0 B12R1.32 CCOC(=O)CC1=CC=CN=C1 SY021549 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SY011574 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.32 CCOC(=O)CC1=NC=CC=C1 SY001136 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.32 CCOC(=O)CC1=NC=CC=N1 SY007015 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.32 CCOC(=O)CC1=NC=CN=C1 SY240706 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.32 CN(CCCl)CC1=CC=CC=C1 SY011648 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.32 CN(CCO)CC1=CC=CC=C1 SY025492 [0,0,0,0,0,0|4,0,0]=4 7 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 SY043058 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.28 BrCCCCC1=CC=CC=C1 SY036816 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.28 BrCCOCC1=CC=CC=C1 SY021677 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.28 CCNCCC1=CC=CC=C1 SY248623 [1,0,0,0,0,0|1,0,1]=3 12 B11R1.28 ClCCNCC1=CC=CC=C1 SY239742 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.28 ICCOCC1=CC=CC=C1 SY260861 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.28 NCCOCC1=CC=CC=C1 SY018893 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.28 OCCCCC1=CC=CC=C1 SY015871 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.28 OCCNCC1=CC=CC=C1 SY001172 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.28 OCCOCC1=CC=CC=C1 SY015814 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [1,0,0,0,0,0|1,0,2]=4 19 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [1,0,0,0,0,0|1,0,2]=4 20 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [1,0,0,0,0,0|1,0,0]=2 22 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [1,0,0,0,0,0|1,0,0]=2 23 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.40 COC(=O)CC1=NC=CC=N1 SY005830 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.40 COC(=O)C[N+]1=NC=CC=C1 SY286050 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.40 N#CC(=O)CC1=CC=CC=C1 SY235509 [1,0,0,0,0,0|1,0,1]=3 28 B11R1.40 NC(CF)CC1=CC=CC=C1 SY045874 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.40 NC(CO)CC1=CC=CC=C1 SY030554 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 SY013878 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 SY045873 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.40 O=C(CCl)NC1=CC=NC=C1 SY022530 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SY022508 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.40 ON=C(Cl)CC1=CC=CC=C1 SY039705 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 SY002712 [0,1,0,0,0,0|0,0,0]=1 39 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 SY043330 [0,1,0,0,0,0|0,0,0]=1 40 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 SY030471 [0,1,0,0,0,0|0,0,0]=1 41 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 SY021383 [0,1,0,0,0,0|0,0,0]=1 42 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 SY041746 [0,1,0,0,0,0|0,0,0]=1 43 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 SY020920 [0,1,0,0,0,0|0,0,0]=1 44 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 SY015387 [0,1,0,0,0,0|0,0,0]=1 45 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 SY059530 [0,1,0,0,0,0|1,0,0]=2 46 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 SY097190 [0,1,0,0,0,0|1,0,0]=2 47 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=N1 SY009334 [0,1,0,0,0,0|2,0,0]=3 48 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 SY258263 [0,1,0,0,0,0|1,0,0]=2 49 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 SY043113 [0,1,0,0,0,0|1,0,0]=2 50 B13R1.19 CCOC(=O)CC1=NC=C(N)C=N1 SY024379 [0,1,0,0,0,0|2,0,0]=3 51 B13R1.19 CCOC(=O)NC1=CC=C(Cl)N=C1 SY039251 [0,1,0,0,0,0|2,0,0]=3 52 B13R1.20 CCOC(=O)CC1=CC(Br)=CC=C1 SY004525 [0,1,0,0,0,0|0,0,0]=1 53 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 SY238207 [0,1,0,0,0,0|1,0,0]=2 54 B13R1.20 CCOC(=O)CC1=CC(Cl)=NC=N1 SY253606 [0,1,0,0,0,0|2,0,0]=3 55 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 SY108732 [0,1,0,0,0,0|1,0,0]=2 56 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 SY038447 [0,1,0,0,0,0|1,0,0]=2 57 B13R1.47 CCOC(=O)C(Br)C1=NC=CC=C1 SY279015 [0,1,0,0,0,0|1,0,0]=2 58 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 SY211257 [0,1,0,0,0,0|0,0,0]=1 59 B13R1.47 CCOC(=O)C(N)C1=CC=CN=C1 SY284563 [0,1,0,0,0,0|1,0,0]=2 60 B13R1.47 CCOC(=O)C(N)C1=CC=NC=C1 SY007583 [0,1,0,0,0,0|1,0,0]=2 61 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 SY007582 [0,1,0,0,0,0|1,0,0]=2 62 B13R1.47 CCOC(=O)[C@@H](O)C1=CC=CC=C1 SY017476 [0,1,0,0,0,0|0,0,0]=1 63 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 SY104927 [0,1,0,0,0,0|0,0,0]=1 64 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 SY017475 [0,1,0,0,0,0|0,0,0]=1 65 B13R1.135 CCC(O)C(=O)NC1=CC=NC=C1 SY278570 [0,1,0,0,0,0|3,0,0]=4 66 B13R1.135 CON(C)C(=O)CC1=CC=CC=C1 SY201708 [0,1,0,0,0,0|2,0,0]=3 67 B13R1.470 CCOC(=O)CC1=CC=CC=C1C SY048389 [0,1,0,0,0,0|0,0,0]=1 68 B13R1.470 CCOC(=O)CC1=CC=CC=C1Cl SY108409 [0,1,0,0,0,0|0,0,0]=1 69 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl SY097610 [0,1,0,0,0,0|1,0,0]=2 70 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br SY025618 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.470 CCOC(=O)CC1=NC=CC=C1F SY267155 [0,1,0,0,0,0|1,0,0]=2 72 B13R1.470 CCOC(=O)CC1=NC=CN=C1Cl SY247691 [0,1,0,0,0,0|2,0,0]=3 73 B13R2.15 O=C1CCCN1C2=CC=CC=C2 SY020012 [0,0,0,1,0,0|2,0,0]=3 74 B13R2.26 CCCC1=NC2=CC=CC=C2N1 SY015986 [0,0,0,1,0,0|3,0,0]=4 75 B13R2.26 CCOC1=NC2=CC=CC=C2N1 SY244449 [0,0,0,1,0,0|2,0,0]=3 76 B13R2.163 O=C1CC2=CC=CC=C2C=CN1 SY018989 [0,0,0,1,0,0|1,0,2]=4 77 B13R2.163 O=C1CCCC2=CC=CC=C2N1 SY017407 [0,0,0,1,0,0|2,0,0]=3 78 B13R2.163 O=C1CCNC2=CC=CC=C2N1 SY079183 [0,0,0,1,0,0|3,0,0]=4 79 B11R1.16 CCCC(=O)C1=CC=CC=N1 SY005363 [0,0,0,0,1,0|2,0,0]=3 80 B11R1.16 CCOC(=N)C1=CC=CC=C1 SY060984 [0,0,0,0,1,0|1,0,0]=2 81 B11R1.16 CCOC(=O)C1=CC=NC=C1 SY001919 [0,0,0,0,1,0|1,0,0]=2 82 B11R1.16 CCOC(=O)C1=CC=NC=N1 SY005565 [0,0,0,0,1,0|2,0,0]=3 83 B11R1.16 CCOC(=O)C1=CC=NN=C1 SY015372 [0,0,0,0,1,0|2,0,0]=3 84 B11R1.16 CCOC(=O)C1=CN=CC=N1 SY012364 [0,0,0,0,1,0|2,0,0]=3 85 B11R1.16 CCOC(=O)C1=CN=CN=C1 SY004401 [0,0,0,0,1,0|2,0,0]=3 86 B11R1.16 CCOC(=O)C1=NC=CC=C1 SY020537 [0,0,0,0,1,0|1,0,0]=2 87 B11R1.16 CCOC(=O)C1=NC=CC=N1 SY010066 [0,0,0,0,1,0|2,0,0]=3 88 B11R1.16 CCOC(=O)C1=NC=CN=N1 SY242551 [0,0,0,0,1,0|3,0,0]=4 89 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 SY257193 [0,0,0,0,1,0|1,0,0]=2 90 B11R1.16 CNNC(=O)C1=CC=CC=C1 SY294316 [0,0,0,0,1,0|2,0,0]=3 91 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SY011838 [0,0,0,0,1,0|2,0,1]=4 92 B11R1.16 NCCC(=O)C1=CC=CC=C1 SY263195 [0,0,0,0,1,0|2,0,0]=3 93 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SY004650 [0,0,0,0,1,0|2,0,0]=3 94 B11R1.16 O=C(NCO)C1=CN=CC=C1 SY051839 [0,0,0,0,1,0|3,0,0]=4 95 B11R1.16 O=C(OCI)C1=CC=CC=C1 SY036475 [0,0,0,0,1,0|1,0,0]=2 96 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 SY018003 [0,0,0,0,1,0|3,0,0]=4 97 B11R1.30 CCNC(=O)CN1C=CC=N1 SY024906 [0,0,0,0,1,0|3,0,0]=4 98 B11R1.30 CCNC(=O)CN1C=CN=C1 SY024907 [0,0,0,0,1,0|3,0,0]=4 99 B11R1.30 CCOC(=O)CC1=CSC=N1 SY023096 [0,0,0,0,1,0|2,0,0]=3 100 B11R1.30 CCOC(=O)CC1=NC=CS1 SY025747 [0,0,0,0,1,0|2,0,0]=3 101 B11R1.30 CCOC(=O)CC1=NC=NN1 SY030921 [0,0,0,0,1,0|3,0,0]=4 102 B11R1.30 CCOC(=O)CC1=NNC=C1 SY030920 [0,0,0,0,1,0|2,0,0]=3 103 B11R1.30 CCOC(=O)CN1C=CC=N1 SY025207 [0,0,0,0,1,0|2,0,0]=3 104 B11R1.30 CCOC(=O)CN1C=CN=C1 SY005432 [0,0,0,0,1,0|2,0,0]=3 105 B11R1.30 CCOC(=O)NC1=CC=CS1 SY002881 [0,0,0,0,1,0|2,0,0]=3 106 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SY192902 [0,0,0,0,0,1|1,0,0]=2 107 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 SY010778 [0,0,0,0,0,1|0,0,1]=2 108 B13R1.42 CCOC(=O)C#CC1=CC=CN=C1 SY022416 [0,0,0,0,0,1|1,0,1]=3 109 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 SY022415 [0,0,0,0,0,1|1,0,1]=3 110 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 SY022417 [0,0,0,0,0,1|1,0,1]=3 111 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SY013603 [0,0,0,0,0,1|0,0,0]=1 112 B13R1.42 CCOC(=O)CCC1=CC=CN=C1 SY022460 [0,0,0,0,0,1|1,0,0]=2 113 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 SY022459 [0,0,0,0,0,1|1,0,0]=2 114 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 SY022461 [0,0,0,0,0,1|1,0,0]=2 115 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 SY049148 [0,0,0,0,0,1|0,0,0]=1 116 B13R1.42 CCOC(=O)COC1=CC=CC=C1 SY017862 [0,0,0,0,0,1|0,0,0]=1 117 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 SY005492 [0,0,0,0,0,1|0,0,1]=2 118 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 SY108025 [0,0,0,0,0,1|1,0,1]=3 119 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 SY125931 [0,0,0,0,0,1|1,0,1]=3 120 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 SY017432 [0,0,0,0,0,1|2,0,0]=3 121 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 SY017868 [0,0,0,0,0,1|2,0,0]=3 122 B13R1.42 [C-]#[N+]CC(=O)OCC1=CC=CC=C1 SY249703 [0,0,0,0,0,1|2,0,1]=4 123 B10R1.17 BrCCCC1=CC=CC=C1 SY046253 [2,0,0,0,0,0|1,0,1]=4 124 B10R1.17 C=COCC1=CC=CC=C1 SY097145 [2,0,0,0,0,0|0,0,2]=4 125 B10R1.17 CCC#CC1=CC=CC=C1 SY049474 [2,0,0,0,0,0|0,0,2]=4 126 B10R1.17 CCCC[N+]1=CC=CC=C1 SY023279 [2,0,0,0,0,0|1,0,1]=4 127 B10R1.17 CCCC[N+]1=CC=CC=C1 SY033834 [2,0,0,0,0,0|1,0,1]=4 128 B10R1.17 CCNCC1=CC=CN=C1 SY005910 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.17 CCNCC1=CC=NC=C1 SY009304 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.17 CCNCC1=NC=CC=C1 SY005911 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.17 CNCCC1=CC=CC=C1 SY002512 [2,0,0,0,0,0|1,0,1]=4 132 B10R1.17 ClCCCC1=CC=CC=C1 SY048978 [2,0,0,0,0,0|1,0,1]=4 133 B10R1.17 ClCOCC1=CC=CC=C1 SY003069 [2,0,0,0,0,0|1,0,0]=3 134 B10R1.17 ICCCC1=CC=CC=C1 SY249461 [2,0,0,0,0,0|1,0,1]=4 135 B10R1.17 NCCCC1=CC=CC=C1 SY049659 [2,0,0,0,0,0|1,0,1]=4 136 B10R1.17 NC\C=C\C1=CC=CC=C1 SY123671 [2,0,0,0,0,0|1,0,1]=4 137 B10R1.17 NOCCC1=CC=CC=C1 SY114401 [2,0,0,0,0,0|1,0,1]=4 138 B10R1.17 NOCCC1=CC=CC=C1 SY281546 [2,0,0,0,0,0|1,0,1]=4 139 B10R1.17 OCCCC1=CC=CC=C1 SY003672 [2,0,0,0,0,0|1,0,1]=4 140 B10R1.17 OC\C=C/C1=CC=CC=C1 SY129813 [2,0,0,0,0,0|1,0,1]=4 141 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [2,0,0,0,0,0|1,0,0]=3 142 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [2,0,0,0,0,0|1,0,0]=3 143 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [2,0,0,0,0,0|1,0,0]=3 144 B10R1.18 CC(C)=CC1=CC=CC=C1 SY055240 [2,0,0,0,0,0|1,0,1]=4 145 B10R1.18 CC(O)CC1=CC=CC=C1 SY051093 [2,0,0,0,0,0|0,0,2]=4 146 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [2,0,0,0,0,0|1,0,0]=3 147 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [2,0,0,0,0,0|1,0,0]=3 149 B10R1.18 O=C(O)CC1=CC=NC=C1 SY003595 [2,0,0,0,0,0|1,0,0]=3 150 B10R1.18 O=C(O)CC1=CN=CN=C1 SY020567 [2,0,0,0,0,0|2,0,0]=4 151 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [2,0,0,0,0,0|1,0,0]=3 152 B10R1.18 O=C(O)CC1=NC=CC=N1 SY004102 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.18 O=C(O)CC1=NC=CN=C1 SY034525 [2,0,0,0,0,0|2,0,0]=4 154 B12R0.1 CC\C=C\C=C/CCC(=O)OCC SY300160 [0,1,1,0,0,0|0,0,2]=4 155 B12R1.8 BrCCCOCC1=CC=CC=C1 SY013896 [1,1,0,0,0,0|2,0,0]=4 156 B12R1.8 OCCCNCC1=CC=CC=C1 SY004678 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.8 OCCCOCC1=CC=CC=C1 SY015683 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.252 CC(O)COCC1=CC=CC=C1 SY115719 [1,1,0,0,0,0|2,0,0]=4 159 B12R1.252 C[C@@H](O)CNCC1=CC=CC=C1 SY046157 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 SY226247 [1,1,0,0,0,0|2,0,0]=4 161 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 SY059957 [1,1,0,0,0,0|2,0,0]=4 162 B12R1.267 CCNCCC1=CC=CC=C1F SY002938 [1,1,0,0,0,0|1,0,1]=4 163 B12R1.34 CC(C(=O)NN)C1=CC=CC=C1 SY263061 [1,1,0,0,0,0|2,0,0]=4 164 B12R1.34 CCC(C)C(N)C1=CC=CC=C1 SY040748 [1,1,0,0,0,0|1,0,1]=4 165 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 SY014788 [1,1,0,0,0,0|0,0,1]=3 166 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SY113594 [1,1,0,0,0,0|0,0,0]=2 167 B12R1.34 COC(=O)C(N)C1=CC=NC=C1 SY023726 [1,1,0,0,0,0|1,0,0]=3 168 B12R1.34 COC(=O)C(N)C1=NC=CC=C1 SY033361 [1,1,0,0,0,0|1,0,0]=3 169 