0 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SY004327 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.27 COC(=O)C#CC1=CC=CN=C1 SY022413 [0,0,0,0,0,0|1,0,2]=3 2 B12R1.27 COC(=O)C#CC1=CC=NC=C1 SY022412 [0,0,0,0,0,0|1,0,2]=3 3 B12R1.27 COC(=O)C#CC1=NC=CC=C1 SY022414 [0,0,0,0,0,0|1,0,2]=3 4 B12R1.27 COC(=O)CCC1=CC=CC=C1 SY017877 [0,0,0,0,0,0|0,0,2]=2 5 B12R1.27 COC(=O)CCC1=CC=NC=C1 SY022395 [0,0,0,0,0,0|1,0,2]=3 6 B12R1.27 COC(=O)CCC1=NC=CC=C1 SY022458 [0,0,0,0,0,0|1,0,2]=3 7 B12R1.27 COC(=O)COC1=CC=CC=C1 SY037886 [0,0,0,0,0,0|1,0,1]=2 8 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY021003 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SY038933 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SY017007 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SY002918 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SY115712 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SY024162 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SY051763 [1,0,0,0,0,0|0,0,2]=3 15 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [1,0,0,0,0,0|0,0,2]=3 16 B11R1.91 CC(=O)COC1=NC=CC=C1 SY251719 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.91 NC(=O)NCC1=CC=CC=C1 SY049437 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.91 NC(=O)OCC1=CC=CC=C1 SY015067 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [1,0,0,0,0,0|0,0,2]=3 20 B11R1.91 O=C(O)C#CC1=CC=CN=C1 SY022409 [1,0,0,0,0,0|1,0,2]=4 21 B11R1.91 O=C(O)C#CC1=CC=NC=C1 SY022408 [1,0,0,0,0,0|1,0,2]=4 22 B11R1.91 O=C(O)C#CC1=NC=CC=C1 SY022410 [1,0,0,0,0,0|1,0,2]=4 23 B11R1.91 O=C(O)C=CC1=CC=NC=C1 SY036404 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [1,0,0,0,0,0|0,0,2]=3 25 B11R1.91 O=C(O)CCC1=CC=NC=C1 SY022403 [1,0,0,0,0,0|1,0,2]=4 26 B11R1.91 O=C(O)CCC1=CN=CC=C1 SY017981 [1,0,0,0,0,0|1,0,2]=4 27 B11R1.91 O=C(O)CCC1=NC=CC=C1 SY013900 [1,0,0,0,0,0|1,0,2]=4 28 B11R1.91 O=C(O)COC1=CC=CN=C1 SY110065 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 SY009573 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SY016110 [1,0,0,0,0,0|1,0,0]=2 31 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 SY020168 [1,0,0,0,0,0|1,0,1]=3 32 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 SY012158 [1,0,0,0,0,0|1,0,1]=3 33 B13R1.11 CNC(=O)CC(=O)C1=CC=CC=C1 SY027105 [0,1,0,0,0,0|1,0,1]=3 34 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 SY033453 [0,1,0,0,0,0|0,0,1]=2 35 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 SY005601 [0,1,0,0,0,0|1,0,1]=3 36 B13R1.11 COC(=O)CC(N)C1=CC=CN=C1 SY020335 [0,1,0,0,0,0|1,0,2]=4 37 B13R1.11 COC(=O)CN(C)C1=NC=CC=C1 SY021379 [0,1,0,0,0,0|2,0,1]=4 38 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SY013642 [0,1,0,0,0,0|0,0,2]=3 39 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 SY028002 [0,1,0,0,0,0|0,0,2]=3 40 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 SY003634 [0,1,0,0,0,0|0,0,2]=3 41 B13R1.14 COC(=O)COC1=CC=C(Cl)N=C1 SY026758 [0,1,0,0,0,0|2,0,1]=4 42 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 SY102551 [0,1,0,0,0,0|1,0,1]=3 43 B13R1.14 COC(=O)COC1=NC=C(Br)C=C1 SY022407 [0,1,0,0,0,0|2,0,1]=4 44 B13R1.14 COC(=O)\C=C\C1=CC=C(Br)C=C1 SY012273 [0,1,0,0,0,0|0,0,0]=1 45 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 SY110360 [0,1,0,0,0,0|0,0,2]=3 46 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 SY046258 [0,1,0,0,0,0|0,0,2]=3 47 B13R1.15 COC(=O)\C=C\C1=CC=CC(O)=C1 SY029355 [0,1,0,0,0,0|0,0,0]=1 48 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SY192902 [0,1,0,0,0,0|1,0,2]=4 49 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 SY010778 [0,1,0,0,0,0|0,0,2]=3 50 B13R1.42 CCOC(=O)C#CC1=CC=CN=C1 SY022416 [0,1,0,0,0,0|1,0,2]=4 51 B13R1.42 CCOC(=O)C#CC1=CC=NC=C1 SY022415 [0,1,0,0,0,0|1,0,2]=4 52 B13R1.42 CCOC(=O)C#CC1=NC=CC=C1 SY022417 [0,1,0,0,0,0|1,0,2]=4 53 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SY013603 [0,1,0,0,0,0|0,0,2]=3 54 B13R1.42 CCOC(=O)CCC1=CC=CN=C1 SY022460 [0,1,0,0,0,0|1,0,2]=4 55 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 SY022459 [0,1,0,0,0,0|1,0,2]=4 56 B13R1.42 CCOC(=O)CCC1=NC=CC=C1 SY022461 [0,1,0,0,0,0|1,0,2]=4 57 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 SY049148 [0,1,0,0,0,0|1,0,1]=3 58 B13R1.42 CCOC(=O)COC1=CC=CC=C1 SY017862 [0,1,0,0,0,0|1,0,1]=3 59 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 SY005492 [0,1,0,0,0,0|0,0,0]=1 60 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 SY108025 [0,1,0,0,0,0|1,0,0]=2 61 B13R1.42 CCOC(=O)\C=C\C1=NC=CC=C1 SY125931 [0,1,0,0,0,0|1,0,0]=2 62 B13R1.42 O=C(CCF)OCC1=CC=CC=C1 SY017432 [0,1,0,0,0,0|2,0,1]=4 63 B13R1.42 O=C(CCO)OCC1=CC=CC=C1 SY017868 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.135 COC(=O)C(Cl)CC1=CC=CC=C1 SY035299 [0,1,0,0,0,0|0,0,2]=3 65 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 SY106384 [0,1,0,0,0,0|0,0,2]=3 66 B13R1.135 COC(=O)C(O)CC1=CC=CC=C1 SY112626 [0,1,0,0,0,0|0,0,2]=3 67 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SY004788 [0,1,0,0,0,0|0,0,2]=3 68 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 SY033782 [0,1,0,0,0,0|0,0,2]=3 69 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 SY034266 [0,1,0,0,0,0|0,0,2]=3 70 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 SY033769 [0,1,0,0,0,0|0,0,2]=3 71 B13R1.135 CON(C)C(=O)CC1=CC=CC=C1 SY201708 [0,1,0,0,0,0|2,0,1]=4 72 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY029626 [0,1,0,0,0,0|2,0,1]=4 73 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 SY030492 [0,1,0,0,0,0|2,0,1]=4 74 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 SY059510 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.528 COC(=O)CCC1=CC=CC=C1Br SY017608 [0,1,0,0,0,0|0,0,2]=3 76 B13R2.10 CC1=CC(C2=CC=CN=C2)=NO1 SY260310 [0,0,0,1,0,0|3,0,0]=4 77 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 SY014437 [0,0,0,1,0,0|2,0,0]=3 78 B13R2.10 NC1=CC(C2=NC=CC=C2)=NO1 SY280444 [0,0,0,1,0,0|3,0,0]=4 79 B13R2.10 NC1=NC(C2=CC=CC=C2)=CO1 SY270923 [0,0,0,1,0,0|2,0,1]=4 80 B13R2.10 NC1=NNC(C2=CC=CC=C2)=C1 SY011840 [0,0,0,1,0,0|3,0,0]=4 81 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SY031841 [0,0,0,1,0,0|1,0,2]=4 82 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 SY037846 [0,0,0,1,0,0|1,0,1]=3 83 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY013456 [0,0,0,1,0,0|1,0,1]=3 84 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SY020305 [0,0,0,1,0,0|1,0,1]=3 85 B13R2.10 OC1=CC(C2=CC=CC=C2)=NO1 SY122686 [0,0,0,1,0,0|1,0,1]=3 86 B13R2.10 OC1=CC(C2=CC=CN=C2)=NO1 SY122700 [0,0,0,1,0,0|2,0,1]=4 87 B13R2.10 OC1=CC(C2=CC=NC=C2)=NO1 SY122699 [0,0,0,1,0,0|2,0,1]=4 88 B13R2.10 OC1=CC(C2=NC=CC=C2)=NO1 SY122701 [0,0,0,1,0,0|2,0,1]=4 89 B13R2.32 CC1=C(Br)C=NC2=CC=CC=C21 SY272016 [0,0,0,1,0,0|3,0,0]=4 90 B13R2.32 CC1=C2N=CC=CC2=CC=C1Br SY021176 [0,0,0,1,0,0|3,0,0]=4 91 B13R2.32 CC1=C2N=CC=CC2=CC=C1Cl SY021168 [0,0,0,1,0,0|3,0,0]=4 92 B13R2.32 CC1=CC=C2C=CC=CC2=C1Br SY012657 [0,0,0,1,0,0|3,0,0]=4 93 B13R2.32 CC1=CC=C2C=CC=CC2=C1N SY050539 [0,0,0,1,0,0|3,0,0]=4 94 B13R2.32 CC1=CC=C2C=CC=CC2=C1O SY045991 [0,0,0,1,0,0|3,0,0]=4 95 B13R2.32 NC1=CC=C2C=CC=CC2=C1Cl SY129327 [0,0,0,1,0,0|3,0,0]=4 96 B13R2.32 OC1=C2C=CC=CC2=CC=C1Br SY021885 [0,0,0,1,0,0|3,0,0]=4 97 B13R2.32 OC1=CC=C2C=CC=CC2=C1Br SY020306 [0,0,0,1,0,0|2,0,1]=4 98 B13R2.32 OC1=CC=C2C=CC=CC2=C1Cl SY055883 [0,0,0,1,0,0|2,0,1]=4 99 B13R2.32 OC1=CC=C2C=CC=CC2=C1I SY019655 [0,0,0,1,0,0|2,0,1]=4 100 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SY036148 [0,0,0,1,0,0|1,0,2]=4 101 B13R2.57 BrCC1=NC2=C(C=CC=C2)C=C1 SY018619 [0,0,0,1,0,0|3,0,0]=4 102 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 SY050708 [0,0,0,1,0,0|2,0,1]=4 103 B13R2.57 C1=C2C=CC=CC2=CC=C1OC SY246289 [0,0,0,1,0,0|1,0,0]=2 104 B13R2.57 C1=CC2=CC=C(OC)C=C2C=C1 SY246288 [0,0,0,1,0,0|1,0,0]=2 105 B13R2.57 C=CC1=CC=C2C=CC=CC2=C1 SY106378 [0,0,0,1,0,0|2,0,1]=4 106 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 SY013880 [0,0,0,1,0,0|2,0,0]=3 107 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 SY012831 [0,0,0,1,0,0|2,0,0]=3 108 B13R2.57 COC1=CC2=C(C=CN=C2)C=C1 SY021161 [0,0,0,1,0,0|2,0,0]=3 109 B13R2.57 COC1=CC2=CC=CC=C2N=C1 SY021113 [0,0,0,1,0,0|2,0,0]=3 110 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021166 [0,0,0,1,0,0|2,0,0]=3 111 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021167 [0,0,0,1,0,0|2,0,0]=3 112 B13R2.57 COC1=NC2=CC=CC=C2C=C1 SY034140 [0,0,0,1,0,0|1,0,0]=2 113 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 SY018308 [0,0,0,1,0,0|3,0,0]=4 114 B13R2.57 N#CC1=CC=C2C=CC=CC2=C1 SY049690 [0,0,0,1,0,0|3,0,0]=4 115 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY023509 [0,0,0,1,0,0|3,0,0]=4 116 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY032005 [0,0,0,1,0,0|3,0,0]=4 117 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 SY034716 [0,0,0,1,0,0|3,0,0]=4 118 B13R2.57 NNC1=CC=C2C=CC=CC2=C1 SY047024 [0,0,0,1,0,0|3,0,0]=4 119 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 SY049526 [0,0,0,1,0,0|3,0,0]=4 120 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282520 [0,0,0,1,0,0|3,0,0]=4 121 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282521 [0,0,0,1,0,0|3,0,0]=4 122 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282068 [0,0,0,1,0,0|2,0,0]=3 123 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282069 [0,0,0,1,0,0|2,0,0]=3 124 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282276 [0,0,0,1,0,0|3,0,0]=4 125 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282277 [0,0,0,1,0,0|3,0,0]=4 126 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 SY019180 [0,0,0,1,0,0|3,0,0]=4 127 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 SY021110 [0,0,0,1,0,0|3,0,0]=4 128 B11R1.25 COC(=O)CCC1=CC=CN1 SY047286 [0,0,0,0,1,0|1,0,2]=4 129 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [0,0,0,0,1,0|2,0,1]=4 130 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [0,0,0,0,1,0|2,0,1]=4 131 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [0,0,0,0,1,0|1,0,1]=3 132 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [0,0,0,0,1,0|1,0,1]=3 133 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [0,0,0,0,1,0|1,0,1]=3 