 B13R1.460 CCOC(=O)C1=CC=CC(OC)=C1 SY109307 [0,2,0,0,0,0|0,0,0]=2 717 B13R1.460 CCOC(=O)C1=CC=NC(C#N)=C1 SY067112 [0,2,0,0,0,0|1,0,0]=3 718 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 SY027105 [0,2,0,0,0,0|1,0,1]=4 719 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 SY033453 [0,2,0,0,0,0|1,0,1]=4 720 B13R1.24 CNCCCC(=O)C1=CC=CN=C1 SY283926 [0,2,0,0,0,0|2,0,0]=4 721 B13R1.45 CC(=O)OCC(=O)C1=NC=CC=C1 SY272145 [0,2,0,0,0,0|1,0,1]=4 722 B13R1.45 CC(C)=NOC(=O)C1=CC=CC=C1 SY102616 [0,2,0,0,0,0|0,0,1]=3 723 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 SY025980 [0,2,0,0,0,0|2,0,0]=4 724 B13R1.45 CC(O)CNC(=O)C1=CC=CC=C1 SY016204 [0,2,0,0,0,0|1,0,0]=3 725 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 SY011505 [0,2,0,0,0,0|1,0,1]=4 726 B13R1.122 C#CCOS(=O)(=O)C1=CC=CC=C1 SY106411 [0,2,0,0,0,0|1,0,1]=4 727 B13R1.674 O=C(OCCO)C1=CC=CC=C1O SY032913 [0,2,0,0,0,0|0,0,0]=2 728 B13R1.86 O=C(C1=CC=CC=C1)C(CCl)CCl SY232949 [0,2,0,0,0,0|2,0,0]=4 729 B13R1.696 COC(=O)C(=O)C1=CC=CC=C1C SY235497 [0,2,0,0,0,0|2,0,0]=4 730 B13R1.347 CC(C)OS(=O)(=O)C1=CC=CC=C1 SY103735 [0,2,0,0,0,0|1,0,0]=3 731 B13R1.352 C=C(O[Si](C)(C)C)C1=CC=CC=C1 SY043340 [0,2,0,0,0,0|1,1,0]=4 732 B13R1.464 CCOC(=O)C1=C(C#N)C=CC=C1 SY005786 [0,2,0,0,0,0|0,0,0]=2 733 B13R1.464 CCOC(=O)C1=CC=CN=C1NC SY194940 [0,2,0,0,0,0|1,0,0]=3 734 B13R1.4453 CCOC(=O)C1=C(C)C=CC=C1O SY031840 [0,2,0,0,0,0|0,0,0]=2 735 B13R1.4453 CCOC(=O)C1=C(C)C=CN=C1C SY020336 [0,2,0,0,0,0|1,0,0]=3 736 B13R1.4453 CCOC(=O)C1=C(C)N=CN=C1Cl SY030574 [0,2,0,0,0,0|2,0,0]=4 737 B13R1.4453 CCOC(=O)C1=C(F)C=CC=C1Br SY043380 [0,2,0,0,0,0|0,0,0]=2 738 B13R1.4453 CCOC(=O)C1=C(F)C=CC=C1F SY043381 [0,2,0,0,0,0|0,0,0]=2 739 B11R1.30 CCOC(=O)NC1=CC=CS1 SY002881 [0,0,1,1,0,0|2,0,0]=4 740 B11R1.41 CCOC1=NC=CC=C1C=O SY271472 [0,0,1,1,0,0|2,0,0]=4 741 B11R2.1 C=C1CCC2=C1C=CC=C2 SY031740 [1,0,0,1,0,0|1,0,0]=3 742 B11R2.1 CC1=C2C=CC=CC2=NO1 SY246355 [1,0,0,1,0,0|2,0,0]=4 743 B11R2.1 NC1=C2C=CC=CC2=NO1 SY233373 [1,0,0,1,0,0|2,0,0]=4 744 B11R2.1 NC1=NCC2=C1C=CC=C2 SY027372 [1,0,0,1,0,0|2,0,0]=4 745 B11R2.1 NC1CCC2=C1C=CC=C2 SY004953 [1,0,0,1,0,0|1,0,1]=4 746 B11R2.1 NC1CCC2=CC=CC=C21 SY004234 [1,0,0,1,0,0|1,0,1]=4 747 B11R2.1 NN1CCC2=C1C=CC=C2 SY096651 [1,0,0,1,0,0|2,0,0]=4 