0 B13R1.585 C=C(Br)CC1=CC=C(C=C1)C(=O)O MCULE-7667601772 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.585 C=C(C)CC1=CC=C(C=C1)C(=O)O MCULE-2462106135 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.585 C=C(Cl)CC1=CC=C(C=C1)C(=O)O MCULE-6612063763 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.585 CC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-7578046977 [0,0,0,0,0,0|2,0,0]=2 4 B13R1.585 CC(=O)C1=CC=C(C=C1)NC(=O)N MCULE-6474869773 [0,0,0,0,0,0|4,0,0]=4 5 B13R1.585 CC(=O)CC1=CC=C(C=C1)C(=O)O MCULE-7260955013 [0,0,0,0,0,0|2,0,1]=3 6 B13R1.585 CC(=O)CC1=CC=C(C=C1)C(C)C MCULE-4519643729 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.585 CC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-8226511025 [0,0,0,0,0,0|1,0,2]=3 8 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)C MCULE-4865713549 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)Cl MCULE-7425195263 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)O MCULE-9560339064 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.585 CC(=O)NC1=CC=C(C=C1)N(=O)=O MCULE-4712987402 [0,0,0,0,0,0|2,0,2]=4 12 B13R1.585 CC(=O)NC1=CC=C(C=C1)S(=O)C MCULE-8329259350 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.585 CC(=O)NC1=CC=C(C=C1)S(=O)O MCULE-6690777618 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.585 CC(=O)NC1=CC=C(C=C1)S(=O)[O-] MCULE-1119866785 [0,0,0,0,0,0|3,0,0]=3 15 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)C MCULE-3875998932 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)Cl MCULE-9104575082 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)N MCULE-7203919123 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)O MCULE-5488979007 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)[O-] MCULE-1078231416 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.585 CC(=O)OC1=CC=C(C=C1)N(=O)=O MCULE-7881970670 [0,0,0,0,0,0|2,0,2]=4 21 B13R1.585 CC(=O)SC1=CC=C(C=C1)N(=O)=O MCULE-6957771302 [0,0,0,0,0,0|2,0,2]=4 22 B13R1.585 CC(C)C1=CC=C(C=C1)CC(=O)Cl MCULE-8671023705 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.585 CC(C)C1=CC=C(C=C1)CC(=O)O MCULE-9538499418 [0,0,0,0,0,0|3,0,0]=3 24 B13R1.585 CC(C)C1=CC=C(N=C1)CC(=O)O MCULE-2726740263 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.585 CC(C)C1=CC=C(N=C1)CC(=O)O MCULE-5358944832 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.585 CC(O)C1=CC=C(C=C1)CC(=O)O MCULE-6744973424 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.585 CN(C)C1=CC=C(C=C1)CC(=O)Cl MCULE-6082038493 [0,0,0,0,0,0|3,0,1]=4 28 B13R1.585 CN(C)C1=CC=C(C=C1)CC(=O)O MCULE-5581642533 [0,0,0,0,0,0|2,0,1]=3 29 B13R1.585 CN(C)C1=CC=C(C=N1)CC(=O)O MCULE-2567820318 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.585 CN(C)C1=CC=C(C=N1)CC(=O)O MCULE-2843840599 [0,0,0,0,0,0|3,0,1]=4 31 B13R1.585 CS(=O)C1=CC=C(C=C1)CC(=O)O MCULE-7818331596 [0,0,0,0,0,0|2,0,0]=2 32 B13R1.585 N=C(N)C1=CC=C(C=C1)CC(=O)O MCULE-3989231137 [0,0,0,0,0,0|3,0,0]=3 33 B13R1.585 N=C(N)C1=CC=C(C=C1)CC(=O)O MCULE-7949798340 [0,0,0,0,0,0|3,0,0]=3 34 B13R1.585 N=C(N)CC1=CC=C(C=C1)C(=O)O MCULE-6239995325 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.585 N=C(N)CC1=CC=C(C=C1)C(=O)O MCULE-7970272053 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.585 N=C(N)CC1=CC=C(C=C1)N(=O)=O MCULE-5808948635 [0,0,0,0,0,0|2,0,2]=4 37 B13R1.585 N=C(N)CC1=CC=C(C=C1)N(=O)=O MCULE-9306680070 [0,0,0,0,0,0|2,0,2]=4 38 B13R1.585 NC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-1968975994 [0,0,0,0,0,0|2,0,0]=2 39 B13R1.585 NC(=O)C1=NC=C(C=C1)CC(=O)O MCULE-6971734264 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.585 NC(=O)CC1=CC=C(C=C1)C(=O)O MCULE-8448479108 [0,0,0,0,0,0|2,0,1]=3 41 B13R1.585 NC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-2950725778 [0,0,0,0,0,0|1,0,2]=3 42 B13R1.585 NC(=O)C[N+]1=CC=C(C=C1)C(=O)N MCULE-3748159167 [0,0,0,0,0,0|4,0,0]=4 43 B13R1.585 NC(=O)C[N+]1=CC=C(C=C1)C(=O)N MCULE-4515159607 [0,0,0,0,0,0|4,0,0]=4 44 B13R1.585 NC(=O)C[N+]1=CC=C(C=C1)C(=O)N MCULE-6396425932 [0,0,0,0,0,0|4,0,0]=4 45 B13R1.585 NC(=O)NC1=CC=C(C=C1)C(=O)O MCULE-9791751066 [0,0,0,0,0,0|3,0,1]=4 46 B13R1.585 NC(=O)NC1=CC=C(C=C1)N(=O)=O MCULE-5243921457 [0,0,0,0,0,0|2,0,2]=4 47 B13R1.585 NC(=O)OC1=CC=C(C=C1)N(=O)=O MCULE-5700049702 [0,0,0,0,0,0|2,0,2]=4 48 B13R1.585 NC(=S)CC1=CC=C(C=C1)N(=O)=O MCULE-3808970264 [0,0,0,0,0,0|1,1,2]=4 49 B13R1.585 O=C(Cl)CC1=CC=C(C=C1)N(=O)=O MCULE-1380235697 [0,0,0,0,0,0|1,0,2]=3 50 B13R1.585 O=C(Cl)OC1=CC=C(C=C1)N(=O)=O MCULE-2216588304 [0,0,0,0,0,0|2,0,2]=4 51 B13R1.585 O=C(O)CC1=CC=C(C=C1)B(O)O MCULE-9491810281 [0,0,0,0,0,0|1,0,2]=3 52 B13R1.585 O=C(O)CC1=CC=C(C=C1)C(=O)O MCULE-6154695882 [0,0,0,0,0,0|1,0,1]=2 53 B13R1.585 O=C(O)CC1=CC=C(C=C1)C(F)F MCULE-6212563880 [0,0,0,0,0,0|3,0,0]=3 54 B13R1.585 O=C(O)CC1=CC=C(C=C1)N(=O)=O MCULE-2593918770 [0,0,0,0,0,0|0,0,2]=2 55 B13R1.585 O=C(O)CC1=CC=C(C=N1)C(F)F MCULE-4007647991 [0,0,0,0,0,0|4,0,0]=4 56 B13R1.585 O=C(O)CC1=CN=C(C=C1)N(=O)=O MCULE-5101542834 [0,0,0,0,0,0|1,0,2]=3 57 B13R1.585 O=C(O)CC1=NC=C(C=C1)C(F)F MCULE-1172903520 [0,0,0,0,0,0|4,0,0]=4 58 B13R1.585 O=C(O)CC1=NC=C(C=C1)N(=O)=O MCULE-9713820034 [0,0,0,0,0,0|1,0,2]=3 59 B13R1.585 O=C(O)C[N+]1=CC=C(C=C1)C(=O)O MCULE-5357242122 [0,0,0,0,0,0|2,0,1]=3 60 B13R1.585 O=C(O)C[N+]1=CC=C(C=C1)C(=O)O MCULE-6534834063 [0,0,0,0,0,0|2,0,1]=3 61 B13R1.585 O=C([O-])CC1=CC=C(C=C1)N(=O)=O MCULE-3102185984 [0,0,0,0,0,0|0,0,3]=3 62 B13R1.585 O=N(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-9327462823 [0,0,0,0,0,0|1,0,3]=4 63 B12R1.4 C#CC1=CC=C(C=C1)CC(=O)O MCULE-5692158567 [1,0,0,0,0,0|2,0,0]=3 64 B12R1.4 CC(=O)CC1=CC=C(C=C1)C#N MCULE-3910151752 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.4 CC(=O)CC1=CC=C(C=C1)CBr MCULE-6808288658 [1,0,0,0,0,0|3,0,0]=4 66 B12R1.4 CC(=O)NC1=CC=C(C=C1)C=O MCULE-9276344221 [1,0,0,0,0,0|3,0,0]=4 67 B12R1.4 CC(=O)OC1=CC=C(C=C1)C=O MCULE-4172612765 [1,0,0,0,0,0|3,0,0]=4 68 B12R1.4 CCC1=CC=C(C=C1)CC(=O)C MCULE-9486373464 [1,0,0,0,0,0|3,0,0]=4 69 B12R1.4 CCC1=CC=C(C=C1)CC(=O)N MCULE-4163968051 [1,0,0,0,0,0|3,0,0]=4 70 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O MCULE-3821428381 [1,0,0,0,0,0|2,0,0]=3 71 B12R1.4 CCC1=CN=C(C=C1)CC(=O)O MCULE-4030216819 [1,0,0,0,0,0|3,0,0]=4 72 B12R1.4 CCC1=CN=C(C=C1)CC(=O)O MCULE-5174930559 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.4 CNC1=CC=C(C=C1)CC(=O)O MCULE-2193745710 [1,0,0,0,0,0|1,0,1]=3 74 B12R1.4 CNC1=CC=C(C=C1)CC(=O)O MCULE-7752411908 [1,0,0,0,0,0|1,0,1]=3 75 B12R1.4 COC1=CC=C(C=C1)CC(=O)C MCULE-8607795744 [1,0,0,0,0,0|3,0,0]=4 76 B12R1.4 COC1=CC=C(C=C1)CC(=O)Cl MCULE-7782557628 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.4 COC1=CC=C(C=C1)CC(=O)N MCULE-2396420706 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.4 COC1=CC=C(C=C1)CC(=O)O MCULE-9247963107 [1,0,0,0,0,0|2,0,0]=3 79 B12R1.4 COC1=CC=C(C=N1)CC(=O)O MCULE-7948548499 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.4 COC1=CN=C(C=C1)CC(=O)O MCULE-1208251865 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.4 COC1=CN=C(C=C1)CC(=O)O MCULE-9358056696 [1,0,0,0,0,0|3,0,0]=4 82 B12R1.4 CSC1=CC=C(C=C1)CC(=O)C MCULE-6332095977 [1,0,0,0,0,0|3,0,0]=4 83 B12R1.4 CSC1=CC=C(C=C1)CC(=O)Cl MCULE-9425466185 [1,0,0,0,0,0|3,0,0]=4 84 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O MCULE-6921616947 [1,0,0,0,0,0|2,0,0]=3 85 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)Cl MCULE-2362407758 [1,0,0,0,0,0|3,0,0]=4 86 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N MCULE-9840686428 [1,0,0,0,0,0|3,0,0]=4 87 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)O MCULE-1048335212 [1,0,0,0,0,0|2,0,0]=3 88 B12R1.4 N#CC1=CN=C(C=C1)CC(=O)O MCULE-2251389493 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.4 N#CC1=NC=C(C=C1)CC(=O)O MCULE-3595894927 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.4 NCC1=CC=C(C=C1)CC(=O)N MCULE-8145698570 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.4 NCC1=CC=C(C=C1)CC(=O)O MCULE-7737351701 [1,0,0,0,0,0|2,0,0]=3 92 B12R1.4 NCC1=CC=C(C=C1)CC(=O)O MCULE-8802844200 [1,0,0,0,0,0|2,0,0]=3 93 B12R1.4 NNC1=CC=C(C=C1)CC(=O)N MCULE-2173208157 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.4 NNC1=CC=C(C=C1)CC(=O)N MCULE-3131016027 [1,0,0,0,0,0|2,0,1]=4 95 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-2250489951 [1,0,0,0,0,0|1,0,1]=3 96 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-6326870019 [1,0,0,0,0,0|1,0,1]=3 97 B12R1.4 NNC1=CC=C(C=C1)CC(=O)O MCULE-9524713590 [1,0,0,0,0,0|1,0,1]=3 98 B12R1.4 O=C(O)CC1=CC=C(C=C1)CBr MCULE-9880773558 [1,0,0,0,0,0|2,0,0]=3 99 B12R1.4 O=C(O)CC1=CC=C(C=C1)CCl MCULE-4471576860 [1,0,0,0,0,0|2,0,0]=3 100 B12R1.4 O=C(O)CC1=CC=C(C=C1)CO MCULE-9150949915 [1,0,0,0,0,0|1,0,1]=3 101 B12R1.4 O=C=C1C=CC(=CC1)CC(=O)O MCULE-8693772412 [1,0,0,0,0,0|1,0,1]=3 102 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O MCULE-6530164917 [1,0,0,0,0,0|1,0,0]=2 103 B12R1.113 C=CCC1=CC=C(C=C1)C(=O)C MCULE-8188317091 [1,0,0,0,0,0|3,0,0]=4 