0 B14R2.781 BrC(Br)C1=CC=C2C=CC=CC2=C1 SY273535 [0,0,0,0,0,0|2,0,1]=3 1 B14R2.781 CC(=O)C1=CC2=C(C=C1)N=CC=C2 SY006186 [0,0,0,0,0,0|1,0,0]=1 2 B14R2.781 CC(=O)C1=CC2=C(C=C1)OCCO2 SY021598 [0,0,0,0,0,0|2,0,2]=4 3 B14R2.781 CC(=O)C1=CN=C2C=CC=CC2=C1 SY011820 [0,0,0,0,0,0|1,0,0]=1 4 B14R2.781 CC(=O)C1=NC2=C(C=CC=C2)N=C1 SY005383 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.781 CC(O)C1=CC=C2C=CC=NC2=C1 SY281517 [0,0,0,0,0,0|1,0,2]=3 6 B14R2.781 C[C@@H](N)C1=CC=C2C=CC=CC2=C1 SY097369 [0,0,0,0,0,0|1,0,1]=2 7 B14R2.781 C[C@H](N)C1=CC=C2C=CC=CC2=C1 SY109489 [0,0,0,0,0,0|1,0,1]=2 8 B14R2.781 FC(F)C1=CC2=CC=CC=C2N=C1 SY198514 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.781 FC(F)C1=CC=C2C=CC=CC2=C1 SY265766 [0,0,0,0,0,0|2,0,1]=3 10 B14R2.781 FC(F)C1=CC=C2N=CC=CC2=C1 SY265773 [0,0,0,0,0,0|3,0,1]=4 11 B14R2.781 FC(F)C1=NC2=CC=CC=C2C=C1 SY265869 [0,0,0,0,0,0|3,0,1]=4 12 B14R2.781 NC(=O)C1=CC=C2C=CC=CC2=C1 SY109446 [0,0,0,0,0,0|1,0,0]=1 13 B14R2.781 NC(=O)C1=CC=C2N=CC=CC2=C1 SY024514 [0,0,0,0,0,0|2,0,0]=2 14 B14R2.781 NC(=O)C1=NC2=CC=CC=C2N=C1 SY032750 [0,0,0,0,0,0|3,0,0]=3 15 B14R2.781 O=C(O)C1=CC2=C(C=C1)C=NC=C2 SY005145 [0,0,0,0,0,0|2,0,0]=2 16 B14R2.781 O=C(O)C1=CC2=C(C=C1)N=CC=N2 SY004481 [0,0,0,0,0,0|3,0,0]=3 17 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)C=N1 SY048006 [0,0,0,0,0,0|2,0,0]=2 18 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)N=C1 SY004162 [0,0,0,0,0,0|2,0,0]=2 19 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=C1 SY003115 [0,0,0,0,0,0|2,0,0]=2 20 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 SY001304 [0,0,0,0,0,0|2,0,0]=2 21 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 SY002404 [0,0,0,0,0,0|3,0,0]=3 22 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 SY112327 [0,0,0,0,0,0|3,0,0]=3 23 B14R2.781 O=C(O)C1=NC=C2C=CC=CC2=C1 SY014652 [0,0,0,0,0,0|2,0,0]=2 24 B14R2.781 O=C(O)C1=NC=C2C=CC=CC2=N1 SY029484 [0,0,0,0,0,0|3,0,0]=3 25 B14R2.781 O=[N+]([O-])C1=CC2=C(C=C1)N=CC=C2 SY008973 [0,0,0,0,0,0|3,0,0]=3 26 B14R2.781 O=[N+]([O-])C1=CC2=NC=CC=C2C=C1 SY009016 [0,0,0,0,0,0|3,0,0]=3 27 B14R2.781 O=[N+]([O-])C1=CC=C2N=CC=NC2=C1 SY007246 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.781 OB(O)C1=CC2=C(C=C1)C=NC=C2 SY026421 [0,0,0,0,0,0|3,0,1]=4 29 B14R2.781 OB(O)C1=CC2=CC=CC=C2N=C1 SY004117 [0,0,0,0,0,0|3,0,1]=4 30 B14R2.781 OB(O)C1=CC=C2C=CC=CC2=C1 SY004747 [0,0,0,0,0,0|2,0,1]=3 31 B14R2.781 OB(O)C1=CC=C2C=CC=NC2=C1 SY047216 [0,0,0,0,0,0|3,0,1]=4 32 B14R2.781 OB(O)C1=CC=C2N=CC=CC2=C1 SY022324 [0,0,0,0,0,0|3,0,1]=4 33 B13R2.57 BrCC1=CC=C2N=CC=CC2=C1 SY117281 [1,0,0,0,0,0|2,0,1]=4 34 B13R2.57 BrCC1=NC2=C(C=CC=C2)C=C1 SY018619 [1,0,0,0,0,0|2,0,1]=4 35 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 SY050708 [1,0,0,0,0,0|0,0,2]=3 36 B13R2.57 C1=C2C=CC=CC2=CC=C1OC SY246289 [1,0,0,0,0,0|1,0,0]=2 37 B13R2.57 C1=CC2=CC=C(OC)C=C2C=C1 SY246288 [1,0,0,0,0,0|1,0,0]=2 38 B13R2.57 C=CC1=CC=C2C=CC=CC2=C1 SY106378 [1,0,0,0,0,0|0,0,1]=2 39 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 SY013880 [1,0,0,0,0,0|2,0,0]=3 40 B13R2.57 COC1=CC2=C(C=C1)N=CC=C2 SY012831 [1,0,0,0,0,0|2,0,0]=3 41 B13R2.57 COC1=CC2=C(C=CN=C2)C=C1 SY021161 [1,0,0,0,0,0|2,0,0]=3 42 B13R2.57 COC1=CC2=CC=CC=C2N=C1 SY021113 [1,0,0,0,0,0|2,0,0]=3 43 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021166 [1,0,0,0,0,0|2,0,0]=3 44 B13R2.57 COC1=CC=C2C=CC=NC2=C1 SY021167 [1,0,0,0,0,0|2,0,0]=3 45 B13R2.57 COC1=NC2=CC=CC=C2C=C1 SY034140 [1,0,0,0,0,0|2,0,0]=3 46 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 SY018308 [1,0,0,0,0,0|2,0,1]=4 47 B13R2.57 N#CC1=CC2=C(C=C1)C=NC=C2 SY005144 [1,0,0,0,0,0|2,0,1]=4 48 B13R2.57 N#CC1=CC2=C(C=CC=C2)C=N1 SY062299 [1,0,0,0,0,0|2,0,1]=4 49 B13R2.57 N#CC1=CC=C2C=CC=CC2=C1 SY049690 [1,0,0,0,0,0|1,0,1]=3 50 B13R2.57 N#CC1=CC=C2N=CC=CC2=C1 SY024166 [1,0,0,0,0,0|2,0,1]=4 51 B13R2.57 NCC1=CC2=C(C=C1)N=CC=C2 SY003390 [1,0,0,0,0,0|2,0,1]=4 52 B13R2.57 NCC1=CC2=C(C=CC=C2)C=N1 SY035476 [1,0,0,0,0,0|2,0,1]=4 53 B13R2.57 NCC1=CC2=CC=CN=C2C=C1 SY006419 [1,0,0,0,0,0|2,0,1]=4 54 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY023509 [1,0,0,0,0,0|1,0,1]=3 55 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 SY032005 [1,0,0,0,0,0|1,0,1]=3 56 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 SY034716 [1,0,0,0,0,0|2,0,1]=4 57 B13R2.57 NNC1=CC=C2C=CC=CC2=C1 SY047024 [1,0,0,0,0,0|2,0,0]=3 58 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 SY049526 [1,0,0,0,0,0|3,0,0]=4 59 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282520 [1,0,0,0,0,0|3,0,0]=4 60 B13R2.57 NOC1=CC2=CC=CC=C2N=C1 SY282521 [1,0,0,0,0,0|3,0,0]=4 61 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282068 [1,0,0,0,0,0|2,0,0]=3 62 B13R2.57 NOC1=CC=C2C=CC=CC2=C1 SY282069 [1,0,0,0,0,0|2,0,0]=3 63 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282276 [1,0,0,0,0,0|3,0,0]=4 64 B13R2.57 NOC1=CC=C2N=CC=CC2=C1 SY282277 [1,0,0,0,0,0|3,0,0]=4 65 B13R2.57 O=CC1=CC2=CC=CC=C2N=C1 SY002981 [1,0,0,0,0,0|1,0,0]=2 66 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 SY006068 [1,0,0,0,0,0|1,0,0]=2 67 B13R2.57 O=CC1=CC2=CN=CN=C2C=C1 SY277662 [1,0,0,0,0,0|2,0,0]=3 68 B13R2.57 O=CC1=CC=C2C=CC=NC2=C1 SY050688 [1,0,0,0,0,0|1,0,0]=2 69 B13R2.57 O=CC1=CC=C2N=CC=NC2=C1 SY042757 [1,0,0,0,0,0|2,0,0]=3 70 