0 B13R1.3787 C=C(C)CCC1=C(C=CC=C1C)C MCULE-8388691475 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.3787 CC(=O)CCC1=C(C=CC=C1F)F MCULE-3965832111 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.3787 CC(=O)COC1=C(C=CC=C1C)C MCULE-1191877671 [0,0,0,0,0,0|1,0,0]=1 3 B13R1.3787 CC1=C(C(=CC=C1)Br)CCC(=O)O MCULE-6157382436 [0,0,0,0,0,0|2,0,0]=2 4 B13R1.3787 CC1=C(C(=CC=C1)Cl)OCC(=O)O MCULE-8862734540 [0,0,0,0,0,0|1,0,0]=1 5 B13R1.3787 CC1=C(C(=CC=C1)F)/C=C/C(=O)O MCULE-4883194531 [0,0,0,0,0,0|2,0,1]=3 6 B13R1.3787 CC1=C(C(=CC=C1)F)CCC(=O)O MCULE-6891839570 [0,0,0,0,0,0|2,0,0]=2 7 B13R1.3787 CC1=C(C(=O)C=CN1)OCC(=O)O MCULE-7609565909 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.3787 CC1=C(C(=O)C=CO1)OCC(=O)O MCULE-4903901537 [0,0,0,0,0,0|2,0,0]=2 9 B13R1.3787 CC1=C(C(=O)NC=N1)CCC(=O)O MCULE-5078124651 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.3787 CC1=CC=CC(=C1C=C[N+](=O)[O-])C MCULE-5913880478 [0,0,0,0,0,0|2,0,2]=4 11 B13R1.3787 CC1=CC=CC(=C1CCC(=O)O)C MCULE-8984423114 [0,0,0,0,0,0|1,0,0]=1 12 B13R1.3787 CC1=CC=CC(=C1CCC(C)N)C MCULE-9362833995 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.3787 CC1=CC=CC(=C1NCC(=O)O)C MCULE-2860622973 [0,0,0,0,0,0|1,0,0]=1 14 B13R1.3787 CC1=CC=CC(=C1NCC(=O)O)C MCULE-7503844582 [0,0,0,0,0,0|1,0,0]=1 15 B13R1.3787 CC1=CC=CC(=C1NCC(C)O)C MCULE-5145210174 [0,0,0,0,0,0|2,0,1]=3 16 B13R1.3787 CC1=CC=CC(=C1NNC(=S)N)C MCULE-4811164239 [0,0,0,0,0,0|3,1,0]=4 17 B13R1.3787 CC1=CC=CC(=C1OCC(=O)Cl)C MCULE-8722258254 [0,0,0,0,0,0|1,0,0]=1 18 B13R1.3787 CC1=CC=CC(=C1OCC(=O)O)C MCULE-5038695383 [0,0,0,0,0,0|0,0,0]=0 19 B13R1.3787 CC1=CC=CC(=C1OCC(C)C)Br MCULE-3631692314 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.3787 CC1=CC=CC(=C1OCC(C)C)N MCULE-4163512976 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.3787 CC1=CC=CC(=C1OCC(C)N)C MCULE-1930292316 [0,0,0,0,0,0|2,0,1]=3 22 B13R1.3787 CC1=CC=CC(=C1OCC(C)N)C MCULE-4507699259 [0,0,0,0,0,0|2,0,1]=3 23 B13R1.3787 CC1=CC=CC(=C1OC[C@@H](C)N)C MCULE-1986283866 [0,0,0,0,0,0|2,0,1]=3 24 B13R1.3787 CC1=CC=CC(=C1OC[C@@H](C)N)C MCULE-4139359087 [0,0,0,0,0,0|2,0,1]=3 25 B13R1.3787 CC1=CC=CC(=C1OC[C@@H](C)N)C MCULE-7418069548 [0,0,0,0,0,0|2,0,1]=3 26 B13R1.3787 CC1=CC=CC(=C1OC[C@@H](C)N)C MCULE-8255232177 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.3787 CC1=CC=CC(=C1OC[C@H](C)N)C MCULE-6547454093 [0,0,0,0,0,0|2,0,1]=3 28 B13R1.3787 CC1=CC=CC(=C1OC[C@H](C)N)C MCULE-7846336069 [0,0,0,0,0,0|2,0,1]=3 29 B13R1.3787 CC1=CC=CC(=C1OC[C@H](C)N)C MCULE-8859490209 [0,0,0,0,0,0|2,0,1]=3 30 B13R1.3787 CC1=CC=CC(=C1SCC(=O)O)C MCULE-7249366497 [0,0,0,0,0,0|0,1,0]=1 31 B13R1.3787 CC1=CC=CC(=O)N1CCC(=O)O MCULE-9046663651 [0,0,0,0,0,0|3,0,0]=3 32 B13R1.3787 NC(=O)CCC1=C(C=CC=C1Cl)F MCULE-2968528627 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.3787 O=C(O)/C=C/C1=C(C=CC=C1Cl)Cl MCULE-9630503896 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.3787 O=C(O)/C=C/C1=C(C=CC=C1F)Cl MCULE-2076873077 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.3787 O=C(O)/C=C/C1=C(C=CC=C1F)F MCULE-5503844271 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.3787 O=C(O)C#CC1=C(C=CC=C1F)F MCULE-4738825041 [0,0,0,0,0,0|3,0,1]=4 37 B13R1.3787 O=C(O)C=CC1=C(C=CC=C1Cl)Cl MCULE-7655572370 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.3787 O=C(O)C=CC1=C(C=CC=C1F)Cl MCULE-1926612613 [0,0,0,0,0,0|3,0,1]=4 39 B13R1.3787 O=C(O)C=CC1=C(C=CC=C1F)F MCULE-7020612939 [0,0,0,0,0,0|3,0,1]=4 40 B13R1.3787 O=C(O)CCC1=C(C=CC=C1Br)Br MCULE-8608462114 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.3787 O=C(O)CCC1=C(C=CC=C1Cl)Cl MCULE-5135125740 [0,0,0,0,0,0|3,0,0]=3 42 B13R1.3787 O=C(O)CCC1=C(C=CC=C1F)Br MCULE-3506126674 [0,0,0,0,0,0|3,0,0]=3 43 B13R1.3787 O=C(O)CCC1=C(C=CC=C1F)Cl MCULE-8174930841 [0,0,0,0,0,0|3,0,0]=3 44 B13R1.3787 O=C(O)CCC1=C(C=CC=C1F)F MCULE-2111261989 [0,0,0,0,0,0|3,0,0]=3 45 B13R1.3787 O=C(O)CCC1=C(OC=CC1=O)O MCULE-1637933721 [0,0,0,0,0,0|4,0,0]=4 46 B13R1.3787 O=C(O)COC1=C(C=CC=C1Br)F MCULE-2164278158 [0,0,0,0,0,0|2,0,0]=2 47 B13R1.3787 O=C(O)COC1=C(C=CC=C1Cl)Cl MCULE-9934720851 [0,0,0,0,0,0|2,0,0]=2 48 B13R1.3787 O=C(O)COC1=C(C=CC=C1F)F MCULE-9477020399 [0,0,0,0,0,0|2,0,0]=2 49 B13R1.3787 O=C(O)CSC1=C(C=CC=C1Cl)Cl MCULE-3039621206 [0,0,0,0,0,0|2,1,0]=3 50 B13R1.3787 [C@@H](C)(N)COC1=C(C=CC=C1C)C MCULE-8358035007 [0,0,0,0,0,0|2,0,1]=3 51 B12R1.125 C=C(Br)CCC1=CC=CC=C1C MCULE-8948786636 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.125 C=C(C)CCC1=CC=CC=C1C MCULE-2436819965 [1,0,0,0,0,0|3,0,0]=4 53 B12R1.125 C=C(C)COC1=C(C=CC=C1)Br MCULE-6024450202 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.125 C=C(C)COC1=CC=CC=C1N MCULE-3008134900 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.125 C=C(C)COC1=CC=CC=C1N MCULE-3466503663 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.125 C=C(Cl)CCC1=CC=CC=C1C MCULE-3281714771 [1,0,0,0,0,0|3,0,0]=4 57 B12R1.125 CC(=O)C#CC1=CC=CC=C1C MCULE-6338868851 [1,0,0,0,0,0|2,0,1]=4 58 B12R1.125 CC(=O)CCC1=C(C=CC=C1)F MCULE-3742205438 [1,0,0,0,0,0|3,0,0]=4 59 B12R1.125 CC(=O)CCC1=CC=CC=C1Cl MCULE-4579663497 [1,0,0,0,0,0|3,0,0]=4 60 B12R1.125 CC(=O)CCC1=CC=CC=[N+]1C MCULE-3656536333 [1,0,0,0,0,0|3,0,0]=4 61 B12R1.125 CC(=O)CCC1=CC=CC=[N+]1C MCULE-7419011539 [1,0,0,0,0,0|3,0,0]=4 62 B12R1.125 CC(=O)COC1=C(C=CC=C1)Br MCULE-1661012462 [1,0,0,0,0,0|2,0,0]=3 63 B12R1.125 CC(=O)COC1=C(C=CC=C1)Cl MCULE-9411965008 [1,0,0,0,0,0|2,0,0]=3 64 B12R1.125 CC(=O)NNC1=CC=CC=C1C MCULE-7210823652 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.125 CC1=C(C=CC=C1)C#CC(=O)O MCULE-2914054144 [1,0,0,0,0,0|1,0,1]=3 66 B12R1.125 CC1=C(C=CC=C1)C=CC(=O)N MCULE-6358361236 [1,0,0,0,0,0|2,0,1]=4 67 B12R1.125 CC1=C(C=CC=C1)CCC(=O)O MCULE-1863841147 [1,0,0,0,0,0|1,0,0]=2 68 B12R1.125 CC1=C(C=CC=C1)COC(=O)Cl MCULE-8254375691 [1,0,0,0,0,0|3,0,0]=4 69 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N MCULE-5782119752 [1,0,0,0,0,0|2,0,0]=3 70 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N MCULE-7900143195 [1,0,0,0,0,0|2,0,0]=3 71 B12R1.125 CC1=C(C=CC=C1)OCC(=O)O MCULE-7437954656 [1,0,0,0,0,0|0,0,0]=1 72 B12R1.125 CC1=C(C=CC=C1)OCC(=S)N MCULE-3451999092 [1,0,0,0,0,0|1,1,0]=3 73 B12R1.125 CC1=C(C=CC=C1)OCC(C)N MCULE-3170497796 [1,0,0,0,0,0|2,0,1]=4 74 B12R1.125 CC1=C(C=CC=C1)OCC(C)O MCULE-8880151994 [1,0,0,0,0,0|1,0,1]=3 75 B12R1.125 CC1=C(C=CC=C1)SCC(=O)O MCULE-3348543127 [1,0,0,0,0,0|0,1,0]=2 76 B12R1.125 CC1=C(C=CN=C1)CCC(=O)O MCULE-7877508148 [1,0,0,0,0,0|2,0,0]=3 77 B12R1.125 CC1=C(C=NC=C1)C=CC(=O)O MCULE-1492169042 [1,0,0,0,0,0|2,0,1]=4 78 B12R1.125 CC1=C(C=NC=C1)C=CC(=O)O MCULE-5135224370 [1,0,0,0,0,0|2,0,1]=4 79 B12R1.125 CC1=C(C=NC=C1)CCC(=O)O MCULE-5337466065 [1,0,0,0,0,0|2,0,0]=3 80 B12R1.125 CC1=C(N=CC=C1)C=CC(=O)O MCULE-2497119427 [1,0,0,0,0,0|2,0,1]=4 81 B12R1.125 CC1=C(N=CC=C1)C=CC(=O)O MCULE-3158859403 [1,0,0,0,0,0|2,0,1]=4 82 B12R1.125 CC1=C(N=CC=C1)CCC(=O)O MCULE-3173547421 [1,0,0,0,0,0|2,0,0]=3 83 B12R1.125 CC1=CC=CC=C1/C=C/C(=O)Cl MCULE-9226637615 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.125 