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 SY003754 [1,1,0,0,0,0|0,0,0]=2 170 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 SY020988 [1,1,0,0,0,0|0,0,0]=2 171 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 SY003762 [1,1,0,0,0,0|0,0,0]=2 172 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 SY017161 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 SY051128 [1,1,0,0,0,0|1,0,1]=4 174 B12R1.43 CC(N)C(=O)CC1=CC=CC=C1 SY147169 [1,1,0,0,0,0|0,0,0]=2 175 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SY139358 [1,1,0,0,0,0|1,0,0]=3 176 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 SY021204 [1,1,0,0,0,0|0,0,0]=2 177 B12R1.49 COC(=O)CC1=CC=C(Br)N=C1 SY235517 [1,1,0,0,0,0|1,0,0]=3 178 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 SY052935 [1,1,0,0,0,0|0,0,0]=2 179 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 SY051360 [1,1,0,0,0,0|0,0,0]=2 180 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 SY030613 [1,1,0,0,0,0|1,0,0]=3 181 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SY041951 [1,1,0,0,0,0|0,0,0]=2 182 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 SY041745 [1,1,0,0,0,0|0,0,0]=2 183 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SY100571 [1,1,0,0,0,0|0,0,0]=2 184 B12R1.49 COC(=O)CC1=CC=C(N)N=C1 SY278591 [1,1,0,0,0,0|1,0,0]=3 185 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 SY001844 [1,1,0,0,0,0|0,0,0]=2 186 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 SY029783 [1,1,0,0,0,0|1,0,0]=3 187 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 SY081416 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 SY004524 [1,1,0,0,0,0|0,0,0]=2 189 B12R1.50 COC(=O)CC1=CC(Br)=NC=C1 SY030795 [1,1,0,0,0,0|1,0,0]=3 190 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 SY053038 [1,1,0,0,0,0|0,0,0]=2 191 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 SY051263 [1,1,0,0,0,0|0,0,0]=2 192 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 SY005119 [1,1,0,0,0,0|0,0,0]=2 193 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 SY023952 [1,1,0,0,0,0|0,0,0]=2 194 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 SY032006 [1,1,0,0,0,0|0,0,0]=2 195 B12R1.371 COC(=O)CC1=CC=CC=C1Br SY023296 [1,1,0,0,0,0|0,0,0]=2 196 B12R1.371 COC(=O)CC1=CC=CC=C1C SY106492 [1,1,0,0,0,0|0,0,0]=2 197 B12R1.371 COC(=O)CC1=CC=CC=C1Cl SY021282 [1,1,0,0,0,0|0,0,0]=2 198 B12R1.371 COC(=O)CC1=CC=CC=C1F SY258978 [1,1,0,0,0,0|0,0,0]=2 199 B12R1.371 COC(=O)CC1=CC=CC=C1I SY311934 [1,1,0,0,0,0|0,0,0]=2 200 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 SY103943 [0,1,0,0,1,0|1,0,0]=3 201 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 SY018273 [0,1,0,0,1,0|1,0,0]=3 202 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 SY013720 [0,1,0,0,1,0|0,0,0]=2 203 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 SY023174 [0,1,0,0,1,0|0,0,0]=2 204 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=N1 SY007130 [0,1,0,0,1,0|2,0,0]=4 205 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 SY003268 [0,1,0,0,1,0|0,0,0]=2 206 B12R1.16 CCOC(=O)C1=CC=C(N)N=N1 SY006599 [0,1,0,0,1,0|2,0,0]=4 207 B12R1.16 CCOC(=O)C1=CC=[N+]([O-])C=C1 SY237823 [0,1,0,0,1,0|1,0,0]=3 208 B12R1.16 CCOC(=O)C1=CN=C(C)C=C1 SY023205 [0,1,0,0,1,0|1,0,0]=3 209 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 SY018316 [0,1,0,0,1,0|1,0,0]=3 210 B12R1.16 CCOC(=O)C1=CN=C(Cl)N=C1 SY019435 [0,1,0,0,1,0|2,0,0]=4 211 B12R1.16 CCOC(=O)C1=CN=C(N)C=C1 SY002470 [0,1,0,0,1,0|1,0,0]=3 212 B12R1.16 CCOC(=O)C1=CN=C(N)C=N1 SY007114 [0,1,0,0,1,0|2,0,0]=4 213 B12R1.16 CCOC(=O)C1=CN=C(N)N=C1 SY014488 [0,1,0,0,1,0|2,0,0]=4 214 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 SY021521 [0,1,0,0,1,0|1,0,0]=3 215 B12R1.16 CCOC(=O)C1=NC=C(Br)C=N1 SY006807 [0,1,0,0,1,0|2,0,0]=4 216 B12R1.16 CCOC(=O)C1=NC=C(Cl)C=N1 SY036157 [0,1,0,0,1,0|2,0,0]=4 217 B12R1.16 CCOC(=O)C1=NN=C(C)C=C1 SY007133 [0,1,0,0,1,0|2,0,0]=4 218 B12R1.16 O=C(CCCl)C1=CC=C(Br)C=C1 SY030177 [0,1,0,0,1,0|2,0,0]=4 219 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 