748 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 SY030463 [1,0,0,1,0,0|1,0,1]=4 749 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 SY028017 [1,0,0,1,0,0|1,0,1]=4 750 B11R2.1 O=C1CCC2=C1C=CC=C2 SY001380 [1,0,0,1,0,0|0,0,0]=2 751 B11R2.1 O=C1CCC2=C1C=CN=C2 SY009406 [1,0,0,1,0,0|1,0,0]=3 752 B11R2.1 O=C1CCC2=CC=CN=C12 SY009408 [1,0,0,1,0,0|1,0,0]=3 753 B11R2.1 O=C1CCC2=NC=CC=C12 SY009444 [1,0,0,1,0,0|1,0,0]=3 754 B11R2.1 O=C1COC2=C1C=CC=C2 SY011530 [1,0,0,1,0,0|1,0,0]=3 755 B11R2.1 O=C1CSC2=CC=CC=C12 SY030591 [1,0,0,1,0,0|1,0,0]=3 756 B11R2.1 O=C1NCC2=C1C=CC=C2 SY020116 [1,0,0,1,0,0|1,0,0]=3 757 B11R2.1 O=C1NCC2=CC=CN=C12 SY206198 [1,0,0,1,0,0|2,0,0]=4 758 B11R2.1 O=C1NNC2=C1C=CC=C2 SY051085 [1,0,0,1,0,0|2,0,0]=4 759 B11R2.1 O=C1OCC2=C1C=CC=C2 SY001701 [1,0,0,1,0,0|0,0,0]=2 760 B11R2.1 O=C1OCC2=C1C=CN=C2 SY045272 [1,0,0,1,0,0|1,0,0]=3 761 B11R2.1 O=C1OCC2=NC=CC=C12 SY033776 [1,0,0,1,0,0|1,0,0]=3 762 B11R2.1 O=C1SSC2=CC=CC=C12 SY123412 [1,0,0,1,0,0|1,1,0]=4 763 B11R2.1 OB1OCC2=CC=CC=C12 SY025271 [1,0,0,1,0,0|1,0,1]=4 764 B11R2.1 OC1CCC2=C1C=CC=C2 SY014889 [1,0,0,1,0,0|0,0,2]=4 765 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 SY275070 [1,0,0,1,0,0|0,0,2]=4 766 B11R2.40 NC1(C2=CC=CC=C2)CC1 SY002295 [1,0,0,1,0,0|1,0,1]=4 767 B11R2.40 NC1(C2=CC=CC=C2)CC1 SY002397 [1,0,0,1,0,0|1,0,1]=4 768 B11R2.20 C1=CC2=C(C=C1)CCC=C2 SY050004 [1,0,0,1,0,0|1,0,0]=3 769 B11R2.20 C1=CC2=C(C=C1)CCN=C2 SY025255 [1,0,0,1,0,0|1,0,0]=3 770 B11R2.20 C1=CC2=C(C=C1)CNCC2 SY001156 [1,0,0,1,0,0|1,0,1]=4 771 B11R2.20 C1=CC2=C(C=C1)COCC2 SY018228 [1,0,0,1,0,0|0,0,1]=3 772 B11R2.20 C1=CC2=C(C=C1)CSCC2 SY286030 [1,0,0,1,0,0|0,1,1]=4 773 B11R2.20 C1=CC2=C(C=C1)NCCC2 SY001847 [1,0,0,1,0,0|2,0,0]=4 774 B11R2.20 C1=CC2=C(C=C1)OCCC2 SY174231 [1,0,0,1,0,0|2,0,0]=4 775 B11R2.238 C1=CC=C(NC2CC2)C=C1 SY207735 [1,0,0,1,0,0|2,0,0]=4 776 B11R2.106 O=C1CCCC2=C1C=CN2 SY027852 [0,0,0,1,1,0|2,0,0]=4 777 B11R2.106 O=C1CCCC2=C1C=CO2 SY045643 [0,0,0,1,1,0|2,0,0]=4 778 B11R2.106 O=C1CCCC2=C1C=CS2 SY004638 [0,0,0,1,1,0|2,0,0]=4 779 B11R2.106 O=C1CCCC2=C1NC=C2 SY197199 [0,0,0,1,1,0|2,0,0]=4 780 B11R2.106 O=C1CCCC2=C1OC=C2 SY126786 [0,0,0,1,1,0|2,0,0]=4 781 B11R2.106 O=C1CCCC2=C1SC=C2 SY262242 [0,0,0,1,1,0|2,0,0]=4 782 B11R2.106 