104 B12R1.113 C=CCC1=CC=C(C=C1)C(=O)N MCULE-3474097422 [1,0,0,0,0,0|3,0,0]=4 105 B12R1.113 C=CCC1=CC=C(C=C1)C(=O)O MCULE-2019087784 [1,0,0,0,0,0|2,0,1]=4 106 B12R1.113 CC(=O)C1=CC=C(C=C1)NC=O MCULE-5852649326 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.113 CC(C)C1=CC=C(C=C1)CC=O MCULE-7659817386 [1,0,0,0,0,0|3,0,0]=4 108 B12R1.113 CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-3161198110 [1,0,0,0,0,0|1,0,1]=3 109 B12R1.113 O=C(O)C1=CC=C(C=C1)CCO MCULE-6681125132 [1,0,0,0,0,0|1,0,2]=4 110 B12R1.113 O=CCC1=CC=C(C=C1)N(=O)=O MCULE-9838391019 [1,0,0,0,0,0|0,0,2]=3 111 B12R1.113 O=CNC1=CC=C(C=C1)C(=O)O MCULE-3537422522 [1,0,0,0,0,0|2,0,1]=4 112 B12R1.113 O=CNC1=CC=C(C=C1)N(=O)=O MCULE-9700353758 [1,0,0,0,0,0|1,0,2]=4 113 B12R1.113 O=COC1=CC=C(C=C1)N(=O)=O MCULE-1363454403 [1,0,0,0,0,0|1,0,2]=4 114 B12R1.113 O=N(=O)C1=CC=C(C=C1)CCO MCULE-3775498091 [1,0,0,0,0,0|0,0,3]=4 115 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)C=CBr MCULE-3516765700 [1,0,0,0,0,0|1,0,1]=3 116 B12R1.113 O=[N+]([O-])C1=CC=C(C=C1)C=NO MCULE-1197206494 [1,0,0,0,0,0|1,0,1]=3 117 B14R1.124 CC(=O)C1=CC=C(C(=C1)F)CC(=O)O MCULE-7263677448 [0,1,0,0,0,0|2,0,0]=3 118 B14R1.124 CC(C)C1=CC=C(C(=C1)N)CC(=O)O MCULE-6345530684 [0,1,0,0,0,0|3,0,0]=4 119 B14R1.124 NC1=CC(=CC=C1CC(=O)O)C(=O)O MCULE-8383243738 [0,1,0,0,0,0|1,0,1]=3 120 B14R1.124 O=C(O)CC1=C(C=C(C=C1)N(=O)=O)Br MCULE-4609863622 [0,1,0,0,0,0|0,0,2]=3 121 B14R1.124 O=C(O)CC1=C(C=C(C=C1)N(=O)=O)Cl MCULE-4497449290 [0,1,0,0,0,0|0,0,2]=3 122 B14R1.124 O=C(O)CC1=C(C=C(C=C1)N(=O)=O)F MCULE-1785572911 [0,1,0,0,0,0|0,0,2]=3 123 B14R1.124 O=C(O)CC1=C(C=C(C=C1)N(=O)=O)O MCULE-7122186730 [0,1,0,0,0,0|0,0,2]=3 124 B14R1.124 O=C(O)CC1=CC=C(C=C1F)B(O)O MCULE-2720981537 [0,1,0,0,0,0|1,0,2]=4 125 B14R1.124 O=C(O)CC1=CC=C(C=C1I)N(=O)=O MCULE-9609109921 [0,1,0,0,0,0|0,0,2]=3 126 B14R1.717 CNC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-5815750478 [0,1,0,0,0,0|2,0,0]=3 127 B14R1.717 COC(=O)C1=CC=C(C=C1)CC(=O)C MCULE-1632275360 [0,1,0,0,0,0|2,0,1]=4 128 B14R1.717 COC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-5881186778 [0,1,0,0,0,0|1,0,1]=3 129 B14R1.717 COC(=O)C1=CN=C(C=C1)CC(=O)O MCULE-6414503101 [0,1,0,0,0,0|2,0,1]=4 130 B14R1.717 COC(=O)C1=NC=C(C=C1)CC(=O)O MCULE-4022495203 [0,1,0,0,0,0|2,0,1]=4 131 B14R1.806 CC(=O)CC1=CC=C(C=C1)S(=O)(=O)C MCULE-2488727526 [0,1,0,0,0,0|2,0,1]=4 132 B14R1.806 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-] MCULE-1036296146 [0,1,0,0,0,0|3,0,0]=4 133 B14R1.806 CC(=O)NC1=CC=C(C=C1)S(=O)(=O)[O-] MCULE-8190785059 [0,1,0,0,0,0|3,0,0]=4 134 B14R1.806 CC(C)(C)C1=CC=C(C=C1)CC(=O)O MCULE-1362276474 [0,1,0,0,0,0|3,0,0]=4 135 B14R1.806 CS(=O)(=O)C1=CC=C(C=C1)CC(=O)Cl MCULE-8692297575 [0,1,0,0,0,0|2,0,1]=4 136 B14R1.806 CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O MCULE-4739523581 [0,1,0,0,0,0|1,0,1]=3 137 B14R1.806 C[Si](C)(C)C1=CC=C(C=C1)CC(=O)O MCULE-5645921128 [0,1,0,0,0,0|3,0,0]=4 138 B14R1.806 NC(=O)CC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-3739223110 [0,1,0,0,0,0|2,0,1]=4 139 B14R1.806 NC(=O)CC1=CC=C(C=C1)S(=O)(=O)N MCULE-1568219116 [0,1,0,0,0,0|2,0,1]=4 140 B14R1.806 NS(=O)(=O)C1=CC=C(C=C1)CC(=O)O MCULE-1592772677 [0,1,0,0,0,0|1,0,1]=3 141 B14R1.806 O=C(O)CC1=CC=C(C=C1)C(F)(F)F MCULE-9216432374 [0,1,0,0,0,0|3,0,0]=4 142 B14R1.806 O=C(O)CC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-9917758127 [0,1,0,0,0,0|1,0,1]=3 143 B14R1.806 O=C(O)CC1=CC=C(C=C1)S(=O)(=O)F MCULE-4163260347 [0,1,0,0,0,0|1,0,1]=3 144 B14R1.2879 CNC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-7974154186 [0,1,0,0,0,0|1,0,2]=4 145 B14R1.2879 COC(=O)CC1=CC=C(C=C1)B(O)O MCULE-3554280180 [0,1,0,0,0,0|1,0,2]=4 146 B14R1.2879 COC(=O)CC1=CC=C(C=C1)C(=O)C MCULE-8984275662 [0,1,0,0,0,0|2,0,0]=3 147 B14R1.2879 COC(=O)CC1=CC=C(C=C1)C(=O)N MCULE-1346927777 [0,1,0,0,0,0|2,0,0]=3 148 B14R1.2879 COC(=O)CC1=CC=C(C=C1)C(=O)O MCULE-7528954367 [0,1,0,0,0,0|1,0,1]=3 149 B14R1.2879 COC(=O)CC1=CC=C(C=C1)C(C)C MCULE-6006014299 [0,1,0,0,0,0|3,0,0]=4 150 B14R1.2879 COC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-9893383837 [0,1,0,0,0,0|0,0,2]=3 151 B14R1.2879 COC(=O)CC1=CC=C(C=C1)N(C)C MCULE-6849946269 [0,1,0,0,0,0|2,0,1]=4 152 B14R1.2879 COC(=O)CC1=NC=C(C=C1)N(=O)=O MCULE-4950458859 [0,1,0,0,0,0|1,0,2]=4 153 B14R1.2879 COC(=O)NC1=CC=C(C=C1)C(=O)O MCULE-1257469086 [0,1,0,0,0,0|2,0,1]=4 154 B14R1.2879 COC(=O)NC1=CC=C(C=C1)N(=O)=O MCULE-2860390546 [0,1,0,0,0,0|1,0,2]=4 155 B14R1.2879 COC(=O)OC1=CC=C(C=C1)C(=O)O MCULE-2463251923 [0,1,0,0,0,0|2,0,1]=4 156 B14R1.2879 COC(=O)OC1=CC=C(C=C1)N(=O)=O MCULE-1713407891 [0,1,0,0,0,0|1,0,2]=4 157 B14R1.2879 N/C(=N\O)/CC1=CC=C(C=C1)N(=O)=O MCULE-2363865225 [0,1,0,0,0,0|1,0,2]=4 158 B14R1.2879 NNC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-1743729659 [0,1,0,0,0,0|1,0,2]=4 159 B14R1.2879 N[C@H](CO)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6694984156 [0,1,0,0,0,0|1,0,1]=3 160 B14R1.2879 O=C(CCl)CC1=CC=C(C=C1)N(=O)=O MCULE-1236255860 [0,1,0,0,0,0|1,0,2]=4 161 B14R1.5801 CC1=CC(=CC=C1N(=O)=O)CC(=O)O MCULE-5449584197 [0,1,0,0,0,0|0,0,2]=3 162 B14R1.5801 NC(=O)CC1=CC=C(C(=C1)Cl)N(=O)=O MCULE-3297105753 [0,1,0,0,0,0|1,0,2]=4 163 B14R1.5801 NC1=C(C=CC(=C1)CC(=O)O)N(=O)=O MCULE-1408322812 [0,1,0,0,0,0|0,0,2]=3 164 B14R1.5801 O=C(O)CC1=CC(=C(C=C1)B(O)O)F MCULE-8659139480 [0,1,0,0,0,0|1,0,2]=4 165 B14R1.5801 O=C(O)CC1=CC(=C(C=C1)N(=O)=O)F MCULE-1745686238 [0,1,0,0,0,0|0,0,2]=3 166 B14R1.5801 O=C(O)CC1=CC(=C(C=C1)N(=O)=O)O MCULE-1627239627 [0,1,0,0,0,0|0,0,2]=3 167 B14R1.5801 O=C(O)CC1=CC=C(C(=C1)Br)N(=O)=O MCULE-8312697785 [0,1,0,0,0,0|0,0,2]=3 168 B14R1.6402 CC(C(=O)N)C1=CC=C(C=C1)N(=O)=O MCULE-6169007430 [0,1,0,0,0,0|1,0,2]=4 169 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)C(=O)N MCULE-6974122363 [0,1,0,0,0,0|2,0,0]=3 170 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-3278431470 [0,1,0,0,0,0|1,0,1]=3 171 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-4351112332 [0,1,0,0,0,0|0,0,2]=3 172 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)N(C)C MCULE-4653378554 [0,1,0,0,0,0|2,0,1]=4 173 B14R1.6402 CC(C)C1=CC=C(C=C1)C(N)C(=O)O MCULE-6411585518 [0,1,0,0,0,0|3,0,0]=4 174 B14R1.6402 CC(C)C1=CC=C(C=C1)C(O)C(=O)O MCULE-1796773856 [0,1,0,0,0,0|3,0,0]=4 175 B14R1.6402 CC(C)C1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-2102307591 [0,1,0,0,0,0|3,0,0]=4 176 B14R1.6402 CN(C)C1=CC=C(C=C1)C(N)C(=O)O MCULE-9827279308 [0,1,0,0,0,0|2,0,1]=4 177 B14R1.6402 C[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5826701361 [0,1,0,0,0,0|0,0,0]=1 178 B14R1.6402 C[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6177919117 [0,1,0,0,0,0|0,0,0]=1 179 B14R1.6402 C[C@@H](O)[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6640785157 [0,1,0,0,0,0|1,0,1]=3 180 B14R1.6402 C[C@@H](O)[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6751283685 [0,1,0,0,0,0|1,0,1]=3 181 B14R1.6402 C[C@H](O)[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5023253619 [0,1,0,0,0,0|1,0,1]=3 182 B14R1.6402 C[C@H](O)[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6318388011 [0,1,0,0,0,0|1,0,1]=3 183 B14R1.6402 NC(=O)C(Cl)C1=CC=C(C=C1)N(=O)=O MCULE-4917467910 [0,1,0,0,0,0|1,0,2]=4 184 B14R1.6402 NC(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-3982434410 [0,1,0,0,0,0|1,0,1]=3 185 B14R1.6402 NC(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-4080875193 [0,1,0,0,0,0|1,0,1]=3 186 B14R1.6402 NC(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-5033449854 [0,1,0,0,0,0|1,0,1]=3 187 B14R1.6402 NC(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-6302282788 [0,1,0,0,0,0|1,0,1]=3 188 B14R1.6402 NC(C(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-3320557207 [0,1,0,0,0,0|0,0,2]=3 189 B14R1.6402 N[C@@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8804782848 [0,1,0,0,0,0|0,0,0]=1 190 B14R1.6402 N[C@@H](C1=CC=C(C=C1)[N+](=O)[O-])C(F)F MCULE-7260507619 [0,1,0,0,0,0|2,0,1]=4 191 B14R1.6402 N[C@@H](C1=CC=C(C=C1)[N+](=O)[O-])C(F)F MCULE-7613684929 [0,1,0,0,0,0|2,0,1]=4 192 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-1367731872 [0,1,0,0,0,0|1,0,1]=3 193 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-4560252468 [0,1,0,0,0,0|1,0,1]=3 194 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-4810160190 [0,1,0,0,0,0|1,0,1]=3 195 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-7805438583 [0,1,0,0,0,0|1,0,1]=3 196 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5519425312 [0,1,0,0,0,0|0,0,0]=1 197 B14R1.6402 N[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-9438161026 [0,1,0,0,0,0|0,0,0]=1 198 B14R1.6402 N[C@H](C1=CC=C(C=C1)[N+](=O)[O-])C(F)F MCULE-6128918270 [0,1,0,0,0,0|2,0,1]=4 199 B14R1.6402 N[C@H](C1=CC=C(C=C1)[N+](=O)[O-])C(F)F MCULE-9634348643 [0,1,0,0,0,0|2,0,1]=4 200 B14R1.6402 O=C(O)C(=O)C1=CC=C(C=C1)N(=O)=O MCULE-6406707671 [0,1,0,0,0,0|0,0,3]=4 201 B14R1.6402 O=C(O)C(Cl)C1=CC=C(C=C1)N(=O)=O MCULE-4434838230 [0,1,0,0,0,0|0,0,2]=3 202 B14R1.6402 