CC1=CC=CC=C1/C=C/C(=O)O MCULE-4568393226 [1,0,0,0,0,0|1,0,1]=3 85 B12R1.125 CC1=CC=CC=C1C=CC(=O)Cl MCULE-4237925880 [1,0,0,0,0,0|2,0,1]=4 86 B12R1.125 CC1=CC=CC=C1C=CC(=O)O MCULE-7568109044 [1,0,0,0,0,0|1,0,1]=3 87 B12R1.125 CC1=CC=CC=C1CCC(=O)Cl MCULE-5434283461 [1,0,0,0,0,0|2,0,0]=3 88 B12R1.125 CC1=CC=CC=C1NCC(=O)O MCULE-9934026722 [1,0,0,0,0,0|1,0,0]=2 89 B12R1.125 CC1=CC=CC=C1OCC(=O)Cl MCULE-5287648365 [1,0,0,0,0,0|1,0,0]=2 90 B12R1.125 CC1=CC=CC=C1OCC(=O)N MCULE-7049614745 [1,0,0,0,0,0|1,0,0]=2 91 B12R1.125 CC1=NC=CC=C1/C=C/C(=O)O MCULE-4255573583 [1,0,0,0,0,0|2,0,1]=4 92 B12R1.125 CC1=NC=CC=C1CCC(=O)O MCULE-3519127515 [1,0,0,0,0,0|2,0,0]=3 93 B12R1.125 CC1=NC=CC=C1CCC(=O)O MCULE-7810332925 [1,0,0,0,0,0|2,0,0]=3 94 B12R1.125 N=C(N)COC1=C(C=CC=C1)Br MCULE-4497317621 [1,0,0,0,0,0|3,0,0]=4 95 B12R1.125 N=C(N)COC1=C(C=CC=C1)F MCULE-2129431735 [1,0,0,0,0,0|3,0,0]=4 96 B12R1.125 N=C(N)COC1=C(C=CC=C1)F MCULE-6941105604 [1,0,0,0,0,0|3,0,0]=4 97 B12R1.125 N=C(N)COC1=CC=CC=C1Br MCULE-2707944834 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.125 N=C(N)COC1=CC=CC=C1Cl MCULE-2351393003 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.125 N=C(N)COC1=CC=CC=C1Cl MCULE-8929121870 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.125 NC(=O)CCC1=C(C=CC=C1)F MCULE-3464151618 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N MCULE-7163988486 [1,0,0,0,0,0|3,0,0]=4 102 B12R1.125 NC(=O)CCC1=CC=CC=C1Cl MCULE-7359271020 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.125 NC(=O)CCC1=CC=CC=C1O MCULE-6563350140 [1,0,0,0,0,0|3,0,0]=4 104 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br MCULE-6843547928 [1,0,0,0,0,0|2,0,0]=3 105 B12R1.125 NC(=O)COC1=C(C=CC=C1)I MCULE-2786204561 [1,0,0,0,0,0|2,0,0]=3 106 B12R1.125 NC(=O)COC1=C(C=CC=C1)O MCULE-2154592280 [1,0,0,0,0,0|2,0,0]=3 107 B12R1.125 NC(=O)COC1=C(N=CC=C1)Br MCULE-6444961734 [1,0,0,0,0,0|3,0,0]=4 108 B12R1.125 NC(=O)COC1=CC=CC=C1Cl MCULE-6372008313 [1,0,0,0,0,0|2,0,0]=3 109 B12R1.125 NC(=O)COC1=CC=CC=C1F MCULE-8187026469 [1,0,0,0,0,0|2,0,0]=3 110 B12R1.125 NC(=O)CSC1=CC=CC=C1N MCULE-8446030479 [1,0,0,0,0,0|2,1,0]=4 111 B12R1.125 NC(=S)COC1=C(C=CC=C1)Cl MCULE-6601795221 [1,0,0,0,0,0|2,1,0]=4 112 B12R1.125 NC1=C(C=CC=C1)C=CC(=O)O MCULE-1813623710 [1,0,0,0,0,0|2,0,1]=4 113 B12R1.125 NC1=C(C=CC=C1)SCC(=O)O MCULE-2684589425 [1,0,0,0,0,0|1,1,0]=3 114 B12R1.125 O=C(Cl)CCC1=C(C=CC=C1)Cl MCULE-6612912792 [1,0,0,0,0,0|3,0,0]=4 115 B12R1.125 O=C(Cl)CCC1=CC=CC=C1F MCULE-6200765385 [1,0,0,0,0,0|3,0,0]=4 116 B12R1.125 O=C(Cl)COC1=C(C=CC=C1)Cl MCULE-7639131412 [1,0,0,0,0,0|2,0,0]=3 117 B12R1.125 O=C(Cl)COC1=CC=CC=C1Br MCULE-2315611440 [1,0,0,0,0,0|2,0,0]=3 118 B12R1.125 O=C(Cl)COC1=CC=CC=C1F MCULE-5828946736 [1,0,0,0,0,0|2,0,0]=3 119 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)Br MCULE-9715214740 [1,0,0,0,0,0|2,0,1]=4 120 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)F MCULE-5550079587 [1,0,0,0,0,0|2,0,1]=4 121 B12R1.125 O=C(O)/C=C/C1=C(C=CC=C1)O MCULE-5451854573 [1,0,0,0,0,0|2,0,1]=4 122 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1Cl MCULE-6586897772 [1,0,0,0,0,0|2,0,1]=4 123 B12R1.125 O=C(O)/C=C/C1=CC=CC=C1I MCULE-4367628203 [1,0,0,0,0,0|2,0,1]=4 124 B12R1.125 O=C(O)C#CC1=CC=CC=C1Cl MCULE-3348013518 [1,0,0,0,0,0|2,0,1]=4 125 B12R1.125 O=C(O)C#CC1=CC=CC=C1F MCULE-2294922933 [1,0,0,0,0,0|2,0,1]=4 126 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)Br MCULE-1992481262 [1,0,0,0,0,0|2,0,1]=4 127 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)F MCULE-2337664175 [1,0,0,0,0,0|2,0,1]=4 128 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)I MCULE-8228854548 [1,0,0,0,0,0|2,0,1]=4 129 B12R1.125 O=C(O)C=CC1=C(C=CC=C1)O MCULE-7485332494 [1,0,0,0,0,0|2,0,1]=4 130 B12R1.125 O=C(O)C=CC1=CC=CC=C1Cl MCULE-7865645572 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Br MCULE-8663170653 [1,0,0,0,0,0|2,0,0]=3 132 B12R1.125 O=C(O)CCC1=C(C=CC=C1)Cl MCULE-2881103060 [1,0,0,0,0,0|2,0,0]=3 133 B12R1.125 O=C(O)CCC1=C(C=CC=C1)F MCULE-6298600610 [1,0,0,0,0,0|2,0,0]=3 134 B12R1.125 O=C(O)CCC1=C(C=CC=C1)O MCULE-1055140821 [1,0,0,0,0,0|2,0,0]=3 135 B12R1.125 O=C(O)CCC1=C(C=NC=C1)Cl MCULE-2478028837 [1,0,0,0,0,0|3,0,0]=4 136 B12R1.125 O=C(O)CCC1=C(C=NC=C1)F MCULE-6252605434 [1,0,0,0,0,0|3,0,0]=4 137 B12R1.125 O=C(O)CCC1=C(N=CC=C1)Cl MCULE-4820330692 [1,0,0,0,0,0|3,0,0]=4 138 B12R1.125 O=C(O)CCC1=C(N=CC=C1)F MCULE-6425720730 [1,0,0,0,0,0|3,0,0]=4 139 B12R1.125 O=C(O)CCC1=CC=CC=C1I MCULE-2650420493 [1,0,0,0,0,0|2,0,0]=3 140 B12R1.125 O=C(O)CCC1=CC=CN=C1Br MCULE-2674571642 [1,0,0,0,0,0|3,0,0]=4 141 B12R1.125 O=C(O)CCC1=NC=CC=C1Br MCULE-1356656825 [1,0,0,0,0,0|3,0,0]=4 142 B12R1.125 O=C(O)CCN1C=CC=CC1=O MCULE-4101713123 [1,0,0,0,0,0|3,0,0]=4 143 B12R1.125 O=C(O)CCN1C=CC=CC1=O MCULE-5586331788 [1,0,0,0,0,0|3,0,0]=4 144 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Br MCULE-2469324501 [1,0,0,0,0,0|2,0,0]=3 145 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Cl MCULE-3724211762 [1,0,0,0,0,0|2,0,0]=3 146 B12R1.125 O=C(O)CNC1=C(C=CC=C1)F MCULE-7862978402 [1,0,0,0,0,0|2,0,0]=3 147 B12R1.125 O=C(O)COC1=C(C=CC=C1)Br MCULE-6691121226 [1,0,0,0,0,0|1,0,0]=2 148 B12R1.125 O=C(O)COC1=C(C=CC=C1)I MCULE-8125182578 [1,0,0,0,0,0|1,0,0]=2 149 B12R1.125 O=C(O)COC1=C(C=CC=N1)F MCULE-5006742111 [1,0,0,0,0,0|2,0,0]=3 150 B12R1.125 O=C(O)COC1=C(N=CC=C1)Cl MCULE-7753759406 [1,0,0,0,0,0|2,0,0]=3 151 B12R1.125 O=C(O)COC1=CC=CC=C1Cl MCULE-3851170810 [1,0,0,0,0,0|1,0,0]=2 152 B12R1.125 O=C(O)COC1=CC=CC=C1F MCULE-6414470288 [1,0,0,0,0,0|1,0,0]=2 153 B12R1.125 O=C(O)COC1=CC=CC=C1O MCULE-3539626165 [1,0,0,0,0,0|1,0,0]=2 154 B12R1.125 O=C(O)COC1=CC=CN=C1Br MCULE-1340033620 [1,0,0,0,0,0|2,0,0]=3 155 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Br MCULE-6245797989 [1,0,0,0,0,0|1,1,0]=3 156 B12R1.125 O=C(O)CSC1=C(C=CC=C1)Cl MCULE-8471018138 [1,0,0,0,0,0|1,1,0]=3 157 B12R1.125 O=C(O)CSC1=C(C=CC=C1)F MCULE-6358016234 [1,0,0,0,0,0|1,1,0]=3 158 B12R1.125 O=C(O)CSC1=C(C=CC=C1)O MCULE-9851363930 [1,0,0,0,0,0|1,1,0]=3 159 B12R1.125 O=C(O)CSC1=C(N=CC=C1)Cl MCULE-5539998802 [1,0,0,0,0,0|2,1,0]=4 160 B12R1.125 O=C(O)CSC1=CC=CC=[N+]1[O-] MCULE-7774881227 [1,0,0,0,0,0|2,1,0]=4 161 B12R1.125 O=C([O-])CO[N+]1=CC=CC=C1O MCULE-5157263311 [1,0,0,0,0,0|2,0,1]=4 162 B12R1.1631 C#CCNC1=C(C=CC=C1C)C MCULE-9863717921 [1,0,0,0,0,0|2,0,1]=4 163 B12R1.1631 C=CCCC1=C(C=CC=C1C)C MCULE-6219570517 [1,0,0,0,0,0|2,0,0]=3 164 B12R1.1631 CC1=C(C(=CC=C1)Cl)OCCN MCULE-1022070761 [1,0,0,0,0,0|2,0,1]=4 165 B12R1.1631 CC1=C(C(=CC=C1)Cl)OCCN MCULE-4148818974 [1,0,0,0,0,0|2,0,1]=4 166 B12R1.1631 CC1=CC=CC(=C1OCC#N)C MCULE-2484300780 [1,0,0,0,0,0|1,0,1]=3 167 B12R1.1631 CC1=CC=CC(=C1OCCBr)C MCULE-7787950038 [1,0,0,0,0,0|1,0,1]=3 168 B12R1.1631 CC1=CC=CC(=C1OCCBr)Cl MCULE-1629693392 [1,0,0,0,0,0|2,0,1]=4 169 B12R1.1631 CC1=CC=CC(=C1OCCN)C MCULE-1087816577 [1,0,0,0,0,0|1,0,1]=3 170 B12R1.1631 CC1=CC=CC(=C1OCCN)C MCULE-1577354719 [1,0,0,0,0,0|1,0,1]=3 171 B12R1.1631 CC1=CC=CC(=C1OCCO)C MCULE-4230260294 [1,0,0,0,0,0|0,0,1]=2 172 B12R1.1631 CC1=CC=CC(=C1SCCO)C