0 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [0,0,0,0,0,0|1,0,3]=4 1 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [0,0,0,0,0,0|1,0,3]=4 2 B8R1.7 C1=NC(=CS1)C(=O)O MCULE-4723437766 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.7 CC(=C1C=CC=C1)C MCULE-1513653645 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.7 CC(=C1C=CC=C1)O MCULE-1295162717 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.7 CC(=C1C=CC=C1)O MCULE-5249133210 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.7 CC(=O)C1=CC=CN1 MCULE-8111376055 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.7 CC(=O)C1=CC=CO1 MCULE-6389695813 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.7 CC(=O)C1=CC=CS1 MCULE-7771755380 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.7 CC(=O)C1=CC=NO1 MCULE-6400530220 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.7 CC(=O)C1=CC=NO1 MCULE-7437421488 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.7 CC(=O)C1=CC=NS1 MCULE-6790489481 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,0,0,0,0,0|3,0,1]=4 13 B8R1.7 CC(=O)C1=CN=CO1 MCULE-6114499046 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.7 CC(=O)C1=CN=CS1 MCULE-5771579983 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.7 CC(=O)C1=CN=NS1 MCULE-2588890993 [0,0,0,0,0,0|2,0,1]=3 16 B8R1.7 CC(=O)C1=CNC=C1 MCULE-6298298881 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.7 CC(=O)C1=CNC=N1 MCULE-1707621771 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.7 CC(=O)C1=CNC=N1 MCULE-5046690186 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.7 CC(=O)C1=CNN=C1 MCULE-2423677830 [0,0,0,0,0,0|1,0,0]=1 20 B8R1.7 CC(=O)C1=CNN=C1 MCULE-5581334055 [0,0,0,0,0,0|1,0,0]=1 21 B8R1.7 CC(=O)C1=CNN=N1 MCULE-8186228258 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.7 CC(=O)C1=CNN=N1 MCULE-8747452765 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.7 CC(=O)C1=COC=C1 MCULE-5791648334 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.7 CC(=O)C1=COC=N1 MCULE-4496552775 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.7 CC(=O)C1=CON=C1 MCULE-6833834209 [0,0,0,0,0,0|2,0,0]=2 26 B8R1.7 CC(=O)C1=CSC=C1 MCULE-3092440506 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.7 CC(=O)C1=CSC=N1 MCULE-4510751071 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.7 CC(=O)C1=CSN=C1 MCULE-3039959061 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.7 CC(=O)C1=CSN=N1 MCULE-7632786596 [0,0,0,0,0,0|3,0,0]=3 30 B8R1.7 CC(=O)C1=C[Se]C=C1 MCULE-3604526457 [0,0,0,0,0,0|3,0,0]=3 31 B8R1.7 CC(=O)C1=NC=NN1 MCULE-7383492886 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.7 CC(=O)C1=NNC=C1 MCULE-1764885364 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.7 CC(=O)C1=NNC=C1 MCULE-2223319558 [0,0,0,0,0,0|3,0,0]=3 34 B8R1.7 CC(=O)C1=NNN=C1 MCULE-3528005164 [0,0,0,0,0,0|2,0,0]=2 35 B8R1.7 CC(=O)C1=NOC=C1 MCULE-5515132953 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.7 CC(=O)C1=NSC=C1 MCULE-3804368348 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.7 CC(=O)N1C=CN=C1 MCULE-8326807704 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.7 CC(=O)N1C=NC=N1 MCULE-3516343201 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.7 CC(C)C1=CNN=C1 MCULE-1733975283 [0,0,0,0,0,0|2,0,1]=3 40 B8R1.7 CC(C)C1=CNN=C1 MCULE-2341064706 [0,0,0,0,0,0|2,0,1]=3 41 B8R1.7 CC(N)C1=CNN=C1 MCULE-2321193308 [0,0,0,0,0,0|2,0,1]=3 42 B8R1.7 CC(N)C1=CNN=C1 MCULE-7566584989 [0,0,0,0,0,0|2,0,1]=3 43 B8R1.7 CC(O)C1=CN=CS1 MCULE-7704279460 [0,0,0,0,0,0|3,0,1]=4 44 B8R1.7 CC(O)C1=CNC=N1 MCULE-3453073104 [0,0,0,0,0,0|3,0,1]=4 45 B8R1.7 CC(O)C1=CNC=N1 MCULE-5369561415 [0,0,0,0,0,0|3,0,1]=4 46 B8R1.7 CC(O)C1=COC=C1 MCULE-1264904534 [0,0,0,0,0,0|3,0,1]=4 47 B8R1.7 CC(O)C1=CSC=C1 MCULE-8518647927 [0,0,0,0,0,0|3,0,1]=4 48 B8R1.7 CC(O)C1=CSN=N1 MCULE-6745923811 [0,0,0,0,0,0|3,0,1]=4 49 B8R1.7 CC(O)C1=NNC=C1 MCULE-4788689959 [0,0,0,0,0,0|3,0,1]=4 50 B8R1.7 C[C@@H](O)C1=CC=NN1 MCULE-5804566468 [0,0,0,0,0,0|3,0,1]=4 51 B8R1.7 C[C@@H](O)C1=CC=NN1 MCULE-9875058758 [0,0,0,0,0,0|3,0,1]=4 52 B8R1.7 C[C@@H](O)C1=COC=C1 MCULE-4608193961 [0,0,0,0,0,0|3,0,1]=4 53 B8R1.7 C[C@H](O)C1=CC=NN1 MCULE-6494962010 [0,0,0,0,0,0|3,0,1]=4 54 B8R1.7 C[C@H](O)C1=CC=NN1 MCULE-8738673186 [0,0,0,0,0,0|3,0,1]=4 55 B8R1.7 C[C@H](O)C1=COC=C1 MCULE-5652894022 [0,0,0,0,0,0|3,0,1]=4 56 B8R1.7 FC(F)C1=CNN=C1 MCULE-5994625541 [0,0,0,0,0,0|2,0,1]=3 57 B8R1.7 N=C(N)C1=CN=CN1 MCULE-8282455848 [0,0,0,0,0,0|4,0,0]=4 58 B8R1.7 N=C(N)C1=CNC=N1 MCULE-4040269539 [0,0,0,0,0,0|4,0,0]=4 59 B8R1.7 N=C(N)C1=COC=C1 MCULE-1928377155 [0,0,0,0,0,0|4,0,0]=4 60 B8R1.7 N=C(N)C1=COC=C1 MCULE-3861879277 [0,0,0,0,0,0|4,0,0]=4 61 B8R1.7 N=C(N)C1=CSC=C1 MCULE-4502076888 [0,0,0,0,0,0|4,0,0]=4 62 B8R1.7 N=C(N)C1=CSC=C1 MCULE-4546745947 [0,0,0,0,0,0|4,0,0]=4 63 B8R1.7 NC(=O)C1=CC=CN1 MCULE-4462347914 [0,0,0,0,0,0|4,0,0]=4 64 B8R1.7 NC(=O)C1=CC=CO1 MCULE-1387924424 [0,0,0,0,0,0|4,0,0]=4 65 B8R1.7 NC(=O)C1=CC=CS1 MCULE-2370255848 [0,0,0,0,0,0|4,0,0]=4 66 B8R1.7 NC(=O)C1=CC=NN1 MCULE-8826349790 [0,0,0,0,0,0|3,0,0]=3 67 B8R1.7 NC(=O)C1=CC=NO1 MCULE-2775036033 [0,0,0,0,0,0|3,0,0]=3 68 B8R1.7 NC(=O)C1=CC=NS1 MCULE-3147200548 [0,0,0,0,0,0|3,0,0]=3 69 B8R1.7 NC(=O)C1=CN=CO1 MCULE-1434757715 [0,0,0,0,0,0|3,0,0]=3 70 B8R1.7 NC(=O)C1=CN=CS1 MCULE-5435637065 [0,0,0,0,0,0|3,0,0]=3 71 B8R1.7 NC(=O)C1=CNC=C1 MCULE-1008967076 [0,0,0,0,0,0|2,0,0]=2 72 B8R1.7 NC(=O)C1=CNC=N1 MCULE-2995118983 [0,0,0,0,0,0|3,0,0]=3 73 B8R1.7 NC(=O)C1=CNN=C1 MCULE-1267271600 [0,0,0,0,0,0|1,0,0]=1 74 B8R1.7 NC(=O)C1=CNN=N1 MCULE-8149645546 [0,0,0,0,0,0|2,0,0]=2 75 B8R1.7 NC(=O)C1=COC=C1 MCULE-2350121576 [0,0,0,0,0,0|3,0,0]=3 76 B8R1.7 NC(=O)C1=COC=N1 MCULE-7901825950 [0,0,0,0,0,0|4,0,0]=4 77 B8R1.7 NC(=O)C1=CON=C1 MCULE-9165062363 [0,0,0,0,0,0|2,0,0]=2 78 B8R1.7 NC(=O)C1=CSC=C1 MCULE-2077197908 [0,0,0,0,0,0|3,0,0]=3 79 B8R1.7 NC(=O)C1=CSC=N1 MCULE-4774917632 [0,0,0,0,0,0|4,0,0]=4 80 B8R1.7 NC(=O)C1=CSN=N1 MCULE-9765038008 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.7 NC(=O)C1=NN=NN1 MCULE-9935330081 [0,0,0,0,0,0|3,0,1]=4 82 B8R1.7 NC(=O)C1=NNC=N1 MCULE-3846375272 [0,0,0,0,0,0|4,0,0]=4 83 B8R1.7 NC(=O)C1=NSC=C1 MCULE-1600606100 [0,0,0,0,0,0|4,0,0]=4 84 B8R1.7 NC(=S)C1=CC=NN1 MCULE-6632380339 [0,0,0,0,0,0|3,1,0]=4 85 B8R1.7 NC(=S)C1=CC=NO1 MCULE-4213211362 [0,0,0,0,0,0|3,1,0]=4 86 B8R1.7 NC(=S)C1=CN=CO1 MCULE-4700729710 [0,0,0,0,0,0|3,1,0]=4 87 B8R1.7 NC(=S)C1=CN=CS1 MCULE-7808430790 [0,0,0,0,0,0|3,1,0]=4 88 B8R1.7 NC(=S)C1=CNC=C1 MCULE-2881593376 [0,0,0,0,0,0|2,1,0]=3 89 B8R1.7 NC(=S)C1=CNC=N1 MCULE-1995021323 [0,0,0,0,0,0|3,1,0]=4 90 B8R1.7 NC(=S)C1=CNN=C1 MCULE-2977611849 [0,0,0,0,0,0|1,1,0]=2 91 B8R1.7 NC(=S)C1=CNN=N1 MCULE-2535123707 [0,0,0,0,0,0|2,1,0]=3 92 B8R1.7 NC(=S)C1=COC=C1 MCULE-6979013983 [0,0,0,0,0,0|3,1,0]=4 93 B8R1.7 NC(=S)C1=CSC=C1 MCULE-4773928936 [0,0,0,0,0,0|3,1,0]=4 94 B8R1.7 O=C(Cl)C1=CC=CN1 MCULE-7026539670 [0,0,0,0,0,0|4,0,0]=4 95 B8R1.7 O=C(Cl)C1=CC=CO1 MCULE-3397677348 [0,0,0,0,0,0|4,0,0]=4 96 B8R1.7 O=C(Cl)C1=CC=CS1 MCULE-9726042533 [0,0,0,0,0,0|4,0,0]=4 97 B8R1.7 O=C(Cl)C1=CC=NN1 MCULE-9336611884 [0,0,0,0,0,0|3,0,0]=3 98 B8R1.7 O=C(Cl)C1=CC=NO1 MCULE-4921347925 [0,0,0,0,0,0|3,0,0]=3 99 B8R1.7 O=C(Cl)C1=CN=CN1 MCULE-9136436568 [0,0,0,0,0,0|3,0,0]=3 100 B8R1.7 O=C(Cl)C1=CN=CO1 MCULE-8427544910 [0,0,0,0,0,0|3,0,0]=3 101 B8R1.7 O=C(Cl)C1=CNN=C1 MCULE-1977295426 [0,0,0,0,0,0|1,0,0]=1 102 B8R1.7 O=C(Cl)C1=COC=C1 MCULE-6792513805 [0,0,0,0,0,0|3,0,0]=3 103 B8R1.7 O=C(Cl)C1=COC=N1 MCULE-1264086684 [0,0,0,0,0,0|4,0,0]=4 104 B8R1.7 O=C(Cl)C1=CSC=C1 MCULE-4098041075 [0,0,0,0,0,0|3,0,0]=3 105 B8R1.7 O=C(Cl)C1=CSC=N1 MCULE-1982441527 [0,0,0,0,0,0|4,0,0]=4 106 B8R1.7 O=C(Cl)C1=CSN=N1 MCULE-1833003523 [0,0,0,0,0,0|3,0,0]=3 107 B8R1.7 O=C(Cl)C1=NC=NN1 MCULE-4581179337 [0,0,0,0,0,0|4,0,0]=4 108 B8R1.7 O=C(Cl)C1=NOC=C1 MCULE-4964682055 [0,0,0,0,0,0|4,0,0]=4 109 B8R1.7 O=C(Cl)C1=NON=C1 MCULE-4470365498 [0,0,0,0,0,0|3,0,0]=3 110 B8R1.7 O=C(O)C1=CC=CN1 MCULE-4915329170 [0,0,0,0,0,0|3,0,0]=3 111 B8R1.7 O=C(O)C1=CC=CO1 MCULE-5132845727 [0,0,0,0,0,0|3,0,0]=3 112 B8R1.7 O=C(O)C1=CC=CS1 MCULE-4461858345 [0,0,0,0,0,0|3,0,0]=3 113 B8R1.7 O=C(O)C1=CC=C[Se]1 MCULE-9543908979 [0,0,0,0,0,0|3,0,0]=3 114 B8R1.7 O=C(O)C1=CC=NO1 MCULE-4061809739 [0,0,0,0,0,0|2,0,0]=2 115 B8R1.7 O=C(O)C1=CC=NS1 MCULE-2138423832 [0,0,0,0,0,0|2,0,0]=2 116 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [0,0,0,0,0,0|2,0,1]=3 117 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [0,0,0,0,0,0|3,0,0]=3 118 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [0,0,0,0,0,0|3,0,0]=3 119 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [0,0,0,0,0,0|1,0,1]=2 120 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [0,0,0,0,0,0|1,0,1]=2 121 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [0,0,0,0,0,0|2,0,1]=3 122 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [0,0,0,0,0,0|2,0,1]=3 123 B8R1.7 O=C(O)C1=CN=CO1 MCULE-9125638838 [0,0,0,0,0,0|2,0,0]=2 124 B8R1.7 O=C(O)C1=CN=CS1 MCULE-2664666751 [0,0,0,0,0,0|2,0,0]=2 125 B8R1.7 O=C(O)C1=CN=NN1 MCULE-1013254576 [0,0,0,0,0,0|1,0,1]=2 126 B8R1.7 O=C(O)C1=CN=NN1 MCULE-7639489993 [0,0,0,0,0,0|1,0,1]=2 127 B8R1.7 O=C(O)C1=CN=NS1 MCULE-6369402827 [0,0,0,0,0,0|1,0,1]=2 128 B8R1.7 O=C(O)C1=CNC=C1 MCULE-2877375791 [0,0,0,0,0,0|1,0,0]=1 129 B8R1.7 O=C(O)C1=CNC=N1 MCULE-2208605512 [0,0,0,0,0,0|2,0,0]=2 130 B8R1.7 O=C(O)C1=CNN=C1 MCULE-8448917990 [0,0,0,0,0,0|0,0,0]=0 131 B8R1.7 O=C(O)C1=COC=C1 MCULE-9346491380 [0,0,0,0,0,0|2,0,0]=2 132 B8R1.7 O=C(O)C1=COC=N1 MCULE-6388820863 [0,0,0,0,0,0|3,0,0]=3 133 B8R1.7 O=C(O)C1=COC=N1 MCULE-8404142877 [0,0,0,0,0,0|3,0,0]=3 134 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [0,0,0,0,0,0|2,0,1]=3 135 B8R1.7 O=C(O)C1=CON=C1 MCULE-7299487683 [0,0,0,0,0,0|1,0,0]=1 136 B8R1.7 O=C(O)C1=CSC=C1 MCULE-7934636767 [0,0,0,0,0,0|2,0,0]=2 137 B8R1.7 O=C(O)C1=CSC=N1 MCULE-6783174927 [0,0,0,0,0,0|3,0,0]=3 138 B8R1.7 O=C(O)C1=CSC=N1 MCULE-8933604600 [0,0,0,0,0,0|3,0,0]=3 139 B8R1.7 O=C(O)C1=CSCS1 MCULE-2399429418 [0,0,0,0,0,0|3,0,0]=3 140 B8R1.7 O=C(O)C1=CSN=C1 MCULE-7435297495 [0,0,0,0,0,0|1,0,0]=1 141 B8R1.7 O=C(O)C1=CSN=N1 MCULE-1656119426 [0,0,0,0,0,0|2,0,0]=2 142 B8R1.7 O=C(O)C1=C[NH2+]N=C1 MCULE-2787032965 [0,0,0,0,0,0|0,0,1]=1 143 B8R1.7 O=C(O)C1=NC=CN1 MCULE-2287559596 [0,0,0,0,0,0|4,0,0]=4 144 B8R1.7 O=C(O)C1=NC=CO1 MCULE-3527449990 [0,0,0,0,0,0|4,0,0]=4 145 B8R1.7 O=C(O)C1=NC=CS1 MCULE-2777928670 [0,0,0,0,0,0|4,0,0]=4 146 B8R1.7 O=C(O)C1=NC=NS1 MCULE-8670562232 [0,0,0,0,0,0|3,0,0]=3 147 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [0,0,0,0,0,0|3,0,1]=4 148 B8R1.7 O=C(O)C1=NN=CS1 MCULE-8669048725 [0,0,0,0,0,0|3,0,0]=3 149 B8R1.7 O=C(O)C1=NN=NN1 MCULE-3471680359 [0,0,0,0,0,0|2,0,1]=3 150 B8R1.7 O=C(O)C1=NNC=C1 MCULE-5843831241 [0,0,0,0,0,0|2,0,0]=2 151 B8R1.7 O=C(O)C1=NNC=N1 MCULE-4465582152 [0,0,0,0,0,0|3,0,0]=3 152 B8R1.7 O=C(O)C1=NOC=C1 MCULE-3455230166 [0,0,0,0,0,0|3,0,0]=3 153 B8R1.7 O=C(O)C1=NOC=N1 MCULE-6368000131 [0,0,0,0,0,0|4,0,0]=4 154 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [0,0,0,0,0,0|3,0,1]=4 155 B8R1.7 O=C(O)C1=NON=C1 MCULE-3271564015 [0,0,0,0,0,0|2,0,0]=2 156 B8R1.7 O=C(O)C1=NSC=C1 MCULE-1466108511 [0,0,0,0,0,0|3,0,0]=3 157 B8R1.7 O=C(O)C1=NSN=C1 MCULE-1904082193 [0,0,0,0,0,0|2,0,0]=2 158 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [0,0,0,0,0,0|2,0,2]=4 159 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [0,0,0,0,0,0|3,0,1]=4 160 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [0,0,0,0,0,0|3,0,1]=4 161 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [0,0,0,0,0,0|3,0,1]=4 162 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [0,0,0,0,0,0|3,0,1]=4 163 B8R1.7 O=C(O)C1C=CCO1 MCULE-7417068170 [0,0,0,0,0,0|3,0,1]=4 164 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [0,0,0,0,0,0|1,0,3]=4 165 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [0,0,0,0,0,0|1,0,3]=4 166 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [0,0,0,0,0,0|1,0,3]=4 167 B8R1.7 O=C(O)N1C=CC=C1 MCULE-3945462651 [0,0,0,0,0,0|3,0,0]=3 168 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [0,0,0,0,0,0|3,0,1]=4 169 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [0,0,0,0,0,0|3,0,1]=4 170 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [0,0,0,0,0,0|3,0,1]=4 171 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [0,0,0,0,0,0|3,0,1]=4 172 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [0,0,0,0,0,0|1,0,3]=4 173 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [0,0,0,0,0,0|1,0,3]=4 174 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [0,0,0,0,0,0|1,0,3]=4 175 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [0,0,0,0,0,0|1,0,3]=4 176 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [0,0,0,0,0,0|3,0,1]=4 177 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [0,0,0,0,0,0|3,0,1]=4 178 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [0,0,0,0,0,0|3,0,1]=4 179 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [0,0,0,0,0,0|1,0,3]=4 180 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [0,0,0,0,0,0|1,0,3]=4 181 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [0,0,0,0,0,0|1,0,3]=4 182 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [0,0,0,0,0,0|1,0,3]=4 183 B8R1.7 O=C([O-])C1=CC=CO1 MCULE-6949656709 [0,0,0,0,0,0|3,0,1]=4 184 B8R1.7 O=C([O-])C1=CC=CO1 MCULE-9985902220 [0,0,0,0,0,0|3,0,1]=4 185 B8R1.7 O=C([O-])C1=CC=CS1 MCULE-8307938812 [0,0,0,0,0,0|3,0,1]=4 186 B8R1.7 O=C([O-])C1=CN=CS1 MCULE-2233717368 [0,0,0,0,0,0|2,0,1]=3 187 B8R1.7 O=C([O-])C1=CSC=N1 MCULE-3576531022 [0,0,0,0,0,0|3,0,1]=4 188 B8R1.7 O=N(=O)C1=CC=NN1 MCULE-3222467123 [0,0,0,0,0,0|3,0,1]=4 189 B8R1.7 O=N(=O)C1=CN=CS1 MCULE-3225844837 [0,0,0,0,0,0|3,0,1]=4 190 B8R1.7 O=N(=O)C1=CNC=C1 MCULE-1115787236 [0,0,0,0,0,0|2,0,1]=3 191 B8R1.7 O=N(=O)C1=CNC=N1 MCULE-1767260490 [0,0,0,0,0,0|3,0,1]=4 192 B8R1.7 O=N(=O)C1=CNN=C1 MCULE-5173430814 [0,0,0,0,0,0|1,0,1]=2 193 B8R1.7 O=N(=O)C1=CNN=N1 MCULE-1205937478 [0,0,0,0,0,0|2,0,1]=3 194 B8R1.7 O=N(=O)C1=CON=C1 MCULE-9344801925 [0,0,0,0,0,0|2,0,1]=3 195 B8R1.7 O=N(=O)C1=CSC=C1 MCULE-2009936164 [0,0,0,0,0,0|3,0,1]=4 196 B8R1.7 O=N(=O)C1=CSN=C1 MCULE-6738144191 [0,0,0,0,0,0|2,0,1]=3 197 B8R1.7 O=N(=O)N1C=CN=C1 MCULE-6690563530 [0,0,0,0,0,0|3,0,1]=4 198 B8R1.7 O=S(O)C1=CC=CS1 MCULE-6418817933 [0,0,0,0,0,0|4,0,0]=4 199 B8R1.7 OB(O)C1=CC=NN1 MCULE-8403012396 [0,0,0,0,0,0|3,0,1]=4 200 B8R1.7 OB(O)C1=CC=NO1 MCULE-2996083804 [0,0,0,0,0,0|3,0,1]=4 201 B8R1.7 OB(O)C1=CC=NS1 MCULE-6813033825 [0,0,0,0,0,0|3,0,1]=4 202 B8R1.7 OB(O)C1=CN=CO1 MCULE-1047709684 [0,0,0,0,0,0|3,0,1]=4 203 B8R1.7 OB(O)C1=CN=CS1 MCULE-5572152359 [0,0,0,0,0,0|3,0,1]=4 204 B8R1.7 OB(O)C1=CN=NN1 MCULE-5136569606 [0,0,0,0,0,0|2,0,2]=4 205 B8R1.7 OB(O)C1=CNC=C1 MCULE-5408174866 [0,0,0,0,0,0|2,0,1]=3 206 B8R1.7 OB(O)C1=CNC=N1 MCULE-5901874336 [0,0,0,0,0,0|3,0,1]=4 207 B8R1.7 OB(O)C1=CNN=C1 MCULE-3415967718 [0,0,0,0,0,0|1,0,1]=2 208 B8R1.7 OB(O)C1=CNN=C1 MCULE-7211608385 [0,0,0,0,0,0|1,0,1]=2 209 B8R1.7 OB(O)C1=COC=C1 MCULE-7052005904 [0,0,0,0,0,0|3,0,1]=4 210 B8R1.7 OB(O)C1=CON=C1 MCULE-7504150545 [0,0,0,0,0,0|2,0,1]=3 211 B8R1.7 OB(O)C1=CSC=C1 MCULE-6184290126 [0,0,0,0,0,0|3,0,1]=4 212 B8R1.7 OB(O)C1=CSN=C1 MCULE-3183713539 [0,0,0,0,0,0|2,0,1]=3 213 B8R1.7 OB(O)C1=NNC=C1 MCULE-9919708608 [0,0,0,0,0,0|3,0,1]=4 214 B8R1.7 S=C(S)C1=CN=CN1 MCULE-5846237105 [0,0,0,0,0,0|2,2,0]=4 215 B7R1.1 BrCC1=CNN=C1 MCULE-2115607467 [1,0,0,0,0,0|1,0,1]=3 216 B7R1.1 BrCC1=CNN=C1 MCULE-2332884190 [1,0,0,0,0,0|1,0,1]=3 217 B7R1.1 BrCC1=CON=C1 MCULE-6174675524 [1,0,0,0,0,0|2,0,1]=4 218 B7R1.1 BrCC1=CSN=C1 MCULE-7286847372 [1,0,0,0,0,0|2,0,1]=4 219 B7R1.1 C#CC1=CNC=C1 MCULE-5099428162 [1,0,0,0,0,0|2,0,1]=4 220 B7R1.1 C#CC1=CNN=C1 MCULE-4007113098 [1,0,0,0,0,0|1,0,1]=3 221 B7R1.1 C#CC1=CNN=N1 MCULE-9061548841 [1,0,0,0,0,0|2,0,1]=4 222 B7R1.1 C#CC1=CSN=C1 MCULE-4267565594 [1,0,0,0,0,0|2,0,1]=4 223 B7R1.1 C=CC1=CN=CN1 MCULE-3254889569 [1,0,0,0,0,0|3,0,0]=4 224 B7R1.1 C=CC1=COC=C1 MCULE-5956408409 [1,0,0,0,0,0|3,0,0]=4 225 B7R1.1 C=CC1=CSC=C1 MCULE-7392660446 [1,0,0,0,0,0|3,0,0]=4 226 B7R1.1 C=CC1=NNC=C1 MCULE-6686249168 [1,0,0,0,0,0|3,0,0]=4 227 B7R1.1 C=CN1C=CN=C1 MCULE-4071130364 [1,0,0,0,0,0|3,0,0]=4 228 B7R1.1 CCC1=CNC=C1 MCULE-7105940220 [1,0,0,0,0,0|2,0,1]=4 229 B7R1.1 CCC1=CNN=C1 MCULE-1620759157 [1,0,0,0,0,0|1,0,1]=3 230 B7R1.1 CNC1=CNN=C1 MCULE-5292411751 [1,0,0,0,0,0|2,0,0]=3 231 B7R1.1 CNC1=CNN=C1 MCULE-9897229735 [1,0,0,0,0,0|2,0,0]=3 232 B7R1.1 CNC1=CON=C1 MCULE-7568456114 [1,0,0,0,0,0|3,0,0]=4 233 B7R1.1 COC1=CNN=C1 MCULE-1531814981 [1,0,0,0,0,0|2,0,0]=3 234 B7R1.1 COC1=CNN=C1 MCULE-4640774653 [1,0,0,0,0,0|2,0,0]=3 235 B7R1.1 CSC1=CNN=C1 MCULE-8603325605 [1,0,0,0,0,0|2,0,0]=3 236 B7R1.1 ClCC1=CNN=C1 MCULE-5220574680 [1,0,0,0,0,0|1,0,1]=3 237 B7R1.1 ClCC1=CNN=C1 MCULE-7296587828 [1,0,0,0,0,0|1,0,1]=3 238 B7R1.1 ClCC1=CNN=N1 MCULE-7489974615 [1,0,0,0,0,0|2,0,1]=4 239 B7R1.1 ClCC1=CNN=N1 MCULE-7933864829 [1,0,0,0,0,0|2,0,1]=4 240 B7R1.1 ClCC1=CON=C1 MCULE-7196518100 [1,0,0,0,0,0|2,0,1]=4 241 B7R1.1 ClCC1=CSN=C1 MCULE-2176872399 [1,0,0,0,0,0|2,0,1]=4 242 B7R1.1 N#CC1=CNC=C1 MCULE-6927599825 [1,0,0,0,0,0|2,0,1]=4 243 B7R1.1 N#CC1=CNN=C1 MCULE-4275978799 [1,0,0,0,0,0|1,0,1]=3 244 B7R1.1 N#CC1=CNN=C1 MCULE-6483956395 [1,0,0,0,0,0|1,0,1]=3 245 B7R1.1 N#CC1=CNN=N1 MCULE-7638025488 [1,0,0,0,0,0|2,0,1]=4 246 B7R1.1 N#CC1=CON=C1 MCULE-9441797959 [1,0,0,0,0,0|2,0,1]=4 247 B7R1.1 N#CC1=CSN=C1 MCULE-6222630066 [1,0,0,0,0,0|2,0,1]=4 248 B7R1.1 NCC1=CNC=C1 MCULE-1100801530 [1,0,0,0,0,0|2,0,1]=4 249 B7R1.1 NCC1=CNC=C1 MCULE-8377955542 [1,0,0,0,0,0|2,0,1]=4 250 B7R1.1 NCC1=CNN=C1 MCULE-3762894549 [1,0,0,0,0,0|1,0,1]=3 251 B7R1.1 NCC1=CNN=C1 MCULE-5740077275 [1,0,0,0,0,0|1,0,1]=3 252 B7R1.1 NCC1=CNN=C1 MCULE-8353465704 [1,0,0,0,0,0|1,0,1]=3 253 B7R1.1 NCC1=CNN=C1 MCULE-9759765236 [1,0,0,0,0,0|1,0,1]=3 254 B7R1.1 NCC1=CNN=N1 MCULE-1888725046 [1,0,0,0,0,0|2,0,1]=4 255 B7R1.1 NCC1=CON=C1 MCULE-1890920006 [1,0,0,0,0,0|2,0,1]=4 256 B7R1.1 NCC1=CON=C1 MCULE-6269871043 [1,0,0,0,0,0|2,0,1]=4 257 B7R1.1 NCC1=CON=C1 MCULE-7811104549 [1,0,0,0,0,0|2,0,1]=4 258 B7R1.1 NCC1=CON=C1 MCULE-9825792061 [1,0,0,0,0,0|2,0,1]=4 259 B7R1.1 NCC1=CSN=C1 MCULE-3907746598 [1,0,0,0,0,0|2,0,1]=4 260 B7R1.1 NCC1=CSN=C1 MCULE-4121739401 [1,0,0,0,0,0|2,0,1]=4 261 B7R1.1 NCC1=CSN=C1 MCULE-5796430350 [1,0,0,0,0,0|2,0,1]=4 262 B7R1.1 NCC1=NNN=C1 MCULE-6144313351 [1,0,0,0,0,0|2,0,1]=4 263 B7R1.1 O=CC1=CC=CN1 MCULE-4586543663 [1,0,0,0,0,0|3,0,0]=4 264 B7R1.1 O=CC1=CC=CO1 MCULE-5757882837 [1,0,0,0,0,0|3,0,0]=4 265 B7R1.1 O=CC1=CC=CS1 MCULE-8254409353 [1,0,0,0,0,0|3,0,0]=4 266 B7R1.1 O=CC1=CC=C[Se]1 MCULE-2409744709 [1,0,0,0,0,0|3,0,0]=4 267 B7R1.1 O=CC1=CC=NO1 MCULE-9603824695 [1,0,0,0,0,0|2,0,0]=3 268 B7R1.1 O=CC1=CC=NS1 MCULE-1236687243 [1,0,0,0,0,0|2,0,0]=3 269 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [1,0,0,0,0,0|2,0,1]=4 270 B7R1.1 O=CC1=CCCO1 MCULE-3464963164 [1,0,0,0,0,0|3,0,0]=4 271 B7R1.1 O=CC1=CCSC1 MCULE-9591036145 [1,0,0,0,0,0|2,0,1]=4 272 B7R1.1 O=CC1=CN=CN1 MCULE-5099904928 [1,0,0,0,0,0|2,0,0]=3 273 B7R1.1 O=CC1=CN=CO1 MCULE-7235306258 [1,0,0,0,0,0|2,0,0]=3 274 B7R1.1 O=CC1=CN=CS1 MCULE-4047651092 [1,0,0,0,0,0|2,0,0]=3 275 B7R1.1 O=CC1=CN=NS1 MCULE-7055219202 [1,0,0,0,0,0|1,0,1]=3 276 B7R1.1 O=CC1=CNC=C1 MCULE-2454944558 [1,0,0,0,0,0|1,0,0]=2 277 B7R1.1 O=CC1=CNN=C1 MCULE-4279791999 [1,0,0,0,0,0|0,0,0]=1 278 B7R1.1 O=CC1=CNN=C1 MCULE-4337494909 [1,0,0,0,0,0|0,0,0]=1 279 B7R1.1 O=CC1=CNN=N1 MCULE-8212298542 [1,0,0,0,0,0|1,0,0]=2 280 B7R1.1 O=CC1=COC=C1 MCULE-4433731812 [1,0,0,0,0,0|2,0,0]=3 281 B7R1.1 O=CC1=COC=N1 MCULE-9948589511 [1,0,0,0,0,0|3,0,0]=4 282 B7R1.1 O=CC1=CON=C1 MCULE-5019842093 [1,0,0,0,0,0|1,0,0]=2 283 B7R1.1 O=CC1=CSC=C1 MCULE-4096224591 [1,0,0,0,0,0|2,0,0]=3 284 B7R1.1 O=CC1=CSC=N1 MCULE-9225156161 [1,0,0,0,0,0|3,0,0]=4 285 B7R1.1 O=CC1=CSN=C1 MCULE-8193875899 [1,0,0,0,0,0|1,0,0]=2 286 B7R1.1 O=CC1=CSN=N1 MCULE-1939480478 [1,0,0,0,0,0|2,0,0]=3 287 B7R1.1 O=CC1=NC=NN1 MCULE-7343959266 [1,0,0,0,0,0|3,0,0]=4 288 B7R1.1 O=CC1=NN=CO1 MCULE-2019186249 [1,0,0,0,0,0|3,0,0]=4 289 B7R1.1 O=CC1=NNC=C1 MCULE-5970837649 [1,0,0,0,0,0|2,0,0]=3 290 B7R1.1 O=CC1=NNN=N1 MCULE-9280642489 [1,0,0,0,0,0|2,0,0]=3 291 B7R1.1 O=CC1=NOC=C1 MCULE-6315054980 [1,0,0,0,0,0|3,0,0]=4 292 B7R1.1 O=CC1=NON=C1 MCULE-5467767925 [1,0,0,0,0,0|2,0,0]=3 293 B7R1.1 O=CC1=NSC=C1 MCULE-2006644927 [1,0,0,0,0,0|3,0,0]=4 294 B7R1.1 O=CC1=NSN=C1 MCULE-4602428363 [1,0,0,0,0,0|2,0,0]=3 295 B7R1.1 O=CN1C=CN=C1 MCULE-5644582461 [1,0,0,0,0,0|2,0,0]=3 296 B7R1.1 OCC1=CC=NN1 MCULE-9206734976 [1,0,0,0,0,0|2,0,1]=4 297 B7R1.1 OCC1=CC=NO1 MCULE-9887136642 [1,0,0,0,0,0|2,0,1]=4 298 B7R1.1 OCC1=CC=NS1 MCULE-5309327051 [1,0,0,0,0,0|2,0,1]=4 299 B7R1.1 OCC1=CN=CO1 MCULE-5114487613 [1,0,0,0,0,0|2,0,1]=4 300 B7R1.1 OCC1=CN=CS1 MCULE-7378624461 [1,0,0,0,0,0|2,0,1]=4 301 B7R1.1 OCC1=CN=NN1 MCULE-2812101931 [1,0,0,0,0,0|1,0,2]=4 302 B7R1.1 OCC1=CN=NS1 MCULE-2440476872 [1,0,0,0,0,0|1,0,2]=4 303 B7R1.1 OCC1=CNC=C1 MCULE-3286092527 [1,0,0,0,0,0|1,0,1]=3 304 B7R1.1 OCC1=CNC=N1 MCULE-7372960664 [1,0,0,0,0,0|2,0,1]=4 305 B7R1.1 OCC1=CNC=N1 MCULE-7985661576 [1,0,0,0,0,0|2,0,1]=4 306 B7R1.1 OCC1=CNN=C1 MCULE-3322868006 [1,0,0,0,0,0|0,0,1]=2 307 B7R1.1 OCC1=CNN=N1 MCULE-2742980446 [1,0,0,0,0,0|1,0,1]=3 308 B7R1.1 OCC1=COC=C1 MCULE-1188853308 [1,0,0,0,0,0|2,0,1]=4 309 B7R1.1 OCC1=CON=C1 MCULE-5122190603 [1,0,0,0,0,0|1,0,1]=3 310 B7R1.1 OCC1=CSC=C1 MCULE-5715575511 [1,0,0,0,0,0|2,0,1]=4 311 B7R1.1 OCC1=CSN=C1 MCULE-2901892714 [1,0,0,0,0,0|1,0,1]=3 312 B7R1.1 OCC1=CSN=N1 MCULE-4791447458 [1,0,0,0,0,0|2,0,1]=4 313 B7R1.1 OCC1=NNC=C1 MCULE-7625791296 [1,0,0,0,0,0|2,0,1]=4 314 B7R1.1 OCC1=NON=C1 MCULE-7693226761 [1,0,0,0,0,0|2,0,1]=4 315 B7R1.1 OCC1=NSN=C1 MCULE-3073517860 [1,0,0,0,0,0|2,0,1]=4 316 B7R1.1 OCN1C=CN=C1 MCULE-2697787926 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.11 CCC(=O)C1=CNC=N1 MCULE-1356544138 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.11 CCC(=O)C1=CNN=C1 MCULE-6693189042 [0,1,0,0,0,0|1,0,0]=2 319 B9R1.11 CCC(=O)C1=CNN=C1 MCULE-9349587181 [0,1,0,0,0,0|1,0,0]=2 320 B9R1.11 CCC(=O)C1=COC=C1 MCULE-5288816813 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.11 CCC(=O)C1=CSC=C1 MCULE-6525890952 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.11 CCC(=O)N1C=CN=C1 