SY048486 [0,1,0,0,1,0|2,0,0]=4 220 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 SY028371 [0,1,0,0,1,0|2,0,0]=4 221 B12R1.16 O=C(CCO)C1=CC=C(O)C=C1 SY027114 [0,1,0,0,1,0|2,0,0]=4 222 B12R1.17 CCNC(=O)C1=CC=CC(Br)=C1 SY024855 [0,1,0,0,1,0|1,0,0]=3 223 B12R1.17 CCOC(=O)C1=CC(N)=NC=C1 SY013136 [0,1,0,0,1,0|1,0,0]=3 224 B12R1.17 CCOC(=O)C1=CC(O)=CN=C1 SY007196 [0,1,0,0,1,0|1,0,0]=3 225 B12R1.17 CCOC(=O)C1=CC=CC(Br)=C1 SY009069 [0,1,0,0,1,0|0,0,0]=2 226 B12R1.17 CCOC(=O)C1=CC=CC(Cl)=C1 SY021823 [0,1,0,0,1,0|0,0,0]=2 227 B12R1.17 CCOC(=O)C1=CC=CC(F)=C1 SY012474 [0,1,0,0,1,0|0,0,0]=2 228 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SY006048 [0,1,0,0,1,0|0,0,0]=2 229 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 SY033468 [0,1,0,0,1,0|0,0,0]=2 230 B12R1.17 CCOC(=O)C1=CC=CC(O)=C1 SY016314 [0,1,0,0,1,0|0,0,0]=2 231 B12R1.17 CCOC(=O)C1=CC=NC(Cl)=C1 SY016470 [0,1,0,0,1,0|1,0,0]=3 232 B12R1.17 CCOC(=O)C1=CN=CC(Br)=C1 SY014061 [0,1,0,0,1,0|1,0,0]=3 233 B12R1.17 CCOC(=O)C1=NC(Br)=CC=C1 SY004812 [0,1,0,0,1,0|1,0,0]=3 234 B12R1.17 CCOC(=O)C1=NC(Cl)=CC=C1 SY039716 [0,1,0,0,1,0|1,0,0]=3 235 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 SY053217 [0,1,0,0,1,0|1,0,0]=3 236 B12R1.17 CCOC(=O)C1=NC=CC(Br)=C1 SY105014 [0,1,0,0,1,0|1,0,0]=3 237 B12R1.17 CCOC(=O)C1=NC=CC(Cl)=C1 SY028389 [0,1,0,0,1,0|1,0,0]=3 238 B12R1.17 CCOC(=O)C1=NC=CC(F)=C1 SY243495 [0,1,0,0,1,0|1,0,0]=3 239 B12R1.17 CCOC(=O)C1=NC=CC(N)=N1 SY106290 [0,1,0,0,1,0|2,0,0]=4 240 B12R1.17 CCOC(=O)C1=NC=NC(Cl)=C1 SY034552 [0,1,0,0,1,0|2,0,0]=4 241 B12R1.39 CCOS(=O)(=O)C1=CC=CC=C1 SY053068 [0,1,0,0,1,0|1,0,0]=3 242 B12R1.39 CCOS(=O)(=O)C1=CC=CN=C1 SY293348 [0,1,0,0,1,0|2,0,0]=4 243 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SY011141 [0,1,0,0,1,0|1,0,1]=4 244 B12R1.107 CC(O)=CC(=O)C1=CC=CC=C1 SY266279 [0,1,0,0,1,0|1,0,1]=4 245 B12R1.308 CCOC(=N)C1=CC=CC=C1F SY129446 [0,1,0,0,1,0|1,0,0]=3 246 B12R1.308 CCOC(=O)C1=C(C)N=CN=C1 SY006265 [0,1,0,0,1,0|2,0,0]=4 247 B12R1.308 CCOC(=O)C1=C(Cl)N=CC=C1 SY005168 [0,1,0,0,1,0|1,0,0]=3 248 B12R1.308 CCOC(=O)C1=C(Cl)N=CN=C1 SY007107 [0,1,0,0,1,0|2,0,0]=4 249 B12R1.308 CCOC(=O)C1=C(Cl)N=NC=C1 SY006110 [0,1,0,0,1,0|2,0,0]=4 250 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 SY003267 [0,1,0,0,1,0|0,0,0]=2 251 B12R1.308 CCOC(=O)C1=C(N)C=CC=N1 SY005551 [0,1,0,0,1,0|1,0,0]=3 252 B12R1.308 CCOC(=O)C1=C(N)C=NC=C1 SY007491 [0,1,0,0,1,0|1,0,0]=3 253 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 SY012807 [0,1,0,0,1,0|2,0,0]=4 254 B12R1.308 CCOC(=O)C1=C(O)N=NC=C1 SY006111 [0,1,0,0,1,0|2,0,0]=4 255 B12R1.308 CCOC(=O)C1=CC=CC=C1Br SY004041 [0,1,0,0,1,0|0,0,0]=2 256 B12R1.308 CCOC(=O)C1=CC=CC=C1Cl SY048209 [0,1,0,0,1,0|0,0,0]=2 257 B12R1.308 CCOC(=O)C1=CC=CC=C1I SY037880 [0,1,0,0,1,0|0,0,0]=2 258 B12R1.308 CCOC(=O)C1=CC=CN=C1C SY004406 [0,1,0,0,1,0|1,0,0]=3 259 B12R1.308 CCOC(=O)C1=CC=CN=C1N SY007228 [0,1,0,0,1,0|1,0,0]=3 260 B12R1.308 CCOC(=O)C1=CC=NN=C1C SY028631 [0,1,0,0,1,0|2,0,0]=4 261 B12R1.308 CCOC(=O)C1=CC=NN=C1N SY011639 [0,1,0,0,1,0|2,0,0]=4 262 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl SY036078 [0,1,0,0,1,0|1,0,0]=3 263 B12R1.308 CCOC(=O)C1=CN=CN=C1N SY015021 [0,1,0,0,1,0|2,0,0]=4 264 B12R1.308 CCOC(=O)C1=NC=CC=C1Br SY025917 [0,1,0,0,1,0|1,0,0]=3 265 B12R1.308 CCOC(=O)C1=NC=CC=C1C SY013318 [0,1,0,0,1,0|1,0,0]=3 266 B12R1.308 CCOC(=O)C1=NC=CC=C1Cl SY253689 [0,1,0,0,1,0|1,0,0]=3 267 B12R1.308 CCOC(=O)C1=NC=CC=C1F SY014737 [0,1,0,0,1,0|1,0,0]=3 268 B12R1.308 CCOC(=O)C1=NC=CC=C1O SY047825 [0,1,0,0,1,0|1,0,0]=3 269 B12R1.308 CCOC(=O)C1=NC=CN=C1C SY029597 [0,1,0,0,1,0|2,0,0]=4 270 B12R1.308 CCOC(=O)C1=NC=NC=C1Br SY022729 [0,1,0,0,1,0|2,0,0]=4 271 B12R1.308 O=C(CCCl)C1=CC=CC=C1F SY096664 [0,1,0,0,1,0|2,0,0]=4 272 B12R1.308 O=C(CCCl)C1=CC=CC=C1O SY046373 [0,1,0,0,1,0|2,0,0]=4 273 B12R1.31 CCOC(=O)CC1=COC(C)=N1 SY223924 [0,1,0,0,1,0|2,0,0]=4 274 B12R1.31 CCOC(=O)CC1=CSC(N)=N1 SY057166 [0,1,0,0,1,0|2,0,0]=4 275 B12R1.55 CCOC(=O)C(F)C1=CC=CS1 SY265787 [0,1,0,0,1,0|1,0,0]=3 276 B12R1.318 CCOC(=O)CC1=C(C)N=CS1 