MCULE-7681931652 [1,0,0,0,0,0|0,1,1]=3 173 B12R1.1631 CCCNC1=C(C=CC=C1C)C MCULE-5266311174 [1,0,0,0,0,0|2,0,1]=4 174 B12R1.1631 CCCOC1=C(C=CC=C1C)Br MCULE-3107359800 [1,0,0,0,0,0|2,0,1]=4 175 B12R1.1631 CCCOC1=C(C=CC=C1N)C MCULE-5112388816 [1,0,0,0,0,0|2,0,1]=4 176 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)Cl MCULE-7630883456 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.1631 O=CCCC1=C(C=CC=C1Cl)F MCULE-6456966881 [1,0,0,0,0,0|3,0,0]=4 178 B12R1.1631 O=CCOC1=C(C=CC=C1F)Br MCULE-4803741590 [1,0,0,0,0,0|2,0,0]=3 179 B12R1.1631 OCCOC1=C(C=CC=C1Cl)Cl MCULE-1135763239 [1,0,0,0,0,0|2,0,1]=4 180 B14R1.2172 CC1=C(C(=CC=C1)C=O)OCC(=O)O MCULE-7693650907 [0,1,0,0,0,0|0,0,1]=2 181 B14R1.2172 COC1=C(C(=CC=C1)Br)OCC(=O)O MCULE-1333781603 [0,1,0,0,0,0|1,0,0]=2 182 B14R1.2172 O=CC1=C(C(=CC=C1)Cl)OCC(=O)O MCULE-4132554385 [0,1,0,0,0,0|1,0,1]=3 183 B14R1.2172 O=CC1=C(C(=CC=C1)F)OCC(=O)O MCULE-4852095011 [0,1,0,0,0,0|1,0,1]=3 184 B14R1.3152 C=C(C)CCC1=C(C=C(C=C1C)C)C MCULE-6560706369 [0,1,0,0,0,0|3,0,0]=4 185 B14R1.3152 CC(=O)C=CC1=C(C=C(C=C1C)C)C MCULE-9142757512 [0,1,0,0,0,0|2,0,1]=4 186 B14R1.3152 CC1=C(C(=CC(=C1)Br)Br)OCC(=O)N MCULE-9126074234 [0,1,0,0,0,0|2,0,0]=3 187 B14R1.3152 CC1=C(C(=CC(=C1)Br)Cl)OCC(=O)O MCULE-7407259512 [0,1,0,0,0,0|1,0,0]=2 188 B14R1.3152 CC1=C(C(=CC(=C1)Cl)Cl)/C=C/C(=O)O MCULE-4383939576 [0,1,0,0,0,0|2,0,1]=4 189 B14R1.3152 CC1=C(C(=CC(=C1)Cl)Cl)OCC(=O)N MCULE-1947970406 [0,1,0,0,0,0|2,0,0]=3 190 B14R1.3152 CC1=C(C(=CC(=C1)F)F)/C=C/C(=O)O MCULE-5848962866 [0,1,0,0,0,0|2,0,1]=4 191 B14R1.3152 CC1=CC(=C(C(=C1)Br)OCC(=O)N)C MCULE-6144777369 [0,1,0,0,0,0|2,0,0]=3 192 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)Cl)Br MCULE-4010703939 [0,1,0,0,0,0|2,0,0]=3 193 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)Cl)Cl MCULE-4647944519 [0,1,0,0,0,0|2,0,0]=3 194 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)Br MCULE-7504766046 [0,1,0,0,0,0|1,0,0]=2 195 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)C MCULE-5733040549 [0,1,0,0,0,0|0,0,0]=1 196 B14R1.3152 CC1=CC(=C(C(=C1)C)OCC(=O)O)Cl MCULE-6584885690 [0,1,0,0,0,0|1,0,0]=2 197 B14R1.3152 CC1=CC(=C(C(=C1)Cl)OCC(=O)N)C MCULE-7256796700 [0,1,0,0,0,0|2,0,0]=3 198 B14R1.3152 CC1=CC(=CC(=C1/C=C/C(=O)O)C)O MCULE-8623273119 [0,1,0,0,0,0|1,0,1]=3 199 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)Cl)Cl)Cl MCULE-1339653434 [0,1,0,0,0,0|2,0,0]=3 200 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)N)C)Br MCULE-4453078551 [0,1,0,0,0,0|1,0,0]=2 201 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)Br)Br MCULE-2389185644 [0,1,0,0,0,0|1,0,0]=2 202 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)C)Br MCULE-8341489885 [0,1,0,0,0,0|0,0,0]=1 203 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)C)Cl MCULE-8715719886 [0,1,0,0,0,0|0,0,0]=1 204 B14R1.3152 CC1=CC(=CC(=C1OCC(=O)O)Cl)Cl MCULE-8157003687 [0,1,0,0,0,0|1,0,0]=2 205 B14R1.3152 CC1=CC(=CC(=C1OCC(C)C)C)Br MCULE-4788338730 [0,1,0,0,0,0|2,0,1]=4 206 B14R1.3152 CC1=CC(=CC(=C1OCC(C)C)C)S MCULE-3904806263 [0,1,0,0,0,0|2,0,1]=4 207 B14R1.3152 CC1=CC(=CC(=O)N1CCC(=O)O)Cl MCULE-5966177862 [0,1,0,0,0,0|3,0,0]=4 208 B14R1.3152 CC1=CC(=CC(=O)N1CCC(=O)O)O MCULE-2638342485 [0,1,0,0,0,0|3,0,0]=4 209 B14R1.3152 CC1=CC(=O)NC(=C1CCC(=O)O)C MCULE-1408371788 [0,1,0,0,0,0|2,0,0]=3 210 B14R1.3152 CC1=CC(=[N+](C(=C1)C)CCC(=O)O)C MCULE-1443430614 [0,1,0,0,0,0|2,0,0]=3 211 B14R1.3152 CC1=CC(=[N+](C(=C1)C)CCC(=O)O)C MCULE-3381524373 [0,1,0,0,0,0|2,0,0]=3 212 B14R1.3152 CC1=NC(=NC(=C1CCC(=O)O)C)N MCULE-8853189812 [0,1,0,0,0,0|3,0,0]=4 213 B14R1.3152 CC1=NC(=NC(=C1CCC(=O)O)C)S MCULE-4145247362 [0,1,0,0,0,0|3,0,0]=4 214 B14R1.3152 CC1=NC(=O)NC(=C1CCC(=O)O)C MCULE-1304759345 [0,1,0,0,0,0|3,0,0]=4 215 B14R1.3152 NC(=O)COC1=C(C=C(C=C1Cl)Cl)Br MCULE-7487986410 [0,1,0,0,0,0|3,0,0]=4 216 B14R1.3152 O=C(O)CCC1=C(C=C(C=C1F)Br)F MCULE-7902017062 [0,1,0,0,0,0|3,0,0]=4 217 B14R1.3152 O=C(O)CCC1=C(C=C(C=C1O)O)O MCULE-4892964005 [0,1,0,0,0,0|3,0,0]=4 218 B14R1.3152 O=C(O)COC1=C(C=C(C=C1Br)Cl)Cl MCULE-7919164207 [0,1,0,0,0,0|2,0,0]=3 219 B14R1.3152 O=C(O)COC1=C(C=C(C=C1Cl)Cl)Cl MCULE-9411161830 [0,1,0,0,0,0|2,0,0]=3 220 B14R1.3152 O=C(O)CSC1=C(C=C(C=C1Cl)Cl)Cl MCULE-2845100007 [0,1,0,0,0,0|2,1,0]=4 221 B14R1.5958 C=C(C)C[C@@H](N)C1=C(C=CC=C1C)C MCULE-5712126261 [0,1,0,0,0,0|3,0,0]=4 222 B14R1.5958 C=C(C)C[C@@H](N)C1=C(C=CC=C1C)C MCULE-8427131607 [0,1,0,0,0,0|3,0,0]=4 223 B14R1.5958 C=C(C)C[C@H](N)C1=C(C=CC=C1C)C MCULE-2584331397 [0,1,0,0,0,0|3,0,0]=4 224 B14R1.5958 C=C(C)C[C@H](N)C1=C(C=CC=C1C)C MCULE-4372739754 [0,1,0,0,0,0|3,0,0]=4 225 B14R1.5958 CC(CC(=O)O)C1=C(C=CC=C1F)F MCULE-1637899303 [0,1,0,0,0,0|3,0,0]=4 226 B14R1.5958 CC1=CC=CC(=C1N(C)CC(=O)O)C MCULE-2542843573 [0,1,0,0,0,0|1,0,0]=2 227 B14R1.5958 NC(CC(=O)O)C1=C(C=CC=C1Cl)F MCULE-2328044589 [0,1,0,0,0,0|3,0,0]=4 228 B14R1.5958 NC(CC(=O)O)C1=C(C=CC=C1F)Cl MCULE-8990615532 [0,1,0,0,0,0|3,0,0]=4 229 B14R1.5958 NC(CC(=O)O)C1=C(C=CC=C1F)F MCULE-2642753703 [0,1,0,0,0,0|3,0,0]=4 230 B14R1.5958 NC(CC(=O)O)C1=C(C=CC=C1F)F MCULE-7158232789 [0,1,0,0,0,0|3,0,0]=4 231 B14R1.5958 N[C@H](CC(=O)O)C1=C(C=CC=C1F)F MCULE-4904078605 [0,1,0,0,0,0|3,0,0]=4 232 B14R1.5958 N[C@H](CC(=O)O)C1=C(C=CC=C1F)F MCULE-7816981685 [0,1,0,0,0,0|3,0,0]=4 233 B14R1.5971 CC(=O)C(C)OC1=C(C=CC=C1C)C MCULE-7554392026 [0,1,0,0,0,0|1,0,0]=2 234 B14R1.5971 CC(=O)C(C)OC1=C(C=CC=C1Cl)Cl MCULE-7157948291 [0,1,0,0,0,0|3,0,0]=4 235 B14R1.5971 CC(CC1=C(C=CC=C1Cl)F)C(=O)O MCULE-8825152638 [0,1,0,0,0,0|3,0,0]=4 236 B14R1.5971 CC(OC1=C(C=CC=C1Cl)Cl)C(=O)N MCULE-9002186186 [0,1,0,0,0,0|3,0,0]=4 237 B14R1.5971 CC(OC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-7085708140 [0,1,0,0,0,0|2,0,0]=3 238 B14R1.5971 CC1=CC=CC(=C1CC(C)C(=O)O)F MCULE-4522376835 [0,1,0,0,0,0|2,0,0]=3 239 B14R1.5971 CC1=CC=CC(=C1CC(N)C(=O)O)C MCULE-2803660056 [0,1,0,0,0,0|1,0,0]=2 240 B14R1.5971 CC1=CC=CC(=C1C[C@H](N)C(=O)O)C MCULE-5113879884 [0,1,0,0,0,0|1,0,0]=2 241 B14R1.5971 CC1=CC=CC(=C1NC(=O)C(=O)O)C MCULE-8868647768 [0,1,0,0,0,0|1,0,1]=3 242 B14R1.5971 CC1=CC=CC(=C1NC(C)C(=O)O)C MCULE-8053965704 [0,1,0,0,0,0|1,0,0]=2 243 B14R1.5971 CC1=CC=CC(=C1OC(C)C(=O)N)C MCULE-4710218135 [0,1,0,0,0,0|1,0,0]=2 244 B14R1.5971 CC1=CC=CC(=C1OC(C)C(=O)O)C MCULE-8322590019 [0,1,0,0,0,0|0,0,0]=1 245 B14R1.5971 CC1=NC=CC(=C1OC(C)C(=O)N)O MCULE-6114650041 [0,1,0,0,0,0|3,0,0]=4 246 B14R1.5971 NC(CC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-4123631374 [0,1,0,0,0,0|3,0,0]=4 247 B14R1.5971 NC(CC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-9046410009 [0,1,0,0,0,0|3,0,0]=4 248 B14R1.5971 NC(CC1=C(C=CC=C1F)Cl)C(=O)O MCULE-6644930285 [0,1,0,0,0,0|3,0,0]=4 249 B14R1.5971 NC(CC1=C(C=CC=C1F)F)C(=O)O MCULE-1353383809 [0,1,0,0,0,0|3,0,0]=4 250 B14R1.5971 NC(CC1=C(C=CC=C1F)F)C(=O)O MCULE-1643055498 [0,1,0,0,0,0|3,0,0]=4 251 B14R1.5971 N[C@@H](CC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-2625640279 [0,1,0,0,0,0|3,0,0]=4 252 B14R1.5971 N[C@@H](CC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-3414442510 [0,1,0,0,0,0|3,0,0]=4 253 B14R1.5971 