O=C1NCCN2C=CC=C12 SY105045 [0,0,0,1,1,0|2,0,0]=4 783 B11R2.106 O=C1OCCC2=C1SC=C2 SY273266 [0,0,0,1,1,0|1,0,0]=3 784 B13R2.15 O=C1CCCN1C2=CC=CC=C2 SY020012 [0,0,0,1,0,1|1,0,0]=3 785 B13R2.26 CCCC1=NC2=CC=CC=C2N1 SY015986 [0,0,0,1,0,1|2,0,0]=4 786 B13R2.26 CCOC1=NC2=CC=CC=C2N1 SY244449 [0,0,0,1,0,1|1,0,0]=3 787 B13R2.163 O=C1CCCC2=CC=CC=C2N1 SY017407 [0,0,0,1,0,1|1,0,0]=3 788 B13R2.163 O=C1CCNC2=CC=CC=C2N1 SY079183 [0,0,0,1,0,1|2,0,0]=4 789 B13R2.3 C1=CC=C(C2=CCCCC2)C=C1 SY048999 [0,1,0,1,0,0|2,0,0]=4 790 B13R2.3 C1=CC=C(C2CNCCO2)C=C1 SY018079 [0,1,0,1,0,0|1,0,1]=4 791 B13R2.3 C1=CC=C([C@@H]2CNCCO2)C=C1 SY240389 [0,1,0,1,0,0|1,0,1]=4 792 B13R2.3 C1=CC=C([C@@H]2COCCN2)C=C1 SY077207 [0,1,0,1,0,0|1,0,1]=4 793 B13R2.3 C1=CC=C([C@H]2CNCCO2)C=C1 SY025491 [0,1,0,1,0,0|1,0,1]=4 794 B13R2.3 C1=CC=C([C@H]2COCCN2)C=C1 SY069429 [0,1,0,1,0,0|1,0,1]=4 795 B13R2.10 CC1=NC=C(C2=CC=CC=C2)O1 SY242503 [0,1,0,1,0,0|1,0,1]=4 796 B13R2.10 CC1COC(C2=CC=CC=C2)O1 SY035743 [0,1,0,1,0,0|0,0,2]=4 797 B13R2.1613 O=C[C@@H]1CCCC2=C1C=CC=C2 SY270606 [0,1,0,1,0,0|1,0,1]=4 798 B13R2.1613 O=C[C@H]1CCCC2=C1C=CC=C2 SY270605 [0,1,0,1,0,0|1,0,1]=4 799 B13R2.2931 CN1C=C(C=O)C2=CC=CC=C21 SY008054 [0,1,0,1,0,0|2,0,0]=4 800 B13R2.2931 CN1N=C(C=O)C2=C1C=CC=C2 SY097414 [0,1,0,1,0,0|2,0,0]=4 801 B13R2.2931 COC1OC(=O)C2=C1C=CC=C2 SY017409 [0,1,0,1,0,0|0,0,0]=2 802 B13R2.12 BrC1=CC=C(C2CCCO2)C=C1 SY235856 [0,1,0,1,0,0|1,0,1]=4 803 B13R2.12 BrC1=CC=C(C2OCCO2)C=C1 SY050928 [0,1,0,1,0,0|0,0,2]=4 804 B13R2.520 O=C(C1=CC=C(Cl)N=C1)C2CC2 SY022930 [0,1,0,1,0,0|2,0,0]=4 805 B13R2.5179 NC1=CC2=C(C=C1)C(=O)CCC2 SY029011 [0,1,0,1,0,0|1,0,0]=3 806 B13R2.5179 O=C1C=C2CCCC(=O)C2=CN1 SY210921 [0,1,0,1,0,0|2,0,0]=4 807 B13R2.5179 O=C1C=CC2=C(CCCC2=O)N1 SY034809 [0,1,0,1,0,0|2,0,0]=4 808 B13R2.5179 O=C1CCCC2=C1C=CC(Br)=C2 SY053074 [0,1,0,1,0,0|1,0,0]=3 809 B13R2.5179 O=C1CCCC2=C1C=CC(Cl)=C2 SY055227 [0,1,0,1,0,0|1,0,0]=3 810 B13R2.5179 O=C1CCCC2=C1C=CC(Cl)=N2 SY033937 [0,1,0,1,0,0|2,0,0]=4 811 B13R2.5179 O=C1CCCC2=C1C=CC(F)=C2 SY033451 [0,1,0,1,0,0|1,0,0]=3 812 B13R2.5179 O=C1CCCC2=C1C=CC(O)=C2 SY003653 [0,1,0,1,0,0|1,0,0]=3 813 B13R2.5179 O=C1CCCC2=C1C=NC(Cl)=C2 SY208474 [0,1,0,1,0,0|2,0,0]=4 814 B13R2.5179 O=C1CCNC2=C1C=CC(Br)=C2 SY226958 [0,1,0,1,0,0|2,0,0]=4 