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 SY019180 [1,0,0,0,0,0|1,0,0]=2 71 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 SY021110 [1,0,0,0,0,0|0,0,2]=3 72 B13R2.57 OCC1=CC=C2N=CC=CC2=C1 SY003114 [1,0,0,0,0,0|1,0,2]=4 73 B15R2.627 FC(F)C1=CC=C2C=CC=CC2=C1Br SY265988 [0,1,0,0,0,0|2,0,1]=4 74 B15R2.627 NC1=C2C=CC=CC2=CC=C1C(=O)O SY027705 [0,1,0,0,0,0|1,0,0]=2 75 B15R2.627 NC1=C2C=CC=CC2=CC=C1[N+](=O)[O-] SY129316 [0,1,0,0,0,0|2,0,0]=3 76 B15R2.627 O=C(O)C1=C(O)C2=C(C=CC=C2)C=C1 SY007524 [0,1,0,0,0,0|1,0,0]=2 77 B15R2.627 O=C(O)C1=C(O)C2=C(C=CC=C2)N=C1 SY003660 [0,1,0,0,0,0|2,0,0]=3 78 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2N=C1 SY058533 [0,1,0,0,0,0|3,0,0]=4 79 B15R2.627 O=C(O)C1=CC=C2C=CC=CC2=C1Br SY036940 [0,1,0,0,0,0|1,0,0]=2 80 B15R2.627 O=C(O)C1=CNC2=C(C=CC=C2)C1=O SY028229 [0,1,0,0,0,0|2,0,0]=3 81 B15R2.627 O=[N+]([O-])C1=C(Cl)C2=CC=CC=C2N=C1 SY027642 [0,1,0,0,0,0|3,0,0]=4 82 B15R2.627 O=[N+]([O-])C1=C(O)C2=CC=CC=C2N=C1 SY040660 [0,1,0,0,0,0|3,0,0]=4 83 B15R2.627 O=[N+]([O-])C1=CC=C2C=CC=CC2=C1Br SY096837 [0,1,0,0,0,0|2,0,0]=3 84 B15R2.984 NC1=C(C(=O)O)C=C2C=CC=CC2=C1 SY049342 [0,1,0,0,0,0|1,0,0]=2 85 B15R2.984 NC1=NC2=CC=CC=C2C=C1C(=O)O SY041506 [0,1,0,0,0,0|2,0,0]=3 86 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1Cl SY034199 [0,1,0,0,0,0|2,0,0]=3 87 B15R2.984 O=C(O)C1=CC2=CC=CC=C2N=C1O SY033881 [0,1,0,0,0,0|2,0,0]=3 88 B15R2.984 O=[N+]([O-])C1=CC2=CC=CC=C2N=C1Cl SY161874 [0,1,0,0,0,0|3,0,0]=4 89 B15R2.1601 C#CC(O)C1=CC2=CC=CC=C2C=C1 SY009897 [0,1,0,0,0,0|0,0,3]=4 90 B15R2.1601 COC(=O)C1=CC2=C(C=C1)C=NC=C2 SY022491 [0,1,0,0,0,0|1,0,0]=2 91 B15R2.1601 COC(=O)C1=CC2=C(C=C1)N=CC=N2 SY005841 [0,1,0,0,0,0|2,0,0]=3 92 B15R2.1601 COC(=O)C1=CC2=C(C=CC=C2)C=N1 SY018429 [0,1,0,0,0,0|1,0,0]=2 93 B15R2.1601 COC(=O)C1=CC=C2C=CC=CC2=C1 SY078684 [0,1,0,0,0,0|0,0,0]=1 94 B15R2.1601 COC(=O)C1=CC=C2N=CC=CC2=C1 SY003113 [0,1,0,0,0,0|1,0,0]=2 95 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2N=C1 SY032313 [0,1,0,0,0,0|2,0,0]=3 96 B15R2.1601 N[C@@H](CO)C1=CC=C2C=CC=CC2=C1 SY275061 [0,1,0,0,0,0|1,0,1]=3 97 B15R2.4441 F[B-](F)(F)C1=CC=C2C=CC=CC2=C1 SY225966 [0,1,0,0,0,0|3,0,0]=4 98 B15R2.4441 NS(=O)(=O)C1=CC=C2C=CC=CC2=C1 SY238127 [0,1,0,0,0,0|2,0,0]=3 99 B15R2.4441 O=S(=O)(Cl)C1=CC2=C(C=C1)C=NC=C2 SY293346 [0,1,0,0,0,0|3,0,0]=4 100 B15R2.4441 O=S(=O)([O-])C1=CC2=C(C=CC=C2)C=C1 SY005670 [0,1,0,0,0,0|2,0,0]=3 101 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Br)=C2)C=N1 SY102262 [0,1,0,0,0,0|2,0,0]=3 102 B15R2.7174 O=C(O)C1=CC2=CC(Br)=CC=C2N=C1 SY104185 [0,1,0,0,0,0|2,0,0]=3 103 B15R2.7174 O=C(O)C1=CC2=CC(Cl)=CC=C2N=C1 SY046768 [0,1,0,0,0,0|2,0,0]=3 104 B15R2.7174 O=C(O)C1=CC2=CC(F)=CC=C2N=C1 SY143804 [0,1,0,0,0,0|2,0,0]=3 105 B15R2.7174 O=C(O)C1=NC2=CC(Br)=CC=C2C=C1 SY102273 [0,1,0,0,0,0|2,0,0]=3 106 B15R2.7174 O=[N+]([O-])C1=CC=C2N=CC(Br)=CC2=C1 SY105848 [0,1,0,0,0,0|3,0,0]=4 107 B15R2.7180 CC1=CC=C2C=C(C(=O)O)C=CC2=N1 SY015613 [0,1,0,0,0,0|2,0,0]=3 108 B15R2.7180 CC1=NC2=CC=C(N(C)C)C=C2C=C1 SY045955 [0,1,0,0,0,0|3,0,0]=4 109 B15R2.7180 CC1=NC2=CC=C([N+](=O)[O-])C=C2C=C1 SY020324 [0,1,0,0,0,0|3,0,0]=4 110 B15R2.7180 CN(C)C1=CC=C2C=C(Br)C=CC2=C1 SY206053 [0,1,0,0,0,0|2,0,0]=3 111 B15R2.7180 NC(=O)C1=CC=C2C=C(Br)C=CC2=C1 SY259442 [0,1,0,0,0,0|1,0,0]=2 112 B15R2.7180 NC(=O)C1=CC=C2C=C(Br)C=NC2=C1 SY268188 [0,1,0,0,0,0|2,0,0]=3 113 B15R2.7180 NC1=CC2=CC=C(C(=O)O)C=C2C=C1 SY050552 [0,1,0,0,0,0|1,0,0]=2 114 B15R2.7180 O=C(Cl)C1=CC=C2C=C(Br)C=CC2=C1 SY284172 [0,1,0,0,0,0|1,0,0]=2 115 B15R2.7180 O=C(O)C1=CC2=C(C=C1)C=C(Br)C=C2 SY008220 [0,1,0,0,0,0|1,0,0]=2 116 B15R2.7180 O=C(O)C1=CC2=C(C=C1)C=C(O)C=C2 SY014339 [0,1,0,0,0,0|1,0,0]=2 117 B15R2.7180 O=C(O)C1=CC2=CC=C(Cl)C=C2N=C1 SY128742 [0,1,0,0,0,0|2,0,0]=3 118 B15R2.7180 O=C(O)C1=CC2=CC=C(F)C=C2N=C1 SY227469 [0,1,0,0,0,0|2,0,0]=3 119 B15R2.7180 O=C(O)C1=NC2=CC=C(Br)C=C2C=C1 SY027677 [0,1,0,0,0,0|2,0,0]=3 120 B15R2.7180 O=C1C=CC2=C(C=CC([N+](=O)[O-])=C2)N1 SY042302 [0,1,0,0,0,0|3,0,0]=4 121 B15R2.7180 O=[N+]([O-])C1=CC2=CC=C(O)C=C2C=C1 SY295786 [0,1,0,0,0,0|2,0,0]=3 122 B15R2.7180 OB(O)C1=CC=C2C=C(O)C=CC2=C1 SY021651 [0,1,0,0,0,0|2,0,1]=4 123 B15R2.13598 CC(C)C1=CC2=C(C=C1)C(Cl)=NC=C2 SY047970 [0,1,0,0,0,0|2,0,1]=4 124 B15R2.13598 NC1=C2C=CC(C(=O)O)=CC2=CC=C1 SY273203 [0,1,0,0,0,0|1,0,0]=2 125 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(=O)NC=N2 SY086879 [0,1,0,0,0,0|3,0,0]=4 126 B15R2.13598 O=C(O)C1=CC2=CC=CC(F)=C2N=C1 SY157955 [0,1,0,0,0,0|2,0,0]=3 127 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=CC2=C1 SY104513 [0,1,0,0,0,0|1,0,0]=2 128 B15R2.13598 O=C(O)C1=CC=C2C(O)=CC=CC2=C1 SY282882 [0,1,0,0,0,0|1,0,0]=2 129 B15R2.14951 CC(=O)N1CC(=O)C2=C(C=CC=C2)C1 SY250101 [0,1,0,0,0,0|1,0,2]=4 130 B15R2.14951 CN1C=C(C(=O)O)CC2=C1C=CC=C2 SY277943 [0,1,0,0,0,0|2,0,1]=4 131 B15R2.14951 NC(=O)C1=NC(O)=C2C=CC=CC2=N1 SY290049 [0,1,0,0,0,0|3,0,0]=4 132 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)O1 SY005480 [0,1,0,0,0,0|2,0,0]=3 133 B15R2.14951 O=C(O)C1=CC(Br)=C2C=CC=NC2=C1 SY271559 [0,1,0,0,0,0|2,0,0]=3 134 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(=O)N1 SY029385 [0,1,0,0,0,0|2,0,0]=3 135 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(=O)O1 SY045104 [0,1,0,0,0,0|2,0,0]=3 136 B15R2.14951 O=C(O)C1=NC2=C(C=CC=C2)C(=O)N1 SY005079 [0,1,0,0,0,0|3,0,0]=4 