N[C@@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-1808843722 [0,1,0,0,0,0|3,0,0]=4 254 B14R1.5971 N[C@@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-4130451072 [0,1,0,0,0,0|3,0,0]=4 255 B14R1.5971 N[C@@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-9193255836 [0,1,0,0,0,0|3,0,0]=4 256 B14R1.5971 N[C@@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-9289085661 [0,1,0,0,0,0|3,0,0]=4 257 B14R1.5971 N[C@@H](CC1=C(C=CC=C1F)O)C(=O)O MCULE-7479664979 [0,1,0,0,0,0|3,0,0]=4 258 B14R1.5971 N[C@@H](CC1=C(C=CC=C1O)O)C(=O)O MCULE-7870259091 [0,1,0,0,0,0|3,0,0]=4 259 B14R1.5971 N[C@H](CC1=C(C=CC=C1Cl)Cl)C(=O)O MCULE-2955469602 [0,1,0,0,0,0|3,0,0]=4 260 B14R1.5971 N[C@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-4479475322 [0,1,0,0,0,0|3,0,0]=4 261 B14R1.5971 N[C@H](CC1=C(C=CC=C1F)F)C(=O)O MCULE-6663971136 [0,1,0,0,0,0|3,0,0]=4 262 B14R1.5971 O=C(O)C(O)CC1=C(C=CC=C1F)Cl MCULE-7066032322 [0,1,0,0,0,0|3,0,0]=4 263 B14R1.6054 CC1=C(C(=C(C=C1)Cl)Cl)/C=C/C(=O)O MCULE-1255177591 [0,1,0,0,0,0|2,0,1]=4 264 B14R1.6054 CC1=C(C=CC(=C1/C=C/C(=O)O)Cl)Cl MCULE-1099508841 [0,1,0,0,0,0|2,0,1]=4 265 B14R1.6054 CC1=CC=C(C(=C1C)OCC(=O)O)C MCULE-9478143234 [0,1,0,0,0,0|0,0,0]=1 266 B14R1.6054 CC1=NC=C(C(=C1OCC(=O)O)O)Br MCULE-6580639135 [0,1,0,0,0,0|2,0,0]=3 267 B14R1.6054 O=C(O)CCC1=C(C=CC(=C1F)F)F MCULE-9280183497 [0,1,0,0,0,0|3,0,0]=4 268 B14R1.19598 CC1=CC=CC(=C1NCC(=O)NN)C MCULE-2926778162 [0,1,0,0,0,0|2,0,0]=3 269 B14R1.19598 CC1=CC=CC(=C1OCC(=O)NN)C MCULE-6573519899 [0,1,0,0,0,0|1,0,0]=2 270 B14R1.19598 CC1=CC=CC(=C1OCC(C)NO)C MCULE-3556387260 [0,1,0,0,0,0|1,0,1]=3 271 B14R1.19598 CC1=CC=CC(=C1OCC(C)NO)C MCULE-9126099359 [0,1,0,0,0,0|1,0,1]=3 272 B14R1.19598 CC1=CC=CC(=C1OCC(O)CN)C MCULE-9224509502 [0,1,0,0,0,0|1,0,1]=3 273 B14R1.19598 CC1=CC=CC(=C1OCC(O)CN)C MCULE-9656223744 [0,1,0,0,0,0|1,0,1]=3 274 B14R1.19598 COC(=O)CCC1=C(C=CC=C1Cl)Cl MCULE-7432754173 [0,1,0,0,0,0|3,0,0]=4 275 B14R1.19598 COC(=O)COC1=C(C=CC=C1Cl)Cl MCULE-2721607299 [0,1,0,0,0,0|2,0,0]=3 276 B14R1.19598 COC(=O)COC1=C(C=CN=C1C)O MCULE-6184057167 [0,1,0,0,0,0|2,0,0]=3 277 B14R1.19598 COC(=O)COC1=C(C=CN=C1C)O MCULE-9521954088 [0,1,0,0,0,0|2,0,0]=3 278 B14R1.19598 COC(=O)CSC1=C(C=CC=C1Cl)Cl MCULE-7928331911 [0,1,0,0,0,0|2,1,0]=4 279 B14R1.19598 N/C(=N\O)/COC1=C(C=CC=C1Cl)Cl MCULE-2923373248 [0,1,0,0,0,0|3,0,0]=4 280 B14R1.19598 NNC(=O)COC1=C(C=CC=C1Cl)Cl MCULE-9138445978 [0,1,0,0,0,0|3,0,0]=4 281 B14R2.717 CC1=CC=CC(=C1OCC2CO2)C MCULE-1590622233 [0,0,0,1,0,0|1,0,1]=3 282 B14R2.7969 CC(=O)C1=CC2=CC=CC(=C2O1)C MCULE-1994342763 [0,0,0,1,0,0|1,0,2]=4 283 B14R2.7969 CC1=C2C=C(NC2=CC=C1)C(=O)O MCULE-4659714822 [0,0,0,1,0,0|2,0,1]=4 284 B14R2.7969 CC1=C2C=C(OC2=CC=C1)C(=O)O MCULE-5032173542 [0,0,0,1,0,0|2,0,1]=4 285 B14R2.7969 CC1=C2CC(NC2=CC=C1)C(=O)O MCULE-3707872162 [0,0,0,1,0,0|2,0,0]=3 286 B14R2.7969 CC1=C2CC(NC2=CC=C1)C(=O)O MCULE-3939504204 [0,0,0,1,0,0|2,0,0]=3 287 B14R2.7969 CC1=C2CC(OC2=CC=C1)C(=O)O MCULE-7955001145 [0,0,0,1,0,0|2,0,0]=3 288 B14R2.7969 CC1=C2CC(SC2=CC=C1)C(=O)O MCULE-8858886424 [0,0,0,1,0,0|2,0,0]=3 289 B14R2.7969 CC1=C2N=C(OC2=CC=C1)C(=O)O MCULE-5185530271 [0,0,0,1,0,0|2,0,1]=4 290 B14R2.7969 CC1=C2N=C(SC2=CC=C1)C(=O)O MCULE-3457890513 [0,0,0,1,0,0|2,0,1]=4 291 B14R2.7969 CC1=C2NC(=CC2=CC=C1)C(=O)O MCULE-4694736949 [0,0,0,1,0,0|1,0,2]=4 292 B14R2.7969 CC1=C2OC(=CC2=CC=C1)C(=O)O MCULE-4015926792 [0,0,0,1,0,0|0,0,2]=3 293 B14R2.7969 CC1=C2OC(CC2=CC=C1)C(=O)O MCULE-7059720319 [0,0,0,1,0,0|0,0,0]=1 294 B14R2.7969 CC1=C2SC(=CC2=CC=C1)C(=O)O MCULE-6864716855 [0,0,0,1,0,0|0,1,2]=4 295 B14R2.7969 CC1=CC=CC2=C1C=C(S2)C(=O)O MCULE-6836680129 [0,0,0,1,0,0|2,0,1]=4 296 B14R2.7969 CC1=CC=CC2=C1N=C(N2)C(=O)O MCULE-6234768865 [0,0,0,1,0,0|2,0,1]=4 297 B14R2.7969 NC1=C2OC(=CC2=CC=C1)C(=O)O MCULE-8058061352 [0,0,0,1,0,0|1,0,2]=4 298 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)Br MCULE-5562158251 [0,0,0,1,0,0|1,0,2]=4 299 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)Cl MCULE-1688329178 [0,0,0,1,0,0|1,0,2]=4 300 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)F MCULE-5626281415 [0,0,0,1,0,0|1,0,2]=4 301 B14R2.7969 O=C(O)C1=CC2=C(O1)C(=CC=C2)O MCULE-6278559313 [0,0,0,1,0,0|1,0,2]=4 302 B14R2.7969 O=C(O)C1=NC2=C(O1)C(=CC=C2)Br MCULE-1923229902 [0,0,0,1,0,0|2,0,1]=4 303 B14R2.7969 O=C(O)C1=NC2=C(O1)C(=CC=C2)Cl MCULE-2521294025 [0,0,0,1,0,0|2,0,1]=4 304 B14R2.7969 O=C(O)C1=NC2=C(O1)C(=CC=C2)F MCULE-4566190024 [0,0,0,1,0,0|2,0,1]=4 305 B14R2.7969 O=C(O)C1CC2=C(C1)C(=CC=C2)Br MCULE-4840054015 [0,0,0,1,0,0|2,0,0]=3 306 B14R2.7969 O=C(O)C1CC2=C(C1)C(=CC=C2)Cl MCULE-4242535008 [0,0,0,1,0,0|2,0,0]=3 307 B14R2.7969 O=C(O)C1CC2=C(C1)C(=CC=C2)O MCULE-8697112323 [0,0,0,1,0,0|2,0,0]=3 308 B14R2.7969 O=C(O)C1CC2=C(C=CC=C2O1)Br MCULE-5180643848 [0,0,0,1,0,0|3,0,0]=4 309 B14R2.7969 O=C(O)C1CC2=C(C=CC=C2S1)Cl MCULE-4563727023 [0,0,0,1,0,0|3,0,0]=4 310 B14R2.7969 O=C(O)C1CC2=C(C=CC=C2S1)F MCULE-4208820800 [0,0,0,1,0,0|3,0,0]=4 311 B14R2.7969 O=C(O)C1CC2=C(O1)C(=CC=C2)F MCULE-3364882121 [0,0,0,1,0,0|1,0,0]=2 312 B14R2.7969 O=C(O)C1CC2=CC=CC(=C2O1)Cl MCULE-4234861123 [0,0,0,1,0,0|1,0,0]=2 313 B14R2.7969 O=C(O)C1CC2=CC=CC(=C2O1)O MCULE-2635851469 [0,0,0,1,0,0|1,0,0]=2 314 B14R2.7969 O=C(O)C1NC2=CC=CC(=C2O1)Br MCULE-8660144037 [0,0,0,1,0,0|2,0,0]=3 315 B12R1.895 CC1=C(N(N=C1)C)CCC(=O)O MCULE-9482946953 [0,0,0,0,1,0|3,0,0]=4 316 B12R1.895 CC1=CC=C(N1CCC(=O)O)C MCULE-6845048538 [0,0,0,0,1,0|2,0,0]=3 317 B12R1.895 CC1=CNC(=C1CCC(=O)O)C MCULE-2695061568 [0,0,0,0,1,0|2,0,0]=3 318 B12R1.895 CC1=NNC(=C1CCC(=O)O)C MCULE-1206963979 [0,0,0,0,1,0|3,0,0]=4 319 B12R1.895 CC1=NNC(=C1CCC(=O)O)C MCULE-7629156157 [0,0,0,0,1,0|3,0,0]=4 320 B12R1.895 CC1=NOC(=C1CCC(=O)O)C MCULE-1308435850 [0,0,0,0,1,0|3,0,0]=4 321 B12R1.1009 C=C(Br)CC1=C(C=CC=C1C)C MCULE-7685865021 [0,0,0,0,1,0|2,0,0]=3 322 B12R1.1009 C=C(Br)CC1=C(C=CC=C1Cl)C MCULE-3126874797 [0,0,0,0,1,0|3,0,0]=4 323 B12R1.1009 C=C(C)CC1=C(C=CC=C1C)C MCULE-5388851353 [0,0,0,0,1,0|2,0,0]=3 324 B12R1.1009 C=C(C)CC1=C(C=CC=C1Cl)C MCULE-9226641132 [0,0,0,0,1,0|3,0,0]=4 325 B12R1.1009 C=C(Cl)CC1=C(C=CC=C1C)C MCULE-6984629334 [0,0,0,0,1,0|2,0,0]=3 326 B12R1.1009 C=C(Cl)CC1=C(C=CC=C1Cl)C MCULE-5839240512 [0,0,0,0,1,0|3,0,0]=4 327 B12R1.1009 CC(=O)CC1=C(C=CC=C1C)C MCULE-7143049554 [0,0,0,0,1,0|1,0,0]=2 328 B12R1.1009 CC(=O)CC1=C(C=CC=C1Cl)Cl MCULE-7606318854 [0,0,0,0,1,0|3,0,0]=4 329 B12R1.1009 CC(=O)CC1=C(C=CC=C1F)Cl MCULE-9324375706 [0,0,0,0,1,0|3,0,0]=4 330 B12R1.1009 CC(=O)CC1=C(C=CC=C1F)F MCULE-9987898736 [0,0,0,0,1,0|3,0,0]=4 331 B12R1.1009 CC(=O)NC1=C(C=CC=C1C)C MCULE-8287569918 [0,0,0,0,1,0|2,0,0]=3 332 B12R1.1009 CC(=O)NC1=C(C=CC=C1C)Cl MCULE-1533842601 [0,0,0,0,1,0|3,0,0]=4 333 B12R1.1009 CC(=O)NC1=C(C=CC=C1C)O MCULE-5537152188 [0,0,0,0,1,0|3,0,0]=4 334 B12R1.1009 CC(=O)OC1=C(C=CC=C1C)C MCULE-6638110938 [0,0,0,0,1,0|1,0,0]=2 335 B12R1.1009 CC1=C(C(=CC=C1)Cl)CC(=O)O MCULE-7050786325 [0,0,0,0,1,0|1,0,0]=2 336 B12R1.1009 CC1=C(C(=NC=N1)O)CC(=O)O MCULE-2227648024 [0,0,0,0,1,0|3,0,0]=4 337 B12R1.1009 CC1=CC=CC(=C1CC(=O)O)C MCULE-2937234668 [0,0,0,0,1,0|0,0,0]=1 338 