SY037196 [0,1,0,0,1,0|2,0,0]=4 277 B12R1.318 CCOC(=O)CC1=C(Cl)C=CO1 SY236779 [0,1,0,0,1,0|1,0,0]=3 278 B12R1.318 CCOC(=O)CN1C=CN=C1C SY013335 [0,1,0,0,1,0|2,0,0]=4 279 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=N1 SY009100 [0,1,0,0,0,1|1,0,0]=3 280 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 SY017675 [0,1,0,0,0,1|1,0,0]=3 281 B14R1.29 CCOC(=O)CC(=O)C1=CN=CC=N1 SY005599 [0,1,0,0,0,1|2,0,0]=4 282 B14R1.29 CCOC(=O)CC(C)C1=CC=CC=C1 SY249487 [0,1,0,0,0,1|0,0,0]=2 283 B14R1.29 CCOC(=O)CC(N)C1=CC=CN=C1 SY015408 [0,1,0,0,0,1|1,0,0]=3 284 B14R1.29 CCOC(=O)CN(C)C1=NC=CC=C1 SY046227 [0,1,0,0,0,1|1,0,0]=3 285 B14R1.29 CCOC(=O)N[C@@H](C)C1=CC=CC=C1 SY008014 [0,1,0,0,0,1|0,0,0]=2 286 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 SY066078 [0,1,0,0,0,1|0,0,1]=3 287 B14R1.32 CCOC(=O)CCC1=CC=CC(N)=C1 SY030602 [0,1,0,0,0,1|0,0,0]=2 288 B14R1.32 CCOC(=O)COC1=CC=CC(F)=C1 SY017191 [0,1,0,0,0,1|0,0,0]=2 289 B14R1.32 CCOC(=S)SCC1=CC(Cl)=NC=C1 SY263754 [0,1,0,0,0,1|1,1,0]=4 290 B14R1.32 CCOC(=S)SCC1=NC(Cl)=CC=C1 SY263755 [0,1,0,0,0,1|1,1,0]=4 291 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 SY265033 [0,1,0,0,0,1|0,0,0]=2 292 B14R1.60 CCOC(=O)C(N)CC1=CC=CC=C1 SY275019 [0,1,0,0,0,1|0,0,0]=2 293 B14R1.60 CCOC(=O)C(N)CC1=NC=CC=C1 SY240441 [0,1,0,0,0,1|1,0,0]=3 294 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 SY066417 [0,1,0,0,0,1|0,0,0]=2 295 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 SY066848 [0,1,0,0,0,1|1,0,0]=3 296 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 SY102986 [0,1,0,0,0,1|1,0,0]=3 297 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 SY105692 [0,1,0,0,0,1|1,0,0]=3 298 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 SY008543 [0,1,0,0,0,1|1,0,0]=3 299 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 SY051387 [0,1,0,0,0,1|1,0,0]=3 300 B14R1.156 O=CCNC(=O)OCC1=CC=CC=C1 SY280161 [0,1,0,0,0,1|1,0,1]=4 301 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 SY021681 [0,1,0,0,0,1|0,0,0]=2 302 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 SY043383 [0,1,0,0,0,1|0,0,0]=2 303 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 SY018459 [0,1,0,0,0,1|0,0,0]=2 304 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY011940 [0,1,0,0,0,1|0,0,1]=3 305 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY074408 [0,1,0,0,0,1|0,0,1]=3 306 B14R1.598 CCOC(=O)\C=C\C1=C(N)C=CN=C1 SY232332 [0,1,0,0,0,1|1,0,1]=4 307 B14R1.756 N[C@@H](CO)C(=O)OCC1=CC=CC=C1 SY030490 [0,1,0,0,0,1|2,0,0]=4 308 B14R1.756 N[C@H](CO)C(=O)NCC1=CC=CC=C1 SY265477 [0,1,0,0,0,1|2,0,0]=4 309 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 SY066432 [0,1,0,0,0,1|2,0,0]=4 310 B14R1.756 N[C@H](CO)C(=O)OCC1=CC=CC=C1 SY308648 [0,1,0,0,0,1|2,0,0]=4 311 B14R1.818 CC(=O)CC(=O)OCC1=CC=CC=C1 SY015679 [0,1,0,0,0,1|1,0,1]=4 312 B14R1.33 O=C(CCCCl)NC1=CC=C(Br)C=C1 SY059688 [0,2,0,0,0,0|2,0,0]=4 313 B14R1.35 CCOC(=O)C(=O)C1=CC=C(C)C=C1 SY063836 [0,2,0,0,0,0|0,0,1]=3 314 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 SY002704 [0,2,0,0,0,0|0,0,1]=3 315 B14R1.954 CCOC(=O)CC1=CC=C(C#N)C=C1 SY043366 [0,2,0,0,0,0|0,0,0]=2 316 B14R1.967 CCOC(=O)CC1=CC=C(Br)C(N)=C1 SY246157 [0,2,0,0,0,0|0,0,0]=2 317 B14R1.967 CCOC(=O)CC1=CC=C(F)C(Cl)=C1 SY038385 [0,2,0,0,0,0|0,0,0]=2 318 B14R1.967 CCOC(=O)CC1=CC=C(N)C(I)=C1 SY262856 [0,2,0,0,0,0|0,0,0]=2 319 B14R1.967 CCOC(=O)CC1=CC=C(O)C(Br)=C1 SY226786 [0,2,0,0,0,0|0,0,0]=2 320 B14R1.967 CCOC(=O)CC1=NC=C(C)C(N)=C1 SY253558 [0,2,0,0,0,0|1,0,0]=3 321 B14R1.967 CCOC(=O)CC1=NC=C(Cl)C(Br)=C1 SY248658 [0,2,0,0,0,0|1,0,0]=3 322 B14R1.950 CCOC(=O)CC1=CC(F)=CC=C1Br SY026878 [0,2,0,0,0,0|0,0,0]=2 323 B14R1.962 CCOC(=O)CC1=CC(C#N)=CN=C1 SY238210 [0,2,0,0,0,0|1,0,0]=3 324 B14R1.962 CCOC(=O)CC1=CC=CC(CBr)=C1 SY270298 [0,2,0,0,0,0|0,0,0]=2 325 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 SY005594 [0,2,0,0,0,0|1,0,1]=4 326 B14R1.510 CCOC(=O)C(C)(C)C1=CC=CC=C1 SY002718 [0,2,0,0,0,0|0,0,0]=2 327 B14R1.510 CCOC(=O)C(C)(C)C1=CC=CN=C1 SY096574 [0,2,0,0,0,0|1,0,0]=3 328 B14R1.510 