0 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SY192902 [0,0,0,0,0,0|1,0,2]=3 1 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 SY010778 [0,0,0,0,0,0|0,0,2]=2 2 B13R1.42 CCOC(=O)C#CC1=CC=CN=C1 SY022416 [0,0,0,0,0,0|1,0,2]=3 3 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 SY022415 [0,0,0,0,0,0|1,0,2]=3 4 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 SY022417 [0,0,0,0,0,0|1,0,2]=3 5 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SY013603 [0,0,0,0,0,0|0,0,2]=2 6 B13R1.42 CCOC(=O)CCC1=CC=CN=C1 SY022460 [0,0,0,0,0,0|1,0,2]=3 7 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 SY022459 [0,0,0,0,0,0|1,0,2]=3 8 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 SY022461 [0,0,0,0,0,0|1,0,2]=3 9 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 SY049148 [0,0,0,0,0,0|1,0,1]=2 10 B13R1.42 CCOC(=O)COC1=CC=CC=C1 SY017862 [0,0,0,0,0,0|1,0,1]=2 11 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 SY005492 [0,0,0,0,0,0|0,0,0]=0 12 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 SY108025 [0,0,0,0,0,0|1,0,0]=1 13 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 SY125931 [0,0,0,0,0,0|1,0,0]=1 14 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 SY017432 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 SY017868 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.27 COC(=O)C#CC1=CC=CN=C1 SY022413 [1,0,0,0,0,0|1,0,2]=4 17 B12R1.27 COC(=O)C#CC1=CC=NC=C1 SY022412 [1,0,0,0,0,0|1,0,2]=4 18 B12R1.27 COC(=O)C#CC1=NC=CC=C1 SY022414 [1,0,0,0,0,0|1,0,2]=4 19 B12R1.27 COC(=O)CCC1=CC=CC=C1 SY017877 [1,0,0,0,0,0|0,0,2]=3 20 B12R1.27 COC(=O)CCC1=CC=NC=C1 SY022395 [1,0,0,0,0,0|1,0,2]=4 21 B12R1.27 COC(=O)CCC1=NC=CC=C1 SY022458 [1,0,0,0,0,0|1,0,2]=4 22 B12R1.27 COC(=O)COC1=CC=CC=C1 SY037886 [1,0,0,0,0,0|1,0,1]=3 23 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY021003 [1,0,0,0,0,0|2,0,1]=4 24 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY038933 [1,0,0,0,0,0|2,0,1]=4 25 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SY002918 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SY115712 [1,0,0,0,0,0|2,0,1]=4 27 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=N1 SY009100 [0,1,0,0,0,0|1,0,1]=3 28 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 SY017675 [0,1,0,0,0,0|1,0,1]=3 29 B14R1.29 CCOC(=O)CC(=O)C1=CN=CC=N1 SY005599 [0,1,0,0,0,0|2,0,1]=4 30 B14R1.29 CCOC(=O)CC(C)C1=CC=CC=C1 SY249487 [0,1,0,0,0,0|0,0,2]=3 31 B14R1.29 CCOC(=O)CC(N)C1=CC=CN=C1 SY015408 [0,1,0,0,0,0|1,0,2]=4 32 B14R1.29 CCOC(=O)CN(C)C1=NC=CC=C1 SY046227 [0,1,0,0,0,0|2,0,1]=4 33 B14R1.29 CCOC(=O)N[C@@H](C)C1=CC=CC=C1 SY008014 [0,1,0,0,0,0|1,0,1]=3 34 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 