B12R1.1009 CC1=CC=CC(=C1NC(=O)N)C MCULE-9137551958 [0,0,0,0,1,0|2,0,0]=3 339 B12R1.1009 CC1=CC=CC(=C1NC(=S)N)C MCULE-8271719195 [0,0,0,0,1,0|2,1,0]=4 340 B12R1.1009 CC1=CC=CC(=C1OC(F)F)C MCULE-6559360785 [0,0,0,0,1,0|2,0,1]=4 341 B12R1.1009 CC1=NC=NC(=C1CC(=O)O)C MCULE-1122966095 [0,0,0,0,1,0|2,0,0]=3 342 B12R1.1009 CC1=NC=NC(=C1CC(=O)O)C MCULE-8933896740 [0,0,0,0,1,0|2,0,0]=3 343 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl MCULE-5536746271 [0,0,0,0,1,0|3,0,0]=4 344 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)Cl MCULE-8091847200 [0,0,0,0,1,0|3,0,0]=4 345 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)F MCULE-5187658120 [0,0,0,0,1,0|3,0,0]=4 346 B12R1.1009 NC1=CC=CC(=C1CC(=O)O)Br MCULE-8753766602 [0,0,0,0,1,0|2,0,0]=3 347 B12R1.1009 NC1=CC=CC(=C1CC(=O)O)F MCULE-8858707305 [0,0,0,0,1,0|2,0,0]=3 348 B12R1.1009 O=C(Cl)CC1=C(C=CC=C1Cl)Cl MCULE-3756273790 [0,0,0,0,1,0|3,0,0]=4 349 B12R1.1009 O=C(Cl)CC1=C(C=CC=C1Cl)F MCULE-1700976854 [0,0,0,0,1,0|3,0,0]=4 350 B12R1.1009 O=C(Cl)CC1=C(C=CC=C1F)F MCULE-9482862152 [0,0,0,0,1,0|3,0,0]=4 351 B12R1.1009 O=C(Cl)OC1=C(C=CC=C1Cl)Cl MCULE-5327492052 [0,0,0,0,1,0|3,0,0]=4 352 B12R1.1009 O=C(Cl)OC1=C(C=CC=C1F)F MCULE-8621989573 [0,0,0,0,1,0|3,0,0]=4 353 B12R1.1009 O=C(O)CC1=C(C=CC=C1Br)Br MCULE-3642758993 [0,0,0,0,1,0|2,0,0]=3 354 B12R1.1009 O=C(O)CC1=C(C=CC=C1Br)F MCULE-1539851221 [0,0,0,0,1,0|2,0,0]=3 355 B12R1.1009 O=C(O)CC1=C(C=CC=C1Br)I MCULE-2885209010 [0,0,0,0,1,0|2,0,0]=3 356 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Br MCULE-4301693417 [0,0,0,0,1,0|2,0,0]=3 357 B12R1.1009 O=C(O)CC1=C(C=CC=C1Cl)Cl MCULE-8904576757 [0,0,0,0,1,0|2,0,0]=3 358 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)Cl MCULE-1927395592 [0,0,0,0,1,0|2,0,0]=3 359 B12R1.1009 O=C(O)CC1=C(C=CC=C1F)F MCULE-5819969803 [0,0,0,0,1,0|2,0,0]=3 360 B12R1.1009 O=C(O)CC1=C(C=CC=C1O)Br MCULE-9551523252 [0,0,0,0,1,0|2,0,0]=3 361 B12R1.1009 O=C(O)CC1=C(C=CN=C1Cl)Cl MCULE-5954236618 [0,0,0,0,1,0|3,0,0]=4 362 B12R1.1009 O=C(O)CC1=C(C=NC=C1Cl)Cl MCULE-9163924192 [0,0,0,0,1,0|3,0,0]=4 363 B12R1.1009 O=C(O)CC1=C(C=NC=C1F)F MCULE-4670135422 [0,0,0,0,1,0|3,0,0]=4 364 B14R1.4920 CC1=CC=CC(=C1OCCC(=O)O)C MCULE-3401363599 [0,0,0,0,0,1|0,0,0]=1 365 B14R1.4920 O=C(O)CCCC1=C(C=CC=C1F)F MCULE-9620801280 [0,0,0,0,0,1|3,0,0]=4 366 B14R1.4920 O=C(O)CCOC1=C(C=CC=C1F)Cl MCULE-9369003030 [0,0,0,0,0,1|2,0,0]=3 367 B14R1.4920 O=C(O)CNCC1=C(C=CC=C1Cl)Cl MCULE-4326777667 [0,0,0,0,0,1|3,0,0]=4 368 B14R1.4920 O=C(O)CNCC1=C(C=CC=C1Cl)F MCULE-3822676547 [0,0,0,0,0,1|3,0,0]=4 369 B14R1.4920 O=C(O)CNCC1=C(C=CC=C1F)Cl MCULE-2778278812 [0,0,0,0,0,1|3,0,0]=4 370 B14R1.4920 O=C(O)CSCC1=C(C=CC=C1Cl)Cl MCULE-6251689132 [0,0,0,0,0,1|2,1,0]=4 371 B14R1.4920 O=C(O)CSCC1=C(C=CC=C1Cl)F MCULE-2912883290 [0,0,0,0,0,1|2,1,0]=4 372 B11R1.17 C#CCOC1=C(C=CC=C1)C MCULE-5442204371 [2,0,0,0,0,0|1,0,1]=4 373 B11R1.17 C=CCCC1=CC=CC=C1C MCULE-1369498924 [2,0,0,0,0,0|2,0,0]=4 374 B11R1.17 C=CCOC1=C(C=CC=C1)Br MCULE-9027100077 [2,0,0,0,0,0|2,0,0]=4 375 B11R1.17 C=CCOC1=C(C=CC=C1)F MCULE-2564415556 [2,0,0,0,0,0|2,0,0]=4 376 B11R1.17 C=CCOC1=C(C=CC=C1)I MCULE-7453192542 [2,0,0,0,0,0|2,0,0]=4 377 B11R1.17 C=CCOC1=C(C=CC=C1)O MCULE-4001036234 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.17 C=CCOC1=CC=CC=C1C MCULE-8096626228 [2,0,0,0,0,0|1,0,0]=3 379 B11R1.17 C=CCOC1=CC=CC=C1N MCULE-2958721991 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.17 C=CCOC1=CC=CC=C1N MCULE-8143511936 [2,0,0,0,0,0|2,0,0]=4 381 B11R1.17 CC1=C(C=CC=C1)CCC=O MCULE-1630847302 [2,0,0,0,0,0|1,0,0]=3 382 B11R1.17 CC1=C(C=CC=C1)CCCO MCULE-1965312124 [2,0,0,0,0,0|1,0,1]=4 383 B11R1.17 CC1=C(C=CC=C1)NCCO MCULE-1530678206 [2,0,0,0,0,0|1,0,1]=4 384 B11R1.17 CC1=C(C=CC=C1)OCCBr MCULE-4175409798 [2,0,0,0,0,0|1,0,1]=4 385 B11R1.17 CC1=C(C=CC=C1)OCCN MCULE-5685029154 [2,0,0,0,0,0|1,0,1]=4 386 B11R1.17 CC1=C(C=NC=C1)CCC=O MCULE-2518666968 [2,0,0,0,0,0|2,0,0]=4 387 B11R1.17 CC1=CC=CC=C1OCC#N MCULE-5121354297 [2,0,0,0,0,0|1,0,1]=4 388 B11R1.17 CC1=CC=CC=C1OCCCl MCULE-2655474660 [2,0,0,0,0,0|1,0,1]=4 389 B11R1.17 CC1=CC=CC=C1OCCF MCULE-1854326790 [2,0,0,0,0,0|1,0,1]=4 390 B11R1.17 CC1=CC=CC=C1OCCN MCULE-2565248077 [2,0,0,0,0,0|1,0,1]=4 391 B11R1.17 CC1=CC=CC=C1OCCO MCULE-2580645678 [2,0,0,0,0,0|0,0,1]=3 392 B11R1.17 CC1=NC=CC=C1OCCO MCULE-3583758699 [2,0,0,0,0,0|1,0,1]=4 393 B11R1.17 CCCOC1=CC=CC=C1C MCULE-6241356190 [2,0,0,0,0,0|1,0,1]=4 394 B11R1.17 COCOC1=CC=CC=C1C MCULE-3455571769 [2,0,0,0,0,0|2,0,0]=4 395 B11R1.17 NC1=CC=CC=C1OCCO MCULE-8129798557 [2,0,0,0,0,0|1,0,1]=4 396 B11R1.17 O=CCCC1=C(C=CC=C1)Cl MCULE-2894944859 [2,0,0,0,0,0|2,0,0]=4 397 B11R1.17 O=CCCC1=CC=CC=C1Br MCULE-6613714408 [2,0,0,0,0,0|2,0,0]=4 398 B11R1.17 O=CCCC1=CC=CC=C1F MCULE-9831382738 [2,0,0,0,0,0|2,0,0]=4 399 B11R1.17 OCCOC1=C(C=CC=C1)Br MCULE-7808627384 [2,0,0,0,0,0|1,0,1]=4 400 B11R1.17 OCCOC1=C(C=CC=C1)F MCULE-3859336199 [2,0,0,0,0,0|1,0,1]=4 401 B11R1.17 OCCOC1=C(C=CC=C1)O MCULE-5832605873 [2,0,0,0,0,0|1,0,1]=4 402 B11R1.17 OCCOC1=CC=CC=C1Cl MCULE-5612266011 [2,0,0,0,0,0|1,0,1]=4 403 B11R1.91 C=C(C)COC1=CC=CC=C1 MCULE-7083540702 [2,0,0,0,0,0|2,0,0]=4 404 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [2,0,0,0,0,0|2,0,0]=4 405 B11R1.91 CC(=O)COC1=CC=CC=C1 MCULE-8124389556 [2,0,0,0,0,0|1,0,0]=3 406 B11R1.91 CC(=O)COC1=NC=CC=C1 MCULE-9843455535 [2,0,0,0,0,0|2,0,0]=4 407 B11R1.91 CC(=O)CSC1=CC=CC=C1 MCULE-8704732850 [2,0,0,0,0,0|1,1,0]=4 408 B11R1.91 CC(O)COC1=CC=CC=C1 MCULE-7693044068 [2,0,0,0,0,0|1,0,1]=4 409 B11R1.91 N=C(N)COC1=CC=CC=C1 MCULE-2324789233 [2,0,0,0,0,0|2,0,0]=4 410 B11R1.91 N=C(N)COC1=CC=CC=C1 MCULE-8412140796 [2,0,0,0,0,0|2,0,0]=4 411 B11R1.91 NC(=O)CCC1=CC=CC=C1 MCULE-3588566414 [2,0,0,0,0,0|2,0,0]=4 412 B11R1.91 NC(=O)CNC1=CC=CC=C1 MCULE-7476540506 [2,0,0,0,0,0|2,0,0]=4 413 B11R1.91 NC(=O)COC1=CC=CC=C1 MCULE-6625282279 [2,0,0,0,0,0|1,0,0]=3 414 B11R1.91 NC(=O)CSC1=CC=CC=C1 MCULE-3396189878 [2,0,0,0,0,0|1,1,0]=4 415 B11R1.91 NC(=S)COC1=CC=CC=C1 MCULE-7627348027 [2,0,0,0,0,0|1,1,0]=4 416 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 MCULE-2895233000 [2,0,0,0,0,0|2,0,0]=4 417 B11R1.91 O=C(Cl)CNC1=CC=CC=C1 MCULE-1633452872 [2,0,0,0,0,0|2,0,0]=4 418 B11R1.91 O=C(Cl)COC1=CC=CC=C1 MCULE-9859987129 [2,0,0,0,0,0|1,0,0]=3 419 B11R1.91 O=C(Cl)CSC1=CC=CC=C1 MCULE-8287615777 [2,0,0,0,0,0|1,1,0]=4 420 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 MCULE-1077406303 [2,0,0,0,0,0|1,0,1]=4 421 B11R1.91 O=C(O)C#CC1=CC=CC=C1 MCULE-1724525388 [2,0,0,0,0,0|1,0,1]=4 422 B11R1.91 O=C(O)C=CC1=CC=CC=C1 MCULE-4051659199 [2,0,0,0,0,0|1,0,1]=4 423 B11R1.91 O=C(O)CCC1=CC=CC=C1 MCULE-1670073750 [2,0,0,0,0,0|1,0,0]=3 424 B11R1.91 O=C(O)CCC1=CC=CC=N1 MCULE-7798422459 [2,0,0,0,0,0|2,0,0]=4 425 B11R1.91 O=C(O)CCC1=CC=NC=C1 MCULE-4931237552 [2,0,0,0,0,0|2,0,0]=4 426 B11R1.91 O=C(O)CCC1=CN=CC=C1 MCULE-9809125467 [2,0,0,0,0,0|2,0,0]=4 427 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-3850875705 [2,0,0,0,0,0|2,0,0]=4 428 B11R1.91 O=C(O)CCC1=NC=CC=C1 MCULE-7947562908 [2,0,0,0,0,0|2,0,0]=4 429 B11R1.91 O=C(O)CNC1=CC=CC=C1 