CCOC(=O)C(Cl)(Cl)C1=CC=CC=C1 SY251826 [0,2,0,0,0,0|0,0,0]=2 329 B14R1.510 CCOC(=O)C(F)(F)C1=CC=CC=C1 SY038854 [0,2,0,0,0,0|0,0,0]=2 330 B14R1.604 CCOC(=O)C(=CO)C1=CC=CC=C1 SY024183 [0,2,0,0,0,0|0,0,1]=3 331 B14R1.604 CCOC(=O)C(C#N)C1=NC=CC=N1 SY021931 [0,2,0,0,0,0|2,0,0]=4 332 B14R1.3348 CCOC(=O)C(=O)C1=CC=CC=C1Cl SY034336 [0,2,0,0,0,0|0,0,1]=3 333 B14R1.3348 CCOC(=O)C(=O)C1=CC=CC=C1F SY032594 [0,2,0,0,0,0|0,0,1]=3 334 B14R1.433 CC(C)(C)OC(=O)NC1=CC=NC=C1 SY016711 [0,2,0,0,0,0|2,0,0]=4 335 B14R1.433 CC(C)(C)OC(=O)NC1=CN=CC=C1 SY006287 [0,2,0,0,0,0|2,0,0]=4 336 B14R1.433 CC(C)(C)OC(=O)NC1=NC=CC=C1 SY031550 [0,2,0,0,0,0|2,0,0]=4 337 B14R1.433 CC(C)(C)OC(=O)OC1=CC=CC=C1 SY012265 [0,2,0,0,0,0|1,0,0]=3 338 B14R1.19171 CCOC(=O)CC1=C(Cl)N=CN=C1Cl SY025214 [0,2,0,0,0,0|2,0,0]=4 339 B14R1.19171 CCOC(=O)CC1=C(F)C=CC=C1Cl SY043354 [0,2,0,0,0,0|0,0,0]=2 340 B14R1.19171 CCOC(=O)CC1=C(O)N=CN=C1O SY025213 [0,2,0,0,0,0|2,0,0]=4 341 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SY063719 [1,0,0,1,0,0|2,0,0]=4 342 B12R2.2 C1=CC=C(C2CCNC2)C=C1 SY023454 [1,0,0,1,0,0|1,0,1]=4 343 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 SY060796 [1,0,0,1,0,0|2,0,0]=4 344 B12R2.2 C1=CC=C([C@@H]2CCON2)C=C1 SY247998 [1,0,0,1,0,0|1,0,0]=3 345 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 SY023849 [1,0,0,1,0,0|1,0,1]=4 346 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 SY245835 [1,0,0,1,0,0|1,0,1]=4 347 B12R2.41 C1=CC=C2CNCCCC2=C1 SY047638 [1,0,0,1,0,0|2,0,0]=4 348 B12R2.1081 CC1NCCC2=C1C=CC=C2 SY027949 [1,0,0,1,0,0|1,0,1]=4 349 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 SY023290 [1,0,0,1,0,0|2,0,0]=4 350 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 SY042826 [1,0,0,1,0,0|1,0,0]=3 351 B12R2.18 CN1C(=O)NC2=CC=CC=C21 SY045893 [1,0,0,1,0,0|2,0,0]=4 352 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O SY016747 [1,0,0,1,0,0|1,0,1]=4 353 B12R2.24 BrC1CCC2=C(C=CC=C2)C1 SY297477 [1,0,0,1,0,0|1,0,1]=4 354 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SY031850 [1,0,0,1,0,0|1,0,1]=4 355 B12R2.24 N[C@@H]1CCC2=C(C=CC=C2)C1 SY118721 [1,0,0,1,0,0|1,0,1]=4 356 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SY036247 [1,0,0,1,0,0|0,0,0]=2 357 B12R2.24 O=C1CCC2=CC=NC=C2N1 SY249512 [1,0,0,1,0,0|2,0,0]=4 358 B12R2.24 O=C1CNC2=C(C=CC=C2)C1 SY292612 [1,0,0,1,0,0|1,0,0]=3 359 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 SY018411 [1,0,0,1,0,0|2,0,0]=4 360 B12R2.24 O=C1CNC2=CC=CC=C2O1 SY292600 [1,0,0,1,0,0|2,0,0]=4 361 B12R2.24 O=C1COC2=C(C=CC=C2)N1 SY007578 [1,0,0,1,0,0|2,0,0]=4 362 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 SY033162 [1,0,0,1,0,0|1,0,0]=3 363 B12R2.24 O=C1NC2=C(C=CN=C2)CO1 SY129221 [1,0,0,1,0,0|2,0,0]=4 364 B12R2.24 O=C1NC2=C(C=NC=C2)CO1 SY129222 [1,0,0,1,0,0|2,0,0]=4 365 B12R2.24 O=C1NC2=CC=CC=C2CO1 SY129148 [1,0,0,1,0,0|1,0,0]=3 366 B12R2.24 O=C1NC2=NC=CC=C2CO1 SY129220 [1,0,0,1,0,0|2,0,0]=4 367 B12R2.24 OC1CC2=C(C=CC=C2)CO1 SY293993 [1,0,0,1,0,0|0,0,2]=4 368 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SY056861 [1,0,0,1,0,0|0,0,2]=4 369 B12R2.32 CCC1=CC2=CC=CC=C2O1 SY067362 [1,0,0,1,0,0|0,0,2]=4 370 B12R2.32 CCC1=NC2=CC=CC=C2N1 SY015992 [1,0,0,1,0,0|2,0,0]=4 371 B12R2.2028 CC1OB(O)C2=CC=CC=C21 SY274016 [0,0,0,1,1,0|1,0,1]=4 372 B12R2.2028 O=C1CC(Br)C2=C1C=CC=C2 SY031995 [0,0,0,1,1,0|2,0,0]=4 373 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 SY036169 [0,0,0,1,1,0|1,0,0]=3 374 B12R2.2028 O=C1OC(O)C2=C1C=CC=C2 SY270554 [0,0,0,1,1,0|1,0,0]=3 375 B12R2.2028 O=C1O[IH2](O)C2=CC=CC=C12 SY041374 [0,0,0,1,1,0|2,0,0]=4 376 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 SY049565 [0,0,0,1,1,0|1,0,0]=3 377 B12R2.2075 O=C(C1=CC=CN=C1)C2CC2 SY016489 [0,0,0,1,1,0|2,0,0]=4 378 B12R2.2075 O=C(C1=CC=NC=C1)C2CC2 SY038710 [0,0,0,1,1,0|2,0,0]=4 379 B12R2.2075 O=C(C1=NC=CC=C1)C2CC2 SY016561 [0,0,0,1,1,0|2,0,0]=4 380 B14R2.21 O=C1CC(C2=CC=CC=C2)CCN1 SY035301 [0,0,0,1,0,1|1,0,0]=3 381 B14R2.21 O=C1COCC(C2=CC=CC=C2)N1 SY030001 [0,0,0,1,0,1|2,0,0]=4 382 B14R2.21 O=C1COC[C@H](C2=CC=CC=C2)N1 