MCULE-2693124590 [0,1,0,0,0,0|3,0,0]=4 323 B9R1.11 CNC(=O)C1=CN=CN1 MCULE-5759305620 [0,1,0,0,0,0|3,0,0]=4 324 B9R1.11 CNC(=O)C1=CNN=C1 MCULE-9468350330 [0,1,0,0,0,0|1,0,0]=2 325 B9R1.11 CNC(=O)C1=CSC=C1 MCULE-1963219302 [0,1,0,0,0,0|3,0,0]=4 326 B9R1.11 CNC(=O)C1=NNC=C1 MCULE-7028350973 [0,1,0,0,0,0|3,0,0]=4 327 B9R1.11 CNC(=O)N1C=CN=C1 MCULE-9971917384 [0,1,0,0,0,0|3,0,0]=4 328 B9R1.11 COC(=N)C1=CNC=N1 MCULE-3953287408 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.11 COC(=N)C1=CNC=N1 MCULE-7197871230 [0,1,0,0,0,0|3,0,0]=4 330 B9R1.11 COC(=O)C1=CC=CN1 MCULE-1019290603 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.11 COC(=O)C1=CC=CO1 MCULE-5445948487 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.11 COC(=O)C1=CC=CS1 MCULE-4187665335 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.11 COC(=O)C1=CC=NO1 MCULE-8662259655 [0,1,0,0,0,0|2,0,0]=3 334 B9R1.11 COC(=O)C1=CC=NS1 MCULE-2853780519 [0,1,0,0,0,0|2,0,0]=3 335 B9R1.11 COC(=O)C1=CCCC1 MCULE-3606282792 [0,1,0,0,0,0|2,0,1]=4 336 B9R1.11 COC(=O)C1=CCSC1 MCULE-2255227686 [0,1,0,0,0,0|2,0,1]=4 337 B9R1.11 COC(=O)C1=CN=CN1 MCULE-3275771291 [0,1,0,0,0,0|2,0,0]=3 338 B9R1.11 COC(=O)C1=CN=CN1 MCULE-8084262259 [0,1,0,0,0,0|2,0,0]=3 339 B9R1.11 COC(=O)C1=CN=CO1 MCULE-1331657317 [0,1,0,0,0,0|2,0,0]=3 340 B9R1.11 COC(=O)C1=CN=CS1 MCULE-4975175162 [0,1,0,0,0,0|2,0,0]=3 341 B9R1.11 COC(=O)C1=CNC=C1 MCULE-2322635433 [0,1,0,0,0,0|1,0,0]=2 342 B9R1.11 COC(=O)C1=CNN=C1 MCULE-6521983972 [0,1,0,0,0,0|0,0,0]=1 343 B9R1.11 COC(=O)C1=CNN=C1 MCULE-6524491075 [0,1,0,0,0,0|0,0,0]=1 344 B9R1.11 COC(=O)C1=CNN=N1 MCULE-4367607305 [0,1,0,0,0,0|1,0,0]=2 345 B9R1.11 COC(=O)C1=COC=C1 MCULE-1170526315 [0,1,0,0,0,0|2,0,0]=3 346 B9R1.11 COC(=O)C1=COC=N1 MCULE-8403924189 [0,1,0,0,0,0|3,0,0]=4 347 B9R1.11 COC(=O)C1=COCC1 MCULE-7180516511 [0,1,0,0,0,0|2,0,1]=4 348 B9R1.11 COC(=O)C1=CON=C1 MCULE-1915140001 [0,1,0,0,0,0|1,0,0]=2 349 B9R1.11 COC(=O)C1=CSC=C1 MCULE-3297346362 [0,1,0,0,0,0|2,0,0]=3 350 B9R1.11 COC(=O)C1=CSC=N1 MCULE-4849990142 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.11 COC(=O)C1=CSN=C1 MCULE-7173282244 [0,1,0,0,0,0|1,0,0]=2 352 B9R1.11 COC(=O)C1=CSN=N1 MCULE-2896926048 [0,1,0,0,0,0|2,0,0]=3 353 B9R1.11 COC(=O)C1=NN=CN1 MCULE-3578265073 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.11 COC(=O)C1=NNC=C1 MCULE-7995555155 [0,1,0,0,0,0|2,0,0]=3 355 B9R1.11 COC(=O)C1=NOC=C1 MCULE-7086247973 [0,1,0,0,0,0|3,0,0]=4 356 B9R1.11 COC(=O)C1=NSC=C1 MCULE-1031368275 [0,1,0,0,0,0|3,0,0]=4 357 B9R1.11 COC(=O)N1C=CC=C1 MCULE-5368572699 [0,1,0,0,0,0|3,0,0]=4 358 B9R1.11 COC(=O)N1C=CN=C1 MCULE-7469375896 [0,1,0,0,0,0|2,0,0]=3 359 B9R1.11 N/C(=N\O)/C1=CSC=C1 MCULE-4525945218 [0,1,0,0,0,0|3,0,0]=4 360 B9R1.11 N=C(NO)C1=CN=CN1 MCULE-4121489812 [0,1,0,0,0,0|3,0,0]=4 361 B9R1.11 NCC(=O)C1=CC=NN1 MCULE-9171044425 [0,1,0,0,0,0|3,0,0]=4 362 B9R1.11 NCC(=O)C1=CSC=C1 MCULE-1136870027 [0,1,0,0,0,0|3,0,0]=4 363 B9R1.11 NCC(=O)C1=CSC=C1 MCULE-8519816800 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.11 NCC(=O)C1=NNC=C1 MCULE-7349681278 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.11 NNC(=O)C1=CC=NN1 MCULE-1004153118 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.11 NNC(=O)C1=CC=NO1 MCULE-5815778810 [0,1,0,0,0,0|3,0,0]=4 367 B9R1.11 NNC(=O)C1=CN=CO1 MCULE-5646440999 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.11 NNC(=O)C1=CN=CS1 MCULE-6847321376 [0,1,0,0,0,0|3,0,0]=4 369 B9R1.11 NNC(=O)C1=CNC=N1 MCULE-4530505403 [0,1,0,0,0,0|3,0,0]=4 370 B9R1.11 NNC(=O)C1=CNN=C1 MCULE-4554097575 [0,1,0,0,0,0|1,0,0]=2 371 B9R1.11 NNC(=O)C1=CNN=N1 MCULE-3683260419 [0,1,0,0,0,0|2,0,0]=3 372 B9R1.11 NNC(=O)C1=COC=C1 MCULE-4367314803 [0,1,0,0,0,0|3,0,0]=4 373 B9R1.11 NNC(=O)C1=CON=C1 MCULE-2177997815 [0,1,0,0,0,0|2,0,0]=3 374 B9R1.11 NNC(=O)C1=CSC=C1 MCULE-8094630241 [0,1,0,0,0,0|3,0,0]=4 375 B9R1.11 NNC(=O)C1=CSN=N1 MCULE-7282588090 [0,1,0,0,0,0|3,0,0]=4 376 B9R1.11 NNC(=O)C1=NSN=C1 MCULE-4203613856 [0,1,0,0,0,0|3,0,0]=4 377 B9R1.11 O=C(CBr)C1=CC=NO1 MCULE-2831148171 [0,1,0,0,0,0|3,0,0]=4 378 B9R1.11 O=C(CBr)C1=CN=CS1 MCULE-2137162462 [0,1,0,0,0,0|3,0,0]=4 379 B9R1.11 O=C(CBr)C1=CN=CS1 MCULE-4277308944 [0,1,0,0,0,0|3,0,0]=4 380 B9R1.11 O=C(CBr)C1=CSC=C1 MCULE-5717303436 [0,1,0,0,0,0|3,0,0]=4 381 B9R1.11 O=C(CCl)C1=CC=NS1 MCULE-6147745993 [0,1,0,0,0,0|3,0,0]=4 382 B9R1.11 O=C(CCl)C1=COC=C1 MCULE-2984056626 [0,1,0,0,0,0|3,0,0]=4 383 B9R1.11 O=C(CO)C1=CC=CO1 MCULE-4777881428 [0,1,0,0,0,0|3,0,0]=4 384 B9R1.11 O=C(CO)C1=CC=CS1 MCULE-2449722487 [0,1,0,0,0,0|3,0,0]=4 385 B9R1.11 O=C(NO)C1=CC=CO1 MCULE-2557625376 [0,1,0,0,0,0|3,0,0]=4 386 B9R1.11 O=C(NO)C1=CCCC1 MCULE-3789818826 [0,1,0,0,0,0|2,0,1]=4 387 B9R1.11 O=C(NO)C1=CSN=N1 MCULE-7901073998 [0,1,0,0,0,0|2,0,0]=3 388 B9R1.11 O=CC(=O)C1=CN=CS1 MCULE-1081234167 [0,1,0,0,0,0|2,0,1]=4 389 B9R1.19 CC(C)(C)C1=CNN=C1 MCULE-4530632434 [0,1,0,0,0,0|2,0,1]=4 390 B9R1.19 CC(C)(O)C1=CNN=C1 MCULE-6762094563 [0,1,0,0,0,0|1,0,1]=3 391 B9R1.19 CC(F)(F)C1=CNN=C1 MCULE-2941438032 [0,1,0,0,0,0|2,0,1]=4 392 B9R1.19 CS(=O)(=O)C1=CNC=C1 MCULE-6666989820 [0,1,0,0,0,0|2,0,1]=4 393 B9R1.19 CS(=O)(=O)C1=CNN=C1 MCULE-7044752595 [0,1,0,0,0,0|1,0,1]=3 394 B9R1.19 FC(F)(F)C1=CNN=C1 MCULE-7601642057 [0,1,0,0,0,0|2,0,1]=4 395 B9R1.19 F[B-](F)(F)C1=CNN=C1 MCULE-5011237667 [0,1,0,0,0,0|3,0,0]=4 396 B9R1.19 F[B-](F)(F)C1=CNN=C1 MCULE-6937646772 [0,1,0,0,0,0|3,0,0]=4 397 B9R1.19 NS(=O)(=O)C1=CNC=C1 MCULE-8593334312 [0,1,0,0,0,0|2,0,1]=4 398 B9R1.19 NS(=O)(=O)C1=CNN=C1 MCULE-5246127891 [0,1,0,0,0,0|1,0,1]=3 399 B9R1.19 O=S(=O)(Cl)C1=CNN=C1 MCULE-5028589725 [0,1,0,0,0,0|1,0,1]=3 400 B9R1.19 O=S(=O)(Cl)C1=CNN=C1 MCULE-7252051218 [0,1,0,0,0,0|1,0,1]=3 401 B9R1.19 O=S(=O)(Cl)C1=CNN=C1 MCULE-7986915875 [0,1,0,0,0,0|1,0,1]=3 402 B9R1.19 O=S(=O)(Cl)C1=CON=C1 MCULE-3465558351 [0,1,0,0,0,0|2,0,1]=4 403 B9R1.19 O=S(=O)(Cl)C1=CSN=C1 MCULE-4737483133 [0,1,0,0,0,0|2,0,1]=4 404 B9R1.19 O=S(=O)(F)C1=NNN=C1 MCULE-1283758357 [0,1,0,0,0,0|2,0,1]=4 405 B9R1.19 O=S(=O)(F)C1=NNN=C1 MCULE-7116794615 [0,1,0,0,0,0|2,0,1]=4 406 B9R1.19 O=S(=O)(O)C1=CNC=N1 MCULE-1102014113 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.19 O=S(=O)(O)C1=CNC=N1 MCULE-1562068546 [0,1,0,0,0,0|3,0,0]=4 408 B9R1.35 C=C(C)C1=CN(N=C1)C MCULE-5957626766 [0,1,0,0,0,0|2,0,0]=3 409 B9R1.35 CC(=O)C1=CC(=NN1)C MCULE-1737620160 [0,1,0,0,0,0|3,0,0]=4 410 B9R1.35 CC(=O)C1=CC(=NN1)N MCULE-7916886776 [0,1,0,0,0,0|3,0,0]=4 411 B9R1.35 CC(=O)C1=CC(=NN1)N MCULE-9458933053 [0,1,0,0,0,0|3,0,0]=4 412 B9R1.35 CC(=O)C1=CC(=NO1)Br MCULE-2447097756 [0,1,0,0,0,0|3,0,0]=4 413 B9R1.35 CC(=O)C1=CC(=NO1)C MCULE-4343959902 [0,1,0,0,0,0|3,0,0]=4 414 B9R1.35 CC(=O)C1=CC(=NS1)C MCULE-3586371676 [0,1,0,0,0,0|3,0,0]=4 415 B9R1.35 CC(=O)C1=CN(C=C1)C MCULE-9521509861 [0,1,0,0,0,0|2,0,0]=3 416 B9R1.35 CC(=O)C1=CN(C=N1)C MCULE-1478441231 [0,1,0,0,0,0|3,0,0]=4 417 B9R1.35 CC(=O)C1=CN(N=C1)C MCULE-2104273429 [0,1,0,0,0,0|1,0,0]=2 418 B9R1.35 CC(=O)C1=CN(N=N1)C MCULE-7250768393 [0,1,0,0,0,0|2,0,0]=3 419 B9R1.35 CC(=O)C1=CN=C(N1)C MCULE-1404378441 [0,1,0,0,0,0|3,0,0]=4 420 B9R1.35 CC(=O)C1=CN=C(N1)N MCULE-4678587309 [0,1,0,0,0,0|3,0,0]=4 421 B9R1.35 CC(=O)C1=CN=C(O1)N MCULE-3094522836 [0,1,0,0,0,0|3,0,0]=4 422 B9R1.35 CC(=O)C1=CN=C(S1)Br MCULE-1383117787 [0,1,0,0,0,0|3,0,0]=4 423 B9R1.35 CC(=O)C1=CN=C(S1)C MCULE-4356350153 [0,1,0,0,0,0|3,0,0]=4 424 B9R1.35 CC(=O)C1=CN=C(S1)Cl MCULE-1639836745 [0,1,0,0,0,0|3,0,0]=4 425 B9R1.35 CC(=O)C1=CN=C(S1)N MCULE-3846243704 [0,1,0,0,0,0|3,0,0]=4 426 B9R1.35 CC(=O)C1=CN=C(S1)N MCULE-5682299017 [0,1,0,0,0,0|3,0,0]=4 427 B9R1.35 CC(=O)C1=CNC(=C1)Br MCULE-2967980252 [0,1,0,0,0,0|2,0,0]=3 428 B9R1.35 CC(=O)C1=CNC(=C1)C MCULE-4421020533 [0,1,0,0,0,0|2,0,0]=3 429 B9R1.35 CC(=O)C1=CSC(=C1)Br MCULE-5063599096 [0,1,0,0,0,0|3,0,0]=4 430 B9R1.35 CC(=O)C1=CSC(=C1)C MCULE-3547711889 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.35 CC(=O)C1=CSC(=C1)Cl MCULE-8295872194 [0,1,0,0,0,0|3,0,0]=4 432 B9R1.35 CC(=O)C1=NN(C=C1)C MCULE-7055752762 [0,1,0,0,0,0|3,0,0]=4 433 B9R1.35 CC(=O)C1=NN(N=C1)C MCULE-6863465409 [0,1,0,0,0,0|2,0,0]=3 434 B9R1.35 CC(N)C1=CN(N=C1)C MCULE-2569500392 [0,1,0,0,0,0|2,0,1]=4 435 B9R1.35 CC(N)C1=CN(N=C1)C MCULE-7657784712 [0,1,0,0,0,0|2,0,1]=4 436 B9R1.35 CC(O)C1=CN(N=C1)C MCULE-1893507389 [0,1,0,0,0,0|1,0,1]=3 437 B9R1.35 CC(O)C1=CN(N=N1)C MCULE-2829941323 [0,1,0,0,0,0|2,0,1]=4 438 B9R1.35 CC1=CC(=CN1)C(=O)O MCULE-4982775315 [0,1,0,0,0,0|1,0,0]=2 439 B9R1.35 CC1=CC(=CO1)C(=O)O MCULE-3833413693 [0,1,0,0,0,0|2,0,0]=3 440 B9R1.35 CC1=CC(=CS1)C(=O)Cl MCULE-5698540738 [0,1,0,0,0,0|3,0,0]=4 441 B9R1.35 CC1=CC(=CS1)C(=O)O MCULE-5909428849 [0,1,0,0,0,0|2,0,0]=3 442 B9R1.35 CC1=CC(=NN1)C(=O)N MCULE-3289950808 [0,1,0,0,0,0|3,0,0]=4 443 B9R1.35 CC1=CC(=NO1)C(=O)O MCULE-5247185976 [0,1,0,0,0,0|3,0,0]=4 444 B9R1.35 CC1=CC(=NS1)C(=O)O MCULE-7973412349 [0,1,0,0,0,0|3,0,0]=4 445 B9R1.35 CC1=CC=C(N1)C(=O)O MCULE-6987274204 [0,1,0,0,0,0|3,0,0]=4 446 B9R1.35 CC1=CC=C(O1)C(=O)O MCULE-6590848957 [0,1,0,0,0,0|3,0,0]=4 447 B9R1.35 CC1=CC=C(S1)C(=O)O MCULE-6715993492 [0,1,0,0,0,0|3,0,0]=4 448 B9R1.35 CC1=CNC(=C1)C(=O)O MCULE-7059587168 [0,1,0,0,0,0|3,0,0]=4 449 B9R1.35 CC1=COC(=C1)C(=O)O MCULE-9747579066 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.35 CC1=CSC(=C1)C(=O)O MCULE-6801775447 [0,1,0,0,0,0|3,0,0]=4 451 B9R1.35 CC1=NC(=CN1)C(=O)O MCULE-9687548902 [0,1,0,0,0,0|2,0,0]=3 452 B9R1.35 CC1=NC(=CO1)C(=O)O MCULE-5941440614 [0,1,0,0,0,0|3,0,0]=4 453 B9R1.35 CC1=NC(=CS1)C(=O)O MCULE-2302425661 [0,1,0,0,0,0|3,0,0]=4 454 B9R1.35 CC1=NC(=CS1)C(=O)O MCULE-5100080967 [0,1,0,0,0,0|3,0,0]=4 455 B9R1.35 CC1=NC(=CS1)C(=O)O MCULE-8354893803 [0,1,0,0,0,0|3,0,0]=4 456 B9R1.35 CC1=NC=C(O1)C(=O)N MCULE-1951896352 [0,1,0,0,0,0|3,0,0]=4 457 B9R1.35 CC1=NC=C(O1)C(=O)O MCULE-6374752093 [0,1,0,0,0,0|2,0,0]=3 458 B9R1.35 CC1=NC=C(S1)C(=O)Cl MCULE-8797719945 [0,1,0,0,0,0|3,0,0]=4 459 B9R1.35 CC1=NC=C(S1)C(=O)O MCULE-1715629651 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.35 CC1=NN=C(O1)C(=O)O MCULE-7165747305 [0,1,0,0,0,0|3,0,0]=4 461 B9R1.35 CC1=NN=C(S1)C(=O)O MCULE-5693293495 [0,1,0,0,0,0|3,0,0]=4 462 B9R1.35 CC1=NNC(=C1)C(=O)O MCULE-9971793748 [0,1,0,0,0,0|2,0,0]=3 463 B9R1.35 CC1=NNC(=N1)C(=O)O MCULE-4888726994 [0,1,0,0,0,0|3,0,0]=4 464 B9R1.35 CC1=NOC(=C1)C(=O)Cl MCULE-5917107050 [0,1,0,0,0,0|3,0,0]=4 465 B9R1.35 CC1=NOC(=C1)C(=O)N MCULE-6678237651 [0,1,0,0,0,0|3,0,0]=4 466 B9R1.35 CC1=NOC(=C1)C(=O)O MCULE-2998502701 [0,1,0,0,0,0|2,0,0]=3 467 B9R1.35 CC1=NOC(=N1)C(=O)O MCULE-9511727615 [0,1,0,0,0,0|3,0,0]=4 468 B9R1.35 CC1=NSC(=C1)C(=O)O MCULE-7076994703 [0,1,0,0,0,0|2,0,0]=3 469 B9R1.35 CC1=NSC(=N1)C(=O)O MCULE-1407426115 [0,1,0,0,0,0|3,0,0]=4 470 B9R1.35 CN1C=C(C=N1)B(O)O MCULE-1442646373 [0,1,0,0,0,0|1,0,1]=3 471 B9R1.35 CN1C=C(C=N1)B(O)O MCULE-2245182924 [0,1,0,0,0,0|1,0,1]=3 472 B9R1.35 CN1C=C(C=N1)C(=N)N MCULE-4713312392 [0,1,0,0,0,0|2,0,0]=3 473 B9R1.35 CN1C=C(C=N1)C(=N)N MCULE-5938512214 [0,1,0,0,0,0|2,0,0]=3 474 B9R1.35 CN1C=C(C=N1)C(=O)Cl MCULE-5187067136 [0,1,0,0,0,0|1,0,0]=2 475 B9R1.35 CN1C=C(C=N1)C(=O)N MCULE-7868747513 [0,1,0,0,0,0|1,0,0]=2 476 B9R1.35 CN1C=C(C=N1)C(=O)O MCULE-4399518565 [0,1,0,0,0,0|0,0,0]=1 477 B9R1.35 CN1C=C(C=N1)C(=O)[O-] MCULE-3773548979 [0,1,0,0,0,0|0,0,1]=2 478 B9R1.35 CN1C=C(C=N1)C(=S)N MCULE-1391898817 [0,1,0,0,0,0|1,1,0]=3 479 B9R1.35 CN1C=C(C=N1)C(F)F MCULE-8492689558 [0,1,0,0,0,0|2,0,1]=4 480 B9R1.35 CN1C=C(C=N1)N(=O)=O MCULE-6430031077 [0,1,0,0,0,0|1,0,1]=3 481 B9R1.35 CN1C=C(C=N1)S(=O)[O-] MCULE-3528853941 [0,1,0,0,0,0|1,0,1]=3 482 B9R1.35 CN1C=C(C=N1)S(=O)[O-] MCULE-4679652606 [0,1,0,0,0,0|1,0,1]=3 483 B9R1.35 CN1C=C(N=N1)B(O)O MCULE-9295876739 [0,1,0,0,0,0|2,0,1]=4 484 B9R1.35 CN1C=C(N=N1)C(=O)N MCULE-5732407238 [0,1,0,0,0,0|2,0,0]=3 485 B9R1.35 CN1C=C(N=N1)C(=O)O MCULE-4712753107 [0,1,0,0,0,0|1,0,0]=2 486 B9R1.35 CN1C=C(N=N1)C(=S)N MCULE-7938267809 [0,1,0,0,0,0|2,1,0]=4 487 B9R1.35 CN1C=C(N=N1)N(=O)=O MCULE-6445411412 [0,1,0,0,0,0|2,0,1]=4 488 B9R1.35 CN1C=CC(=C1)C(=O)O MCULE-1624976508 [0,1,0,0,0,0|1,0,0]=2 489 B9R1.35 CN1C=CC(=C1)N(=O)=O MCULE-4437027248 [0,1,0,0,0,0|2,0,1]=4 490 B9R1.35 CN1C=CC(=N1)C(=O)Cl MCULE-2579408359 [0,1,0,0,0,0|3,0,0]=4 491 B9R1.35 CN1C=CC(=N1)C(=O)N MCULE-9814075297 [0,1,0,0,0,0|3,0,0]=4 492 B9R1.35 CN1C=CC(=N1)C(=O)O MCULE-3162926527 [0,1,0,0,0,0|2,0,0]=3 493 B9R1.35 CN1C=NC(=C1)C(=O)N MCULE-8189346957 [0,1,0,0,0,0|3,0,0]=4 494 B9R1.35 CN1C=NC(=C1)C(=O)O MCULE-6425519215 [0,1,0,0,0,0|2,0,0]=3 495 B9R1.35 CN1C=NC(=N1)C(=O)O MCULE-4268221307 [0,1,0,0,0,0|3,0,0]=4 496 B9R1.35 CN1N=CC(=N1)C(=O)O MCULE-8939192853 [0,1,0,0,0,0|1,0,0]=2 497 B9R1.35 CN1N=CC(=N1)N(=O)=O MCULE-5218968299 [0,1,0,0,0,0|2,0,1]=4 498 B9R1.35 CN1N=NC(=N1)C(=O)N MCULE-6008629216 [0,1,0,0,0,0|3,0,0]=4 499 B9R1.35 CN1N=NC(=N1)C(=O)O MCULE-9433135806 [0,1,0,0,0,0|2,0,0]=3 500 B9R1.35 C[C@@H](N)C1=CN(N=C1)C MCULE-6046290735 [0,1,0,0,0,0|2,0,1]=4 501 B9R1.35 C[C@@H](N)C1=CN(N=C1)C MCULE-8424780265 [0,1,0,0,0,0|2,0,1]=4 502 B9R1.35 C[C@H](N)C1=CN(N=C1)C MCULE-1521995085 [0,1,0,0,0,0|2,0,1]=4 503 B9R1.35 C[C@H](N)C1=CN(N=C1)C MCULE-2703821517 [0,1,0,0,0,0|2,0,1]=4 504 B9R1.35 NC(=O)C1=CC(=NO1)Br MCULE-9814488457 [0,1,0,0,0,0|3,0,0]=4 505 B9R1.35 NC(=O)C1=CC(=NO1)O MCULE-7072418191 [0,1,0,0,0,0|3,0,0]=4 506 B9R1.35 NC(=O)C1=CN=C(O1)N MCULE-3769650861 [0,1,0,0,0,0|3,0,0]=4 507 B9R1.35 NC(=O)C1=CN=C(S1)Br MCULE-4877913034 [0,1,0,0,0,0|3,0,0]=4 508 B9R1.35 NC(=O)C1=CN=C(S1)Cl MCULE-1370349188 [0,1,0,0,0,0|3,0,0]=4 509 B9R1.35 NC(=O)C1=CN=C(S1)N MCULE-3353996184 [0,1,0,0,0,0|3,0,0]=4 510 B9R1.35 NC(=O)C1=COC(=C1)Br MCULE-5622241125 [0,1,0,0,0,0|3,0,0]=4 511 B9R1.35 NC(=O)C1=CSC(=C1)Br MCULE-9192263859 [0,1,0,0,0,0|3,0,0]=4 512 B9R1.35 NC(=O)C1=CSC(=C1)Cl MCULE-5261359218 [0,1,0,0,0,0|3,0,0]=4 513 B9R1.35 NC(=O)C1=CSC(=C1)N MCULE-3057114401 [0,1,0,0,0,0|3,0,0]=4 514 B9R1.35 NC(=O)C1=NNC(=C1)F MCULE-7738314232 [0,1,0,0,0,0|3,0,0]=4 515 B9R1.35 NC(=O)C1=NNC(=C1)N MCULE-1398772840 [0,1,0,0,0,0|3,0,0]=4 516 B9R1.35 NC(=O)C1=NNC(=C1)N MCULE-9331505515 [0,1,0,0,0,0|3,0,0]=4 517 B9R1.35 NC1=CC(=CS1)C(=O)O MCULE-2963920308 [0,1,0,0,0,0|2,0,0]=3 518 B9R1.35 NC1=CC(=CS1)C(=O)O MCULE-5571428862 [0,1,0,0,0,0|2,0,0]=3 519 B9R1.35 NC1=CC(=NN1)C(=O)O MCULE-9614770025 [0,1,0,0,0,0|2,0,0]=3 520 B9R1.35 NC1=CC=C(N1)C(=O)O MCULE-5208029782 [0,1,0,0,0,0|3,0,0]=4 521 B9R1.35 NC1=CNC(=C1)C(=O)O MCULE-5415250073 [0,1,0,0,0,0|3,0,0]=4 522 B9R1.35 NC1=CSC(=C1)C(=O)O MCULE-4848582549 [0,1,0,0,0,0|3,0,0]=4 523 B9R1.35 NC1=CSC(=C1)C(=O)O MCULE-7512029277 [0,1,0,0,0,0|3,0,0]=4 524 B9R1.35 NC1=NC(=CN1)C(=O)O MCULE-1485966557 [0,1,0,0,0,0|2,0,0]=3 525 B9R1.35 NC1=NC(=CO1)C(=O)O MCULE-7591773620 [0,1,0,0,0,0|3,0,0]=4 526 B9R1.35 NC1=NC(=CS1)C(=O)O MCULE-2940184015 [0,1,0,0,0,0|3,0,0]=4 527 B9R1.35 NC1=NC(=CS1)C(=O)O MCULE-6733274164 [0,1,0,0,0,0|3,0,0]=4 528 B9R1.35 NC1=NC(=CS1)C(=O)O MCULE-8372887078 [0,1,0,0,0,0|3,0,0]=4 529 B9R1.35 NC1=NC=C(O1)C(=O)O MCULE-9746785354 [0,1,0,0,0,0|2,0,0]=3 530 B9R1.35 NC1=NC=C(S1)C(=O)O MCULE-7626123830 [0,1,0,0,0,0|2,0,0]=3 531 B9R1.35 NC1=NN=C(O1)C(=O)O MCULE-6520978340 [0,1,0,0,0,0|3,0,0]=4 532 B9R1.35 NC1=NN=C(S1)C(=O)O MCULE-9742352474 [0,1,0,0,0,0|3,0,0]=4 533 B9R1.35 NC1=NNC(=C1)C(=O)O MCULE-3685279381 [0,1,0,0,0,0|2,0,0]=3 534 B9R1.35 NC1=NOC(=C1)C(=O)O MCULE-6813059933 [0,1,0,0,0,0|2,0,0]=3 535 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-7944190057 [0,1,0,0,0,0|2,0,1]=4 536 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-9202589777 [0,1,0,0,0,0|2,0,1]=4 537 B9R1.35 NN1C=C(C=N1)N(=O)=O MCULE-5714268486 [0,1,0,0,0,0|1,0,1]=3 538 B9R1.35 O=C(Cl)C1=CN=C(S1)Br MCULE-8425279720 [0,1,0,0,0,0|3,0,0]=4 539 B9R1.35 O=C(Cl)C1=CN=C(S1)Cl MCULE-4333447485 [0,1,0,0,0,0|3,0,0]=4 540 B9R1.35 O=C(O)C1=CC(=CN1)Br MCULE-5413993794 [0,1,0,0,0,0|3,0,0]=4 541 B9R1.35 O=C(O)C1=CC(=CN1)Cl MCULE-3563331543 [0,1,0,0,0,0|3,0,0]=4 542 B9R1.35 O=C(O)C1=CC(=CN1)F MCULE-5396770825 [0,1,0,0,0,0|3,0,0]=4 543 B9R1.35 O=C(O)C1=CC(=CN1)I MCULE-6663353052 [0,1,0,0,0,0|3,0,0]=4 544 B9R1.35 O=C(O)C1=CC(=CO1)Br MCULE-8874165183 [0,1,0,0,0,0|3,0,0]=4 545 B9R1.35 O=C(O)C1=CC(=CO1)Cl MCULE-2755887010 [0,1,0,0,0,0|3,0,0]=4 546 B9R1.35 O=C(O)C1=CC(=CS1)Br MCULE-3215230238 [0,1,0,0,0,0|3,0,0]=4 547 B9R1.35 O=C(O)C1=CC(=CS1)Cl MCULE-5391563592 [0,1,0,0,0,0|3,0,0]=4 548 B9R1.35 O=C(O)C1=CC(=CS1)F MCULE-6565971084 [0,1,0,0,0,0|3,0,0]=4 549 B9R1.35 O=C(O)C1=CC(=CS1)O MCULE-4772728495 [0,1,0,0,0,0|3,0,0]=4 550 B9R1.35 O=C(O)C1=CC(=NN1)F MCULE-6990144057 [0,1,0,0,0,0|2,0,0]=3 551 B9R1.35 O=C(O)C1=CC(=NO1)Br MCULE-6001904598 [0,1,0,0,0,0|2,0,0]=3 552 B9R1.35 O=C(O)C1=CC(=NO1)Cl MCULE-3407836735 [0,1,0,0,0,0|2,0,0]=3 553 B9R1.35 O=C(O)C1=CC(=NO1)O MCULE-4091331329 [0,1,0,0,0,0|2,0,0]=3 554 B9R1.35 O=C(O)C1=CC(=NS1)Br MCULE-4532819327 [0,1,0,0,0,0|2,0,0]=3 555 B9R1.35 O=C(O)C1=CC(=NS1)Cl MCULE-1642084386 [0,1,0,0,0,0|2,0,0]=3 556 B9R1.35 O=C(O)C1=CC(CC1)O MCULE-6046983646 [0,1,0,0,0,0|2,0,1]=4 557 B9R1.35 O=C(O)C1=CC=C(N1)Br MCULE-7394837443 [0,1,0,0,0,0|3,0,0]=4 558 B9R1.35 O=C(O)C1=CC=C(N1)Cl MCULE-5770211324 [0,1,0,0,0,0|3,0,0]=4 559 B9R1.35 O=C(O)C1=CC=C(O1)Br MCULE-6194417885 [0,1,0,0,0,0|3,0,0]=4 560 B9R1.35 O=C(O)C1=CC=C(O1)Cl MCULE-1354138883 [0,1,0,0,0,0|3,0,0]=4 561 B9R1.35 O=C(O)C1=CC=C(O1)F MCULE-1270135272 [0,1,0,0,0,0|3,0,0]=4 562 B9R1.35 O=C(O)C1=CC=C(O1)I MCULE-9691222760 [0,1,0,0,0,0|3,0,0]=4 563 B9R1.35 O=C(O)C1=CC=C(S1)Br MCULE-4848894693 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.35 O=C(O)C1=CC=C(S1)Cl MCULE-5610315272 [0,1,0,0,0,0|3,0,0]=4 565 B9R1.35 O=C(O)C1=CC=C(S1)F MCULE-9715640662 [0,1,0,0,0,0|3,0,0]=4 566 B9R1.35 O=C(O)C1=CC=C(S1)I MCULE-2454892500 [0,1,0,0,0,0|3,0,0]=4 567 B9R1.35 O=C(O)C1=CN=C(N1)Br MCULE-4474261991 [0,1,0,0,0,0|2,0,0]=3 568 B9R1.35 O=C(O)C1=CN=C(N1)Cl MCULE-4622360113 [0,1,0,0,0,0|2,0,0]=3 569 B9R1.35 O=C(O)C1=CN=C(O1)Br MCULE-1205835335 [0,1,0,0,0,0|2,0,0]=3 570 B9R1.35 O=C(O)C1=CN=C(O1)Cl MCULE-3783515083 [0,1,0,0,0,0|2,0,0]=3 571 B9R1.35 O=C(O)C1=CN=C(S1)Br MCULE-1848481035 [0,1,0,0,0,0|2,0,0]=3 572 B9R1.35 O=C(O)C1=CN=C(S1)Cl MCULE-4005312484 [0,1,0,0,0,0|2,0,0]=3 573 B9R1.35 O=C(O)C1=CN=C(S1)I MCULE-3187988111 [0,1,0,0,0,0|2,0,0]=3 574 B9R1.35 O=C(O)C1=CNC(=C1)Br MCULE-7070022577 [0,1,0,0,0,0|1,0,0]=2 575 B9R1.35 O=C(O)C1=CNC(=C1)Cl MCULE-3108565697 [0,1,0,0,0,0|1,0,0]=2 576 B9R1.35 O=C(O)C1=CNC(=N1)S MCULE-8206263153 [0,1,0,0,0,0|2,0,0]=3 577 B9R1.35 O=C(O)C1=COC(=C1)Br MCULE-1089920498 [0,1,0,0,0,0|2,0,0]=3 578 B9R1.35 O=C(O)C1=COC(=C1)Cl MCULE-2469235944 [0,1,0,0,0,0|2,0,0]=3 579 B9R1.35 O=C(O)C1=COC(=N1)Br MCULE-2675592853 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.35 O=C(O)C1=COC(=N1)Cl MCULE-9123994881 [0,1,0,0,0,0|3,0,0]=4 581 B9R1.35 O=C(O)C1=COC(=N1)I MCULE-9039043557 [0,1,0,0,0,0|3,0,0]=4 582 B9R1.35 O=C(O)C1=CSC(=C1)Br MCULE-5219101423 [0,1,0,0,0,0|2,0,0]=3 583 B9R1.35 O=C(O)C1=CSC(=C1)Cl MCULE-4675960369 [0,1,0,0,0,0|2,0,0]=3 584 B9R1.35 O=C(O)C1=CSC(=C1)F MCULE-4657799890 [0,1,0,0,0,0|2,0,0]=3 585 B9R1.35 O=C(O)C1=CSC(=C1)I MCULE-1455425367 [0,1,0,0,0,0|2,0,0]=3 586 B9R1.35 O=C(O)C1=CSC(=N1)Br MCULE-6978306709 [0,1,0,0,0,0|3,0,0]=4 587 B9R1.35 O=C(O)C1=CSC(=N1)Cl MCULE-6782548401 [0,1,0,0,0,0|3,0,0]=4 588 B9R1.35 O=C(O)C1=CSC(=N1)I MCULE-7322672763 [0,1,0,0,0,0|3,0,0]=4 589 B9R1.35 O=C(O)C1=NC(=NN1)Cl MCULE-4273453331 [0,1,0,0,0,0|3,0,0]=4 590 B9R1.35 O=C(O)C1=NN=C(S1)Br MCULE-5836813856 [0,1,0,0,0,0|3,0,0]=4 591 B9R1.35 O=C(O)C1=NN=C(S1)Cl MCULE-6002139108 [0,1,0,0,0,0|3,0,0]=4 592 B9R1.35 O=C(O)C1=NNC(=C1)Br MCULE-7119502457 [0,1,0,0,0,0|2,0,0]=3 593 B9R1.35 O=C(O)C1=NNC(=C1)Cl MCULE-1848969347 [0,1,0,0,0,0|2,0,0]=3 594 B9R1.35 O=C(O)C1=NNC(=C1)I MCULE-2058971552 [0,1,0,0,0,0|2,0,0]=3 595 B9R1.35 O=C(O)C1=NNC(=N1)Br MCULE-3522023799 [0,1,0,0,0,0|3,0,0]=4 596 B9R1.35 O=C(O)C1=NNC(=N1)Br MCULE-4121190274 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.35 O=C(O)C1=NNC(=N1)Br MCULE-7141592859 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.35 O=C(O)C1=NNC(=N1)Cl MCULE-2320594877 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.35 O=C(O)C1=NNC(=N1)O MCULE-2701424429 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.35 O=C(O)C1=NOC(=C1)Cl MCULE-3208024268 [0,1,0,0,0,0|3,0,0]=4 601 B9R1.35 O=C(O)C1=NOC(=C1)I MCULE-9975628012 [0,1,0,0,0,0|3,0,0]=4 602 B9R1.35 O=C(O)C1=NSC(=C1)Br MCULE-6900768660 [0,1,0,0,0,0|3,0,0]=4 603 B9R1.35 O=C1C=C(CC1)C(=O)O MCULE-7681373121 [0,1,0,0,0,0|2,0,1]=4 604 B9R1.35 O=C1C=C(NN1)C(=O)O MCULE-2820101826 [0,1,0,0,0,0|2,0,0]=3 605 B9R1.35 O=C1CC(=NN1)C(=O)O MCULE-2135539733 [0,1,0,0,0,0|2,0,1]=4 606 B9R1.35 O=C1NC(=CO1)C(=O)O MCULE-2610586771 [0,1,0,0,0,0|3,0,0]=4 607 B9R1.35 O=C1NC(=CS1)C(=O)O MCULE-6848220699 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.35 O=C1NC=C(N1)C(=O)O MCULE-2879870126 [0,1,0,0,0,0|2,0,0]=3 609 B9R1.35 O=C1NC=C(O1)C(=O)O MCULE-1855563319 [0,1,0,0,0,0|2,0,0]=3 610 B9R1.41 CC(=O)C1=C(C=NN1)Br MCULE-7187574966 [0,1,0,0,0,0|3,0,0]=4 611 B9R1.41 CC(=O)C1=C(C=NS1)Br MCULE-1414552110 [0,1,0,0,0,0|3,0,0]=4 612 B9R1.41 CC(=O)C1=C(N=CO1)C MCULE-3991993799 [0,1,0,0,0,0|3,0,0]=4 613 B9R1.41 CC(=O)C1=C(N=CS1)Br MCULE-2876070686 [0,1,0,0,0,0|3,0,0]=4 614 B9R1.41 CC(=O)C1=C(N=CS1)C MCULE-6994510850 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.41 CC(=O)C1=C(N=CS1)Cl MCULE-3378903457 [0,1,0,0,0,0|3,0,0]=4 616 B9R1.41 CC(=O)C1=C(N=NS1)C MCULE-5502173214 [0,1,0,0,0,0|2,0,1]=4 617 B9R1.41 CC(=O)C1=C(NC=C1)C MCULE-8216611591 [0,1,0,0,0,0|2,0,0]=3 618 B9R1.41 CC(=O)C1=C(NN=C1)C MCULE-1368213261 [0,1,0,0,0,0|1,0,0]=2 619 B9R1.41 CC(=O)C1=C(NN=N1)C MCULE-6859714558 [0,1,0,0,0,0|2,0,0]=3 620 B9R1.41 CC(=O)C1=C(ON=C1)C MCULE-1288179798 [0,1,0,0,0,0|2,0,0]=3 621 B9R1.41 CC(=O)C1=C(SC=C1)Br MCULE-1124146254 [0,1,0,0,0,0|3,0,0]=4 622 B9R1.41 CC(=O)C1=C(SC=C1)N MCULE-9310559168 [0,1,0,0,0,0|3,0,0]=4 623 B9R1.41 CC(=O)C1=CC=NN1C MCULE-1996404405 [0,1,0,0,0,0|3,0,0]=4 624 B9R1.41 CC(=O)C1=CN=CN1C MCULE-3076045100 [0,1,0,0,0,0|3,0,0]=4 625 B9R1.41 CC(=O)C1=CN=CN1C MCULE-3949595611 [0,1,0,0,0,0|3,0,0]=4 626 B9R1.41 CC(=O)C1=CN=NN1C MCULE-3249424842 [0,1,0,0,0,0|2,0,1]=4 627 B9R1.41 CC(=O)C1=CNC=C1C MCULE-8534573669 [0,1,0,0,0,0|2,0,0]=3 628 B9R1.41 CC(=O)C1=CON=C1C MCULE-1639090074 [0,1,0,0,0,0|2,0,0]=3 629 B9R1.41 CC(=O)C1=CSC=C1Br MCULE-1924395169 [0,1,0,0,0,0|3,0,0]=4 630 B9R1.41 CC(=O)C1=CSC=C1Cl MCULE-6961495608 [0,1,0,0,0,0|3,0,0]=4 