134 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [0,0,0,0,1,0|1,0,1]=3 135 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [0,0,0,0,1,0|1,0,1]=3 136 B11R1.40 COC(=O)CC1=NC=CC=N1 SY005830 [0,0,0,0,1,0|2,0,1]=4 137 B11R1.40 COC(=O)C[N+]1=NC=CC=C1 SY286050 [0,0,0,0,1,0|2,0,1]=4 138 B11R1.40 N#CC(=O)CC1=CC=CC=C1 SY235509 [0,0,0,0,1,0|2,0,1]=4 139 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [0,0,0,0,1,0|2,0,1]=4 140 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [0,0,0,0,1,0|3,0,0]=4 141 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [0,0,0,0,1,0|3,0,0]=4 142 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SY048553 [0,0,0,0,1,0|3,0,0]=4 143 B13R1.718 CCC(=O)OCCC1=CC=CC=C1 SY049056 [0,0,0,0,0,1|1,0,2]=4 144 B13R1.718 COC(=O)CCNC1=CC=CC=C1 SY028349 [0,0,0,0,0,1|0,0,2]=3 145 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SY174443 [0,0,0,0,0,1|0,0,2]=3 146 B10R1.17 N#C\C=C\C1=CC=CC=C1 SY014969 [2,0,0,0,0,0|1,0,1]=4 147 B10R1.17 NC\C=C\C1=CC=CC=C1 SY123671 [2,0,0,0,0,0|1,0,1]=4 148 B10R1.17 O=CC#CC1=CC=CC=C1 SY015622 [2,0,0,0,0,0|0,0,2]=4 149 B10R1.17 OC\C=C/C1=CC=CC=C1 SY129813 [2,0,0,0,0,0|0,0,1]=3 150 B10R1.17 OC\C=C\C1=CC=CN=C1 SY022168 [2,0,0,0,0,0|1,0,1]=4 151 B10R1.17 OC\C=C\C1=CC=NC=C1 SY022167 [2,0,0,0,0,0|1,0,1]=4 152 B10R1.17 OC\C=C\C1=NC=CC=C1 SY022169 [2,0,0,0,0,0|1,0,1]=4 153 B12R1.32 COCC(=O)OC1=CC=CC=C1 SY261726 [1,1,0,0,0,0|1,0,1]=4 154 B12R1.21 CC(=O)CCC1=CC=C(C)C=C1 SY022010 [1,1,0,0,0,0|0,0,2]=4 155 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 SY004032 [1,1,0,0,0,0|0,0,2]=4 156 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SY007830 [1,1,0,0,0,0|0,0,2]=4 157 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 SY003984 [1,1,0,0,0,0|0,0,0]=2 158 B12R1.21 CC1=CC=C(\C=C\[N+](=O)[O-])C=C1 SY106389 [1,1,0,0,0,0|1,0,1]=4 159 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=N1 SY023087 [1,1,0,0,0,0|1,0,0]=3 160 B12R1.21 O=C(O)C=CC1=CC=C(Cl)C=C1 SY003740 [1,1,0,0,0,0|0,0,0]=2 161 B12R1.21 O=C(O)C=CC1=CC=C(F)C=C1 SY036413 [1,1,0,0,0,0|0,0,0]=2 162 B12R1.21 O=C(O)C=CC1=CC=C(O)C=C1 SY015618 [1,1,0,0,0,0|0,0,0]=2 163 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SY013641 [1,1,0,0,0,0|0,0,2]=4 164 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SY003370 [1,1,0,0,0,0|0,0,2]=4 165 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 SY006122 [1,1,0,0,0,0|0,0,2]=4 166 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SY016883 [1,1,0,0,0,0|0,0,2]=4 167 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 SY012298 [1,1,0,0,0,0|1,0,1]=4 168 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 SY003346 [1,1,0,0,0,0|1,0,1]=4 169 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 SY049560 [1,1,0,0,0,0|1,0,1]=4 170 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 SY012252 [1,1,0,0,0,0|0,0,0]=2 171 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 SY020906 [1,1,0,0,0,0|0,0,0]=2 172 B12R1.21 O=[N+]([O-])C=CC1=CC=C(Cl)C=C1 SY111175 [1,1,0,0,0,0|1,0,1]=4 173 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(Br)C=C1 SY122924 [1,1,0,0,0,0|1,0,1]=4 174 B12R1.21 OB(O)\C=C\C1=CC=C(Cl)C=C1 SY026561 [1,1,0,0,0,0|1,0,1]=4 175 B12R1.43 C=C(C)C(=O)NC1=CC=CC=C1 SY051128 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SY006039 [1,1,0,0,0,0|0,0,1]=3 177 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O SY185587 [1,1,0,0,0,0|0,0,2]=4 178 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SY001531 [1,1,0,0,0,0|0,0,2]=4 179 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SY005120 [1,1,0,0,0,0|0,0,2]=4 180 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SY103074 [1,1,0,0,0,0|0,0,2]=4 181 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SY036063 [1,1,0,0,0,0|0,0,2]=4 182 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SY020879 [1,1,0,0,0,0|0,0,2]=4 183 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SY021341 [1,1,0,0,0,0|0,0,2]=4 184 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 SY011141 [1,1,0,0,0,0|0,0,1]=3 185 B12R1.107 CC(=O)NC(C)C1=CC=CC=C1 SY007036 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.107 CC(O)=CC(=O)C1=CC=CC=C1 SY266279 [1,1,0,0,0,0|0,0,1]=3 187 B12R1.107 C[C@@H](CC(=O)O)C1=CC=CC=C1 SY231348 [1,1,0,0,0,0|0,0,2]=4 188 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 SY226436 [1,1,0,0,0,0|0,0,2]=4 189 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 SY002485 [1,1,0,0,0,0|0,0,2]=4 190 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 SY017494 [1,1,0,0,0,0|0,0,2]=4 191 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 SY014163 [1,1,0,0,0,0|0,0,2]=4 192 B12R1.107 O=C(O)CC(=O)C1=CC=CC=C1 SY045029 [1,1,0,0,0,0|0,0,1]=3 193 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 SY017555 [1,1,0,0,0,0|0,0,2]=4 194 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 SY015112 [1,1,0,0,0,0|0,0,0]=2 195 B12R1.125 CC1=CC=CC=C1CCC(=O)O SY017785 [1,1,0,0,0,0|0,0,2]=4 196 B12R1.125 O=C(O)CCC1=CC=CC=C1Br SY017169 [1,1,0,0,0,0|0,0,2]=4 197 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl SY003324 [1,1,0,0,0,0|0,0,2]=4 198 B12R1.125 O=C(O)CCC1=CC=CC=C1F SY016160 [1,1,0,0,0,0|0,0,2]=4 199 B12R1.125 O=C(O)CCC1=CC=CC=C1I SY238889 [1,1,0,0,0,0|0,0,2]=4 200 B12R1.125 O=C(O)CCC1=CC=CC=C1O SY101015 [1,1,0,0,0,0|0,0,2]=4 201 B12R1.125 O=C(O)COC1=CC=CC=C1F SY008332 [1,1,0,0,0,0|1,0,1]=4 202 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 SY009527 [1,1,0,0,0,0|0,0,0]=2 203 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl SY003739 [1,1,0,0,0,0|0,0,0]=2 204 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O SY048367 [1,1,0,0,0,0|0,0,0]=2 205 B12R1.125 O=[N+]([O-])\C=C\C1=CC=CC=C1Cl SY127914 [1,1,0,0,0,0|1,0,1]=4 206 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 SY062646 [1,1,0,0,0,0|0,0,2]=4 207 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 SY003985 [1,1,0,0,0,0|0,0,0]=2 208 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 SY062293 [1,1,0,0,0,0|0,0,2]=4 209 B12R1.226 O=C(O)CCC1=CC(Br)=CC=C1 SY013761 [1,1,0,0,0,0|0,0,2]=4 210 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 SY017063 [1,1,0,0,0,0|0,0,2]=4 211 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 SY017727 [1,1,0,0,0,0|0,0,2]=4 212 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 SY022016 [1,1,0,0,0,0|0,0,2]=4 213 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 SY008336 [1,1,0,0,0,0|1,0,1]=4 214 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 SY122974 [1,1,0,0,0,0|1,0,1]=4 215 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 SY008331 [1,1,0,0,0,0|1,0,1]=4 216 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 SY003741 [1,1,0,0,0,0|0,0,0]=2 217 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 SY012681 [1,1,0,0,0,0|0,0,0]=2 218 B12R1.891 O=S(=O)(Cl)C=CC1=CC=CC=C1 SY120986 [1,1,0,0,0,0|1,0,1]=4 219 B12R1.891 O=S(=O)(Cl)\C=C\C1=CC=CC=C1 SY122183 [1,1,0,0,0,0|1,0,1]=4 220 B12R1.15 COC(=O)CC(=O)C1=CC=CO1 SY007446 [0,1,0,0,1,0|1,0,1]=4 221 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 SY014788 [0,1,0,0,1,0|0,0,0]=2 222 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SY113594 [0,1,0,0,1,0|0,0,1]=3 223 B12R1.34 COC(=O)C(N)C1=CC=NC=C1 SY023726 [0,1,0,0,1,0|1,0,1]=4 224 B12R1.34 COC(=O)C(N)C1=NC=CC=C1 SY033361 [0,1,0,0,1,0|1,0,1]=4 225 B12R1.34 COC(=O)[C@@H](O)C1=CC=CC=C1 SY003754 [0,1,0,0,1,0|0,0,1]=3 226 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 SY020988 [0,1,0,0,1,0|0,0,1]=3 227 B12R1.34 COC(=O)[C@H](O)C1=CC=CC=C1 SY003762 [0,1,0,0,1,0|0,0,1]=3 228 B12R1.34 CON(C)C(=O)C1=CC=CC=C1 SY052485 [0,1,0,0,1,0|2,0,0]=4 229 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 SY139358 [0,1,0,0,1,0|2,0,0]=4 230 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 SY021204 [0,1,0,0,1,0|0,0,1]=3 231 B12R1.49 COC(=O)CC1=CC=C(Br)N=C1 SY235517 [0,1,0,0,1,0|1,0,1]=4 232 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 SY052935 [0,1,0,0,1,0|0,0,1]=3 233 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 SY051360 [0,1,0,0,1,0|0,0,1]=3 234 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 SY030613 [0,1,0,0,1,0|1,0,1]=4 235 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SY041951 [0,1,0,0,1,0|0,0,1]=3 236 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 SY041745 [0,1,0,0,1,0|0,0,1]=3 237 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SY100571 [0,1,0,0,1,0|0,0,1]=3 238 B12R1.49 COC(=O)CC1=CC=C(N)N=C1 SY278591 [0,1,0,0,1,0|1,0,1]=4 239 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 SY001844 [0,1,0,0,1,0|0,0,1]=3 240 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 SY029783 [0,1,0,0,1,0|1,0,1]=4 241 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 SY004524 [0,1,0,0,1,0|0,0,1]=3 242 B12R1.50 COC(=O)CC1=CC(Br)=NC=C1 SY030795 [0,1,0,0,1,0|1,0,1]=4 243 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 SY053038 [0,1,0,0,1,0|0,0,1]=3 244 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 SY051263 [0,1,0,0,1,0|0,0,1]=3 245 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 SY005119 [0,1,0,0,1,0|0,0,1]=3 246 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 SY023952 [0,1,0,0,1,0|0,0,1]=3 247 B12R1.371 COC(=O)CC1=C(O)C=CC=C1 SY032006 [0,1,0,0,1,0|0,0,1]=3 248 B12R1.371 COC(=O)CC1=CC=CC=C1Br SY023296 [0,1,0,0,1,0|0,0,1]=3 249 B12R1.371 COC(=O)CC1=CC=CC=C1C SY106492 [0,1,0,0,1,0|0,0,1]=3 250 B12R1.371 COC(=O)CC1=CC=CC=C1Cl SY021282 [0,1,0,0,1,0|0,0,1]=3 251 B12R1.371 COC(=O)CC1=CC=CC=C1F SY258978 [0,1,0,0,1,0|0,0,1]=3 252 B12R1.371 COC(=O)CC1=CC=CC=C1I SY311934 [0,1,0,0,1,0|0,0,1]=3 253 B14R1.13 COC(=O)CCNC1=CC=C(O)C=C1 SY027115 [0,1,0,0,0,1|0,0,2]=4 254 B14R1.163 COC(=O)CCC(=O)C1=CC=CC=C1 SY009084 [0,1,0,0,0,1|0,0,1]=3 255 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SY021454 [0,1,0,0,0,1|0,0,2]=4 256 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 SY005594 [0,1,0,0,0,1|0,0,1]=3 257 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 SY031217 [0,1,0,0,0,1|0,0,2]=4 258 B14R1.756 COC(=O)[C@H](C)NCC1=CC=CC=C1 SY144060 [0,1,0,0,0,1|0,0,2]=4 259 B14R1.10 COC(=O)CC(=O)C1=CC=C(Br)C=C1 SY058771 [0,2,0,0,0,0|0,0,1]=3 260 B14R1.10 COC(=O)CC(=O)C1=CC=C(C)C=C1 