SY207241 [0,0,0,1,0,1|2,0,0]=4 383 B14R2.30 O=C1C=CCN1CC2=CC=CC=C2 SY250035 [0,0,0,1,0,1|1,0,1]=4 384 B14R2.30 O=C1CCCN1CC2=CC=CC=C2 SY019726 [0,0,0,1,0,1|1,0,0]=3 385 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 SY012059 [0,0,0,1,0,1|1,0,0]=3 386 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 SY012058 [0,0,0,1,0,1|1,0,0]=3 387 B14R2.598 O=C1N[C@@H](C2=CC=CC=C2)C(=O)O1 SY225275 [0,0,0,1,0,1|1,0,1]=4 388 B14R2.598 O=C1N[C@H](C2=CC=CC=C2)C(=O)O1 SY225252 [0,0,0,1,0,1|1,0,1]=4 389 B14R2.926 NC1=CC=C(N2CCCC2=O)C=C1 SY006662 [0,1,0,1,0,0|2,0,0]=4 390 B14R2.926 O=C1CCCN1C2=CC=C(Br)C=C2 SY008878 [0,1,0,1,0,0|2,0,0]=4 391 B14R2.926 O=C1NCCN1C2=CC=C(Cl)C=C2 SY046070 [0,1,0,1,0,0|2,0,0]=4 392 B14R2.269 O=C1NCCN1C2=CC=CC(Br)=C2 SY022750 [0,1,0,1,0,0|2,0,0]=4 393 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 SY048753 [0,1,0,1,0,0|1,0,0]=3 394 B14R2.24 O=C1COCCN1C2=CC=CC=C2 SY108001 [0,1,0,1,0,0|1,0,0]=3 395 B14R2.741 O=C1NC2=C(C=CC=C2)CCC1Br SY020870 [0,1,0,1,0,0|2,0,0]=4 396 B14R2.1128 CCN1SC2=CC=CC=C2NC1=O SY294329 [0,1,0,1,0,0|2,0,0]=4 397 B14R2.296 O=C1CCCN1C2=C(Br)C=CC=C2 SY005102 [0,1,0,1,0,0|2,0,0]=4 398 B14R2.4621 O=C(CC1=CC=CC=C1F)C2CC2 SY019546 [0,1,0,1,0,0|1,0,0]=3 399 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [1,0,0,0,1,0|1,0,0]=3 400 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [1,0,0,0,1,0|0,0,2]=4 401 B10R1.15 CCN(C)C1=CC=CC=C1 SY032004 [1,0,0,0,1,0|2,0,0]=4 402 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [1,0,0,0,1,0|1,0,0]=3 403 B10R1.15 COC(=O)C1=CN=CC=N1 SY006191 [1,0,0,0,1,0|2,0,0]=4 404 B10R1.15 COC(=O)C1=CN=CN=C1 SY096988 [1,0,0,0,1,0|2,0,0]=4 405 B10R1.15 COC(=O)C1=CN=NC=C1 SY004472 [1,0,0,0,1,0|2,0,0]=4 406 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [1,0,0,0,1,0|1,0,0]=3 407 B10R1.15 COC(=O)C1=NC=CC=N1 SY006773 [1,0,0,0,1,0|2,0,0]=4 408 B10R1.15 COC(=O)C1=NC=NC=C1 SY019964 [1,0,0,0,1,0|2,0,0]=4 409 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [1,0,0,0,1,0|1,0,0]=3 410 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [1,0,0,0,1,0|1,0,0]=3 411 B10R1.15 O=C(CBr)C1=CC=CN=C1 SY023116 [1,0,0,0,1,0|2,0,0]=4 412 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY007962 [1,0,0,0,1,0|2,0,0]=4 413 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY226653 [1,0,0,0,1,0|2,0,0]=4 414 B10R1.15 O=C(CCl)C1=CC=NC=C1 SY011676 [1,0,0,0,1,0|2,0,0]=4 415 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [1,0,0,0,1,0|1,0,0]=3 416 B10R1.15 O=C(CO)C1=CC=CN=C1 SY131032 [1,0,0,0,1,0|2,0,0]=4 417 B10R1.15 O=C(CO)C1=CC=NC=C1 SY131033 [1,0,0,0,1,0|2,0,0]=4 418 B10R1.15 O=C(CO)C1=NC=CC=C1 SY131031 [1,0,0,0,1,0|2,0,0]=4 419 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [1,0,0,0,1,0|1,0,1]=4 420 B10R1.27 COC(=O)CC1=CC=CS1 SY233030 [1,0,0,0,1,0|1,0,0]=3 421 B10R1.27 COC(=O)CN1C=CN=C1 SY005431 [1,0,0,0,1,0|2,0,0]=4 422 B10R1.11 CCOC(=O)C1=CC=CN1 SY006751 [0,0,0,0,2,0|1,0,0]=3 423 B10R1.11 CCOC(=O)C1=CC=CO1 SY013608 [0,0,0,0,2,0|1,0,0]=3 424 B10R1.11 CCOC(=O)C1=CN=CO1 SY025474 [0,0,0,0,2,0|2,0,0]=4 425 B10R1.11 CCOC(=O)C1=CN=CS1 SY033057 [0,0,0,0,2,0|2,0,0]=4 426 B10R1.11 CCOC(=O)C1=CNC=N1 SY009035 [0,0,0,0,2,0|2,0,0]=4 427 B10R1.11 CCOC(=O)C1=CNN=C1 SY008759 [0,0,0,0,2,0|2,0,0]=4 428 B10R1.11 CCOC(=O)C1=COC=C1 SY050805 [0,0,0,0,2,0|1,0,0]=3 429 B10R1.11 CCOC(=O)C1=COC=N1 SY020022 [0,0,0,0,2,0|2,0,0]=4 430 B10R1.11 CCOC(=O)C1=CSC=C1 SY020096 [0,0,0,0,2,0|1,0,0]=3 431 B10R1.11 CCOC(=O)C1=CSC=N1 SY007521 [0,0,0,0,2,0|2,0,0]=4 432 B10R1.11 CCOC(=O)C1=NC=CN1 SY008432 [0,0,0,0,2,0|2,0,0]=4 433 B10R1.11 CCOC(=O)C1=NC=CO1 SY015034 [0,0,0,0,2,0|2,0,0]=4 434 B10R1.11 CCOC(=O)C1=NC=CS1 SY006151 [0,0,0,0,2,0|2,0,0]=4 435 B10R1.11 CCOC(=O)C1=NNC=C1 SY012805 [0,0,0,0,2,0|2,0,0]=4 436 B10R1.11 CCOC(=O)C1=NOC=C1 SY066081 [0,0,0,0,2,0|2,0,0]=4 437 B14R1.520 CCOC(=O)CCCC1=NC=CN=C1 SY280123 [0,0,0,0,0,2|2,0,0]=4 438 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SY021323 [0,0,0,0,0,2|1,0,0]=3 439 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SY021454 [0,0,0,0,0,2|0,0,0]=2