SY066078 [0,1,0,0,0,0|0,0,0]=1 35 B14R1.32 CCOC(=O)CCC1=CC=CC(N)=C1 SY030602 [0,1,0,0,0,0|0,0,2]=3 36 B14R1.32 CCOC(=O)COC1=CC=CC(F)=C1 SY017191 [0,1,0,0,0,0|1,0,1]=3 37 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 SY265033 [0,1,0,0,0,0|0,0,1]=2 38 B14R1.60 CCOC(=O)C(N)CC1=CC=CC=C1 SY275019 [0,1,0,0,0,0|0,0,2]=3 39 B14R1.60 CCOC(=O)C(N)CC1=NC=CC=C1 SY240441 [0,1,0,0,0,0|1,0,2]=4 40 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 SY066417 [0,1,0,0,0,0|0,0,2]=3 41 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 SY066848 [0,1,0,0,0,0|2,0,1]=4 42 B14R1.156 NCCNC(=O)OCC1=CC=CC=C1 SY102986 [0,1,0,0,0,0|2,0,1]=4 43 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 SY105692 [0,1,0,0,0,0|2,0,1]=4 44 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 SY008543 [0,1,0,0,0,0|2,0,1]=4 45 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 SY051387 [0,1,0,0,0,0|2,0,1]=4 46 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 SY021681 [0,1,0,0,0,0|0,0,2]=3 47 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 SY043383 [0,1,0,0,0,0|0,0,2]=3 48 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 SY018459 [0,1,0,0,0,0|0,0,2]=3 49 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY011940 [0,1,0,0,0,0|0,0,0]=1 50 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY074408 [0,1,0,0,0,0|0,0,0]=1 51 B14R1.598 CCOC(=O)\C=C\C1=C(N)C=CN=C1 SY232332 [0,1,0,0,0,0|1,0,0]=2 52 B14R2.21 O=C1CC(C2=CC=CC=C2)CCN1 SY035301 [0,0,0,1,0,0|1,0,2]=4 53 B14R2.30 O=C1CCCN1CC2=CC=CC=C2 SY019726 [0,0,0,1,0,0|2,0,1]=4 54 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 SY096670 [0,0,0,1,0,0|3,0,0]=4 55 B14R2.112 ClCOC1=CC2=C(C=CC=C2)C=C1 SY298507 [0,0,0,1,0,0|2,0,0]=3 56 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 SY183807 [0,0,0,1,0,0|3,0,0]=4 57 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 SY107549 [0,0,0,1,0,0|3,0,0]=4 58 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 SY012059 [0,0,0,1,0,0|2,0,1]=4 59 B14R2.598 C[C@H]1NC(=O)O[C@H]1C2=CC=CC=C2 SY012058 [0,0,0,1,0,0|2,0,1]=4 60 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 SY049678 [0,0,0,1,0,0|1,0,1]=3 61 B12R1.32 CCOC(=O)CC1=CC=CN=C1 SY021549 [0,0,0,0,1,0|1,0,1]=3 62 B12R1.32 CCOC(=O)CC1=CC=NC=C1 SY011574 [0,0,0,0,1,0|1,0,1]=3 63 B12R1.32 CCOC(=O)CC1=NC=CC=C1 SY001136 [0,0,0,0,1,0|1,0,1]=3 64 B12R1.32 CCOC(=O)CC1=NC=CC=N1 SY007015 [0,0,0,0,1,0|2,0,1]=4 65 B12R1.32 CCOC(=O)CC1=NC=CN=C1 SY240706 [0,0,0,0,1,0|2,0,1]=4 66 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [0,0,0,0,1,0|3,0,0]=4 67 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SY021323 [0,0,0,0,0,1|1,0,2]=4 68 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SY021454 [0,0,0,0,0,1|0,0,2]=3 69 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SY051763 [2,0,0,0,0,0|0,0,2]=4 70 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [2,0,0,0,0,0|0,0,2]=4 71 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [2,0,0,0,0,0|0,0,2]=4 72 B11R1.91 O=C(O)C=CC1=CC=NC=C1 SY036404 [2,0,0,0,0,0|1,0,0]=3 73 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [2,0,0,0,0,0|0,0,2]=4 74 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 SY009573 [2,0,0,0,0,0|1,0,0]=3 75 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SY016110 [2,0,0,0,0,0|1,0,0]=3 76 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SY020168 [2,0,0,0,0,0|1,0,1]=4 77 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SY012158 [2,0,0,0,0,0|1,0,1]=4 78 B13R1.337 CC(=O)OCC=CC1=CC=CC=C1 SY033240 [1,1,0,0,0,0|0,0,2]=4 79 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 SY027105 [1,1,0,0,0,0|1,0,1]=4 80 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 SY033453 [1,1,0,0,0,0|0,0,1]=3 81 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 SY005601 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SY013642 [1,1,0,0,0,0|0,0,2]=4 83 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 SY028002 [1,1,0,0,0,0|0,0,2]=4 84 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 SY003634 [1,1,0,0,0,0|0,0,2]=4 85 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 SY102551 [1,1,0,0,0,0|1,0,1]=4 86 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 SY012273 [1,1,0,0,0,0|0,0,0]=2 87 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 SY110360 [1,1,0,0,0,0|0,0,2]=4 88 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 SY046258 [1,1,0,0,0,0|0,0,2]=4 89 B13R1.15 COC(=O)\C=C\C1=CC=CC(O)=C1 SY029355 [1,1,0,0,0,0|0,0,0]=2 90 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 SY035299 [1,1,0,0,0,0|0,0,2]=4 91 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 SY106384 [1,1,0,0,0,0|0,0,2]=4 92 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 SY112626 [1,1,0,0,0,0|0,0,2]=4 93 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SY004788 [1,1,0,0,0,0|0,0,2]=4 94 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 SY033782 [1,1,0,0,0,0|0,0,2]=4 95 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 SY034266 [1,1,0,0,0,0|0,0,2]=4 96 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 SY033769 [1,1,0,0,0,0|0,0,2]=4 97 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY029626 [1,1,0,0,0,0|1,0,1]=4 98 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY030492 [1,1,0,0,0,0|1,0,1]=4 99 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 SY059510 [1,1,0,0,0,0|1,0,1]=4 100 B13R1.528 