SY122682 [0,2,0,0,0,0|0,0,1]=3 261 B14R1.10 COC(=O)CC(=O)C1=CC=C(F)C=C1 SY002576 [0,2,0,0,0,0|0,0,1]=3 262 B14R1.10 COC(=O)CC(=O)C1=CC=C(I)C=C1 SY122707 [0,2,0,0,0,0|0,0,1]=3 263 B14R1.10 COC(=O)CC(N)C1=CC=C(O)C=C1 SY028034 [0,2,0,0,0,0|0,0,2]=4 264 B14R1.11 COC(=O)CC(=O)C1=CC=CC(Br)=C1 SY022179 [0,2,0,0,0,0|0,0,1]=3 265 B14R1.11 COC(=O)CC(=O)C1=CC=CC(Cl)=C1 SY122678 [0,2,0,0,0,0|0,0,1]=3 266 B14R1.11 COC(=O)CC(=O)C1=CC=CC(F)=C1 SY122677 [0,2,0,0,0,0|0,0,1]=3 267 B14R1.11 COC(=O)CC(C)C1=CC=CC(O)=C1 SY028727 [0,2,0,0,0,0|0,0,2]=4 268 B14R1.11 COC(=O)CC(N)C1=CC=CC(O)=C1 SY028033 [0,2,0,0,0,0|0,0,2]=4 269 B14R1.11 COC(=O)CC(O)C1=CC=CC(O)=C1 SY028025 [0,2,0,0,0,0|0,0,2]=4 270 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=N1 SY009100 [0,2,0,0,0,0|1,0,1]=4 271 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 SY017675 [0,2,0,0,0,0|1,0,1]=4 272 B14R1.29 CCOC(=O)CC(C)C1=CC=CC=C1 SY249487 [0,2,0,0,0,0|0,0,2]=4 273 B14R1.29 CCOC(=O)N[C@@H](C)C1=CC=CC=C1 SY008014 [0,2,0,0,0,0|1,0,1]=4 274 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 SY066078 [0,2,0,0,0,0|0,0,0]=2 275 B14R1.85 COC(=O)C(C)C(=O)C1=CC=CC=C1 SY025988 [0,2,0,0,0,0|0,0,1]=3 276 B14R1.85 COC(=O)C(N)C(=O)C1=CC=CC=C1 SY281096 [0,2,0,0,0,0|0,0,1]=3 277 B14R1.587 COC(=O)CC(=O)C1=CC=CC=C1Br SY122680 [0,2,0,0,0,0|0,0,1]=3 278 B14R1.587 COC(=O)CC(=O)C1=CC=CC=C1C SY122683 [0,2,0,0,0,0|0,0,1]=3 279 B14R1.587 COC(=O)CC(=O)C1=CC=CC=C1Cl SY033035 [0,2,0,0,0,0|0,0,1]=3 280 B14R1.587 COC(=O)CC(=O)C1=CC=CC=C1I SY122681 [0,2,0,0,0,0|0,0,1]=3 281 B14R1.741 COC(=O)CS(=O)(=O)C1=CC=CC=C1 SY049693 [0,2,0,0,0,0|1,0,1]=4 282 B14R1.5 C#CC1=CC=C(CCC(=O)OC)C=C1 SY028001 [0,2,0,0,0,0|0,0,2]=4 283 B14R1.5 COC(=O)COC1=CC=C(C#N)C=C1 SY012813 [0,2,0,0,0,0|1,0,1]=4 284 B14R1.5 COC(=O)\C=C\C1=CC=C(CBr)C=C1 SY018618 [0,2,0,0,0,0|0,0,0]=2 285 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 SY109110 [0,2,0,0,0,0|0,0,2]=4 286 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 SY011309 [0,2,0,0,0,0|0,0,2]=4 287 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 SY015879 [0,2,0,0,0,0|0,0,2]=4 288 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Br)C=C1 SY237222 [0,2,0,0,0,0|0,0,2]=4 289 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(O)C=C1 SY057646 [0,2,0,0,0,0|0,0,2]=4 290 B14R1.134 COC(=O)[C@H](O)CC1=CC=C(F)C=C1 SY008378 [0,2,0,0,0,0|0,0,2]=4 291 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 SY021681 [0,2,0,0,0,0|0,0,2]=4 292 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 SY043383 [0,2,0,0,0,0|0,0,2]=4 293 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 SY018459 [0,2,0,0,0,0|0,0,2]=4 294 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY011940 [0,2,0,0,0,0|0,0,0]=2 295 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 SY074408 [0,2,0,0,0,0|0,0,0]=2 296 B14R1.727 COC(=O)CCC1=CC=C(Br)C=C1O SY289390 [0,2,0,0,0,0|0,0,2]=4 297 B14R1.727 COC(=O)CCC1=CC=C(O)C=C1C SY026463 [0,2,0,0,0,0|0,0,2]=4 298 B14R1.727 COC(=O)\C=C\C1=NC=C(Cl)C=C1N SY273292 [0,2,0,0,0,0|1,0,0]=3 299 B14R1.833 COC(=O)\C=C\C1=CC=C(N)C(O)=C1 SY247651 [0,2,0,0,0,0|0,0,0]=2 300 B14R1.833 COC(=O)\C=C\C1=CC=C(O)C(O)=C1 SY057957 [0,2,0,0,0,0|0,0,0]=2 301 B14R1.32 CCOC(=O)CCC1=CC=CC(N)=C1 SY030602 [0,2,0,0,0,0|0,0,2]=4 302 B14R1.32 CCOC(=O)COC1=CC=CC(F)=C1 SY017191 [0,2,0,0,0,0|1,0,1]=4 303 B14R1.135 COC(=O)C(N)CC1=CC=CC(Br)=C1 SY131081 [0,2,0,0,0,0|0,0,2]=4 304 B14R1.135 COC(=O)C(O)CC1=CC=CC(O)=C1 SY028024 [0,2,0,0,0,0|0,0,2]=4 305 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 SY131080 [0,2,0,0,0,0|0,0,2]=4 306 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 SY236621 [0,2,0,0,0,0|0,0,2]=4 307 B14R1.60 CCOC(=O)C(=O)CC1=CC=CC=C1 SY265033 [0,2,0,0,0,0|0,0,1]=3 308 B14R1.60 CCOC(=O)C(N)CC1=CC=CC=C1 SY275019 [0,2,0,0,0,0|0,0,2]=4 309 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 SY066417 [0,2,0,0,0,0|0,0,2]=4 310 B14R1.598 CCOC(=O)\C=C\C1=C(N)C=CN=C1 SY232332 [0,2,0,0,0,0|1,0,0]=3 311 B14R1.1031 CN[C@H](CC1=CC=CC=C1)C(=O)OC SY249564 [0,2,0,0,0,0|0,0,2]=4 312 B14R1.1031 COC(=O)\C(C#N)=C\C1=CC=CC=C1 SY014783 [0,2,0,0,0,0|0,0,0]=2 313 B12R1.77 CNC1=CC=CC=C1C(=O)OC SY048962 [0,0,1,1,0,0|1,0,1]=4 314 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 SY012783 [0,0,1,1,0,0|1,0,0]=3 315 B12R1.77 COC(=O)C1=CC=CC=C1C#N SY005784 [0,0,1,1,0,0|1,0,1]=4 316 B12R1.77 COC(=O)C1=CC=CC=C1CBr SY018859 [0,0,1,1,0,0|1,0,1]=4 317 B12R1.77 COC(=O)C1=CC=CC=C1OC SY048778 [0,0,1,1,0,0|1,0,1]=4 318 B12R1.354 COC(=O)C1=C(Br)C=CC(Cl)=C1 SY018973 [0,0,1,1,0,0|2,0,0]=4 319 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=C1 SY018237 [0,0,1,1,0,0|2,0,0]=4 320 B12R1.354 COC(=O)C1=C(C)C=CC(F)=C1 SY016119 [0,0,1,1,0,0|1,0,1]=4 321 B12R1.354 COC(=O)C1=C(C)C=CC(O)=C1 SY123668 [0,0,1,1,0,0|1,0,1]=4 322 B12R1.354 COC(=O)C1=C(Cl)C=CC(N)=C1 SY013757 [0,0,1,1,0,0|2,0,0]=4 323 B12R1.354 COC(=O)C1=C(F)C=CC(F)=C1 SY011018 [0,0,1,1,0,0|2,0,0]=4 324 B12R1.354 COC(=O)C1=C(I)C=CC(Br)=C1 SY015039 [0,0,1,1,0,0|2,0,0]=4 325 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=C1 SY008595 [0,0,1,1,0,0|2,0,0]=4 