631 B9R1.41 CC(=O)C1=CSN=C1C MCULE-6479512660 [0,1,0,0,0,0|2,0,0]=3 632 B9R1.41 CC(=O)C1=NON=C1C MCULE-6557517499 [0,1,0,0,0,0|3,0,0]=4 633 B9R1.41 CC(C)C1=CNN=C1N MCULE-5036809323 [0,1,0,0,0,0|2,0,1]=4 634 B9R1.41 CC1=C(C=CN1)C(=O)O MCULE-5422010043 [0,1,0,0,0,0|1,0,0]=2 635 B9R1.41 CC1=C(C=CN1)N(=O)=O MCULE-6767706308 [0,1,0,0,0,0|2,0,1]=4 636 B9R1.41 CC1=C(C=CO1)C(=O)Cl MCULE-7084217728 [0,1,0,0,0,0|3,0,0]=4 637 B9R1.41 CC1=C(C=CO1)C(=O)N MCULE-7846664403 [0,1,0,0,0,0|3,0,0]=4 638 B9R1.41 CC1=C(C=CO1)C(=O)O MCULE-6104152288 [0,1,0,0,0,0|2,0,0]=3 639 B9R1.41 CC1=C(C=CS1)C(=O)Cl MCULE-2356438285 [0,1,0,0,0,0|3,0,0]=4 640 B9R1.41 CC1=C(C=CS1)C(=O)N MCULE-7443569195 [0,1,0,0,0,0|3,0,0]=4 641 B9R1.41 CC1=C(C=CS1)C(=O)O MCULE-7306254893 [0,1,0,0,0,0|2,0,0]=3 642 B9R1.41 CC1=C(C=NN1)B(O)O MCULE-3160900236 [0,1,0,0,0,0|1,0,1]=3 643 B9R1.41 CC1=C(C=NN1)C(C)O MCULE-8431333316 [0,1,0,0,0,0|1,0,1]=3 644 B9R1.41 CC1=C(C=NO1)C(=O)Cl MCULE-3679555517 [0,1,0,0,0,0|2,0,0]=3 645 B9R1.41 CC1=C(C=NO1)C(=O)N MCULE-8896768829 [0,1,0,0,0,0|2,0,0]=3 646 B9R1.41 CC1=C(C=NO1)C(=O)O MCULE-3852480189 [0,1,0,0,0,0|1,0,0]=2 647 B9R1.41 CC1=C(C=NO1)C(C)O MCULE-2225279284 [0,1,0,0,0,0|2,0,1]=4 648 B9R1.41 CC1=C(C=NO1)N(=O)=O MCULE-9000846240 [0,1,0,0,0,0|2,0,1]=4 649 B9R1.41 CC1=C(C=NS1)C(=O)O MCULE-8021727078 [0,1,0,0,0,0|1,0,0]=2 650 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,1,0,0,0,0|2,0,1]=4 651 B9R1.41 CC1=C(CCO1)C(=O)O MCULE-2847123201 [0,1,0,0,0,0|2,0,1]=4 652 B9R1.41 CC1=C(N=CN1)C(=O)O MCULE-8395032119 [0,1,0,0,0,0|2,0,0]=3 653 B9R1.41 CC1=C(N=CO1)C(=O)O MCULE-6634738672 [0,1,0,0,0,0|3,0,0]=4 654 B9R1.41 CC1=C(N=CS1)C(=O)O MCULE-9908235231 [0,1,0,0,0,0|3,0,0]=4 655 B9R1.41 CC1=C(N=NO1)C(=O)Cl MCULE-3612968483 [0,1,0,0,0,0|3,0,0]=4 656 B9R1.41 CC1=C(N=NO1)C(=O)O MCULE-1088925130 [0,1,0,0,0,0|2,0,0]=3 657 B9R1.41 CC1=C(N=NS1)C(=O)O MCULE-3147231508 [0,1,0,0,0,0|2,0,0]=3 658 B9R1.41 CC1=C(NC=C1)C(=O)O MCULE-5829407864 [0,1,0,0,0,0|3,0,0]=4 659 B9R1.41 CC1=C(NC=N1)C(=O)O MCULE-2635413979 [0,1,0,0,0,0|2,0,0]=3 660 B9R1.41 CC1=C(OC=C1)C(=O)O MCULE-5843476566 [0,1,0,0,0,0|3,0,0]=4 661 B9R1.41 CC1=C(OC=N1)C(=O)Cl MCULE-2140810012 [0,1,0,0,0,0|3,0,0]=4 662 B9R1.41 CC1=C(OC=N1)C(=O)N MCULE-6355520023 [0,1,0,0,0,0|3,0,0]=4 663 B9R1.41 CC1=C(OC=N1)C(=O)O MCULE-8655353439 [0,1,0,0,0,0|2,0,0]=3 664 B9R1.41 CC1=C(ON=C1)C(=O)Cl MCULE-5954783150 [0,1,0,0,0,0|3,0,0]=4 665 B9R1.41 CC1=C(ON=C1)C(=O)O MCULE-6322970071 [0,1,0,0,0,0|2,0,0]=3 666 B9R1.41 CC1=C(SC=C1)C(=O)O MCULE-1266721644 [0,1,0,0,0,0|3,0,0]=4 667 B9R1.41 CC1=C(SC=N1)C(=O)Cl MCULE-6111034461 [0,1,0,0,0,0|3,0,0]=4 668 B9R1.41 CC1=C(SC=N1)C(=O)O MCULE-2173669838 [0,1,0,0,0,0|2,0,0]=3 669 B9R1.41 CC1=C(SC=N1)C(=O)O MCULE-6255147265 [0,1,0,0,0,0|2,0,0]=3 670 B9R1.41 CC1=C(SN=C1)C(=O)O MCULE-6281498793 [0,1,0,0,0,0|2,0,0]=3 671 B9R1.41 CC1=C(SN=N1)C(=O)Cl MCULE-6497518472 [0,1,0,0,0,0|2,0,1]=4 672 B9R1.41 CC1=C(SN=N1)C(=O)N MCULE-1865295877 [0,1,0,0,0,0|2,0,1]=4 673 B9R1.41 CC1=C(SN=N1)C(=O)O MCULE-9212518193 [0,1,0,0,0,0|1,0,1]=3 674 B9R1.41 CC1=CNC=C1C(=O)O MCULE-8296584752 [0,1,0,0,0,0|1,0,0]=2 675 B9R1.41 CC1=CNN=C1C(=O)O MCULE-8004004734 [0,1,0,0,0,0|2,0,0]=3 676 B9R1.41 CC1=CNN=C1C(=O)O MCULE-9442763947 [0,1,0,0,0,0|2,0,0]=3 677 B9R1.41 CC1=COC=C1C(=O)O MCULE-1591932651 [0,1,0,0,0,0|2,0,0]=3 678 B9R1.41 CC1=CON=C1C(=O)O MCULE-4420750357 [0,1,0,0,0,0|3,0,0]=4 679 B9R1.41 CC1=CSC=C1C(=O)O MCULE-1882159775 [0,1,0,0,0,0|2,0,0]=3 680 B9R1.41 CC1=NNC=C1B(O)O MCULE-4519488252 [0,1,0,0,0,0|1,0,1]=3 681 B9R1.41 CC1=NNC=C1C(=N)N MCULE-5561283886 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.41 CC1=NNC=C1C(=N)N MCULE-7594237800 [0,1,0,0,0,0|2,0,0]=3 683 B9R1.41 CC1=NNC=C1C(=O)N MCULE-7787168279 [0,1,0,0,0,0|1,0,0]=2 684 B9R1.41 CC1=NNC=C1C(=O)O MCULE-3024852965 [0,1,0,0,0,0|0,0,0]=1 685 B9R1.41 CC1=NNC=C1C(C)C MCULE-6855206197 [0,1,0,0,0,0|2,0,1]=4 686 B9R1.41 CC1=NNC=C1N(=O)=O MCULE-1795080287 [0,1,0,0,0,0|1,0,1]=3 687 B9R1.41 CC1=NNN=C1C(=O)O MCULE-4341523293 [0,1,0,0,0,0|1,0,0]=2 688 B9R1.41 CC1=NNN=C1C(=O)O MCULE-9616197662 [0,1,0,0,0,0|1,0,0]=2 689 B9R1.41 CC1=NOC=C1B(O)O MCULE-6303568795 [0,1,0,0,0,0|2,0,1]=4 690 B9R1.41 CC1=NOC=C1C(=O)O MCULE-8677211663 [0,1,0,0,0,0|1,0,0]=2 691 B9R1.41 CC1=NON=C1C(=O)N MCULE-7392710730 [0,1,0,0,0,0|3,0,0]=4 692 B9R1.41 CC1=NON=C1C(=O)O MCULE-3720968784 [0,1,0,0,0,0|2,0,0]=3 693 B9R1.41 CC1=NSC=C1C(=O)O MCULE-5398893110 [0,1,0,0,0,0|1,0,0]=2 694 B9R1.41 CC1=NSC=C1N(=O)=O MCULE-3060317663 [0,1,0,0,0,0|2,0,1]=4 695 B9R1.41 CC1=NSN=C1C(=O)O MCULE-8202422140 [0,1,0,0,0,0|2,0,0]=3 696 B9R1.41 CN1C=CC=C1C(=O)O MCULE-8318842554 [0,1,0,0,0,0|3,0,0]=4 697 B9R1.41 CN1C=NC=C1C(=O)Cl MCULE-3181753592 [0,1,0,0,0,0|3,0,0]=4 698 B9R1.41 CN1C=NC=C1C(=O)Cl MCULE-6132331993 [0,1,0,0,0,0|3,0,0]=4 699 B9R1.41 CN1C=NC=C1C(=O)N MCULE-9320798044 [0,1,0,0,0,0|3,0,0]=4 700 B9R1.41 CN1C=NC=C1C(=O)O MCULE-8948481474 [0,1,0,0,0,0|2,0,0]=3 701 B9R1.41 CN1C=NN=C1C(=O)O MCULE-9183256242 [0,1,0,0,0,0|3,0,0]=4 702 B9R1.41 CN1N=CC=C1C(=O)Cl MCULE-5141395675 [0,1,0,0,0,0|3,0,0]=4 703 B9R1.41 CN1N=CC=C1C(=O)N MCULE-9858917116 [0,1,0,0,0,0|3,0,0]=4 704 B9R1.41 CN1N=CC=C1C(=O)O MCULE-2921786113 [0,1,0,0,0,0|2,0,0]=3 705 B9R1.41 CN1N=CN=C1C(=O)O MCULE-5122799901 [0,1,0,0,0,0|3,0,0]=4 706 B9R1.41 CN1N=NC=C1C(=O)N MCULE-9192785462 [0,1,0,0,0,0|2,0,1]=4 707 B9R1.41 CN1N=NC=C1C(=O)O MCULE-9709099520 [0,1,0,0,0,0|1,0,1]=3 708 B9R1.41 NC(=O)C1=C(C=NN1)Br MCULE-9319781428 [0,1,0,0,0,0|3,0,0]=4 709 B9R1.41 NC(=O)C1=C(C=NN1)Cl MCULE-1064956476 [0,1,0,0,0,0|3,0,0]=4 710 B9R1.41 NC(=O)C1=C(C=NN1)N MCULE-3354148227 [0,1,0,0,0,0|3,0,0]=4 711 B9R1.41 NC(=O)C1=C(C=NN1)N MCULE-3684447747 [0,1,0,0,0,0|3,0,0]=4 712 B9R1.41 NC(=O)C1=C(C=NN1)N MCULE-4793687042 [0,1,0,0,0,0|3,0,0]=4 713 B9R1.41 NC(=O)C1=C(N=CN1)N MCULE-2385217196 [0,1,0,0,0,0|3,0,0]=4 714 B9R1.41 NC(=O)C1=C(N=CN1)N MCULE-6761686802 [0,1,0,0,0,0|3,0,0]=4 715 B9R1.41 NC(=O)C1=C(N=CN1)O MCULE-9070035552 [0,1,0,0,0,0|3,0,0]=4 716 B9R1.41 NC(=O)C1=C(N=NN1)N MCULE-3369442540 [0,1,0,0,0,0|2,0,1]=4 717 B9R1.41 NC(=O)C1=C(NC=N1)I MCULE-9095770777 [0,1,0,0,0,0|3,0,0]=4 718 B9R1.41 NC(=O)C1=C(NN=N1)I MCULE-2679356622 [0,1,0,0,0,0|2,0,0]=3 719 B9R1.41 NC(=O)C1=C(NN=N1)O MCULE-9528975346 [0,1,0,0,0,0|2,0,0]=3 720 B9R1.41 NC(=O)C1=C(NN=N1)[O-] MCULE-5265245182 [0,1,0,0,0,0|2,0,0]=3 721 B9R1.41 NC(=O)C1=C(ON=C1)N MCULE-3983014624 [0,1,0,0,0,0|2,0,0]=3 722 B9R1.41 NC(=O)C1=C(ON=C1)[NH3+] MCULE-6391696517 [0,1,0,0,0,0|2,0,0]=3 723 B9R1.41 NC(=O)C1=C(SC=C1)Br MCULE-5260760620 [0,1,0,0,0,0|3,0,0]=4 724 B9R1.41 NC(=O)C1=C(SC=C1)Cl MCULE-5331292430 [0,1,0,0,0,0|3,0,0]=4 725 B9R1.41 NC(=O)C1=C(SC=C1)F MCULE-4177756039 [0,1,0,0,0,0|3,0,0]=4 726 B9R1.41 NC(=O)C1=C(SC=C1)N MCULE-9368384927 [0,1,0,0,0,0|3,0,0]=4 727 B9R1.41 NC(=O)C1=C(SN=C1)N MCULE-5359010151 [0,1,0,0,0,0|2,0,0]=3 728 B9R1.41 NC(=O)C1=C(SN=N1)Cl MCULE-6512111451 [0,1,0,0,0,0|3,0,0]=4 729 B9R1.41 NC(=O)C1=CN=CN1N MCULE-1814584884 [0,1,0,0,0,0|3,0,0]=4 730 B9R1.41 NC(=O)C1=CNN=C1N MCULE-1431282094 [0,1,0,0,0,0|1,0,0]=2 731 B9R1.41 NC(=O)C1=CNN=C1N MCULE-7276691240 [0,1,0,0,0,0|1,0,0]=2 732 B9R1.41 NC(=O)C1=CSC=C1Br MCULE-1258664496 [0,1,0,0,0,0|3,0,0]=4 733 B9R1.41 NC(=O)C1=CSC=C1Cl MCULE-9641817528 [0,1,0,0,0,0|3,0,0]=4 734 B9R1.41 NC(=O)C1=CSC=C1F MCULE-7075472552 [0,1,0,0,0,0|3,0,0]=4 735 B9R1.41 NC(=O)C1=CSC=C1N MCULE-6062389383 [0,1,0,0,0,0|3,0,0]=4 736 B9R1.41 NC(=O)C1=NNC=C1F MCULE-9836552130 [0,1,0,0,0,0|3,0,0]=4 737 B9R1.41 NC(=O)C1=NNC=C1I MCULE-9326092978 [0,1,0,0,0,0|3,0,0]=4 738 B9R1.41 NC(=O)C1=NON=C1N MCULE-7036883680 [0,1,0,0,0,0|3,0,0]=4 739 B9R1.41 NC(=O)C1=NSN=C1N MCULE-5420176269 [0,1,0,0,0,0|3,0,0]=4 740 B9R1.41 NC(=S)C1=C(NN=C1)N MCULE-3978613727 [0,1,0,0,0,0|1,1,0]=3 741 B9R1.41 NC1=C(C=CS1)C(=O)O MCULE-8893386109 [0,1,0,0,0,0|2,0,0]=3 742 B9R1.41 NC1=C(C=CS1)C(=O)[O-] MCULE-3569263089 [0,1,0,0,0,0|2,0,1]=4 743 B9R1.41 NC1=C(C=NO1)C(=O)O MCULE-8926762970 [0,1,0,0,0,0|1,0,0]=2 744 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [0,1,0,0,0,0|2,0,1]=4 745 B9R1.41 NC1=C(N=CN1)C(=O)O MCULE-7472251887 [0,1,0,0,0,0|2,0,0]=3 746 B9R1.41 NC1=C(N=CS1)C(=O)O MCULE-3864874434 [0,1,0,0,0,0|3,0,0]=4 747 B9R1.41 NC1=C(OC=C1)C(=O)O MCULE-3882551342 [0,1,0,0,0,0|3,0,0]=4 748 B9R1.41 NC1=C(SC=C1)C(=O)O MCULE-2518122602 [0,1,0,0,0,0|3,0,0]=4 749 B9R1.41 NC1=C(SC=C1)C(=O)O MCULE-8970200640 [0,1,0,0,0,0|3,0,0]=4 750 B9R1.41 NC1=CNN=C1C(=O)O MCULE-2495404267 [0,1,0,0,0,0|2,0,0]=3 751 B9R1.41 NC1=CNN=C1C(=O)O MCULE-3960902812 [0,1,0,0,0,0|2,0,0]=3 752 B9R1.41 NC1=CSC=C1C(=O)O MCULE-2350072650 [0,1,0,0,0,0|2,0,0]=3 753 B9R1.41 NC1=CSC=C1C(=O)O MCULE-4373944172 [0,1,0,0,0,0|2,0,0]=3 754 B9R1.41 NC1=CSN=C1C(=O)O MCULE-6042054849 [0,1,0,0,0,0|3,0,0]=4 755 B9R1.41 NC1=CSN=C1C(=O)O MCULE-6329060137 [0,1,0,0,0,0|3,0,0]=4 756 B9R1.41 NC1=NNC=C1C(=O)O MCULE-1146443572 [0,1,0,0,0,0|0,0,0]=1 757 B9R1.41 NC1=NNC=C1N(=O)=O MCULE-2635073186 [0,1,0,0,0,0|1,0,1]=3 758 B9R1.41 NC1=NON=C1C(=O)O MCULE-6850187023 [0,1,0,0,0,0|2,0,0]=3 759 B9R1.41 NC1=NSC=C1C(=O)O MCULE-1933904719 [0,1,0,0,0,0|1,0,0]=2 760 B9R1.41 NC1=NSC=C1C(=O)O MCULE-8414139334 [0,1,0,0,0,0|1,0,0]=2 761 B9R1.41 NC1=NSN=C1C(=O)O MCULE-2603922743 [0,1,0,0,0,0|2,0,0]=3 762 B9R1.41 O=C(Cl)C1=C(OC=C1)Br MCULE-6650876030 [0,1,0,0,0,0|3,0,0]=4 763 B9R1.41 O=C(Cl)C1=C(SC=C1)Br MCULE-4983958272 [0,1,0,0,0,0|3,0,0]=4 764 B9R1.41 O=C(Cl)C1=CSC=C1Br MCULE-5358514031 [0,1,0,0,0,0|3,0,0]=4 765 B9R1.41 O=C(Cl)C1=NNC=C1Br MCULE-5773491115 [0,1,0,0,0,0|3,0,0]=4 766 B9R1.41 O=C(Cl)C1=NNC=C1Cl MCULE-5843853519 [0,1,0,0,0,0|3,0,0]=4 767 B9R1.41 O=C(O)C1=C(C=CN1)Br MCULE-5841816451 [0,1,0,0,0,0|3,0,0]=4 768 B9R1.41 O=C(O)C1=C(C=CN1)F MCULE-8955586724 [0,1,0,0,0,0|3,0,0]=4 769 B9R1.41 O=C(O)C1=C(C=CO1)Br MCULE-4162393624 [0,1,0,0,0,0|3,0,0]=4 770 B9R1.41 O=C(O)C1=C(C=CO1)Cl MCULE-6784078961 [0,1,0,0,0,0|3,0,0]=4 771 B9R1.41 O=C(O)C1=C(C=CO1)F MCULE-4676782360 [0,1,0,0,0,0|3,0,0]=4 772 B9R1.41 O=C(O)C1=C(C=CS1)Br MCULE-5383143996 [0,1,0,0,0,0|3,0,0]=4 773 B9R1.41 O=C(O)C1=C(C=CS1)Cl MCULE-5551947952 [0,1,0,0,0,0|3,0,0]=4 774 B9R1.41 O=C(O)C1=C(C=CS1)F MCULE-1187794527 [0,1,0,0,0,0|3,0,0]=4 775 B9R1.41 O=C(O)C1=C(C=CS1)I MCULE-8955518770 [0,1,0,0,0,0|3,0,0]=4 776 B9R1.41 O=C(O)C1=C(C=CS1)O MCULE-5017544087 [0,1,0,0,0,0|3,0,0]=4 777 B9R1.41 O=C(O)C1=C(C=CS1)S MCULE-5804644923 [0,1,0,0,0,0|3,0,0]=4 778 B9R1.41 O=C(O)C1=C(C=NN1)I MCULE-7800240532 [0,1,0,0,0,0|2,0,0]=3 779 B9R1.41 O=C(O)C1=C(C=NS1)Br MCULE-1237715902 [0,1,0,0,0,0|2,0,0]=3 780 B9R1.41 O=C(O)C1=C(C=NS1)Cl MCULE-2940746161 [0,1,0,0,0,0|2,0,0]=3 781 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [0,1,0,0,0,0|2,0,1]=4 782 B9R1.41 O=C(O)C1=C(N=CN1)Br MCULE-1363236756 [0,1,0,0,0,0|2,0,0]=3 783 B9R1.41 O=C(O)C1=C(N=CS1)Br MCULE-3259220365 [0,1,0,0,0,0|2,0,0]=3 784 B9R1.41 O=C(O)C1=C(N=CS1)Cl MCULE-9073236997 [0,1,0,0,0,0|2,0,0]=3 785 B9R1.41 O=C(O)C1=C(NN=C1)Br MCULE-1542027664 [0,1,0,0,0,0|0,0,0]=1 786 B9R1.41 O=C(O)C1=C(NN=C1)Cl MCULE-8282187205 [0,1,0,0,0,0|0,0,0]=1 787 B9R1.41 O=C(O)C1=C(NN=C1)I MCULE-1655349232 [0,1,0,0,0,0|0,0,0]=1 788 B9R1.41 O=C(O)C1=C(NN=N1)Br MCULE-4014007381 [0,1,0,0,0,0|1,0,0]=2 789 B9R1.41 O=C(O)C1=C(OC=C1)Br MCULE-8129175514 [0,1,0,0,0,0|2,0,0]=3 790 B9R1.41 O=C(O)C1=C(OC=C1)Cl MCULE-7654199179 [0,1,0,0,0,0|2,0,0]=3 791 B9R1.41 O=C(O)C1=C(OC=C1)I MCULE-1256850772 [0,1,0,0,0,0|2,0,0]=3 792 B9R1.41 O=C(O)C1=C(OC=N1)Br MCULE-7356751291 [0,1,0,0,0,0|3,0,0]=4 793 B9R1.41 O=C(O)C1=C(SC=C1)Br MCULE-3649446439 [0,1,0,0,0,0|2,0,0]=3 794 B9R1.41 O=C(O)C1=C(SC=C1)Cl MCULE-3384760583 [0,1,0,0,0,0|2,0,0]=3 795 B9R1.41 O=C(O)C1=C(SC=C1)F MCULE-8530480017 [0,1,0,0,0,0|2,0,0]=3 796 B9R1.41 O=C(O)C1=C(SC=C1)I MCULE-5941903001 [0,1,0,0,0,0|2,0,0]=3 797 B9R1.41 O=C(O)C1=C(SC=N1)Br MCULE-2431540981 [0,1,0,0,0,0|3,0,0]=4 798 B9R1.41 O=C(O)C1=CNNC1=O MCULE-4087238675 [0,1,0,0,0,0|0,0,1]=2 799 B9R1.41 O=C(O)C1=COC=C1Br MCULE-8701332557 [0,1,0,0,0,0|2,0,0]=3 800 B9R1.41 O=C(O)C1=CSC=C1Br MCULE-1004514900 [0,1,0,0,0,0|2,0,0]=3 801 B9R1.41 O=C(O)C1=CSC=C1Cl MCULE-6017707778 [0,1,0,0,0,0|2,0,0]=3 802 B9R1.41 O=C(O)C1=CSC=C1F MCULE-2213326283 [0,1,0,0,0,0|2,0,0]=3 803 B9R1.41 O=C(O)C1=CSN=C1Br MCULE-5486470019 [0,1,0,0,0,0|1,0,0]=2 804 B9R1.41 O=C(O)C1=CSN=C1Cl MCULE-3329649016 [0,1,0,0,0,0|1,0,0]=2 805 B9R1.41 O=C(O)C1=NNC=C1Br MCULE-8803859737 [0,1,0,0,0,0|2,0,0]=3 806 B9R1.41 O=C(O)C1=NNC=C1Cl MCULE-9369842938 [0,1,0,0,0,0|2,0,0]=3 807 B9R1.41 O=C(O)C1=NNC=C1F MCULE-1796630857 [0,1,0,0,0,0|2,0,0]=3 808 B9R1.41 O=C(O)C1=NNN=C1Cl MCULE-8381827672 [0,1,0,0,0,0|1,0,0]=2 809 B9R1.41 O=C(O)C1=NOC=C1Cl MCULE-1396174123 [0,1,0,0,0,0|3,0,0]=4 810 B9R1.41 O=C(O)C1=NON=C1O MCULE-2928095407 [0,1,0,0,0,0|2,0,0]=3 811 B9R1.41 O=C(O)C1=NSC=C1Br MCULE-6994597985 [0,1,0,0,0,0|3,0,0]=4 812 B9R1.41 O=C(O)C1=NSC=C1I MCULE-5566810622 [0,1,0,0,0,0|3,0,0]=4 813 B9R1.41 O=C(O)C1=NSN=C1Cl MCULE-3083742267 [0,1,0,0,0,0|2,0,0]=3 814 B9R1.41 O=C(O)C1=NSN=C1O MCULE-1717006967 [0,1,0,0,0,0|2,0,0]=3 815 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [0,1,0,0,0,0|1,0,2]=4 816 B9R1.41 O=C(O)N1CCNC1=O MCULE-2423498210 [0,1,0,0,0,0|2,0,1]=4 817 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [0,1,0,0,0,0|1,0,2]=4 818 B9R1.41 O=C([O-])C1=C(NN=C1)[O-] MCULE-9189531243 [0,1,0,0,0,0|0,0,1]=2 819 B9R1.41 O=C1NNC=C1N(=O)=O MCULE-4834809365 [0,1,0,0,0,0|1,0,2]=4 820 B9R1.41 O=N(=O)C1=CNN=C1Br MCULE-1653061152 [0,1,0,0,0,0|1,0,1]=3 821 B9R1.41 O=N(=O)C1=CNN=C1Cl MCULE-9129424669 [0,1,0,0,0,0|1,0,1]=3 822 B9R1.41 O=N(=O)C1=CNN=C1F MCULE-6041575179 [0,1,0,0,0,0|1,0,1]=3 823 B9R1.41 O=N(=O)C1=CNN=C1I MCULE-2336228038 [0,1,0,0,0,0|1,0,1]=3 824 B9R1.41 [NH3+]C1=NNC=C1C(=O)N MCULE-1852417179 [0,1,0,0,0,0|1,0,0]=2 825 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [0,0,1,0,0,0|2,0,1]=4 826 B7R0.4 C/C=C/C=C/C(=O)O MCULE-5933850278 [0,0,1,0,0,0|2,0,1]=4 827 B7R0.4 C/C=C/C=C\C(=O)O MCULE-3744855708 [0,0,1,0,0,0|2,0,1]=4 828 B7R0.4 CC=CC=CC(=O)O MCULE-9397415946 [0,0,1,0,0,0|2,0,1]=4 829 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [0,0,1,0,0,0|2,0,1]=4 830 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [0,0,1,0,0,0|2,0,1]=4 831 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [0,0,1,0,0,0|2,0,1]=4 832 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [0,0,1,0,0,0|2,0,1]=4 833 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [0,0,1,0,0,0|2,0,1]=4 834 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [0,0,1,0,0,0|2,0,1]=4 835 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,0,1,0,0,0|2,0,1]=4 836 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,0,1,0,0,0|2,0,1]=4 837 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,0,1,0,0,0|2,0,1]=4 838 B7R0.5 C=CC=C(C)C(=O)O MCULE-9568360048 [0,0,1,0,0,0|2,0,1]=4 839 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [0,0,1,0,0,0|2,0,1]=4 840 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [0,0,1,0,0,0|2,0,1]=4 841 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [0,0,1,0,0,0|3,0,0]=4 842 B7R0.15 C/C=C(\C#N)/C(=O)O MCULE-4984827905 [0,0,1,0,0,0|1,0,2]=4 843 B7R0.15 CC=C(C#N)C(=O)O MCULE-5255376210 [0,0,1,0,0,0|1,0,2]=4 844 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [0,0,1,0,0,0|2,0,1]=4 845 B9R2.2 C1=NNC=C1C2CC2 MCULE-3611436250 [0,0,0,1,0,0|2,0,1]=4 846 B9R2.2 C1=NNC=C1C2CC2 MCULE-6397841586 [0,0,0,1,0,0|2,0,1]=4 847 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,0,0,0,1,0|1,0,2]=4 848 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,0,0,0,1,0|1,0,1]=3 849 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,0,0,0,1,0|1,0,2]=4 850 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,0,0,0,1,0|1,0,2]=4 851 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,0,0,0,1,0|1,0,2]=4 852 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [0,0,0,0,1,0|0,0,3]=4 853 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [0,0,0,0,1,0|0,0,3]=4 854 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,0,0,0,1,0|1,0,2]=4 855 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,0,0,0,1,0|1,0,2]=4 856 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,0,0,0,1,0|1,0,2]=4 857 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,0,0,0,1,0|1,0,2]=4 858 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,0,0,0,1,0|1,0,2]=4 859 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,0,0,0,1,0|1,0,2]=4 860 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,0,0,0,1,0|1,0,2]=4 861 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,0,0,0,1,0|1,0,2]=4 862 B9R1.6 C=C(C)C1=CC=NC=C1 MCULE-1011829156 [0,0,0,0,0,1|3,0,0]=4 863 B9R1.6 C=C(C)C1=CN=CC=C1 MCULE-6049337405 [0,0,0,0,0,1|3,0,0]=4 864 B9R1.6 C=C(C)C1=NC=CN=C1 MCULE-6159356317 [0,0,0,0,0,1|3,0,0]=4 865 B9R1.6 CC(=O)C1=CC=CC=C1 MCULE-4710225344 [0,0,0,0,0,1|3,0,0]=4 866 B9R1.6 CC(=O)C1=CC=CC=N1 MCULE-7714885820 [0,0,0,0,0,1|3,0,0]=4 867 B9R1.6 CC(=O)C1=CC=CN=N1 MCULE-1105133022 [0,0,0,0,0,1|3,0,0]=4 868 B9R1.6 CC(=O)C1=CC=NC=C1 MCULE-6567027343 [0,0,0,0,0,1|2,0,0]=3 869 B9R1.6 CC(=O)C1=CN=CC=C1 MCULE-8295843302 [0,0,0,0,0,1|2,0,0]=3 870 B9R1.6 CC(=O)C1=CN=CN=C1 MCULE-1179208473 [0,0,0,0,0,1|1,0,1]=3 871 B9R1.6 CC(=O)C1=CN=NC=C1 MCULE-3357999917 [0,0,0,0,0,1|1,0,1]=3 872 B9R1.6 CC(=O)C1=NC=CN=C1 MCULE-7752756680 [0,0,0,0,0,1|2,0,0]=3 873 B9R1.6 CC(=O)C1=NC=NC=C1 MCULE-8168389148 [0,0,0,0,0,1|2,0,0]=3 874 B9R1.6 CC(O)C1=CC=NC=C1 MCULE-2900889532 [0,0,0,0,0,1|2,0,1]=4 875 B9R1.6 CC(O)C1=CC=NC=C1 MCULE-2957917346 [0,0,0,0,0,1|2,0,1]=4 876 B9R1.6 CC(O)C1=CN=CC=C1 MCULE-8528239439 [0,0,0,0,0,1|2,0,1]=4 877 B9R1.6 CC(O)C1=CN=CN=C1 MCULE-6213533949 [0,0,0,0,0,1|1,0,2]=4 878 B9R1.6 CC(O)C1=NC=CN=C1 MCULE-4414742046 [0,0,0,0,0,1|2,0,1]=4 879 B9R1.6 CS(=O)C1=CC=CN=C1 MCULE-5687846072 [0,0,0,0,0,1|3,0,0]=4 880 B9R1.6 CS(=O)C1=CC=NC=C1 MCULE-8748622849 [0,0,0,0,0,1|3,0,0]=4 881 B9R1.6 CS(=O)C1=CN=CN=C1 MCULE-8349538480 [0,0,0,0,0,1|2,0,1]=4 882 B9R1.6 C[C@@H](O)C1=CC=NC=C1 MCULE-3878694442 [0,0,0,0,0,1|2,0,1]=4 883 B9R1.6 C[C@@H](O)C1=CC=NC=C1 MCULE-8787984442 [0,0,0,0,0,1|2,0,1]=4 884 B9R1.6 C[C@@H](O)C1=CN=CC=C1 MCULE-2458883410 [0,0,0,0,0,1|2,0,1]=4 885 B9R1.6 C[C@@H](O)C1=CN=CC=C1 MCULE-4460238058 [0,0,0,0,0,1|2,0,1]=4 886 B9R1.6 C[C@@H](O)C1=NC=CN=C1 MCULE-6158743400 [0,0,0,0,0,1|2,0,1]=4 887 B9R1.6 C[C@H](O)C1=CC=CN=C1 MCULE-4254676435 [0,0,0,0,0,1|2,0,1]=4 888 B9R1.6 C[C@H](O)C1=CC=NC=C1 MCULE-7683661104 [0,0,0,0,0,1|2,0,1]=4 889 B9R1.6 C[C@H](O)C1=CC=NC=C1 MCULE-9663767139 [0,0,0,0,0,1|2,0,1]=4 890 B9R1.6 C[C@H](O)C1=CN=CC=C1 MCULE-9700495518 [0,0,0,0,0,1|2,0,1]=4 891 B9R1.6 C[C@H](O)C1=NC=CN=C1 MCULE-7964754707 [0,0,0,0,0,1|2,0,1]=4 892 B9R1.6 C[C@H](O)C1=NC=NC=C1 MCULE-5929602167 [0,0,0,0,0,1|2,0,1]=4 893 B9R1.6 N=C(N)C1=CC=CN=C1 MCULE-3769153590 [0,0,0,0,0,1|3,0,0]=4 894 B9R1.6 N=C(N)C1=CC=NC=C1 MCULE-1209604756 [0,0,0,0,0,1|3,0,0]=4 895 B9R1.6 N=C(N)C1=CC=NC=C1 MCULE-1354093753 [0,0,0,0,0,1|3,0,0]=4 896 B9R1.6 N=C(N)C1=CC=NC=C1 MCULE-5405601654 [0,0,0,0,0,1|3,0,0]=4 897 B9R1.6 N=C(N)C1=CN=CC=C1 MCULE-2150990954 [0,0,0,0,0,1|3,0,0]=4 898 B9R1.6 N=C(N)C1=CN=CC=C1 MCULE-6098739958 [0,0,0,0,0,1|3,0,0]=4 899 B9R1.6 N=C(N)C1=CN=CC=N1 MCULE-2015887946 [0,0,0,0,0,1|3,0,0]=4 900 B9R1.6 N=C(N)C1=CN=CN=C1 MCULE-1849693690 [0,0,0,0,0,1|2,0,1]=4 901 B9R1.6 N=C(N)C1=CN=CN=C1 MCULE-5524882842 [0,0,0,0,0,1|2,0,1]=4 902 B9R1.6 N=C(N)C1=NC=CN=C1 MCULE-4385712446 [0,0,0,0,0,1|3,0,0]=4 903 B9R1.6 NC(=O)C1=CC=CC=C1 MCULE-2811211507 [0,0,0,0,0,1|3,0,0]=4 904 B9R1.6 NC(=O)C1=CC=CC=C1 MCULE-8128969762 [0,0,0,0,0,1|3,0,0]=4 905 B9R1.6 NC(=O)C1=CC=CC=N1 MCULE-9969255912 [0,0,0,0,0,1|3,0,0]=4 906 B9R1.6 NC(=O)C1=CC=CN=C1 MCULE-3532732201 [0,0,0,0,0,1|2,0,0]=3 907 B9R1.6 NC(=O)C1=CC=NC=C1 MCULE-7439588553 [0,0,0,0,0,1|2,0,0]=3 908 B9R1.6 NC(=O)C1=CN=CC=C1 MCULE-2677532198 [0,0,0,0,0,1|2,0,0]=3 909 B9R1.6 NC(=O)C1=CN=CN=C1 MCULE-9964800006 [0,0,0,0,0,1|1,0,1]=3 910 B9R1.6 NC(=O)C1=CN=NC=C1 MCULE-8407008168 [0,0,0,0,0,1|1,0,1]=3 911 B9R1.6 NC(=O)C1=CNC=CC1 MCULE-5235252463 [0,0,0,0,0,1|2,0,0]=3 912 B9R1.6 NC(=O)C1=CNCCC1 MCULE-5396085408 [0,0,0,0,0,1|2,0,1]=4 913 B9R1.6 NC(=O)C1=NC=CN=C1 MCULE-6846697749 [0,0,0,0,0,1|2,0,0]=3 914 B9R1.6 NC(=O)C1=NC=NC=C1 MCULE-1208064578 [0,0,0,0,0,1|2,0,0]=3 915 B9R1.6 NC(=O)C1=NN=CC=C1 MCULE-1078609888 [0,0,0,0,0,1|3,0,0]=4 916 B9R1.6 NC(=S)C1=CC=CN=C1 MCULE-2738128542 [0,0,0,0,0,1|2,1,0]=4 917 B9R1.6 NC(=S)C1=CC=NC=C1 MCULE-8387696003 [0,0,0,0,0,1|2,1,0]=4 918 B9R1.6 NC(=S)C1=CN=CN=C1 MCULE-3766175052 [0,0,0,0,0,1|1,1,1]=4 919 B9R1.6 NC(=S)C1=CN=NC=C1 MCULE-5841480101 [0,0,0,0,0,1|1,1,1]=4 920 B9R1.6 NC(=S)C1=NC=CN=C1 MCULE-7470857415 [0,0,0,0,0,1|2,1,0]=4 921 B9R1.6 NC(=S)C1=NC=NC=C1 MCULE-6065811194 [0,0,0,0,0,1|2,1,0]=4 922 B9R1.6 O=C(Br)C1=CC=CC=C1 MCULE-7522078795 [0,0,0,0,0,1|3,0,0]=4 923 B9R1.6 O=C(Cl)C1=CC=CC=C1 MCULE-3627399529 [0,0,0,0,0,1|3,0,0]=4 924 B9R1.6 O=C(Cl)C1=CC=CN=C1 MCULE-6351950438 [0,0,0,0,0,1|2,0,0]=3 925 B9R1.6 O=C(Cl)C1=CC=CN=C1 MCULE-7094058271 [0,0,0,0,0,1|2,0,0]=3 926 B9R1.6 O=C(Cl)C1=CC=NC=C1 MCULE-5942110874 [0,0,0,0,0,1|2,0,0]=3 927 B9R1.6 O=C(Cl)C1=CC=NC=C1 MCULE-7614393771 [0,0,0,0,0,1|2,0,0]=3 928 B9R1.6 O=C(Cl)C1=CN=CC=N1 MCULE-5938812267 [0,0,0,0,0,1|2,0,0]=3 929 B9R1.6 O=C(Cl)C1=CN=CN=C1 MCULE-6682089739 [0,0,0,0,0,1|1,0,1]=3 930 B9R1.6 O=C(Cl)C1=NC=CC=C1 MCULE-7643180144 [0,0,0,0,0,1|3,0,0]=4 931 B9R1.6 O=C(Cl)C1=NC=CC=C1 MCULE-8117283812 [0,0,0,0,0,1|3,0,0]=4 932 B9R1.6 O=C(Cl)C1=NC=CN=C1 MCULE-3637149993 [0,0,0,0,0,1|2,0,0]=3 933 B9R1.6 O=C(Cl)C1=NC=NC=C1 MCULE-3658934002 [0,0,0,0,0,1|2,0,0]=3 934 B9R1.6 O=C(Cl)C1=NN=CC=C1 MCULE-3566917182 [0,0,0,0,0,1|3,0,0]=4 935 B9R1.6 O=C(F)C1=CC=CC=C1 MCULE-3130976263 [0,0,0,0,0,1|3,0,0]=4 936 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-4193677899 [0,0,0,0,0,1|2,0,0]=3 937 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-4467353796 [0,0,0,0,0,1|2,0,0]=3 938 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-5568997402 [0,0,0,0,0,1|2,0,0]=3 939 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-5754802516 [0,0,0,0,0,1|2,0,0]=3 940 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-6090736102 [0,0,0,0,0,1|2,0,0]=3 941 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-6741432668 [0,0,0,0,0,1|2,0,0]=3 942 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-7145299919 [0,0,0,0,0,1|2,0,0]=3 943 B9R1.6 O=C(O)C1=CC=CC=C1 MCULE-8355780752 [0,0,0,0,0,1|2,0,0]=3 944 B9R1.6 O=C(O)C1=CC=CC=N1 MCULE-6881755701 [0,0,0,0,0,1|2,0,0]=3 945 B9R1.6 O=C(O)C1=CC=CN=C1 MCULE-3788394698 [0,0,0,0,0,1|1,0,0]=2 946 B9R1.6 O=C(O)C1=CC=NC=C1 MCULE-4582819440 [0,0,0,0,0,1|1,0,0]=2 947 B9R1.6 O=C(O)C1=CC=NC=N1 MCULE-5378963231 [0,0,0,0,0,1|1,0,0]=2 948 B9R1.6 O=C(O)C1=CCCCC1 MCULE-1482472372 [0,0,0,0,0,1|2,0,1]=4 949 B9R1.6 O=C(O)C1=CCCCO1 MCULE-8158964792 [0,0,0,0,0,1|2,0,1]=4 950 B9R1.6 O=C(O)C1=CCCNC1 MCULE-7878143035 [0,0,0,0,0,1|1,0,1]=3 951 B9R1.6 O=C(O)C1=CCCNC1 MCULE-9382105537 [0,0,0,0,0,1|1,0,1]=3 952 B9R1.6 O=C(O)C1=CCCOC1 MCULE-4597846034 [0,0,0,0,0,1|2,0,1]=4 953 B9R1.6 O=C(O)C1=CCCSC1 MCULE-6991730217 [0,0,0,0,0,1|2,0,1]=4 954 B9R1.6 O=C(O)C1=CCNCC1 MCULE-7813592729 [0,0,0,0,0,1|1,0,1]=3 955 B9R1.6 O=C(O)C1=CCNCC1 MCULE-9446043448 [0,0,0,0,0,1|1,0,1]=3 956 B9R1.6 O=C(O)C1=CCOCC1 MCULE-8602474600 [0,0,0,0,0,1|2,0,1]=4 957 B9R1.6 O=C(O)C1=CN=CC=C1 MCULE-6679024547 [0,0,0,0,0,1|1,0,0]=2 958 B9R1.6 O=C(O)C1=CN=CC=N1 MCULE-8414492991 [0,0,0,0,0,1|1,0,0]=2 959 B9R1.6 O=C(O)C1=CN=CN=C1 MCULE-5896698235 [0,0,0,0,0,1|0,0,1]=2 960 B9R1.6 O=C(O)C1=CN=NC=C1 MCULE-6655616758 [0,0,0,0,0,1|0,0,1]=2 961 B9R1.6 O=C(O)C1=COCCC1 MCULE-4203786677 [0,0,0,0,0,1|2,0,1]=4 962 B9R1.6 O=C(O)C1=COCCO1 MCULE-9406944236 [0,0,0,0,0,1|2,0,1]=4 963 B9R1.6 O=C(O)C1=NC=CC=C1 MCULE-1025041475 [0,0,0,0,0,1|2,0,0]=3 964 B9R1.6 O=C(O)C1=NC=CC=N1 MCULE-1770737133 [0,0,0,0,0,1|3,0,0]=4 965 B9R1.6 O=C(O)C1=NN=CC=C1 MCULE-1209477716 [0,0,0,0,0,1|2,0,0]=3 966 B9R1.6 O=C(O)C1=NN=CC=C1 MCULE-8785090866 [0,0,0,0,0,1|2,0,0]=3 967 B9R1.6 O=C(O)C1=NN=CC=N1 MCULE-7323600585 [0,0,0,0,0,1|2,0,0]=3 968 B9R1.6 O=C(O)C1=NNCCC1 MCULE-7500831474 [0,0,0,0,0,1|2,0,1]=4 969 B9R1.6 O=C(O)C1C=CCC=C1 MCULE-1209088345 [0,0,0,0,0,1|2,0,1]=4 970 B9R1.6 O=C(S)C1=CN=CC=C1 MCULE-3878046366 [0,0,0,0,0,1|1,1,0]=3 971 B9R1.6 O=C(S)C1=NC=CC=C1 MCULE-1429436751 [0,0,0,0,0,1|2,1,0]=4 972 B9R1.6 O=C(S)C1=NC=CC=C1 MCULE-6810065051 [0,0,0,0,0,1|2,1,0]=4 973 B9R1.6 O=C([O-])C1=CC=CC=C1 MCULE-1942326291 [0,0,0,0,0,1|2,0,1]=4 974 B9R1.6 O=C([O-])C1=CC=NC=C1 MCULE-8851263521 [0,0,0,0,0,1|1,0,1]=3 975 B9R1.6 O=C([O-])C1=CC=NC=N1 MCULE-1657038900 [0,0,0,0,0,1|1,0,1]=3 976 B9R1.6 O=C([O-])C1=CN=CC=C1 MCULE-3202431259 [0,0,0,0,0,1|1,0,1]=3 977 B9R1.6 O=C([O-])C1=CN=CC=C1 MCULE-8064615687 [0,0,0,0,0,1|1,0,1]=3 978 B9R1.6 O=C([O-])C1=NC=CC=C1 MCULE-1772335294 [0,0,0,0,0,1|2,0,1]=4 979 B9R1.6 O=C([O-])C1=NC=CN=N1 MCULE-9647354113 [0,0,0,0,0,1|2,0,1]=4 980 B9R1.6 O=N(=O)C1=CC=CN=C1 MCULE-7006780902 [0,0,0,0,0,1|2,0,1]=4 981 B9R1.6 O=N(=O)C1=CC=NC=C1 MCULE-8653948779 [0,0,0,0,0,1|2,0,1]=4 982 B9R1.6 O=N(=O)C1=CN=CN=C1 MCULE-7641385631 [0,0,0,0,0,1|1,0,2]=4 983 B9R1.6 O=S(O)C1=CC=CC=C1 MCULE-6343931944 [0,0,0,0,0,1|3,0,0]=4 984 B9R1.6 O=S(O)C1=CN=CC=C1 MCULE-2092147555 [0,0,0,0,0,1|2,0,0]=3 985 B9R1.6 O=S(O)C1=CN=CC=C1 MCULE-6698166959 [0,0,0,0,0,1|2,0,0]=3 986 B9R1.6 O=S(O)C1=NC=CC=C1 MCULE-4645749820 [0,0,0,0,0,1|3,0,0]=4 987 B9R1.6 O=S([O-])C1=CC=CN=C1 MCULE-5738558896 [0,0,0,0,0,1|2,0,1]=4 988 B9R1.6 O=S([O-])C1=CC=NC=C1 MCULE-7013298668 [0,0,0,0,0,1|2,0,1]=4 989 B9R1.6 O=S([O-])C1=CC=NC=C1 MCULE-7818458124 [0,0,0,0,0,1|2,0,1]=4 990 B9R1.6 O=[Se](O)C1=CC=CC=C1 MCULE-1071286798 [0,0,0,0,0,1|3,0,0]=4 991 B9R1.6 OB(O)C1=CC=CN=C1 MCULE-2870246858 [0,0,0,0,0,1|2,0,1]=4 992 B9R1.6 OB(O)C1=CC=NC=C1 MCULE-2683701590 [0,0,0,0,0,1|2,0,1]=4 993 B9R1.6 OB(O)C1=CC=NC=C1 MCULE-8347634876 [0,0,0,0,0,1|2,0,1]=4 994 B9R1.6 OB(O)C1=CC=NC=N1 MCULE-1496635664 [0,0,0,0,0,1|2,0,1]=4 995 B9R1.6 OB(O)C1=CC=NN=C1 MCULE-3182539518 [0,0,0,0,0,1|1,0,2]=4 996 B9R1.6 OB(O)C1=CN=CC=C1 MCULE-2775522608 [0,0,0,0,0,1|2,0,1]=4 997 B9R1.6 OB(O)C1=CN=CN=C1 MCULE-3751370401 [0,0,0,0,0,1|1,0,2]=4 998 B9R1.6 OB(O)C1=NC=CN=C1 MCULE-2121712626 [0,0,0,0,0,1|2,0,1]=4 999 B9R1.6 OC(=S)C1=CC=CC=C1 MCULE-2456776015 [0,0,0,0,0,1|2,1,0]=4 1000 B9R1.6 P(=O)(O)C1=CC=CC=C1 MCULE-8341609278 [0,0,0,0,0,1|3,0,0]=4 1001 B9R1.13 C1=NC(=CS1)CC(=O)O MCULE-1238453262 [0,0,0,0,0,1|3,0,0]=4 1002 B9R1.13 CC(=O)CC1=CC=NO1 MCULE-9545444993 [0,0,0,0,0,1|3,0,0]=4 1003 B9R1.13 CC(=O)CC1=CN=CS1 MCULE-8783347852 [0,0,0,0,0,1|3,0,0]=4 1004 B9R1.13 CC(=O)CC1=COC=C1 MCULE-2428760368 [0,0,0,0,0,1|3,0,0]=4 1005 B9R1.13 CC(=O)CC1=CSC=C1 MCULE-1364443363 [0,0,0,0,0,1|3,0,0]=4 1006 B9R1.13 CC(=O)CN1C=CN=C1 MCULE-1604792895 [0,0,0,0,0,1|3,0,0]=4 1007 B9R1.13 CC(=O)CN1C=CN=C1 MCULE-6829549689 [0,0,0,0,0,1|3,0,0]=4 1008 B9R1.13 CC(=O)NC1=CC=NN1 MCULE-2847031032 [0,0,0,0,0,1|3,0,0]=4 1009 B9R1.13 CC(=O)NC1=CNN=C1 MCULE-9362671115 [0,0,0,0,0,1|1,0,0]=2 1010 B9R1.13 CC(=O)NC1=CON=C1 MCULE-3612409333 [0,0,0,0,0,1|2,0,0]=3 1011 B9R1.13 CC(=O)NC1=CSC=C1 MCULE-4876700541 [0,0,0,0,0,1|3,0,0]=4 1012 B9R1.13 CC(C)OC1=CNN=C1 MCULE-9829059559 [0,0,0,0,0,1|2,0,1]=4 1013 B9R1.13 CC(C)SC1=CNN=C1 MCULE-2400566566 [0,0,0,0,0,1|2,0,1]=4 1014 B9R1.13 N=C(N)CC1=CNN=C1 MCULE-2238899202 [0,0,0,0,0,1|2,0,0]=3 1015 B9R1.13 NC(=O)CC1=CSC=C1 MCULE-7143041722 [0,0,0,0,0,1|3,0,0]=4 1016 B9R1.13 NC(=O)CN1C=CN=C1 MCULE-1856941988 [0,0,0,0,0,1|3,0,0]=4 1017 B9R1.13 NC(=O)NN1C=NN=C1 MCULE-3812572208 [0,0,0,0,0,1|2,0,1]=4 1018 B9R1.13 O=C(Cl)CC1=CSC=C1 MCULE-4949997920 [0,0,0,0,0,1|3,0,0]=4 1019 B9R1.13 O=C(Cl)CN1C=CN=C1 MCULE-8315453161 [0,0,0,0,0,1|3,0,0]=4 1020 B9R1.13 O=C(O)/C=C\1/CCNC1 MCULE-3459034443 [0,0,0,0,0,1|1,0,2]=4 1021 B9R1.13 O=C(O)CC1=CC=CN1 MCULE-7285438888 [0,0,0,0,0,1|3,0,0]=4 1022 B9R1.13 O=C(O)CC1=CC=CO1 MCULE-8441709842 [0,0,0,0,0,1|3,0,0]=4 1023 B9R1.13 O=C(O)CC1=CC=CS1 MCULE-7149489344 [0,0,0,0,0,1|3,0,0]=4 1024 B9R1.13 O=C(O)CC1=CC=NN1 MCULE-6168707042 [0,0,0,0,0,1|2,0,0]=3 1025 B9R1.13 O=C(O)CC1=CC=NN1 MCULE-7841552779 [0,0,0,0,0,1|2,0,0]=3 1026 B9R1.13 O=C(O)CC1=CC=NO1 MCULE-1530103657 [0,0,0,0,0,1|2,0,0]=3 1027 B9R1.13 O=C(O)CC1=CC=NS1 MCULE-3265054261 [0,0,0,0,0,1|2,0,0]=3 1028 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [0,0,0,0,0,1|2,0,1]=4 1029 B9R1.13 O=C(O)CC1=CN=CN1 MCULE-4462983491 [0,0,0,0,0,1|2,0,0]=3 1030 B9R1.13 O=C(O)CC1=CN=CO1 MCULE-6840081660 [0,0,0,0,0,1|2,0,0]=3 1031 B9R1.13 O=C(O)CC1=CN=CS1 MCULE-1649938849 [0,0,0,0,0,1|2,0,0]=3 1032 B9R1.13 O=C(O)CC1=CN=NS1 MCULE-5313238952 [0,0,0,0,0,1|1,0,1]=3 1033 B9R1.13 O=C(O)CC1=CNC=C1 MCULE-4117122327 [0,0,0,0,0,1|1,0,0]=2 1034 B9R1.13 O=C(O)CC1=CNC=N1 MCULE-7235823721 [0,0,0,0,0,1|2,0,0]=3 1035 B9R1.13 O=C(O)CC1=CNN=C1 MCULE-2060094937 [0,0,0,0,0,1|0,0,0]=1 1036 B9R1.13 O=C(O)CC1=CNN=C1 MCULE-6213369275 [0,0,0,0,0,1|0,0,0]=1 1037 B9R1.13 O=C(O)CC1=CNN=N1 MCULE-1613172716 [0,0,0,0,0,1|1,0,0]=2 1038 B9R1.13 O=C(O)CC1=COC=C1 MCULE-9657437511 [0,0,0,0,0,1|2,0,0]=3 1039 B9R1.13 O=C(O)CC1=COC=N1 MCULE-5978349363 [0,0,0,0,0,1|3,0,0]=4 1040 B9R1.13 O=C(O)CC1=CON=C1 MCULE-4980334302 [0,0,0,0,0,1|1,0,0]=2 1041 B9R1.13 O=C(O)CC1=CSC=C1 MCULE-7786560221 [0,0,0,0,0,1|2,0,0]=3 1042 B9R1.13 O=C(O)CC1=CSC=N1 MCULE-1276507774 [0,0,0,0,0,1|3,0,0]=4 1043 B9R1.13 O=C(O)CC1=CSN=C1 MCULE-1320580283 [0,0,0,0,0,1|1,0,0]=2 1044 B9R1.13 O=C(O)CC1=CSN=N1 MCULE-2027393850 [0,0,0,0,0,1|2,0,0]=3 1045 B9R1.13 O=C(O)CC1=NC=NN1 MCULE-9852413315 [0,0,0,0,0,1|3,0,0]=4 1046 B9R1.13 O=C(O)CC1=NN=CN1 MCULE-6109033233 [0,0,0,0,0,1|3,0,0]=4 1047 B9R1.13 O=C(O)CC1=NN=CO1 MCULE-5332086475 [0,0,0,0,0,1|3,0,0]=4 1048 B9R1.13 O=C(O)CC1=NN=NN1 MCULE-6950195023 [0,0,0,0,0,1|2,0,1]=4 1049 B9R1.13 O=C(O)CC1=NOC=C1 MCULE-9033104587 [0,0,0,0,0,1|3,0,0]=4 1050 B9R1.13 O=C(O)CN1C=CC=C1 MCULE-2328864169 [0,0,0,0,0,1|3,0,0]=4 1051 B9R1.13 O=C(O)CN1C=CN=C1 MCULE-5564448666 [0,0,0,0,0,1|2,0,0]=3 1052 B9R1.13 O=C(O)CN1C=CN=C1 MCULE-6772025310 [0,0,0,0,0,1|2,0,0]=3 1053 B9R1.13 O=C(O)CN1C=CN=N1 MCULE-4822674812 [0,0,0,0,0,1|3,0,0]=4 1054 B9R1.13 O=C(O)CN1C=CN=N1 MCULE-6170546878 [0,0,0,0,0,1|3,0,0]=4 1055 B9R1.13 O=C(O)CN1C=NC=N1 MCULE-5004883798 [0,0,0,0,0,1|3,0,0]=4 1056 B9R1.13 O=C(O)CN1C=NC=N1 MCULE-7489588316 [0,0,0,0,0,1|3,0,0]=4 1057 B9R1.13 O=C(O)CN1C=NN=C1 MCULE-3454837161 [0,0,0,0,0,1|1,0,1]=3 1058 B9R1.13 O=C(O)CN1C=NN=N1 MCULE-8164680022 [0,0,0,0,0,1|2,0,1]=4 1059 B9R1.13 O=C(O)C[N+]1=CSC=C1 MCULE-3248970334 [0,0,0,0,0,1|3,0,0]=4 1060 B9R1.13 O=C(O)C[N+]1=CSC=C1 MCULE-9264364233 [0,0,0,0,0,1|3,0,0]=4 1061 B9R1.13 O=C([O-])CC1=CNC=N1 MCULE-1164076285 [0,0,0,0,0,1|2,0,1]=4 1062 B6R0.4 C=C/C=C/C(=O)O MCULE-7975593411 [1,0,1,0,0,0|1,0,0]=3 1063 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [1,0,1,0,0,0|1,0,1]=4 1064 B6R0.4 C=CC=CC(=O)Cl MCULE-6383997047 [1,0,1,0,0,0|2,0,0]=4 1065 B6R0.4 C=CC=CC(=O)O MCULE-5189540617 [1,0,1,0,0,0|1,0,0]=3 1066 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [1,0,1,0,0,0|1,0,1]=4 1067 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [1,0,1,0,0,0|1,0,1]=4 1068 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [1,0,1,0,0,0|1,0,1]=4 1069 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [1,0,1,0,0,0|1,0,1]=4 1070 B6R0.4 COC=CC(=O)O MCULE-4252899122 [1,0,1,0,0,0|1,0,1]=4 1071 B6R0.4 CON=CC(=O)O MCULE-6800819509 [1,0,1,0,0,0|1,0,1]=4 1072 B6R0.4 N#CC=CC(=O)O MCULE-9790502930 [1,0,1,0,0,0|1,0,1]=4 1073 B6R0.4 N/N=C/NC(=O)N MCULE-6272806279 [1,0,1,0,0,0|2,0,0]=4 1074 B6R0.4 N/N=C/NC(=O)N MCULE-7518775080 [1,0,1,0,0,0|2,0,0]=4 1075 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [1,0,1,0,0,0|1,0,0]=3 1076 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [1,0,1,0,0,0|1,0,0]=3 1077 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [1,0,1,0,0,0|1,0,0]=3 1078 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [1,0,1,0,0,0|2,0,0]=4 1079 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [1,0,1,0,0,0|2,0,0]=4 1080 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [1,0,1,0,0,0|2,0,0]=4 1081 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [1,0,1,0,0,0|2,0,0]=4 1082 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [1,0,1,0,0,0|2,0,0]=4 1083 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [1,0,1,0,0,0|2,0,0]=4 1084 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [1,0,1,0,0,0|1,0,1]=4 1085 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [1,0,1,0,0,0|2,0,0]=4 1086 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [1,0,1,0,0,0|1,0,1]=4 1087 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [1,0,1,0,0,0|2,0,0]=4 1088 B6R0.3 C=C(C#N)C(=O)O MCULE-1746285232 [1,0,1,0,0,0|0,0,2]=4 1089 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [1,0,1,0,0,0|1,0,1]=4 1090 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,0,1,0,0,0|1,0,1]=4 1091 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [1,0,1,0,0,0|1,0,1]=4 1092 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [1,0,1,0,0,0|2,0,0]=4 1093 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [1,0,1,0,0,0|2,0,0]=4 1094 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [1,0,1,0,0,0|1,0,1]=4 1095 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [1,0,1,0,0,0|1,0,1]=4 1096 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [1,0,1,0,0,0|1,0,1]=4 1097 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [1,0,1,0,0,0|1,0,1]=4 1098 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [1,0,1,0,0,0|1,0,1]=4 1099 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [1,0,1,0,0,0|1,0,1]=4 1100 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [1,0,1,0,0,0|1,0,1]=4 1101 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [1,0,1,0,0,0|1,0,1]=4 1102 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [1,0,1,0,0,0|1,0,1]=4 1103 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [1,0,1,0,0,0|1,0,1]=4 1104 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [1,0,1,0,0,0|1,0,1]=4 1105 B6R0.3 CC(=CBr)C(=O)O MCULE-3682516046 [1,0,1,0,0,0|1,0,1]=4 1106 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [1,0,1,0,0,0|1,0,1]=4 1107 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [1,0,1,0,0,0|2,0,0]=4 1108 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [1,0,1,0,0,0|1,0,1]=4 1109 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [1,0,1,0,0,0|2,0,0]=4 1110 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [1,0,1,0,0,0|2,0,0]=4 1111 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [1,0,1,0,0,0|2,0,0]=4 1112 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [1,0,1,0,0,0|2,0,0]=4 1113 B6R0.3 O=C(O)/C(=C/Cl)/Cl MCULE-4317518344 [1,0,1,0,0,0|2,0,0]=4 1114 B6R0.3 O=C(O)C(=CCl)Cl MCULE-2693859334 [1,0,1,0,0,0|2,0,0]=4 1115 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [1,0,1,0,0,0|1,0,1]=4 1116 B6R0.9 N#CC(=CN)C=O MCULE-8372425513 [1,0,1,0,0,0|0,0,2]=4 1117 B6R1.2 BrC1=CNC=C1 MCULE-2704154564 [2,0,0,0,0,0|2,0,0]=4 1118 B6R1.2 BrC1=CNN=C1 MCULE-2600716492 [2,0,0,0,0,0|1,0,0]=3 1119 B6R1.2 BrC1=CON=C1 MCULE-7025802564 [2,0,0,0,0,0|2,0,0]=4 1120 B6R1.2 BrC1=CSN=C1 MCULE-2285235944 [2,0,0,0,0,0|2,0,0]=4 1121 B6R1.2 CC1=CNC=C1 MCULE-9114555776 [2,0,0,0,0,0|1,0,1]=4 1122 B6R1.2 CC1=CNN=C1 MCULE-2732751720 [2,0,0,0,0,0|0,0,1]=3 1123 B6R1.2 CC1=CNN=C1 MCULE-3538959589 [2,0,0,0,0,0|0,0,1]=3 1124 B6R1.2 CC1=CNN=N1 MCULE-2819973344 [2,0,0,0,0,0|1,0,1]=4 1125 B6R1.2 CC1=CON=C1 MCULE-4312100714 [2,0,0,0,0,0|1,0,1]=4 1126 B6R1.2 CC1=CSN=C1 MCULE-2603580928 [2,0,0,0,0,0|1,0,1]=4 1127 B6R1.2 ClC1=CNN=C1 MCULE-2092045123 [2,0,0,0,0,0|1,0,0]=3 1128 B6R1.2 ClC1=CSN=C1 MCULE-6113180722 [2,0,0,0,0,0|2,0,0]=4 1129 B6R1.2 FC1=CNN=C1 MCULE-7981107171 [2,0,0,0,0,0|1,0,0]=3 1130 B6R1.2 FC1=CNN=C1 MCULE-9509914186 [2,0,0,0,0,0|1,0,0]=3 1131 B6R1.2 IC1=CNC=C1 MCULE-4230351559 [2,0,0,0,0,0|2,0,0]=4 1132 B6R1.2 IC1=CNN=C1 MCULE-4755201793 [2,0,0,0,0,0|1,0,0]=3 1133 B6R1.2 IC1=CON=C1 MCULE-4450603437 [2,0,0,0,0,0|2,0,0]=4 1134 B6R1.2 IC1=CSN=C1 MCULE-5646861702 [2,0,0,0,0,0|2,0,0]=4 1135 B6R1.2 NC1=CNC=C1 MCULE-1411730985 [2,0,0,0,0,0|2,0,0]=4 1136 B6R1.2 NC1=CNC=C1 MCULE-7701316156 [2,0,0,0,0,0|2,0,0]=4 1137 B6R1.2 NC1=CNN=C1 MCULE-4119655375 [2,0,0,0,0,0|1,0,0]=3 1138 B6R1.2 NC1=CNN=C1 MCULE-5097217370 [2,0,0,0,0,0|1,0,0]=3 1139 B6R1.2 NC1=CNN=C1 MCULE-6287007700 [2,0,0,0,0,0|1,0,0]=3 1140 B6R1.2 NC1=CNN=N1 MCULE-7644677669 [2,0,0,0,0,0|2,0,0]=4 1141 B6R1.2 NC1=CON=C1 MCULE-2373604754 [2,0,0,0,0,0|2,0,0]=4 1142 B6R1.2 NC1=CON=C1 MCULE-7932471087 [2,0,0,0,0,0|2,0,0]=4 1143 B6R1.2 NC1=CSN=C1 MCULE-8555779572 [2,0,0,0,0,0|2,0,0]=4 1144 B6R1.2 NC1=CSN=C1 MCULE-9110365089 [2,0,0,0,0,0|2,0,0]=4 1145 B6R1.2 NC1=CSN=C1 MCULE-9229676240 [2,0,0,0,0,0|2,0,0]=4 1146 B6R1.2 NC1=NNN=C1 MCULE-4268197612 [2,0,0,0,0,0|2,0,0]=4 1147 B6R1.2 O=C1C=CNN1 MCULE-8045056316 [2,0,0,0,0,0|2,0,0]=4 1148 B6R1.2 OC1=CC=NN1 MCULE-9109008036 [2,0,0,0,0,0|2,0,0]=4 1149 B6R1.2 OC1=CN=CS1 MCULE-4004908551 [2,0,0,0,0,0|2,0,0]=4 1150 B6R1.2 OC1=CNC=C1 MCULE-3938204755 [2,0,0,0,0,0|1,0,0]=3 1151 B6R1.2 OC1=CNC=N1 MCULE-1911765165 [2,0,0,0,0,0|2,0,0]=4 1152 B6R1.2 OC1=CNN=C1 MCULE-5672706063 [2,0,0,0,0,0|0,0,0]=2 1153 B6R1.2 OC1=CNN=C1 MCULE-5774317326 [2,0,0,0,0,0|0,0,0]=2 1154 B6R1.2 OC1=CON=C1 MCULE-9622003135 [2,0,0,0,0,0|1,0,0]=3 1155 B6R1.2 OC1=CSC=C1 MCULE-2226095386 [2,0,0,0,0,0|2,0,0]=4 1156 B6R1.2 OC1=NSN=C1 MCULE-1499049623 [2,0,0,0,0,0|2,0,0]=4 1157 B6R1.2 SC1=CNN=C1 MCULE-7844673145 [2,0,0,0,0,0|0,1,0]=3 1158 B8R0.9 C(=CC(=O)NC)C(=O)O MCULE-6946307549 [0,1,1,0,0,0|1,0,1]=4 1159 B8R0.9 CNC(=O)/C=C\C(=O)O MCULE-9272095560 [0,1,1,0,0,0|1,0,1]=4 1160 B8R0.28 CN(C)C/C=C/C(=O)O MCULE-2726508724 [0,1,1,0,0,0|1,0,1]=4 1161 B8R0.28 CN(C)C/C=C/C(=O)O MCULE-2945466855 [0,1,1,0,0,0|1,0,1]=4 1162 B8R0.28 CN(C)CC=CC(=O)O MCULE-5265576987 [0,1,1,0,0,0|1,0,1]=4 1163 B8R0.28 CN(C)CC=CC(=O)O MCULE-6262530852 [0,1,1,0,0,0|1,0,1]=4 1164 B8R0.28 NC(=O)NC=CC(=O)O MCULE-5004188805 [0,1,1,0,0,0|2,0,0]=4 1165 B8R0.23 C=C(CN(C)C)C(=O)O MCULE-9526642183 [0,1,1,0,0,0|1,0,1]=4 1166 B8R0.18 CC(=O)C(=CN)C(=O)C MCULE-1809554699 [0,1,1,0,0,0|2,0,0]=4 1167 B8R0.18 N#CC(=C(N)Cl)C(=O)O MCULE-9943473987 [0,1,1,0,0,0|0,0,2]=4 1168 B8R0.18 O=C(O)C(=CBr)C(=O)O MCULE-6610352716 [0,1,1,0,0,0|2,0,0]=4 1169 B8R1.1 C#CC1=CN(N=C1)C MCULE-4241479124 [1,1,0,0,0,0|1,0,1]=4 1170 B8R1.1 C=CC1=CN(N=C1)C MCULE-5112014066 [1,1,0,0,0,0|1,0,0]=3 1171 B8R1.1 CC1=CC(=CS1)C=O MCULE-4654357481 [1,1,0,0,0,0|2,0,0]=4 1172 B8R1.1 CC1=NC(=CN1)C=O MCULE-7054645578 [1,1,0,0,0,0|2,0,0]=4 1173 B8R1.1 CC1=NC=C(O1)C=O MCULE-1917920554 [1,1,0,0,0,0|2,0,0]=4 1174 B8R1.1 CC1=NC=C(S1)C=O MCULE-9484469063 [1,1,0,0,0,0|2,0,0]=4 1175 B8R1.1 CC1=NNC(=C1)C=O MCULE-8923372806 [1,1,0,0,0,0|2,0,0]=4 1176 B8R1.1 CC1=NOC(=C1)C=O MCULE-1834049159 [1,1,0,0,0,0|2,0,0]=4 1177 B8R1.1 CC1=NSC(=C1)C=O MCULE-5196335862 [1,1,0,0,0,0|2,0,0]=4 1178 B8R1.1 CN1C=C(C=N1)C#N MCULE-9955105566 [1,1,0,0,0,0|1,0,1]=4 1179 B8R1.1 CN1C=C(C=N1)C=O MCULE-9367348547 [1,1,0,0,0,0|0,0,0]=2 1180 B8R1.1 CN1C=C(C=N1)CBr MCULE-3970966462 [1,1,0,0,0,0|1,0,1]=4 1181 B8R1.1 CN1C=C(C=N1)CBr MCULE-5050767615 [1,1,0,0,0,0|1,0,1]=4 1182 B8R1.1 CN1C=C(C=N1)CCl MCULE-5398255993 [1,1,0,0,0,0|1,0,1]=4 1183 B8R1.1 CN1C=C(C=N1)CCl MCULE-9722792376 [1,1,0,0,0,0|1,0,1]=4 1184 B8R1.1 CN1C=C(C=N1)CN MCULE-2268712025 [1,1,0,0,0,0|1,0,1]=4 1185 B8R1.1 CN1C=C(C=N1)CN MCULE-3460357407 [1,1,0,0,0,0|1,0,1]=4 1186 B8R1.1 CN1C=C(C=N1)CN MCULE-6051862975 [1,1,0,0,0,0|1,0,1]=4 1187 B8R1.1 CN1C=C(C=N1)CO MCULE-5787125938 [1,1,0,0,0,0|0,0,1]=3 1188 B8R1.1 CN1C=C(C=N1)CS MCULE-6588285384 [1,1,0,0,0,0|0,1,1]=4 1189 B8R1.1 CN1C=C(C=N1)NN MCULE-1949963555 [1,1,0,0,0,0|2,0,0]=4 1190 B8R1.1 CN1C=C(C=N1)NN MCULE-3191777841 [1,1,0,0,0,0|2,0,0]=4 1191 B8R1.1 CN1C=C(C=N1)NN MCULE-6437464868 [1,1,0,0,0,0|2,0,0]=4 1192 B8R1.1 CN1C=C(N=N1)C=O MCULE-8728589225 [1,1,0,0,0,0|1,0,0]=3 1193 B8R1.1 CN1C=C(N=N1)CO MCULE-1481303590 [1,1,0,0,0,0|1,0,1]=4 1194 B8R1.1 CN1C=C(N=N1)CO MCULE-4674144486 [1,1,0,0,0,0|1,0,1]=4 1195 B8R1.1 CN1C=CC(=C1)C=O MCULE-3196849957 [1,1,0,0,0,0|1,0,0]=3 1196 B8R1.1 CN1C=CC(=C1)CO MCULE-3776279548 [1,1,0,0,0,0|1,0,1]=4 1197 B8R1.1 CN1C=CC(=N1)C=O MCULE-9758898516 [1,1,0,0,0,0|2,0,0]=4 1198 B8R1.1 CN1C=NC(=C1)C=O MCULE-1440199869 [1,1,0,0,0,0|2,0,0]=4 1199 B8R1.1 CN1N=CC(=N1)C=O MCULE-2530075826 [1,1,0,0,0,0|1,0,0]=3 1200 B8R1.1 CN1N=CC(=N1)CO MCULE-8999578050 [1,1,0,0,0,0|1,0,1]=4 1201 B8R1.1 CN1N=NC(=N1)C=O MCULE-3778647308 [1,1,0,0,0,0|2,0,0]=4 1202 B8R1.1 CNC1=CN(N=C1)C MCULE-1159966798 [1,1,0,0,0,0|2,0,0]=4 1203 B8R1.1 CNC1=CN(N=C1)C MCULE-6061547804 [1,1,0,0,0,0|2,0,0]=4 1204 B8R1.1 CNC1=CN(N=C1)C MCULE-7191607932 [1,1,0,0,0,0|2,0,0]=4 1205 B8R1.1 COC1=CN(N=C1)C MCULE-4803156922 [1,1,0,0,0,0|2,0,0]=4 1206 B8R1.1 CSC1=CN(N=C1)C MCULE-8667538993 [1,1,0,0,0,0|2,0,0]=4 1207 B8R1.1 NC1=NC=C(S1)C=O MCULE-3494753598 [1,1,0,0,0,0|2,0,0]=4 1208 B8R1.1 NC1=NC=C(S1)C=O MCULE-7692870141 [1,1,0,0,0,0|2,0,0]=4 1209 B8R1.1 NC1=NNC(=C1)C=O MCULE-3430898897 [1,1,0,0,0,0|2,0,0]=4 1210 B8R1.1 O=CC1=CC(=NO1)Br MCULE-8160002215 [1,1,0,0,0,0|2,0,0]=4 1211 B8R1.1 O=CC1=CN=C(N1)Br MCULE-7917892628 [1,1,0,0,0,0|2,0,0]=4 1212 B8R1.1 O=CC1=CN=C(S1)Br MCULE-7003447562 [1,1,0,0,0,0|2,0,0]=4 1213 B8R1.1 O=CC1=CN=C(S1)Cl MCULE-3135685903 [1,1,0,0,0,0|2,0,0]=4 1214 B8R1.1 O=CC1=CNC(=C1)Br MCULE-2415455714 [1,1,0,0,0,0|1,0,0]=3 1215 B8R1.1 O=CC1=CNC(=C1)I MCULE-7300933638 [1,1,0,0,0,0|1,0,0]=3 1216 B8R1.1 O=CC1=CNC(=O)N1 MCULE-9682504518 [1,1,0,0,0,0|2,0,0]=4 1217 B8R1.1 O=CC1=CSC(=C1)Br MCULE-9550005786 [1,1,0,0,0,0|2,0,0]=4 1218 B8R1.1 O=CC1=CSC(=C1)Cl MCULE-4281855766 [1,1,0,0,0,0|2,0,0]=4 1219 B8R1.1 O=CC1=NNC(=C1)Br MCULE-1824548499 [1,1,0,0,0,0|2,0,0]=4 1220 B8R1.8 BrCCC1=CNN=C1 MCULE-1609362784 [1,1,0,0,0,0|1,0,1]=4 1221 B8R1.8 BrCCC1=CNN=C1 MCULE-4352397136 [1,1,0,0,0,0|1,0,1]=4 1222 B8R1.8 CCCC1=CNN=C1 MCULE-5993557570 [1,1,0,0,0,0|1,0,1]=4 1223 B8R1.8 CCOC1=CNN=C1 MCULE-9362951835 [1,1,0,0,0,0|1,0,1]=4 1224 B8R1.8 CNCC1=CNN=C1 MCULE-4124168667 [1,1,0,0,0,0|1,0,1]=4 1225 B8R1.8 CNCC1=CNN=C1 MCULE-7733307968 [1,1,0,0,0,0|1,0,1]=4 1226 B8R1.8 COCC1=CNN=C1 MCULE-4969426420 [1,1,0,0,0,0|0,0,1]=3 1227 B8R1.8 ClCCC1=CNN=C1 MCULE-7222651507 [1,1,0,0,0,0|1,0,1]=4 1228 B8R1.8 ClCCC1=CNN=C1 MCULE-8510653831 [1,1,0,0,0,0|1,0,1]=4 1229 B8R1.8 N#CCC1=CNN=C1 MCULE-3041142936 [1,1,0,0,0,0|1,0,1]=4 1230 B8R1.8 NCCC1=CNN=C1 MCULE-3507122508 [1,1,0,0,0,0|1,0,1]=4 1231 B8R1.8 NCCC1=CNN=C1 MCULE-9226408302 [1,1,0,0,0,0|1,0,1]=4 1232 B8R1.8 O/N=C/C1=CSC=C1 MCULE-2882135618 [1,1,0,0,0,0|2,0,0]=4 1233 B8R1.8 O=CNC1=CNN=N1 MCULE-8970433130 [1,1,0,0,0,0|1,0,0]=3 1234 B8R1.8 OCCC1=CNN=C1 MCULE-3556623955 [1,1,0,0,0,0|0,0,1]=3 1235 B8R1.8 OCCC1=CNN=C1 MCULE-5507251951 [1,1,0,0,0,0|0,0,1]=3 1236 B8R1.8 OCCC1=CNN=N1 MCULE-1190869996 [1,1,0,0,0,0|1,0,1]=4 1237 B8R1.8 OCCC1=CNN=N1 MCULE-1877062017 [1,1,0,0,0,0|1,0,1]=4 1238 B8R1.8 OCCC1=CON=C1 MCULE-2787695851 [1,1,0,0,0,0|1,0,1]=4 1239 B8R1.8 ON=CC1=COC=C1 MCULE-8914608943 [1,1,0,0,0,0|2,0,0]=4 1240 B8R1.8 ON=CC1=CON=C1 MCULE-1361920950 [1,1,0,0,0,0|1,0,0]=3 1241 B8R1.8 ON=CC1=CSC=C1 MCULE-6550369660 [1,1,0,0,0,0|2,0,0]=4 1242 B8R1.11 C(=O)C1=CNN=C1C MCULE-3491224580 [1,1,0,0,0,0|0,0,0]=2 1243 B8R1.11 CC1=C(C=CO1)C=O MCULE-3756016050 [1,1,0,0,0,0|2,0,0]=4 1244 B8R1.11 CC1=C(C=CS1)C=O MCULE-6448646967 [1,1,0,0,0,0|2,0,0]=4 1245 B8R1.11 CC1=C(C=NN1)CN MCULE-9628349636 [1,1,0,0,0,0|1,0,1]=4 1246 B8R1.11 CC1=C(C=NN1)CO MCULE-3686101220 [1,1,0,0,0,0|0,0,1]=3 1247 B8R1.11 CC1=C(C=NO1)C=O MCULE-4524941364 [1,1,0,0,0,0|1,0,0]=3 1248 B8R1.11 CC1=C(C=NO1)CO MCULE-4541715943 [1,1,0,0,0,0|1,0,1]=4 1249 B8R1.11 CC1=C(C=NS1)C=O MCULE-6399882085 [1,1,0,0,0,0|1,0,0]=3 1250 B8R1.11 CC1=C(N=NN1)C=O MCULE-1010010442 [1,1,0,0,0,0|1,0,0]=3 1251 B8R1.11 CC1=C(NC=N1)C=O MCULE-6500436461 [1,1,0,0,0,0|2,0,0]=4 1252 B8R1.11 CC1=C(NN=C1)C=O MCULE-2538988412 [1,1,0,0,0,0|2,0,0]=4 1253 B8R1.11 CC1=C(OC=N1)C=O MCULE-7950633787 [1,1,0,0,0,0|2,0,0]=4 1254 B8R1.11 CC1=C(SC=N1)C=O MCULE-3001345213 [1,1,0,0,0,0|2,0,0]=4 1255 B8R1.11 CC1=C(SN=C1)C=O MCULE-8866340084 [1,1,0,0,0,0|2,0,0]=4 1256 B8R1.11 CC1=C(SN=N1)C=O MCULE-5344475640 [1,1,0,0,0,0|1,0,1]=4 1257 B8R1.11 CC1=CNN=C1C=O MCULE-3810518670 [1,1,0,0,0,0|2,0,0]=4 1258 B8R1.11 CC1=CSC=C1C=O MCULE-5921118381 [1,1,0,0,0,0|2,0,0]=4 1259 B8R1.11 CC1=NNC=C1C#N MCULE-8794401963 [1,1,0,0,0,0|1,0,1]=4 1260 B8R1.11 CC1=NNC=C1C=O MCULE-4695510996 [1,1,0,0,0,0|0,0,0]=2 1261 B8R1.11 CC1=NNC=C1CN MCULE-5603360973 [1,1,0,0,0,0|1,0,1]=4 1262 B8R1.11 CC1=NNC=C1CN MCULE-6409973282 [1,1,0,0,0,0|1,0,1]=4 1263 B8R1.11 CC1=NNC=C1CN MCULE-7518229795 [1,1,0,0,0,0|1,0,1]=4 1264 B8R1.11 CC1=NOC=C1C=O MCULE-7737800065 [1,1,0,0,0,0|1,0,0]=3 1265 B8R1.11 CC1=NOC=C1CO MCULE-9392549761 [1,1,0,0,0,0|1,0,1]=4 1266 