O=C(O)C(O)C1=CC=C(C=C1)N(=O)=O MCULE-8392082526 [0,1,0,0,0,0|0,0,2]=3 203 B14R1.6402 O=C(O)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5366390432 [0,1,0,0,0,0|0,0,0]=1 204 B14R2.601 CC(=O)C1=CC=C2NC(=O)OC2=C1 MCULE-6825112864 [0,0,0,1,0,0|3,0,0]=4 205 B14R2.601 O=C1CC2=C(C1)C=C(C=C2)N(=O)=O MCULE-3687549666 [0,0,0,1,0,0|1,0,2]=4 206 B14R2.601 O=C1CC2=C(N1)C=C(C=C2)C(=O)O MCULE-2619087218 [0,0,0,1,0,0|2,0,1]=4 207 B14R2.601 O=C1CC2=C(N1)C=C(C=C2)C(=O)[O-] MCULE-9728627789 [0,0,0,1,0,0|2,0,0]=3 208 B14R2.601 O=C1CC2=C(N1)C=C(C=C2)N(=O)=O MCULE-1031191536 [0,0,0,1,0,0|1,0,2]=4 209 B14R2.601 O=C1NC2=C(O1)C=C(C=C2)C(=O)O MCULE-1796229441 [0,0,0,1,0,0|2,0,1]=4 210 B14R2.601 O=C1NC2=C(O1)C=C(C=C2)N(=O)=O MCULE-2729517530 [0,0,0,1,0,0|1,0,2]=4 211 B14R2.1006 O=C(O)CC1=CC=C(C=C1)C2CC2 MCULE-4865052837 [0,0,0,1,0,0|3,0,0]=4 212 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)C MCULE-6429827613 [0,0,0,0,1,0|3,0,0]=4 213 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)Cl MCULE-3052790387 [0,0,0,0,1,0|3,0,0]=4 214 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)N MCULE-1208786487 [0,0,0,0,1,0|3,0,0]=4 215 B12R1.256 CC(=O)C1=CC=C(C=C1)C(=O)O MCULE-5486422687 [0,0,0,0,1,0|2,0,0]=3 216 B12R1.256 CC(=O)C1=CC=C(C=C1)N(=O)=O MCULE-1366613088 [0,0,0,0,1,0|1,0,2]=4 217 B12R1.256 CC(=O)C1=CC=C(C=C1)S(=O)C MCULE-1187072609 [0,0,0,0,1,0|3,0,0]=4 218 B12R1.256 CC(=O)C1=CN=C(C=C1)C(=O)O MCULE-7479942361 [0,0,0,0,1,0|3,0,0]=4 219 B12R1.256 CC(Br)C1=CC=C(C=C1)C(=O)O MCULE-3735616649 [0,0,0,0,1,0|3,0,0]=4 220 B12R1.256 CC(C)C1=CC=C(C=C1)C(=O)O MCULE-7346179959 [0,0,0,0,1,0|3,0,0]=4 221 B12R1.256 CC(N)C1=CC=C(C=C1)C(=O)O MCULE-1576650021 [0,0,0,0,1,0|3,0,0]=4 222 B12R1.256 CC(N)C1=CC=C(C=C1)C(=O)O MCULE-5298133753 [0,0,0,0,1,0|3,0,0]=4 223 B12R1.256 CC(N)C1=CC=C(C=C1)C(=O)O MCULE-6434994471 [0,0,0,0,1,0|3,0,0]=4 224 B12R1.256 CC(N)C1=CC=C(C=C1)C(=O)O MCULE-7129464087 [0,0,0,0,1,0|3,0,0]=4 225 B12R1.256 CC(O)C1=CC=C(C=C1)C(=O)O MCULE-8897020648 [0,0,0,0,1,0|2,0,1]=4 226 B12R1.256 CN(C)C1=CC=C(C=C1)C(=O)O MCULE-2235235718 [0,0,0,0,1,0|2,0,1]=4 227 B12R1.256 CS(=O)C1=CC=C(C=C1)C(=O)O MCULE-5973526071 [0,0,0,0,1,0|2,0,0]=3 228 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-1355690708 [0,0,0,0,1,0|3,0,0]=4 229 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-4130251698 [0,0,0,0,1,0|3,0,0]=4 230 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-6312590094 [0,0,0,0,1,0|3,0,0]=4 231 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-6967460011 [0,0,0,0,1,0|3,0,0]=4 232 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1988712530 [0,0,0,0,1,0|2,0,1]=4 233 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2087176188 [0,0,0,0,1,0|2,0,1]=4 234 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2381893264 [0,0,0,0,1,0|2,0,1]=4 235 B12R1.256 C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5076051118 [0,0,0,0,1,0|2,0,1]=4 236 B12R1.256 C[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2145104300 [0,0,0,0,1,0|1,0,1]=3 237 B12R1.256 C[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5793896928 [0,0,0,0,1,0|1,0,1]=3 238 B12R1.256 C[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-1372649881 [0,0,0,0,1,0|3,0,0]=4 239 B12R1.256 C[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-3171936874 [0,0,0,0,1,0|3,0,0]=4 240 B12R1.256 C[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-4376836646 [0,0,0,0,1,0|3,0,0]=4 241 B12R1.256 C[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-7060626913 [0,0,0,0,1,0|3,0,0]=4 242 B12R1.256 C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3564509029 [0,0,0,0,1,0|2,0,1]=4 243 B12R1.256 C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5312653034 [0,0,0,0,1,0|2,0,1]=4 244 B12R1.256 C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7765486384 [0,0,0,0,1,0|2,0,1]=4 245 B12R1.256 C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8159986106 [0,0,0,0,1,0|2,0,1]=4 246 B12R1.256 N=C(N)C1=CC=C(C=C1)C(=O)O MCULE-1690764832 [0,0,0,0,1,0|3,0,0]=4 247 B12R1.256 N=C(N)C1=CC=C(C=C1)C(=O)O MCULE-1766318651 [0,0,0,0,1,0|3,0,0]=4 248 B12R1.256 NC(=O)C1=CC=C(C=C1)C(=O)N MCULE-5484173337 [0,0,0,0,1,0|3,0,0]=4 249 B12R1.256 NC(=O)C1=CC=C(C=C1)C(=O)O MCULE-9178311509 [0,0,0,0,1,0|2,0,0]=3 250 B12R1.256 NC(=O)C1=CC=C(C=C1)N(=O)=O MCULE-1333476668 [0,0,0,0,1,0|1,0,2]=4 251 B12R1.256 NC(=O)C1=CN=C(C=C1)C(=O)O MCULE-6235237840 [0,0,0,0,1,0|3,0,0]=4 252 B12R1.256 NC(=O)C1=NC=C(C=C1)C(=O)O MCULE-7859855927 [0,0,0,0,1,0|3,0,0]=4 253 B12R1.256 NC(=S)C1=CC=C(C=C1)C(=O)O MCULE-1300867261 [0,0,0,0,1,0|2,1,0]=4 254 B12R1.256 O=C(Cl)C1=CC=C(C=C1)C(=O)Cl MCULE-9481285116 [0,0,0,0,1,0|3,0,0]=4 255 B12R1.256 O=C(Cl)C1=CC=C(C=C1)N(=O)=O MCULE-7189136630 [0,0,0,0,1,0|1,0,2]=4 256 B12R1.256 O=C(O)C1=CC=C(C=C1)B(O)O MCULE-9853890632 [0,0,0,0,1,0|1,0,2]=4 257 B12R1.256 O=C(O)C1=CC=C(C=C1)C(=O)O MCULE-9289682931 [0,0,0,0,1,0|1,0,1]=3 258 B12R1.256 O=C(O)C1=CC=C(C=C1)C(Cl)Cl MCULE-9768639175 [0,0,0,0,1,0|3,0,0]=4 259 B12R1.256 O=C(O)C1=CC=C(C=C1)C(F)F MCULE-7512894897 [0,0,0,0,1,0|3,0,0]=4 260 B12R1.256 O=C(O)C1=CC=C(C=C1)N(=O)=O MCULE-9990648682 [0,0,0,0,1,0|0,0,2]=3 261 B12R1.256 O=C(O)C1=CN=C(C=C1)C(=O)O MCULE-4931082325 [0,0,0,0,1,0|2,0,1]=4 262 B12R1.256 O=C(O)C1=CN=C(C=C1)N(=O)=O MCULE-8627550710 [0,0,0,0,1,0|1,0,2]=4 263 B12R1.256 O=C(O)C1=NC=C(C=C1)N(=O)=O MCULE-2044098891 [0,0,0,0,1,0|1,0,2]=4 264 B12R1.256 O=C([O-])C1=CC=C(C=C1)C(=O)[O-] MCULE-1079660937 [0,0,0,0,1,0|1,0,1]=3 265 B12R1.256 O=C([O-])C1=CC=C(C=C1)N(=O)=O MCULE-7988147686 [0,0,0,0,1,0|0,0,3]=4 266 B12R1.256 O=C([O-])C1=CC=C(C=C1)N(=O)=O MCULE-8747988053 [0,0,0,0,1,0|0,0,3]=4 267 B12R1.256 O=C([O-])C1=CC=C(C=C1)N(=O)=O MCULE-9361105693 [0,0,0,0,1,0|0,0,3]=4 268 B12R1.256 O=N(=O)C1=CC=C(C=C1)S(=O)O MCULE-2646827231 [0,0,0,0,1,0|1,0,2]=4 269 B12R1.256 O=N(=O)C1=CC=C(C=C1)S(=O)[O-] MCULE-5448851448 [0,0,0,0,1,0|2,0,1]=4 270 B12R1.389 CC(=O)C1=CC(=CS1)CC(=O)O MCULE-2610249368 [0,0,0,0,1,0|3,0,0]=4 271 B12R1.389 CC(=O)C1=CC=C(S1)CC(=O)O MCULE-6553217374 [0,0,0,0,1,0|3,0,0]=4 272 B14R1.419 CC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-6606465558 [0,0,0,0,0,1|2,0,0]=3 273 B14R1.419 CC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-6308989130 [0,0,0,0,0,1|2,0,0]=3 274 B14R1.419 CC(=O)C1=CC=C(C=C1)OCC(=O)N MCULE-5217778352 [0,0,0,0,0,1|3,0,0]=4 275 B14R1.419 CC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1748099805 [0,0,0,0,0,1|2,0,0]=3 276 B14R1.419 CC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8806924824 [0,0,0,0,0,1|1,0,1]=3 277 B14R1.419 CC(=O)CCC1=CC=C(C=C1)C(=O)O MCULE-9852688164 [0,0,0,0,0,1|2,0,1]=4 278 B14R1.419 CC(=O)CCC1=CC=C(C=C1)N(=O)=O MCULE-3942852091 [0,0,0,0,0,1|1,0,2]=4 279 B14R1.419 CC(=O)COC1=CC=C(C=C1)C(=O)N MCULE-1657329216 [0,0,0,0,0,1|3,0,0]=4 280 B14R1.419 CC(=O)COC1=CC=C(C=C1)N(=O)=O MCULE-3436511080 [0,0,0,0,0,1|1,0,2]=4 281 B14R1.419 CC(=O)NCC1=CC=C(C=C1)C(=O)C MCULE-2270071283 [0,0,0,0,0,1|3,0,0]=4 282 B14R1.419 CC(=O)NCC1=CC=C(C=C1)C(=O)O MCULE-2944965321 [0,0,0,0,0,1|2,0,1]=4 283 B14R1.419 CC(=O)NCC1=CC=C(C=C1)N(=O)=O MCULE-4800469878 [0,0,0,0,0,1|1,0,2]=4 284 B14R1.419 CC(=O)OCC1=CC=C(C=C1)C(=O)O MCULE-7497414580 [0,0,0,0,0,1|2,0,1]=4 285 B14R1.419 CC(=O)OCC1=CC=C(C=C1)N(=O)=O MCULE-7509921863 [0,0,0,0,0,1|1,0,2]=4 286 B14R1.419 CC(C)C1=CC=C(C=C1)CCC(=O)O MCULE-3538060424 [0,0,0,0,0,1|3,0,0]=4 287 B14R1.419 CC(C)C1=CC=C(C=C1)OCC(=O)O MCULE-7142642080 [0,0,0,0,0,1|3,0,0]=4 288 B14R1.419 CC(C)C1=CC=C(C=C1)SCC(=O)O MCULE-5029055380 [0,0,0,0,0,1|3,0,0]=4 289 B14R1.419 CN(C)C1=CC=C(C=C1)CCC(=O)O MCULE-3604664882 [0,0,0,0,0,1|2,0,1]=4 290 B14R1.419 CN(C)C1=CC=C(C=C1)CCC(=O)O MCULE-9421060777 [0,0,0,0,0,1|2,0,1]=4 291 B14R1.419 CS(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-4112594230 [0,0,0,0,0,1|2,0,0]=3 292 B14R1.419 NC(=O)C1=CC=C(C=C1)C=CC(=O)O MCULE-3221603484 [0,0,0,0,0,1|2,0,1]=4 293 B14R1.419 NC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-1942357944 [0,0,0,0,0,1|2,0,0]=3 294 B14R1.419 NC(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-7853749088 [0,0,0,0,0,1|2,0,0]=3 295 B14R1.419 NC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1220330631 [0,0,0,0,0,1|2,0,0]=3 296 B14R1.419 NC(=O)C1=CN=C(C=C1)NCC(=O)O MCULE-9663263895 [0,0,0,0,0,1|3,0,0]=4 297 B14R1.419 NC(=O)CCC1=CC=C(C=C1)C(=O)O MCULE-9635325999 [0,0,0,0,0,1|2,0,1]=4 298 B14R1.419 NC(=O)CCC1=CC=C(C=C1)N(=O)=O MCULE-6043062927 [0,0,0,0,0,1|1,0,2]=4 299 B14R1.419 NC(=O)CNC1=CC=C(C=C1)C(=O)O MCULE-5857810007 [0,0,0,0,0,1|2,0,1]=4 300 B14R1.419 NC(=O)CNC1=CC=C(C=C1)N(=O)=O MCULE-2966234779 [0,0,0,0,0,1|1,0,2]=4 301 B14R1.419 NC(=O)COC1=CC=C(C=C1)C(=O)N MCULE-8335796005 [0,0,0,0,0,1|3,0,0]=4 302 B14R1.419 NC(=O)COC1=CC=C(C=C1)C(=O)O MCULE-9010748774 [0,0,0,0,0,1|2,0,1]=4 303 B14R1.419 NC(=O)COC1=CC=C(C=C1)N(=O)=O MCULE-8784074900 [0,0,0,0,0,1|1,0,2]=4 304 B14R1.419 NC(=O)NCC1=CC=C(C=C1)C(=O)O MCULE-4266089132 [0,0,0,0,0,1|2,0,1]=4 305 B14R1.419 NC(=O)OCC1=CC=C(C=C1)N(=O)=O MCULE-8617058304 [0,0,0,0,0,1|1,0,2]=4 