COC(=O)CCC1=CC=CC=C1Br SY017608 [1,1,0,0,0,0|0,0,2]=4 101 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=C1 SY002712 [0,1,0,0,1,0|0,0,1]=3 102 B13R1.19 CCOC(=O)CC1=CC=C(C)C=C1 SY043330 [0,1,0,0,1,0|0,0,1]=3 103 B13R1.19 CCOC(=O)CC1=CC=C(Cl)C=C1 SY030471 [0,1,0,0,1,0|0,0,1]=3 104 B13R1.19 CCOC(=O)CC1=CC=C(F)C=C1 SY021383 [0,1,0,0,1,0|0,0,1]=3 105 B13R1.19 CCOC(=O)CC1=CC=C(I)C=C1 SY041746 [0,1,0,0,1,0|0,0,1]=3 106 B13R1.19 CCOC(=O)CC1=CC=C(N)C=C1 SY020920 [0,1,0,0,1,0|0,0,1]=3 107 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 SY015387 [0,1,0,0,1,0|0,0,1]=3 108 B13R1.19 CCOC(=O)CC1=CN=C(Cl)C=C1 SY059530 [0,1,0,0,1,0|1,0,1]=4 109 B13R1.19 CCOC(=O)CC1=NC=C(Br)C=C1 SY097190 [0,1,0,0,1,0|1,0,1]=4 110 B13R1.19 CCOC(=O)CC1=NC=C(F)C=C1 SY258263 [0,1,0,0,1,0|1,0,1]=4 111 B13R1.19 CCOC(=O)CC1=NC=C(N)C=C1 SY043113 [0,1,0,0,1,0|1,0,1]=4 112 B13R1.19 CCOC(=O)NC1=CC=C(Cl)N=C1 SY039251 [0,1,0,0,1,0|2,0,0]=4 113 B13R1.20 CCOC(=O)CC1=CC(Br)=CC=C1 SY004525 [0,1,0,0,1,0|0,0,1]=3 114 B13R1.20 CCOC(=O)CC1=CC(Br)=CN=C1 SY238207 [0,1,0,0,1,0|1,0,1]=4 115 B13R1.20 CCOC(=O)CC1=NC(C)=CC=C1 SY108732 [0,1,0,0,1,0|1,0,1]=4 116 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 SY038447 [0,1,0,0,1,0|1,0,1]=4 117 B13R1.47 CCOC(=O)C(Br)C1=NC=CC=C1 SY279015 [0,1,0,0,1,0|1,0,1]=4 118 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 SY211257 [0,1,0,0,1,0|0,0,1]=3 119 B13R1.47 CCOC(=O)C(N)C1=CC=CN=C1 SY284563 [0,1,0,0,1,0|1,0,1]=4 120 B13R1.47 CCOC(=O)C(N)C1=CC=NC=C1 SY007583 [0,1,0,0,1,0|1,0,1]=4 121 B13R1.47 CCOC(=O)C(N)C1=NC=CC=C1 SY007582 [0,1,0,0,1,0|1,0,1]=4 122 B13R1.47 CCOC(=O)[C@@H](O)C1=CC=CC=C1 SY017476 [0,1,0,0,1,0|0,0,1]=3 123 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 SY104927 [0,1,0,0,1,0|0,0,1]=3 124 B13R1.47 CCOC(=O)[C@H](O)C1=CC=CC=C1 SY017475 [0,1,0,0,1,0|0,0,1]=3 125 B13R1.470 CCOC(=O)CC1=CC=CC=C1C SY048389 [0,1,0,0,1,0|0,0,1]=3 126 B13R1.470 CCOC(=O)CC1=CC=CC=C1Cl SY108409 [0,1,0,0,1,0|0,0,1]=3 127 B13R1.470 CCOC(=O)CC1=CC=CN=C1Cl SY097610 [0,1,0,0,1,0|1,0,1]=4 128 B13R1.470 CCOC(=O)CC1=NC=CC=C1Br SY025618 [0,1,0,0,1,0|1,0,1]=4 129 B13R1.470 CCOC(=O)CC1=NC=CC=C1F SY267155 [0,1,0,0,1,0|1,0,1]=4 130 B13R1.33 CCOC(=O)CC(=O)C1=CC=CO1 SY005598 [0,1,0,0,1,0|1,0,1]=4 131 B13R1.33 CCOC(=O)CC(=O)C1=CC=CS1 SY050575 [0,1,0,0,1,0|1,0,1]=4 132 B15R1.89 CCOC(=O)CN[C@@H](C)C1=CC=CC=C1 SY005835 [0,1,0,0,0,1|0,0,2]=4 133 B15R1.89 CCOC(=O)CN[C@H](C)C1=CC=CC=C1 SY005447 [0,1,0,0,0,1|0,0,2]=4 134 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 SY041609 [0,1,0,0,0,1|0,0,1]=3 135 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 SY013535 [0,1,0,0,0,1|0,0,1]=3 136 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 