326 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 SY015102 [0,0,1,1,0,0|2,0,0]=4 327 B12R1.354 COC(=O)C1=CC(Br)=CC=C1Br SY020916 [0,0,1,1,0,0|2,0,0]=4 328 B12R1.354 COC(=O)C1=CC(Br)=CC=C1C SY021478 [0,0,1,1,0,0|1,0,1]=4 329 B12R1.354 COC(=O)C1=CC(Br)=CC=C1Cl SY024436 [0,0,1,1,0,0|2,0,0]=4 330 B12R1.354 COC(=O)C1=CC(Br)=CC=C1F SY058384 [0,0,1,1,0,0|2,0,0]=4 331 B12R1.354 COC(=O)C1=CC(Br)=CC=C1N SY011823 [0,0,1,1,0,0|2,0,0]=4 332 B12R1.354 COC(=O)C1=CC(Br)=CC=C1N SY292217 [0,0,1,1,0,0|2,0,0]=4 333 B12R1.354 COC(=O)C1=CC(C)=CC=C1Br SY104606 [0,0,1,1,0,0|1,0,1]=4 334 B12R1.354 COC(=O)C1=CC(C)=CC=C1F SY016925 [0,0,1,1,0,0|1,0,1]=4 335 B12R1.354 COC(=O)C1=CC(C)=CC=C1I SY027849 [0,0,1,1,0,0|1,0,1]=4 336 B12R1.354 COC(=O)C1=CC(C)=CC=C1N SY025953 [0,0,1,1,0,0|1,0,1]=4 337 B12R1.354 COC(=O)C1=CC(C)=CC=C1O SY035511 [0,0,1,1,0,0|1,0,1]=4 338 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1C SY016955 [0,0,1,1,0,0|1,0,1]=4 339 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1Cl SY109358 [0,0,1,1,0,0|2,0,0]=4 340 B12R1.354 COC(=O)C1=CC(Cl)=CC=C1N SY007126 [0,0,1,1,0,0|2,0,0]=4 341 B12R1.354 COC(=O)C1=CC(F)=CC=C1N SY009285 [0,0,1,1,0,0|2,0,0]=4 342 B12R1.354 COC(=O)C1=CC(F)=CC=C1O SY109922 [0,0,1,1,0,0|2,0,0]=4 343 B12R1.354 COC(=O)C1=CC(I)=CC=C1N SY041013 [0,0,1,1,0,0|2,0,0]=4 344 B12R1.354 COC(=O)C1=CC(N)=CC=C1Br SY034469 [0,0,1,1,0,0|2,0,0]=4 345 B12R1.354 COC(=O)C1=CC(N)=CC=C1C SY021381 [0,0,1,1,0,0|1,0,1]=4 346 B12R1.354 COC(=O)C1=CC(N)=CC=C1F SY013943 [0,0,1,1,0,0|2,0,0]=4 347 B12R1.354 COC(=O)C1=CC(N)=CC=C1N SY027277 [0,0,1,1,0,0|2,0,0]=4 348 B12R1.354 COC(=O)C1=CC(N)=CC=C1O SY060717 [0,0,1,1,0,0|2,0,0]=4 349 B12R1.354 COC(=O)C1=CC(O)=CC=C1F SY027275 [0,0,1,1,0,0|2,0,0]=4 350 B12R1.354 COC(=O)C1=CC(O)=CC=C1N SY043028 [0,0,1,1,0,0|2,0,0]=4 351 B12R1.435 C#CC1=CC(C(=O)OC)=CC=C1 SY033191 [0,0,1,1,0,0|0,0,2]=4 352 B12R1.435 COC(=O)C1=CC(C=O)=CC=C1 SY004534 [0,0,1,1,0,0|1,0,0]=3 353 B12R1.435 COC(=O)C1=CC(OC)=CC=C1 SY049891 [0,0,1,1,0,0|1,0,1]=4 354 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 SY019269 [0,0,1,1,0,0|1,0,1]=4 355 B12R1.435 COC(=O)C1=CC=NC(C=O)=C1 SY105765 [0,0,1,1,0,0|2,0,0]=4 356 B12R2.2 C1=CC=C(C2=CC=CN2)C=C1 SY122110 [1,0,0,1,0,0|2,0,0]=4 357 B12R2.2 C1=CC=C(C2=CC=CS2)C=C1 SY009364 [1,0,0,1,0,0|2,0,0]=4 358 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 SY009071 [1,0,0,1,0,0|2,0,0]=4 359 B12R2.2 C1=CC=C(C2=NON=C2)C=C1 SY129105 [1,0,0,1,0,0|2,0,0]=4 360 B12R2.1081 IC1=C2C=CC=CC2=CC=C1 SY024097 [1,0,0,1,0,0|2,0,0]=4 361 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 SY029843 [1,0,0,1,0,0|0,0,2]=4 362 B12R2.24 BrC1=NC2=C(C=CC=C2)C=C1 SY019854 [1,0,0,1,0,0|2,0,0]=4 363 B12R2.24 CC1=CC2=CC=CC=C2N=C1 SY048469 [1,0,0,1,0,0|2,0,0]=4 364 B12R2.24 CC1=NC2=CC=CN=C2C=C1 SY098561 [1,0,0,1,0,0|2,0,0]=4 365 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SY017550 [1,0,0,1,0,0|2,0,0]=4 366 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 SY055345 [1,0,0,1,0,0|1,0,1]=4 367 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 SY001152 [1,0,0,1,0,0|2,0,0]=4 368 B12R2.24 IC1=CC=C2C=CC=CC2=C1 SY103936 [1,0,0,1,0,0|1,0,1]=4 369 B12R2.24 O=C1C=CC2=C(C=CN=C2)N1 SY129309 [1,0,0,1,0,0|2,0,0]=4 370 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 SY241058 [1,0,0,1,0,0|2,0,0]=4 371 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SY036247 [1,0,0,1,0,0|1,0,1]=4 372 B12R2.24 O=C1CNC2=C(C=CC=C2)C1 SY292612 [1,0,0,1,0,0|1,0,1]=4 373 B12R2.24 O=C1CNC2=CC=CC=C2O1 SY292600 [1,0,0,1,0,0|1,0,1]=4 374 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 SY033162 [1,0,0,1,0,0|1,0,1]=4 375 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 SY020019 [1,0,0,1,0,0|2,0,0]=4 376 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SY009024 [1,0,0,1,0,0|2,0,0]=4 377 B12R2.24 OC1=CC2=CC=CC=C2C=N1 SY005563 [1,0,0,1,0,0|2,0,0]=4 378 B12R2.24 OC1=CC=C2C=CC=NC2=C1 SY025837 [1,0,0,1,0,0|2,0,0]=4 379 B12R2.24 OC1=CC=C2C=CN=CC2=C1 SY020018 [1,0,0,1,0,0|2,0,0]=4 380 B12R2.24 OC1=CC=C2N=CC=CC2=C1 SY003116 [1,0,0,1,0,0|2,0,0]=4 381 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 SY003693 [1,0,0,1,0,0|1,0,0]=3 382 B12R2.24 OC1=NC2=C(C=CC=C2)N=C1 SY013680 [1,0,0,1,0,0|2,0,0]=4 383 B12R2.24 OC1=NC2=CC=CN=C2C=C1 SY116568 [1,0,0,1,0,0|2,0,0]=4 384 B12R2.2403 CC1(C)C=CC2=C1C=CC=C2 SY297315 [1,0,0,1,0,0|1,0,1]=4 385 B12R2.2403 O=S1(=O)C=CC2=CC=CC=C21 SY046790 [1,0,0,1,0,0|1,0,1]=4 386 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 SY185508 [1,0,0,1,0,0|0,0,2]=4 387 B12R2.44 COC1=CC2=C(C=C1)NC=C2 SY004368 [0,0,0,1,1,0|2,0,0]=4 388 B12R2.44 COC1=CC2=C(C=CN2)C=C1 SY001985 [0,0,0,1,1,0|2,0,0]=4 389 B12R2.44 COC1=CC=C2C=CSC2=C1 SY122383 [0,0,0,1,1,0|2,0,0]=4 390 B12R2.44 COC1=CC=C2OC=CC2=C1 SY032575 [0,0,0,1,1,0|2,0,0]=4 391 B12R2.18 CC1=CC2=C(C=CC=C2)N1C SY004658 [0,0,0,1,1,0|2,0,0]=4 392 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 SY042826 [0,0,0,1,1,0|1,0,1]=4 393 B12R2.18 CN1C(=O)NC2=CC=CC=C21 SY045893 [0,0,0,1,1,0|2,0,0]=4 394 B12R2.18 CN1C(Br)=CC2=C1C=CC=C2 SY247582 [0,0,0,1,1,0|2,0,0]=4 395 B12R2.32 