306 B14R1.419 O=C(Cl)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6021155359 [0,0,0,0,0,1|1,0,1]=3 307 B14R1.419 O=C(Cl)CCC1=CC=C(C=C1)N(=O)=O MCULE-5123598647 [0,0,0,0,0,1|1,0,2]=4 308 B14R1.419 O=C(Cl)COC1=CC=C(C=C1)N(=O)=O MCULE-4883867299 [0,0,0,0,0,1|1,0,2]=4 309 B14R1.419 O=C(Cl)OCC1=CC=C(C=C1)N(=O)=O MCULE-1101457882 [0,0,0,0,0,1|1,0,2]=4 310 B14R1.419 O=C(O)/C=C/C1=CC=C(C=C1)C(=O)O MCULE-1556557733 [0,0,0,0,0,1|1,0,2]=4 311 B14R1.419 O=C(O)/C=C/C1=CC=C(C=C1)N(=O)=O MCULE-1003929141 [0,0,0,0,0,1|0,0,3]=4 312 B14R1.419 O=C(O)C#CC1=CC=C(C=C1)C(=O)O MCULE-1712555337 [0,0,0,0,0,1|1,0,2]=4 313 B14R1.419 O=C(O)C#CC1=CC=C(C=C1)N(=O)=O MCULE-2828439530 [0,0,0,0,0,1|0,0,3]=4 314 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)C(=O)O MCULE-8546356772 [0,0,0,0,0,1|1,0,2]=4 315 B14R1.419 O=C(O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-9027320436 [0,0,0,0,0,1|0,0,1]=2 316 B14R1.419 O=C(O)CCC1=CC=C(C=C1)B(O)O MCULE-4027092502 [0,0,0,0,0,1|1,0,2]=4 317 B14R1.419 O=C(O)CCC1=CC=C(C=C1)C(=O)O MCULE-9352979588 [0,0,0,0,0,1|1,0,1]=3 318 B14R1.419 O=C(O)CCC1=CC=C(C=C1)C(F)F MCULE-4816732931 [0,0,0,0,0,1|3,0,0]=4 319 B14R1.419 O=C(O)CCC1=CC=C(C=C1)N(=O)=O MCULE-7564556532 [0,0,0,0,0,1|0,0,2]=3 320 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-7640246804 [0,0,0,0,0,1|1,0,1]=3 321 B14R1.419 O=C(O)CNC1=CC=C(C=C1)C(=O)O MCULE-8996993209 [0,0,0,0,0,1|1,0,1]=3 322 B14R1.419 O=C(O)CNC1=CC=C(C=C1)N(=O)=O MCULE-3622411298 [0,0,0,0,0,1|0,0,2]=3 323 B14R1.419 O=C(O)CNC1=NC=C(C=C1)N(=O)=O MCULE-7960722006 [0,0,0,0,0,1|1,0,2]=4 324 B14R1.419 O=C(O)COC1=CC=C(C=C1)B(O)O MCULE-8102752710 [0,0,0,0,0,1|1,0,2]=4 325 B14R1.419 O=C(O)COC1=CC=C(C=C1)C(=O)O MCULE-2855315257 [0,0,0,0,0,1|1,0,1]=3 326 B14R1.419 O=C(O)COC1=CC=C(C=C1)N(=O)=O MCULE-4354028178 [0,0,0,0,0,1|0,0,2]=3 327 B14R1.419 O=C(O)CSC1=CC=C(C=C1)N(=O)=O MCULE-4016627330 [0,0,0,0,0,1|0,0,2]=3 328 B14R1.419 O=[N+]([O-])C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1340524704 [0,0,0,0,0,1|1,0,2]=4 329 B14R1.805 CC(=O)CC1=CC=C(C=C1)NC(=O)C MCULE-4281899235 [0,0,0,0,0,1|3,0,0]=4 330 B14R1.805 CC(=O)NC1=CC=C(C=C1)CC(=O)O MCULE-7045967741 [0,0,0,0,0,1|2,0,0]=3 331 B14R1.805 CC(=O)OC1=CC=C(C=C1)CC(=O)O MCULE-5606823269 [0,0,0,0,0,1|2,0,0]=3 332 B14R1.805 CC(C)CC1=CC=C(C=C1)CC(=O)O MCULE-9215319549 [0,0,0,0,0,1|3,0,0]=4 333 B14R1.805 CC(C)OC1=CC=C(C=C1)CC(=O)O MCULE-7963457895 [0,0,0,0,0,1|3,0,0]=4 334 B14R1.805 CC(C)SC1=CC=C(C=C1)CC(=O)O MCULE-1111837201 [0,0,0,0,0,1|3,0,0]=4 335 B14R1.805 CN(C)CC1=CC=C(C=C1)CC(=O)O MCULE-4462021956 [0,0,0,0,0,1|2,0,1]=4 336 B14R1.805 CN(C)CC1=CC=C(C=C1)CC(=O)O MCULE-9097366174 [0,0,0,0,0,1|2,0,1]=4 337 B14R1.805 NC(=O)CC1=CC=C(C=C1)CC(=O)N MCULE-1448389808 [0,0,0,0,0,1|3,0,0]=4 338 B14R1.805 NC(=O)NC1=CC=C(C=C1)CC(=O)O MCULE-9936363602 [0,0,0,0,0,1|2,0,0]=3 339 B14R1.805 O=C(O)CC1=CC=C(C=C1)CC(=O)O MCULE-1758863091 [0,0,0,0,0,1|1,0,1]=3 340 B14R1.805 O=C(O)CC1=CC=C(C=C1)OC(F)F MCULE-1239437706 [0,0,0,0,0,1|3,0,0]=4 341 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br MCULE-2796276312 [2,0,0,0,0,0|2,0,0]=4 342 B11R1.20 CC(=O)CC1=CC=C(C=C1)C MCULE-9432147559 [2,0,0,0,0,0|2,0,0]=4 343 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl MCULE-3336422329 [2,0,0,0,0,0|2,0,0]=4 344 B11R1.20 CC(=O)CC1=CC=C(C=C1)F MCULE-7867529938 [2,0,0,0,0,0|2,0,0]=4 345 B11R1.20 CC(=O)CC1=CC=C(C=C1)I MCULE-4302219477 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.20 CC(=O)CC1=CC=C(C=C1)N MCULE-8992401567 [2,0,0,0,0,0|1,0,1]=4 347 B11R1.20 CC(=O)CC1=CC=C(C=C1)O MCULE-1295731157 [2,0,0,0,0,0|1,0,1]=4 348 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 MCULE-9623129492 [2,0,0,0,0,0|2,0,0]=4 349 B11R1.20 CC1=CC=C(C=C1)CC(=O)Cl MCULE-8548926281 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.20 CC1=CC=C(C=C1)CC(=O)O MCULE-7836754263 [2,0,0,0,0,0|1,0,0]=3 351 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-4500305633 [2,0,0,0,0,0|2,0,0]=4 352 B11R1.20 CC1=CN=C(C=C1)CC(=O)O MCULE-6746029360 [2,0,0,0,0,0|2,0,0]=4 353 B11R1.20 CC1=NC=C(C=C1)CC(=O)O MCULE-1929752400 [2,0,0,0,0,0|2,0,0]=4 354 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br MCULE-6494224473 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl MCULE-5575880469 [2,0,0,0,0,0|2,0,0]=4 356 B11R1.20 NC(=O)CC1=CC=C(C=C1)F MCULE-5260225130 [2,0,0,0,0,0|2,0,0]=4 357 B11R1.20 NC(=O)CC1=CC=C(C=C1)I MCULE-5828221034 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.20 NC(=O)CC1=CC=C(C=C1)N MCULE-3368755597 [2,0,0,0,0,0|1,0,1]=4 359 B11R1.20 NC(=O)CC1=CC=C(C=C1)O MCULE-9884834100 [2,0,0,0,0,0|1,0,1]=4 360 B11R1.20 NC1=CC=C(C=C1)CC(=O)O MCULE-7171963222 [2,0,0,0,0,0|0,0,1]=3 361 B11R1.20 NC1=CC=C(C=C1)CC(=S)O MCULE-7097123857 [2,0,0,0,0,0|0,1,1]=4 362 B11R1.20 NC1=CC=C(C=N1)CC(=O)O MCULE-6419974192 [2,0,0,0,0,0|1,0,1]=4 363 B11R1.20 NC1=CN=C(C=C1)CC(=O)O MCULE-6727372902 [2,0,0,0,0,0|1,0,1]=4 364 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Br MCULE-1088437289 [2,0,0,0,0,0|2,0,0]=4 365 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl MCULE-5852291690 [2,0,0,0,0,0|2,0,0]=4 366 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)F MCULE-9707670299 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)I MCULE-1084666200 [2,0,0,0,0,0|2,0,0]=4 368 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br MCULE-8300414581 [2,0,0,0,0,0|1,0,0]=3 369 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl MCULE-1634058139 [2,0,0,0,0,0|1,0,0]=3 370 B11R1.20 O=C(O)CC1=CC=C(C=C1)F MCULE-8246447237 [2,0,0,0,0,0|1,0,0]=3 371 B11R1.20 O=C(O)CC1=CC=C(C=C1)I MCULE-1221154743 [2,0,0,0,0,0|1,0,0]=3 372 B11R1.20 O=C(O)CC1=CC=C(C=C1)O MCULE-7254180433 [2,0,0,0,0,0|0,0,1]=3 373 B11R1.20 O=C(O)CC1=CC=C(C=C1)S MCULE-8771795045 [2,0,0,0,0,0|0,1,0]=3 374 B11R1.20 O=C(O)CC1=CC=C(N=C1)Br MCULE-5955108459 [2,0,0,0,0,0|2,0,0]=4 375 B11R1.20 O=C(O)CC1=CC=C(N=C1)Cl MCULE-8148043601 [2,0,0,0,0,0|2,0,0]=4 376 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 MCULE-7521356508 [2,0,0,0,0,0|1,0,0]=3 377 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-5682923665 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.20 O=C(O)CC1=NC=C(C=C1)Br MCULE-6438430612 [2,0,0,0,0,0|2,0,0]=4 379 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-2200072147 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.20 O=C(O)CC1=NC=C(C=C1)Cl MCULE-9214741763 [2,0,0,0,0,0|2,0,0]=4 381 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-2871798928 [2,0,0,0,0,0|2,0,0]=4 382 B11R1.20 O=C(O)CC1=NC=C(C=C1)F MCULE-6124722524 [2,0,0,0,0,0|2,0,0]=4 383 B11R1.20 O=C(O)CC1=NC=C(C=C1)I MCULE-5351430465 [2,0,0,0,0,0|2,0,0]=4 384 B11R1.20 O=C(O)CC1=NC=C(C=C1)O MCULE-3180190519 [2,0,0,0,0,0|1,0,1]=4 385 B11R1.20 O=C(O)CC1=NNC(=O)C=C1 MCULE-9531239734 [2,0,0,0,0,0|2,0,0]=4 386 B11R1.20 O=C([O-])CC1=CC=C(C=C1)F MCULE-7645691765 [2,0,0,0,0,0|1,0,1]=4 387 B11R1.20 O=C1C=CN(C=C1)CC(=O)O MCULE-1041841208 [2,0,0,0,0,0|1,0,0]=3 388 B11R1.83 C=CCC1=CC=C(C=C1)C=O MCULE-6894916308 [2,0,0,0,0,0|2,0,0]=4 389 B11R1.83 CCC1=CC=C(C=C1)CC=O MCULE-2474839507 [2,0,0,0,0,0|2,0,0]=4 390 B11R1.83 COC1=CC=C(C=C1)CC=O MCULE-1804738431 [2,0,0,0,0,0|2,0,0]=4 391 B11R1.83 CSC1=CC=C(C=C1)CC=O MCULE-8315732838 [2,0,0,0,0,0|2,0,0]=4 392 B11R1.83 N#CC1=CC=C(C=C1)CC=O MCULE-7565665949 [2,0,0,0,0,0|2,0,0]=4 393 B11R1.83 O=CC1=CC=C(C=C1)CCO MCULE-7870003381 [2,0,0,0,0,0|1,0,1]=4 394 B11R1.83 O=CCC1=CC=C(C=C1)CCl MCULE-2630776820 [2,0,0,0,0,0|2,0,0]=4 395 B11R1.3 CC(=O)C1=CC=C(C=C1)C=O MCULE-7131909990 [2,0,0,0,0,0|2,0,0]=4 396 B11R1.3 CC(=O)C1=CC=C(C=C1)CO MCULE-7449170575 [2,0,0,0,0,0|2,0,0]=4 397 B11R1.3 CCC1=CC=C(C=C1)S(=O)[O-] MCULE-7501057295 [2,0,0,0,0,0|1,0,1]=4 398 B11R1.3 CS(=O)C1=CC=C(C=C1)C=O MCULE-5119080204 [2,0,0,0,0,0|2,0,0]=4 399 B11R1.3 NC(=O)C1=CC=C(C=C1)C=O MCULE-8386199112 [2,0,0,0,0,0|2,0,0]=4 400 B11R1.3 NC(=O)C1=CC=C(C=C1)CO MCULE-1460211543 [2,0,0,0,0,0|2,0,0]=4 401 B11R1.3 O=C(O)C1=CC=C(C=C1)CO MCULE-9885454652 [2,0,0,0,0,0|1,0,1]=4 402 B11R1.3 O=CC1=CC=C(C=C1)C(=O)Cl MCULE-4945590337 [2,0,0,0,0,0|2,0,0]=4 403 B11R1.3 O=CC1=CC=C(C=C1)C(=O)O MCULE-2960554549 [2,0,0,0,0,0|1,0,1]=4 404 B11R1.3 O=CC1=CC=C(C=C1)C(=O)[O-] MCULE-2035634959 [2,0,0,0,0,0|1,0,0]=3 405 B11R1.3 O=CC1=CC=C(C=C1)N(=O)=O MCULE-1359316508 [2,0,0,0,0,0|0,0,2]=4 406 B11R1.3 O=N(=O)C1=CC=C(C=C1)CO MCULE-2487170035 [2,0,0,0,0,0|0,0,2]=4 407 B13R1.5 C#CC1=CC=C(C=C1)CC(=O)OC MCULE-2062060452 [1,1,0,0,0,0|2,0,0]=4 408 B13R1.5 C=CC1=CC=C(C=C1)CC(=O)OC MCULE-7492571505 [1,1,0,0,0,0|2,0,0]=4 409 B13R1.5 CCC1=CC=C(C=C1)CC(=O)OC MCULE-1197604686 [1,1,0,0,0,0|2,0,0]=4 410 B13R1.5 CNC1=CC=C(C=C1)CC(=O)OC MCULE-5643959588 [1,1,0,0,0,0|1,0,1]=4 411 B13R1.5 COC(=O)CC1=CC=C(C=C1)C#N MCULE-2294464151 [1,1,0,0,0,0|2,0,0]=4 412 B13R1.5 COC(=O)CC1=CC=C(C=C1)C=O MCULE-5988958314 [1,1,0,0,0,0|1,0,0]=3 413 B13R1.5 COC(=O)CC1=CC=C(C=C1)CBr MCULE-1519101796 [1,1,0,0,0,0|2,0,0]=4 414 B13R1.5 COC(=O)CC1=CC=C(C=C1)CCl MCULE-4344469590 [1,1,0,0,0,0|2,0,0]=4 415 B13R1.5 