SY008760 [0,1,0,0,0,1|0,0,2]=4 137 B15R1.826 CCOC(=O)[C@H](N)CCC1=CC=CC=C1 SY012188 [0,1,0,0,0,1|0,0,2]=4 138 B15R1.826 CCOC(=O)[C@H](O)CCC1=CC=CC=C1 SY056855 [0,1,0,0,0,1|0,0,2]=4 139 B15R1.1252 CCOC(=O)C=COC1=CC=CC=C1Br SY040048 [0,1,0,0,0,1|0,0,0]=2 140 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)C=C1 SY017251 [0,2,0,0,0,0|0,0,1]=3 141 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)N=C1 SY014447 [0,2,0,0,0,0|1,0,1]=4 142 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 SY079867 [0,2,0,0,0,0|0,0,1]=3 143 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1 SY050577 [0,2,0,0,0,0|0,0,1]=3 144 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(F)C=C1 SY008086 [0,2,0,0,0,0|0,0,1]=3 145 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(N)C=C1 SY237878 [0,2,0,0,0,0|0,0,1]=3 146 B15R1.23 CCOC(=O)CC(N)C1=CC=C(Cl)C=C1 SY262839 [0,2,0,0,0,0|0,0,2]=4 147 B15R1.24 CCOC(=O)CC(=O)C1=CC(Br)=CC=C1 SY019933 [0,2,0,0,0,0|0,0,1]=3 148 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(C)=C1 SY058425 [0,2,0,0,0,0|0,0,1]=3 149 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(Cl)=C1 SY079907 [0,2,0,0,0,0|0,0,1]=3 150 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(O)=C1 SY027397 [0,2,0,0,0,0|0,0,1]=3 151 B15R1.24 CCOC(=O)CC(N)C1=CC=CC(Cl)=C1 SY262825 [0,2,0,0,0,0|0,0,2]=4 152 B15R1.24 CCOC(=O)CC(N)C1=CC=CC(O)=C1 SY028064 [0,2,0,0,0,0|0,0,2]=4 153 B15R1.578 CCOC(=O)C(C)C(=O)C1=CC=CC=C1 SY024531 [0,2,0,0,0,0|0,0,1]=3 154 B15R1.807 CCOC(=O)CS(=O)(=O)C1=CC=CC=C1 SY051006 [0,2,0,0,0,0|1,0,1]=4 155 B15R1.3722 CCOC(=O)CC(=O)C1=CC=CC=C1Br SY122672 [0,2,0,0,0,0|0,0,1]=3 156 B15R1.3722 CCOC(=O)CC(=O)C1=CC=CC=C1Cl SY031952 [0,2,0,0,0,0|0,0,1]=3 157 B15R1.3722 CCOC(=O)CC(=O)C1=CC=CC=C1F SY050576 [0,2,0,0,0,0|0,0,1]=3 158 B15R1.3722 CCOC(=O)CC(=O)C1=CC=CC=C1I SY041360 [0,2,0,0,0,0|0,0,1]=3 159 B15R1.10389 CCOC(=O)COC1=CC=CC(C#N)=C1 SY016096 [0,2,0,0,0,0|1,0,1]=4 160 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 SY036802 [0,2,0,0,0,0|0,0,2]=4 161 B15R1.640 CCOC(=O)C(C#N)CC1=CC=CC=C1 SY023619 [0,2,0,0,0,0|0,0,2]=4 162 B15R1.640 CCOC(=O)\C(C#N)=C\C1=CC=CN=C1 SY021408 [0,2,0,0,0,0|1,0,0]=3 163 B15R1.5919 CC(C)COC(=O)\C=C\C1=CC=CC=C1 SY015388 [0,2,0,0,0,0|0,0,0]=2 164 B15R1.791 CCOC(=O)CCC1=CC=C(O)C=C1F SY023751 [0,2,0,0,0,0|0,0,2]=4 165 B15R1.791 CCOC(=O)\C=C\C1=C(N)C=C(Br)N=C1 SY285193 [0,2,0,0,0,0|1,0,0]=3 166 B15R1.791 CCOC(=O)\C=C\C1=C(N)C=C(Cl)N=C1 SY286747 [0,2,0,0,0,0|1,0,0]=3 167 B15R1.791 CCOC(=O)\C=C\C1=CC=C(Cl)N=C1Cl SY272688 [0,2,0,0,0,0|1,0,0]=3 168 B15R1.793 CCOC(=O)CCC1=CC=C(CO)C=C1 SY046032 [0,2,0,0,0,0|0,0,2]=4 169 B15R1.793 CCOC(=O)\C=C\C1=CC=C(OC)C=C1 SY036618 [0,2,0,0,0,0|0,0,0]=2 170 B15R1.768 CCOC(=O)CNC1=CC=CC=C1C#N SY004376 [0,2,0,0,0,0|1,0,1]=4 171 B15R1.768 CCOC(=O)COC1=CC=CC=C1C#N SY016091 [0,2,0,0,0,0|1,0,1]=4 172 B15R1.768 CCOC(=O)COC1=CC=CC=C1SC SY046176 [0,2,0,0,0,0|1,0,1]=4 173 B15R1.36731 CCOC(=O)\C=C\C1=C(O)C=CC=C1Br SY270965 [0,2,0,0,0,0|0,0,0]=2 174 B15R1.3465 CC(C)(C)OC(=O)COC1=CC=CC=C1 SY265377 [0,2,0,0,0,0|1,0,1]=4 175 B15R1.3465 CC(C)(C)OC(=O)\C=C\C1=CC=CN=C1 SY277733 [0,2,0,0,0,0|1,0,0]=3 176 B13R1.464 CCOC(=O)C1=C(C#N)C=CC=C1 SY005786 [0,0,1,1,0,0|1,0,1]=4 177 B13R1.460 CCOC(=O)C1=CC=CC(CCl)=C1 SY032679 [0,0,1,1,0,0|1,0,1]=4 178 B13R1.460 CCOC(=O)C1=CC=CC(CN)=C1 SY161686 [0,0,1,1,0,0|1,0,1]=4 179 B13R1.460 CCOC(=O)C1=CC=CC(NN)=C1 SY038148 [0,0,1,1,0,0|2,0,0]=4 180 B13R1.460 CCOC(=O)C1=CC=CC(OC)=C1 SY109307 [0,0,1,1,0,0|1,0,1]=4 181 B13R1.446 CCOC(=O)C1=C(Cl)C=CC(Br)=C1 SY012257 [0,0,1,1,0,0|2,0,0]=4 182 B13R1.446 CCOC(=O)C1=CC(C)=CC=C1F SY017650 [0,0,1,1,0,0|1,0,1]=4 183 B13R1.446 CCOC(=O)C1=CC(C)=CC=C1N SY104722 [0,0,1,1,0,0|1,0,1]=4 184 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1Br SY023646 [0,0,1,1,0,0|2,0,0]=4 185 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1F SY039194 [0,0,1,1,0,0|2,0,0]=4 186 B13R1.446 CCOC(=O)C1=CC(F)=CC=C1N SY096690 [0,0,1,1,0,0|2,0,0]=4 187 B13R1.446 CCOC(=O)C1=CC(I)=CC=C1N SY106802 [0,0,1,1,0,0|2,0,0]=4 188 B13R2.3 C1=CC=C(C2=CCCCC2)C=C1 SY048999 [1,0,0,1,0,0|1,0,1]=4 189 B13R2.1613 CCC1=C2C=CC=CC2=CC=C1 SY051576 [1,0,0,1,0,0|1,0,0]=3 190 B13R2.1613 CCC1=C2N=CC=CC2=CC=C1 SY047171 [1,0,0,1,0,0|2,0,0]=4 191 B13R2.1613 CNC1=C2C=CC=CC2=CC=C1 SY042924 [1,0,0,1,0,0|2,0,0]=4 192 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 SY011422 [1,0,0,1,0,0|2,0,0]=4 193 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 SY032092 [1,0,0,1,0,0|2,0,0]=4 194 B13R2.1613 OCC1=C2C=CC=CC2=CC=C1 SY007270 [1,0,0,1,0,0|2,0,0]=4 195 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 SY014437 [1,0,0,1,0,0|2,0,0]=4 196 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 SY037846 [1,0,0,1,0,0|1,0,1]=4 197 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY013456 [1,0,0,1,0,0|1,0,1]=4 198 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SY020305 [1,0,0,1,0,0|1,0,1]=4 199 B13R2.10 OC1=CC(C2=CC=CC=C2)=NO1 SY122686 [1,0,0,1,0,0|1,0,1]=4 200 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SY036148 [1,0,0,1,0,0|0,0,2]=4 201 B13R2.57 BrCC1=NC2=C(C=CC=C2)C=C1 SY018619 [1,0,0,1,0,0|2,0,0]=4 202 B13R2.57 C1=C2C=CC=CC2=CC=C1OC SY246289 [1,0,0,1,0,0|1,0,0]=3 203 B13R2.57 C1=CC2=CC=C(OC)C=C2C=C1 SY246288 [1,0,0,1,0,0|1,0,0]=3 204 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 SY013880 [1,0,0,1,0,0|2,0,0]=4 205 