CCC1=CC2=CC=CC=C2O1 SY067362 [0,0,0,1,1,0|1,0,1]=4 396 B14R2.8 COC1=CNC(C2=CC=CC=C2)=N1 SY263391 [0,0,0,1,0,1|1,0,0]=3 397 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 SY010607 [0,0,0,1,0,1|0,0,2]=4 398 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 SY007401 [0,0,0,1,0,1|0,0,2]=4 399 B14R2.68 O=C1C=CC(C2=CC=CC=C2)=NN1 SY023992 [0,0,0,1,0,1|2,0,0]=4 400 B14R2.95 COC(=O)C1=CNC2=C1C=CC=C2 SY020043 [0,0,0,1,0,1|0,0,0]=2 401 B14R2.95 COC(=O)C1=CNC2=NC=CC=C12 SY042023 [0,0,0,1,0,1|1,0,0]=3 402 B14R2.95 COC(=O)C1=CSC2=C1C=CN=C2 SY068116 [0,0,0,1,0,1|1,0,0]=3 403 B14R2.95 COC(=O)C1=NNC2=C1C=CC=C2 SY032788 [0,0,0,1,0,1|1,0,0]=3 404 B14R2.95 O=C(CCl)N1C=CC2=C1C=CC=C2 SY250443 [0,0,0,1,0,1|2,0,0]=4 405 B14R2.95 O=C(CO)C1=CNC2=C1C=CC=C2 SY131003 [0,0,0,1,0,1|2,0,0]=4 406 B14R2.958 COC(=O)C1N=C1C2=CC=CC=C2 SY037180 [0,0,0,1,0,1|0,0,1]=3 407 B14R2.958 COC(=O)C1NC1C2=CC=CC=C2 SY037179 [0,0,0,1,0,1|0,0,2]=4 408 B14R2.958 COC(=O)C1OC1C2=CC=CC=C2 SY037171 [0,0,0,1,0,1|0,0,2]=4 409 B14R2.958 COC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 SY266108 [0,0,0,1,0,1|0,0,2]=4 410 B14R2.958 COC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 SY266109 [0,0,0,1,0,1|0,0,2]=4 411 B14R2.958 COC(=O)[C@H]1C[C@@H]1C2=CC=CC=C2 SY266107 [0,0,0,1,0,1|0,0,2]=4 412 B14R2.21 O=C1COCC(C2=CC=CC=C2)N1 SY030001 [0,1,0,1,0,0|1,0,1]=4 413 B14R2.21 O=C1COC[C@H](C2=CC=CC=C2)N1 SY207241 [0,1,0,1,0,0|1,0,1]=4 414 B14R2.260 CC1=CC(C2=CC=CC=C2)=CN1C SY264837 [0,1,0,1,0,0|2,0,0]=4 415 B14R2.260 CN1N=C(C2=CC=CC=C2)C=C1N SY078781 [0,1,0,1,0,0|2,0,0]=4 416 B14R2.260 CN1N=C(C2=CC=CC=C2)C=C1O SY239377 [0,1,0,1,0,0|1,0,1]=4 417 B14R2.1019 COC1=CC(Br)=C2C=CC=NC2=C1 SY253670 [0,1,0,1,0,0|2,0,0]=4 418 B14R2.1019 COC1=CC(Br)=C2N=CC=CC2=C1 SY265508 [0,1,0,1,0,0|2,0,0]=4 419 B14R2.7724 CN1C(=O)C=C(Cl)C2=C1N=CC=C2 SY249723 [0,1,0,1,0,0|2,0,0]=4 420 B14R2.7724 CN1C(=O)OC(=O)C2=C1C=CC=C2 SY013490 [0,1,0,1,0,0|2,0,0]=4 421 B14R2.20 CC1=CC=C(C2=NOC(N)=C2)C=C1 SY012492 [0,1,0,1,0,0|2,0,0]=4 422 B14R2.20 CC1=CC=C(C2=NOC(O)=C2)C=C1 SY122705 [0,1,0,1,0,0|1,0,1]=4 423 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NO1 SY012482 [0,1,0,1,0,0|2,0,0]=4 424 B14R2.20 NC1=CC(C2=CC=C(F)C=C2)=NO1 SY012481 [0,1,0,1,0,0|2,0,0]=4 425 B14R2.20 NC1=CC(C2=CC=C(I)C=C2)=NO1 SY184898 [0,1,0,1,0,0|2,0,0]=4 426 B14R2.20 OC1=CC(C2=CC=C(Br)C=C2)=NO1 SY058547 [0,1,0,1,0,0|1,0,1]=4 427 B14R2.20 OC1=CC(C2=CC=C(Cl)C=C2)=NO1 SY122695 [0,1,0,1,0,0|1,0,1]=4 428 B14R2.20 OC1=CC(C2=CC=C(F)C=C2)=NO1 SY122691 [0,1,0,1,0,0|1,0,1]=4 429 B14R2.20 OC1=CC(C2=CC=C(I)C=C2)=NO1 SY122708 [0,1,0,1,0,0|1,0,1]=4 430 B14R2.134 COC1=CC2=C(C=C1)C=NC(Cl)=C2 SY221785 [0,1,0,1,0,0|2,0,0]=4 431 B14R2.134 COC1=CC2=CC(Br)=CC=C2C=C1 SY027765 [0,1,0,1,0,0|1,0,0]=3 432 B14R2.134 COC1=CC2=CC(N)=CC=C2N=C1 SY265402 [0,1,0,1,0,0|2,0,0]=4 433 B14R2.134 COC1=CC2=CC(O)=CC=C2C=C1 SY063965 [0,1,0,1,0,0|1,0,0]=3 434 B14R2.134 COC1=CC=C2C=CC(C)=CC2=C1 SY027767 [0,1,0,1,0,0|1,0,0]=3 435 B14R2.134 COC1=CC=C2C=CC(C)=NC2=C1 SY037169 [0,1,0,1,0,0|2,0,0]=4 436 B14R2.134 COC1=CC=C2N=CC(N)=CC2=C1 SY240305 [0,1,0,1,0,0|2,0,0]=4 437 B14R2.134 COC1=NC2=CC(N)=CC=C2C=C1 SY121191 [0,1,0,1,0,0|1,0,0]=3 438 B14R2.4513 CN1C(=O)C=CC2=C1N=C(Cl)C=C2 SY036003 [0,1,0,1,0,0|2,0,0]=4 439 B14R2.4513 CN1C(=O)C=CC2=C1N=C(N)C=C2 SY039064 [0,1,0,1,0,0|2,0,0]=4 440 B14R2.22 CC1=CC(C2=NOC(N)=C2)=CC=C1 SY084730 [0,1,0,1,0,0|2,0,0]=4 441 B14R2.22 NC1=CC(C2=CC=CC(Br)=C2)=NO1 SY012484 [0,1,0,1,0,0|2,0,0]=4 442 B14R2.22 NC1=CC(C2=CC=CC(Cl)=C2)=NO1 SY012483 [0,1,0,1,0,0|2,0,0]=4 443 B14R2.22 NC1=CC(C2=CC=CC(F)=C2)=NO1 SY012488 [0,1,0,1,0,0|2,0,0]=4 444 B14R2.22 NC1=CC(C2=CC=CC(I)=C2)=NO1 SY280445 [0,1,0,1,0,0|2,0,0]=4 445 B14R2.22 OC1=CC(C2=CC=CC(Br)=C2)=NO1 SY122697 [0,1,0,1,0,0|1,0,1]=4 446 B14R2.22 OC1=CC(C2=CC=CC(Cl)=C2)=NO1 SY122694 [0,1,0,1,0,0|1,0,1]=4 447 B14R2.22 OC1=CC(C2=CC=CC(F)=C2)=NO1 SY122692 [0,1,0,1,0,0|1,0,1]=4 448 B14R2.142 COC1=CC2=C(Br)C=CC=C2N=C1 SY248854 [0,1,0,1,0,0|2,0,0]=4 449 B14R2.142 COC1=CC2=C(N)C=CC=C2N=C1 SY271600 [0,1,0,1,0,0|2,0,0]=4 450 B14R2.142 COC1=CC=C2N=CC=C(Br)C2=C1 SY101760 [0,1,0,1,0,0|2,0,0]=4 451 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=C1 SY003956 [0,1,0,1,0,0|2,0,0]=4 452 B14R2.142 COC1=NC2=C(Cl)C=CN=C2C=C1 SY104955 [0,1,0,1,0,0|2,0,0]=4 453 B14R2.2332 COC1=CC2=C(C=C1)C=C(Br)C=C2 SY011231 [0,1,0,1,0,0|1,0,0]=3 454 B14R2.2332 COC1=CC2=C(C=C1)C=C(Cl)N=C2 SY262988 [0,1,0,1,0,0|2,0,0]=4 455 B14R2.2332 COC1=CC2=C(C=N1)C=C(Br)C=C2 SY068119 [0,1,0,1,0,0|2,0,0]=4 456 B14R2.2332 COC1=CC2=CC=C(O)C=C2C=C1 SY102105 [0,1,0,1,0,0|1,0,0]=3 457 B14R2.2332 COC1=CC=C2C=C(Br)C=NC2=C1 SY108754 [0,1,0,1,0,0|2,0,0]=4 458 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 SY101758 [0,1,0,1,0,0|2,0,0]=4 459 B14R2.2332 COC1=NC2=CC=C(Br)C=C2C=C1 SY065637 [0,1,0,1,0,0|1,0,0]=3 460 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 SY096670 [0,1,0,1,0,0|2,0,0]=4 461 B14R2.112 ClCOC1=CC2=C(C=CC=C2)C=C1 SY298507 [0,1,0,1,0,0|1,0,0]=3 462 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 SY183807 [0,1,0,1,0,0|2,0,0]=4 463 B14R2.112 