815 B13R2.5179 O=C1CCOC2=C1C=CC(Br)=C2 SY032002 [0,1,0,1,0,0|2,0,0]=4 816 B13R2.5179 O=C1CCOC2=C1C=CC(F)=C2 SY032000 [0,1,0,1,0,0|2,0,0]=4 817 B13R2.5179 O=C1CCSC2=C1C=CC(Br)=C2 SY072434 [0,1,0,1,0,0|2,0,0]=4 818 B13R2.5179 O=C1COCC2=C1C=CC(Br)=C2 SY124506 [0,1,0,1,0,0|2,0,0]=4 819 B13R2.5179 O=C1NCCC2=C1C=CC(Br)=C2 SY025396 [0,1,0,1,0,0|1,0,0]=3 820 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 SY123746 [0,1,0,1,0,0|1,0,0]=3 821 B13R2.5179 O=C1NCCC2=CC(Cl)=CC=C12 SY014075 [0,1,0,1,0,0|1,0,0]=3 822 B13R2.5187 CC1=CC=C2C(=O)OC(=O)C2=C1 SY011496 [0,1,0,1,0,0|1,0,1]=4 823 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 SY002025 [0,1,0,1,0,0|1,0,1]=4 824 B13R2.5187 O=C1OC(=O)C2=CC(Br)=CC=C12 SY014696 [0,1,0,1,0,0|1,0,1]=4 825 B13R2.5187 O=C1OC(=O)C2=CC(F)=CC=C12 SY045297 [0,1,0,1,0,0|1,0,1]=4 826 B13R2.5187 O=C1OC(=O)C2=CC(O)=CC=C12 SY102305 [0,1,0,1,0,0|1,0,1]=4 827 B13R2.13 BrC1=CC(C2OCCO2)=CC=C1 SY005324 [0,1,0,1,0,0|0,0,2]=4 828 B13R2.162 CC1=CC2=C(C=C1)CCCC2=O SY030270 [0,1,0,1,0,0|1,0,0]=3 829 B13R2.162 NC1=CC2=C(C=C1)CCCC2=O SY004798 [0,1,0,1,0,0|1,0,0]=3 830 B13R2.162 O=C1CCCC2=C1C=C(Br)C=C2 SY006976 [0,1,0,1,0,0|1,0,0]=3 831 B13R2.162 O=C1CCCC2=C1C=C(Br)C=N2 SY244553 [0,1,0,1,0,0|2,0,0]=4 832 B13R2.162 O=C1CCCC2=C1C=C(Br)N=C2 SY261724 [0,1,0,1,0,0|2,0,0]=4 833 B13R2.162 O=C1CCCC2=C1C=C(Cl)C=C2 SY033196 [0,1,0,1,0,0|1,0,0]=3 834 B13R2.162 O=C1CCCC2=C1C=C(Cl)N=C2 SY128799 [0,1,0,1,0,0|2,0,0]=4 835 B13R2.162 O=C1CCCC2=C1C=C(O)C=C2 SY045775 [0,1,0,1,0,0|1,0,0]=3 836 B13R2.162 O=C1CCCC2=C1N=C(Cl)C=C2 SY144837 [0,1,0,1,0,0|2,0,0]=4 837 B13R2.162 O=C1CCCC2=CC=C(F)C=C12 SY038468 [0,1,0,1,0,0|1,0,0]=3 838 B13R2.162 O=C1CCNC2=C1C=C(Br)C=C2 SY107822 [0,1,0,1,0,0|2,0,0]=4 839 B13R2.162 O=C1CCNC2=C1C=C(Cl)C=C2 SY278624 [0,1,0,1,0,0|2,0,0]=4 840 B13R2.162 O=C1CCOC2=C1C=C(Br)C=C2 SY019816 [0,1,0,1,0,0|2,0,0]=4 841 B13R2.162 O=C1CCOC2=C1C=C(Cl)C=C2 SY013983 [0,1,0,1,0,0|2,0,0]=4 842 B13R2.162 O=C1NCCC2=C1C=C(Br)C=C2 SY024204 [0,1,0,1,0,0|1,0,0]=3 843 B13R2.342 CC1=CC=CC2=C1OCCC2=O SY023822 [0,1,0,1,0,0|2,0,0]=4 844 B13R2.342 NC1=CC=CC2=C1C=COC2=O SY273270 [0,1,0,1,0,0|0,0,2]=4 845 B13R2.342 O=C1CCCC2=C1C=CC=C2Br SY107005 [0,1,0,1,0,0|1,0,0]=3 846 B13R2.342 O=C1CCOC2=C1C=CC=C2Cl SY107928 [0,1,0,1,0,0|2,0,0]=4 847 B13R2.342 O=C1CCOC2=C1C=CC=C2F SY007144 [0,1,0,1,0,0|2,0,0]=4 848 B13R2.342 O=C1NCCC2=C1C=CC=C2Br SY111299 [0,1,0,1,0,0|1,0,0]=3 849 B13R2.342 O=C1OC=CC2=C1C=CC=C2Br SY269657 [0,1,0,1,0,0|0,0,2]=4 850 B13R2.4857 CC1=C2C(=O)OC(=O)C2=CC=C1 SY049258 [0,1,0,1,0,0|1,0,1]=4 851 B13R2.4857 O=C1OC(=O)C2=C(F)C=CC=C12 SY037776 [0,1,0,1,0,0|1,0,1]=4 852 B13R2.4857 O=C1OC(=O)C2=C(O)C=CC=C12 SY039506 [0,1,0,1,0,0|1,0,1]=4 853 B13R2.4857 O=C1OC(=O)C2=C1C=CC=C2Br SY010203 [0,1,0,1,0,0|1,0,1]=4 854 B13R2.4857 O=C1OC(Br)C2=C1C=CC=C2Br SY248350 [0,1,0,1,0,0|1,0,0]=3 855 B13R2.5324 O=C(C1=NC(Br)=CC=C1)C2CC2 SY278703 [0,1,0,1,0,0|2,0,0]=4 856 B13R2.371 CC1=NNC(=O)C2=C1C=CC=C2 SY083782 [0,1,0,1,0,0|1,0,1]=4 857 B13R2.371 CC1CCC(=O)C2=C1C=CC=C2 SY061805 [0,1,0,1,0,0|1,0,0]=3 858 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 SY051585 [0,1,0,1,0,0|1,0,0]=3 859 B13R2.5252 O=C1CCCNC2=CC=CC=C12 SY009734 [0,1,0,1,0,0|1,0,0]=3 860 B13R2.5252 O=C1NCCNC2=CC=CC=C12 SY033892 [0,1,0,1,0,0|1,0,0]=3 861 B13R2.32 CC1CCC2=C(C=CC=C2)C1=O SY101951 [0,1,0,1,0,0|1,0,0]=3 862 B13R2.45 CNN1SC2=CC=CC=C2C1=O SY294806 [0,1,0,1,0,0|2,0,0]=4 863 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY048456 [0,1,0,1,0,0|2,0,0]=4 864 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 SY293688 [0,1,0,1,0,0|2,0,0]=4 865 B13R2.12159 CC1(C)CC(=O)C2=C1C=CC=C2 SY053429 [0,1,0,1,0,0|1,0,0]=3 866 B13R2.12159 CC1NS(=O)(=O)C2=C1C=CC=C2 SY015537 [0,1,0,1,0,0|2,0,0]=4 867 B13R2.12159 O=C1OI(=O)(O)C2=CC=CC=C12 SY295001 [0,1,0,1,0,0|2,0,0]=4 868 B13R2.18 BrC1=CC=CC=C1C2OCCO2 SY050277 [0,1,0,1,0,0|0,0,2]=4 869 B13R2.18 ClC1=CC=CC=C1C2=NCCN2 SY280122 [0,1,0,1,0,0|2,0,0]=4 870 B13R2.18 NC1=CC=CC=C1C2=NCCC2 SY248001 [0,1,0,1,0,0|2,0,0]=4 871 B13R2.4818 CC1=CC=CC2=C1C(=O)CCC2 SY262881 [0,1,0,1,0,0|1,0,0]=3 872 B13R2.4818 NC1=CC=CC2=C1C(=O)CCC2 SY122862 [0,1,0,1,0,0|1,0,0]=3 873 B13R2.4818 O=C1CCCC2=C1C(Br)=CC=C2 SY258037 [0,1,0,1,0,0|1,0,0]=3 874 B13R2.4818 O=C1CCCC2=C1C(O)=CC=C2 SY264600 [0,1,0,1,0,0|1,0,0]=3 875 B13R2.4818 O=C1CCOC2=C1C(F)=CC=C2 SY022041 [0,1,0,1,0,0|2,0,0]=4 876 B13R2.4818 O=C1NCCC2=C1C(Br)=CC=C2 SY111693 [0,1,0,1,0,0|1,0,0]=3 877 B9R1.11 CCC(=O)C1=CC=CS1 SY031388 [1,0,0,0,1,0|1,0,0]=3 878 B9R1.11 COC(=O)C1=CC=CN1 