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 SY012831 [1,0,0,1,0,0|2,0,0]=4 206 B13R2.57 COC1=CC2=C(C=CN=C2)C=C1 SY021161 [1,0,0,1,0,0|2,0,0]=4 207 B13R2.57 COC1=CC2=CC=CC=C2N=C1 SY021113 [1,0,0,1,0,0|2,0,0]=4 208 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021166 [1,0,0,1,0,0|2,0,0]=4 209 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021167 [1,0,0,1,0,0|2,0,0]=4 210 B13R2.57 COC1=NC2=CC=CC=C2C=C1 SY034140 [1,0,0,1,0,0|1,0,0]=3 211 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 SY018308 [1,0,0,1,0,0|2,0,0]=4 212 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY023509 [1,0,0,1,0,0|2,0,0]=4 213 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY032005 [1,0,0,1,0,0|2,0,0]=4 214 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 SY034716 [1,0,0,1,0,0|2,0,0]=4 215 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282068 [1,0,0,1,0,0|2,0,0]=4 216 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282069 [1,0,0,1,0,0|2,0,0]=4 217 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 SY021110 [1,0,0,1,0,0|2,0,0]=4 218 B13R2.26 CCOC1=NC2=CC=CC=C2N1 SY244449 [0,0,0,1,1,0|2,0,0]=4 219 B13R2.163 O=C1CCCC2=CC=CC=C2N1 SY017407 [0,0,0,1,1,0|2,0,0]=4 220 B15R2.66 CCOC1=CNC(C2=CC=CC=C2)=N1 SY265066 [0,0,0,1,0,1|1,0,0]=3 221 B15R2.73 CCOC(=O)C1=C2C=CC=CN2C=N1 SY021951 [0,0,0,1,0,1|1,0,0]=3 222 B15R2.73 CCOC(=O)C1=C2C=CC=CN2N=C1 SY060415 [0,0,0,1,0,1|1,0,0]=3 223 B15R2.73 CCOC(=O)C1=C2N=CC=CN2N=C1 SY042783 [0,0,0,1,0,1|2,0,0]=4 224 B15R2.73 CCOC(=O)C1=CN=C2C=CC=CN12 SY004049 [0,0,0,1,0,1|1,0,0]=3 225 B15R2.73 CCOC(=O)C1=CNC2=C1C=CC=C2 SY037991 [0,0,0,1,0,1|0,0,0]=2 226 B15R2.73 CCOC(=O)C1=COC2=CC=CC=C21 SY040041 [0,0,0,1,0,1|0,0,0]=2 227 B15R2.73 CCOC(=O)C1=NNC2=C1C=CC=C2 SY004042 [0,0,0,1,0,1|1,0,0]=3 228 B15R2.73 CCOC(=O)C1=NNC2=CC=CN=C21 SY097188 [0,0,0,1,0,1|2,0,0]=4 229 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 SY099273 [0,0,0,1,0,1|0,0,2]=4 230 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 SY266106 [0,0,0,1,0,1|0,0,2]=4 231 B15R2.1342 CCOC(=O)[C@H]1C[C@@H]1C2=CC=CC=C2 SY266105 [0,0,0,1,0,1|0,0,2]=4 232 B15R2.1290 CCOC1=CC2=C(C=C1)NC=CC2=O SY227478 [0,1,0,1,0,0|2,0,0]=4 233 B15R2.1290 CCOC1=CC=C2N=CC=C(Br)C2=C1 SY293529 [0,1,0,1,0,0|2,0,0]=4 234 B15R2.1290 CCOC1=CC=C2N=CC=C(Cl)C2=C1 SY227424 [0,1,0,1,0,0|2,0,0]=4 235 B15R2.10252 ClCOC1=CC2=C(C=C1)C=C(Br)C=C2 SY298501 [0,1,0,1,0,0|2,0,0]=4 236 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)N1 SY001911 [0,1,0,1,0,0|0,0,0]=2 237 B15R2.1356 CCOC(=O)C1=CC2=C(C=CN=C2)N1 SY019643 [0,1,0,1,0,0|1,0,0]=3 238 B15R2.1356 CCOC(=O)C1=CC2=C(C=NC=C2)N1 SY009260 [0,1,0,1,0,0|1,0,0]=3 239 B15R2.1356 CCOC(=O)C1=CC2=CC=CN=C2N1 SY014131 [0,1,0,1,0,0|1,0,0]=3 240 B15R2.1356 CCOC(=O)C1=CC2=NC=CC=C2N1 SY004471 [0,1,0,1,0,0|1,0,0]=3 241 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2=N1 SY004050 [0,1,0,1,0,0|1,0,0]=3 242 B15R2.1356 CCOC(=O)C1=CN2C=CC=NC2=N1 SY014179 [0,1,0,1,0,0|2,0,0]=4 243 B15R2.1356 CCOC(=O)C1=CN2C=CN=CC2=N1 SY008394 [0,1,0,1,0,0|2,0,0]=4 244 B15R2.1356 CCOC(=O)C1=NC2=C(C=NC=C2)S1 SY294203 [0,1,0,1,0,0|2,0,0]=4 245 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2S1 SY027943 [0,1,0,1,0,0|1,0,0]=3 246 B15R2.352 N#CCOC1=CC=C2C=CC=CC2=C1 SY067734 [0,1,0,1,0,0|1,0,1]=4 247 B15R2.352 NCCOC1=CC=C2C=CC=CC2=C1 SY169760 [0,1,0,1,0,0|1,0,0]=3 248 B15R2.1282 CCOC1=CC2=CC(O)=CC=C2C=C1 SY039189 [0,1,0,1,0,0|1,0,0]=3 249 B15R2.1282 ClCOC1=CC2=C(C=CC(Br)=C2)C=C1 SY298443 [0,1,0,1,0,0|2,0,0]=4 250 B15R2.2220 ClCOC1=C(Br)C2=C(C=CC=C2)C=C1 SY298557 [0,1,0,1,0,0|2,0,0]=4 251 B15R3.31603 C1=CC2=CC=C(C3CC3)C=C2C=C1 SY263865 [0,0,0,2,0,0|2,0,0]=4 252 B15R3.31603 C1=CC=C2N=C(C3CC3)C=CC2=C1 SY264177 [0,0,0,2,0,0|2,0,0]=4 253 B15R3.2009 [C@H]12CC3=C(C=CC=C3)[C@H]1NC(=O)O2 SY223970 [0,0,0,2,0,0|1,0,1]=4 254 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [1,0,0,0,1,0|1,0,1]=4 255 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [1,0,0,0,1,0|1,0,1]=4 256 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [1,0,0,0,1,0|1,0,1]=4 257 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [1,0,0,0,1,0|1,0,1]=4 258 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [1,0,0,0,1,0|1,0,1]=4 259 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [1,0,0,0,1,0|2,0,0]=4 260 B11R1.16 CCCC(=O)C1=CC=CC=N1 SY005363 [0,0,0,0,2,0|2,0,0]=4 261 B11R1.16 CCOC(=N)C1=CC=CC=C1 SY060984 [0,0,0,0,2,0|1,0,0]=3 262 B11R1.16 CCOC(=O)C1=CC=NC=C1 SY001919 [0,0,0,0,2,0|1,0,0]=3 263 B11R1.16 CCOC(=O)C1=CC=NC=N1 SY005565 [0,0,0,0,2,0|2,0,0]=4 264 B11R1.16 CCOC(=O)C1=CC=NN=C1 SY015372 [0,0,0,0,2,0|2,0,0]=4 265 B11R1.16 CCOC(=O)C1=CN=CC=N1 SY012364 [0,0,0,0,2,0|2,0,0]=4 266 B11R1.16 CCOC(=O)C1=CN=CN=C1 SY004401 [0,0,0,0,2,0|2,0,0]=4 267 B11R1.16 CCOC(=O)C1=NC=CC=C1 SY020537 [0,0,0,0,2,0|1,0,0]=3 268 B11R1.16 CCOC(=O)C1=NC=CC=N1 SY010066 [0,0,0,0,2,0|2,0,0]=4 269 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 SY257193 [0,0,0,0,2,0|1,0,0]=3 270 B11R1.16 CNNC(=O)C1=CC=CC=C1 SY294316 [0,0,0,0,2,0|2,0,0]=4 271 B11R1.16 NCCC(=O)C1=CC=CC=C1 SY263195 [0,0,0,0,2,0|2,0,0]=4 272 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SY004650 [0,0,0,0,2,0|2,0,0]=4 273 B11R1.16 O=C(OCI)C1=CC=CC=C1 SY036475 [0,0,0,0,2,0|1,0,0]=3 274 B11R1.30 CCOC(=O)NC1=CC=CS1 SY002881 [0,0,0,0,2,0|2,0,0]=4 275 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 SY003944 [0,0,0,0,0,2|0,0,2]=4