MCULE-4813130378 [2,0,0,0,0,0|1,0,0]=3 430 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-1578102322 [2,0,0,0,0,0|2,0,0]=4 431 B11R1.91 O=C(O)CNC1=CC=CN=C1 MCULE-6139247264 [2,0,0,0,0,0|2,0,0]=4 432 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-3150988193 [2,0,0,0,0,0|2,0,0]=4 433 B11R1.91 O=C(O)CNC1=CC=NC=C1 MCULE-6561822983 [2,0,0,0,0,0|2,0,0]=4 434 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5066813794 [2,0,0,0,0,0|2,0,0]=4 435 B11R1.91 O=C(O)CNC1=NC=CC=C1 MCULE-5626569031 [2,0,0,0,0,0|2,0,0]=4 436 B11R1.91 O=C(O)COC1=CC=CC=C1 MCULE-5625991303 [2,0,0,0,0,0|0,0,0]=2 437 B11R1.91 O=C(O)COC1=CC=CC=N1 MCULE-4844717094 [2,0,0,0,0,0|1,0,0]=3 438 B11R1.91 O=C(O)COC1=CC=NC=C1 MCULE-5903809736 [2,0,0,0,0,0|1,0,0]=3 439 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-1733906903 [2,0,0,0,0,0|1,0,0]=3 440 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-2439507515 [2,0,0,0,0,0|1,0,0]=3 441 B11R1.91 O=C(O)COC1=CN=CC=C1 MCULE-3978081968 [2,0,0,0,0,0|1,0,0]=3 442 B11R1.91 O=C(O)COC1=NC=CC=C1 MCULE-2958185004 [2,0,0,0,0,0|1,0,0]=3 443 B11R1.91 O=C(O)COC1=NC=CC=N1 MCULE-4203130703 [2,0,0,0,0,0|2,0,0]=4 444 B11R1.91 O=C(O)COC1=NN=CC=C1 MCULE-3500815204 [2,0,0,0,0,0|2,0,0]=4 445 B11R1.91 O=C(O)CSC1=CC=CC=C1 MCULE-4616509502 [2,0,0,0,0,0|0,1,0]=3 446 B11R1.91 O=C(O)CSC1=CC=NC=C1 MCULE-7699690938 [2,0,0,0,0,0|1,1,0]=4 447 B11R1.91 O=C(O)CSC1=NC=CC=C1 MCULE-3224679092 [2,0,0,0,0,0|1,1,0]=4 448 B11R1.91 O=C([O-])CCC1=CC=CC=C1 MCULE-5708877330 [2,0,0,0,0,0|1,0,1]=4 449 B11R1.91 O=C([O-])CNC1=CC=CC=C1 MCULE-9404328653 [2,0,0,0,0,0|1,0,1]=4 450 B11R1.91 O=C([O-])COC1=CC=CC=C1 MCULE-2112503384 [2,0,0,0,0,0|0,0,1]=3 451 B11R1.91 O=C([O-])COC1=NC=CC=C1 MCULE-7533065514 [2,0,0,0,0,0|1,0,1]=4 452 B11R1.605 C#CCC1=C(C=CC=C1C)C MCULE-7222742925 [2,0,0,0,0,0|1,0,1]=4 453 B11R1.605 C=CCC1=C(C=CC=C1C)C MCULE-9774669896 [2,0,0,0,0,0|1,0,0]=3 454 B11R1.605 C=CCC1=C(C=CC=C1Cl)C MCULE-1818415233 [2,0,0,0,0,0|2,0,0]=4 455 B11R1.605 CC1=CC=CC(=C1C=NO)C MCULE-2159353970 [2,0,0,0,0,0|1,0,1]=4 456 B11R1.605 CC1=CC=CC(=C1CC#N)C MCULE-3682527667 [2,0,0,0,0,0|1,0,1]=4 457 B11R1.605 CC1=CC=CC(=C1CC=O)C MCULE-8040740774 [2,0,0,0,0,0|0,0,0]=2 458 B11R1.605 CC1=CC=CC(=C1CCN)C MCULE-3092254887 [2,0,0,0,0,0|1,0,1]=4 459 B11R1.605 CC1=CC=CC(=C1CCO)C MCULE-9193229583 [2,0,0,0,0,0|0,0,1]=3 460 B11R1.605 CC1=CC=CC(=C1CON)C MCULE-3404767799 [2,0,0,0,0,0|2,0,0]=4 461 B11R1.605 CC1=CC=CC(=C1CON)C MCULE-6695398319 [2,0,0,0,0,0|2,0,0]=4 462 B11R1.605 CC1=CC=CC(=C1N=C=O)C MCULE-5381939284 [2,0,0,0,0,0|1,0,1]=4 463 B11R1.605 CC1=CC=CC(=C1N=S=O)C MCULE-1830390854 [2,0,0,0,0,0|2,0,0]=4 464 B11R1.605 CC1=CC=CC(=C1NC=O)C MCULE-2076127194 [2,0,0,0,0,0|1,0,0]=3 465 B11R1.605 CCNC1=C(C=CC=C1C)C MCULE-2368612854 [2,0,0,0,0,0|1,0,1]=4 466 B11R1.605 CCOC1=C(C=CC=C1C)Br MCULE-6643237884 [2,0,0,0,0,0|1,0,1]=4 467 B11R1.605 CCOC1=C(C=CC=C1C)C MCULE-9270451135 [2,0,0,0,0,0|0,0,1]=3 468 B11R1.605 CCOC1=C(C=CC=C1C)N MCULE-9022613260 [2,0,0,0,0,0|1,0,1]=4 469 B11R1.605 CNCC1=C(C=CC=C1C)C MCULE-3070904231 [2,0,0,0,0,0|2,0,0]=4 470 B11R1.605 CNCC1=C(C=CC=C1C)C MCULE-8773889625 [2,0,0,0,0,0|2,0,0]=4 471 B11R1.605 CSCC1=C(C=CC=C1C)C MCULE-5147483460 [2,0,0,0,0,0|2,0,0]=4 472 B11R1.605 O=CCC1=C(C=CC=C1Cl)Cl MCULE-3159729702 [2,0,0,0,0,0|2,0,0]=4 473 B11R1.605 O=CCC1=C(C=CC=C1Cl)F MCULE-3415793229 [2,0,0,0,0,0|2,0,0]=4 474 B11R1.605 O=CCC1=C(C=CC=C1F)F MCULE-4448672392 [2,0,0,0,0,0|2,0,0]=4 475 B13R1.90 C=C(C)COC1=CC=CC=C1CO MCULE-9617298079 [1,1,0,0,0,0|2,0,0]=4 476 B13R1.90 C=CC1=CC=CC=C1OCC(=O)O MCULE-2322182634 [1,1,0,0,0,0|0,0,1]=3 477 B13R1.90 CC(=O)COC1=C(C=CC=C1)C#N MCULE-6506689448 [1,1,0,0,0,0|1,0,1]=4 478 B13R1.90 CC(O)COC1=C(C=CC=C1)CN MCULE-1453682414 [1,1,0,0,0,0|1,0,1]=4 479 B13R1.90 CC(O)COC1=C(C=CC=C1)CN MCULE-1537335028 [1,1,0,0,0,0|1,0,1]=4 480 B13R1.90 CCC1=C(C=CC=C1)/C=C/C(=O)O MCULE-7885578000 [1,1,0,0,0,0|1,0,1]=4 481 B13R1.90 CCC1=C(C=CC=C1)C=CC(=O)O MCULE-6217421798 [1,1,0,0,0,0|1,0,1]=4 482 B13R1.90 CCC1=C(C=CC=C1)CCC(=O)O MCULE-5649569072 [1,1,0,0,0,0|1,0,0]=3 483 B13R1.90 CCC1=C(C=CC=C1)NCC(=O)O MCULE-4975994630 [1,1,0,0,0,0|1,0,0]=3 484 B13R1.90 CCC1=C(C=CC=C1)OCC(=O)O MCULE-9590469317 [1,1,0,0,0,0|0,0,0]=2 485 B13R1.90 CCC1=CC=CC=C1C#CC(=O)O MCULE-4469431566 [1,1,0,0,0,0|1,0,1]=4 486 B13R1.90 COC1=C(C=CC=C1)C#CC(=O)O MCULE-3551078164 [1,1,0,0,0,0|1,0,1]=4 487 B13R1.90 COC1=C(C=CC=C1)CCC(=O)C MCULE-7917243999 [1,1,0,0,0,0|2,0,0]=4 488 B13R1.90 COC1=C(C=CC=C1)CCC(=O)Cl MCULE-9494866151 [1,1,0,0,0,0|2,0,0]=4 489 B13R1.90 COC1=C(C=CC=C1)NCC(=O)O MCULE-9578368069 [1,1,0,0,0,0|1,0,0]=3 490 B13R1.90 COC1=C(C=CC=C1)OCC(=O)N MCULE-9042627931 [1,1,0,0,0,0|1,0,0]=3 491 B13R1.90 COC1=C(C=CC=C1)OCC(C)O MCULE-8865268610 [1,1,0,0,0,0|1,0,1]=4 492 B13R1.90 COC1=C(C=CC=C1)SCC(=O)O MCULE-7477264520 [1,1,0,0,0,0|0,1,0]=3 493 B13R1.90 COC1=C(C=CC=N1)CCC(=O)O MCULE-6923035200 [1,1,0,0,0,0|2,0,0]=4 494 B13R1.90 COC1=C(C=CN=C1)CCC(=O)O MCULE-8251474026 [1,1,0,0,0,0|2,0,0]=4 495 B13R1.90 COC1=C(C=NC=C1)CCC(=O)O MCULE-6190512838 [1,1,0,0,0,0|2,0,0]=4 496 B13R1.90 COC1=C(N=CC=C1)CCC(=O)O MCULE-8681009799 [1,1,0,0,0,0|2,0,0]=4 497 B13R1.90 COC1=CC=CC=C1/C=C/C(=O)O MCULE-8899868802 [1,1,0,0,0,0|1,0,1]=4 498 B13R1.90 COC1=CC=CC=C1/C=C\C(=O)O MCULE-9054021938 [1,1,0,0,0,0|1,0,1]=4 499 B13R1.90 COC1=CC=CC=C1C=CC(=O)O MCULE-3461622518 [1,1,0,0,0,0|1,0,1]=4 500 B13R1.90 COC1=CC=CC=C1CCC(=O)O MCULE-1258270395 [1,1,0,0,0,0|1,0,0]=3 501 B13R1.90 COC1=CC=CC=C1OCC(=N)N MCULE-1031681902 [1,1,0,0,0,0|2,0,0]=4 502 B13R1.90 COC1=CC=CC=C1OCC(=N)N MCULE-8552806743 [1,1,0,0,0,0|2,0,0]=4 503 B13R1.90 COC1=CC=CC=C1OCC(=O)C MCULE-3613649504 [1,1,0,0,0,0|1,0,0]=3 504 B13R1.90 COC1=CC=CC=C1OCC(=O)Cl MCULE-2612833532 [1,1,0,0,0,0|1,0,0]=3 505 B13R1.90 COC1=CC=CC=C1OCC(=O)O MCULE-3487267475 [1,1,0,0,0,0|0,0,0]=2 506 B13R1.90 COC1=CC=CC=C1OCC(=O)[O-] MCULE-6785914379 [1,1,0,0,0,0|0,0,1]=3 507 B13R1.90 COC1=NC=CC=C1SCC(=O)O MCULE-3235803503 [1,1,0,0,0,0|1,1,0]=4 508 B13R1.90 CSC1=CC=CC=C1OCC(=O)O MCULE-5696408001 [1,1,0,0,0,0|0,0,0]=2 509 B13R1.90 N#CC1=C(C=CC=C1)CCC(=O)O MCULE-9936278616 [1,1,0,0,0,0|1,0,1]=4 510 B13R1.90 N#CC1=C(C=CC=C1)NCC(=O)O MCULE-2842796162 [1,1,0,0,0,0|1,0,1]=4 511 B13R1.90 N#CC1=C(C=CC=C1)OCC(=O)O MCULE-3106293154 [1,1,0,0,0,0|0,0,1]=3 512 B13R1.90 N#CC1=CC=CC=C1OCC(=O)N MCULE-8175551418 [1,1,0,0,0,0|1,0,1]=4 513 B13R1.90 NC(=O)COC1=C(C=CC=C1)C=O MCULE-6096725708 [1,1,0,0,0,0|1,0,1]=4 514 B13R1.90 NCC1=C(C=CC=C1)CCC(=O)O MCULE-5925184388 [1,1,0,0,0,0|1,0,0]=3 515 B13R1.90 NCC1=C(C=CC=C1)CCC(=O)O MCULE-9449119489 [1,1,0,0,0,0|1,0,0]=3 516 B13R1.90 NCC1=CC=CC=C1OCC(=O)O MCULE-8665331888 [1,1,0,0,0,0|0,0,0]=2 517 B13R1.90 O=C(O)CCC1=CC=CC=C1CO MCULE-3184331379 [1,1,0,0,0,0|1,0,0]=3 518 B13R1.90 O=C(O)COC1=C(C=CC=C1)CO MCULE-9317810362 [1,1,0,0,0,0|0,0,0]=2 519 B13R1.90 O=CC1=CC=CC=C1OCC(=O)O MCULE-7880702668 [1,1,0,0,0,0|0,0,1]=3 520 B13R1.150 CC1=C(C(=CC=C1)CCC(=O)O)Br MCULE-3804017325 [1,1,0,0,0,0|2,0,0]=4 521 B13R1.150 CC1=C(C(=CC=C1)CCC(=O)O)C MCULE-7229413741 [1,1,0,0,0,0|1,0,0]=3 522 