COC(=O)CC1=CC=C(C=C1)CN MCULE-4965814987 [1,1,0,0,0,0|2,0,0]=4 416 B13R1.5 COC(=O)CC1=CC=C(C=C1)CN MCULE-9146601821 [1,1,0,0,0,0|2,0,0]=4 417 B13R1.5 COC(=O)CC1=CC=C(C=C1)CO MCULE-8018406257 [1,1,0,0,0,0|1,0,1]=4 418 B13R1.5 COC(=O)CC1=CC=C(C=C1)NN MCULE-3773310534 [1,1,0,0,0,0|1,0,1]=4 419 B13R1.5 COC(=O)CC1=CC=C(C=C1)NN MCULE-5536917821 [1,1,0,0,0,0|1,0,1]=4 420 B13R1.5 COC(=O)CC1=CC=C(C=C1)OC MCULE-4770734024 [1,1,0,0,0,0|2,0,0]=4 421 B13R1.5 COC(=O)CC1=CC=C(C=C1)SC MCULE-8659749255 [1,1,0,0,0,0|2,0,0]=4 422 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Br MCULE-6125953891 [1,1,0,0,0,0|2,0,0]=4 423 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)C MCULE-5278942848 [1,1,0,0,0,0|2,0,0]=4 424 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Cl MCULE-5566391995 [1,1,0,0,0,0|2,0,0]=4 425 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)F MCULE-9520654638 [1,1,0,0,0,0|2,0,0]=4 426 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)N MCULE-1361198594 [1,1,0,0,0,0|2,0,0]=4 427 B13R1.35 COC1=CC=C(C=C1O)CC(=O)O MCULE-5933449235 [1,1,0,0,0,0|2,0,0]=4 428 B13R1.35 CSC1=CC=C(C=C1Br)CC(=O)O MCULE-4752007515 [1,1,0,0,0,0|2,0,0]=4 429 B13R1.35 CSC1=CC=C(C=C1C)CC(=O)O MCULE-2907765038 [1,1,0,0,0,0|2,0,0]=4 430 B13R1.35 CSC1=CC=C(C=C1Cl)CC(=O)O MCULE-6006427232 [1,1,0,0,0,0|2,0,0]=4 431 B13R1.35 CSC1=CC=C(C=C1F)CC(=O)O MCULE-8411006519 [1,1,0,0,0,0|2,0,0]=4 432 B13R1.35 N#CC1=C(C=C(C=C1)CC(=O)O)Br MCULE-6268578762 [1,1,0,0,0,0|2,0,0]=4 433 B13R1.35 N#CC1=CC=C(C=C1Cl)CC(=O)O MCULE-9702653885 [1,1,0,0,0,0|2,0,0]=4 434 B13R1.35 N#CC1=CC=C(C=C1F)CC(=O)O MCULE-4253475220 [1,1,0,0,0,0|2,0,0]=4 435 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)C#N MCULE-7219839594 [1,1,0,0,0,0|2,0,0]=4 436 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)C=O MCULE-4798784727 [1,1,0,0,0,0|1,0,0]=3 437 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)CBr MCULE-3500985708 [1,1,0,0,0,0|2,0,0]=4 438 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)CCl MCULE-9324884677 [1,1,0,0,0,0|2,0,0]=4 439 B13R1.36 CCC1=CC=C(C=C1)C(C)C(=O)O MCULE-2241556211 [1,1,0,0,0,0|2,0,0]=4 440 B13R1.36 CCC1=CC=C(C=C1)C(N)C(=O)O MCULE-2471078114 [1,1,0,0,0,0|2,0,0]=4 441 B13R1.36 CCC1=CC=C(C=C1)C(O)C(=O)O MCULE-3750172697 [1,1,0,0,0,0|2,0,0]=4 442 B13R1.36 COC1=CC=C(C=C1)C(Br)C(=O)O MCULE-9882705294 [1,1,0,0,0,0|2,0,0]=4 443 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O MCULE-3271823908 [1,1,0,0,0,0|2,0,0]=4 444 B13R1.36 COC1=CC=C(C=C1)C(F)C(=O)O MCULE-3928324349 [1,1,0,0,0,0|2,0,0]=4 445 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O MCULE-6547601332 [1,1,0,0,0,0|2,0,0]=4 446 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O MCULE-8406708308 [1,1,0,0,0,0|2,0,0]=4 447 B13R1.36 COC1=CC=C(C=C1)C(O)C(=O)O MCULE-2468839753 [1,1,0,0,0,0|2,0,0]=4 448 B13R1.36 COC1=CC=C(C=C1)C(O)C(=O)O MCULE-3558912620 [1,1,0,0,0,0|2,0,0]=4 449 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-1755446407 [1,1,0,0,0,0|2,0,0]=4 450 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-4155221741 [1,1,0,0,0,0|2,0,0]=4 451 B13R1.36 COC1=CC=C(C=C1)[C@@H](N)C(=O)O MCULE-8832989274 [1,1,0,0,0,0|2,0,0]=4 452 B13R1.36 COC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-5122633702 [1,1,0,0,0,0|2,0,0]=4 453 B13R1.36 COC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-9845559956 [1,1,0,0,0,0|2,0,0]=4 454 B13R1.36 COC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-4289161147 [1,1,0,0,0,0|2,0,0]=4 455 B13R1.36 COC1=CC=C(C=C1)[C@H](C)C(=O)O MCULE-9964310661 [1,1,0,0,0,0|2,0,0]=4 456 B13R1.36 COC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-4196789392 [1,1,0,0,0,0|2,0,0]=4 457 B13R1.36 COC1=CC=C(C=C1)[C@H](N)C(=O)O MCULE-7788610808 [1,1,0,0,0,0|2,0,0]=4 458 B13R1.36 COC1=CC=C(C=C1)[C@H](O)C(=O)O MCULE-5426171312 [1,1,0,0,0,0|2,0,0]=4 459 B13R1.36 COC1=CC=C(C=C1)[C@H](O)C(=O)O MCULE-7024031381 [1,1,0,0,0,0|2,0,0]=4 460 B13R1.36 CSC1=CC=C(C=C1)C(N)C(=O)O MCULE-3251314994 [1,1,0,0,0,0|2,0,0]=4 461 B13R1.36 CSC1=CC=C(C=C1)C(N)C(=O)O MCULE-8367251118 [1,1,0,0,0,0|2,0,0]=4 462 B13R1.36 CSC1=CC=C(C=C1)[C@@H](O)C(=O)O MCULE-3256062833 [1,1,0,0,0,0|2,0,0]=4 463 B13R1.36 N#CC1=CC=C(C=C1)C(N)C(=O)O MCULE-8258435466 [1,1,0,0,0,0|2,0,0]=4 464 B13R1.36 N#CC1=CC=C(C=C1)C(O)C(=O)O MCULE-2477335074 [1,1,0,0,0,0|2,0,0]=4 465 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO MCULE-3378388885 [1,1,0,0,0,0|1,0,1]=4 466 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO MCULE-6327147062 [1,1,0,0,0,0|1,0,1]=4 467 B13R1.142 CCCC1=CC=C(C=C1)CC(=O)O MCULE-9128885025 [1,1,0,0,0,0|2,0,0]=4 468 B13R1.142 CCOC1=CC=C(C=C1)CC(=O)O MCULE-4210436364 [1,1,0,0,0,0|2,0,0]=4 469 B13R1.142 CCSC1=CC=C(C=C1)CC(=O)O MCULE-4977243327 [1,1,0,0,0,0|2,0,0]=4 470 B13R1.142 CNCC1=CC=C(C=C1)CC(=O)O MCULE-6028981663 [1,1,0,0,0,0|1,0,1]=4 471 B13R1.142 CNCC1=CC=C(C=C1)CC(=O)O MCULE-7849529309 [1,1,0,0,0,0|1,0,1]=4 472 B13R1.142 COCC1=CC=C(C=C1)CC(=O)O MCULE-6023407572 [1,1,0,0,0,0|1,0,1]=4 473 B13R1.142 N#N=NC1=CC=C(C=C1)CC(=O)O MCULE-9643697003 [1,1,0,0,0,0|1,0,1]=4 474 B13R1.142 NCCC1=CC=C(C=C1)CC(=O)O MCULE-6158338693 [1,1,0,0,0,0|2,0,0]=4 475 B13R1.142 NCCC1=CC=C(C=C1)CC(=O)O MCULE-6494340895 [1,1,0,0,0,0|2,0,0]=4 476 B13R1.142 O=C(O)CC1=CC=C(C=C1)N=C=S MCULE-6300833252 [1,1,0,0,0,0|0,1,1]=4 477 B13R1.142 O=CNC1=CC=C(C=C1)CC(=O)O MCULE-6981310987 [1,1,0,0,0,0|0,0,1]=3 478 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)Br MCULE-7081259902 [1,1,0,0,0,0|2,0,0]=4 479 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)C MCULE-2111628657 [1,1,0,0,0,0|2,0,0]=4 480 B13R1.653 COC1=CC(=C(C=C1)CC(=O)O)Cl MCULE-7999064615 [1,1,0,0,0,0|2,0,0]=4 481 B13R1.653 COC1=CC=C(C(=C1)F)CC(=O)O MCULE-2667546868 [1,1,0,0,0,0|2,0,0]=4 482 B13R1.653 N#CC1=CC(=C(C=C1)CC(=O)O)F MCULE-3906255177 [1,1,0,0,0,0|2,0,0]=4 483 B13R1.653 N#CC1=CC=C(C(=C1)I)CC(=O)O MCULE-2375218823 [1,1,0,0,0,0|2,0,0]=4 484 B13R1.74 N#CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-2485445720 [1,1,0,0,0,0|1,0,1]=4 485 B13R1.74 O=CC=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6924839107 [1,1,0,0,0,0|0,0,1]=3 486 B13R1.74 O=CCOC1=CC=C(C=C1)N(=O)=O MCULE-2266537015 [1,1,0,0,0,0|0,0,2]=4 487 B13R1.74 O=[N+]([O-])C1=CC=C(C=C1)C=CCBr MCULE-2389061763 [1,1,0,0,0,0|1,0,1]=4 488 B13R1.74 O=[N+]([O-])C1=CC=C(C=C1)C=CCO MCULE-5310040655 [1,1,0,0,0,0|0,0,1]=3 489 B13R1.139 COC(=O)C1=CC=C(C=C1)CC=O MCULE-7160742414 [1,1,0,0,0,0|1,0,1]=4 490 B13R1.140 CS(=O)(=O)C1=CC=C(C=C1)CC=O MCULE-7164601578 [1,1,0,0,0,0|1,0,1]=4 491 B13R1.144 CC1=CC(=CC=C1CC=O)N(=O)=O MCULE-3193473072 [1,1,0,0,0,0|0,0,2]=4 492 B13R1.537 C=C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1581250549 [1,1,0,0,0,0|1,0,0]=3 493 B13R1.537 C=C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7978039982 [1,1,0,0,0,0|1,0,0]=3 494 B13R1.537 C=C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6552703827 [1,1,0,0,0,0|1,0,0]=3 495 B13R1.537 C=C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7505281688 [1,1,0,0,0,0|1,0,0]=3 496 B13R1.537 CC(=NO)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8424563363 [1,1,0,0,0,0|1,0,1]=4 497 B13R1.537 CC[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1582688706 [1,1,0,0,0,0|1,0,1]=4 498 B13R1.537 CC[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-4952494938 [1,1,0,0,0,0|1,0,1]=4 499 B13R1.537 CC[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2795574321 [1,1,0,0,0,0|1,0,1]=4 500 B13R1.537 CC[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7934787852 [1,1,0,0,0,0|1,0,1]=4 501 B13R1.537 NC[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1365837107 [1,1,0,0,0,0|1,0,1]=4 502 B13R1.537 NC[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6004332501 [1,1,0,0,0,0|1,0,1]=4 503 B13R1.537 NC[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6012450204 [1,1,0,0,0,0|1,0,1]=4 504 B13R1.537 NC[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8025876724 [1,1,0,0,0,0|1,0,1]=4 505 B13R1.537 N[C@@H](CF)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7258610701 [1,1,0,0,0,0|1,0,1]=4 506 B13R1.537 N[C@@H](CF)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8021965111 [1,1,0,0,0,0|1,0,1]=4 507 B13R1.537 N[C@@H](CO)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5728777136 [1,1,0,0,0,0|0,0,1]=3 508 B13R1.537 N[C@@H](CO)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6455725916 [1,1,0,0,0,0|0,0,1]=3 509 B13R1.537 N[C@H](CF)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2555815703 [1,1,0,0,0,0|1,0,1]=4 510 B13R1.537 N[C@H](CF)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-4815876140 [1,1,0,0,0,0|1,0,1]=4 511 B13R1.537 N[C@H](CO)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1432000685 [1,1,0,0,0,0|0,0,1]=3 512 B13R1.537 N[C@H](CO)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6054457500 [1,1,0,0,0,0|0,0,1]=3 513 B13R1.537 O=CC(Cl)C1=CC=C(C=C1)N(=O)=O MCULE-9532527340 [1,1,0,0,0,0|0,0,2]=4 514 B13R1.537 O=[N+]([O-])C1=CC=C(C=C1)C(=NO)Cl MCULE-2989829970 [1,1,0,0,0,0|1,0,1]=4 515 B13R1.120 CC(=O)C1=C(C=C(C=C1)C(=O)O)C MCULE-1660503700 [0,1,0,0,1,0|2,0,0]=4 516 B13R1.120 CC(=O)C1=C(C=C(C=C1)C(=O)O)F MCULE-2280318686 [0,1,0,0,1,0|2,0,0]=4 517 B13R1.120 CC(=O)C1=C(C=C(C=C1)C(=O)O)O MCULE-3189776967 [0,1,0,0,1,0|2,0,0]=4 518 B13R1.120 CC(=O)C1=CC(=C(C=C1)C(=O)O)Br MCULE-7759594136 [0,1,0,0,1,0|2,0,0]=4 519 B13R1.120 CC(=O)C1=CC(=C(C=C1)C(=O)O)C MCULE-8106845657 [0,1,0,0,1,0|2,0,0]=4 520 B13R1.120 CC(=O)C1=CC(=C(C=C1)C(=O)O)F MCULE-6126725448 [0,1,0,0,1,0|2,0,0]=4 521 B13R1.120 CC(=O)C1=CC=C(C(=C1)Cl)C(=O)O MCULE-5860267931 [0,1,0,0,1,0|2,0,0]=4 522 B13R1.120 CC(=O)C1=CC=C(C(=C1)I)C(=O)O MCULE-3399664093 [0,1,0,0,1,0|2,0,0]=4 523 B13R1.120 CC(=O)C1=CC=C(C(=C1)O)C(=O)O MCULE-3118780503 [0,1,0,0,1,0|2,0,0]=4 524 B13R1.120 CC(=O)C1=CC=C(C=C1Cl)C(=O)O MCULE-2828882135 [0,1,0,0,1,0|2,0,0]=4 525 B13R1.120 CC1=C(C=CC(=C1)C(=O)N)C(=O)O MCULE-5514089781 [0,1,0,0,1,0|2,0,0]=4 526 B13R1.120 CC1=C(C=CC(=C1)N(=O)=O)C(=O)O MCULE-7892247166 [0,1,0,0,1,0|0,0,2]=4 527 B13R1.120 CC1=CC(=CC=C1C(=O)O)C(=O)O MCULE-1893993072 [0,1,0,0,1,0|1,0,1]=4 528 B13R1.120 CC1=CC(=CC=C1N(=O)=O)C(=O)O MCULE-3101826203 [0,1,0,0,1,0|0,0,2]=4 529 B13R1.120 CS(=O)C1=CC=C(C=C1F)C(=O)O MCULE-6079743593 [0,1,0,0,1,0|2,0,0]=4 530 B13R1.120 C[C@@H](O)C1=CC(=C(C=C1)[N+](=O)[O-])F MCULE-2485895864 [0,1,0,0,1,0|1,0,1]=4 531 B13R1.120 C[C@H](O)C1=CC(=C(C=C1)[N+](=O)[O-])F MCULE-9644514031 [0,1,0,0,1,0|1,0,1]=4 532 B13R1.120 C[C@H](O)C1=CC=C(C(=C1)F)[N+](=O)[O-] MCULE-3416502820 [0,1,0,0,1,0|1,0,1]=4 533 B13R1.120 NC(=O)C1=C(C=C(C=C1)C(=O)O)Br MCULE-8779057196 [0,1,0,0,1,0|2,0,0]=4 534 B13R1.120 NC(=O)C1=CC=C(C(=C1)F)C(=O)O MCULE-3683640545 [0,1,0,0,1,0|2,0,0]=4 535 B13R1.120 NC1=C(C=CC(=C1)C(=O)O)N(=O)=O MCULE-4092802913 [0,1,0,0,1,0|0,0,2]=4 536 B13R1.120 NC1=CC(=CC=C1C(=O)O)C(=O)O MCULE-3257908313 [0,1,0,0,1,0|1,0,1]=4 537 B13R1.120 NC1=CC(=CC=C1C(=O)O)N(=O)=O MCULE-1086407001 [0,1,0,0,1,0|0,0,2]=4 538 B13R1.120 O=C(O)C1=C(C=C(C=C1)N(=O)=O)Br MCULE-3876670446 [0,1,0,0,1,0|0,0,2]=4 539 B13R1.120 O=C(O)C1=C(C=C(C=C1)N(=O)=O)F MCULE-6080271807 [0,1,0,0,1,0|0,0,2]=4 540 B13R1.120 O=C(O)C1=C(C=C(C=C1)N(=O)=O)I MCULE-4131160701 [0,1,0,0,1,0|0,0,2]=4 541 B13R1.120 O=C(O)C1=C(C=C(C=C1)N(=O)=O)O MCULE-9961533581 [0,1,0,0,1,0|0,0,2]=4 542 B13R1.120 O=C(O)C1=CC(=C(C=C1)C(=O)O)O MCULE-2441895054 [0,1,0,0,1,0|1,0,1]=4 543 B13R1.120 O=C(O)C1=CC(=C(C=C1)N(=O)=O)Cl MCULE-6717081738 [0,1,0,0,1,0|0,0,2]=4 544 B13R1.120 O=C(O)C1=CC(=C(C=C1)N(=O)=O)F MCULE-4830159713 [0,1,0,0,1,0|0,0,2]=4 545 B13R1.120 O=C(O)C1=CC(=C(C=C1)N(=O)=O)O MCULE-1756105077 [0,1,0,0,1,0|0,0,2]=4 546 B13R1.120 O=C(O)C1=CC(=C(C=C1)N(=O)=O)S MCULE-8363968142 [0,1,0,0,1,0|0,0,2]=4 547 B13R1.120 O=C(O)C1=CC=C(C(=C1)Br)C(=O)O MCULE-9107598887 [0,1,0,0,1,0|1,0,1]=4 548 B13R1.120 O=C(O)C1=CC=C(C(=C1)Br)N(=O)=O MCULE-4511175552 [0,1,0,0,1,0|0,0,2]=4 549 B13R1.120 O=C(O)C1=CC=C(C(=C1)Cl)C(=O)O MCULE-8536270656 [0,1,0,0,1,0|1,0,1]=4 550 B13R1.120 O=C(O)C1=CC=C(C(=C1)F)C(=O)O MCULE-8627057109 [0,1,0,0,1,0|1,0,1]=4 551 B13R1.120 O=C(O)C1=CC=C(C(=C1)I)C(=O)O MCULE-3394871951 [0,1,0,0,1,0|1,0,1]=4 552 B13R1.120 O=C(O)C1=CC=C(C=C1Cl)N(=O)=O MCULE-2491347010 [0,1,0,0,1,0|0,0,2]=4 553 B13R1.338 CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-] MCULE-3393438429 [0,1,0,0,1,0|2,0,0]=4 554 B13R1.338 CC(=O)C1=CC=C(C=C1)S(=O)(=O)[O-] MCULE-9924847410 [0,1,0,0,1,0|2,0,0]=4 555 B13R1.338 CP(=O)(C)C1=CC=C(C=C1)C(=O)O MCULE-1106314052 [0,1,0,0,1,0|1,1,0]=4 556 B13R1.338 CS(=N)(=O)C1=CC=C(C=C1)C(=O)O MCULE-5884159371 [0,1,0,0,1,0|2,0,0]=4 557 B13R1.338 CS(=O)(=O)C1=CC=C(C=C1)C(=O)O MCULE-1053721443 [0,1,0,0,1,0|1,0,1]=4 558 B13R1.338 NS(=O)(=O)C1=CC=C(C=C1)C(=O)O MCULE-1656100749 [0,1,0,0,1,0|1,0,1]=4 559 B13R1.338 O=C(O)C1=CC=C(C=C1)P(=O)(O)O MCULE-7355944932 [0,1,0,0,1,0|0,1,1]=4 560 B13R1.338 O=C(O)C1=CC=C(C=C1)S(=O)(=O)Cl MCULE-1842819262 [0,1,0,0,1,0|1,0,1]=4 561 B13R1.338 O=C(O)C1=CC=C(C=C1)S(=O)(=O)F MCULE-6672028464 [0,1,0,0,1,0|1,0,1]=4 562 B13R1.338 O=C(O)C1=CC=C(C=C1)S(=O)(=O)O MCULE-7296245027 [0,1,0,0,1,0|1,0,1]=4 563 B13R1.338 O=C([O-])C1=CC=C(C=C1)S(=O)(=O)O MCULE-7235428178 [0,1,0,0,1,0|2,0,0]=4 564 B15R1.495 CC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])C MCULE-2524898971 [0,1,0,0,0,1|1,0,1]=4 565 B15R1.495 CC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-6950657193 [0,1,0,0,0,1|2,0,0]=4 566 B15R1.495 CC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-8807354935 [0,1,0,0,0,1|2,0,0]=4 567 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-1782603905 [0,1,0,0,0,1|2,0,0]=4 568 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-8569330100 [0,1,0,0,0,1|2,0,0]=4 569 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1220877169 [0,1,0,0,0,1|2,0,0]=4 570 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-2753524221 [0,1,0,0,0,1|2,0,0]=4 571 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-4025064471 [0,1,0,0,0,1|2,0,0]=4 572 B15R1.495 CC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-8797522346 [0,1,0,0,0,1|2,0,0]=4 573 B15R1.495 CC(=O)C1=CC=C(C=C1)OC(C)C(=O)O MCULE-3745936146 [0,1,0,0,0,1|2,0,0]=4 574 B15R1.495 CC(OC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-3576985873 [0,1,0,0,0,1|0,0,2]=4 575 B15R1.495 CC(SC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-7704776318 [0,1,0,0,0,1|0,0,2]=4 576 B15R1.495 C[C@@H](NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-6300415190 [0,1,0,0,0,1|0,0,0]=2 577 B15R1.495 C[C@@H](NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9871188117 [0,1,0,0,0,1|0,0,0]=2 578 B15R1.495 NC(=O)C1=CC=C(C=C1)CC(N)C(=O)O MCULE-7278608683 [0,1,0,0,0,1|2,0,0]=4 579 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4186619996 [0,1,0,0,0,1|2,0,0]=4 580 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@@H](N)C(=O)O MCULE-4883051060 [0,1,0,0,0,1|2,0,0]=4 581 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-1392937896 [0,1,0,0,0,1|2,0,0]=4 582 B15R1.495 NC(=O)C1=CC=C(C=C1)C[C@H](N)C(=O)O MCULE-3581109554 [0,1,0,0,0,1|2,0,0]=4 583 B15R1.495 NC(CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-8431079171 [0,1,0,0,0,1|1,0,1]=4 584 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-2273600120 [0,1,0,0,0,1|0,0,2]=4 585 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-5071164478 [0,1,0,0,0,1|0,0,2]=4 586 B15R1.495 NC(CC1=CC=C(C=C1)N(=O)=O)C(=O)O MCULE-6247112607 [0,1,0,0,0,1|0,0,2]=4 587 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-2408168813 [0,1,0,0,0,1|1,0,1]=4 588 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-7535447371 [0,1,0,0,0,1|1,0,1]=4 589 B15R1.495 N[C@@H](CC1=CC=C(C=C1)C(=O)O)C(=O)O MCULE-9954201924 [0,1,0,0,0,1|1,0,1]=4 590 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-1693855897 [0,1,0,0,0,1|0,0,0]=2 591 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3511055155 [0,1,0,0,0,1|0,0,0]=2 592 B15R1.495 N[C@@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-8831767805 [0,1,0,0,0,1|0,0,0]=2 593 B15R1.495 N[C@@H](CC1=NC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-5418388495 [0,1,0,0,0,1|1,0,0]=3 594 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-2856704024 [0,1,0,0,0,1|0,0,0]=2 595 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3581843023 [0,1,0,0,0,1|0,0,0]=2 596 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-4275372069 [0,1,0,0,0,1|0,0,0]=2 597 B15R1.495 N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-9556380283 [0,1,0,0,0,1|0,0,0]=2 598 B15R1.495 O=C(O)C(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-6223294787 [0,1,0,0,0,1|0,0,2]=4 599 B15R1.495 O=C(O)C(Cl)CC1=CC=C(C=C1)N(=O)=O MCULE-8225224848 [0,1,0,0,0,1|0,0,2]=4 600 B15R1.495 O=C(O)C(O)CC1=CC=C(C=C1)N(=O)=O MCULE-8476441689 [0,1,0,0,0,1|0,0,2]=4 601 B15R1.495 O=C(O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1733119463 [0,1,0,0,0,1|0,0,0]=2 602 B15R1.495 O=C(O)[C@@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7846582064 [0,1,0,0,0,1|0,0,0]=2 603 B15R1.495 O=C(O)[C@H](O)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8667813748 [0,1,0,0,0,1|0,0,0]=2 604 B15R1.495 [C@H](N)(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O MCULE-3738503916 [0,1,0,0,0,1|0,0,0]=2 605 B15R1.498 CS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-5318347440 [0,1,0,0,0,1|1,0,1]=4 606 B15R1.498 CS(=O)(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-7520577188 [0,1,0,0,0,1|1,0,1]=4 607 B15R1.498 CS(=O)(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1033971099 [0,1,0,0,0,1|1,0,1]=4 608 B15R1.498 NS(=O)(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-9111713187 [0,1,0,0,0,1|1,0,1]=4 609 B15R1.498 NS(=O)(=O)C1=CC=C(C=C1)NCC(=O)O MCULE-5826372922 [0,1,0,0,0,1|1,0,1]=4 610 B15R1.498 NS(=O)(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-9814263320 [0,1,0,0,0,1|1,0,1]=4 611 B15R1.498 NS(=O)(=O)C1=CC=C(C=C1)SCC(=O)O MCULE-3144290038 [0,1,0,0,0,1|1,0,1]=4 612 B15R1.498 O=C(O)CCC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-7411259985 [0,1,0,0,0,1|1,0,1]=4 613 B15R1.498 O=C(O)CCC1=CC=C(C=C1)S(=O)(=O)F MCULE-2509152707 [0,1,0,0,0,1|1,0,1]=4 614 B15R1.498 O=C(O)CNC1=CC=C(C=C1)P(=O)(O)O MCULE-4725051485 [0,1,0,0,0,1|0,1,1]=4 615 B15R1.498 O=C(O)COC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-4783606076 [0,1,0,0,0,1|1,0,1]=4 616 B15R1.498 O=C(O)COC1=CC=C(C=C1)S(=O)(=O)O MCULE-3154609296 [0,1,0,0,0,1|1,0,1]=4 617 B15R1.944 CCC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-1408407757 [0,1,0,0,0,1|2,0,0]=4 618 B15R1.944 CNC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-7362583815 [0,1,0,0,0,1|2,0,0]=4 619 B15R1.944 COC(=O)C1=CC=C(C=C1)CCC(=O)O MCULE-2424710523 [0,1,0,0,0,1|1,0,1]=4 620 B15R1.944 COC(=O)C1=CC=C(C=C1)OCC(=O)O MCULE-6830705110 [0,1,0,0,0,1|1,0,1]=4 621 B15R1.944 O=C(O)COC1=CC=C(C=C1)C(=O)CBr MCULE-6833504331 [0,1,0,0,0,1|2,0,0]=4 622 B15R1.956 CNC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8455170565 [0,1,0,0,0,1|1,0,1]=4 623 B15R1.956 COC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6147222723 [0,1,0,0,0,1|0,0,1]=3 624 B15R1.956 COC(=O)CCC1=CC=C(C=C1)C(=O)O MCULE-1699209824 [0,1,0,0,0,1|1,0,1]=4 625 B15R1.956 COC(=O)CCC1=CC=C(C=C1)N(=O)=O MCULE-6480791968 [0,1,0,0,0,1|0,0,2]=4 626 B15R1.956 COC(=O)CNC1=CC=C(C=C1)C(=O)O MCULE-6634729715 [0,1,0,0,0,1|1,0,1]=4 627 B15R1.956 COC(=O)CNC1=CC=C(C=C1)N(=O)=O MCULE-4811384574 [0,1,0,0,0,1|0,0,2]=4 628 B15R1.956 COC(=O)COC1=CC=C(C=C1)C(=O)C MCULE-3065243819 [0,1,0,0,0,1|2,0,0]=4 629 B15R1.956 COC(=O)COC1=CC=C(C=C1)C(=O)O MCULE-7292497228 [0,1,0,0,0,1|1,0,1]=4 630 B15R1.956 COC(=O)COC1=CC=C(C=C1)N(=O)=O MCULE-7935819832 [0,1,0,0,0,1|0,0,2]=4 631 B15R1.956 COC(=O)NCC1=CC=C(C=C1)C(=O)O MCULE-9219078004 [0,1,0,0,0,1|1,0,1]=4 632 B15R1.956 NNC(=O)N=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-1917071141 [0,1,0,0,0,1|1,0,1]=4 633 B15R1.5380 CC(=O)C1=C(C=C(C=C1)OCC(=O)O)O MCULE-1300772851 [0,1,0,0,0,1|2,0,0]=4 634 B15R1.5380 CC(=O)C1=C(C=C(C=C1)SCC(=O)O)F MCULE-7026381029 [0,1,0,0,0,1|2,0,0]=4 635 B15R1.5380 CC1=C(C=CC(=C1)OCC(=O)O)N(=O)=O MCULE-1668349672 [0,1,0,0,0,1|0,0,2]=4 636 B15R1.5380 CC1=CC(=CC=C1S(=O)C)OCC(=O)O MCULE-3325447694 [0,1,0,0,0,1|2,0,0]=4 637 B15R1.5380 O=C(O)CCC1=CC(=C(C=C1)N(=O)=O)F MCULE-4174420548 [0,1,0,0,0,1|0,0,2]=4 638 B15R1.5380 O=C(O)COC1=CC(=C(C=C1)N(=O)=O)F MCULE-3880520043 [0,1,0,0,0,1|0,0,2]=4 639 B15R1.5504 C=C(C)C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1843904192 [0,1,0,0,0,1|2,0,0]=4 640 B15R1.5504 C=C(C)C[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6519231941 [0,1,0,0,0,1|2,0,0]=4 641 B15R1.5504 C=C(C)C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1025381099 [0,1,0,0,0,1|2,0,0]=4 642 B15R1.5504 C=C(C)C[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-9408048034 [0,1,0,0,0,1|2,0,0]=4 643 B15R1.5504 CC(=N)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5244940588 [0,1,0,0,0,1|2,0,0]=4 644 B15R1.5504 CN(CC(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-5291433757 [0,1,0,0,0,1|1,0,1]=4 645 B15R1.5504 CN(CC(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-1596617511 [0,1,0,0,0,1|0,0,2]=4 646 B15R1.5504 NC(CC(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-1139940351 [0,1,0,0,0,1|1,0,1]=4 647 B15R1.5504 NC(CC(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-8651359891 [0,1,0,0,0,1|0,0,2]=4 648 B15R1.5504 NC(CC(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-9020939713 [0,1,0,0,0,1|0,0,2]=4 649 B15R1.5504 N[C@@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1357783260 [0,1,0,0,0,1|0,0,0]=2 650 B15R1.5504 N[C@@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3677927687 [0,1,0,0,0,1|0,0,0]=2 651 B15R1.5504 N[C@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1026925409 [0,1,0,0,0,1|0,0,0]=2 652 B15R1.5504 N[C@H](CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6038136748 [0,1,0,0,0,1|0,0,0]=2 653 B15R1.5504 O=C(O)CS(=O)C1=CC=C(C=C1)N(=O)=O MCULE-9097643391 [0,1,0,0,0,1|0,0,2]=4 654 B15R1.8014 CC(=O)C1=CC(=C(C=C1)SCC(=O)O)F MCULE-6322894281 [0,1,0,0,0,1|2,0,0]=4 655 B15R1.8014 CC1=CC(=CC=C1OCC(=O)O)N(=O)=O MCULE-6477485141 [0,1,0,0,0,1|0,0,2]=4 656 B15R1.8014 O=C(O)CCC1=C(C=C(C=C1)N(=O)=O)Cl MCULE-4846509282 [0,1,0,0,0,1|0,0,2]=4 657 B15R1.8014 O=C(O)CCC1=CC=C(C=C1Br)N(=O)=O MCULE-3975002024 [0,1,0,0,0,1|0,0,2]=4 658 B15R1.8014 O=C(O)COC1=C(C=C(C=C1)N(=O)=O)Br MCULE-5158453744 [0,1,0,0,0,1|0,0,2]=4 659 B15R1.8014 O=C(O)COC1=CC=C(C=C1Cl)N(=O)=O MCULE-5228010490 [0,1,0,0,0,1|0,0,2]=4 660 B15R1.8014 O=C(O)CSC1=CC=C(C=C1Cl)N(=O)=O MCULE-3743987490 [0,1,0,0,0,1|0,0,2]=4 661 B15R1.1075 CS(=O)(=O)NC1=CC=C(C=C1)CC(=O)O MCULE-4251246667 [0,1,0,0,0,1|1,0,1]=4 662 B15R1.1075 CS(=O)(=O)OC1=CC=C(C=C1)CC(=O)O MCULE-9276514822 [0,1,0,0,0,1|1,0,1]=4 663 B15R1.2997 CC(=O)NC1=CC=C(C=C1)CC(=O)NO MCULE-2864651130 [0,1,0,0,0,1|2,0,0]=4 664 B15R1.2997 COC(=O)CC1=CC=C(C=C1)CC(=O)C MCULE-7179250702 [0,1,0,0,0,1|2,0,0]=4 665 B15R1.2997 COC(=O)CC1=CC=C(C=C1)CC(=O)O MCULE-1751753103 [0,1,0,0,0,1|1,0,1]=4 666 B15R1.2997 COC(=O)CC1=CC=C(C=C1)NC(=O)C MCULE-9459865536 [0,1,0,0,0,1|2,0,0]=4 667 B15R1.2997 O=C(O)CC1=CC=C(C=C1)NC(=O)CCl MCULE-3083237460 [0,1,0,0,0,1|2,0,0]=4 668 B15R1.12250 CC(=O)N(C)C1=CC=C(C=C1)CC(=O)O MCULE-2356305348 [0,1,0,0,0,1|2,0,0]=4 669 B15R1.12250 CC(=O)NC1=CC=C(C=C1)C(C)C(=O)O MCULE-8644789320 [0,1,0,0,0,1|2,0,0]=4 670 B15R1.37 NCC1=CC(=CC=C1CC(=O)O)C(=O)O MCULE-7053053581 [0,2,0,0,0,0|1,0,1]=4 671 B15R1.992 COC(=O)C1=CC(=C(C=C1)CC(=O)O)C MCULE-4786085623 [0,2,0,0,0,0|1,0,1]=4 672 B15R1.2999 COC(=O)CC1=CC=C(C=C1F)C(=O)C MCULE-3189303814 [0,2,0,0,0,0|2,0,0]=4 673 B15R1.2999 COC(=O)CC1=CC=C(C=C1F)N(=O)=O MCULE-2862950003 [0,2,0,0,0,0|0,0,2]=4 674 B15R1.5381 CC(C(=O)O)C1=C(C=C(C=C1)N(=O)=O)Br MCULE-6051177556 [0,2,0,0,0,0|0,0,2]=4 675 B15R1.5381 CC(C(=O)O)C1=C(C=C(C=C1)N(=O)=O)F MCULE-2998486031 [0,2,0,0,0,0|0,0,2]=4 676 B15R1.5381 CC1=C(C=CC(=C1)C(=O)O)[C@H](N)C(=O)O MCULE-2923573096 [0,2,0,0,0,0|1,0,1]=4 677 B15R1.5381 CC1=CC(=CC=C1C(N)C(=O)O)C(=O)O MCULE-1218236272 [0,2,0,0,0,0|1,0,1]=4 678 B15R1.5381 CC1=CC(=CC=C1C(N)C(=O)O)C(=O)O MCULE-7198937021 [0,2,0,0,0,0|1,0,1]=4 679 B15R1.5381 CC1=CC(=CC=C1[C@H](N)C(=O)O)C(=O)O MCULE-5555124884 [0,2,0,0,0,0|1,0,1]=4 680 B15R1.5381 CC1=CC(=CC=C1[C@H](N)C(=O)O)C(=O)O MCULE-9395143048 [0,2,0,0,0,0|1,0,1]=4 681 B15R1.5381 CC1=CC(=CC=C1[C@H](N)C(=O)O)C(=O)O MCULE-9471421396 [0,2,0,0,0,0|1,0,1]=4 682 B15R1.8391 O=C(O)CC1=C(C=C(C(=C1)Br)N(=O)=O)F MCULE-6841564382 [0,2,0,0,0,0|0,0,2]=4 683 B15R1.8391 O=C(O)CC1=CC(=C(C=C1Br)N(=O)=O)F MCULE-9311735291 [0,2,0,0,0,0|0,0,2]=4 684 B15R1.8391 O=C(O)CC1=CC(=C(C=C1F)N(=O)=O)F MCULE-5107946061 [0,2,0,0,0,0|0,0,2]=4 685 B15R1.28960 O=C(O)CC1=C(C=C(C=C1Cl)N(=O)=O)Cl MCULE-6905622316 [0,2,0,0,0,0|0,0,2]=4 686 B15R1.28960 O=C(O)CC1=C(C=C(C=C1F)N(=O)=O)F MCULE-7313134926 [0,2,0,0,0,0|0,0,2]=4 687 B15R1.317 CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)O MCULE-1681526659 [0,2,0,0,0,0|1,0,1]=4 688 B15R1.317 CNS(=O)(=O)C1=CC=C(C=C1)CC(=O)O MCULE-5634561181 [0,2,0,0,0,0|1,0,1]=4 689 B15R1.779 CCOC(=O)C1=CC=C(C=C1)CC(=O)O MCULE-5908440213 [0,2,0,0,0,0|1,0,1]=4 690 B15R1.2994 COC(=O)CC1=CC=C(C=C1)C(=O)OC MCULE-2218988745 [0,2,0,0,0,0|1,0,1]=4 691 B15R1.11693 COC(=O)C1=C(C=C(C=C1)CC(=O)O)Cl MCULE-2325806306 [0,2,0,0,0,0|1,0,1]=4 692 B15R1.11693 COC(=O)C1=C(C=C(C=C1)CC(=O)O)F MCULE-8230020611 [0,2,0,0,0,0|1,0,1]=4 693 B15R1.11694 COC(=O)C1=CC=C(C=C1)C(N)C(=O)O MCULE-8884355632 [0,2,0,0,0,0|1,0,1]=4 694 B15R1.2995 COC(=O)CC1=CC=C(C=C1)S(=O)(=O)C MCULE-5709550103 [0,2,0,0,0,0|1,0,1]=4 695 B15R1.2995 COC(=O)CC1=CC=C(C=C1)S(=O)(=O)Cl MCULE-9988717105 [0,2,0,0,0,0|1,0,1]=4 696 B15R1.3665 CC(C(=O)O)C1=CC=C(C=C1)S(=O)(=O)C MCULE-6573157006 [0,2,0,0,0,0|1,0,1]=4 697 B15R1.3665 NC(C(=O)O)C1=CC=C(C=C1)P(=O)(O)O MCULE-9977357613 [0,2,0,0,0,0|0,1,1]=4 698 B15R1.5385 CC1=CC(=CC=C1S(=O)(=O)C)CC(=O)O MCULE-2158959359 [0,2,0,0,0,0|1,0,1]=4 699 B15R1.5385 CS(=O)(=O)C1=CC=C(C=C1Br)CC(=O)O MCULE-6968579566 [0,2,0,0,0,0|1,0,1]=4 700 B15R1.5385 CS(=O)(=O)C1=CC=C(C=C1Cl)CC(=O)O MCULE-7174087746 [0,2,0,0,0,0|1,0,1]=4 701 B15R1.5385 CS(=O)(=O)C1=CC=C(C=C1F)CC(=O)O MCULE-3328120257 [0,2,0,0,0,0|1,0,1]=4 702 B15R1.1262 CCOC(=N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-4930135498 [0,2,0,0,0,0|1,0,0]=3 703 B15R1.1262 CCOC(=N)CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-8224392034 [0,2,0,0,0,0|1,0,0]=3 704 B15R1.1262 CCOC(=O)CC1=CC=C(C=C1)C(=O)C MCULE-3208559513 [0,2,0,0,0,0|2,0,0]=4 705 B15R1.1262 CCOC(=O)CC1=CC=C(C=C1)N(=O)=O MCULE-1612332548 [0,2,0,0,0,0|0,0,2]=4 706 B15R1.1262 O=C(C=NO)NC1=CC=C(C=C1)[N+](=O)[O-] MCULE-5105461676 [0,2,0,0,0,0|1,0,0]=3 707 B15R1.1333 COC(=O)C(Br)C1=CC=C(C=C1)N(=O)=O MCULE-1473959872 [0,2,0,0,0,0|0,0,2]=4 708 B15R1.1333 COC(=O)C(C)C1=CC=C(C=C1)N(=O)=O MCULE-3362203991 [0,2,0,0,0,0|0,0,2]=4 709 B15R1.1333 COC(=O)C(Cl)C1=CC=C(C=C1)N(=O)=O MCULE-3776115189 [0,2,0,0,0,0|0,0,2]=4 710 B15R1.1333 COC(=O)C(N)C1=CC=C(C=C1)N(=O)=O MCULE-5187601654 [0,2,0,0,0,0|0,0,2]=4 711 B15R1.1333 