137 B15R2.61353 CC1=C2C=C(C(=O)O)C=NC2=CC=C1 SY266685 [0,1,0,0,0,0|2,0,0]=3 138 B15R2.61353 NC1=C2C=C(C(=O)O)C=CC2=CC=C1 SY273202 [0,1,0,0,0,0|1,0,0]=2 139 B15R2.61353 O=C(O)C1=CC2=C(Br)C=CC=C2N=C1 SY241185 [0,1,0,0,0,0|2,0,0]=3 140 B15R2.61353 O=C(O)C1=CC2=C(C=C1)N=CNC2=O SY020062 [0,1,0,0,0,0|3,0,0]=4 141 B15R2.61353 O=C(O)C1=CC2=C(Cl)C=CC=C2N=C1 SY241164 [0,1,0,0,0,0|2,0,0]=3 142 B15R2.61353 O=C(O)C1=CC2=C(F)C=CC=C2N=C1 SY266680 [0,1,0,0,0,0|2,0,0]=3 143 B15R2.61353 O=[N+]([O-])C1=CC=C2N=CC=C(O)C2=C1 SY033819 [0,1,0,0,0,0|3,0,0]=4 144 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 SY020108 [0,0,1,0,0,0|3,0,0]=4 145 B13R1.74 O=CC=CC1=CC=C([N+](=O)[O-])C=C1 SY026867 [0,0,1,0,0,0|3,0,0]=4 146 B13R1.3091 C=CC1=CC(C(C)=O)=CC=C1CO SY249417 [0,0,1,0,0,0|1,0,1]=3 147 B15R3.31603 C1=CC2=C(C=CC(C3CC3)=C2)C=N1 SY263874 [0,0,0,1,0,0|2,0,1]=4 148 B15R3.31603 C1=CC2=CC(C3CC3)=CC=C2N=C1 SY263877 [0,0,0,1,0,0|2,0,1]=4 149 B15R3.31603 C1=CC2=CC=C(C3CC3)C=C2C=C1 SY263865 [0,0,0,1,0,0|1,0,1]=3 150 B15R3.31603 C1=CC2=CC=C(C3CC3)C=C2N=C1 SY264001 [0,0,0,1,0,0|2,0,1]=4 151 B15R3.31603 C1=CC=C2N=C(C3CC3)C=CC2=C1 SY264177 [0,0,0,1,0,0|2,0,1]=4 152 B13R2.72 CC(=O)C1=CN=C2C=CC=CN12 SY108207 [0,0,0,0,1,0|2,0,0]=3 153 B13R2.72 CC(=O)C1=CNC2=C1C=CC=C2 SY003989 [0,0,0,0,1,0|1,0,0]=2 154 B13R2.72 CC(=O)C1=CNC2=C1C=CC=N2 SY067107 [0,0,0,0,1,0|2,0,0]=3 155 B13R2.72 CC(=O)N1N=CC2=CC=NC=C21 SY008015 [0,0,0,0,1,0|3,0,0]=4 156 B13R2.72 NC(=O)C1=COC2=CC=CC=C21 SY040045 [0,0,0,0,1,0|2,0,0]=3 157 B13R2.72 NC(=O)C1=NNC2=C1C=CC=C2 SY032797 [0,0,0,0,1,0|3,0,0]=4 158 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 SY025360 [0,0,0,0,1,0|3,0,0]=4 159 B13R2.72 O=C(O)C1=CN=C2C=CC=CN12 SY004048 [0,0,0,0,1,0|3,0,0]=4 160 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 SY004104 [0,0,0,0,1,0|2,0,0]=3 161 B13R2.72 O=C(O)C1=CNC2=C1C=CC=N2 SY013957 [0,0,0,0,1,0|3,0,0]=4 162 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 SY021563 [0,0,0,0,1,0|2,0,0]=3 163 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 SY003148 [0,0,0,0,1,0|3,0,0]=4 164 B13R2.72 O=[N+]([O-])C1=CNC2=C1C=CC=C2 SY244788 [0,0,0,0,1,0|3,0,0]=4 165 B13R2.430 CC(=O)C1=CC2=C(C=C1)CCC2 SY048885 [0,0,0,0,1,0|0,0,3]=4 166 B13R2.430 CC(=O)C1=CC2=C(C=C1)NCC2 SY079649 [0,0,0,0,1,0|1,0,2]=4 167 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCC2 SY003967 [0,0,0,0,1,0|1,0,2]=4 168 B13R2.430 CC(=O)C1=CC=C2OCOC2=C1 SY048504 [0,0,0,0,1,0|2,0,1]=4 169 B13R2.430 O=C(O)C1=CC2=C(C=C1)C=NO2 SY263552 [0,0,0,0,1,0|3,0,0]=4 170 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 SY004023 [0,0,0,0,1,0|2,0,0]=3 171 B13R2.430 O=C(O)C1=CC2=CC=NN2C=C1 SY069193 [0,0,0,0,1,0|3,0,0]=4 172 B13R2.430 O=C(O)C1=CC2=CN=CN2C=C1 SY105104 [0,0,0,0,1,0|3,0,0]=4 173 B13R2.430 O=C(O)C1=CC2=NC=CN2C=C1 SY016704 [0,0,0,0,1,0|3,0,0]=4 174 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 SY004025 [0,0,0,0,1,0|2,0,0]=3 175 B13R2.430 O=C(O)C1=CC=C2C=COC2=C1 SY046615 [0,0,0,0,1,0|2,0,0]=3 176 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 SY003903 [0,0,0,0,1,0|3,0,0]=4 177 B13R2.430 O=C(O)C1=CC=C2N=COC2=C1 SY018731 [0,0,0,0,1,0|3,0,0]=4 178 B13R2.430 O=C(O)C1=CC=C2N=CSC2=C1 SY006123 [0,0,0,0,1,0|3,0,0]=4 179 B13R2.430 O=C(O)C1=CC=C2NC=NC2=C1 SY002468 [0,0,0,0,1,0|3,0,0]=4 180 B13R2.430 O=C(O)C1=CC=C2NN=CC2=C1 SY003900 [0,0,0,0,1,0|3,0,0]=4 181 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 SY003675 [0,0,0,0,1,0|2,0,0]=3 182 B13R2.430 O=C(O)C1=CC=C2OC=NC2=C1 SY008172 [0,0,0,0,1,0|3,0,0]=4 183 B13R2.430 O=C(O)C1=CC=C2SC=NC2=C1 SY027147 [0,0,0,0,1,0|3,0,0]=4 184 B13R2.430 O=C(O)C1=CN2C=CN=C2C=C1 SY005596 [0,0,0,0,1,0|3,0,0]=4 185 B13R2.430 O=C(O)C1=CN=C2NC=CC2=C1 SY022609 [0,0,0,0,1,0|3,0,0]=4 186 B13R2.430 O=C(O)C1=NC2=C(C=CN2)C=C1 SY013959 [0,0,0,0,1,0|3,0,0]=4 187 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)NC=C2 SY006010 [0,0,0,0,1,0|3,0,0]=4 188 B13R2.430 O=[N+]([O-])C1=CC2=C(C=CN2)C=C1 SY003824 [0,0,0,0,1,0|3,0,0]=4 189 B13R2.430 O=[N+]([O-])C1=CC=C2SC=CC2=C1 SY042673 [0,0,0,0,1,0|3,0,0]=4 190 B13R2.435 CC(=O)C1=CC2=CC=CC=C2O1 SY045444 [0,0,0,0,1,0|1,0,0]=2 191 B13R2.435 CC(=O)C1=CC2=CC=CC=C2S1 SY001822 [0,0,0,0,1,0|1,0,0]=2 192 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 SY225211 [0,0,0,0,1,0|2,0,0]=3 193 B13R2.435 NC(=O)C1=NC2=CC=CC=C2N1 SY024481 [0,0,0,0,1,0|3,0,0]=4 194 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 SY024866 [0,0,0,0,1,0|1,0,1]=3 195 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 SY003715 [0,0,0,0,1,0|2,0,0]=3 196 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 SY005603 [0,0,0,0,1,0|2,0,0]=3 197 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 SY003106 [0,0,0,0,1,0|2,0,0]=3 198 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 SY016149 [0,0,0,0,1,0|3,0,0]=4 199 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 SY004412 [0,0,0,0,1,0|3,0,0]=4 200 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 SY004051 [0,0,0,0,1,0|3,0,0]=4 201 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 SY286053 [0,0,0,0,1,0|3,0,0]=4 202 B13R2.435 O=C(O)C1=NC2=CC=CC=C2S1 SY042596 [0,0,0,0,1,0|3,0,0]=4 203 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 SY004701 [0,0,0,0,1,0|3,0,0]=4 204 B15R2.1668 CC(=O)NC1=CC=C2C=CC=CC2=C1 SY292704 [0,0,0,0,0,1|0,0,0]=1 