B8R1.11 CC1=NON=C1C=O MCULE-9206393170 [1,1,0,0,0,0|2,0,0]=4 1267 B8R1.11 CC1=NSC=C1C=O MCULE-6060853192 [1,1,0,0,0,0|1,0,0]=3 1268 B8R1.11 CC1=NSC=C1CO MCULE-3473428292 [1,1,0,0,0,0|1,0,1]=4 1269 B8R1.11 CCC1=CNN=C1C MCULE-7215089634 [1,1,0,0,0,0|1,0,1]=4 1270 B8R1.11 CCC1=CNN=C1N MCULE-3300872767 [1,1,0,0,0,0|1,0,1]=4 1271 B8R1.11 CCC1=CNN=C1N MCULE-5669500423 [1,1,0,0,0,0|1,0,1]=4 1272 B8R1.11 CCC1=CNN=C1N MCULE-8503142096 [1,1,0,0,0,0|1,0,1]=4 1273 B8R1.11 CN1C=NC=C1C=O MCULE-4444133297 [1,1,0,0,0,0|2,0,0]=4 1274 B8R1.11 CN1N=CC=C1C=O MCULE-9719887404 [1,1,0,0,0,0|2,0,0]=4 1275 B8R1.11 CN1N=NC=C1C=O MCULE-9536514607 [1,1,0,0,0,0|1,0,1]=4 1276 B8R1.11 COC1=C(NN=C1)I MCULE-3543245763 [1,1,0,0,0,0|2,0,0]=4 1277 B8R1.11 COC1=CNN=C1N MCULE-8895206084 [1,1,0,0,0,0|2,0,0]=4 1278 B8R1.11 N#CC1=C(NN=C1)Br MCULE-1118972577 [1,1,0,0,0,0|1,0,1]=4 1279 B8R1.11 N#CC1=CNN=C1Cl MCULE-1714863515 [1,1,0,0,0,0|1,0,1]=4 1280 B8R1.11 N#CC1=CNN=C1F MCULE-7090318323 [1,1,0,0,0,0|1,0,1]=4 1281 B8R1.11 N#CC1=CNN=C1I MCULE-2390914638 [1,1,0,0,0,0|1,0,1]=4 1282 B8R1.11 N#CC1=CNN=C1N MCULE-7948837243 [1,1,0,0,0,0|1,0,1]=4 1283 B8R1.11 NCC1=CNN=C1N MCULE-2781169576 [1,1,0,0,0,0|1,0,1]=4 1284 B8R1.11 O=CC1=C(C=NN1)Cl MCULE-4445625133 [1,1,0,0,0,0|2,0,0]=4 1285 B8R1.11 O=CC1=C(C=NN1)I MCULE-6173586190 [1,1,0,0,0,0|2,0,0]=4 1286 B8R1.11 O=CC1=C(C=NS1)Br MCULE-5757906656 [1,1,0,0,0,0|2,0,0]=4 1287 B8R1.11 O=CC1=C(N=CS1)Br MCULE-5778697877 [1,1,0,0,0,0|2,0,0]=4 1288 B8R1.11 O=CC1=C(N=CS1)Cl MCULE-2207721318 [1,1,0,0,0,0|2,0,0]=4 1289 B8R1.11 O=CC1=C(NC=N1)Br MCULE-8036679538 [1,1,0,0,0,0|2,0,0]=4 1290 B8R1.11 O=CC1=C(OC=C1)Br MCULE-2063545242 [1,1,0,0,0,0|2,0,0]=4 1291 B8R1.11 O=CC1=C(SC=C1)Br MCULE-6013911317 [1,1,0,0,0,0|2,0,0]=4 1292 B8R1.11 O=CC1=C(SC=C1)Cl MCULE-6708957327 [1,1,0,0,0,0|2,0,0]=4 1293 B8R1.11 O=CC1=C(SC=C1)I MCULE-7857037884 [1,1,0,0,0,0|2,0,0]=4 1294 B8R1.11 O=CC1=COC=C1Br MCULE-2199528244 [1,1,0,0,0,0|2,0,0]=4 1295 B8R1.11 O=CC1=CSC=C1Br MCULE-5683115437 [1,1,0,0,0,0|2,0,0]=4 1296 B8R1.11 O=CC1=CSC=C1Cl MCULE-3910471283 [1,1,0,0,0,0|2,0,0]=4 1297 B8R1.11 O=CC1=CSC=C1F MCULE-7819102302 [1,1,0,0,0,0|2,0,0]=4 1298 B8R1.11 O=CC1=NNC=C1Br MCULE-7124457612 [1,1,0,0,0,0|2,0,0]=4 1299 B8R1.38 COC(=O)C1=CCC1 MCULE-5016158090 [0,1,0,0,1,0|1,0,1]=4 1300 B10R1.13 CC(=O)C1=CC=C(N=C1)Cl MCULE-8616631911 [0,1,0,0,0,1|2,0,0]=4 1301 B10R1.13 CC(=O)C1=CC=C(N=C1)F MCULE-4342527090 [0,1,0,0,0,1|2,0,0]=4 1302 B10R1.13 CC(=O)C1=CC=C(N=C1)N MCULE-1327073980 [0,1,0,0,0,1|2,0,0]=4 1303 B10R1.13 CC(=O)C1=CC=C(N=C1)O MCULE-7168294285 [0,1,0,0,0,1|2,0,0]=4 1304 B10R1.13 CC(=O)C1=CN=C(C=C1)Br MCULE-1300244784 [0,1,0,0,0,1|2,0,0]=4 1305 B10R1.13 CC(=O)C1=CN=C(C=C1)C MCULE-1797172168 [0,1,0,0,0,1|2,0,0]=4 1306 B10R1.13 CC(=O)C1=CN=C(N=C1)C MCULE-6112254168 [0,1,0,0,0,1|1,0,1]=4 1307 B10R1.13 CC(=O)C1=CN=C(N=C1)Cl MCULE-5954250858 [0,1,0,0,0,1|1,0,1]=4 1308 B10R1.13 CC(=O)C1=CN=C(N=C1)N MCULE-7306497144 [0,1,0,0,0,1|1,0,1]=4 1309 B10R1.13 CC(=O)C1=CN=C(N=C1)O MCULE-8148199592 [0,1,0,0,0,1|1,0,1]=4 1310 B10R1.13 CC(=O)C1=NC=C(N=C1)C MCULE-7883967206 [0,1,0,0,0,1|2,0,0]=4 1311 B10R1.13 CC(=O)C1=NC=C(N=C1)Cl MCULE-7363703320 [0,1,0,0,0,1|2,0,0]=4 1312 B10R1.13 CC(=O)C1=NC=C(N=C1)F MCULE-1867498258 [0,1,0,0,0,1|2,0,0]=4 1313 B10R1.13 CC(=O)C1=NC=C(N=C1)N MCULE-6135498034 [0,1,0,0,0,1|2,0,0]=4 1314 B10R1.13 CC(=O)C1=NC=C(N=C1)O MCULE-5888329951 [0,1,0,0,0,1|2,0,0]=4 1315 B10R1.13 CC1=CC=C(C=C1)C(=O)O MCULE-2497536187 [0,1,0,0,0,1|2,0,0]=4 1316 B10R1.13 CC1=CC=C(C=N1)C(=O)Cl MCULE-2118927774 [0,1,0,0,0,1|2,0,0]=4 1317 B10R1.13 CC1=CC=C(C=N1)C(=O)Cl MCULE-4889716638 [0,1,0,0,0,1|2,0,0]=4 1318 B10R1.13 CC1=CC=C(C=N1)C(=O)O MCULE-5464563726 [0,1,0,0,0,1|1,0,0]=3 1319 B10R1.13 CC1=CCC(=CC1)C(=O)O MCULE-6201411165 [0,1,0,0,0,1|2,0,0]=4 1320 B10R1.13 CC1=CN=C(C=C1)C(=O)O MCULE-3552865301 [0,1,0,0,0,1|2,0,0]=4 1321 B10R1.13 CC1=CN=C(C=C1)C(=O)O MCULE-9478432207 [0,1,0,0,0,1|2,0,0]=4 1322 B10R1.13 CC1=CN=C(C=N1)C(=O)Cl MCULE-7427858780 [0,1,0,0,0,1|2,0,0]=4 1323 B10R1.13 CC1=NC=C(C=C1)C(=O)N MCULE-2376003868 [0,1,0,0,0,1|2,0,0]=4 1324 B10R1.13 CC1=NC=C(C=N1)C(=O)O MCULE-5025492635 [0,1,0,0,0,1|0,0,1]=3 1325 B10R1.13 CC1=NC=C(N=C1)C(=O)N MCULE-6499701604 [0,1,0,0,0,1|2,0,0]=4 1326 B10R1.13 CC1=NC=C(N=C1)C(=O)O MCULE-1352477816 [0,1,0,0,0,1|1,0,0]=3 1327 B10R1.13 CC1=NN=C(C=C1)C(=O)O MCULE-9488516286 [0,1,0,0,0,1|2,0,0]=4 1328 B10R1.13 C[N+]1=CC=C(C=C1)C(=O)O MCULE-2821947139 [0,1,0,0,0,1|1,0,1]=4 1329 B10R1.13 NC(=O)C1=CC=C(N=C1)Cl MCULE-2313068514 [0,1,0,0,0,1|2,0,0]=4 1330 B10R1.13 NC(=O)C1=CC=C(N=C1)N MCULE-4611667997 [0,1,0,0,0,1|2,0,0]=4 1331 B10R1.13 NC(=O)C1=CN=C(C=C1)Br MCULE-5220852418 [0,1,0,0,0,1|2,0,0]=4 1332 B10R1.13 NC(=O)C1=CN=C(C=C1)F MCULE-1209378017 [0,1,0,0,0,1|2,0,0]=4 1333 B10R1.13 NC(=O)C1=CN=C(N=C1)Cl MCULE-2689050889 [0,1,0,0,0,1|1,0,1]=4 1334 B10R1.13 NC(=O)C1=CN=C(N=C1)N MCULE-6411998938 [0,1,0,0,0,1|1,0,1]=4 1335 B10R1.13 NC(=O)C1=CN=C(N=C1)O MCULE-8423094001 [0,1,0,0,0,1|1,0,1]=4 1336 B10R1.13 NC(=O)C1=CNC(=O)C=C1 MCULE-8659797496 [0,1,0,0,0,1|2,0,0]=4 1337 B10R1.13 NC(=O)C1=NC=C(N=C1)Br MCULE-7641376168 [0,1,0,0,0,1|2,0,0]=4 1338 B10R1.13 NC(=O)C1=NC=C(N=C1)Cl MCULE-6745774339 [0,1,0,0,0,1|2,0,0]=4 1339 B10R1.13 NC(=O)C1=NC=C(N=C1)N MCULE-6030490811 [0,1,0,0,0,1|2,0,0]=4 1340 B10R1.13 NC(=O)C1=NC=C(N=C1)O MCULE-5701401922 [0,1,0,0,0,1|2,0,0]=4 1341 B10R1.13 NC1=CC=C(C=C1)C(=O)O MCULE-1312588393 [0,1,0,0,0,1|2,0,0]=4 1342 B10R1.13 NC1=CC=C(C=C1)C(=O)O MCULE-3535374816 [0,1,0,0,0,1|2,0,0]=4 1343 B10R1.13 NC1=CC=C(C=N1)C(=O)Cl MCULE-1419590685 [0,1,0,0,0,1|2,0,0]=4 1344 B10R1.13 NC1=CN=C(C=C1)C(=O)O MCULE-3661537145 [0,1,0,0,0,1|2,0,0]=4 1345 B10R1.13 NC1=CN=C(C=C1)C(=O)O MCULE-4737233687 [0,1,0,0,0,1|2,0,0]=4 1346 B10R1.13 NC1=CN=C(C=N1)C(=O)O MCULE-3348804227 [0,1,0,0,0,1|1,0,0]=3 1347 B10R1.13 NC1=NC=C(C=C1)C(=O)O MCULE-7790559176 [0,1,0,0,0,1|1,0,0]=3 1348 B10R1.13 NC1=NC=C(C=C1)C(=O)O MCULE-9531923741 [0,1,0,0,0,1|1,0,0]=3 1349 B10R1.13 NC1=NC=C(C=N1)C(=O)O MCULE-9108053340 [0,1,0,0,0,1|0,0,1]=3 1350 B10R1.13 NC1=NN=C(C=C1)C(=O)O MCULE-8056644881 [0,1,0,0,0,1|2,0,0]=4 1351 B10R1.13 O=C(Cl)C1=CC=C(N=C1)Br MCULE-2730722568 [0,1,0,0,0,1|2,0,0]=4 1352 B10R1.13 O=C(Cl)C1=CC=C(N=C1)Cl MCULE-4922625551 [0,1,0,0,0,1|2,0,0]=4 1353 B10R1.13 O=C(Cl)C1=CC=C(N=C1)F MCULE-1864540565 [0,1,0,0,0,1|2,0,0]=4 1354 B10R1.13 O=C(Cl)C1=CN=C(N=C1)Cl MCULE-5643465976 [0,1,0,0,0,1|1,0,1]=4 1355 B10R1.13 O=C(Cl)C1=NC=C(N=C1)Cl MCULE-6806073185 [0,1,0,0,0,1|2,0,0]=4 1356 B10R1.13 O=C(O)C1=CC=C(C=C1)Br MCULE-8812168827 [0,1,0,0,0,1|2,0,0]=4 1357 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl MCULE-2882010588 [0,1,0,0,0,1|2,0,0]=4 1358 B10R1.13 O=C(O)C1=CC=C(C=C1)F MCULE-8450862504 [0,1,0,0,0,1|2,0,0]=4 1359 B10R1.13 O=C(O)C1=CC=C(C=C1)I MCULE-5643610100 [0,1,0,0,0,1|2,0,0]=4 1360 B10R1.13 O=C(O)C1=CC=C(C=C1)O MCULE-1367764897 [0,1,0,0,0,1|2,0,0]=4 1361 B10R1.13 O=C(O)C1=CC=C(C=C1)S MCULE-9342507054 [0,1,0,0,0,1|2,0,0]=4 1362 B10R1.13 O=C(O)C1=CC=C(C=N1)O MCULE-4924797784 [0,1,0,0,0,1|2,0,0]=4 1363 B10R1.13 O=C(O)C1=CC=C(N=C1)Cl MCULE-2921354079 [0,1,0,0,0,1|1,0,0]=3 1364 B10R1.13 O=C(O)C1=CC=C(N=C1)O MCULE-8547168855 [0,1,0,0,0,1|1,0,0]=3 1365 B10R1.13 O=C(O)C1=CC=N(=O)C=C1 MCULE-6664353188 [0,1,0,0,0,1|1,0,1]=4 1366 B10R1.13 O=C(O)C1=CN=C(C=C1)Br MCULE-7251747001 [0,1,0,0,0,1|1,0,0]=3 1367 B10R1.13 O=C(O)C1=CN=C(C=C1)F MCULE-2050221449 [0,1,0,0,0,1|1,0,0]=3 1368 B10R1.13 O=C(O)C1=CN=C(C=C1)I MCULE-7670666785 [0,1,0,0,0,1|1,0,0]=3 1369 B10R1.13 O=C(O)C1=CN=C(C=C1)S MCULE-9782817249 [0,1,0,0,0,1|1,0,0]=3 1370 B10R1.13 O=C(O)C1=CN=C(N=C1)Br MCULE-3112211117 [0,1,0,0,0,1|0,0,1]=3 1371 B10R1.13 O=C(O)C1=CN=C(N=C1)Cl MCULE-4142147028 [0,1,0,0,0,1|0,0,1]=3 1372 B10R1.13 O=C(O)C1=CN=C(N=C1)O MCULE-1192882734 [0,1,0,0,0,1|0,0,1]=3 1373 B10R1.13 O=C(O)C1=NC=C(C=C1)Br MCULE-6501819231 [0,1,0,0,0,1|2,0,0]=4 1374 B10R1.13 O=C(O)C1=NC=C(C=C1)Cl MCULE-8875788252 [0,1,0,0,0,1|2,0,0]=4 1375 B10R1.13 O=C(O)C1=NC=C(C=C1)F MCULE-2128607104 [0,1,0,0,0,1|2,0,0]=4 1376 B10R1.13 O=C(O)C1=NC=C(C=C1)F MCULE-2798554650 [0,1,0,0,0,1|2,0,0]=4 1377 B10R1.13 O=C(O)C1=NC=C(C=C1)I MCULE-1702439933 [0,1,0,0,0,1|2,0,0]=4 1378 B10R1.13 O=C(O)C1=NC=C(C=C1)O MCULE-4623282930 [0,1,0,0,0,1|2,0,0]=4 1379 B10R1.13 O=C(O)C1=NC=C(N=C1)Br MCULE-6640664942 [0,1,0,0,0,1|1,0,0]=3 1380 B10R1.13 O=C(O)C1=NC=C(N=C1)Cl MCULE-7557393353 [0,1,0,0,0,1|1,0,0]=3 1381 B10R1.13 O=C(O)C1=NC=C(N=C1)F MCULE-1506250194 [0,1,0,0,0,1|1,0,0]=3 1382 B10R1.13 O=C(O)C1=NC=C(N=C1)O MCULE-1775479402 [0,1,0,0,0,1|1,0,0]=3 1383 B10R1.13 O=C(O)C1=NN=C(C=C1)Br MCULE-4066821298 [0,1,0,0,0,1|2,0,0]=4 1384 B10R1.13 O=C(O)C1=NN=C(C=C1)Cl MCULE-3752151178 [0,1,0,0,0,1|2,0,0]=4 1385 B10R1.13 O=C(O)C1=NN=C(C=C1)O MCULE-1876021170 [0,1,0,0,0,1|2,0,0]=4 1386 B10R1.13 O=C([O-])C1=CC=C(N=C1)[S-] MCULE-2713735125 [0,1,0,0,0,1|1,0,1]=4 1387 B10R1.13 O=C1C=CC(=CO1)C(=O)O MCULE-9279858523 [0,1,0,0,0,1|2,0,0]=4 1388 B10R1.13 O=C1C=CC(=NN1)C(=O)O MCULE-4975386160 [0,1,0,0,0,1|2,0,0]=4 1389 B10R1.13 O=C1C=NC(=CN1)C(=O)[O-] MCULE-8258719328 [0,1,0,0,0,1|1,0,1]=4 1390 B10R1.13 O=C1CC=C(N=N1)C(=O)O MCULE-8930674606 [0,1,0,0,0,1|2,0,0]=4 1391 B10R1.13 O=C1N=CC(=CN1)N(=O)=O MCULE-5053459294 [0,1,0,0,0,1|1,0,1]=4 1392 B10R1.13 O=S(O)C1=CN=C(C=C1)Cl MCULE-1021900660 [0,1,0,0,0,1|2,0,0]=4 1393 B10R1.15 C/C(=N/O)/C1=CC=CN=C1 MCULE-2834975639 [0,1,0,0,0,1|2,0,0]=4 1394 B10R1.15 C/C(=N/O)/C1=CC=NC=C1 MCULE-1211916135 [0,1,0,0,0,1|2,0,0]=4 1395 B10R1.15 C/C(=N\O)/C1=CC=NC=C1 MCULE-9884602146 [0,1,0,0,0,1|2,0,0]=4 1396 B10R1.15 C/C(=N\O)/C1=CN=CC=C1 MCULE-4316575109 [0,1,0,0,0,1|2,0,0]=4 1397 B10R1.15 CC(=NO)C1=CC=NC=C1 MCULE-2779687355 [0,1,0,0,0,1|2,0,0]=4 1398 B10R1.15 CC(=NO)C1=CN=CC=C1 MCULE-9602969569 [0,1,0,0,0,1|2,0,0]=4 1399 B10R1.15 CC(=NO)C1=CN=CC=N1 MCULE-5567495963 [0,1,0,0,0,1|2,0,0]=4 1400 B10R1.15 CCC(=O)C1=CC=CN=C1 MCULE-4357281643 [0,1,0,0,0,1|2,0,0]=4 1401 B10R1.15 CCC(=O)C1=CC=NC=C1 MCULE-9952804021 [0,1,0,0,0,1|2,0,0]=4 1402 B10R1.15 CCC(=O)C1=CN=CN=C1 MCULE-2477557744 [0,1,0,0,0,1|1,0,1]=4 1403 B10R1.15 CCC(=O)C1=NC=CN=C1 MCULE-2579038199 [0,1,0,0,0,1|2,0,0]=4 1404 B10R1.15 CNC(=O)C1=CC=CN=C1 MCULE-1306605084 [0,1,0,0,0,1|2,0,0]=4 1405 B10R1.15 CNC(=O)C1=CC=NC=C1 MCULE-8766926434 [0,1,0,0,0,1|2,0,0]=4 1406 B10R1.15 CNC(=O)C1=NC=CN=C1 MCULE-1205626974 [0,1,0,0,0,1|2,0,0]=4 1407 B10R1.15 COC(=N)C1=CC=NC=C1 MCULE-3059280457 [0,1,0,0,0,1|2,0,0]=4 1408 B10R1.15 COC(=N)C1=CN=CC=C1 MCULE-2192434486 [0,1,0,0,0,1|2,0,0]=4 1409 B10R1.15 COC(=N)C1=CN=CN=C1 MCULE-5105576031 [0,1,0,0,0,1|1,0,1]=4 1410 B10R1.15 COC(=N)C1=NC=CN=C1 MCULE-7404891317 [0,1,0,0,0,1|2,0,0]=4 1411 B10R1.15 COC(=N)C1=NC=CN=C1 MCULE-8178321183 [0,1,0,0,0,1|2,0,0]=4 1412 B10R1.15 COC(=O)C1=CC=CC=C1 MCULE-3681534655 [0,1,0,0,0,1|2,0,0]=4 1413 B10R1.15 COC(=O)C1=CC=NC=C1 MCULE-1637182584 [0,1,0,0,0,1|1,0,0]=3 1414 B10R1.15 COC(=O)C1=CC=NC=C1 MCULE-7248854376 [0,1,0,0,0,1|1,0,0]=3 1415 B10R1.15 COC(=O)C1=CC=NC=N1 MCULE-4726932553 [0,1,0,0,0,1|1,0,0]=3 1416 B10R1.15 COC(=O)C1=CCCNC1 MCULE-4220762988 [0,1,0,0,0,1|1,0,1]=4 1417 B10R1.15 COC(=O)C1=CCCNC1 MCULE-8178236584 [0,1,0,0,0,1|1,0,1]=4 1418 B10R1.15 COC(=O)C1=CCCNC1 MCULE-9139351406 [0,1,0,0,0,1|1,0,1]=4 1419 B10R1.15 COC(=O)C1=CCNCC1 MCULE-3308640134 [0,1,0,0,0,1|1,0,1]=4 1420 B10R1.15 COC(=O)C1=CCNCC1 MCULE-5623631465 [0,1,0,0,0,1|1,0,1]=4 1421 B10R1.15 COC(=O)C1=CN=CC=C1 MCULE-2161067131 [0,1,0,0,0,1|1,0,0]=3 1422 B10R1.15 COC(=O)C1=CN=CN=C1 MCULE-7475095097 [0,1,0,0,0,1|0,0,1]=3 1423 B10R1.15 COC(=O)C1=CN=NC=C1 MCULE-3869479906 [0,1,0,0,0,1|0,0,1]=3 1424 B10R1.15 COC(=O)C1=CN=NN=C1 MCULE-1196083367 [0,1,0,0,0,1|0,0,1]=3 1425 B10R1.15 COC(=O)C1=CNCCC1 MCULE-5565494663 [0,1,0,0,0,1|1,0,1]=4 1426 B10R1.15 COC(=O)C1=NC=CC=C1 MCULE-3218797617 [0,1,0,0,0,1|2,0,0]=4 1427 B10R1.15 COC(=O)C1=NC=CN=C1 MCULE-4197149171 [0,1,0,0,0,1|1,0,0]=3 1428 B10R1.15 COC(=O)C1=NN=CC=C1 MCULE-5311967260 [0,1,0,0,0,1|2,0,0]=4 1429 B10R1.15 N/C(=N\O)/C1=CC=NC=C1 MCULE-5685174015 [0,1,0,0,0,1|2,0,0]=4 1430 B10R1.15 N/C(=N\O)/C1=CC=NC=N1 MCULE-3408948365 [0,1,0,0,0,1|2,0,0]=4 1431 B10R1.15 N/C(=N\O)/C1=CN=CC=C1 MCULE-7139275901 [0,1,0,0,0,1|2,0,0]=4 1432 B10R1.15 N/C(=N\O)/C1=NC=CN=C1 MCULE-9539048286 [0,1,0,0,0,1|2,0,0]=4 1433 B10R1.15 N=C(NO)C1=CN=CN=C1 MCULE-4289816067 [0,1,0,0,0,1|1,0,1]=4 1434 B10R1.15 NCC(=O)C1=CC=CN=C1 MCULE-4232573211 [0,1,0,0,0,1|2,0,0]=4 1435 B10R1.15 NCC(=O)C1=CC=CN=C1 MCULE-4592437397 [0,1,0,0,0,1|2,0,0]=4 1436 B10R1.15 NCC(=O)C1=CC=CN=C1 MCULE-5920625773 [0,1,0,0,0,1|2,0,0]=4 1437 B10R1.15 NCC(=O)C1=CC=NC=C1 MCULE-4668841223 [0,1,0,0,0,1|2,0,0]=4 1438 B10R1.15 NCC(=O)C1=CC=NC=C1 MCULE-8768974693 [0,1,0,0,0,1|2,0,0]=4 1439 B10R1.15 NNC(=O)C1=CC=NC=C1 MCULE-6324947959 [0,1,0,0,0,1|2,0,0]=4 1440 B10R1.15 NNC(=O)C1=CC=NC=N1 MCULE-1780001845 [0,1,0,0,0,1|2,0,0]=4 1441 B10R1.15 NNC(=O)C1=CN=CC=C1 MCULE-1871418352 [0,1,0,0,0,1|2,0,0]=4 1442 B10R1.15 NNC(=O)C1=CN=CC=C1 MCULE-2005077256 [0,1,0,0,0,1|2,0,0]=4 1443 B10R1.15 NNC(=O)C1=CN=CN=C1 MCULE-3858256320 [0,1,0,0,0,1|1,0,1]=4 1444 B10R1.15 NNC(=O)C1=NC=CN=C1 MCULE-6210518290 [0,1,0,0,0,1|2,0,0]=4 1445 B10R1.15 NOC(=O)C1=CC=CC=C1 MCULE-6181192543 [0,1,0,0,0,1|2,0,0]=4 1446 B10R1.15 O=C(CBr)C1=CC=CN=C1 MCULE-1756857236 [0,1,0,0,0,1|2,0,0]=4 1447 B10R1.15 O=C(CBr)C1=CC=CN=C1 MCULE-4278270608 [0,1,0,0,0,1|2,0,0]=4 1448 B10R1.15 O=C(CBr)C1=CC=NC=C1 MCULE-1783496003 [0,1,0,0,0,1|2,0,0]=4 1449 B10R1.15 O=C(CBr)C1=CC=NC=C1 MCULE-2166516556 [0,1,0,0,0,1|2,0,0]=4 1450 B10R1.15 O=C(CBr)C1=CN=CN=C1 MCULE-1900140011 [0,1,0,0,0,1|1,0,1]=4 1451 B10R1.15 O=C(CBr)C1=CN=CN=C1 MCULE-3013773716 [0,1,0,0,0,1|1,0,1]=4 1452 B10R1.15 O=C(CBr)C1=NC=CN=C1 MCULE-4502418070 [0,1,0,0,0,1|2,0,0]=4 1453 B10R1.15 O=C(CBr)C1=NC=CN=C1 MCULE-6393940368 [0,1,0,0,0,1|2,0,0]=4 1454 B10R1.15 O=C(CBr)C1=NC=NC=C1 MCULE-2391450319 [0,1,0,0,0,1|2,0,0]=4 1455 B10R1.15 O=C(CBr)C1=NC=NC=C1 MCULE-4257447517 [0,1,0,0,0,1|2,0,0]=4 1456 B10R1.15 O=C(CCl)C1=CC=CN=C1 MCULE-1696097492 [0,1,0,0,0,1|2,0,0]=4 1457 B10R1.15 O=C(CCl)C1=CC=CN=C1 MCULE-3348827882 [0,1,0,0,0,1|2,0,0]=4 1458 B10R1.15 O=C(CCl)C1=CC=NC=C1 MCULE-1177201893 [0,1,0,0,0,1|2,0,0]=4 1459 B10R1.15 O=C(CCl)C1=CC=NC=C1 MCULE-6903837932 [0,1,0,0,0,1|2,0,0]=4 1460 B10R1.15 O=C(CCl)C1=NC=CN=C1 MCULE-3175751331 [0,1,0,0,0,1|2,0,0]=4 1461 B10R1.15 O=C(CO)C1=CC=CC=C1 MCULE-8152973932 [0,1,0,0,0,1|2,0,0]=4 1462 B10R1.15 O=C(CO)C1=CC=CN=C1 MCULE-5877498750 [0,1,0,0,0,1|1,0,0]=3 1463 B10R1.15 O=C(CO)C1=CC=NC=C1 MCULE-5255216626 [0,1,0,0,0,1|1,0,0]=3 1464 B10R1.15 O=C(CO)C1=NC=CC=C1 MCULE-6303984441 [0,1,0,0,0,1|2,0,0]=4 1465 B10R1.15 O=C(NCl)C1=CC=NC=C1 MCULE-4103261221 [0,1,0,0,0,1|2,0,0]=4 1466 B10R1.15 O=C(NO)C1=CC=CC=C1 MCULE-6084710046 [0,1,0,0,0,1|2,0,0]=4 1467 B10R1.15 O=C(NO)C1=CC=CN=C1 MCULE-9554510543 [0,1,0,0,0,1|1,0,0]=3 1468 B10R1.15 O=C(NO)C1=CC=NC=C1 MCULE-6355368198 [0,1,0,0,0,1|1,0,0]=3 1469 B10R1.28 O=P(O)(O)C1=CC=NC=C1 MCULE-2730302493 [0,1,0,0,0,1|2,0,0]=4 1470 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 MCULE-8484617638 [0,1,0,0,0,1|2,0,0]=4 1471 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 MCULE-5983426278 [0,1,0,0,0,1|2,0,0]=4 1472 B10R1.28 O=S(=O)(O)C1=NC=CN=C1 MCULE-7633709528 [0,1,0,0,0,1|2,0,0]=4 1473 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1786007668 [0,1,0,0,0,1|2,0,0]=4 1474 B10R1.61 CC(=O)C1=C(C=CN=C1)C MCULE-1864551259 [0,1,0,0,0,1|2,0,0]=4 1475 B10R1.61 CC(=O)C1=C(C=CN=C1)Cl MCULE-1860885201 [0,1,0,0,0,1|2,0,0]=4 1476 B10R1.61 CC(=O)C1=C(C=CN=C1)Cl MCULE-4326251229 [0,1,0,0,0,1|2,0,0]=4 1477 B10R1.61 CC(=O)C1=C(C=CN=C1)F MCULE-2356957788 [0,1,0,0,0,1|2,0,0]=4 1478 B10R1.61 CC(=O)C1=C(C=CN=C1)N MCULE-5759723657 [0,1,0,0,0,1|2,0,0]=4 1479 B10R1.61 CC(=O)C1=C(C=CN=C1)O MCULE-2666165855 [0,1,0,0,0,1|2,0,0]=4 1480 B10R1.61 CC(=O)C1=C(C=NC=C1)Br MCULE-6626151846 [0,1,0,0,0,1|2,0,0]=4 1481 B10R1.61 CC(=O)C1=C(C=NC=C1)C MCULE-5320077243 [0,1,0,0,0,1|2,0,0]=4 1482 B10R1.61 CC(=O)C1=C(C=NC=C1)Cl MCULE-3091099587 [0,1,0,0,0,1|2,0,0]=4 1483 B10R1.61 CC(=O)C1=C(C=NC=C1)F MCULE-7778949077 [0,1,0,0,0,1|2,0,0]=4 1484 B10R1.61 CC(=O)C1=C(C=NC=C1)N MCULE-1200285505 [0,1,0,0,0,1|2,0,0]=4 1485 B10R1.61 CC(=O)C1=C(C=NC=C1)N MCULE-6637347706 [0,1,0,0,0,1|2,0,0]=4 1486 B10R1.61 CC(=O)C1=C(C=NC=C1)O MCULE-9732792007 [0,1,0,0,0,1|2,0,0]=4 1487 B10R1.61 CC(=O)C1=C(C=NC=N1)C MCULE-2229384012 [0,1,0,0,0,1|2,0,0]=4 1488 B10R1.61 CC(=O)C1=C(N=CC=C1)Cl MCULE-8683539263 [0,1,0,0,0,1|2,0,0]=4 1489 B10R1.61 CC(=O)C1=C(N=CC=C1)N MCULE-3588289826 [0,1,0,0,0,1|2,0,0]=4 1490 B10R1.61 CC(=O)C1=C(N=CC=N1)C MCULE-8161935606 [0,1,0,0,0,1|2,0,0]=4 1491 B10R1.61 CC(=O)C1=C(N=CC=N1)Cl MCULE-5629715037 [0,1,0,0,0,1|2,0,0]=4 1492 B10R1.61 CC(=O)C1=CC=CN=C1Br MCULE-7197475093 [0,1,0,0,0,1|2,0,0]=4 1493 B10R1.61 CC(=O)C1=CC=CN=C1C MCULE-6054213950 [0,1,0,0,0,1|2,0,0]=4 1494 B10R1.61 CC(=O)C1=CC=CN=C1F MCULE-5772803066 [0,1,0,0,0,1|2,0,0]=4 1495 B10R1.61 CC(=O)C1=CC=CNC1=O MCULE-8332051237 [0,1,0,0,0,1|2,0,0]=4 1496 B10R1.61 CC(=O)C1=CN=CN=C1C MCULE-6235367249 [0,1,0,0,0,1|1,0,1]=4 1497 B10R1.61 CC(=O)C1=CN=CN=C1Cl MCULE-1111940644 [0,1,0,0,0,1|1,0,1]=4 1498 B10R1.61 CC(=O)C1=CN=CN=C1N MCULE-9746066690 [0,1,0,0,0,1|1,0,1]=4 1499 B10R1.61 CC(=O)C1=NC=CN=C1N MCULE-4955312625 [0,1,0,0,0,1|2,0,0]=4 1500 B10R1.61 CC(=O)C1=NC=NC=C1Br MCULE-2989754478 [0,1,0,0,0,1|2,0,0]=4 1501 B10R1.61 CC1=C(C=CC=C1)C(=O)O MCULE-8662697935 [0,1,0,0,0,1|2,0,0]=4 1502 B10R1.61 CC1=C(C=CC=N1)C(=O)N MCULE-6050643158 [0,1,0,0,0,1|2,0,0]=4 1503 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1358504120 [0,1,0,0,0,1|1,0,0]=3 1504 B10R1.61 CC1=C(C=CC=N1)C(=O)O MCULE-1760335656 [0,1,0,0,0,1|1,0,0]=3 1505 B10R1.61 CC1=C(C=CN=C1)C(=O)O MCULE-4068777983 [0,1,0,0,0,1|1,0,0]=3 1506 B10R1.61 CC1=C(C=CN=C1)C(=O)O MCULE-4098532555 [0,1,0,0,0,1|1,0,0]=3 1507 B10R1.61 CC1=C(C=CN=C1)S(=O)O MCULE-7276775695 [0,1,0,0,0,1|2,0,0]=4 1508 B10R1.61 CC1=C(C=CN=N1)C(=O)O MCULE-8713969384 [0,1,0,0,0,1|0,0,1]=3 1509 B10R1.61 CC1=C(C=NC=C1)C(=O)Cl MCULE-9862174877 [0,1,0,0,0,1|2,0,0]=4 1510 B10R1.61 CC1=C(C=NC=C1)C(=O)N MCULE-2817608526 [0,1,0,0,0,1|2,0,0]=4 1511 B10R1.61 CC1=C(C=NC=C1)C(=O)O MCULE-3830443009 [0,1,0,0,0,1|1,0,0]=3 1512 B10R1.61 CC1=C(C=NC=N1)C(=O)O MCULE-3074138717 [0,1,0,0,0,1|0,0,1]=3 1513 B10R1.61 CC1=C(C=NN=C1)C(=O)O MCULE-3697066998 [0,1,0,0,0,1|0,0,1]=3 1514 B10R1.61 CC1=C(N=CC=C1)C(=O)O MCULE-8081940811 [0,1,0,0,0,1|2,0,0]=4 1515 B10R1.61 CC1=C(N=CC=N1)C(=O)O MCULE-3068762074 [0,1,0,0,0,1|1,0,0]=3 1516 B10R1.61 CC1=CC=CN=C1C(=O)O MCULE-6679892229 [0,1,0,0,0,1|2,0,0]=4 1517 B10R1.61 CC1=CC=NC=C1C(=O)O MCULE-2967865061 [0,1,0,0,0,1|1,0,0]=3 1518 B10R1.61 CC1=CC=NN=C1C(=O)O MCULE-6501091471 [0,1,0,0,0,1|2,0,0]=4 1519 B10R1.61 CC1=CN=CC=C1C(=O)N MCULE-5659093153 [0,1,0,0,0,1|2,0,0]=4 1520 B10R1.61 CC1=CN=CN=C1C(=O)O MCULE-3791670846 [0,1,0,0,0,1|1,0,0]=3 1521 B10R1.61 CC1=NC=CC=C1C(=O)Cl MCULE-5422613457 [0,1,0,0,0,1|2,0,0]=4 1522 B10R1.61 CC1=NC=CN=C1C(=O)N MCULE-1199994902 [0,1,0,0,0,1|2,0,0]=4 1523 B10R1.61 C[N+]1=C(C=CC=C1)C(=O)O MCULE-9509911443 [0,1,0,0,0,1|2,0,0]=4 1524 B10R1.61 NC(=O)C1=C(C=CN=C1)Cl MCULE-9875444719 [0,1,0,0,0,1|2,0,0]=4 1525 B10R1.61 NC(=O)C1=C(C=CN=C1)N MCULE-1402743622 [0,1,0,0,0,1|2,0,0]=4 1526 B10R1.61 NC(=O)C1=C(C=CN=C1)N MCULE-9586218080 [0,1,0,0,0,1|2,0,0]=4 1527 B10R1.61 NC(=O)C1=C(C=CN=C1)O MCULE-3805082690 [0,1,0,0,0,1|2,0,0]=4 1528 B10R1.61 NC(=O)C1=C(C=NC=C1)Br MCULE-9821398899 [0,1,0,0,0,1|2,0,0]=4 1529 B10R1.61 NC(=O)C1=C(C=NC=C1)Cl MCULE-4690728646 [0,1,0,0,0,1|2,0,0]=4 1530 B10R1.61 NC(=O)C1=C(C=NC=C1)F MCULE-3139012118 [0,1,0,0,0,1|2,0,0]=4 1531 B10R1.61 NC(=O)C1=C(C=NC=C1)N MCULE-7319689697 [0,1,0,0,0,1|2,0,0]=4 1532 B10R1.61 NC(=O)C1=C(N=CC=C1)Br MCULE-5384308853 [0,1,0,0,0,1|2,0,0]=4 1533 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl MCULE-4022706398 [0,1,0,0,0,1|2,0,0]=4 1534 B10R1.61 NC(=O)C1=C(N=CC=C1)N MCULE-1431156151 [0,1,0,0,0,1|2,0,0]=4 1535 B10R1.61 NC(=O)C1=C(N=CC=C1)S MCULE-9849545949 [0,1,0,0,0,1|2,0,0]=4 1536 B10R1.61 NC(=O)C1=C(N=CN=C1)N MCULE-2298654764 [0,1,0,0,0,1|1,0,1]=4 1537 B10R1.61 NC(=O)C1=CC=CN=C1F MCULE-8064629807 [0,1,0,0,0,1|2,0,0]=4 1538 B10R1.61 NC(=O)C1=CC=CNC1=O MCULE-5159050018 [0,1,0,0,0,1|2,0,0]=4 1539 B10R1.61 NC(=O)C1=CC=NC=C1O MCULE-4727285160 [0,1,0,0,0,1|2,0,0]=4 1540 B10R1.61 NC(=O)C1=CC=NNC1=O MCULE-1282159099 [0,1,0,0,0,1|1,0,0]=3 1541 B10R1.61 NC(=O)C1=CN=CC=C1F MCULE-1603494017 [0,1,0,0,0,1|2,0,0]=4 1542 B10R1.61 NC(=O)C1=CNC=NC1=O MCULE-7799177075 [0,1,0,0,0,1|1,0,0]=3 1543 B10R1.61 NC(=O)C1=NC=CN=C1Br MCULE-4070490041 [0,1,0,0,0,1|2,0,0]=4 1544 B10R1.61 NC(=O)C1=NC=CN=C1Cl MCULE-2272428763 [0,1,0,0,0,1|2,0,0]=4 1545 B10R1.61 NC(=O)C1=NC=CN=C1N MCULE-6860982001 [0,1,0,0,0,1|2,0,0]=4 1546 B10R1.61 NC(=O)C1=NC=CN=C1O MCULE-7149774620 [0,1,0,0,0,1|2,0,0]=4 1547 B10R1.61 NC(=O)C1=NC=CN=C1[O-] MCULE-3503709642 [0,1,0,0,0,1|2,0,0]=4 1548 B10R1.61 NC(=O)C1=NC=NC=C1Br MCULE-1156916190 [0,1,0,0,0,1|2,0,0]=4 1549 B10R1.61 NC1=C(C=CC=C1)C(=O)O MCULE-8970106555 [0,1,0,0,0,1|2,0,0]=4 1550 B10R1.61 NC1=C(C=CN=N1)C(=O)O MCULE-4311909541 [0,1,0,0,0,1|0,0,1]=3 1551 B10R1.61 NC1=C(C=NC=C1)C(=O)O MCULE-3652592206 [0,1,0,0,0,1|1,0,0]=3 1552 B10R1.61 NC1=C(C=NC=C1)C(=O)O MCULE-7276846664 [0,1,0,0,0,1|1,0,0]=3 1553 B10R1.61 NC1=C(C=NC=N1)C(=O)O MCULE-9960106839 [0,1,0,0,0,1|0,0,1]=3 1554 B10R1.61 NC1=C(C=NN=C1)C(=O)O MCULE-3721350904 [0,1,0,0,0,1|0,0,1]=3 1555 B10R1.61 NC1=C(N=CC=N1)C(=O)O MCULE-3463289297 [0,1,0,0,0,1|1,0,0]=3 1556 B10R1.61 NC1=C(N=CN=N1)C(=O)O MCULE-7728947492 [0,1,0,0,0,1|0,0,1]=3 1557 B10R1.61 NC1=CC=CN=C1C(=O)O MCULE-2356810587 [0,1,0,0,0,1|2,0,0]=4 1558 B10R1.61 NC1=CC=CN=C1C(=O)O MCULE-9991303306 [0,1,0,0,0,1|2,0,0]=4 1559 B10R1.61 NC1=CC=NN=C1C(=O)O MCULE-6542067746 [0,1,0,0,0,1|2,0,0]=4 1560 B10R1.61 NC1=CC=NN=C1C(=O)O MCULE-8539591838 [0,1,0,0,0,1|2,0,0]=4 1561 B10R1.61 NC1=CN=CC=C1C(=O)O MCULE-9282322392 [0,1,0,0,0,1|1,0,0]=3 1562 B10R1.61 NC1=CN=CN=C1C(=O)O MCULE-2578476872 [0,1,0,0,0,1|1,0,0]=3 1563 B10R1.61 NC1=NC=CC=C1C(=O)Cl MCULE-3679071580 [0,1,0,0,0,1|2,0,0]=4 1564 B10R1.61 NC1=NC=CC=C1C(=O)O MCULE-3175833110 [0,1,0,0,0,1|1,0,0]=3 1565 B10R1.61 O=C(Cl)C1=C(C=NC=C1)Br MCULE-7149989875 [0,1,0,0,0,1|2,0,0]=4 1566 B10R1.61 O=C(Cl)C1=C(C=NC=C1)F MCULE-6589738945 [0,1,0,0,0,1|2,0,0]=4 1567 B10R1.61 O=C(Cl)C1=CC=CN=C1Br MCULE-5088816790 [0,1,0,0,0,1|2,0,0]=4 