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)Cl)C MCULE-2354430338 [1,1,0,0,0,0|1,0,0]=3 523 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)N)Br MCULE-4686757741 [1,1,0,0,0,0|2,0,0]=4 524 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)N)C MCULE-5553244251 [1,1,0,0,0,0|1,0,0]=3 525 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)O)C MCULE-8473278629 [1,1,0,0,0,0|0,0,0]=2 526 B13R1.150 CC1=C(C(=CC=C1)OCC(=O)O)F MCULE-6230442553 [1,1,0,0,0,0|1,0,0]=3 527 B13R1.150 CC1=C(C=CC=C1/C=C/C(=O)O)F MCULE-6026950985 [1,1,0,0,0,0|1,0,1]=4 528 B13R1.150 CC1=C(C=CC=C1CCC(=O)O)Br MCULE-4567041559 [1,1,0,0,0,0|1,0,0]=3 529 B13R1.150 CC1=C(C=CC=C1CCC(=O)O)F MCULE-6037696218 [1,1,0,0,0,0|1,0,0]=3 530 B13R1.150 CC1=C(C=CC=C1Cl)C#CC(=O)O MCULE-2107531852 [1,1,0,0,0,0|1,0,1]=4 531 B13R1.150 CC1=C(C=CC=C1Cl)OCC(=O)O MCULE-8169039109 [1,1,0,0,0,0|0,0,0]=2 532 B13R1.150 CC1=C(C=CC=C1Cl)SCC(=O)O MCULE-7642761661 [1,1,0,0,0,0|0,1,0]=3 533 B13R1.150 CC1=C(C=CC=C1F)C=CC(=O)O MCULE-7339897321 [1,1,0,0,0,0|1,0,1]=4 534 B13R1.150 CC1=C(C=CC=C1NCC(=O)O)Cl MCULE-9227409323 [1,1,0,0,0,0|1,0,0]=3 535 B13R1.150 CC1=CC=CC(=C1C)C#CC(=O)O MCULE-2825325205 [1,1,0,0,0,0|1,0,1]=4 536 B13R1.150 CC1=CC=CC(=C1C)C=CC(=O)O MCULE-3057229377 [1,1,0,0,0,0|1,0,1]=4 537 B13R1.150 CC1=CC=CC(=C1C)NCC(=O)O MCULE-1299502816 [1,1,0,0,0,0|1,0,0]=3 538 B13R1.150 CC1=CC=CC(=C1F)CCC(=O)O MCULE-6684435337 [1,1,0,0,0,0|2,0,0]=4 539 B13R1.150 NC(=O)COC1=CC=CC(=C1Br)Cl MCULE-1979893754 [1,1,0,0,0,0|2,0,0]=4 540 B13R1.150 NC(=O)COC1=CC=CC(=C1Br)F MCULE-1607146662 [1,1,0,0,0,0|2,0,0]=4 541 B13R1.150 NC1=C(C(=CC=C1)CCC(=O)O)Br MCULE-1105635411 [1,1,0,0,0,0|2,0,0]=4 542 B13R1.150 O=C(Cl)COC1=CC=CC(=C1Cl)Cl MCULE-5550279486 [1,1,0,0,0,0|2,0,0]=4 543 B13R1.150 O=C(O)CCC1=C(C(=CC=C1)Cl)Cl MCULE-5031742857 [1,1,0,0,0,0|2,0,0]=4 544 B13R1.150 O=C(O)CCC1=C(C(=CC=C1)F)Br MCULE-3552241811 [1,1,0,0,0,0|2,0,0]=4 545 B13R1.150 O=C(O)CCC1=C(C(=CC=C1)F)F MCULE-3046930496 [1,1,0,0,0,0|2,0,0]=4 546 B13R1.150 O=C(O)CCC1=C(C(=CC=C1)O)O MCULE-4062301450 [1,1,0,0,0,0|2,0,0]=4 547 B13R1.150 O=C(O)CCC1=CC=CC(=C1Cl)Br MCULE-3355264966 [1,1,0,0,0,0|2,0,0]=4 548 B13R1.150 O=C(O)CCC1=CC=CC(=C1Cl)F MCULE-4843444566 [1,1,0,0,0,0|2,0,0]=4 549 B13R1.150 O=C(O)CCC1=CC=CC(=C1F)Br MCULE-5476544771 [1,1,0,0,0,0|2,0,0]=4 550 B13R1.150 O=C(O)CCC1=CC=CC(=C1F)Cl MCULE-5154929555 [1,1,0,0,0,0|2,0,0]=4 551 B13R1.150 O=C(O)COC1=C(C(=CC=C1)Cl)Cl MCULE-7912433796 [1,1,0,0,0,0|1,0,0]=3 552 B13R1.150 O=C(O)COC1=CC=CC(=C1F)Br MCULE-2591468923 [1,1,0,0,0,0|1,0,0]=3 553 B13R1.150 O=C(O)COC1=CC=CC(=C1O)O MCULE-1686341438 [1,1,0,0,0,0|1,0,0]=3 554 B13R1.150 O=C(O)CSC1=C(C(=CC=C1)Cl)Cl MCULE-9040148561 [1,1,0,0,0,0|1,1,0]=4 555 B13R1.157 O=P(O)(O)COC1=C(C=CC=C1)O MCULE-5861495695 [1,1,0,0,0,0|2,0,0]=4 556 B13R1.164 CC(=O)COC1=C(C=C(C=C1)Cl)Cl MCULE-9195463974 [1,1,0,0,0,0|2,0,0]=4 557 B13R1.164 CC1=C(C=CC(=C1)Br)NCC(=O)O MCULE-2158700604 [1,1,0,0,0,0|1,0,0]=3 558 B13R1.164 CC1=C(C=CC(=C1)Br)OCC(=O)N MCULE-3025281370 [1,1,0,0,0,0|1,0,0]=3 559 B13R1.164 CC1=C(C=CC(=C1)Br)OCC(=O)O MCULE-6292271105 [1,1,0,0,0,0|0,0,0]=2 560 B13R1.164 CC1=C(C=CC(=C1)Cl)C#CC(=O)O MCULE-6751901161 [1,1,0,0,0,0|1,0,1]=4 561 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)N MCULE-9968404062 [1,1,0,0,0,0|1,0,0]=3 562 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)O MCULE-3405120876 [1,1,0,0,0,0|0,0,0]=2 563 B13R1.164 CC1=C(C=CC(=C1)Cl)OCC(=O)[O-] MCULE-8822562838 [1,1,0,0,0,0|0,0,1]=3 564 B13R1.164 CC1=C(C=CC(=C1)F)CCC(=O)O MCULE-1013388620 [1,1,0,0,0,0|1,0,0]=3 565 B13R1.164 CC1=C(C=CC(=C1)N)OCC(=O)O MCULE-1853093698 [1,1,0,0,0,0|0,0,0]=2 566 B13R1.164 CC1=CC(=C(C=C1)C#CC(=O)O)C MCULE-8316562714 [1,1,0,0,0,0|1,0,1]=4 567 B13R1.164 CC1=CC(=C(C=C1)C=CC(=O)O)C MCULE-1694881584 [1,1,0,0,0,0|1,0,1]=4 568 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)Br MCULE-6766787776 [1,1,0,0,0,0|2,0,0]=4 569 B13R1.164 CC1=CC(=C(C=C1)CCC(=O)O)C MCULE-6418950097 [1,1,0,0,0,0|1,0,0]=3 570 B13R1.164 CC1=CC(=C(C=C1)NCC(=O)O)C MCULE-2134932799 [1,1,0,0,0,0|1,0,0]=3 571 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)Cl)C MCULE-9756133713 [1,1,0,0,0,0|1,0,0]=3 572 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)N)Br MCULE-9505961665 [1,1,0,0,0,0|2,0,0]=4 573 B13R1.164 CC1=CC(=C(C=C1)OCC(=O)N)C MCULE-9697219196 [1,1,0,0,0,0|1,0,0]=3 574 B13R1.164 CC1=CC(=C(C=C1)SCC(=O)O)C MCULE-7611143326 [1,1,0,0,0,0|0,1,0]=3 575 B13R1.164 CC1=CC(=CC=C1C#CC(=O)O)F MCULE-3671418886 [1,1,0,0,0,0|1,0,1]=4 576 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)F MCULE-5476342488 [1,1,0,0,0,0|1,0,1]=4 577 B13R1.164 CC1=CC(=CC=C1C=CC(=O)O)O MCULE-1922876294 [1,1,0,0,0,0|1,0,1]=4 578 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Br MCULE-8861086857 [1,1,0,0,0,0|1,0,0]=3 579 B13R1.164 CC1=CC(=CC=C1CCC(=O)O)Cl MCULE-6046464602 [1,1,0,0,0,0|1,0,0]=3 580 B13R1.164 CC1=CC(=CC=C1OCC(=O)Cl)Cl MCULE-7385167462 [1,1,0,0,0,0|1,0,0]=3 581 B13R1.164 CC1=CC(=CC=C1OCC(=O)N)N MCULE-2881588201 [1,1,0,0,0,0|1,0,0]=3 582 B13R1.164 CC1=CC(=CC=C1OCC(=O)O)F MCULE-7359119685 [1,1,0,0,0,0|0,0,0]=2 583 B13R1.164 CC1=CC(=CC=C1OCC(=O)[O-])Cl MCULE-4971672877 [1,1,0,0,0,0|0,0,1]=3 584 B13R1.164 CC1=CC(=CC=C1SCC(=O)O)Br MCULE-6865374244 [1,1,0,0,0,0|0,1,0]=3 585 B13R1.164 CC1=CC(=O)C(=CN1)OCC(=O)O MCULE-1432850427 [1,1,0,0,0,0|2,0,0]=4 586 B13R1.164 CC1=CC(=O)C(=CO1)OCC(=O)O MCULE-7455315009 [1,1,0,0,0,0|2,0,0]=4 587 B13R1.164 CC1=CC=C(C(=C1)Br)OCC(=O)O MCULE-4948736396 [1,1,0,0,0,0|1,0,0]=3 588 B13R1.164 CC1=CC=C(C(=C1)C)/C=C/C(=O)O MCULE-5580725255 [1,1,0,0,0,0|1,0,1]=4 589 B13R1.164 CC1=CC=C(C(=C1)C)OCC(=O)O MCULE-9147952930 [1,1,0,0,0,0|0,0,0]=2 590 B13R1.164 CC1=CC=C(C(=C1)Cl)OCC(=O)O MCULE-9724689973 [1,1,0,0,0,0|1,0,0]=3 591 B13R1.164 CC1=CC=C(C(=C1)F)CCC(=O)O MCULE-4790737763 [1,1,0,0,0,0|2,0,0]=4 592 B13R1.164 CC1=CC=C(C(=C1)F)NCC(=O)O MCULE-5608789891 [1,1,0,0,0,0|2,0,0]=4 593 B13R1.164 CC1=CC=C(C(=N1)C)CCC(=O)O MCULE-2624440825 [1,1,0,0,0,0|2,0,0]=4 594 B13R1.164 NC(=O)COC1=C(C=C(C=C1)Br)Br MCULE-5879690406 [1,1,0,0,0,0|2,0,0]=4 595 B13R1.164 NC(=O)COC1=C(C=C(C=C1)Br)Cl MCULE-8196782479 [1,1,0,0,0,0|2,0,0]=4 596 B13R1.164 NC(=O)COC1=C(C=C(C=C1)F)Cl MCULE-1885585060 [1,1,0,0,0,0|2,0,0]=4 597 B13R1.164 NC(=O)COC1=C(C=C(C=C1)F)F MCULE-5147981868 [1,1,0,0,0,0|2,0,0]=4 598 B13R1.164 NC(=O)COC1=CC=C(C=C1Br)N MCULE-2767877971 [1,1,0,0,0,0|2,0,0]=4 599 B13R1.164 NC(=O)COC1=CC=C(C=C1Cl)Cl MCULE-4232728338 [1,1,0,0,0,0|2,0,0]=4 600 B13R1.164 NC(=O)COC1=CC=C(C=C1F)N MCULE-7230201685 [1,1,0,0,0,0|2,0,0]=4 601 B13R1.164 NC1=CC=C(C(=C1)Br)OCC(=O)O MCULE-6678781700 [1,1,0,0,0,0|1,0,0]=3 602 B13R1.164 NC1=CC=C(C(=C1)F)CCC(=O)O MCULE-3007647292 [1,1,0,0,0,0|2,0,0]=4 603 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)Br)Br MCULE-8041283934 [1,1,0,0,0,0|2,0,0]=4 604 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)Cl)Cl MCULE-6311903546 [1,1,0,0,0,0|2,0,0]=4 605 B13R1.164 O=C(Cl)COC1=C(C=C(C=C1)F)F MCULE-3036083125 [1,1,0,0,0,0|2,0,0]=4 606 B13R1.164 O=C(Cl)COC1=CC=C(C=C1Cl)Br MCULE-7139290333 [1,1,0,0,0,0|2,0,0]=4 607 B13R1.164 