205 B15R2.1668 O=C(Cl)OC1=CC=C2C=CC=CC2=C1 SY052421 [0,0,0,0,0,1|1,0,0]=2 206 B15R2.1668 O=C(O)CC1=CC2=C(C=C1)N=CC=C2 SY003152 [0,0,0,0,0,1|2,0,0]=3 207 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=C1 SY005583 [0,0,0,0,0,1|1,0,0]=2 208 B12R1.113 C=CCC1=CC=C(C(N)=O)C=C1 SY236853 [1,0,1,0,0,0|1,0,1]=4 209 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 SY015112 [1,0,1,0,0,0|1,0,1]=4 210 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 SY009527 [1,0,1,0,0,0|2,0,0]=4 211 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl SY003739 [1,0,1,0,0,0|2,0,0]=4 212 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O SY048367 [1,0,1,0,0,0|2,0,0]=4 213 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 SY083558 [1,0,1,0,0,0|1,0,1]=4 214 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O SY006039 [1,0,1,0,0,0|1,0,1]=4 215 B12R1.279 C=CCC1=CC(C(N)=O)=CC=C1 SY232879 [1,0,1,0,0,0|1,0,1]=4 216 B12R1.382 C=CCOC1=CC(C=O)=CC=C1 SY025669 [1,0,1,0,0,0|1,0,1]=4 217 B12R2.24 BrC1=CC2=C(C=C1)C=NC=C2 SY004580 [2,0,0,0,0,0|2,0,0]=4 218 B12R2.24 BrC1=CC2=C(C=CC=C2)C=N1 SY009417 [2,0,0,0,0,0|2,0,0]=4 219 B12R2.24 BrC1=CC2=C(C=CN=C2)C=C1 SY014834 [2,0,0,0,0,0|2,0,0]=4 220 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 SY017164 [2,0,0,0,0,0|2,0,0]=4 221 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 SY004614 [2,0,0,0,0,0|2,0,0]=4 222 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 SY025844 [2,0,0,0,0,0|2,0,0]=4 223 B12R2.24 BrC1=NC2=C(C=CC=C2)C=C1 SY019854 [2,0,0,0,0,0|2,0,0]=4 224 B12R2.24 CC1=CC2=C(C=C1)N=CC=N2 SY017397 [2,0,0,0,0,0|2,0,0]=4 225 B12R2.24 CC1=CC2=CC=CC=C2N=C1 SY048469 [2,0,0,0,0,0|1,0,0]=3 226 B12R2.24 CC1=NC2=CC=CN=C2C=C1 SY098561 [2,0,0,0,0,0|2,0,0]=4 227 B12R2.24 CC1=NC2=NC=CC=C2C=C1 SY017550 [2,0,0,0,0,0|2,0,0]=4 228 B12R2.24 ClC1=CC2=C(C=CC=C2)C=N1 SY005184 [2,0,0,0,0,0|2,0,0]=4 229 B12R2.24 ClC1=CC2=C(C=CC=N2)C=C1 SY021162 [2,0,0,0,0,0|2,0,0]=4 230 B12R2.24 ClC1=CC2=C(C=CN=C2)C=C1 SY065588 [2,0,0,0,0,0|2,0,0]=4 231 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 SY021114 [2,0,0,0,0,0|2,0,0]=4 232 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 SY055345 [2,0,0,0,0,0|1,0,0]=3 233 B12R2.24 ClC1=CC=C2C=NC=CC2=C1 SY021135 [2,0,0,0,0,0|2,0,0]=4 234 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 SY021132 [2,0,0,0,0,0|2,0,0]=4 235 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 SY001152 [2,0,0,0,0,0|2,0,0]=4 236 B12R2.24 FC1=CC2=C(C=C1)N=CC=C2 SY004609 [2,0,0,0,0,0|2,0,0]=4 237 B12R2.24 FC1=CC2=CC=CC=C2N=C1 SY260141 [2,0,0,0,0,0|2,0,0]=4 238 B12R2.24 IC1=CC2=CC=CC=C2N=C1 SY191981 [2,0,0,0,0,0|2,0,0]=4 239 B12R2.24 IC1=CC=C2C=CC=CC2=C1 SY103936 [2,0,0,0,0,0|1,0,0]=3 240 B12R2.24 IC1=CC=C2N=CC=CC2=C1 SY030914 [2,0,0,0,0,0|2,0,0]=4 241 B12R2.24 NC1=CC2=C(C=C1)C=NC=C2 SY021134 [2,0,0,0,0,0|2,0,0]=4 242 B12R2.24 NC1=CC2=C(C=C1)N=CC=C2 SY021131 [2,0,0,0,0,0|2,0,0]=4 243 B12R2.24 NC1=CC2=C(C=CC=C2)C=N1 SY030951 [2,0,0,0,0,0|2,0,0]=4 244 B12R2.24 NC1=CC2=C(C=CC=N2)C=C1 SY021315 [2,0,0,0,0,0|2,0,0]=4 245 B12R2.24 NC1=CC2=C(C=CN=C2)C=C1 SY020017 [2,0,0,0,0,0|2,0,0]=4 246 B12R2.24 NC1=CC=C2C=CC=NC2=C1 SY021164 [2,0,0,0,0,0|2,0,0]=4 247 B12R2.24 O=C1C=CC2=C(C=CN=C2)N1 SY129309 [2,0,0,0,0,0|2,0,0]=4 248 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 SY241058 [2,0,0,0,0,0|2,0,0]=4 249 B12R2.24 OC1=CC2=C(C=C1)C=NC=C2 SY020019 [2,0,0,0,0,0|1,0,1]=4 250 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 SY009024 [2,0,0,0,0,0|1,0,1]=4 251 B12R2.24 OC1=CC2=CC=CC=C2C=N1 SY005563 [2,0,0,0,0,0|1,0,1]=4 252 B12R2.24 OC1=CC=C2C=CC=NC2=C1 SY025837 [2,0,0,0,0,0|1,0,1]=4 253 B12R2.24 OC1=CC=C2C=CN=CC2=C1 SY020018 [2,0,0,0,0,0|1,0,1]=4 254 B12R2.24 OC1=CC=C2N=CC=CC2=C1 SY003116 [2,0,0,0,0,0|1,0,1]=4 255 B12R2.24 OC1=NC2=C(C=CC=C2)C=C1 SY003693 [2,0,0,0,0,0|1,0,1]=4 256 B12R2.24 [O-][N+]1=CC=C2C=CC=CC2=C1 SY024667 [2,0,0,0,0,0|1,0,1]=4 257 B14R1.1031 COC(=O)\C(C#N)=C\C1=CC=CC=C1 SY014783 [0,1,1,0,0,0|1,0,1]=4 258 B14R2.92 COC1=CC=C2C=CC=CC2=C1Br SY037749 [1,1,0,0,0,0|1,0,0]=3 259 B14R2.92 COC1=CC=C2C=CC=NC2=C1Br SY021165 [1,1,0,0,0,0|2,0,0]=4 260 B14R2.92 N#CC1=CC=C2C=CC=CC2=C1N SY109208 [1,1,0,0,0,0|1,0,1]=4 261 B14R2.92 NC1=C2C=CC=CC2=CC=C1CO SY129214 [1,1,0,0,0,0|0,0,2]=4 262 B14R2.92 O=CC1=C(Cl)C2=C(C=CC=C2)CC1 SY264195 [1,1,0,0,0,0|0,0,2]=4 263 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1Br SY052201 [1,1,0,0,0,0|0,0,0]=2 264 B14R2.92 O=CC1=CC=C2C=CC=CC2=C1F SY038081 [1,1,0,0,0,0|0,0,0]=2 265 B14R2.92 O=CC1=COC2=C(C=CC=C2)C1=O SY048640 [1,1,0,0,0,0|1,0,0]=3 266 B14R2.112 CNCC1=CC2=CC=CN=C2C=C1 SY004184 [1,1,0,0,0,0|1,0,1]=4 267 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 SY096670 [1,1,0,0,0,0|0,0,1]=3 268 B14R2.112 ClCOC1=CC2=C(C=CC=C2)C=C1 SY298507 [1,1,0,0,0,0|1,0,0]=3 269 B14R2.112 N#CCC1=CC=C2C=CC=CC2=C1 SY015803 [1,1,0,0,0,0|0,0,2]=4 270 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 SY183807 [1,1,0,0,0,0|1,0,1]=4 271 B14R2.112 NNCC1=CC=C2C=CC=CC2=C1 SY048074 [1,1,0,0,0,0|1,0,1]=4 272 B14R2.112 NOCC1=CC=C2C=CC=CC2=C1 SY281750 [1,1,0,0,0,0|0,0,2]=4 273 B14R2.112 NOCC1=CC=C2C=CC=CC2=C1 SY281751 [1,1,0,0,0,0|0,0,2]=4 274 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 SY107549 [1,1,0,0,0,0|1,0,1]=4 275 B14R2.134 CC1=CC2=CC(C#N)=CC=C2C=C1 SY027160 [1,1,0,0,0,0|1,0,1]=4 276 B14R2.134 COC1=CC2=C(C=C1)C=NC(Cl)=C2 SY221785 [1,1,0,0,0,0|2,0,0]=4 277 B14R2.134 COC1=CC2=CC(Br)=CC=C2C=C1 SY027765 [1,1,0,0,0,0|1,0,0]=3 278 B14R2.134 COC1=CC2=CC(N)=CC=C2N=C1 SY265402 [1,1,0,0,0,0|2,0,0]=4 279 B14R2.134 COC1=CC2=CC(O)=CC=C2C=C1 SY063965 [1,1,0,0,0,0|1,0,0]=3 280 B14R2.134 COC1=CC=C2C=CC(C)=CC2=C1 SY027767 [1,1,0,0,0,0|1,0,0]=3 281 B14R2.134 COC1=CC=C2C=CC(C)=NC2=C1 SY037169 [1,1,0,0,0,0|2,0,0]=4 282 B14R2.134 COC1=CC=C2N=CC(N)=CC2=C1 SY240305 [1,1,0,0,0,0|2,0,0]=4 283 B14R2.134 COC1=NC2=CC(N)=CC=C2C=C1 SY121191 [1,1,0,0,0,0|2,0,0]=4 284 B14R2.142 COC1=CC2=C(Br)C=CC=C2N=C1 SY248854 [1,1,0,0,0,0|2,0,0]=4 285 B14R2.142 COC1=CC2=C(N)C=CC=C2N=C1 SY271600 [1,1,0,0,0,0|2,0,0]=4 286 B14R2.142 COC1=CC=C2N=CC=C(Br)C2=C1 SY101760 [1,1,0,0,0,0|2,0,0]=4 287 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=C1 SY003956 [1,1,0,0,0,0|2,0,0]=4 288 B14R2.142 O=CC1=CC=C2C=CC=C(O)C2=N1 SY011471 [1,1,0,0,0,0|1,0,0]=3 289 B14R2.1019 COC1=CC(Br)=C2C=CC=NC2=C1 SY253670 [1,1,0,0,0,0|2,0,0]=4 290 B14R2.1019 COC1=CC(Br)=C2N=CC=CC2=C1 SY265508 [1,1,0,0,0,0|2,0,0]=4 291 B14R2.1128 COC1=C(Br)C=C2C=CC=NC2=C1 SY260171 [1,1,0,0,0,0|2,0,0]=4 292 B14R2.1128 COC1=C(C)C=C2C=CC=NC2=C1 SY030009 [1,1,0,0,0,0|2,0,0]=4 293 B14R2.1128 COC1=C(N)C=C2C=CC=NC2=C1 SY244446 [1,1,0,0,0,0|2,0,0]=4 294 B14R2.1128 N#CC1=C(O)C=C2C=CC=CC2=C1 SY028476 [1,1,0,0,0,0|1,0,1]=4 295 B14R2.1128 NCC1=C(O)C=C2C=CC=CC2=C1 SY027128 [1,1,0,0,0,0|1,0,1]=4 296 B14R2.1128 O=CC1=C(F)C=C2C=CC=CC2=C1 SY275318 [1,1,0,0,0,0|0,0,0]=2 297 B14R2.1128 O=CC1=C(O)C=C2C=CC=CC2=C1 SY028654 [1,1,0,0,0,0|0,0,0]=2 298 B14R2.1128 O=CC1=NC2=CC=CC=C2C=C1Cl SY034207 [1,1,0,0,0,0|1,0,0]=3 299 B14R2.1128 O=CC1=NC2=CC=CC=C2N=C1Br SY034213 [1,1,0,0,0,0|2,0,0]=4 300 B14R2.1128 OCC1=C(F)C=C2C=CC=CC2=C1 SY280119 [1,1,0,0,0,0|0,0,2]=4 301 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=C2 SY030066 [1,1,0,0,0,0|2,0,0]=4 302 B14R2.1801 COC1=CC2=C(C=C1)C(Cl)=NC=C2 SY003965 [1,1,0,0,0,0|2,0,0]=4 303 B14R2.1801 COC1=CC2=CC=CC(O)=C2C=C1 SY102964 [1,1,0,0,0,0|1,0,0]=3 304 B14R2.1801 COC1=CC=C2C(C)=CC=NC2=C1 SY024005 [1,1,0,0,0,0|2,0,0]=4 305 B14R2.1801 COC1=CC=C2C(Cl)=CC=NC2=C1 SY003966 [1,1,0,0,0,0|2,0,0]=4 306 B14R2.1801 COC1=CC=C2C(N)=CC=NC2=C1 SY227414 [1,1,0,0,0,0|2,0,0]=4 307 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 SY004730 [1,1,0,0,0,0|2,0,0]=4 308 B14R2.1801 COC1=CC=C2C(O)=CC=NC2=C1 SY276702 [1,1,0,0,0,0|2,0,0]=4 309 B14R2.1801 FC1=C2C=CC(CBr)=CC2=CC=C1 SY274671 [1,1,0,0,0,0|1,0,1]=4 310 B14R2.1801 O=CC1=CC2=CC=NC(Cl)=C2N=C1 SY274999 [1,1,0,0,0,0|2,0,0]=4 311 B14R2.1801 O=CC1=CC=C2C(F)=CC=CC2=C1 SY274272 [1,1,0,0,0,0|0,0,0]=2 312 B14R2.2332 CC1=NC2=CC=C(C=O)C=C2C=C1 SY023405 [1,1,0,0,0,0|1,0,0]=3 313 B14R2.2332 COC1=CC2=C(C=C1)C=C(Br)C=C2 SY011231 [1,1,0,0,0,0|1,0,0]=3 314 B14R2.2332 COC1=CC2=C(C=C1)C=C(Cl)N=C2 SY262988 [1,1,0,0,0,0|2,0,0]=4 315 B14R2.2332 COC1=CC2=C(C=N1)C=C(Br)C=C2 SY068119 [1,1,0,0,0,0|2,0,0]=4 316 B14R2.2332 COC1=CC2=CC=C(O)C=C2C=C1 SY102105 [1,1,0,0,0,0|1,0,0]=3 317 B14R2.2332 COC1=CC=C2C=C(Br)C=NC2=C1 SY108754 [1,1,0,0,0,0|2,0,0]=4 318 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 SY101758 [1,1,0,0,0,0|2,0,0]=4 319 B14R2.2332 COC1=NC2=CC=C(Br)C=C2C=C1 SY065637 [1,1,0,0,0,0|2,0,0]=4 320 B14R2.2332 N#CC1=CC=C2C=C(Br)C=CC2=C1 SY243675 [1,1,0,0,0,0|1,0,1]=4 321 B14R2.2332 O=CC1=CC2=CC=C(O)C=C2C=C1 SY014307 [1,1,0,0,0,0|0,0,0]=2 322 B14R2.2332 O=CC1=CC=C2C=C(Br)C=CC2=C1 SY051412 [1,1,0,0,0,0|0,0,0]=2 323 B14R2.95 COC(=O)C1=CNC2=C1C=CC=C2 SY020043 [0,1,0,0,1,0|1,0,0]=3 324 B14R2.95 COC(=O)C1=CNC2=NC=CC=C12 SY042023 [0,1,0,0,1,0|2,0,0]=4 325 B14R2.95 COC(=O)C1=CSC2=C1C=CN=C2 SY068116 [0,1,0,0,1,0|2,0,0]=4 326 B14R2.95 COC(=O)C1=NNC2=C1C=CC=C2 SY032788 [0,1,0,0,1,0|2,0,0]=4 327 B14R2.95 O=C(CCl)N1C=CC2=C1C=CC=C2 SY250443 [0,1,0,0,1,0|1,0,0]=3 328 B14R2.95 O=C(CO)C1=CNC2=C1C=CC=C2 SY131003 [0,1,0,0,1,0|1,0,0]=3 329 B14R2.300 CC(=O)N1C=CC2=C1C=CC(N)=C2 SY031803 [0,1,0,0,1,0|1,0,0]=3 330 B14R2.300 CC(=O)N1N=CC2=C1C=CC(F)=C2 SY007199 [0,1,0,0,1,0|2,0,0]=4 331 B14R2.300 CC1=CC2=C(C=C1)C(C(=O)O)=CN2 SY058808 [0,1,0,0,1,0|2,0,0]=4 332 B14R2.300 O=C(O)C1=CNC2=C1C=CC(Br)=C2 SY030975 [0,1,0,0,1,0|2,0,0]=4 333 B14R2.300 O=C(O)C1=CNC2=C1C=CC(Cl)=C2 SY030199 [0,1,0,0,1,0|2,0,0]=4 334 B14R2.300 O=C(O)C1=CNC2=C1C=CC(F)=C2 SY058811 [0,1,0,0,1,0|2,0,0]=4 335 B14R2.5816 CC(=O)C1=CNC2=C1C=C(Br)C=C2 SY201499 [0,1,0,0,1,0|1,0,0]=3 336 B14R2.5816 CC1=CC2=C(C=C1)NC=C2C(=O)O SY046824 [0,1,0,0,1,0|2,0,0]=4 337 B14R2.5816 O=C(O)C1=CNC2=C1C=C(Br)C=C2 SY020530 [0,1,0,0,1,0|2,0,0]=4 338 B14R2.5816 O=C(O)C1=CNC2=C1C=C(Cl)C=C2 SY040069 [0,1,0,0,1,0|2,0,0]=4 339 B14R2.5816 O=C(O)C1=CNC2=C1C=C(F)C=C2 SY058805 [0,1,0,0,1,0|2,0,0]=4 340 B14R2.8032 CC(=O)N1N=CC2=C1C=CC=C2Br SY005435 [0,1,0,0,1,0|2,0,0]=4 341 B14R2.8032 CC1=CC=CC2=C1NC=C2C(=O)O SY058809 [0,1,0,0,1,0|2,0,0]=4 342 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Br SY023120 [0,1,0,0,1,0|2,0,0]=4 343 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Cl SY058802 [0,1,0,0,1,0|2,0,0]=4 344 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2F SY058815 [0,1,0,0,1,0|2,0,0]=4 345 B14R2.8053 CC1=CC=CC2=C1C(C(=O)O)=CN2 SY024473 [0,1,0,0,1,0|2,0,0]=4 346 B14R2.8053 NC1=CC=CC2=C1C(C(=O)O)=CN2 SY040834 [0,1,0,0,1,0|2,0,0]=4 