1568 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl MCULE-5603349813 [0,1,0,0,0,1|2,0,0]=4 1569 B10R1.61 O=C(Cl)C1=CC=CN=C1F MCULE-4604425450 [0,1,0,0,0,1|2,0,0]=4 1570 B10R1.61 O=C(Cl)C1=CC=CN=C1S MCULE-1062479064 [0,1,0,0,0,1|2,0,0]=4 1571 B10R1.61 O=C(Cl)C1=CC=NC=C1Cl MCULE-1395231155 [0,1,0,0,0,1|2,0,0]=4 1572 B10R1.61 O=C(Cl)C1=CN=CC=C1Cl MCULE-1937945145 [0,1,0,0,0,1|2,0,0]=4 1573 B10R1.61 O=C(Cl)C1=NC=CN=C1Cl MCULE-3868837151 [0,1,0,0,0,1|2,0,0]=4 1574 B10R1.61 O=C(Cl)C1=NC=CN=C1O MCULE-6753341779 [0,1,0,0,0,1|2,0,0]=4 1575 B10R1.61 O=C(O)C1=C(C=CC=C1)Br MCULE-3239222085 [0,1,0,0,0,1|2,0,0]=4 1576 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl MCULE-1696137032 [0,1,0,0,0,1|2,0,0]=4 1577 B10R1.61 O=C(O)C1=C(C=CC=C1)O MCULE-4238157211 [0,1,0,0,0,1|2,0,0]=4 1578 B10R1.61 O=C(O)C1=C(C=CC=C1)S MCULE-8297385152 [0,1,0,0,0,1|2,0,0]=4 1579 B10R1.61 O=C(O)C1=C(C=CC=N1)Br MCULE-4344174693 [0,1,0,0,0,1|2,0,0]=4 1580 B10R1.61 O=C(O)C1=C(C=CC=N1)I MCULE-3545834696 [0,1,0,0,0,1|2,0,0]=4 1581 B10R1.61 O=C(O)C1=C(C=CC=N1)O MCULE-7115836080 [0,1,0,0,0,1|2,0,0]=4 1582 B10R1.61 O=C(O)C1=C(C=CC=N1)S MCULE-4203077129 [0,1,0,0,0,1|2,0,0]=4 1583 B10R1.61 O=C(O)C1=C(C=CN=C1)Br MCULE-1594185108 [0,1,0,0,0,1|1,0,0]=3 1584 B10R1.61 O=C(O)C1=C(C=CN=C1)Cl MCULE-2513513305 [0,1,0,0,0,1|1,0,0]=3 1585 B10R1.61 O=C(O)C1=C(C=CN=C1)F MCULE-5137747992 [0,1,0,0,0,1|1,0,0]=3 1586 B10R1.61 O=C(O)C1=C(C=CN=C1)O MCULE-9587370315 [0,1,0,0,0,1|1,0,0]=3 1587 B10R1.61 O=C(O)C1=C(C=NC=C1)Cl MCULE-2538567621 [0,1,0,0,0,1|1,0,0]=3 1588 B10R1.61 O=C(O)C1=C(C=NC=C1)F MCULE-4354141649 [0,1,0,0,0,1|1,0,0]=3 1589 B10R1.61 O=C(O)C1=C(C=NC=C1)I MCULE-5814291278 [0,1,0,0,0,1|1,0,0]=3 1590 B10R1.61 O=C(O)C1=C(C=NC=C1)O MCULE-6913534695 [0,1,0,0,0,1|1,0,0]=3 1591 B10R1.61 O=C(O)C1=C(C=NC=N1)Cl MCULE-4284259761 [0,1,0,0,0,1|1,0,0]=3 1592 B10R1.61 O=C(O)C1=C(C=NC=N1)F MCULE-2197612040 [0,1,0,0,0,1|1,0,0]=3 1593 B10R1.61 O=C(O)C1=C(C=NN=C1)Br MCULE-5717059044 [0,1,0,0,0,1|0,0,1]=3 1594 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-5950030289 [0,1,0,0,0,1|1,0,1]=4 1595 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-7466992226 [0,1,0,0,0,1|1,0,1]=4 1596 B10R1.61 O=C(O)C1=C(N=CC=C1)Cl MCULE-9186493058 [0,1,0,0,0,1|1,0,0]=3 1597 B10R1.61 O=C(O)C1=C(N=CC=C1)I MCULE-4031419128 [0,1,0,0,0,1|1,0,0]=3 1598 B10R1.61 O=C(O)C1=C(N=CC=N1)S MCULE-7646133165 [0,1,0,0,0,1|1,0,0]=3 1599 B10R1.61 O=C(O)C1=C(N=NC=C1)Cl MCULE-1589091595 [0,1,0,0,0,1|0,0,1]=3 1600 B10R1.61 O=C(O)C1=C(N=NC=C1)S MCULE-3462080597 [0,1,0,0,0,1|0,0,1]=3 1601 B10R1.61 O=C(O)C1=CC=CC=C1F MCULE-2885931404 [0,1,0,0,0,1|2,0,0]=4 1602 B10R1.61 O=C(O)C1=CC=CC=C1I MCULE-5987010449 [0,1,0,0,0,1|2,0,0]=4 1603 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8407868694 [0,1,0,0,0,1|2,0,0]=4 1604 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-8756695354 [0,1,0,0,0,1|2,0,0]=4 1605 B10R1.61 O=C(O)C1=CC=CC=C1O MCULE-9332636114 [0,1,0,0,0,1|2,0,0]=4 1606 B10R1.61 O=C(O)C1=CC=CC=[N+]1[O-] MCULE-1615765456 [0,1,0,0,0,1|2,0,0]=4 1607 B10R1.61 O=C(O)C1=CC=CN=C1Br MCULE-2307647512 [0,1,0,0,0,1|1,0,0]=3 1608 B10R1.61 O=C(O)C1=CC=CN=C1F MCULE-8936365151 [0,1,0,0,0,1|1,0,0]=3 1609 B10R1.61 O=C(O)C1=CC=CN=C1O MCULE-3119679537 [0,1,0,0,0,1|1,0,0]=3 1610 B10R1.61 O=C(O)C1=CC=CN=C1S MCULE-9687940814 [0,1,0,0,0,1|1,0,0]=3 1611 B10R1.61 O=C(O)C1=CC=COC1=O MCULE-7272938902 [0,1,0,0,0,1|2,0,0]=4 1612 B10R1.61 O=C(O)C1=CC=NC=C1Br MCULE-2837047087 [0,1,0,0,0,1|1,0,0]=3 1613 B10R1.61 O=C(O)C1=CC=NNC1=O MCULE-5812037295 [0,1,0,0,0,1|0,0,0]=2 1614 B10R1.61 O=C(O)C1=CN=CC=C1Br MCULE-4300578257 [0,1,0,0,0,1|1,0,0]=3 1615 B10R1.61 O=C(O)C1=CN=CC=C1Br MCULE-6329072205 [0,1,0,0,0,1|1,0,0]=3 1616 B10R1.61 O=C(O)C1=CN=CC=C1S MCULE-8908983932 [0,1,0,0,0,1|1,0,0]=3 1617 B10R1.61 O=C(O)C1=CN=CN=C1Cl MCULE-1324066589 [0,1,0,0,0,1|0,0,1]=3 1618 B10R1.61 O=C(O)C1=CNC=NC1=O MCULE-7526187020 [0,1,0,0,0,1|0,0,0]=2 1619 B10R1.61 O=C(O)C1=CNN=CC1=O MCULE-3661596942 [0,1,0,0,0,1|0,0,0]=2 1620 B10R1.61 O=C(O)C1=NC=CC=C1Br MCULE-3606808833 [0,1,0,0,0,1|2,0,0]=4 1621 B10R1.61 O=C(O)C1=NC=CC=C1Cl MCULE-2890401948 [0,1,0,0,0,1|2,0,0]=4 1622 B10R1.61 O=C(O)C1=NC=CC=C1F MCULE-4259510995 [0,1,0,0,0,1|2,0,0]=4 1623 B10R1.61 O=C(O)C1=NC=CC=C1F MCULE-9291944516 [0,1,0,0,0,1|2,0,0]=4 1624 B10R1.61 O=C(O)C1=NC=CC=C1S MCULE-7486731745 [0,1,0,0,0,1|2,0,0]=4 1625 B10R1.61 O=C(O)C1=NC=CN=C1Br MCULE-9422637464 [0,1,0,0,0,1|1,0,0]=3 1626 B10R1.61 O=C(O)C1=NC=CN=C1Cl MCULE-4997590987 [0,1,0,0,0,1|1,0,0]=3 1627 B10R1.61 O=C(O)C1=NC=CN=C1F MCULE-4103589228 [0,1,0,0,0,1|1,0,0]=3 1628 B10R1.61 O=C(O)C1=NC=CN=C1I MCULE-3852096378 [0,1,0,0,0,1|1,0,0]=3 1629 B10R1.61 O=C(O)C1=NC=CN=C1O MCULE-1082436349 [0,1,0,0,0,1|1,0,0]=3 1630 B10R1.61 O=C(O)C1=NC=NC=C1Br MCULE-1151611735 [0,1,0,0,0,1|1,0,0]=3 1631 B10R1.61 O=C(O)C1C=CC=NC1=O MCULE-4953790271 [0,1,0,0,0,1|1,0,1]=4 1632 B10R1.61 O=C([O-])C1=C(C=CN=C1)O MCULE-5831902195 [0,1,0,0,0,1|1,0,1]=4 1633 B10R1.61 O=C([O-])C1=C(N=CC=C1)O MCULE-9169400221 [0,1,0,0,0,1|1,0,1]=4 1634 B10R1.61 O=C1NC=NC=C1N(=O)=O MCULE-2857199020 [0,1,0,0,0,1|1,0,1]=4 1635 B10R1.61 [NH-]C(=O)C1=NC=CNC1=O MCULE-1904711334 [0,1,0,0,0,1|2,0,0]=4 1636 B10R1.61 [NH-]C(=O)C1=NC=CNC1=O MCULE-3826493918 [0,1,0,0,0,1|2,0,0]=4 1637 B10R1.113 CC(=O)C1=CC(=CN=C1)C MCULE-5628044845 [0,1,0,0,0,1|2,0,0]=4 1638 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl MCULE-3873806121 [0,1,0,0,0,1|2,0,0]=4 1639 B10R1.113 CC(=O)C1=CC(=CN=C1)F MCULE-3863098963 [0,1,0,0,0,1|2,0,0]=4 1640 B10R1.113 CC(=O)C1=CC(=CN=C1)F MCULE-9845484449 [0,1,0,0,0,1|2,0,0]=4 1641 B10R1.113 CC(=O)C1=CC(=CN=C1)O MCULE-9488751647 [0,1,0,0,0,1|2,0,0]=4 1642 B10R1.113 CC(=O)C1=CC(=NC=C1)Br MCULE-6472726710 [0,1,0,0,0,1|2,0,0]=4 1643 B10R1.113 CC(=O)C1=CC(=NC=C1)Br MCULE-9200448193 [0,1,0,0,0,1|2,0,0]=4 1644 B10R1.113 CC(=O)C1=CC(=NC=C1)C MCULE-5557262548 [0,1,0,0,0,1|2,0,0]=4 1645 B10R1.113 CC(=O)C1=CC(=NC=C1)N MCULE-3900813387 [0,1,0,0,0,1|2,0,0]=4 1646 B10R1.113 CC(=O)C1=CC(=O)NC=C1 MCULE-4212592174 [0,1,0,0,0,1|2,0,0]=4 1647 B10R1.113 CC(=O)C1=CC=NC(=C1)Cl MCULE-6845382822 [0,1,0,0,0,1|2,0,0]=4 1648 B10R1.113 CC(=O)C1=CC=NC(=C1)F MCULE-7124532428 [0,1,0,0,0,1|2,0,0]=4 1649 B10R1.113 CC(=O)C1=CC=NC(=N1)Cl MCULE-4303919924 [0,1,0,0,0,1|2,0,0]=4 1650 B10R1.113 CC(=O)C1=CN=CC(=C1)Br MCULE-9805827315 [0,1,0,0,0,1|2,0,0]=4 1651 B10R1.113 CC(=O)C1=CN=CC(=N1)Cl MCULE-3456705038 [0,1,0,0,0,1|2,0,0]=4 1652 B10R1.113 CC(=O)C1=NC(=CN=C1)C MCULE-2166143470 [0,1,0,0,0,1|2,0,0]=4 1653 B10R1.113 CC(=O)C1=NC(=NC=C1)C MCULE-2257809383 [0,1,0,0,0,1|2,0,0]=4 1654 B10R1.113 CC(=O)C1=NC(=NC=C1)N MCULE-9407852722 [0,1,0,0,0,1|2,0,0]=4 1655 B10R1.113 CC(=O)C1=NC=NC(=C1)C MCULE-3239512417 [0,1,0,0,0,1|2,0,0]=4 1656 B10R1.113 CC1=CC(=CC=C1)C(=O)O MCULE-8632144278 [0,1,0,0,0,1|2,0,0]=4 1657 B10R1.113 CC1=CC(=CC=N1)C(=O)O MCULE-7190658769 [0,1,0,0,0,1|1,0,0]=3 1658 B10R1.113 CC1=CC(=CN=C1)C(=O)Cl MCULE-6685505962 [0,1,0,0,0,1|2,0,0]=4 1659 B10R1.113 CC1=CC(=CN=C1)C(=O)N MCULE-1292950313 [0,1,0,0,0,1|2,0,0]=4 1660 B10R1.113 CC1=CC(=CN=C1)C(=O)O MCULE-4739873978 [0,1,0,0,0,1|1,0,0]=3 1661 B10R1.113 CC1=CC(=NC=C1)C(=O)O MCULE-9474979386 [0,1,0,0,0,1|2,0,0]=4 1662 B10R1.113 CC1=CC(=NN=C1)C(=O)O MCULE-9633056381 [0,1,0,0,0,1|2,0,0]=4 1663 B10R1.113 CC1=CN=CC(=N1)C(=O)N MCULE-8735204644 [0,1,0,0,0,1|2,0,0]=4 1664 B10R1.113 CC1=CN=CC(=N1)C(=O)O MCULE-4859154101 [0,1,0,0,0,1|1,0,0]=3 1665 B10R1.113 CC1=NC(=CC=C1)C(=O)O MCULE-8640923497 [0,1,0,0,0,1|2,0,0]=4 1666 B10R1.113 CC1=NC(=CC=N1)C(=O)O MCULE-3907223443 [0,1,0,0,0,1|1,0,0]=3 1667 B10R1.113 CC1=NC=CC(=C1)C(=O)Cl MCULE-3574283825 [0,1,0,0,0,1|2,0,0]=4 1668 B10R1.113 CC1=NC=CC(=C1)C(=O)N MCULE-5237575475 [0,1,0,0,0,1|2,0,0]=4 1669 B10R1.113 CC1=NC=NC(=C1)C(=O)O MCULE-3959886425 [0,1,0,0,0,1|1,0,0]=3 1670 B10R1.113 CC1=NN=CC(=C1)C(=O)O MCULE-1146860977 [0,1,0,0,0,1|0,0,1]=3 1671 B10R1.113 CC1=NN=CC(=C1)C(=O)O MCULE-7391883450 [0,1,0,0,0,1|0,0,1]=3 1672 B10R1.113 CN1C=CCC(=C1)C(=O)N MCULE-5571377120 [0,1,0,0,0,1|2,0,0]=4 1673 B10R1.113 CN1CCC=C(C1)C(=O)O MCULE-5778457701 [0,1,0,0,0,1|1,0,1]=4 1674 B10R1.113 C[N+]1=CC(=CC=C1)C(=O)O MCULE-3607042354 [0,1,0,0,0,1|1,0,1]=4 1675 B10R1.113 C[N+]1=CC(=CC=C1)C(=O)O MCULE-8427101186 [0,1,0,0,0,1|1,0,1]=4 1676 B10R1.113 C[N+]1=CC(=NC=C1)C(=O)O MCULE-3544130112 [0,1,0,0,0,1|1,0,1]=4 1677 B10R1.113 C[N+]1=CC(=NC=C1)C(=O)O MCULE-8874386125 [0,1,0,0,0,1|1,0,1]=4 1678 B10R1.113 NC(=O)C1=CC(=CN=C1)Br MCULE-6893802010 [0,1,0,0,0,1|2,0,0]=4 1679 B10R1.113 NC(=O)C1=CC(=CN=C1)Cl MCULE-9535783282 [0,1,0,0,0,1|2,0,0]=4 1680 B10R1.113 NC(=O)C1=CC(=CN=C1)I MCULE-3974085337 [0,1,0,0,0,1|2,0,0]=4 1681 B10R1.113 NC(=O)C1=CC(=NC=C1)Br MCULE-6886275576 [0,1,0,0,0,1|2,0,0]=4 1682 B10R1.113 NC(=O)C1=CC(=NC=C1)Cl MCULE-2595547677 [0,1,0,0,0,1|2,0,0]=4 1683 B10R1.113 NC(=O)C1=CC(=NC=C1)F MCULE-8009823666 [0,1,0,0,0,1|2,0,0]=4 1684 B10R1.113 NC(=O)C1=CC(=NC=C1)I MCULE-2506143509 [0,1,0,0,0,1|2,0,0]=4 1685 B10R1.113 NC(=O)C1=CC(=NC=C1)N MCULE-1562942602 [0,1,0,0,0,1|2,0,0]=4 1686 B10R1.113 NC(=O)C1=CC=NC(=N1)Cl MCULE-4582263816 [0,1,0,0,0,1|2,0,0]=4 1687 B10R1.113 NC(=O)C1=CN=CC(=C1)F MCULE-3084031157 [0,1,0,0,0,1|2,0,0]=4 1688 B10R1.113 NC(=O)C1=CN=CC(=C1)N MCULE-6137377433 [0,1,0,0,0,1|2,0,0]=4 1689 B10R1.113 NC(=O)C1=NC(=CN=C1)Br MCULE-7307444537 [0,1,0,0,0,1|2,0,0]=4 1690 B10R1.113 NC(=O)C1=NC(=CN=C1)Cl MCULE-9125930968 [0,1,0,0,0,1|2,0,0]=4 1691 B10R1.113 NC(=O)C1=NC(=CN=C1)F MCULE-7451903424 [0,1,0,0,0,1|2,0,0]=4 1692 B10R1.113 NC(=O)C1=NC(=NC=C1)N MCULE-9338856751 [0,1,0,0,0,1|2,0,0]=4 1693 B10R1.113 NC(=O)C1=NC=NC(=C1)Cl MCULE-9419317924 [0,1,0,0,0,1|2,0,0]=4 1694 B10R1.113 NC(=O)C1=NC=NC(=C1)O MCULE-2951027103 [0,1,0,0,0,1|2,0,0]=4 1695 B10R1.113 NC1=CC(=NC=C1)C(=O)O MCULE-9056941592 [0,1,0,0,0,1|2,0,0]=4 1696 B10R1.113 NC1=CC(=NC=N1)C(=O)O MCULE-5788733439 [0,1,0,0,0,1|1,0,0]=3 1697 B10R1.113 NC1=CC(=NC=N1)C(=O)O MCULE-8448092758 [0,1,0,0,0,1|1,0,0]=3 1698 B10R1.113 NC1=CC(=NC=N1)C(=O)[O-] MCULE-3325925004 [0,1,0,0,0,1|1,0,1]=4 1699 B10R1.113 NC1=CC=CC(=C1)C(=O)O MCULE-8263489676 [0,1,0,0,0,1|2,0,0]=4 1700 B10R1.113 NC1=CC=NC(=C1)C(=O)O MCULE-9545736743 [0,1,0,0,0,1|2,0,0]=4 1701 B10R1.113 NC1=CN=CC(=N1)C(=O)O MCULE-3266601821 [0,1,0,0,0,1|1,0,0]=3 1702 B10R1.113 NC1=NC(=CC=C1)C(=O)O MCULE-9724208608 [0,1,0,0,0,1|2,0,0]=4 1703 B10R1.113 NC1=NC=CC(=C1)C(=O)O MCULE-3692050475 [0,1,0,0,0,1|1,0,0]=3 1704 B10R1.113 NC1=NC=CC(=C1)C(=O)O MCULE-4566777212 [0,1,0,0,0,1|1,0,0]=3 1705 B10R1.113 NC1=NC=CC(=N1)C(=O)O MCULE-6973432332 [0,1,0,0,0,1|1,0,0]=3 1706 B10R1.113 NC1=NN=CC(=C1)C(=O)O MCULE-3718911900 [0,1,0,0,0,1|0,0,1]=3 1707 B10R1.113 O=C(Cl)C1=CC(=CN=C1)Cl MCULE-5188708849 [0,1,0,0,0,1|2,0,0]=4 1708 B10R1.113 O=C(Cl)C1=CC(=CN=C1)F MCULE-2672601460 [0,1,0,0,0,1|2,0,0]=4 1709 B10R1.113 O=C(Cl)C1=CC(=NC=C1)Br MCULE-3587910111 [0,1,0,0,0,1|2,0,0]=4 1710 B10R1.113 O=C(Cl)C1=CC(=NC=C1)F MCULE-9015800571 [0,1,0,0,0,1|2,0,0]=4 1711 B10R1.113 O=C(Cl)C1=CC=NC(=C1)Cl MCULE-5719911360 [0,1,0,0,0,1|2,0,0]=4 1712 B10R1.113 O=C(Cl)C1=CN=CC(=C1)Br MCULE-6124449744 [0,1,0,0,0,1|2,0,0]=4 1713 B10R1.113 O=C(Cl)C1=NC(=NC=C1)Cl MCULE-6519889551 [0,1,0,0,0,1|2,0,0]=4 1714 B10R1.113 O=C(Cl)C1=NC=NC(=C1)Cl MCULE-2088943523 [0,1,0,0,0,1|2,0,0]=4 1715 B10R1.113 O=C(O)C1=CC(=CC=C1)Br MCULE-8805391978 [0,1,0,0,0,1|2,0,0]=4 1716 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl MCULE-4475337074 [0,1,0,0,0,1|2,0,0]=4 1717 B10R1.113 O=C(O)C1=CC(=CC=C1)F MCULE-6577870473 [0,1,0,0,0,1|2,0,0]=4 1718 B10R1.113 O=C(O)C1=CC(=CC=C1)I MCULE-7599924260 [0,1,0,0,0,1|2,0,0]=4 1719 B10R1.113 O=C(O)C1=CC(=CC=C1)O MCULE-3607182166 [0,1,0,0,0,1|2,0,0]=4 1720 B10R1.113 O=C(O)C1=CC(=CC=C1)S MCULE-3153980516 [0,1,0,0,0,1|2,0,0]=4 1721 B10R1.113 O=C(O)C1=CC(=CC=N1)Cl MCULE-3645636799 [0,1,0,0,0,1|2,0,0]=4 1722 B10R1.113 O=C(O)C1=CC(=CC=N1)I MCULE-2574584567 [0,1,0,0,0,1|2,0,0]=4 1723 B10R1.113 O=C(O)C1=CC(=CN=C1)Br MCULE-3401398565 [0,1,0,0,0,1|1,0,0]=3 1724 B10R1.113 O=C(O)C1=CC(=CN=C1)Cl MCULE-5011407455 [0,1,0,0,0,1|1,0,0]=3 1725 B10R1.113 O=C(O)C1=CC(=CN=C1)F MCULE-7456596815 [0,1,0,0,0,1|1,0,0]=3 1726 B10R1.113 O=C(O)C1=CC(=CN=C1)I MCULE-1738768737 [0,1,0,0,0,1|1,0,0]=3 1727 B10R1.113 O=C(O)C1=CC(=CN=C1)S MCULE-7221797925 [0,1,0,0,0,1|1,0,0]=3 1728 B10R1.113 O=C(O)C1=CC(=CN=C1)S MCULE-9937294575 [0,1,0,0,0,1|1,0,0]=3 1729 B10R1.113 O=C(O)C1=CC(=NC=C1)Br MCULE-3872320725 [0,1,0,0,0,1|1,0,0]=3 1730 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl MCULE-8384749674 [0,1,0,0,0,1|1,0,0]=3 1731 B10R1.113 O=C(O)C1=CC(=NC=C1)F MCULE-8703830168 [0,1,0,0,0,1|1,0,0]=3 1732 B10R1.113 O=C(O)C1=CC(=NC=C1)I MCULE-4043623395 [0,1,0,0,0,1|1,0,0]=3 1733 B10R1.113 O=C(O)C1=CC(=NC=C1)S MCULE-4830574914 [0,1,0,0,0,1|1,0,0]=3 1734 B10R1.113 O=C(O)C1=CC(=NC=N1)Cl MCULE-9180249208 [0,1,0,0,0,1|1,0,0]=3 1735 B10R1.113 O=C(O)C1=CC(=NC=N1)O MCULE-6681794599 [0,1,0,0,0,1|1,0,0]=3 1736 B10R1.113 O=C(O)C1=CC(=NN=C1)Cl MCULE-8975164728 [0,1,0,0,0,1|0,0,1]=3 1737 B10R1.113 O=C(O)C1=CC=CC(=N1)Br MCULE-6323362899 [0,1,0,0,0,1|2,0,0]=4 1738 B10R1.113 O=C(O)C1=CC=CC(=N1)F MCULE-9893977306 [0,1,0,0,0,1|2,0,0]=4 1739 B10R1.113 O=C(O)C1=CC=CC(=N1)I MCULE-6412426237 [0,1,0,0,0,1|2,0,0]=4 1740 B10R1.113 O=C(O)C1=CC=CN(=C1)=O MCULE-6254640605 [0,1,0,0,0,1|1,0,1]=4 1741 B10R1.113 O=C(O)C1=CN=CC(=C1)O MCULE-4896018532 [0,1,0,0,0,1|1,0,0]=3 1742 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl MCULE-9918226320 [0,1,0,0,0,1|2,0,0]=4 1743 B10R1.113 O=C(O)C1=NC(=CC=C1)O MCULE-9188843949 [0,1,0,0,0,1|2,0,0]=4 1744 B10R1.113 O=C(O)C1=NC(=CC=C1)S MCULE-6945963876 [0,1,0,0,0,1|2,0,0]=4 1745 B10R1.113 O=C(O)C1=NC(=CN=C1)Br MCULE-4158235218 [0,1,0,0,0,1|1,0,0]=3 1746 B10R1.113 O=C(O)C1=NC(=CN=C1)Cl MCULE-1216041030 [0,1,0,0,0,1|1,0,0]=3 1747 B10R1.113 O=C(O)C1=NC(=CN=C1)F MCULE-1309474814 [0,1,0,0,0,1|1,0,0]=3 1748 B10R1.113 O=C(O)C1=NC(=NC=C1)Br MCULE-3614341140 [0,1,0,0,0,1|1,0,0]=3 1749 B10R1.113 O=C(O)C1=NC(=NC=C1)Cl MCULE-7148111314 [0,1,0,0,0,1|1,0,0]=3 1750 B10R1.113 O=C(O)C1=NC=CC(=C1)Br MCULE-1739288332 [0,1,0,0,0,1|2,0,0]=4 1751 B10R1.113 O=C(O)C1=NC=CC(=C1)F MCULE-1019747704 [0,1,0,0,0,1|2,0,0]=4 1752 B10R1.113 O=C(O)C1=NC=CC(=C1)I MCULE-5622070666 [0,1,0,0,0,1|2,0,0]=4 1753 B10R1.113 O=C(O)C1=NC=CC(=C1)O MCULE-2705303745 [0,1,0,0,0,1|2,0,0]=4 1754 B10R1.113 O=C(O)C1=NC=CC(=C1)O MCULE-7268708037 [0,1,0,0,0,1|2,0,0]=4 1755 B10R1.113 O=C(O)C1=NC=CC(=C1)S MCULE-7032793351 [0,1,0,0,0,1|2,0,0]=4 1756 B10R1.113 O=C(O)C1=NN=CC(=C1)Cl MCULE-4265563084 [0,1,0,0,0,1|2,0,0]=4 1757 B10R1.113 O=C([O-])C1=CC(=NC=N1)O MCULE-1399338948 [0,1,0,0,0,1|1,0,1]=4 1758 B10R1.113 O=C([O-])C1=CN=CC(=N1)O MCULE-5159753382 [0,1,0,0,0,1|1,0,1]=4 1759 B10R1.113 O=C1C=C(C=CN1)C(=O)O MCULE-8873155750 [0,1,0,0,0,1|1,0,0]=3 1760 B10R1.113 O=C1C=C(C=NN1)C(=O)O MCULE-3854450321 [0,1,0,0,0,1|0,0,0]=2 1761 B10R1.113 O=C1C=CC=C(O1)C(=O)O MCULE-4419556396 [0,1,0,0,0,1|2,0,0]=4 1762 B10R1.113 O=C1C=COC(=C1)C(=O)O MCULE-3051094771 [0,1,0,0,0,1|2,0,0]=4 1763 B10R1.113 O=C1C=NC=C(N1)C(=O)O MCULE-6285474543 [0,1,0,0,0,1|1,0,0]=3 1764 B10R1.113 O=C1CC(=CC=N1)C(=O)O MCULE-3789271459 [0,1,0,0,0,1|1,0,0]=3 1765 B10R1.113 O=C1N=CC=C(N1)C(=O)O MCULE-6042406465 [0,1,0,0,0,1|1,0,0]=3 1766 B10R1.113 O=S(O)C1=CC(=NC=C1)Cl MCULE-6935237672 [0,1,0,0,0,1|2,0,0]=4 1767 B10R1.113 [NH3+]C1=CC=CC(=C1)C(=O)O MCULE-9535213423 [0,1,0,0,0,1|2,0,0]=4 1768 B10R1.113 [NH3+]C1=CN=CC(=C1)C(=O)[O-] MCULE-1422178835 [0,1,0,0,0,1|1,0,1]=4 1769 B10R1.23 CC(C(=O)O)C1=COC=C1 MCULE-4326585522 [0,1,0,0,0,1|2,0,0]=4 1770 B10R1.23 CC(C(=O)O)C1=CSC=C1 MCULE-7049134758 [0,1,0,0,0,1|2,0,0]=4 1771 B10R1.23 CC(C(=O)O)N1C=CN=C1 MCULE-6250259665 [0,1,0,0,0,1|2,0,0]=4 1772 B10R1.23 CC(C(=O)O)N1C=CN=C1 MCULE-6265035276 [0,1,0,0,0,1|2,0,0]=4 1773 B10R1.23 C[C@H](C(=O)O)N1C=CN=C1 MCULE-7676346166 [0,1,0,0,0,1|2,0,0]=4 1774 B10R1.23 C[C@H](C(=O)O)N1C=CN=C1 MCULE-7919952873 [0,1,0,0,0,1|2,0,0]=4 1775 B10R1.23 NC(C(=O)O)C1=CC=NS1 MCULE-1938977249 [0,1,0,0,0,1|2,0,0]=4 1776 B10R1.23 NC(C(=O)O)C1=CNN=C1 MCULE-5361903799 [0,1,0,0,0,1|0,0,0]=2 1777 B10R1.23 NC(C(=O)O)C1=COC=C1 MCULE-7814394097 [0,1,0,0,0,1|2,0,0]=4 1778 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-1102402224 [0,1,0,0,0,1|2,0,0]=4 1779 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-6018523481 [0,1,0,0,0,1|2,0,0]=4 1780 B10R1.23 NC(C(=O)O)C1=CSC=C1 MCULE-8080979991 [0,1,0,0,0,1|2,0,0]=4 1781 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-6987247145 [0,1,0,0,0,1|2,0,0]=4 1782 B10R1.23 N[C@@H](C(=O)O)C1=CSC=C1 MCULE-8041766294 [0,1,0,0,0,1|2,0,0]=4 1783 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-3946730105 [0,1,0,0,0,1|2,0,0]=4 1784 B10R1.23 N[C@H](C(=O)O)C1=CSC=C1 MCULE-5706986594 [0,1,0,0,0,1|2,0,0]=4 1785 B10R1.23 O=C(O)C(=O)C1=CNC=N1 MCULE-8916685899 [0,1,0,0,0,1|2,0,0]=4 1786 B10R1.23 O=C(O)C(=O)C1=CSC=C1 MCULE-4791693629 [0,1,0,0,0,1|2,0,0]=4 1787 B10R1.23 O=C(O)C(F)C1=CSC=C1 MCULE-5837038972 [0,1,0,0,0,1|2,0,0]=4 1788 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-3158873766 [0,1,0,0,0,1|2,0,0]=4 1789 B10R1.23 O=C(O)C(O)C1=CNC=N1 MCULE-5031403061 [0,1,0,0,0,1|2,0,0]=4 1790 B10R1.23 O=C(O)C(O)C1=COC=C1 MCULE-3232908149 [0,1,0,0,0,1|2,0,0]=4 1791 B10R1.27 COC(=O)CC1=CC=NN1 MCULE-6983223647 [0,1,0,0,0,1|2,0,0]=4 1792 B10R1.27 COC(=O)CC1=CN=CS1 MCULE-6332104559 [0,1,0,0,0,1|2,0,0]=4 1793 B10R1.27 COC(=O)CC1=CN=NN1 MCULE-8011202514 [0,1,0,0,0,1|1,0,1]=4 1794 B10R1.27 COC(=O)CC1=CNC=N1 MCULE-1550182309 [0,1,0,0,0,1|2,0,0]=4 1795 B10R1.27 COC(=O)CC1=CNC=N1 MCULE-6621169825 [0,1,0,0,0,1|2,0,0]=4 1796 B10R1.27 COC(=O)CC1=CNN=C1 MCULE-1922516425 [0,1,0,0,0,1|0,0,0]=2 1797 B10R1.27 COC(=O)CC1=CNN=C1 MCULE-5448333250 [0,1,0,0,0,1|0,0,0]=2 1798 B10R1.27 COC(=O)CC1=COC=C1 MCULE-6724530459 [0,1,0,0,0,1|2,0,0]=4 1799 B10R1.27 COC(=O)CC1=CSC=C1 MCULE-1425485326 [0,1,0,0,0,1|2,0,0]=4 1800 B10R1.27 COC(=O)CC1=NNN=N1 MCULE-4730475203 [0,1,0,0,0,1|2,0,0]=4 1801 B10R1.27 COC(=O)CN1C=CN=C1 MCULE-1735450905 [0,1,0,0,0,1|2,0,0]=4 1802 B10R1.27 COC(=O)NN1C=NN=C1 MCULE-2433300112 [0,1,0,0,0,1|1,0,1]=4 1803 B10R1.27 NCC(=O)NC1=CNN=C1 MCULE-7143548245 [0,1,0,0,0,1|1,0,0]=3 1804 B10R1.27 NCC(=O)NC1=CNN=C1 MCULE-9763641165 [0,1,0,0,0,1|1,0,0]=3 1805 B10R1.27 NNC(=O)CC1=CNN=N1 MCULE-4627562092 [0,1,0,0,0,1|2,0,0]=4 1806 B10R1.54 CC(=CC1=CN(N=C1)C)C MCULE-1667274517 [0,1,0,0,0,1|2,0,0]=4 1807 B10R1.54 CC(=CC1=CN(N=C1)C)C MCULE-8279058013 [0,1,0,0,0,1|2,0,0]=4 1808 B10R1.54 CC(=O)CC1=CN(N=C1)C MCULE-4318046037 [0,1,0,0,0,1|1,0,0]=3 1809 B10R1.54 CC(=O)NC1=CN(N=C1)C MCULE-4291797588 [0,1,0,0,0,1|1,0,0]=3 1810 B10R1.54 CC1=CC(=CS1)CC(=O)O MCULE-8700180303 [0,1,0,0,0,1|2,0,0]=4 1811 B10R1.54 CC1=CC(=NN1)CC(=O)O MCULE-9189935482 [0,1,0,0,0,1|2,0,0]=4 1812 B10R1.54 CC1=NC=C(O1)CC(=O)O MCULE-3634082969 [0,1,0,0,0,1|2,0,0]=4 1813 B10R1.54 CC1=NC=C(S1)CC(=O)O MCULE-3228022946 [0,1,0,0,0,1|2,0,0]=4 1814 B10R1.54 CC1=NNC(=C1)CC(=O)O MCULE-4936433367 [0,1,0,0,0,1|2,0,0]=4 1815 B10R1.54 CC1=NOC(=C1)CC(=O)O MCULE-1458938389 [0,1,0,0,0,1|2,0,0]=4 1816 B10R1.54 CC1=NSC(=C1)CC(=O)O MCULE-5761974818 [0,1,0,0,0,1|2,0,0]=4 1817 B10R1.54 CN1C=C(C=N1)C=C(Br)Br MCULE-8859031893 [0,1,0,0,0,1|2,0,0]=4 1818 B10R1.54 CN1C=C(C=N1)CC(=O)O MCULE-7112131076 [0,1,0,0,0,1|0,0,0]=2 1819 B10R1.54 CN1C=C(C=N1)CC(=O)O MCULE-8387534193 [0,1,0,0,0,1|0,0,0]=2 1820 B10R1.54 CN1C=C(C=N1)NC(=O)N MCULE-7365046832 [0,1,0,0,0,1|1,0,0]=3 1821 B10R1.54 CN1C=C(C=N1)NC(=S)N MCULE-2076187704 [0,1,0,0,0,1|1,1,0]=4 1822 B10R1.54 CN1C=C(N=N1)CC(=O)O MCULE-6860538436 [0,1,0,0,0,1|1,0,0]=3 1823 B10R1.54 CN1C=C(N=N1)CC(=O)O MCULE-9755797612 [0,1,0,0,0,1|1,0,0]=3 1824 B10R1.54 CN1C=CC(=C1)CC(=O)O MCULE-7960244777 [0,1,0,0,0,1|1,0,0]=3 1825 B10R1.54 CN1C=CC(=N1)CC(=O)O MCULE-3475757844 [0,1,0,0,0,1|2,0,0]=4 1826 B10R1.54 CN1C=CC(=N1)CC(=O)O MCULE-8234874677 [0,1,0,0,0,1|2,0,0]=4 1827 B10R1.54 CN1C=C[N+](=C1)CC(=O)O MCULE-4577850730 [0,1,0,0,0,1|2,0,0]=4 1828 B10R1.54 CN1C=C[N+](=C1)CC(=O)O MCULE-8522062892 [0,1,0,0,0,1|2,0,0]=4 1829 B10R1.54 CN1C=NC(=C1)CC(=O)O MCULE-3578579487 [0,1,0,0,0,1|2,0,0]=4 1830 B10R1.54 CN1C=NC(=C1)CC(=O)O MCULE-5475235258 [0,1,0,0,0,1|2,0,0]=4 1831 B10R1.54 CN1N=NC(=N1)CC(=O)O MCULE-1923232448 [0,1,0,0,0,1|2,0,0]=4 1832 B10R1.54 NC1=NC=C(S1)CC(=O)O MCULE-1412802881 [0,1,0,0,0,1|2,0,0]=4 1833 B10R1.54 NC1=NNC(=C1)CC(=O)O MCULE-3869915440 [0,1,0,0,0,1|2,0,0]=4 1834 B10R1.54 O=C(O)CC1=CC(=O)NN1 MCULE-5112159197 [0,1,0,0,0,1|2,0,0]=4 1835 B10R1.54 O=C(O)CC1=CN=C(S1)Cl MCULE-6753942980 [0,1,0,0,0,1|2,0,0]=4 1836 B10R1.54 O=C(O)CC1=CSC(=C1)Br MCULE-2092123395 [0,1,0,0,0,1|2,0,0]=4 1837 B10R1.54 O=C(O)CC1=CSC(=C1)Cl MCULE-5249616412 [0,1,0,0,0,1|2,0,0]=4 1838 B10R1.54 O=C(O)CN1C=NC(=C1)Br MCULE-9237606179 [0,1,0,0,0,1|2,0,0]=4 1839 B10R1.64 CC(=O)NC1=CNN=C1Cl MCULE-2397024138 [0,1,0,0,0,1|1,0,0]=3 1840 B10R1.64 CC1=C(C=CO1)SC(=O)O MCULE-6392412359 [0,1,0,0,0,1|2,0,0]=4 1841 B10R1.64 CC1=C(C=CS1)CC(=O)O MCULE-1419046904 [0,1,0,0,0,1|2,0,0]=4 1842 B10R1.64 CC1=C(C=NO1)CC(=O)O MCULE-9442529602 [0,1,0,0,0,1|1,0,0]=3 1843 B10R1.64 CC1=C(N=CN1)CC(=O)O MCULE-5024867197 [0,1,0,0,0,1|2,0,0]=4 1844 B10R1.64 CC1=C(N=CN1)CC(=O)O MCULE-9587919004 [0,1,0,0,0,1|2,0,0]=4 1845 B10R1.64 CC1=C(OC=N1)CC(=O)O MCULE-8618901468 [0,1,0,0,0,1|2,0,0]=4 1846 B10R1.64 CC1=C(SC=N1)CC(=O)O MCULE-9329716705 [0,1,0,0,0,1|2,0,0]=4 1847 B10R1.64 CC1=CN=CN1CC(=O)O MCULE-2710640387 [0,1,0,0,0,1|2,0,0]=4 1848 B10R1.64 CC1=NC=CN1CC(=O)O MCULE-3448638971 [0,1,0,0,0,1|2,0,0]=4 1849 B10R1.64 CC1=NC=CN1CC(=O)O MCULE-6844192190 [0,1,0,0,0,1|2,0,0]=4 1850 B10R1.64 CC1=NOC=C1CC(=O)O MCULE-6247296087 [0,1,0,0,0,1|1,0,0]=3 1851 B10R1.64 CC1=NON=C1CC(=O)O MCULE-2815643743 [0,1,0,0,0,1|2,0,0]=4 1852 B10R1.64 CN1C=NC=C1CC(=O)O MCULE-5761290478 [0,1,0,0,0,1|2,0,0]=4 1853 B10R1.64 CN1C=NC=C1CC(=O)O MCULE-7833091626 [0,1,0,0,0,1|2,0,0]=4 1854 B10R1.64 CN1N=CC=C1CC(=O)O MCULE-4612296796 [0,1,0,0,0,1|2,0,0]=4 1855 B10R1.64 CN1N=CC=C1CC(=O)O MCULE-6636681023 [0,1,0,0,0,1|2,0,0]=4 1856 B10R1.64 CN1N=NC=C1CC(=O)O MCULE-9235292727 [0,1,0,0,0,1|1,0,1]=4 1857 B10R1.64 NC1=NON=C1CC(=O)O MCULE-6062273067 [0,1,0,0,0,1|2,0,0]=4 1858 B10R1.64 O=C(O)CC1=C(SC=C1)Br MCULE-9300722210 [0,1,0,0,0,1|2,0,0]=4 1859 B10R1.64 O=C(O)CC1=C(SC=C1)Cl MCULE-3906836942 [0,1,0,0,0,1|2,0,0]=4 1860 B10R1.64 O=C(O)CC1=CNN=C1O MCULE-1830909072 [0,1,0,0,0,1|0,0,0]=2 1861 B10R1.64 O=C(O)CC1=CSC=C1Br