COC(=O)C(O)C1=CC=C(C=C1)N(=O)=O MCULE-9039885340 [0,2,0,0,0,0|0,0,2]=4 712 B15R1.1333 COC(=O)[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-4039077869 [0,2,0,0,0,0|1,0,1]=4 713 B15R1.1333 COC(=O)[C@@H](N)C1=CC=C(C=C1)C(=O)O MCULE-8839533871 [0,2,0,0,0,0|1,0,1]=4 714 B15R1.1333 COC(=O)[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5767545260 [0,2,0,0,0,0|0,0,0]=2 715 B15R1.1333 COC(=O)[C@@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-6305740648 [0,2,0,0,0,0|0,0,0]=2 716 B15R1.1333 COC(=O)[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-3777385102 [0,2,0,0,0,0|1,0,1]=4 717 B15R1.1333 COC(=O)[C@H](N)C1=CC=C(C=C1)C(=O)O MCULE-9922323814 [0,2,0,0,0,0|1,0,1]=4 718 B15R1.1333 COC(=O)[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3986376113 [0,2,0,0,0,0|0,0,0]=2 719 B15R1.1333 COC(=O)[C@H](N)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5095234245 [0,2,0,0,0,0|0,0,0]=2 720 B15R1.1333 N[C@@H](CO)[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-1302636002 [0,2,0,0,0,0|1,0,1]=4 721 B15R1.1333 N[C@@H](CO)[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7334288622 [0,2,0,0,0,0|1,0,1]=4 722 B15R1.1333 N[C@@H](CO)[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-9881577345 [0,2,0,0,0,0|1,0,1]=4 723 B15R1.1333 N[C@@H](CO)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2480126867 [0,2,0,0,0,0|1,0,1]=4 724 B15R1.1333 N[C@H](CO)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2720042008 [0,2,0,0,0,0|1,0,1]=4 725 B15R1.1333 N[C@H](CO)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3507418822 [0,2,0,0,0,0|1,0,1]=4 726 B15R1.1333 N[C@H](CO)[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5359035931 [0,2,0,0,0,0|1,0,1]=4 727 B15R1.3848 COC(=O)CC1=CC(=C(C=C1)N(=O)=O)F MCULE-9658466148 [0,2,0,0,0,0|0,0,2]=4 728 B15R1.3848 COC(=O)CC1=CC=C(C(=C1)Br)N(=O)=O MCULE-5441230829 [0,2,0,0,0,0|0,0,2]=4 729 B15R1.3848 COC(=O)CC1=CC=C(C(=C1)C)N(=O)=O MCULE-8128807828 [0,2,0,0,0,0|0,0,2]=4 730 B15R1.3848 COC(=O)CC1=CC=C(C(=C1)O)N(=O)=O MCULE-3319536959 [0,2,0,0,0,0|0,0,2]=4 731 B15R1.5379 N[C@H](C(=O)O)C1=CC=C(C(=C1)O)C(=O)O MCULE-4547898187 [0,2,0,0,0,0|1,0,1]=4 732 B15R1.12449 COC1=CC(=CC=C1N(=O)=O)CC(=O)O MCULE-2744884498 [0,2,0,0,0,0|0,0,2]=4 733 B15R1.1354 CCC(C(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-3318777039 [0,2,0,0,0,0|0,0,2]=4 734 B15R1.1354 NC[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-2758095775 [0,2,0,0,0,0|0,0,0]=2 735 B15R1.1354 NC[C@H](C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-8762866413 [0,2,0,0,0,0|0,0,0]=2 736 B15R1.8948 CC(=O)C1=CC=C(C=C1)C(F)(F)C(=O)O MCULE-2490882724 [0,2,0,0,0,0|2,0,0]=4 737 B15R1.8948 CC(C)(C(=O)O)C1=CC=C(C=C1)N(=O)=O MCULE-6290153676 [0,2,0,0,0,0|0,0,2]=4 738 B15R1.8948 CC(N)(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-7003471840 [0,2,0,0,0,0|1,0,1]=4 739 B15R1.8948 CC(N)(C(=O)[O-])C1=CC=C(C=C1)C(=O)[O-] MCULE-4327709098 [0,2,0,0,0,0|1,0,1]=4 740 B15R1.8948 C[C@@](N)(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-2574288266 [0,2,0,0,0,0|1,0,1]=4 741 B15R1.8948 C[C@@](N)(C(=O)O)C1=CC=C(C=C1)C(=O)O MCULE-6809464598 [0,2,0,0,0,0|1,0,1]=4 742 B15R1.8948 O=C(O)C(F)(F)C1=CC=C(C=C1)N(=O)=O MCULE-4678357542 [0,2,0,0,0,0|0,0,2]=4 743 B15R1.8948 O=C(O)C1=CC=C(C=C1)C(F)(F)C(=O)O MCULE-8135737639 [0,2,0,0,0,0|1,0,1]=4 744 B13R1.1985 O=C(O)C=CC1=CC=C(O1)[N+](=O)[O-] MCULE-6903611173 [0,0,1,1,0,0|1,0,1]=4 745 B13R1.1985 O=C(O)C=CC1=CC=C(S1)[N+](=O)[O-] MCULE-1564775970 [0,0,1,1,0,0|1,0,1]=4 746 B13R2.2121 COC1=CC=C2CC(=O)OC2=C1 MCULE-4748466698 [1,0,0,1,0,0|2,0,0]=4 747 B13R2.2121 O=CC1=CC2=C(C=C1)CC(=O)N2 MCULE-9427855257 [1,0,0,1,0,0|2,0,0]=4 748 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)O2 MCULE-8944149524 [1,0,0,1,0,0|2,0,0]=4 749 B13R2.2121 O=CC1=CC2=C(C=C1)OC(=O)O2 MCULE-7758108134 [1,0,0,1,0,0|2,0,0]=4 750 B15R2.16216 O=[N+]([O-])C1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-4946425199 [0,0,0,1,0,1|1,0,1]=4 751 B15R2.16216 O=[N+]([O-])C1=CC=C(C=C1)OC[C@@H]2CO2 MCULE-7664772574 [0,0,0,1,0,1|1,0,1]=4 752 B15R2.16216 O=[N+]([O-])C1=CC=C(C=C1)OC[C@H]2CO2 MCULE-5774794275 [0,0,0,1,0,1|1,0,1]=4 753 B15R2.926 O=C(O)CC1=CC2=C(C=C1)CC(=O)N2 MCULE-5735825105 [0,0,0,1,0,1|2,0,0]=4 754 B15R2.926 O=C(O)CC1=CC2=C(C=C1)NC(=O)N2 MCULE-9401984456 [0,0,0,1,0,1|2,0,0]=4 755 B15R2.926 O=C(O)CC1=CC2=C(C=C1)OC(=O)N2 MCULE-3152805422 [0,0,0,1,0,1|2,0,0]=4 756 B15R2.7180 O=C1COC2=CC(=CC=C2C1)N(=O)=O MCULE-2764172861 [0,1,0,1,0,0|0,0,2]=4 757 B15R2.1693 O=[N+]([O-])C1=CC=C(C=C1)[C@H]2O[C@@H]2CO MCULE-9848488993 [0,1,0,1,0,0|0,0,2]=4 758 B11R1.43 O=CC1=CC=C(N1)CC(=O)O MCULE-2738289874 [1,0,0,0,1,0|2,0,0]=4 759 B13R1.3 C#CC1=CC=C(C=C1)CCC(=O)O MCULE-5589526715 [1,0,0,0,0,1|2,0,0]=4 760 B13R1.3 C#CC1=CC=C(C=C1)OCC(=O)O MCULE-5020938168 [1,0,0,0,0,1|2,0,0]=4 761 B13R1.3 CCC1=CC=C(C=C1)CCC(=O)O MCULE-2110019416 [1,0,0,0,0,1|2,0,0]=4 762 B13R1.3 CCC1=CC=C(C=C1)OCC(=O)O MCULE-1934779223 [1,0,0,0,0,1|2,0,0]=4 763 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O MCULE-1674311204 [1,0,0,0,0,1|2,0,0]=4 764 B13R1.3 COC1=CC=C(C=C1)NCC(=O)O MCULE-7179149062 [1,0,0,0,0,1|2,0,0]=4 765 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O MCULE-3881661052 [1,0,0,0,0,1|2,0,0]=4 766 B13R1.3 COC1=CC=C(C=C1)SCC(=O)O MCULE-8573257372 [1,0,0,0,0,1|2,0,0]=4 767 B13R1.3 CSC1=CC=C(C=C1)CCC(=O)O MCULE-9755721169 [1,0,0,0,0,1|2,0,0]=4 768 B13R1.3 CSC1=CC=C(C=C1)OCC(=O)O MCULE-9073748724 [1,0,0,0,0,1|2,0,0]=4 769 B13R1.3 N#CC1=CC=C(C=C1)CCC(=O)O MCULE-6891261134 [1,0,0,0,0,1|2,0,0]=4 770 B13R1.3 N#CC1=CC=C(C=C1)NCC(=O)O MCULE-6156960439 [1,0,0,0,0,1|2,0,0]=4 771 B13R1.3 N#CC1=CC=C(C=C1)OCC(=O)O MCULE-1619496132 [1,0,0,0,0,1|2,0,0]=4 772 B13R1.3 N#CC1=CC=C(C=C1)SCC(=O)O MCULE-5271203534 [1,0,0,0,0,1|2,0,0]=4 773 B13R1.3 NC(=O)CCC1=CC=C(C=C1)C=O MCULE-6927921646 [1,0,0,0,0,1|2,0,0]=4 774 B13R1.3 NC(=O)COC1=CC=C(C=C1)C=O MCULE-1657662911 [1,0,0,0,0,1|2,0,0]=4 775 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3166710921 [1,0,0,0,0,1|2,0,0]=4 776 B13R1.3 NCC1=CC=C(C=C1)CCC(=O)O MCULE-3624977655 [1,0,0,0,0,1|2,0,0]=4 777 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-1705612417 [1,0,0,0,0,1|1,0,1]=4 778 B13R1.3 NNC1=CC=C(C=C1)CCC(=O)O MCULE-2881336886 [1,0,0,0,0,1|1,0,1]=4 779 B13R1.3 O=C(O)CCC1=CC=C(C=C1)CO MCULE-1979680062 [1,0,0,0,0,1|1,0,1]=4 780 B13R1.3 O=C(O)COC1=CC=C(C=C1)CBr MCULE-4096571478 [1,0,0,0,0,1|2,0,0]=4 781 B13R1.3 O=C(O)COC1=CC=C(C=C1)CO MCULE-4472330611 [1,0,0,0,0,1|1,0,1]=4 782 B13R1.3 O=CC1=CC=C(C=C1)/C=C/C(=O)O MCULE-5017170189 [1,0,0,0,0,1|1,0,1]=4 783 B13R1.3 O=CC1=CC=C(C=C1)C=CC(=O)O MCULE-2468143780 [1,0,0,0,0,1|1,0,1]=4 784 B13R1.3 O=CC1=CC=C(C=C1)CCC(=O)O MCULE-8265326595 [1,0,0,0,0,1|1,0,0]=3 785 B13R1.3 O=CC1=CC=C(C=C1)OCC(=O)O MCULE-9498358536 [1,0,0,0,0,1|1,0,0]=3 786 B13R1.587 CC(=O)C1=CC(=CC=C1)CC(=O)O MCULE-3282989019 [0,0,0,0,1,1|2,0,0]=4 787 B13R1.587 CS(=O)C1=CC(=CC=C1)CC(=O)O MCULE-4517305847 [0,0,0,0,1,1|2,0,0]=4 788 B13R1.587 NC(=O)C1=CC(=CC=C1)CC(=O)O MCULE-1776243179 [0,0,0,0,1,1|2,0,0]=4 789 B13R1.587 NC(=O)C1=NC=CC(=C1)CC(=O)O MCULE-8397371634 [0,0,0,0,1,1|2,0,0]=4 790 B13R1.587 O=C(O)CC1=CC(=CC=C1)C(=O)O MCULE-3248068610 [0,0,0,0,1,1|1,0,1]=4 791 B13R1.587 O=C(O)CC1=CC=CC(=C1)N(=O)=O MCULE-1620041803 [0,0,0,0,1,1|0,0,2]=4 792 B15R1.499 CC(=O)NC1=CC=C(C=C1)CCC(=O)O MCULE-9653779424 [0,0,0,0,0,2|2,0,0]=4 793 B15R1.499 CC(=O)NC1=CC=C(C=C1)NCC(=O)O MCULE-7543418199 [0,0,0,0,0,2|2,0,0]=4 794 B15R1.499 CC(=O)NC1=CC=C(C=C1)OCC(=O)O MCULE-6182616228 [0,0,0,0,0,2|2,0,0]=4 795 B15R1.499 CC(=O)OC1=CC=C(C=C1)CCC(=O)O MCULE-6472862414 [0,0,0,0,0,2|2,0,0]=4 796 B15R1.499 CC(=O)OC1=CC=C(C=C1)OCC(=O)O MCULE-7852384922 [0,0,0,0,0,2|2,0,0]=4 797 B15R1.499 NC(=O)CC1=CC=C(C=C1)OCC(=O)O MCULE-8959471445 [0,0,0,0,0,2|2,0,0]=4 798 B15R1.499 NC(=O)NC1=CC=C(C=C1)OCC(=O)O MCULE-3463218513 [0,0,0,0,0,2|2,0,0]=4 799 B15R1.1080 CC(=O)C1=CC=C(C=C1)CCCC(=O)O MCULE-6404950225 [0,0,0,0,0,2|2,0,0]=4 800 B15R1.1080 CC(=O)C1=CC=C(C=C1)OCCC(=O)O MCULE-5200740337 [0,0,0,0,0,2|2,0,0]=4 801 B15R1.1080 CC(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-6080828731 [0,0,0,0,0,2|1,0,1]=4 802 B15R1.1080 NC(=O)C1=CC=C(C=C1)OCCC(=O)O MCULE-7236620435 [0,0,0,0,0,2|2,0,0]=4 803 B15R1.1080 NC(=O)NN=CC1=CC=C(C=C1)[N+](=O)[O-] MCULE-7362846085 [0,0,0,0,0,2|1,0,1]=4 804 B15R1.1080 O=C(O)CCCC1=CC=C(C=C1)N(=O)=O MCULE-6175571640 [0,0,0,0,0,2|0,0,2]=4 805 B15R1.1080 O=C(O)CCNC1=CC=C(C=C1)C(=O)O MCULE-2463472136 [0,0,0,0,0,2|1,0,1]=4 806 B15R1.1080 O=C(O)CCNC1=CC=C(C=C1)N(=O)=O MCULE-7004510007 [0,0,0,0,0,2|0,0,2]=4 807 B15R1.1080 O=C(O)CCOC1=CC=C(C=C1)N(=O)=O MCULE-6207171899 [0,0,0,0,0,2|0,0,2]=4 808 B15R1.1080 O=C(O)CCSC1=CC=C(C=C1)N(=O)=O MCULE-6463037121 [0,0,0,0,0,2|0,0,2]=4 809 B15R1.1080 O=C(O)CNCC1=CC=C(C=C1)N(=O)=O MCULE-5552012209 [0,0,0,0,0,2|0,0,2]=4 810 B15R1.1080 O=C(O)COCC1=CC=C(C=C1)N(=O)=O MCULE-1581125519 [0,0,0,0,0,2|0,0,2]=4 811 B15R1.1080 O=C(O)CSCC1=CC=C(C=C1)N(=O)=O MCULE-9354824378 [0,0,0,0,0,2|0,0,2]=4