NOCC1=CC=C2C=CC=CC2=C1 SY281750 [0,1,0,1,0,0|2,0,0]=4 464 B14R2.112 NOCC1=CC=C2C=CC=CC2=C1 SY281751 [0,1,0,1,0,0|2,0,0]=4 465 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 SY107549 [0,1,0,1,0,0|2,0,0]=4 466 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 SY049678 [0,1,0,1,0,0|0,0,1]=3 467 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 SY021058 [0,1,0,1,0,0|0,0,0]=2 468 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)S1 SY006828 [0,1,0,1,0,0|0,0,0]=2 469 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)N1 SY005381 [0,1,0,1,0,0|1,0,0]=3 470 B14R2.972 COC(=O)C1=CC2=CC=CC=C2O1 SY045665 [0,1,0,1,0,0|0,0,0]=2 471 B14R2.972 COC(=O)C1=CC2=CC=CN=C2S1 SY297120 [0,1,0,1,0,0|1,0,0]=3 472 B14R2.972 COC(=O)C1=CC2=NC=CC=C2N1 SY004470 [0,1,0,1,0,0|1,0,0]=3 473 B14R2.972 COC(=O)C1=CN2C=CC=CC2=C1 SY189942 [0,1,0,1,0,0|1,0,0]=3 474 B14R2.972 COC(=O)C1=CN2N=CC=CC2=C1 SY286054 [0,1,0,1,0,0|2,0,0]=4 475 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 SY013022 [0,1,0,1,0,0|1,0,0]=3 476 B14R2.972 COC(=O)C1=NN2C=CC=CC2=C1 SY008568 [0,1,0,1,0,0|1,0,0]=3 477 B14R2.972 COC(=O)C1CC2=C(C=CC=C2)C1 SY034832 [0,1,0,1,0,0|0,0,2]=4 478 B14R2.972 O=C(CO)C1=CC2=CC=CC=C2S1 SY131035 [0,1,0,1,0,0|2,0,0]=4 479 B14R2.1128 COC1=C(Br)C=C2C=CC=NC2=C1 SY260171 [0,1,0,1,0,0|2,0,0]=4 480 B14R2.1128 COC1=C(C)C=C2C=CC=NC2=C1 SY030009 [0,1,0,1,0,0|2,0,0]=4 481 B14R2.1128 COC1=C(N)C=C2C=CC=NC2=C1 SY244446 [0,1,0,1,0,0|2,0,0]=4 482 B14R2.781 C[C@@H](N)C1=CC=C2C=CC=CC2=C1 SY097369 [0,1,0,1,0,0|2,0,0]=4 483 B14R2.781 C[C@H](N)C1=CC=C2C=CC=CC2=C1 SY109489 [0,1,0,1,0,0|2,0,0]=4 484 B14R2.92 COC1=CC=C2C=CC=CC2=C1Br SY037749 [0,1,0,1,0,0|1,0,0]=3 485 B14R2.92 COC1=CC=C2C=CC=NC2=C1Br SY021165 [0,1,0,1,0,0|2,0,0]=4 486 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1Br SY052201 [0,1,0,1,0,0|2,0,0]=4 487 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1F SY038081 [0,1,0,1,0,0|2,0,0]=4 488 B14R2.256 CC1=CC=CC=C1C2=NOC(O)=C2 SY122706 [0,1,0,1,0,0|1,0,1]=4 489 B14R2.256 NC1=CC(C2=CC=CC=C2Br)=NO1 SY012490 [0,1,0,1,0,0|2,0,0]=4 490 B14R2.256 NC1=CC(C2=CC=CC=C2Cl)=NO1 SY012493 [0,1,0,1,0,0|2,0,0]=4 491 B14R2.256 NC1=CC(C2=CC=CC=C2I)=NO1 SY192216 [0,1,0,1,0,0|2,0,0]=4 492 B14R2.256 OC1=CC(C2=CC=CC=C2Br)=NO1 SY122698 [0,1,0,1,0,0|1,0,1]=4 493 B14R2.256 OC1=CC(C2=CC=CC=C2Cl)=NO1 SY122696 [0,1,0,1,0,0|1,0,1]=4 494 B14R2.256 OC1=CC(C2=CC=CC=C2F)=NO1 SY122693 [0,1,0,1,0,0|1,0,1]=4 495 B14R2.256 OC1=CC(C2=CC=CC=C2I)=NO1 SY122709 [0,1,0,1,0,0|1,0,1]=4 496 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=C2 SY030066 [0,1,0,1,0,0|2,0,0]=4 497 B14R2.1801 COC1=CC2=C(C=C1)C(Cl)=NC=C2 SY003965 [0,1,0,1,0,0|2,0,0]=4 498 B14R2.1801 COC1=CC2=CC=CC(O)=C2C=C1 SY102964 [0,1,0,1,0,0|1,0,0]=3 499 B14R2.1801 COC1=CC=C2C(C)=CC=NC2=C1 SY024005 [0,1,0,1,0,0|2,0,0]=4 500 B14R2.1801 COC1=CC=C2C(Cl)=CC=NC2=C1 SY003966 [0,1,0,1,0,0|2,0,0]=4 501 B14R2.1801 COC1=CC=C2C(N)=CC=NC2=C1 SY227414 [0,1,0,1,0,0|2,0,0]=4 502 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 SY004730 [0,1,0,1,0,0|2,0,0]=4 503 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 SY276702 [0,1,0,1,0,0|2,0,0]=4 504 B10R1.18 BrC(Br)=CC1=CC=CC=C1 SY022051 [1,0,0,0,1,0|2,0,0]=4 505 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [1,0,0,0,1,0|1,0,1]=4 506 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [1,0,0,0,1,0|1,0,1]=4 507 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [1,0,0,0,1,0|1,0,1]=4 508 B10R1.18 CC(C)=CC1=CC=CC=C1 SY055240 [1,0,0,0,1,0|1,0,0]=3 509 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [1,0,0,0,1,0|1,0,1]=4 510 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [1,0,0,0,1,0|2,0,0]=4 511 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [1,0,0,0,1,0|1,0,1]=4 512 B10R1.18 O=C(O)CC1=CC=NC=C1 SY003595 [1,0,0,0,1,0|1,0,1]=4 513 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [1,0,0,0,1,0|1,0,1]=4 514 B10R1.66 O=C(O)\C=C/C1=CC=CO1 SY056646 [1,0,0,0,1,0|1,0,0]=3 515 B10R1.66 O=C(O)\C=C\C1=CC=CO1 SY009542 [1,0,0,0,1,0|1,0,0]=3 516 B10R1.66 O=C(O)\C=C\C1=COC=C1 SY278590 [1,0,0,0,1,0|1,0,0]=3 517 B10R1.66 O=C(O)\C=C\C1=NC=CS1 SY041142 [1,0,0,0,1,0|2,0,0]=4 518 B10R1.27 COC(=O)CC1=CC=CS1 SY233030 [0,0,0,0,2,0|1,0,1]=4 519 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [0,0,0,0,2,0|2,0,0]=4 520 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [0,0,0,0,2,0|1,0,0]=3 521 B10R1.15 COC(=O)C1=CN=CC=N1 SY006191 [0,0,0,0,2,0|2,0,0]=4 522 B10R1.15 COC(=O)C1=CN=CN=C1 SY096988 [0,0,0,0,2,0|2,0,0]=4 523 B10R1.15 COC(=O)C1=CN=NC=C1 SY004472 [0,0,0,0,2,0|2,0,0]=4 524 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [0,0,0,0,2,0|1,0,0]=3 525 B10R1.15 COC(=O)C1=NC=CC=N1 SY006773 [0,0,0,0,2,0|2,0,0]=4 526 B10R1.15 COC(=O)C1=NC=NC=C1 SY019964 [0,0,0,0,2,0|2,0,0]=4 527 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [0,0,0,0,2,0|1,0,0]=3 528 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [0,0,0,0,2,0|2,0,0]=4 529 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [0,0,0,0,2,0|2,0,0]=4 530 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [0,0,0,0,2,0|2,0,0]=4