MCULE-6770983933 [0,1,0,0,0,1|2,0,0]=4 1862 B10R1.64 O=C(O)CC1=NNC=C1Br MCULE-7982995810 [0,1,0,0,0,1|2,0,0]=4 1863 B10R1.64 O=C(O)CC1=NON=C1O MCULE-4442973861 [0,1,0,0,0,1|2,0,0]=4 1864 B10R1.64 O=C(O)CN1C=CN=C1Cl MCULE-7897123660 [0,1,0,0,0,1|2,0,0]=4 1865 B10R1.64 O=C(O)CN1C=NNC1=S MCULE-5289386958 [0,1,0,0,0,1|1,0,0]=3 1866 B10R1.281 CS(=O)(=NC1=CNN=C1)C MCULE-1285678654 [0,1,0,0,0,1|2,0,0]=4 1867 B10R1.281 CS(=O)(=NC1=CNN=C1)C MCULE-5102286071 [0,1,0,0,0,1|2,0,0]=4 1868 B10R1.6 NNS(=O)(=O)C1=CNN=C1 MCULE-4212290524 [0,2,0,0,0,0|1,0,1]=4 1869 B10R1.11 CCNC(=O)C1=CNN=C1 MCULE-5583401283 [0,2,0,0,0,0|1,0,0]=3 1870 B10R1.11 CCNC(=O)C1=CNN=N1 MCULE-9813786940 [0,2,0,0,0,0|2,0,0]=4 1871 B10R1.11 CCOC(=O)C1=CC=NO1 MCULE-5986325534 [0,2,0,0,0,0|2,0,0]=4 1872 B10R1.11 CCOC(=O)C1=CN=CO1 MCULE-5953159562 [0,2,0,0,0,0|2,0,0]=4 1873 B10R1.11 CCOC(=O)C1=CN=CS1 MCULE-4167508977 [0,2,0,0,0,0|2,0,0]=4 1874 B10R1.11 CCOC(=O)C1=CN=CS1 MCULE-7290752913 [0,2,0,0,0,0|2,0,0]=4 1875 B10R1.11 CCOC(=O)C1=CN=NS1 MCULE-4602067933 [0,2,0,0,0,0|1,0,1]=4 1876 B10R1.11 CCOC(=O)C1=CNC=C1 MCULE-4549962794 [0,2,0,0,0,0|1,0,0]=3 1877 B10R1.11 CCOC(=O)C1=CNC=N1 MCULE-8677760402 [0,2,0,0,0,0|2,0,0]=4 1878 B10R1.11 CCOC(=O)C1=CNN=C1 MCULE-2192738792 [0,2,0,0,0,0|0,0,0]=2 1879 B10R1.11 CCOC(=O)C1=CNN=C1 MCULE-5895609234 [0,2,0,0,0,0|0,0,0]=2 1880 B10R1.11 CCOC(=O)C1=CNN=N1 MCULE-9554217135 [0,2,0,0,0,0|1,0,0]=3 1881 B10R1.11 CCOC(=O)C1=COC=C1 MCULE-6706151358 [0,2,0,0,0,0|2,0,0]=4 1882 B10R1.11 CCOC(=O)C1=CON=C1 MCULE-2634863079 [0,2,0,0,0,0|1,0,0]=3 1883 B10R1.11 CCOC(=O)C1=CSC=C1 MCULE-8933512005 [0,2,0,0,0,0|2,0,0]=4 1884 B10R1.11 CCOC(=O)C1=CSN=C1 MCULE-4507381057 [0,2,0,0,0,0|1,0,0]=3 1885 B10R1.11 CCOC(=O)C1=CSN=N1 MCULE-9286295728 [0,2,0,0,0,0|2,0,0]=4 1886 B10R1.11 CCOC(=O)C1=NNC=C1 MCULE-4192977461 [0,2,0,0,0,0|2,0,0]=4 1887 B10R1.11 CCOC(=O)N1C=CN=C1 MCULE-6923782669 [0,2,0,0,0,0|2,0,0]=4 1888 B10R1.14 CC(=NO)C1=CN(N=C1)C MCULE-6068636730 [0,2,0,0,0,0|1,0,0]=3 1889 B10R1.14 CCC(=O)C1=CN(N=C1)C MCULE-3121441561 [0,2,0,0,0,0|1,0,0]=3 1890 B10R1.14 CN1C=C(C=N1)/C(=N/O)/N MCULE-8661916287 [0,2,0,0,0,0|1,0,0]=3 1891 B10R1.14 CN1C=C(C=N1)C(=O)CBr MCULE-1999990553 [0,2,0,0,0,0|1,0,0]=3 1892 B10R1.14 CN1C=C(C=N1)C(=O)CCl MCULE-2351954916 [0,2,0,0,0,0|1,0,0]=3 1893 B10R1.14 CN1C=C(C=N1)C(=O)CN MCULE-1801693475 [0,2,0,0,0,0|1,0,0]=3 1894 B10R1.14 CN1C=C(C=N1)C(=O)CN MCULE-5921679583 [0,2,0,0,0,0|1,0,0]=3 1895 B10R1.14 CN1C=C(C=N1)C(=O)NN MCULE-2895593641 [0,2,0,0,0,0|1,0,0]=3 1896 B10R1.14 CN1C=C(C=N1)C(N)CO MCULE-9406828243 [0,2,0,0,0,0|1,0,1]=4 1897 B10R1.14 CN1C=C(C=N1)C(O)CN MCULE-3817884356 [0,2,0,0,0,0|1,0,1]=4 1898 B10R1.14 CN1C=C(N=N1)C(=O)CCl MCULE-3832461711 [0,2,0,0,0,0|2,0,0]=4 1899 B10R1.14 CN1C=C(N=N1)C(=O)NN MCULE-4633536592 [0,2,0,0,0,0|2,0,0]=4 1900 B10R1.14 CN1C=CC(=C1)C(=O)CCl MCULE-2529082483 [0,2,0,0,0,0|2,0,0]=4 1901 B10R1.14 CN1N=CC(=N1)C(=O)CCl MCULE-1354539602 [0,2,0,0,0,0|2,0,0]=4 1902 B10R1.14 CNC(=O)C1=CN(N=C1)C MCULE-9828300089 [0,2,0,0,0,0|1,0,0]=3 1903 B10R1.14 CNC(=O)C1=CN(N=N1)C MCULE-2696883253 [0,2,0,0,0,0|2,0,0]=4 1904 B10R1.14 COC(=O)C1=CC(=NN1)N MCULE-3415764958 [0,2,0,0,0,0|2,0,0]=4 1905 B10R1.14 COC(=O)C1=CC(=NN1)O MCULE-2462260822 [0,2,0,0,0,0|2,0,0]=4 1906 B10R1.14 COC(=O)C1=CC(=NO1)Br MCULE-8801705301 [0,2,0,0,0,0|2,0,0]=4 1907 B10R1.14 COC(=O)C1=CC(=NO1)C MCULE-1514161202 [0,2,0,0,0,0|2,0,0]=4 1908 B10R1.14 COC(=O)C1=CC(=NO1)Cl MCULE-9262997904 [0,2,0,0,0,0|2,0,0]=4 1909 B10R1.14 COC(=O)C1=CC(=NO1)N MCULE-9078094228 [0,2,0,0,0,0|2,0,0]=4 1910 B10R1.14 COC(=O)C1=CC(=NO1)O MCULE-3204071858 [0,2,0,0,0,0|2,0,0]=4 1911 B10R1.14 COC(=O)C1=CC(=NS1)Br MCULE-9326203399 [0,2,0,0,0,0|2,0,0]=4 1912 B10R1.14 COC(=O)C1=CC(NN1)O MCULE-5673611742 [0,2,0,0,0,0|2,0,0]=4 1913 B10R1.14 COC(=O)C1=CN(C=C1)C MCULE-6668716332 [0,2,0,0,0,0|1,0,0]=3 1914 B10R1.14 COC(=O)C1=CN(C=N1)C MCULE-5927385951 [0,2,0,0,0,0|2,0,0]=4 1915 B10R1.14 COC(=O)C1=CN(N=C1)C MCULE-9775468141 [0,2,0,0,0,0|0,0,0]=2 1916 B10R1.14 COC(=O)C1=CN(N=N1)C MCULE-2009878230 [0,2,0,0,0,0|1,0,0]=3 1917 B10R1.14 COC(=O)C1=CN=C(N1)Br MCULE-3801070399 [0,2,0,0,0,0|2,0,0]=4 1918 B10R1.14 COC(=O)C1=CN=C(O1)Br MCULE-6818012570 [0,2,0,0,0,0|2,0,0]=4 1919 B10R1.14 COC(=O)C1=CN=C(O1)C MCULE-8345545291 [0,2,0,0,0,0|2,0,0]=4 1920 B10R1.14 COC(=O)C1=CN=C(O1)Cl MCULE-7895811510 [0,2,0,0,0,0|2,0,0]=4 1921 B10R1.14 COC(=O)C1=CN=C(O1)N MCULE-4582666702 [0,2,0,0,0,0|2,0,0]=4 1922 B10R1.14 COC(=O)C1=CN=C(S1)Br MCULE-1719888409 [0,2,0,0,0,0|2,0,0]=4 1923 B10R1.14 COC(=O)C1=CN=C(S1)C MCULE-4166403391 [0,2,0,0,0,0|2,0,0]=4 1924 B10R1.14 COC(=O)C1=CN=C(S1)Cl MCULE-4653418521 [0,2,0,0,0,0|2,0,0]=4 1925 B10R1.14 COC(=O)C1=CN=C(S1)N MCULE-8147071289 [0,2,0,0,0,0|2,0,0]=4 1926 B10R1.14 COC(=O)C1=CN=C(S1)O MCULE-4008589225 [0,2,0,0,0,0|2,0,0]=4 1927 B10R1.14 COC(=O)C1=CN=C(S1)S MCULE-2738372207 [0,2,0,0,0,0|2,0,0]=4 1928 B10R1.14 COC(=O)C1=CN=C([Se]1)N MCULE-9351111856 [0,2,0,0,0,0|2,0,0]=4 1929 B10R1.14 COC(=O)C1=CNC(=C1)Br MCULE-3281546607 [0,2,0,0,0,0|1,0,0]=3 1930 B10R1.14 COC(=O)C1=CNC(=C1)C MCULE-6968884020 [0,2,0,0,0,0|1,0,0]=3 1931 B10R1.14 COC(=O)C1=CNC(=N1)C MCULE-3691310870 [0,2,0,0,0,0|2,0,0]=4 1932 B10R1.14 COC(=O)C1=CNC(=N1)N MCULE-6713018595 [0,2,0,0,0,0|2,0,0]=4 1933 B10R1.14 COC(=O)C1=CNC(=N1)S MCULE-2928575583 [0,2,0,0,0,0|2,0,0]=4 1934 B10R1.14 COC(=O)C1=CNC(=O)N1 MCULE-4492175408 [0,2,0,0,0,0|2,0,0]=4 1935 B10R1.14 COC(=O)C1=CNC(=O)O1 MCULE-2828417321 [0,2,0,0,0,0|2,0,0]=4 1936 B10R1.14 COC(=O)C1=COC(=C1)Br MCULE-5431878034 [0,2,0,0,0,0|2,0,0]=4 1937 B10R1.14 COC(=O)C1=COC(=C1)C MCULE-1684701176 [0,2,0,0,0,0|2,0,0]=4 1938 B10R1.14 COC(=O)C1=CSC(=C1)Br MCULE-5442166469 [0,2,0,0,0,0|2,0,0]=4 1939 B10R1.14 COC(=O)C1=CSC(=C1)C MCULE-6679552373 [0,2,0,0,0,0|2,0,0]=4 1940 B10R1.14 COC(=O)C1=CSC(=C1)Cl MCULE-2895852018 [0,2,0,0,0,0|2,0,0]=4 1941 B10R1.14 COC(=O)C1=CSC(=C1)I MCULE-5638542501 [0,2,0,0,0,0|2,0,0]=4 1942 B10R1.14 COC(=O)C1=CSC(=C1)N MCULE-5616210106 [0,2,0,0,0,0|2,0,0]=4 1943 B10R1.14 COC(=O)C1=NN(C=C1)C MCULE-2671123567 [0,2,0,0,0,0|2,0,0]=4 1944 B10R1.14 COC(=O)C1=NN(N=C1)C MCULE-9328625684 [0,2,0,0,0,0|1,0,0]=3 1945 B10R1.14 COC(=O)C1=NNC(=C1)Br MCULE-2579546590 [0,2,0,0,0,0|2,0,0]=4 1946 B10R1.14 COC(=O)C1=NNC(=C1)C MCULE-1750080124 [0,2,0,0,0,0|2,0,0]=4 1947 B10R1.14 COC(=O)C1=NNC(=C1)Cl MCULE-5240482742 [0,2,0,0,0,0|2,0,0]=4 1948 B10R1.14 COC(=O)C1=NNC(=C1)F MCULE-8675492219 [0,2,0,0,0,0|2,0,0]=4 1949 B10R1.14 COC(=O)C1=NNC(=C1)I MCULE-9137204011 [0,2,0,0,0,0|2,0,0]=4 1950 B10R1.14 COC(=O)C1=NNC(=C1)N MCULE-1516646695 [0,2,0,0,0,0|2,0,0]=4 1951 B10R1.149 CC1=C(C=NO1)C(=O)CCl MCULE-2988249921 [0,2,0,0,0,0|2,0,0]=4 1952 B10R1.149 CC1=NNC=C1C(=O)NN MCULE-8613514140 [0,2,0,0,0,0|1,0,0]=3 1953 B10R1.149 CC1=NOC=C1C(=O)CCl MCULE-2460642933 [0,2,0,0,0,0|2,0,0]=4 1954 B10R1.149 CNC(=O)C1=C(NN=C1)N MCULE-2408982788 [0,2,0,0,0,0|1,0,0]=3 1955 B10R1.149 CNC(=O)C1=C(NN=N1)I MCULE-4231629426 [0,2,0,0,0,0|2,0,0]=4 1956 B10R1.149 CNC(=O)C1=C(NN=N1)S MCULE-3921812593 [0,2,0,0,0,0|2,0,0]=4 1957 B10R1.149 COC(=O)C1=C(C=NN1)Br MCULE-1081372633 [0,2,0,0,0,0|2,0,0]=4 1958 B10R1.149 COC(=O)C1=C(C=NO1)C MCULE-9894136011 [0,2,0,0,0,0|2,0,0]=4 1959 B10R1.149 COC(=O)C1=C(C=NS1)Br MCULE-1050793224 [0,2,0,0,0,0|2,0,0]=4 1960 B10R1.149 COC(=O)C1=C(N=CN1)C MCULE-7155712477 [0,2,0,0,0,0|2,0,0]=4 1961 B10R1.149 COC(=O)C1=C(N=CN1)N MCULE-3962198552 [0,2,0,0,0,0|2,0,0]=4 1962 B10R1.149 COC(=O)C1=C(N=CO1)Br MCULE-7694249399 [0,2,0,0,0,0|2,0,0]=4 1963 B10R1.149 COC(=O)C1=C(N=CO1)C MCULE-9619806638 [0,2,0,0,0,0|2,0,0]=4 1964 B10R1.149 COC(=O)C1=C(N=CS1)Br MCULE-5621057319 [0,2,0,0,0,0|2,0,0]=4 1965 B10R1.149 COC(=O)C1=C(N=CS1)C MCULE-2693804512 [0,2,0,0,0,0|2,0,0]=4 1966 B10R1.149 COC(=O)C1=C(N=CS1)Cl MCULE-4706766170 [0,2,0,0,0,0|2,0,0]=4 1967 B10R1.149 COC(=O)C1=C(N=CS1)N MCULE-4123240208 [0,2,0,0,0,0|2,0,0]=4 1968 B10R1.149 COC(=O)C1=C(N=NS1)C MCULE-9453446376 [0,2,0,0,0,0|1,0,1]=4 1969 B10R1.149 COC(=O)C1=C(NC=C1)C MCULE-5978062379 [0,2,0,0,0,0|1,0,0]=3 1970 B10R1.149 COC(=O)C1=C(NC=N1)Br MCULE-2306683525 [0,2,0,0,0,0|2,0,0]=4 1971 B10R1.149 COC(=O)C1=C(NC=N1)C MCULE-6210172389 [0,2,0,0,0,0|2,0,0]=4 1972 B10R1.149 COC(=O)C1=C(NN=N1)Br MCULE-7524298777 [0,2,0,0,0,0|1,0,0]=3 1973 B10R1.149 COC(=O)C1=C(NN=N1)C MCULE-8647322345 [0,2,0,0,0,0|1,0,0]=3 1974 B10R1.149 COC(=O)C1=C(NN=N1)Cl MCULE-5885255885 [0,2,0,0,0,0|1,0,0]=3 1975 B10R1.149 COC(=O)C1=C(OC=C1)Br MCULE-1749830482 [0,2,0,0,0,0|2,0,0]=4 1976 B10R1.149 COC(=O)C1=C(OC=C1)C MCULE-4821265874 [0,2,0,0,0,0|2,0,0]=4 1977 B10R1.149 COC(=O)C1=C(OC=C1)N MCULE-3478026891 [0,2,0,0,0,0|2,0,0]=4 1978 B10R1.149 COC(=O)C1=C(ON=C1)C MCULE-9759381409 [0,2,0,0,0,0|1,0,0]=3 1979 B10R1.149 COC(=O)C1=C(ON=C1)N MCULE-9494416698 [0,2,0,0,0,0|1,0,0]=3 1980 B10R1.149 COC(=O)C1=C(SC=C1)Br MCULE-5183989977 [0,2,0,0,0,0|2,0,0]=4 1981 B10R1.149 COC(=O)C1=C(SC=C1)C MCULE-2457772039 [0,2,0,0,0,0|2,0,0]=4 1982 B10R1.149 COC(=O)C1=C(SC=C1)Cl MCULE-4636063974 [0,2,0,0,0,0|2,0,0]=4 1983 B10R1.149 COC(=O)C1=C(SC=C1)F MCULE-4517248858 [0,2,0,0,0,0|2,0,0]=4 1984 B10R1.149 COC(=O)C1=C(SC=C1)N MCULE-4936240174 [0,2,0,0,0,0|2,0,0]=4 1985 B10R1.149 COC(=O)C1=CC=NN1C MCULE-1338013575 [0,2,0,0,0,0|2,0,0]=4 1986 B10R1.149 COC(=O)C1=CN=CN1C MCULE-3317583007 [0,2,0,0,0,0|2,0,0]=4 1987 B10R1.149 COC(=O)C1=CN=CN1N MCULE-2358115064 [0,2,0,0,0,0|2,0,0]=4 1988 B10R1.149 COC(=O)C1=CN=NN1C MCULE-8848821675 [0,2,0,0,0,0|1,0,1]=4 1989 B10R1.149 COC(=O)C1=CNC=C1Br MCULE-5582606771 [0,2,0,0,0,0|1,0,0]=3 1990 B10R1.149 COC(=O)C1=CNC=C1C MCULE-5184767507 [0,2,0,0,0,0|1,0,0]=3 1991 B10R1.149 COC(=O)C1=CNN=C1C MCULE-6531486904 [0,2,0,0,0,0|0,0,0]=2 1992 B10R1.149 COC(=O)C1=CNN=C1Cl MCULE-8769959961 [0,2,0,0,0,0|0,0,0]=2 1993 B10R1.149 COC(=O)C1=CNN=C1I MCULE-5601276735 [0,2,0,0,0,0|0,0,0]=2 1994 B10R1.149 COC(=O)C1=CNN=C1N MCULE-7019951169 [0,2,0,0,0,0|0,0,0]=2 1995 B10R1.149 COC(=O)C1=COC=C1Br MCULE-1711388531 [0,2,0,0,0,0|2,0,0]=4 1996 B10R1.149 COC(=O)C1=CON=C1C MCULE-4394545267 [0,2,0,0,0,0|1,0,0]=3 1997 B10R1.149 COC(=O)C1=CSC=C1Br MCULE-4152522521 [0,2,0,0,0,0|2,0,0]=4 1998 B10R1.149 COC(=O)C1=CSC=C1C MCULE-7554681302 [0,2,0,0,0,0|2,0,0]=4 1999 B10R1.149 COC(=O)C1=CSC=C1Cl MCULE-2782282019 [0,2,0,0,0,0|2,0,0]=4 2000 B10R1.149 COC(=O)C1=CSC=C1F MCULE-5163667288 [0,2,0,0,0,0|2,0,0]=4 2001 B10R1.149 COC(=O)C1=CSC=C1N MCULE-2782837371 [0,2,0,0,0,0|2,0,0]=4 2002 B10R1.149 COC(=O)C1=CSC=C1N MCULE-5494480725 [0,2,0,0,0,0|2,0,0]=4 2003 B10R1.149 COC(=O)C1=CSC=C1O MCULE-6238580272 [0,2,0,0,0,0|2,0,0]=4 2004 B10R1.149 COC(=O)C1=CSN=C1C MCULE-1339831175 [0,2,0,0,0,0|1,0,0]=3 2005 B10R1.149 COC(=O)C1=NNC=C1C MCULE-6382863604 [0,2,0,0,0,0|2,0,0]=4 2006 B10R1.149 COC(=O)C1=NNC=C1C MCULE-9034344893 [0,2,0,0,0,0|2,0,0]=4 2007 B10R1.149 COC(=O)C1=NNC=C1Cl MCULE-8626864149 [0,2,0,0,0,0|2,0,0]=4 2008 B10R1.149 COC(=O)C1=NNC=C1F MCULE-6478918358 [0,2,0,0,0,0|2,0,0]=4 2009 B10R1.149 COC(=O)C1=NNC=C1I MCULE-8829415073 [0,2,0,0,0,0|2,0,0]=4 2010 B10R1.149 COC(=O)C1=NNC=C1N MCULE-2543171846 [0,2,0,0,0,0|2,0,0]=4 2011 B10R1.149 COC(=O)C1=NNC=C1N MCULE-7590438908 [0,2,0,0,0,0|2,0,0]=4 2012 B10R1.149 COC(=O)C1=NON=C1N MCULE-1337914374 [0,2,0,0,0,0|2,0,0]=4 2013 B10R1.149 COC(=O)C1=NSN=C1Br MCULE-4646755913 [0,2,0,0,0,0|2,0,0]=4 2014 B10R1.149 COC(=O)C1=NSN=C1N MCULE-7080249794 [0,2,0,0,0,0|2,0,0]=4 2015 B10R1.149 N=C(NO)C1=C(NN=C1)N MCULE-2205370572 [0,2,0,0,0,0|1,0,0]=3 2016 B10R1.149 NNC(=O)C1=C(NN=C1)O MCULE-8930162021 [0,2,0,0,0,0|1,0,0]=3 2017 B10R1.149 NNC(=O)C1=C(NN=N1)Br MCULE-9269167201 [0,2,0,0,0,0|2,0,0]=4 2018 B10R1.149 [NH3+]C1=NNC=C1C(=O)OC MCULE-4445999058 [0,2,0,0,0,0|0,0,0]=2 2019 B10R1.55 CN1C=C(C=N1)S(=N)(=O)C MCULE-3584284724 [0,2,0,0,0,0|2,0,0]=4 2020 B10R1.55 CN1C=C(C=N1)S(=O)(=O)C MCULE-1278870936 [0,2,0,0,0,0|1,0,1]=4 2021 B10R1.55 CN1C=C(C=N1)S(=O)(=O)Cl MCULE-7957280859 [0,2,0,0,0,0|1,0,1]=4 2022 B10R1.55 CN1C=C(C=N1)S(=O)(=O)N MCULE-4994094657 [0,2,0,0,0,0|1,0,1]=4 2023 B10R1.65 CC1=C(C=NN1)S(=O)(=O)N MCULE-5769145061 [0,2,0,0,0,0|1,0,1]=4 2024 B10R1.65 CC1=NNC=C1S(=O)(=O)Cl MCULE-6881409215 [0,2,0,0,0,0|1,0,1]=4 2025 B10R1.65 CC1=NSC=C1S(=O)(=O)O MCULE-9602247787 [0,2,0,0,0,0|2,0,0]=4 2026 B10R1.65 O=S(=O)(Cl)C1=CNN=C1Br MCULE-4723351028 [0,2,0,0,0,0|1,0,1]=4 2027 B10R1.65 O=S(=O)(Cl)C1=CNN=C1Cl MCULE-7844640523 [0,2,0,0,0,0|1,0,1]=4 2028 B10R1.31 C=CN1C=C(C=N1)C(=O)O MCULE-3490878690 [0,2,0,0,0,0|0,0,0]=2 2029 B10R1.31 C=CN1C=C(C=N1)N(=O)=O MCULE-1920188468 [0,2,0,0,0,0|1,0,1]=4 2030 B10R1.31 CC(=O)C1=CNC(=C1)C=O MCULE-6111275994 [0,2,0,0,0,0|2,0,0]=4 2031 B10R1.31 CCC1=CC(=CS1)C(=O)O MCULE-8075303964 [0,2,0,0,0,0|2,0,0]=4 2032 B10R1.31 CCC1=CC(=NN1)C(=O)O MCULE-3840467199 [0,2,0,0,0,0|2,0,0]=4 2033 B10R1.31 CCC1=NC(=CN1)C(=O)O MCULE-2752293733 [0,2,0,0,0,0|2,0,0]=4 2034 B10R1.31 CCC1=NC(=CN1)C(=O)O MCULE-6638169843 [0,2,0,0,0,0|2,0,0]=4 2035 B10R1.31 CCC1=NC=C(O1)C(=O)O MCULE-6974665431 [0,2,0,0,0,0|2,0,0]=4 2036 B10R1.31 CCC1=NC=C(S1)C(=O)O MCULE-4881217857 [0,2,0,0,0,0|2,0,0]=4 2037 B10R1.31 CCC1=NOC(=C1)C(=O)O MCULE-2026983281 [0,2,0,0,0,0|2,0,0]=4 2038 B10R1.31 CCN1C=C(C=N1)B(O)O MCULE-6821925956 [0,2,0,0,0,0|1,0,1]=4 2039 B10R1.31 CCN1C=C(C=N1)C(=O)C MCULE-6113000335 [0,2,0,0,0,0|1,0,0]=3 2040 B10R1.31 CCN1C=C(C=N1)C(=O)Cl MCULE-7381573323 [0,2,0,0,0,0|1,0,0]=3 2041 B10R1.31 CCN1C=C(C=N1)C(=O)N MCULE-4811332049 [0,2,0,0,0,0|1,0,0]=3 2042 B10R1.31 CCN1C=C(C=N1)C(=O)O MCULE-8656819052 [0,2,0,0,0,0|0,0,0]=2 2043 B10R1.31 CCN1C=C(C=N1)C(C)O MCULE-3722865177 [0,2,0,0,0,0|1,0,1]=4 2044 B10R1.31 CCN1C=C(C=N1)N(=O)=O MCULE-5945021793 [0,2,0,0,0,0|1,0,1]=4 2045 B10R1.31 CCN1C=C(N=N1)C(=O)O MCULE-2501848280 [0,2,0,0,0,0|1,0,0]=3 2046 B10R1.31 CCN1C=CC(=C1)C(=O)O MCULE-4694241881 [0,2,0,0,0,0|1,0,0]=3 2047 B10R1.31 CCN1C=CC(=N1)C(=O)O MCULE-4757802727 [0,2,0,0,0,0|2,0,0]=4 2048 B10R1.31 CCN1C=NC(=C1)C(=O)O MCULE-3247647663 [0,2,0,0,0,0|2,0,0]=4 2049 B10R1.31 CCN1C=NC(=C1)C(=O)O MCULE-7934830591 [0,2,0,0,0,0|2,0,0]=4 2050 B10R1.31 CCN1N=CC(=N1)C(=O)O MCULE-8621521986 [0,2,0,0,0,0|1,0,0]=3 2051 B10R1.31 CNC1=NC=C(S1)C(=O)O MCULE-9263659165 [0,2,0,0,0,0|2,0,0]=4 2052 B10R1.31 COC1=CC(=NN1)C(=O)O MCULE-3382908600 [0,2,0,0,0,0|2,0,0]=4 2053 B10R1.31 COC1=NC=C(S1)C(=O)O MCULE-5280657902 [0,2,0,0,0,0|2,0,0]=4 2054 B10R1.31 COC1=NOC(=C1)C(=O)O MCULE-1544396702 [0,2,0,0,0,0|2,0,0]=4 2055 B10R1.31 COC1=NSC(=C1)C(=O)O MCULE-8714020849 [0,2,0,0,0,0|2,0,0]=4 2056 B10R1.31 CSC1=CC(=CO1)C(=O)O MCULE-7287309057 [0,2,0,0,0,0|2,0,0]=4 2057 B10R1.31 CSC1=CC(=CS1)C(=O)O MCULE-1968213227 [0,2,0,0,0,0|2,0,0]=4 2058 B10R1.31 CSC1=NC=C(S1)C(=O)O MCULE-9882599034 [0,2,0,0,0,0|2,0,0]=4 2059 B10R1.31 N#CC1=CC(=CN1)C(=O)O MCULE-5969144009 [0,2,0,0,0,0|1,0,0]=3 2060 B10R1.31 N#CC1=CC(=CO1)C(=O)O MCULE-3951716463 [0,2,0,0,0,0|2,0,0]=4 2061 B10R1.31 N#CC1=CC(=CS1)C(=O)O MCULE-9030698801 [0,2,0,0,0,0|2,0,0]=4 2062 B10R1.31 N#CC1=NC=C(S1)C(=O)O MCULE-7759671331 [0,2,0,0,0,0|2,0,0]=4 2063 B10R1.31 N#CC1=NNC(=C1)C(=O)O MCULE-8193426397 [0,2,0,0,0,0|2,0,0]=4 2064 B10R1.31 NCC1=CC(=CO1)C(=O)O MCULE-8009916414 [0,2,0,0,0,0|2,0,0]=4 2065 B10R1.31 NCC1=CC(=CO1)C(=O)O MCULE-8081573675 [0,2,0,0,0,0|2,0,0]=4 2066 B10R1.31 NCC1=NC(=CN1)C(=O)O MCULE-2422277377 [0,2,0,0,0,0|2,0,0]=4 2067 B10R1.31 NCC1=NC(=CN1)C(=O)O MCULE-3399916996 [0,2,0,0,0,0|2,0,0]=4 2068 B10R1.31 NCC1=NC=C(S1)C(=O)O MCULE-3946560323 [0,2,0,0,0,0|2,0,0]=4 2069 B10R1.31 NCC1=NC=C(S1)C(=O)O MCULE-7312147052 [0,2,0,0,0,0|2,0,0]=4 2070 B10R1.31 NCC1=NNC(=C1)C(=O)O MCULE-2100935430 [0,2,0,0,0,0|2,0,0]=4 2071 B10R1.31 NCC1=NNC(=C1)C(=O)O MCULE-5271280541 [0,2,0,0,0,0|2,0,0]=4 2072 B10R1.31 O=C(O)C1=CC(=NN1)CO MCULE-3574728390 [0,2,0,0,0,0|2,0,0]=4 2073 B10R1.31 O=C(O)C1=CN(N=C1)CO MCULE-8466058822 [0,2,0,0,0,0|0,0,0]=2 2074 B10R1.31 O=C(O)C1=CN=C(O1)CO MCULE-2494542728 [0,2,0,0,0,0|2,0,0]=4 2075 B10R1.31 O=C(O)C1=CN=C(S1)CO MCULE-4366462137 [0,2,0,0,0,0|2,0,0]=4 2076 B10R1.31 O=C(O)C1=COC(=C1)CO MCULE-1954413493 [0,2,0,0,0,0|2,0,0]=4 2077 B10R1.31 O=C(O)C1=NN(C=C1)CO MCULE-4711074129 [0,2,0,0,0,0|2,0,0]=4 2078 B10R1.31 O=CC1=CC(=CO1)C(=O)O MCULE-6941989821 [0,2,0,0,0,0|2,0,0]=4 2079 B10R1.31 O=CC1=CC(=CS1)C(=O)O MCULE-9793010071 [0,2,0,0,0,0|2,0,0]=4 2080 B10R1.31 O=CC1=NC=C(S1)C(=O)O MCULE-8787788779 [0,2,0,0,0,0|2,0,0]=4 2081 B10R1.31 O=N(=O)C1=CN(N=C1)CCl MCULE-1815222300 [0,2,0,0,0,0|1,0,1]=4 2082 B10R1.31 O=N(=O)C1=CN(N=C1)CO MCULE-4382530151 [0,2,0,0,0,0|1,0,1]=4 2083 B10R1.58 CC1=CC(=CN1C)C(=O)O MCULE-6713410524 [0,2,0,0,0,0|1,0,0]=3 2084 B10R1.58 CC1=CC(=NN1C)C(=O)O MCULE-3825001208 [0,2,0,0,0,0|2,0,0]=4 2085 B10R1.58 CC1=NC(=CN1C)C(=O)O MCULE-4837490088 [0,2,0,0,0,0|2,0,0]=4 2086 B10R1.58 CN1C=C(C=C1Br)C(=O)O MCULE-6956812091 [0,2,0,0,0,0|1,0,0]=3 2087 B10R1.58 CN1C=C(N=C1Br)C(=O)O MCULE-5854692838 [0,2,0,0,0,0|2,0,0]=4 2088 B10R1.58 CN1C=C(NC1=O)C(=O)O MCULE-2401585728 [0,2,0,0,0,0|2,0,0]=4 2089 B10R1.58 CN1N=C(C=C1Br)C(=O)O MCULE-7852923873 [0,2,0,0,0,0|2,0,0]=4 2090 B10R1.58 CN1N=C(C=C1Cl)C(=O)O MCULE-7347468266 [0,2,0,0,0,0|2,0,0]=4 2091 B10R1.58 CN1N=C(C=C1F)C(=O)O MCULE-5196585125 [0,2,0,0,0,0|2,0,0]=4 2092 B10R1.58 CN1N=C(C=C1I)C(=O)O MCULE-7683880423 [0,2,0,0,0,0|2,0,0]=4 2093 B10R1.58 CN1N=C(C=C1N)C(=O)O MCULE-2170248787 [0,2,0,0,0,0|2,0,0]=4 2094 B10R1.58 CN1N=C(C=C1N)C(=O)O MCULE-3031952383 [0,2,0,0,0,0|2,0,0]=4 2095 B10R1.58 CN1N=C(C=C1O)C(=O)O MCULE-7493978501 [0,2,0,0,0,0|2,0,0]=4 2096 B10R1.58 CN1OC(=CC1=O)C(=O)O MCULE-5351669299 [0,2,0,0,0,0|2,0,0]=4 2097 B10R1.59 CC(=O)C1=C(NC(=C1)C)C MCULE-6663248559 [0,2,0,0,0,0|2,0,0]=4 2098 B10R1.59 CC(=O)C1=CN(N=C1C)C MCULE-3905120764 [0,2,0,0,0,0|1,0,0]=3 2099 B10R1.59 CC1=C(C=C(O1)Br)C(=O)O MCULE-9399804066 [0,2,0,0,0,0|2,0,0]=4 2100 B10R1.59 CC1=C(C=C(S1)Br)C(=O)O MCULE-3979333205 [0,2,0,0,0,0|2,0,0]=4 2101 B10R1.59 CC1=C(NC(=N1)Br)C(=O)O MCULE-3307589222 [0,2,0,0,0,0|2,0,0]=4 2102 B10R1.59 CC1=C(NC(=O)N1)C(=O)O MCULE-4489172846 [0,2,0,0,0,0|2,0,0]=4 2103 B10R1.59 CC1=C(OC(=N1)Br)C(=O)O MCULE-6398954981 [0,2,0,0,0,0|2,0,0]=4 2104 B10R1.59 CC1=C(OC(=N1)I)C(=O)O MCULE-5497790148 [0,2,0,0,0,0|2,0,0]=4 2105 B10R1.59 CC1=C(SC(=N1)Br)C(=O)O MCULE-3932114661 [0,2,0,0,0,0|2,0,0]=4 2106 B10R1.59 CC1=C(SC(=N1)Cl)C(=O)O MCULE-4549195978 [0,2,0,0,0,0|2,0,0]=4 2107 B10R1.59 CC1=C(SC(=N1)I)C(=O)O MCULE-3820471269 [0,2,0,0,0,0|2,0,0]=4 2108 B10R1.59 CC1=C(SC(=N1)N)C(=O)O MCULE-3025372140 [0,2,0,0,0,0|2,0,0]=4 2109 B10R1.59 CC1=C(SC(=O)N1)C(=O)O MCULE-8001416115 [0,2,0,0,0,0|2,0,0]=4 2110 B10R1.59 CC1=C(SC(=S)N1)C(=O)O MCULE-6074061234 [0,2,0,0,0,0|2,0,0]=4 2111 B10R1.59 CC1=CC(=C(N1)C)C(=O)O MCULE-8264342260 [0,2,0,0,0,0|1,0,0]=3 2112 B10R1.59 CC1=CC(=C(O1)C)C(=O)O MCULE-6083512637 [0,2,0,0,0,0|2,0,0]=4 2113 B10R1.59 CC1=CC(=C(S1)Br)C(=O)O MCULE-5795316576 [0,2,0,0,0,0|2,0,0]=4 2114 B10R1.59 CC1=CC(=C(S1)C)C(=O)O MCULE-1096301669 [0,2,0,0,0,0|2,0,0]=4 2115 B10R1.59 CC1=CC(=C(S1)N)C(=O)O MCULE-8725784449 [0,2,0,0,0,0|2,0,0]=4 2116 B10R1.59 CC1=CC(=C([Se]1)C)C(=O)O MCULE-9043801301 [0,2,0,0,0,0|2,0,0]=4 2117 B10R1.59 CC1=CN(C=C1C(=O)O)C MCULE-4534414180 [0,2,0,0,0,0|1,0,0]=3 2118 B10R1.59 CC1=CN(N=C1C(=O)O)C MCULE-3597914180 [0,2,0,0,0,0|2,0,0]=4 2119 B10R1.59 CC1=CN(N=C1C(=O)O)C MCULE-5446759488 [0,2,0,0,0,0|2,0,0]=4 2120 B10R1.59 CC1=NC(=C(N1)C(=O)O)Cl MCULE-9321382640 [0,2,0,0,0,0|2,0,0]=4 2121 B10R1.59 CC1=NC(=C(N1)C)C(=O)O MCULE-2410908385 [0,2,0,0,0,0|2,0,0]=4 2122 B10R1.59 CC1=NC(=C(N1)C)C(=O)O MCULE-5000904113 [0,2,0,0,0,0|2,0,0]=4 2123 B10R1.59 CC1=NC(=C(O1)C(=O)O)C MCULE-6966085063 [0,2,0,0,0,0|2,0,0]=4 2124 B10R1.59 CC1=NC(=C(S1)C(=O)O)C MCULE-6275034447 [0,2,0,0,0,0|2,0,0]=4 2125 B10R1.59 CC1=NC(=C(S1)C(=O)O)O MCULE-5815813162 [0,2,0,0,0,0|2,0,0]=4 2126 B10R1.59 CC1=NN(C(=C1)C(=O)O)C MCULE-6579012974 [0,2,0,0,0,0|2,0,0]=4 2127 B10R1.59 CC1=NN(C=C1B(O)O)C MCULE-3028122776 [0,2,0,0,0,0|1,0,1]=4 2128 B10R1.59 CC1=NN(C=C1C(=O)Cl)C MCULE-9237969940 [0,2,0,0,0,0|1,0,0]=3 2129 B10R1.59 CC1=NN(C=C1C(=O)N)C MCULE-9357472300 [0,2,0,0,0,0|1,0,0]=3 2130 B10R1.59 CC1=NN(C=C1C(=O)O)C MCULE-7471080463 [0,2,0,0,0,0|0,0,0]=2 2131 B10R1.59 CC1=NN(C=C1C(=O)O)C MCULE-9433058172 [0,2,0,0,0,0|0,0,0]=2 2132 B10R1.59 CC1=NN(C=C1C(C)O)C MCULE-8507144151 [0,2,0,0,0,0|1,0,1]=4 2133 B10R1.59 CC1=NN(C=C1N(=O)=O)C MCULE-2913890567 [0,2,0,0,0,0|1,0,1]=4 2134 B10R1.59 CN1C=C(C(=N1)Br)C(=O)O MCULE-2048584298 [0,2,0,0,0,0|0,0,0]=2 2135 B10R1.59 CN1C=C(C(=N1)Br)N(=O)=O MCULE-8826181913 [0,2,0,0,0,0|1,0,1]=4 2136 B10R1.59 CN1C=C(C(=N1)C(=O)O)Br MCULE-2394473157 [0,2,0,0,0,0|2,0,0]=4 2137 B10R1.59 CN1C=C(C(=N1)C(=O)O)Cl MCULE-3517141799 [0,2,0,0,0,0|2,0,0]=4 2138 B10R1.59 CN1C=C(C(=N1)C(=O)O)F MCULE-6538919895 [0,2,0,0,0,0|2,0,0]=4 2139 B10R1.59 CN1C=C(C(=N1)C(=O)O)I MCULE-3541390694 [0,2,0,0,0,0|2,0,0]=4 2140 B10R1.59 CN1C=C(C(=N1)C(=O)O)N MCULE-1195481233 [0,2,0,0,0,0|2,0,0]=4 2141 B10R1.59 CN1C=C(C(=N1)C(=O)O)N MCULE-4660390916 [0,2,0,0,0,0|2,0,0]=4 2142 B10R1.59 CN1C=C(C(=N1)C(=O)O)S MCULE-5703324576 [0,2,0,0,0,0|2,0,0]=4 2143 B10R1.59 CN1C=C(C(=N1)Cl)C(=O)O MCULE-6978988518 [0,2,0,0,0,0|0,0,0]=2 2144 B10R1.59 CN1C=C(C(=N1)Cl)N(=O)=O MCULE-1712335724 [0,2,0,0,0,0|1,0,1]=4 2145 B10R1.59 CN1C=C(C(=N1)F)C(=O)O MCULE-4458975659 [0,2,0,0,0,0|0,0,0]=2 2146 B10R1.59 CN1C=C(C(=N1)F)N(=O)=O MCULE-6597167562 [0,2,0,0,0,0|1,0,1]=4 2147 B10R1.59 CN1C=C(C(=N1)I)C(=O)O MCULE-6388844527 [0,2,0,0,0,0|0,0,0]=2 2148 B10R1.59 CN1C=C(C(=N1)I)N(=O)=O MCULE-7842550495 [0,2,0,0,0,0|1,0,1]=4 2149 B10R1.59 CN1C=C(C(=N1)N)C(=O)N MCULE-2910039073 [0,2,0,0,0,0|1,0,0]=3 2150 B10R1.59 CN1C=C(C(=N1)N)C(=O)O MCULE-1756259801 [0,2,0,0,0,0|0,0,0]=2 2151 B10R1.59 CN1C=C(C(=N1)N)N(=O)=O MCULE-4242301813 [0,2,0,0,0,0|1,0,1]=4 2152 B10R1.59 CN1C=C(C(=N1)O)C(=O)O MCULE-9102308034 [0,2,0,0,0,0|0,0,0]=2 2153 B10R1.59 CN1C=C(C(=N1)O)N(=O)=O MCULE-2348615961 [0,2,0,0,0,0|1,0,1]=4 2154 B10R1.59 CN1N=C(C=C1C(=O)O)Br MCULE-8735932932 [0,2,0,0,0,0|2,0,0]=4 2155 B10R1.59 CN1N=C(C=C1C(=O)O)Cl MCULE-7001400278 [0,2,0,0,0,0|2,0,0]=4 2156 B10R1.59 CN1N=C(C=C1C(=O)O)F MCULE-3464026753 [0,2,0,0,0,0|2,0,0]=4 2157 B10R1.59 CN1N=C(C=C1C(=O)O)I MCULE-6413010644 [0,2,0,0,0,0|2,0,0]=4 2158 B10R1.59 CN1N=C(C=C1C(=O)O)N MCULE-4098716532 [0,2,0,0,0,0|2,0,0]=4 2159 B10R1.59 CN1N=C(C=C1C(=O)O)N MCULE-6005121841 [0,2,0,0,0,0|2,0,0]=4 2160 B10R1.59 CN1N=C(C=C1C(=O)O)O MCULE-4041256083 [0,2,0,0,0,0|2,0,0]=4 2161 B10R1.59 NC1=NC(=C(S1)C(=O)O)Cl MCULE-3839923725 [0,2,0,0,0,0|2,0,0]=4 