347 B14R2.8053 O=C(O)C1=CNC2=C1C(Br)=CC=C2 SY058803 [0,1,0,0,1,0|2,0,0]=4 348 B14R2.8053 O=C(O)C1=CNC2=C1C(Cl)=CC=C2 SY029798 [0,1,0,0,1,0|2,0,0]=4 349 B14R2.8053 O=C(O)C1=CNC2=C1C(F)=CC=C2 SY046829 [0,1,0,0,1,0|2,0,0]=4 350 B14R2.25733 CC(=O)C1=CN(C)C2=C1C=CC=C2 SY033964 [0,1,0,0,1,0|1,0,0]=3 351 B14R2.25733 CC(=O)N1C=C(Br)C2=C1C=CC=C2 SY019754 [0,1,0,0,1,0|1,0,0]=3 352 B14R2.25733 CC(=O)N1CC(=O)C2=C1C=CC=C2 SY110099 [0,1,0,0,1,0|1,0,1]=4 353 B14R2.25733 CN1C=C(C(=O)O)C2=C1C=CC=C2 SY003132 [0,1,0,0,1,0|2,0,0]=4 354 B14R2.624 O=C(O)C1=CC2=C(C=CN2)C=C1Br SY300095 [0,1,0,0,1,0|2,0,0]=4 355 B14R2.624 O=C(O)C1=CC2=C(C=CN2)C=C1O SY293900 [0,1,0,0,1,0|2,0,0]=4 356 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 SY003617 [0,1,0,0,1,0|1,0,0]=3 357 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 SY282727 [0,1,0,0,1,0|1,0,0]=3 358 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=N2 SY007514 [0,1,0,0,1,0|2,0,0]=4 359 B14R2.966 COC(=O)C1=CC2=C(C=C1)OC=C2 SY004326 [0,1,0,0,1,0|1,0,0]=3 360 B14R2.966 COC(=O)C1=CC2=C(C=CN2)C=C1 SY002751 [0,1,0,0,1,0|1,0,0]=3 361 B14R2.966 COC(=O)C1=CC2=C(N=C1)NC=C2 SY033608 [0,1,0,0,1,0|2,0,0]=4 362 B14R2.966 COC(=O)C1=CC2=CC=CN2C=C1 SY027259 [0,1,0,0,1,0|1,0,0]=3 363 B14R2.966 COC(=O)C1=CC2=CC=NN2C=C1 SY070091 [0,1,0,0,1,0|2,0,0]=4 364 B14R2.966 COC(=O)C1=CC2=NC=CN2C=C1 SY060392 [0,1,0,0,1,0|2,0,0]=4 365 B14R2.966 COC(=O)C1=CC=C2C=CNC2=N1 SY097826 [0,1,0,0,1,0|2,0,0]=4 366 B14R2.966 COC(=O)C1=CC=C2C=COC2=C1 SY069050 [0,1,0,0,1,0|1,0,0]=3 367 B14R2.966 COC(=O)C1=CC=C2C=NNC2=C1 SY003902 [0,1,0,0,1,0|2,0,0]=4 368 B14R2.966 COC(=O)C1=CC=C2N=COC2=C1 SY022493 [0,1,0,0,1,0|2,0,0]=4 369 B14R2.966 COC(=O)C1=CC=C2NN=CC2=C1 SY003901 [0,1,0,0,1,0|2,0,0]=4 370 B14R2.966 COC(=O)C1=CC=C2OC=NC2=C1 SY022495 [0,1,0,0,1,0|2,0,0]=4 371 B14R2.966 COC(=O)C1=CN2C=CN=C2C=C1 SY005597 [0,1,0,0,1,0|2,0,0]=4 372 B14R2.966 O=C(CCl)C1=CC2=C(C=CN2)C=C1 SY278554 [0,1,0,0,1,0|1,0,0]=3 373 B14R2.5719 CN1C=CC2=C1C=CC(C(=O)O)=C2 SY022474 [0,1,0,0,1,0|2,0,0]=4 374 B14R2.5719 O=C(O)C1=CC2=C(C=C1)C(Cl)=CN2 SY294239 [0,1,0,0,1,0|2,0,0]=4 375 B14R2.5719 O=C(O)C1=CC=C2C(Br)=CNC2=C1 SY006248 [0,1,0,0,1,0|2,0,0]=4 376 B14R2.8824 O=C(O)C1=CC2=C(C=CN2)C(F)=C1 SY128754 [0,1,0,0,1,0|2,0,0]=4 377 B14R2.8824 O=C(O)C1=CC2=C(C=CN2)C(O)=C1 SY293899 [0,1,0,0,1,0|2,0,0]=4 378 B14R2.24358 CN1C=CC2=C1C=C(C(=O)O)C=C2 SY022482 [0,1,0,0,1,0|2,0,0]=4 379 B14R2.24358 O=C(O)C1=CC2=C(C=C1)NC=C2Br SY006247 [0,1,0,0,1,0|2,0,0]=4 380 B14R2.24358 O=C(O)C1=CC2=C(C=C1)NC=C2Cl SY294238 [0,1,0,0,1,0|2,0,0]=4 381 B14R2.450 CC(=O)N1SC2=CC=CC=C2C1=O SY293843 [0,1,0,0,1,0|2,0,0]=4 382 B14R2.450 CC1=C(C(=O)O)NC2=C1C=CC=C2 SY101248 [0,1,0,0,1,0|2,0,0]=4 383 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 SY050484 [0,1,0,0,1,0|2,0,0]=4 384 B14R2.450 O=C(O)C1=C(Br)C2=CC=CC=C2N1 SY006239 [0,1,0,0,1,0|2,0,0]=4 385 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)N1 SY021058 [0,1,0,0,1,0|1,0,0]=3 386 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)S1 SY006828 [0,1,0,0,1,0|1,0,0]=3 387 B14R2.972 COC(=O)C1=CC2=C(N=CC=C2)N1 SY005381 [0,1,0,0,1,0|2,0,0]=4 388 B14R2.972 COC(=O)C1=CC2=CC=CC=C2O1 SY045665 [0,1,0,0,1,0|1,0,0]=3 389 B14R2.972 COC(=O)C1=CC2=CC=CN=C2S1 SY297120 [0,1,0,0,1,0|2,0,0]=4 390 B14R2.972 COC(=O)C1=CC2=NC=CC=C2N1 SY004470 [0,1,0,0,1,0|2,0,0]=4 391 B14R2.972 COC(=O)C1=CN2C=CC=CC2=C1 SY189942 [0,1,0,0,1,0|1,0,0]=3 392 B14R2.972 COC(=O)C1=CN2N=CC=CC2=C1 SY286054 [0,1,0,0,1,0|2,0,0]=4 393 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 SY013022 [0,1,0,0,1,0|2,0,0]=4 394 B14R2.972 COC(=O)C1=NN2C=CC=CC2=C1 SY008568 [0,1,0,0,1,0|2,0,0]=4 395 B14R2.972 O=C(CO)C1=CC2=CC=CC=C2S1 SY131035 [0,1,0,0,1,0|1,0,0]=3 396 B14R2.4529 CC1=CC=C2C=C(C(=O)O)OC2=C1 SY045632 [0,1,0,0,1,0|2,0,0]=4 397 B14R2.4529 CC1=CC=C2OC(C(=O)O)=CC2=C1 SY045639 [0,1,0,0,1,0|2,0,0]=4 398 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Cl)=C2)N1 SY251599 [0,1,0,0,1,0|2,0,0]=4 399 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)N1 SY051129 [0,1,0,0,1,0|2,0,0]=4 400 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 SY041968 [0,1,0,0,1,0|2,0,0]=4 401 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)N1 SY101335 [0,1,0,0,1,0|2,0,0]=4 402 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 SY035588 [0,1,0,0,1,0|2,0,0]=4 403 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 SY004252 [0,1,0,0,1,0|2,0,0]=4 404 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 SY022888 [0,1,0,0,1,0|2,0,0]=4 405 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 SY104077 [0,1,0,0,1,0|2,0,0]=4 406 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2O1 SY049517 [0,1,0,0,1,0|2,0,0]=4 407 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2O1 SY045635 [0,1,0,0,1,0|2,0,0]=4 408 B14R2.4529 O=C(O)C1=CC2=CC(O)=CC=C2O1 SY019649 [0,1,0,0,1,0|2,0,0]=4 409 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 SY041971 [0,1,0,0,1,0|2,0,0]=4 410 B14R2.4529 O=C(O)C1=CC2=CC=C(O)C=C2O1 SY019648 [0,1,0,0,1,0|2,0,0]=4 411 B14R2.4529 O=C(O)C1=CN2C=C(O)C=CC2=C1 SY277699 [0,1,0,0,1,0|2,0,0]=4 412 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)N2 SY037268 [0,1,0,0,1,0|2,0,0]=4 413 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2O1 SY226910 [0,1,0,0,1,0|2,0,0]=4 414 