SY001201 [1,0,0,0,1,0|1,0,0]=3 879 B9R1.11 COC(=O)C1=CC=CS1 SY048432 [1,0,0,0,1,0|1,0,0]=3 880 B9R1.11 COC(=O)C1=CC=NO1 SY078826 [1,0,0,0,1,0|2,0,0]=4 881 B9R1.11 COC(=O)C1=CNC=C1 SY005883 [1,0,0,0,1,0|1,0,0]=3 882 B9R1.11 COC(=O)C1=CNC=N1 SY019856 [1,0,0,0,1,0|2,0,0]=4 883 B9R1.11 COC(=O)C1=CNN=C1 SY011914 [1,0,0,0,1,0|2,0,0]=4 884 B9R1.11 COC(=O)C1=CSC=C1 SY019965 [1,0,0,0,1,0|1,0,0]=3 885 B9R1.11 COC(=O)C1=CSC=N1 SY007519 [1,0,0,0,1,0|2,0,0]=4 886 B9R1.11 COC(=O)C1=NC=CN1 SY026818 [1,0,0,0,1,0|2,0,0]=4 887 B9R1.11 COC(=O)C1=NC=CS1 SY013211 [1,0,0,0,1,0|2,0,0]=4 888 B9R1.11 COC(=O)C1=NNC=C1 SY013591 [1,0,0,0,1,0|2,0,0]=4 889 B9R1.11 NCC(=O)C1=CSC=C1 SY269123 [1,0,0,0,1,0|2,0,0]=4 890 B9R1.11 O=C(CBr)C1=CC=CO1 SY040209 [1,0,0,0,1,0|2,0,0]=4 891 B9R1.11 O=C(CO)C1=CC=CO1 SY131034 [1,0,0,0,1,0|2,0,0]=4 892 B9R1.11 O=C(CO)C1=CC=CS1 SY131036 [1,0,0,0,1,0|2,0,0]=4 893 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SY192902 [0,0,0,0,0,2|1,0,0]=3 894 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 SY010778 [0,0,0,0,0,2|0,0,0]=2 895 B13R1.42 CCOC(=O)C#CC1=CC=CN=C1 SY022416 [0,0,0,0,0,2|1,0,0]=3 896 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 SY022415 [0,0,0,0,0,2|1,0,0]=3 897 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 SY022417 [0,0,0,0,0,2|1,0,0]=3 898 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SY013603 [0,0,0,0,0,2|0,0,0]=2 899 B13R1.42 CCOC(=O)CCC1=CC=CN=C1 SY022460 [0,0,0,0,0,2|1,0,0]=3 900 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 SY022459 [0,0,0,0,0,2|1,0,0]=3 901 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 SY022461 [0,0,0,0,0,2|1,0,0]=3 902 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 SY049148 [0,0,0,0,0,2|0,0,0]=2 903 B13R1.42 CCOC(=O)COC1=CC=CC=C1 SY017862 [0,0,0,0,0,2|0,0,0]=2 904 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 SY005492 [0,0,0,0,0,2|0,0,0]=2 905 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 SY108025 [0,0,0,0,0,2|1,0,0]=3 906 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 SY125931 [0,0,0,0,0,2|1,0,0]=3 907 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 SY017432 [0,0,0,0,0,2|2,0,0]=4 908 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 SY017868 [0,0,0,0,0,2|2,0,0]=4