2162 B10R1.59 O=C(O)C1=C(N=C(S1)Br)Br MCULE-4413282612 [0,2,0,0,0,0|2,0,0]=4 2163 B10R1.59 O=C(O)C1=C(N=C(S1)Br)Cl MCULE-9892262655 [0,2,0,0,0,0|2,0,0]=4 2164 B10R1.59 O=C(O)C1=C(N=C(S1)Cl)Cl MCULE-3202218564 [0,2,0,0,0,0|2,0,0]=4 2165 B10R1.59 O=C(O)C1=C(OC(=C1)Br)Br MCULE-7340286931 [0,2,0,0,0,0|2,0,0]=4 2166 B10R1.59 O=C(O)C1=C(SC(=C1)Br)Br MCULE-6740777616 [0,2,0,0,0,0|2,0,0]=4 2167 B10R1.59 O=C(O)C1=C(SC(=C1)Br)Cl MCULE-6593014496 [0,2,0,0,0,0|2,0,0]=4 2168 B10R1.59 O=C(O)C1=C(SC(=C1)Cl)Br MCULE-6709414623 [0,2,0,0,0,0|2,0,0]=4 2169 B10R1.59 O=C(O)C1=C(SC(=C1)Cl)Cl MCULE-9687878787 [0,2,0,0,0,0|2,0,0]=4 2170 B10R1.194 C=C1C(=O)OC=C1C(=O)O MCULE-2170452031 [0,2,0,0,0,0|2,0,0]=4 2171 B10R1.194 CC(=O)C1=C(N(N=C1)C)C MCULE-9536534918 [0,2,0,0,0,0|1,0,0]=3 2172 B10R1.194 CC(=O)C1=C(N(N=C1)C)Cl MCULE-6125798265 [0,2,0,0,0,0|1,0,0]=3 2173 B10R1.194 CC(=O)C1=C(N(N=C1)C)N MCULE-4300735023 [0,2,0,0,0,0|1,0,0]=3 2174 B10R1.194 CC(=O)C1=C(N(N=N1)C)C MCULE-2595775497 [0,2,0,0,0,0|2,0,0]=4 2175 B10R1.194 CC(=O)C1=CNC(=C1C)Br MCULE-1287297622 [0,2,0,0,0,0|2,0,0]=4 2176 B10R1.194 CC1=C(C(=CS1)C(=O)O)C MCULE-5616649297 [0,2,0,0,0,0|2,0,0]=4 2177 B10R1.194 CC1=C(C(=CS1)C(=O)O)N MCULE-9639122588 [0,2,0,0,0,0|2,0,0]=4 2178 B10R1.194 CC1=C(C(=NN1)C(=O)O)Br MCULE-6209499257 [0,2,0,0,0,0|2,0,0]=4 2179 B10R1.194 CC1=C(C(=NN1)C(=O)O)C MCULE-3611962040 [0,2,0,0,0,0|2,0,0]=4 2180 B10R1.194 CC1=C(C(=NN1)C(=O)O)Cl MCULE-5399802501 [0,2,0,0,0,0|2,0,0]=4 2181 B10R1.194 CC1=C(C(=NN1)C(=O)O)F MCULE-2377075490 [0,2,0,0,0,0|2,0,0]=4 2182 B10R1.194 CC1=C(C(=NN1)C(=O)O)F MCULE-9194472437 [0,2,0,0,0,0|2,0,0]=4 2183 B10R1.194 CC1=C(C(=NN1)C(=O)O)N MCULE-8578542406 [0,2,0,0,0,0|2,0,0]=4 2184 B10R1.194 CC1=C(C(=NN1)C(=O)O)O MCULE-3278182601 [0,2,0,0,0,0|2,0,0]=4 2185 B10R1.194 CC1=C(C=CN1C)C(=O)O MCULE-2749853338 [0,2,0,0,0,0|1,0,0]=3 2186 B10R1.194 CC1=C(C=NN1C)B(O)O MCULE-7516829701 [0,2,0,0,0,0|1,0,1]=4 2187 B10R1.194 CC1=C(C=NN1C)C(=O)Cl MCULE-3963400988 [0,2,0,0,0,0|1,0,0]=3 2188 B10R1.194 CC1=C(C=NN1C)C(=O)N MCULE-7941167333 [0,2,0,0,0,0|1,0,0]=3 2189 B10R1.194 CC1=C(C=NN1C)C(=O)O MCULE-6457645161 [0,2,0,0,0,0|0,0,0]=2 2190 B10R1.194 CC1=C(C=NN1C)C(C)O MCULE-5647743777 [0,2,0,0,0,0|1,0,1]=4 2191 B10R1.194 CC1=C(C=NN1C)N(=O)=O MCULE-2195821248 [0,2,0,0,0,0|1,0,1]=4 2192 B10R1.194 CC1=C(N=CN1C)C(=O)O MCULE-7299540284 [0,2,0,0,0,0|2,0,0]=4 2193 B10R1.194 CC1=C(N=NN1C)C(=O)O MCULE-1364508990 [0,2,0,0,0,0|1,0,0]=3 2194 B10R1.194 CC1=C(NN=C1C(=O)O)Br MCULE-4548617590 [0,2,0,0,0,0|2,0,0]=4 2195 B10R1.194 CC1=C(NNC1=O)C(=O)O MCULE-2982850514 [0,2,0,0,0,0|2,0,0]=4 2196 B10R1.194 CC1=C(SC=C1C(=O)O)Br MCULE-1958566161 [0,2,0,0,0,0|2,0,0]=4 2197 B10R1.194 CC1=NC=C(N1C)C(=O)O MCULE-6538495729 [0,2,0,0,0,0|2,0,0]=4 2198 B10R1.194 CC1=NC=C(N1C)C(=O)O MCULE-9483806880 [0,2,0,0,0,0|2,0,0]=4 2199 B10R1.194 CC1=NNC(=C1I)C(=O)O MCULE-2388517020 [0,2,0,0,0,0|2,0,0]=4 2200 B10R1.194 CC1=NOC(=C1Br)C(=O)O MCULE-8196267325 [0,2,0,0,0,0|2,0,0]=4 2201 B10R1.194 CC1=NOC(=C1C)C(=O)O MCULE-3262584949 [0,2,0,0,0,0|2,0,0]=4 2202 B10R1.194 CC1=NOC(=C1Cl)C(=O)O MCULE-6918971398 [0,2,0,0,0,0|2,0,0]=4 2203 B10R1.194 CC1=NOC(=C1N)C(=O)O MCULE-1575869220 [0,2,0,0,0,0|2,0,0]=4 2204 B10R1.194 CC1=NSC(=C1Br)C(=O)O MCULE-6726089456 [0,2,0,0,0,0|2,0,0]=4 2205 B10R1.194 CC1=NSC(=C1N)C(=O)O MCULE-7279357937 [0,2,0,0,0,0|2,0,0]=4 2206 B10R1.194 CC1=NSC(=C1N)C(=O)O MCULE-9080489716 [0,2,0,0,0,0|2,0,0]=4 2207 B10R1.194 CN1C(=CN=C1Br)C(=O)O MCULE-9790399681 [0,2,0,0,0,0|2,0,0]=4 2208 B10R1.194 CN1C(=CN=C1Cl)C(=O)O MCULE-6008588560 [0,2,0,0,0,0|2,0,0]=4 2209 B10R1.194 CN1C(=CN=C1S)C(=O)O MCULE-3653326496 [0,2,0,0,0,0|2,0,0]=4 2210 B10R1.194 CN1C(=O)NC=C1C(=O)O MCULE-5867936313 [0,2,0,0,0,0|2,0,0]=4 2211 B10R1.194 CN1C=NC(=C1N)C(=O)O MCULE-4389496088 [0,2,0,0,0,0|2,0,0]=4 2212 B10R1.194 CN1N=CC(=C1Br)C(=O)O MCULE-8726846672 [0,2,0,0,0,0|0,0,0]=2 2213 B10R1.194 CN1N=CC(=C1Br)N(=O)=O MCULE-1725022055 [0,2,0,0,0,0|1,0,1]=4 2214 B10R1.194 CN1N=CC(=C1Cl)C(=O)Cl MCULE-7699583434 [0,2,0,0,0,0|1,0,0]=3 2215 B10R1.194 CN1N=CC(=C1Cl)C(=O)N MCULE-2621680138 [0,2,0,0,0,0|1,0,0]=3 2216 B10R1.194 CN1N=CC(=C1Cl)C(=O)O MCULE-7396887829 [0,2,0,0,0,0|0,0,0]=2 2217 B10R1.194 CN1N=CC(=C1Cl)N(=O)=O MCULE-8905481286 [0,2,0,0,0,0|1,0,1]=4 2218 B10R1.194 CN1N=CC(=C1F)C(=O)Cl MCULE-9381531379 [0,2,0,0,0,0|1,0,0]=3 2219 B10R1.194 CN1N=CC(=C1F)C(=O)N MCULE-8349112918 [0,2,0,0,0,0|1,0,0]=3 2220 B10R1.194 CN1N=CC(=C1F)C(=O)O MCULE-1095006011 [0,2,0,0,0,0|0,0,0]=2 2221 B10R1.194 CN1N=CC(=C1I)C(=O)O MCULE-3948004824 [0,2,0,0,0,0|0,0,0]=2 2222 B10R1.194 CN1N=CC(=C1I)N(=O)=O MCULE-3506675033 [0,2,0,0,0,0|1,0,1]=4 2223 B10R1.194 CN1N=CC(=C1N)C(=O)N MCULE-2472130885 [0,2,0,0,0,0|1,0,0]=3 2224 B10R1.194 CN1N=CC(=C1N)C(=O)O MCULE-1364711767 [0,2,0,0,0,0|0,0,0]=2 2225 B10R1.194 CN1N=CC(=C1N)N(=O)=O MCULE-2448811130 [0,2,0,0,0,0|1,0,1]=4 2226 B10R1.194 CN1N=CC(=C1O)C(=O)O MCULE-7765035193 [0,2,0,0,0,0|0,0,0]=2 2227 B10R1.194 CN1N=NC(=C1N)C(=O)N MCULE-4175172077 [0,2,0,0,0,0|2,0,0]=4 2228 B10R1.194 CN1N=NC(=C1N)C(=O)O MCULE-3226856210 [0,2,0,0,0,0|1,0,0]=3 2229 B10R1.194 CN1N=NC(=C1[O-])C(=O)N MCULE-4023454511 [0,2,0,0,0,0|2,0,0]=4 2230 B10R1.194 CN1N=NC(=C1[O-])C(=O)N MCULE-8948181526 [0,2,0,0,0,0|2,0,0]=4 2231 B10R1.194 CN1NC=C(C1=O)C(=O)O MCULE-3419529586 [0,2,0,0,0,0|0,0,1]=3 2232 B10R1.194 NC1=NNC(=C1Br)C(=O)O MCULE-5054788672 [0,2,0,0,0,0|2,0,0]=4 2233 B10R1.194 NC1=NNC(=C1Cl)C(=O)O MCULE-2623268506 [0,2,0,0,0,0|2,0,0]=4 2234 B10R1.194 NC1=NNC(=C1Cl)C(=O)O MCULE-8376724259 [0,2,0,0,0,0|2,0,0]=4 2235 B10R1.194 NC1=NNC(=C1I)C(=O)O MCULE-1188524456 [0,2,0,0,0,0|2,0,0]=4 2236 B10R1.194 O=C(O)C1=C(C(=NN1)Br)Br MCULE-5260191539 [0,2,0,0,0,0|2,0,0]=4 2237 B10R1.194 O=C(O)C1=C(C(=NS1)Cl)Cl MCULE-3663688933 [0,2,0,0,0,0|2,0,0]=4 2238 B10R1.194 O=C(O)C1=C(C(=NS1)O)Cl MCULE-1577231541 [0,2,0,0,0,0|2,0,0]=4 2239 B10R1.194 O=C(O)C1=CSC(=C1Br)Br MCULE-9977866887 [0,2,0,0,0,0|2,0,0]=4 2240 B10R1.194 O=C(O)C1=CSC(=C1Br)I MCULE-3021606207 [0,2,0,0,0,0|2,0,0]=4 2241 B10R1.194 O=C(O)C1=CSC(=C1Cl)Cl MCULE-8811291818 [0,2,0,0,0,0|2,0,0]=4 2242 B10R1.194 O=C(O)C1=NNC(=C1Cl)Cl MCULE-7681212649 [0,2,0,0,0,0|2,0,0]=4 2243 B10R1.39 C=CN1N=CC=C1C(=O)O MCULE-5917448333 [0,2,0,0,0,0|2,0,0]=4 2244 B10R1.39 CCC1=C(C=CN1)C(=O)O MCULE-6354695157 [0,2,0,0,0,0|1,0,0]=3 2245 B10R1.39 CCC1=C(C=CO1)C(=O)O MCULE-3678135782 [0,2,0,0,0,0|2,0,0]=4 2246 B10R1.39 CCC1=C(C=CS1)C(=O)O MCULE-8509523486 [0,2,0,0,0,0|2,0,0]=4 2247 B10R1.39 CCC1=C(C=NN1)C(=O)O MCULE-9120353135 [0,2,0,0,0,0|0,0,0]=2 2248 B10R1.39 CCC1=C(C=NO1)C(=O)O MCULE-8729370633 [0,2,0,0,0,0|1,0,0]=3 2249 B10R1.39 CCC1=C(NC=N1)C(=O)O MCULE-6536232856 [0,2,0,0,0,0|2,0,0]=4 2250 B10R1.39 CCC1=C(NC=N1)C(=O)O MCULE-7161764556 [0,2,0,0,0,0|2,0,0]=4 2251 B10R1.39 CCC1=C(OC=N1)C(=O)O MCULE-1650785386 [0,2,0,0,0,0|2,0,0]=4 2252 B10R1.39 CCC1=C(ON=C1)C(=O)O MCULE-3250458339 [0,2,0,0,0,0|2,0,0]=4 2253 B10R1.39 CCC1=C(SC=N1)C(=O)O MCULE-6772114465 [0,2,0,0,0,0|2,0,0]=4 2254 B10R1.39 CCC1=C(SN=N1)C(=O)O MCULE-5444307481 [0,2,0,0,0,0|1,0,1]=4 2255 B10R1.39 CCC1=CNC=C1C(=O)O MCULE-2156378229 [0,2,0,0,0,0|1,0,0]=3 2256 B10R1.39 CCC1=CSC=C1C(=O)O MCULE-8937787346 [0,2,0,0,0,0|2,0,0]=4 2257 B10R1.39 CCC1=NNC=C1N(=O)=O MCULE-2684186287 [0,2,0,0,0,0|1,0,1]=4 2258 B10R1.39 CCC1=NOC=C1C(=O)O MCULE-8447215387 [0,2,0,0,0,0|1,0,0]=3 2259 B10R1.39 CCC1=NON=C1C(=O)O MCULE-8022235091 [0,2,0,0,0,0|2,0,0]=4 2260 B10R1.39 CCN1C=NC=C1C(=O)O MCULE-3950331627 [0,2,0,0,0,0|2,0,0]=4 2261 B10R1.39 CCN1C=NC=C1C(=O)O MCULE-9319904210 [0,2,0,0,0,0|2,0,0]=4 2262 B10R1.39 CCN1N=CC=C1C(=O)O MCULE-9083355173 [0,2,0,0,0,0|2,0,0]=4 2263 B10R1.39 CCN1N=NC=C1C(=O)O MCULE-9682306181 [0,2,0,0,0,0|1,0,1]=4 2264 B10R1.39 CNC1=C(C=NN1)N(=O)=O MCULE-9230298591 [0,2,0,0,0,0|1,0,1]=4 2265 B10R1.39 CNC1=NSN=C1C(=O)O MCULE-6072700183 [0,2,0,0,0,0|2,0,0]=4 2266 B10R1.39 COC1=C(C=CS1)C(=O)O MCULE-8538241423 [0,2,0,0,0,0|2,0,0]=4 2267 B10R1.39 COC1=C(C=NN1)N(=O)=O MCULE-9381739275 [0,2,0,0,0,0|1,0,1]=4 2268 B10R1.39 COC1=CSC=C1C(=O)O MCULE-6921030563 [0,2,0,0,0,0|2,0,0]=4 2269 B10R1.39 COC1=NNC=C1C(=O)O MCULE-4779362091 [0,2,0,0,0,0|0,0,0]=2 2270 B10R1.39 COC1=NSC=C1C(=O)C MCULE-1423150976 [0,2,0,0,0,0|2,0,0]=4 2271 B10R1.39 COC1=NSC=C1C(=O)O MCULE-6831748504 [0,2,0,0,0,0|1,0,0]=3 2272 B10R1.39 CSC1=C(C=CS1)C(=O)O MCULE-8918500009 [0,2,0,0,0,0|2,0,0]=4 2273 B10R1.39 N#CC1=C(C=CS1)C(=O)O MCULE-1445140257 [0,2,0,0,0,0|2,0,0]=4 2274 B10R1.39 N#CC1=C(NN=C1)C(=O)O MCULE-2808193073 [0,2,0,0,0,0|2,0,0]=4 2275 B10R1.39 N#CC1=CNN=C1C(=O)O MCULE-7154264011 [0,2,0,0,0,0|2,0,0]=4 2276 B10R1.39 N#CC1=CSC=C1C(=O)O MCULE-6949049854 [0,2,0,0,0,0|2,0,0]=4 2277 B10R1.39 N#CC1=NNC=C1N(=O)=O MCULE-9841001652 [0,2,0,0,0,0|1,0,1]=4 2278 B10R1.39 NCC1=C(C=CO1)C(=O)O MCULE-2445597682 [0,2,0,0,0,0|2,0,0]=4 2279 B10R1.39 NCC1=C(C=CO1)C(=O)O MCULE-6855365670 [0,2,0,0,0,0|2,0,0]=4 2280 B10R1.39 NCC1=NOC=C1C(=O)O MCULE-1070042942 [0,2,0,0,0,0|1,0,0]=3 2281 B10R1.39 O=C(O)C1=C(N=CN1)CO MCULE-4632207762 [0,2,0,0,0,0|2,0,0]=4 2282 B10R1.39 O=C(O)C1=C(N=NS1)CO MCULE-6409459624 [0,2,0,0,0,0|1,0,1]=4 2283 B10R1.39 O=C(O)C1=C(OC=C1)CBr MCULE-7195288663 [0,2,0,0,0,0|2,0,0]=4 2284 B10R1.39 O=C(O)C1=C(ON=C1)CCl MCULE-7952982460 [0,2,0,0,0,0|1,0,0]=3 2285 B10R1.39 O=CC1=C(C=CO1)C(=O)O MCULE-6471557174 [0,2,0,0,0,0|2,0,0]=4 2286 B10R1.39 O=CC1=C(C=CS1)C(=O)O MCULE-8929121379 [0,2,0,0,0,0|2,0,0]=4 2287 B10R1.39 O=CC1=C(NC=N1)C(=O)O MCULE-2846806296 [0,2,0,0,0,0|2,0,0]=4 2288 B10R1.39 O=CC1=CNN=C1C(=O)O MCULE-9816954326 [0,2,0,0,0,0|2,0,0]=4 2289 B10R1.39 O=CC1=CSC=C1C(=O)O MCULE-6099035678 [0,2,0,0,0,0|2,0,0]=4 2290 B10R1.39 O=N(=O)C1=C(NN=C1)CO MCULE-1177309535 [0,2,0,0,0,0|1,0,1]=4 2291 B10R1.192 CC(=O)C1=C(NC=C1C)C MCULE-3177341467 [0,2,0,0,0,0|2,0,0]=4 2292 B10R1.192 CC(=O)C1=C(NN=C1C)C MCULE-4549522309 [0,2,0,0,0,0|1,0,0]=3 2293 B10R1.192 CC(=O)C1=C(NN=C1C)N MCULE-1229130122 [0,2,0,0,0,0|1,0,0]=3 2294 B10R1.192 CC(=O)C1=C(NN=C1C)N MCULE-3038332601 [0,2,0,0,0,0|1,0,0]=3 2295 B10R1.192 CC(=O)C1=C(NNC1=O)C MCULE-8264085098 [0,2,0,0,0,0|1,0,1]=4 2296 B10R1.192 CC(=O)C1=C(ON=C1C)C MCULE-6909883836 [0,2,0,0,0,0|2,0,0]=4 2297 B10R1.192 CC(=O)C1=C(SN=C1C)N MCULE-1468637031 [0,2,0,0,0,0|2,0,0]=4 2298 B10R1.192 CC(=O)C1=C(SN=C1C)N MCULE-8505043976 [0,2,0,0,0,0|2,0,0]=4 2299 B10R1.192 CC1=C(C(=NN1)F)C(=O)O MCULE-3877824839 [0,2,0,0,0,0|0,0,0]=2 2300 B10R1.192 CC1=C(C(=NN1)N)C(=O)N MCULE-6920775732 [0,2,0,0,0,0|1,0,0]=3 2301 B10R1.192 CC1=C(C(=NN1)N)N(=O)=O MCULE-2052877342 [0,2,0,0,0,0|1,0,1]=4 2302 B10R1.192 CC1=C(C(=NO1)Br)C(=O)O MCULE-4508348638 [0,2,0,0,0,0|1,0,0]=3 2303 B10R1.192 CC1=C(C(=NO1)O)C(=O)O MCULE-8602854846 [0,2,0,0,0,0|1,0,0]=3 2304 B10R1.192 CC1=C(N(C=N1)C)C(=O)O MCULE-1447636281 [0,2,0,0,0,0|2,0,0]=4 2305 B10R1.192 CC1=C(N(C=N1)C)C(=O)O MCULE-2625001449 [0,2,0,0,0,0|2,0,0]=4 2306 B10R1.192 CC1=C(N(N=C1)C)C(=O)O MCULE-1318304278 [0,2,0,0,0,0|2,0,0]=4 2307 B10R1.192 CC1=C(N(N=N1)C)C(=O)O MCULE-2403464045 [0,2,0,0,0,0|1,0,1]=4 2308 B10R1.192 CC1=CNC(=C1C(=O)O)C MCULE-2733757506 [0,2,0,0,0,0|1,0,0]=3 2309 B10R1.192 CC1=COC(=C1C(=O)O)C MCULE-5662027641 [0,2,0,0,0,0|2,0,0]=4 2310 B10R1.192 CC1=CSC(=C1C(=O)O)C MCULE-1936059424 [0,2,0,0,0,0|2,0,0]=4 2311 B10R1.192 CC1=CSC(=C1C(=O)O)Cl MCULE-6302017788 [0,2,0,0,0,0|2,0,0]=4 2312 B10R1.192 CC1=CSC(=C1C(=O)O)I MCULE-8869233503 [0,2,0,0,0,0|2,0,0]=4 2313 B10R1.192 CC1=CSC(=C1C(=O)O)N MCULE-2634110728 [0,2,0,0,0,0|2,0,0]=4 2314 B10R1.192 CC1=NNC(=C1B(O)O)C MCULE-4635742998 [0,2,0,0,0,0|1,0,1]=4 2315 B10R1.192 CC1=NNC(=C1B(O)O)C MCULE-5817551203 [0,2,0,0,0,0|1,0,1]=4 2316 B10R1.192 CC1=NNC(=C1C(=O)N)N MCULE-3387039030 [0,2,0,0,0,0|1,0,0]=3 2317 B10R1.192 CC1=NNC(=C1C(=O)O)Br MCULE-9846547929 [0,2,0,0,0,0|0,0,0]=2 2318 B10R1.192 CC1=NNC(=C1C(=O)O)C MCULE-8131288281 [0,2,0,0,0,0|0,0,0]=2 2319 B10R1.192 CC1=NNC(=C1C(=O)O)Cl MCULE-7631496399 [0,2,0,0,0,0|0,0,0]=2 2320 B10R1.192 CC1=NNC(=C1C(C)O)C MCULE-2223889819 [0,2,0,0,0,0|1,0,1]=4 2321 B10R1.192 CC1=NNC(=C1N(=O)=O)C MCULE-2345917127 [0,2,0,0,0,0|1,0,1]=4 2322 B10R1.192 CC1=NNC(=C1N(=O)=O)Cl MCULE-7485484858 [0,2,0,0,0,0|1,0,1]=4 2323 B10R1.192 CC1=NNC(=C1N(=O)=O)N MCULE-1316182025 [0,2,0,0,0,0|1,0,1]=4 2324 B10R1.192 CC1=NOC(=C1C(=O)Cl)C MCULE-8932775251 [0,2,0,0,0,0|2,0,0]=4 2325 B10R1.192 CC1=NOC(=C1C(=O)N)C MCULE-4408093963 [0,2,0,0,0,0|2,0,0]=4 2326 B10R1.192 CC1=NOC(=C1C(=O)N)N MCULE-2417520187 [0,2,0,0,0,0|2,0,0]=4 2327 B10R1.192 CC1=NOC(=C1C(=O)O)C MCULE-1008791205 [0,2,0,0,0,0|1,0,0]=3 2328 B10R1.192 CC1=NOC(=C1C(=O)O)N MCULE-8800430061 [0,2,0,0,0,0|1,0,0]=3 2329 B10R1.192 CC1=NSC(=C1C(=O)N)I MCULE-1056276434 [0,2,0,0,0,0|2,0,0]=4 2330 B10R1.192 CC1=NSC(=C1C(=O)N)N MCULE-1546890234 [0,2,0,0,0,0|2,0,0]=4 2331 B10R1.192 CC1=NSC(=C1C(=O)O)Br MCULE-6889945628 [0,2,0,0,0,0|1,0,0]=3 2332 B10R1.192 CC1=NSC(=C1C(=O)O)C MCULE-9813826118 [0,2,0,0,0,0|1,0,0]=3 2333 B10R1.192 CC1=NSC(=C1C(=O)O)Cl MCULE-9866278152 [0,2,0,0,0,0|1,0,0]=3 2334 B10R1.192 CC1=NSC(=C1C(=O)O)I MCULE-5173264784 [0,2,0,0,0,0|1,0,0]=3 2335 B10R1.192 CC1=NSC(=C1C(=O)O)N MCULE-4038153983 [0,2,0,0,0,0|1,0,0]=3 2336 B10R1.192 CN1C=NC(=C1C(=O)O)N MCULE-2274580761 [0,2,0,0,0,0|2,0,0]=4 2337 B10R1.192 CN1N=CC(=C1C(=O)O)Br MCULE-4991918679 [0,2,0,0,0,0|2,0,0]=4 2338 B10R1.192 CN1N=CC(=C1C(=O)O)Cl MCULE-2636357172 [0,2,0,0,0,0|2,0,0]=4 2339 B10R1.192 CN1N=CC(=C1C(=O)O)I MCULE-4061389143 [0,2,0,0,0,0|2,0,0]=4 2340 B10R1.192 CN1N=CC(=C1C(=O)O)N MCULE-7628421561 [0,2,0,0,0,0|2,0,0]=4 2341 B10R1.192 CN1N=CC(=C1C(=O)O)N MCULE-8678776001 [0,2,0,0,0,0|2,0,0]=4 2342 B10R1.192 CN1N=CC(=C1C(=O)O)S MCULE-9430261889 [0,2,0,0,0,0|2,0,0]=4 2343 B10R1.192 CN1N=NC(=C1C(=O)O)Br MCULE-1367242551 [0,2,0,0,0,0|1,0,1]=4 2344 B10R1.192 NC(=O)C1=C(NN=C1N)Br MCULE-2480958437 [0,2,0,0,0,0|1,0,0]=3 2345 B10R1.192 NC(=O)C1=C(SN=C1Cl)Br MCULE-9091081023 [0,2,0,0,0,0|2,0,0]=4 2346 B10R1.192 NC(=O)C1=C(SN=C1Cl)Cl MCULE-8329543579 [0,2,0,0,0,0|2,0,0]=4 2347 B10R1.192 NC(=O)C1=C(SN=C1Cl)I MCULE-8897131575 [0,2,0,0,0,0|2,0,0]=4 2348 B10R1.192 NC1=C(C(=NN1)Br)C(=O)O MCULE-8622438301 [0,2,0,0,0,0|0,0,0]=2 2349 B10R1.192 NC1=C(C(=NS1)Cl)C(=O)O MCULE-5318389435 [0,2,0,0,0,0|1,0,0]=3 2350 B10R1.192 NC1=C(C(=O)NN1)C(=O)O MCULE-5399437502 [0,2,0,0,0,0|0,0,1]=3 2351 B10R1.192 NC1=NNC(=C1N(=O)=O)N MCULE-5369606095 [0,2,0,0,0,0|1,0,1]=4 2352 B10R1.192 O=C(O)C1=C(NN=C1Br)Br MCULE-3622534291 [0,2,0,0,0,0|0,0,0]=2 2353 B10R1.192 O=C(O)C1=C(SC=C1Cl)Cl MCULE-5330809707 [0,2,0,0,0,0|2,0,0]=4 2354 B10R1.192 O=C(O)C1=C(SN=C1Cl)Br MCULE-5436294672 [0,2,0,0,0,0|1,0,0]=3 2355 B10R1.192 O=C(O)C1=C(SN=C1Cl)Cl MCULE-8023069924 [0,2,0,0,0,0|1,0,0]=3 2356 B10R1.192 O=C([O-])C1=C(SN=C1O)S MCULE-5613558421 [0,2,0,0,0,0|1,0,1]=4 2357 B10R1.192 O=C([O-])C1=C(SN=C1[O-])[S-] MCULE-2193948420 [0,2,0,0,0,0|1,0,1]=4 2358 B10R1.192 O=N(=O)C1=C(NN=C1Br)Br MCULE-6736372315 [0,2,0,0,0,0|1,0,1]=4 2359 B8R1.4 O=C1C=CNC(=O)O1 MCULE-3791093466 [0,0,1,1,0,0|2,0,0]=4 2360 B10R2.2 BrC1=CC2=C(S1)NN=C2 MCULE-2495637069 [0,0,0,1,0,1|1,1,0]=4 2361 B10R2.2 O=C1CC2=C(C1)NC=C2 MCULE-6737209084 [0,0,0,1,0,1|2,0,0]=4 2362 B10R2.32 NC1=NNC2=C1C=NN2 MCULE-4769190900 [0,1,0,1,0,0|2,0,0]=4 2363 B10R2.32 O=C1CCC2=C1C=NN2 MCULE-9219454613 [0,1,0,1,0,0|1,0,0]=3 2364 B10R2.32 O=C1CCC2=CNC=C12 MCULE-7142016383 [0,1,0,1,0,0|2,0,0]=4 2365 B10R2.32 O=C1OCC2=NON=C12 MCULE-7083419972 [0,1,0,1,0,0|2,0,0]=4 2366 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [0,0,0,0,2,0|0,0,2]=4 2367 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [0,0,0,0,2,0|0,0,2]=4 2368 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [0,0,0,0,2,0|0,0,2]=4 2369 B8R1.2 C=CC1=CC=CN=C1 MCULE-8817818665 [1,0,0,0,0,1|2,0,0]=4 2370 B8R1.2 C=CC1=CC=NC=C1 MCULE-5473364021 [1,0,0,0,0,1|2,0,0]=4 2371 B8R1.2 C=CC1=CN=CN=C1 MCULE-2861994100 [1,0,0,0,0,1|1,0,1]=4 2372 B8R1.2 C=CC1=NC=CN=C1 MCULE-5190300016 [1,0,0,0,0,1|2,0,0]=4 2373 B8R1.2 O=CC1=CC=CC=C1 MCULE-7744113682 [1,0,0,0,0,1|2,0,0]=4 2374 B8R1.2 O=CC1=CC=CC=N1 MCULE-4937131604 [1,0,0,0,0,1|2,0,0]=4 2375 B8R1.2 O=CC1=CC=CN=C1 MCULE-3309731741 [1,0,0,0,0,1|1,0,0]=3 2376 B8R1.2 O=CC1=CC=CN=N1 MCULE-4854117500 [1,0,0,0,0,1|2,0,0]=4 2377 B8R1.2 O=CC1=CC=NC=C1 MCULE-5970042944 [1,0,0,0,0,1|1,0,0]=3 2378 B8R1.2 O=CC1=CN=CN=C1 MCULE-7356621974 [1,0,0,0,0,1|0,0,1]=3 2379 B8R1.2 O=CC1=CN=NC=C1 MCULE-1523327227 [1,0,0,0,0,1|0,0,1]=3 2380 B8R1.2 O=CC1=NC=CN=C1 MCULE-6505422257 [1,0,0,0,0,1|1,0,0]=3 2381 B8R1.2 O=CC1=NC=CN=N1 MCULE-7239711976 [1,0,0,0,0,1|2,0,0]=4 2382 B8R1.2 O=CC1=NC=NC=C1 MCULE-2340151808 [1,0,0,0,0,1|1,0,0]=3 2383 B8R1.2 OCC1=CC=CN=C1 MCULE-4350730997 [1,0,0,0,0,1|1,0,1]=4 2384 B8R1.2 OCC1=CC=NC=C1 MCULE-2006782998 [1,0,0,0,0,1|1,0,1]=4 2385 B8R1.2 OCC1=CC=NC=C1 MCULE-8260320611 [1,0,0,0,0,1|1,0,1]=4 2386 B8R1.2 OCC1=CC=NC=C1 MCULE-8745577217 [1,0,0,0,0,1|1,0,1]=4 2387 B8R1.2 OCC1=CN=CN=C1 MCULE-9994325653 [1,0,0,0,0,1|0,0,2]=4 2388 B8R1.2 OCC1=CN=NC=C1 MCULE-6819828194 [1,0,0,0,0,1|0,0,2]=4 2389 B8R1.2 OCC1=NC=CN=C1 MCULE-1281180900 [1,0,0,0,0,1|1,0,1]=4 2390 B8R1.2 OCC1=NC=CN=C1 MCULE-1808729856 [1,0,0,0,0,1|1,0,1]=4 2391 B8R1.2 OCC1=NC=NC=C1 MCULE-9547917578 [1,0,0,0,0,1|1,0,1]=4 2392 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-4376271458 [0,0,0,0,0,2|2,0,0]=4 2393 B10R1.18 CC(=O)CC1=CC=CN=C1 MCULE-6272069358 [0,0,0,0,0,2|2,0,0]=4 2394 B10R1.18 CC(=O)CC1=CC=NC=C1 MCULE-5471990345 [0,0,0,0,0,2|2,0,0]=4 2395 B10R1.18 CC(=O)CC1=CC=NC=C1 MCULE-6085085905 [0,0,0,0,0,2|2,0,0]=4 2396 B10R1.18 CC(=O)CC1=NC=CN=C1 MCULE-5617549412 [0,0,0,0,0,2|2,0,0]=4 2397 B10R1.18 CC(=O)NC1=CC=CN=C1 MCULE-5150981925 [0,0,0,0,0,2|2,0,0]=4 2398 B10R1.18 CC(=O)NC1=CC=NC=C1 MCULE-4577197733 [0,0,0,0,0,2|2,0,0]=4 2399 B10R1.18 CC(=O)NC1=CN=CC=N1 MCULE-6162528979 [0,0,0,0,0,2|2,0,0]=4 2400 B10R1.18 CC(=O)NC1=CN=CN=C1 MCULE-5786711510 [0,0,0,0,0,2|1,0,1]=4 2401 B10R1.18 CC(=O)NC1=NC=NC=C1 MCULE-4275892925 [0,0,0,0,0,2|2,0,0]=4 2402 B10R1.18 CC(=O)OC1=CC=CN=C1 MCULE-6451249272 [0,0,0,0,0,2|2,0,0]=4 2403 B10R1.18 NC(=O)CC1=CC=CN=C1 MCULE-8050501584 [0,0,0,0,0,2|2,0,0]=4 2404 B10R1.18 NC(=O)CC1=CC=NC=C1 MCULE-8398784775 [0,0,0,0,0,2|2,0,0]=4 2405 B10R1.18 NC(=O)CC1=CN=CN=C1 MCULE-7573611428 [0,0,0,0,0,2|1,0,1]=4 2406 B10R1.18 NC(=O)NC1=CC=NC=C1 MCULE-1303176623 [0,0,0,0,0,2|2,0,0]=4 2407 B10R1.18 NC(=O)NC1=CN=CC=C1 MCULE-2651350209 [0,0,0,0,0,2|2,0,0]=4 2408 B10R1.18 NC(=O)NC1=NC=CN=C1 MCULE-8974152317 [0,0,0,0,0,2|2,0,0]=4 2409 B10R1.18 O=C(Cl)CC1=CC=CN=C1 MCULE-2590747143 [0,0,0,0,0,2|2,0,0]=4 2410 B10R1.18 O=C(Cl)CC1=CC=CN=C1 MCULE-9011561830 [0,0,0,0,0,2|2,0,0]=4 2411 B10R1.18 O=C(Cl)CC1=CC=NC=C1 MCULE-2503504370 [0,0,0,0,0,2|2,0,0]=4 2412 B10R1.18 O=C(Cl)CC1=CC=NC=C1 MCULE-3913890613 [0,0,0,0,0,2|2,0,0]=4 2413 B10R1.18 O=C(O)CC1=CC=CC=C1 MCULE-6701370784 [0,0,0,0,0,2|2,0,0]=4 2414 B10R1.18 O=C(O)CC1=CC=CN=C1 MCULE-5025740933 [0,0,0,0,0,2|1,0,0]=3 2415 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6196505642 [0,0,0,0,0,2|1,0,0]=3 2416 B10R1.18 O=C(O)CC1=CC=NC=C1 MCULE-6918467554 [0,0,0,0,0,2|1,0,0]=3 2417 B10R1.18 O=C(O)CC1=CC=NN=C1 MCULE-7498559885 [0,0,0,0,0,2|0,0,1]=3 2418 B10R1.18 O=C(O)CC1=CN=CC=C1 MCULE-7568450264 [0,0,0,0,0,2|1,0,0]=3 2419 B10R1.18 O=C(O)CC1=CN=CN=C1 MCULE-5355497283 [0,0,0,0,0,2|0,0,1]=3 2420 B10R1.18 O=C(O)CC1=CN=CN=C1 MCULE-7234097881 [0,0,0,0,0,2|0,0,1]=3 2421 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-3223507615 [0,0,0,0,0,2|2,0,0]=4 2422 B10R1.18 O=C(O)CC1=NC=CC=C1 MCULE-6540788884 [0,0,0,0,0,2|2,0,0]=4 2423 B10R1.18 O=C(O)CC1=NC=CN=C1 MCULE-6028395313 [0,0,0,0,0,2|1,0,0]=3 2424 B10R1.18 O=C(O)CC1=NC=NC=C1 MCULE-5590967773 [0,0,0,0,0,2|1,0,0]=3 2425 B10R1.18 O=C(O)CC1=NN=CC=C1 MCULE-7921775623 [0,0,0,0,0,2|2,0,0]=4 2426 B10R1.18 O=C([O-])CC1=CN=NC=C1 MCULE-1619156725 [0,0,0,0,0,2|0,0,2]=4 2427 B10R1.18 O=C([O-])CC1=CN=NC=C1 MCULE-5031332259 [0,0,0,0,0,2|0,0,2]=4 2428 B10R1.18 O=C([O-])CC1=NC=CN=C1 MCULE-7790515580 [0,0,0,0,0,2|1,0,1]=4 2429 B10R1.18 O=C([O-])CC1=NC=NC=C1 MCULE-3671131193 [0,0,0,0,0,2|1,0,1]=4 2430 B10R1.18 O=C([O-])CC1=NC=NC=C1 MCULE-9748410377 [0,0,0,0,0,2|1,0,1]=4 2431 B10R1.66 O=C(O)/C=C/C1=CN=CS1 MCULE-7572472922 [0,0,0,0,0,2|2,0,0]=4 2432 B10R1.66 O=C(O)/C=C/C1=CNC=N1 MCULE-6953426192 [0,0,0,0,0,2|2,0,0]=4 2433 B10R1.66 O=C(O)/C=C/C1=COC=C1 MCULE-6642700286 [0,0,0,0,0,2|2,0,0]=4 2434 B10R1.66 O=C(O)/C=C/C1=CSC=C1 MCULE-1958527580 [0,0,0,0,0,2|2,0,0]=4 2435 B10R1.66 O=C(O)/C=C\C1=CN=CN1 MCULE-7236014213 [0,0,0,0,0,2|2,0,0]=4 2436 B10R1.66 O=C(O)C#CC1=CSC=C1 MCULE-7555347588 [0,0,0,0,0,2|2,0,0]=4 2437 B10R1.66 O=C(O)C=CC1=CN=CS1 MCULE-7641560153 [0,0,0,0,0,2|2,0,0]=4 2438 B10R1.66 O=C(O)C=CC1=CNC=C1 MCULE-6780323683 [0,0,0,0,0,2|1,0,0]=3 2439 B10R1.66 O=C(O)C=CC1=CNC=N1 MCULE-7002606160 [0,0,0,0,0,2|2,0,0]=4 2440 B10R1.66 O=C(O)C=CC1=CNN=C1 MCULE-7650068377 [0,0,0,0,0,2|0,0,0]=2 2441 B10R1.66 O=C(O)C=CC1=COC=C1 MCULE-6318317369 [0,0,0,0,0,2|2,0,0]=4 2442 B10R1.66 O=C(O)C=CC1=CSC=C1 MCULE-3580115373 [0,0,0,0,0,2|2,0,0]=4 2443 B10R1.66 O=C(O)CCC1=CC=NO1 MCULE-2698728972 [0,0,0,0,0,2|2,0,0]=4 2444 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-2668820713 [0,0,0,0,0,2|2,0,0]=4 2445 B10R1.66 O=C(O)CCC1=CN=CS1 MCULE-7272215073 [0,0,0,0,0,2|2,0,0]=4 2446 B10R1.66 O=C(O)CCC1=CNC=C1 MCULE-9116858435 [0,0,0,0,0,2|1,0,0]=3 2447 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-3618491840 [0,0,0,0,0,2|2,0,0]=4 2448 B10R1.66 O=C(O)CCC1=CNC=N1 MCULE-8133590347 [0,0,0,0,0,2|2,0,0]=4 2449 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-1705333891 [0,0,0,0,0,2|0,0,0]=2 2450 B10R1.66 O=C(O)CCC1=CNN=C1 MCULE-4996856052 [0,0,0,0,0,2|0,0,0]=2 2451 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-2306529453 [0,0,0,0,0,2|1,0,0]=3 2452 B10R1.66 O=C(O)CCC1=CNN=N1 MCULE-3429425016 [0,0,0,0,0,2|1,0,0]=3 2453 B10R1.66 O=C(O)CCC1=COC=C1 MCULE-6225332803 [0,0,0,0,0,2|2,0,0]=4 2454 B10R1.66 O=C(O)CCC1=CON=C1 MCULE-7141916112 [0,0,0,0,0,2|1,0,0]=3 2455 B10R1.66 O=C(O)CCC1=CSC=C1 MCULE-5919306548 [0,0,0,0,0,2|2,0,0]=4 2456 B10R1.66 O=C(O)CCN1C=CN=C1 MCULE-9380136310 [0,0,0,0,0,2|2,0,0]=4 2457 B10R1.66 O=C(O)CCN1C=NN=C1 MCULE-5584916896 [0,0,0,0,0,2|1,0,1]=4 2458 B10R1.66 O=C(O)CCN1C=NN=C1 MCULE-6356200855 [0,0,0,0,0,2|1,0,1]=4 2459 B10R1.66 O=C(O)CNC1=CSC=C1 MCULE-7792185653 [0,0,0,0,0,2|2,0,0]=4 2460 B10R1.66 O=C(O)CNC1=NNC=C1 MCULE-8140407014 [0,0,0,0,0,2|2,0,0]=4 2461 B10R1.66 O=C(O)COC1=CSC=C1 MCULE-1973135166 [0,0,0,0,0,2|2,0,0]=4