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)N1 SY031913 [0,1,0,0,1,0|2,0,0]=4 415 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2F)N1 SY059457 [0,1,0,0,1,0|2,0,0]=4 416 B14R2.7969 O=C(O)C1=CC2=C(N1)C(Br)=CC=C2 SY110415 [0,1,0,0,1,0|2,0,0]=4 417 B14R2.7969 O=C(O)C1=CC2=C(O)C=CC=C2O1 SY285491 [0,1,0,0,1,0|2,0,0]=4 418 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 SY026154 [0,1,0,0,1,0|2,0,0]=4 419 B16R2.5347 COC(=O)CC1=CC2=C(C=C1)N=CC=C2 SY003560 [0,1,0,0,0,1|1,0,0]=3 420 B16R2.11975 O=C(Cl)OC1=CC=C2C=CC(Br)=CC2=C1 SY296906 [0,1,0,0,0,1|1,0,0]=3 421 B16R2.11988 CC(=O)NC1=CC2=C(C=C1)C=C(Br)C=C2 SY057570 [0,1,0,0,0,1|0,0,0]=2 422 B16R2.11988 O=C(Cl)OC1=CC=C2C=C(Br)C=CC2=C1 SY296964 [0,1,0,0,0,1|1,0,0]=3 423 B16R2.24933 CC(=O)SC1=CC(O)=C2C=CC=CC2=C1 SY096749 [0,1,0,0,0,1|0,0,0]=2 424 B16R2.82802 CC(C)(C)OC1=CC=C2C=CC=CC2=C1 SY298942 [0,1,0,0,0,1|1,0,1]=4 425 B16R2.82802 CC(C)(N)CC1=CC=C2C=CC=CC2=C1 SY102450 [0,1,0,0,0,1|1,0,1]=4 426 B16R2.83538 O=C(Cl)OC1=CC=C2C=CC=CC2=C1Br SY297059 [0,1,0,0,0,1|1,0,0]=3 427 B16R2.12044 O=C(O)C1=C(O)C2=C(C=CC(F)=C2)N=C1 SY003323 [0,2,0,0,0,0|2,0,0]=4 428 B16R2.22861 O=C(O)C1=C(O)C2=C(N=C1)C(F)=CC=C2 SY003658 [0,2,0,0,0,0|2,0,0]=4 429 B16R2.133456 O=C(O)C1=C(O)C2=CC=C(Cl)C=C2N=C1 SY033656 [0,2,0,0,0,0|2,0,0]=4 430 B16R2.23520 O=C(O)C1=CC2=C(C=C(O)C=C2)OC1=O SY055309 [0,2,0,0,0,0|2,0,0]=4 431 B16R2.23521 O=C(O)C1=C(O)C=C2C=CC(Br)=CC2=C1 SY050712 [0,2,0,0,0,0|1,0,0]=3 432 B16R2.33941 COC(=O)C1=C(F)C=C2C=CC=CC2=C1 SY034650 [0,2,0,0,0,0|0,0,0]=2 433 B16R2.33941 COC(=O)C1=C(N)C=C2C=CC=CC2=C1 SY178120 [0,2,0,0,0,0|0,0,0]=2 434 B16R2.767 CCOC(=O)C1=CC2=C(C=C1)C=NC=C2 SY022492 [0,2,0,0,0,0|1,0,0]=3 435 B16R2.767 CCOC(=O)C1=CC2=C(C=C1)N=CC=C2 SY016103 [0,2,0,0,0,0|1,0,0]=3 436 B16R2.767 CCOC(=O)C1=CC2=C(C=CC=C2)C=N1 SY023234 [0,2,0,0,0,0|1,0,0]=3 437 B16R2.767 CCOC(=O)C1=CC=C2N=CC=NC2=C1 SY039602 [0,2,0,0,0,0|2,0,0]=4 438 B16R2.767 CCOC(=O)C1=NC2=CC=CC=C2C=C1 SY034371 [0,2,0,0,0,0|1,0,0]=3 439 B16R2.767 N#CCC(=O)C1=CC2=C(C=CC=C2)C=N1 SY268705 [0,2,0,0,0,0|1,0,0]=3 440 B16R2.767 N#CCC(=O)C1=CC=C2C=CC=CC2=C1 SY092780 [0,2,0,0,0,0|0,0,0]=2 441 B16R2.767 N#CCC(=O)C1=CC=C2N=CC=CC2=C1 SY163645 [0,2,0,0,0,0|1,0,0]=3 442 B16R2.767 N#CCC(=O)C1=CC=C2N=CC=NC2=C1 SY268569 [0,2,0,0,0,0|2,0,0]=4 443 B16R2.1205 COC(=O)C1=CC2=CC(Br)=CC=C2N=C1 SY111303 [0,2,0,0,0,0|1,0,0]=3 444 B16R2.1205 COC(=O)C1=CC2=CC(C)=CC=C2N=C1 SY266688 [0,2,0,0,0,0|1,0,0]=3 445 B16R2.1205 COC(=O)C1=CC2=CC(Cl)=CC=C2N=C1 SY266695 [0,2,0,0,0,0|1,0,0]=3 446 B16R2.1205 COC(=O)C1=CC2=CC(F)=CC=C2N=C1 SY266667 [0,2,0,0,0,0|1,0,0]=3 447 B16R2.1205 COC(=O)C1=CC2=CC(N)=CC=C2N=C1 SY244666 [0,2,0,0,0,0|1,0,0]=3 448 B16R2.1205 COC(=O)C1=CC2=NC(Cl)=NC=C2C=C1 SY097576 [0,2,0,0,0,0|2,0,0]=4 449 B16R2.1205 COC(=O)C1=CC=C2C=CC(N)=NC2=C1 SY263451 [0,2,0,0,0,0|1,0,0]=3 450 B16R2.1205 COC(=O)C1=CC=C2N=CC(N)=CC2=C1 SY264025 [0,2,0,0,0,0|1,0,0]=3 451 B16R2.1212 COC(=O)C1=CC2=C(Br)C=CC=C2N=C1 SY266626 [0,2,0,0,0,0|1,0,0]=3 452 B16R2.1212 COC(=O)C1=CC2=C(C)C=CC=C2N=C1 SY266686 [0,2,0,0,0,0|1,0,0]=3 453 B16R2.1212 COC(=O)C1=CC2=C(Cl)C=CC=C2N=C1 SY266679 [0,2,0,0,0,0|1,0,0]=3 454 B16R2.1212 COC(=O)C1=CC2=C(F)C=CC=C2N=C1 SY266681 [0,2,0,0,0,0|1,0,0]=3 455 B16R2.1212 COC(=O)C1=CC=C2C=CC=C(N)C2=C1 SY273139 [0,2,0,0,0,0|0,0,0]=2 456 B16R2.33799 COC(=O)C1=CC2=C(C=C1)C=C(Br)C=C2 SY007269 [0,2,0,0,0,0|0,0,0]=2 457 B16R2.33799 COC(=O)C1=CC2=CC=C(Cl)C=C2N=C1 SY266640 [0,2,0,0,0,0|1,0,0]=3 458 B16R2.33799 COC(=O)C1=CC2=CC=C(F)C=C2N=C1 SY266617 [0,2,0,0,0,0|1,0,0]=3 459 B16R2.33799 COC(=O)C1=CC2=CN=C(Cl)N=C2C=C1 SY097590 [0,2,0,0,0,0|2,0,0]=4 460 B16R2.33799 COC(=O)C1=CC=C2C=C(N)C=CC2=C1 SY054417 [0,2,0,0,0,0|0,0,0]=2 461 B16R2.33799 COC(=O)C1=CC=C2C=C(N)C=NC2=C1 SY264024 [0,2,0,0,0,0|1,0,0]=3 462 B16R2.33799 COC(=O)C1=CC=C2N=C(C)C=CC2=C1 SY022688 [0,2,0,0,0,0|1,0,0]=3 463 B16R2.33799 COC(=O)C1=CC=C2N=C(Cl)C=CC2=C1 SY103003 [0,2,0,0,0,0|1,0,0]=3 464 B16R2.33799 COC(=O)C1=CC=C2N=C(N)C=CC2=C1 SY244680 [0,2,0,0,0,0|1,0,0]=3 465 B16R2.33887 COC(=O)C1=CC(=O)C2=CC=CC=C2O1 SY248636 [0,2,0,0,0,0|1,0,0]=3 466 B16R2.33887 COC(=O)C1=CC(Br)=C2C=CC=NC2=C1 SY278312 [0,2,0,0,0,0|1,0,0]=3 467 B16R2.33887 COC(=O)C1=NC2=C(C=CC=C2)C(O)=C1 SY003849 [0,2,0,0,0,0|1,0,0]=3 468 B16R2.33887 COC(=O)C1=NC2=CC=CC=C2C(Cl)=C1 SY035692 [0,2,0,0,0,0|1,0,0]=3 469 B16R2.173132 COC(=O)C1=CC2=C(C=C1)C(Cl)=NC=N2 SY006788 [0,2,0,0,0,0|2,0,0]=4 470 B16R2.173132 COC(=O)C1=CC2=CC=CC(C)=C2N=C1 SY266674 [0,2,0,0,0,0|1,0,0]=3 471 B16R2.173132 COC(=O)C1=CC=C2C(N)=CC=CC2=C1 SY273140 [0,2,0,0,0,0|0,0,0]=2 472 B16R2.11987 CC(C)(C)C1=CC2=CC=C(O)C=C2C=C1 SY286012 [0,2,0,0,0,0|1,0,1]=4 473 B16R2.11987 O=S(=O)(Cl)C1=CC=C2C=C(Br)C=CC2=C1 SY161929 [0,2,0,0,0,0|2,0,0]=4 474 B16R2.11987 O=S(=O)(O)C1=CC=C2C=C(Br)C=CC2=C1 SY247390 [0,2,0,0,0,0|2,0,0]=4 475 B16R2.11987 O=S(=O)([O-])C1=CC=C2C=C(O)C=CC2=C1 SY056360 [0,2,0,0,0,0|2,0,0]=4 476 B16R2.3885 O=C(O)C1=CC2=CC(Br)=C(F)C=C2N=C1 SY266628 [0,2,0,0,0,0|2,0,0]=4 477 B16R2.3885 O=C(O)C1=CC2=CC(F)=C(Br)C=C2N=C1 SY266703 [0,2,0,0,0,0|2,0,0]=4 478 B16R2.3885 O=C(O)C1=CC2=CC(F)=C(F)C=C2N=C1 SY266676 [0,2,0,0,0,0|2,0,0]=4 479 B16R2.26103 O=C(O)C1=CC2=CC(Br)=CC(Br)=C2N=C1 SY266670 [0,2,0,0,0,0|2,0,0]=4 480 B16R2.133406 O=C(O)C1=CC(=O)C2=C(C=C(Br)C=C2)O1 SY251233 [0,2,0,0,0,0|2,0,0]=4 481 B16R2.7486 CN(C)C1=CC2=CC=C(C=O)C=C2C=C1 SY107624 [0,2,0,0,0,0|2,0,0]=4 482 B16R2.7486 COC1=CC2=C(C=C1)C=C(C(C)=O)C=C2 SY014453 [0,2,0,0,0,0|0,0,0]=2 483 B16R2.7486 COC1=CC2=C(C=N1)C=C(C(=O)O)C=C2 SY283958 [0,2,0,0,0,0|2,0,0]=4 484 B16R2.7486 COC1=CC=C2C=C(C(=O)O)C=CC2=C1 SY050144 [0,2,0,0,0,0|1,0,0]=3 485 B16R2.7486 COC1=CC=C2C=C(C(=O)O)C=NC2=C1 SY227471 [0,2,0,0,0,0|2,0,0]=4 486 B16R2.11989 CC1=C(Br)C2=CC=C(C(=O)O)C=C2C=C1 SY281292 [0,2,0,0,0,0|1,0,0]=3 487 B16R2.26112 O=C(O)C1=CC2=C(F)C=C(F)C=C2N=C1 SY278988 [0,2,0,0,0,0|2,0,0]=4 488 B16R2.24425 O=C(O)C1=CC2=C(Br)C=CC(F)=C2N=C1 SY266710 [0,2,0,0,0,0|2,0,0]=4 489 B16R2.36806 COC1=C2N=CC(C(=O)O)=CC2=CC=C1 SY258380 [0,2,0,0,0,0|2,0,0]=4 490 B16R2.189541 COC1=C2C=C(C(=O)O)C=NC2=CC=C1 SY241275 [0,2,0,0,0,0|2,0,0]=4 491 B14R2.2 CC(=O)CC1=CNC2=C1C=CC=C2 SY269712 [0,0,1,1,0,0|1,0,1]=4 492 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 SY059874 [0,0,1,1,0,0|2,0,0]=4 493 B14R2.2 CC(=O)OC1=COC2=CC=CC=C21 SY253154 [0,0,1,1,0,0|2,0,0]=4 494 B14R2.2 CC(=O)OC1=CSC2=CC=CC=C12 SY253153 [0,0,1,1,0,0|2,0,0]=4 495 B14R2.31359 CC(=O)C1=CC=CC2=C1C=CC=C2 SY013630 [0,0,1,1,0,0|0,0,0]=2 496 B14R2.31359 CC(=O)C1=NC=CC2=C1C=CC=C2 SY047277 [0,0,1,1,0,0|1,0,0]=3 497 B14R2.31359 CC(Cl)C1=C2C=CC=CC2=CC=C1 SY279767 [0,0,1,1,0,0|1,0,1]=4 498 B14R2.31359 CC(N)C1=C2C=CC=CC2=CC=C1 SY032143 [0,0,1,1,0,0|1,0,1]=4 499 B14R2.31359 CC(O)C1=C2C=CC=CC2=CC=C1 SY051902 [0,0,1,1,0,0|0,0,2]=4 500 B14R2.31359 C[C@@H](N)C1=C2C=CC=CC2=CC=C1 SY020862 [0,0,1,1,0,0|1,0,1]=4 501 B14R2.31359 NC(=O)C1=C2C=CC=CC2=CC=C1 SY031982 [0,0,1,1,0,0|1,0,0]=3 502 B14R2.31359 O=C(O)C1=C2C=CC=NC2=CC=C1 SY001019 [0,0,1,1,0,0|2,0,0]=4 503 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 SY021170 [0,0,1,1,0,0|2,0,0]=4 504 B14R2.31359 O=C(O)C1=CC=CC2=C1C=CC=C2 SY005963 [0,0,1,1,0,0|1,0,0]=3 505 B14R2.31359 O=C(O)C1=CC=CC2=C1C=CN=C2 SY002346 [0,0,1,1,0,0|2,0,0]=4 506 B14R2.31359 O=C(O)C1=CC=CC2=C1C=NC=C2 SY022477 [0,0,1,1,0,0|2,0,0]=4 507 B14R2.31359 O=C(O)C1=CC=NC2=CC=CC=C21 SY021566 [0,0,1,1,0,0|2,0,0]=4 508 B14R2.31359 O=C(O)C1=CN=CC2=C1C=CC=C2 SY030022 [0,0,1,1,0,0|2,0,0]=4 509 B14R2.31359 O=C(O)C1=NC=CC2=C1C=CC=C2 SY018979 [0,0,1,1,0,0|2,0,0]=4 510 B16R3.335 CC1=NC2=C(O1)C3=CC=CC=C3N=C2 SY130013 [0,0,0,1,0,1|1,0,1]=4 511 B16R3.335 O=C1NC2=C(O1)C3=CC=CC=C3N=C2 SY312623 [0,0,0,1,0,1|2,0,0]=4 512 B16R3.2620 ClC1=NOC2=C3C=CC=CC3=CC=C12 SY280830 [0,1,0,1,0,0|1,0,1]=4 513 B16R3.2620 O=C1COC2=C3C=CC=CC3=CC=C12 SY058315 [0,1,0,1,0,0|0,0,0]=2 514 B16R3.2620 O=C1NOC2=C3C=CC=CC3=CC=C12 SY280829 [0,1,0,1,0,0|1,0,0]=3 515 B16R3.17428 ClC1=NOC2=CC3=CC=CC=C3C=C21 SY280826 [0,1,0,1,0,0|1,0,1]=4 516 B16R3.17428 O=C1COC2=CC3=CC=CC=C3C=C12 SY058309 [0,1,0,1,0,0|0,0,0]=2 517 B16R3.17428 O=C1NOC2=CC3=CC=CC=C3C=C12 SY280825 [0,1,0,1,0,0|1,0,0]=3 518 B16R3.11647 NC1(C2=CC=C3C=CC=CC3=C2)CC1 SY225795 [0,1,0,1,0,0|1,0,1]=4 519 B16R3.275899 C1=CC2=CC=C(C3CNC3)C=C2C=C1 SY267217 [0,1,0,1,0,0|1,0,1]=4 520 B16R3.275899 C1=CC2=CC=C(C3CNC3)C=C2C=C1 SY267218 [0,1,0,1,0,0|1,0,1]=4 521 B16R3.96480 NC1=CC=C2C=C(C3CC3)C=CC2=C1 SY264132 [0,1,0,1,0,0|1,0,1]=4 522 B12R2.1 O=CC1=C2C=CC=CC2=NO1 SY246815 [1,0,0,0,1,0|2,0,0]=4 523 B12R2.1 O=CC1=C2C=CC=CN2N=C1 SY185365 [1,0,0,0,1,0|2,0,0]=4 524 B12R2.1 O=CC1=CN=C2C=CC=CN12 SY024152 [1,0,0,0,1,0|2,0,0]=4 525 B12R2.1 O=CC1=CNC2=C1C=CC=N2 SY018104 [1,0,0,0,1,0|2,0,0]=4 526 B12R2.1 O=CC1=CNC2=C1C=CN=C2 SY113573 [1,0,0,0,1,0|2,0,0]=4 527 B12R2.1 O=CC1=CNC2=CC=CN=C12 SY065692 [1,0,0,0,1,0|2,0,0]=4 528 B12R2.1 O=CC1=COC2=CC=CC=C12 SY023570 [1,0,0,0,1,0|1,0,0]=3 529 B12R2.1 O=CC1=CSC2=C1C=CC=C2 SY014520 [1,0,0,0,1,0|1,0,0]=3 530 B12R2.1 O=CC1=NNC2=C1C=CC=C2 SY004602 [1,0,0,0,1,0|2,0,0]=4 531 B12R2.32 CCC1=CC2=CC=CC=C2O1 SY067362 [1,0,0,0,1,0|1,0,1]=4 532 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 SY042244 [1,0,0,0,1,0|1,0,0]=3 533 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 SY065641 [1,0,0,0,1,0|2,0,0]=4 534 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 SY066930 [1,0,0,0,1,0|2,0,0]=4 535 B12R2.32 O=CC1=CC2=CC=CC=C2O1 SY013762 [1,0,0,0,1,0|1,0,0]=3 536 B12R2.32 O=CC1=CC2=CC=CC=C2S1 SY019968 [1,0,0,0,1,0|1,0,0]=3 537 B12R2.32 O=CC1=NC2=CC=CC=C2N1 SY025423 [1,0,0,0,1,0|2,0,0]=4 538 B12R2.32 O=CC1=NC2=CC=CC=C2O1 SY206427 [1,0,0,0,1,0|2,0,0]=4 539 B12R2.32 O=CC1=NC2=CC=CC=C2S1 SY059450 [1,0,0,0,1,0|2,0,0]=4 540 B12R2.44 COC1=CC2=C(C=C1)NC=C2 SY004368 [1,0,0,0,1,0|2,0,0]=4 541 B12R2.44 COC1=CC2=C(C=CN2)C=C1 SY001985 [1,0,0,0,1,0|2,0,0]=4 542 B12R2.44 COC1=CC=C2C=CSC2=C1 SY122383 [1,0,0,0,1,0|2,0,0]=4 543 B12R2.44 COC1=CC=C2OC=CC2=C1 SY032575 [1,0,0,0,1,0|2,0,0]=4 544 B12R2.44 O=CC1=CC2=C(C=C1)C=NN2 SY035918 [1,0,0,0,1,0|2,0,0]=4 545 B12R2.44 O=CC1=CC2=C(C=C1)NC=C2 SY014625 [1,0,0,0,1,0|1,0,0]=3 546 B12R2.44 O=CC1=CC2=C(C=C1)NN=C2 SY020611 [1,0,0,0,1,0|2,0,0]=4 547 B12R2.44 O=CC1=CC2=C(C=CN2)C=C1 SY002555 [1,0,0,0,1,0|1,0,0]=3 548 B12R2.44 O=CC1=CC=C2C=COC2=C1 SY026601 [1,0,0,0,1,0|1,0,0]=3 549 B12R2.44 O=CC1=CC=C2NC=NC2=C1 SY002474 [1,0,0,0,1,0|2,0,0]=4 550 B14R1.68 CC(=O)OC1=CC=C(\C=C\CO)C=C1 SY253728 [0,0,1,0,0,1|1,0,1]=4 551 B14R2.1008 CC(=O)NC1=CC2=C(C=N1)NC=C2 SY041199 [0,0,0,0,1,1|2,0,0]=4 552 B14R2.1008 O=C(O)CC1=CC=C2OC=CC2=C1 SY029483 [0,0,0,0,1,1|2,0,0]=4 553 B16R2.477 O=C(O)CCC1=CC=C2C=CC=CC2=C1 SY022237 [0,0,0,0,0,2|1,0,0]=3