O=C(Cl)COC1=CC=C(C=C1Cl)F MCULE-4628341214 [1,1,0,0,0,0|2,0,0]=4 608 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)Br MCULE-2555097895 [1,1,0,0,0,0|2,0,0]=4 609 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Br)F MCULE-2307054648 [1,1,0,0,0,0|2,0,0]=4 610 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)Cl MCULE-4616446158 [1,1,0,0,0,0|2,0,0]=4 611 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)F MCULE-4908436802 [1,1,0,0,0,0|2,0,0]=4 612 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)Cl)O MCULE-7610233894 [1,1,0,0,0,0|2,0,0]=4 613 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)F)F MCULE-4713099592 [1,1,0,0,0,0|2,0,0]=4 614 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)Cl MCULE-3999378523 [1,1,0,0,0,0|2,0,0]=4 615 B13R1.164 O=C(O)CCC1=C(C=C(C=C1)O)F MCULE-3984526308 [1,1,0,0,0,0|2,0,0]=4 616 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)Cl MCULE-7576387587 [1,1,0,0,0,0|2,0,0]=4 617 B13R1.164 O=C(O)CCC1=CC=C(C=C1Br)F MCULE-8205149810 [1,1,0,0,0,0|2,0,0]=4 618 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)Br MCULE-2448713732 [1,1,0,0,0,0|2,0,0]=4 619 B13R1.164 O=C(O)CCC1=CC=C(C=C1Cl)F MCULE-2575221656 [1,1,0,0,0,0|2,0,0]=4 620 B13R1.164 O=C(O)CCC1=CC=C(C=C1O)O MCULE-2725234741 [1,1,0,0,0,0|2,0,0]=4 621 B13R1.164 O=C(O)CNC1=CC=C(C=C1F)F MCULE-8553039611 [1,1,0,0,0,0|2,0,0]=4 622 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)Br MCULE-5338022751 [1,1,0,0,0,0|1,0,0]=3 623 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)Cl MCULE-2854812128 [1,1,0,0,0,0|1,0,0]=3 624 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Br)F MCULE-7103639142 [1,1,0,0,0,0|1,0,0]=3 625 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)Cl MCULE-7323613760 [1,1,0,0,0,0|1,0,0]=3 626 B13R1.164 O=C(O)COC1=C(C=C(C=C1)Cl)F MCULE-6325296568 [1,1,0,0,0,0|1,0,0]=3 627 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)Br MCULE-2782899090 [1,1,0,0,0,0|1,0,0]=3 628 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)Cl MCULE-1850622872 [1,1,0,0,0,0|1,0,0]=3 629 B13R1.164 O=C(O)COC1=C(C=C(C=C1)F)F MCULE-6142280248 [1,1,0,0,0,0|1,0,0]=3 630 B13R1.164 O=C(O)COC1=CC=C(C=C1Br)Cl MCULE-9503443931 [1,1,0,0,0,0|1,0,0]=3 631 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)Cl MCULE-6841252961 [1,1,0,0,0,0|1,0,0]=3 632 B13R1.164 O=C(O)COC1=CC=C(C=C1Cl)O MCULE-9424477231 [1,1,0,0,0,0|1,0,0]=3 633 B13R1.164 O=C(O)COC1=CC=C(C=C1I)Cl MCULE-8358512420 [1,1,0,0,0,0|1,0,0]=3 634 B13R1.164 O=C(O)COC1=CC=C(C=C1O)Cl MCULE-9623510680 [1,1,0,0,0,0|1,0,0]=3 635 B13R1.164 O=C(O)COC1=NC=C(C=C1Cl)Cl MCULE-7969184423 [1,1,0,0,0,0|2,0,0]=4 636 B13R1.164 O=C(O)CSC1=C(C=C(C=C1)F)Cl MCULE-6270813625 [1,1,0,0,0,0|1,1,0]=4 637 B13R1.164 O=C(O)CSC1=C(C=C(C=C1)F)F MCULE-7511205312 [1,1,0,0,0,0|1,1,0]=4 638 B13R1.164 O=C(O)CSC1=CC=C(C=C1Cl)Cl MCULE-7751197473 [1,1,0,0,0,0|1,1,0]=4 639 B13R1.164 O=C([O-])COC1=CC=C(C=C1Cl)Cl MCULE-2432700258 [1,1,0,0,0,0|1,0,1]=4 640 B13R1.164 O=C([O-])COC1=CC=C(C=C1Cl)Cl MCULE-5459302647 [1,1,0,0,0,0|1,0,1]=4 641 B13R1.201 CC(=CC(=O)O)C1=C(C=CC=C1)C MCULE-8787555330 [1,1,0,0,0,0|1,0,1]=4 642 B13R1.201 CC(=O)CC(=O)C1=CC=CC=C1C MCULE-8100231015 [1,1,0,0,0,0|2,0,0]=4 643 B13R1.201 CC(CC(=O)O)C1=C(C=CC=C1)Br MCULE-5346134558 [1,1,0,0,0,0|2,0,0]=4 644 B13R1.201 CC(CC(=O)O)C1=C(C=CC=C1)Cl MCULE-6381795911 [1,1,0,0,0,0|2,0,0]=4 645 B13R1.201 CC(CC(=O)O)C1=C(C=CC=C1)F MCULE-9853096824 [1,1,0,0,0,0|2,0,0]=4 646 B13R1.201 CC1=C(C=CC=C1)C(C)CC(=O)O MCULE-1940027299 [1,1,0,0,0,0|1,0,0]=3 647 B13R1.201 CC1=C(C=CC=C1)C(N)CC(=O)O MCULE-3857105495 [1,1,0,0,0,0|1,0,0]=3 648 B13R1.201 CC1=C(C=CC=C1)C(N)CC(=O)O MCULE-8413444787 [1,1,0,0,0,0|1,0,0]=3 649 B13R1.201 CC1=C(C=CC=C1)[C@@H](N)CC(=O)O MCULE-3601172192 [1,1,0,0,0,0|1,0,0]=3 650 B13R1.201 CC1=C(C=CC=C1)[C@@H](N)CC(=O)O MCULE-6049562326 [1,1,0,0,0,0|1,0,0]=3 651 B13R1.201 CC1=CC=CC=C1C(O)CC(=O)O MCULE-4101559300 [1,1,0,0,0,0|1,0,0]=3 652 B13R1.201 CC1=CC=CC=C1[C@@H](N)CC(=O)O MCULE-1733307768 [1,1,0,0,0,0|1,0,0]=3 653 B13R1.201 CC1=CC=CC=C1[C@@H](N)CC(=O)O MCULE-9693068609 [1,1,0,0,0,0|1,0,0]=3 654 B13R1.201 CC1=CC=CC=C1[C@H](N)CC(=O)O MCULE-3290294040 [1,1,0,0,0,0|1,0,0]=3 655 B13R1.201 CC1=CC=CC=C1[C@H](N)CC(=O)O MCULE-9561799195 [1,1,0,0,0,0|1,0,0]=3 656 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)Cl MCULE-6871814675 [1,1,0,0,0,0|2,0,0]=4 657 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)F MCULE-8493662538 [1,1,0,0,0,0|2,0,0]=4 658 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)I MCULE-4417945438 [1,1,0,0,0,0|2,0,0]=4 659 B13R1.201 NC(CC(=O)O)C1=C(C=CC=C1)O MCULE-3137402305 [1,1,0,0,0,0|2,0,0]=4 660 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Br MCULE-1406006969 [1,1,0,0,0,0|2,0,0]=4 661 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Cl MCULE-9668686300 [1,1,0,0,0,0|2,0,0]=4 662 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1O MCULE-4239540894 [1,1,0,0,0,0|2,0,0]=4 663 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1Br MCULE-7220804757 [1,1,0,0,0,0|2,0,0]=4 664 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1Br MCULE-9590414534 [1,1,0,0,0,0|2,0,0]=4 665 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1Cl MCULE-4469915688 [1,1,0,0,0,0|2,0,0]=4 666 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1Cl MCULE-5664240919 [1,1,0,0,0,0|2,0,0]=4 667 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1Cl MCULE-9832661970 [1,1,0,0,0,0|2,0,0]=4 668 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1F MCULE-2384747150 [1,1,0,0,0,0|2,0,0]=4 669 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1F MCULE-5490656771 [1,1,0,0,0,0|2,0,0]=4 670 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1O MCULE-2620729398 [1,1,0,0,0,0|2,0,0]=4 671 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1O MCULE-2656571420 [1,1,0,0,0,0|2,0,0]=4 672 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1O MCULE-4322632726 [1,1,0,0,0,0|2,0,0]=4 673 B13R1.201 N[C@@H](CC(=O)O)C1=CC=CC=C1O MCULE-8993392147 [1,1,0,0,0,0|2,0,0]=4 674 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1Br MCULE-3525799799 [1,1,0,0,0,0|2,0,0]=4 675 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1Br MCULE-6236115781 [1,1,0,0,0,0|2,0,0]=4 676 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1Cl MCULE-5036741280 [1,1,0,0,0,0|2,0,0]=4 677 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1Cl MCULE-5834515363 [1,1,0,0,0,0|2,0,0]=4 678 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1F MCULE-9123726609 [1,1,0,0,0,0|2,0,0]=4 679 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1F MCULE-9436072511 [1,1,0,0,0,0|2,0,0]=4 680 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1O MCULE-1572169056 [1,1,0,0,0,0|2,0,0]=4 681 B13R1.201 N[C@H](CC(=O)O)C1=CC=CC=C1O MCULE-5924484826 [1,1,0,0,0,0|2,0,0]=4 682 B13R1.201 O=C(O)CC(=O)C1=CC=CC=C1Cl MCULE-2599664916 [1,1,0,0,0,0|2,0,0]=4 683 B13R1.201 O=C(O)CC(O)C1=CC=CC=C1Cl MCULE-8252179218 [1,1,0,0,0,0|2,0,0]=4 684 B13R1.201 O=C(O)CC(O)C1=CC=CC=C1F MCULE-6216788990 [1,1,0,0,0,0|2,0,0]=4 685 B13R1.202 CC(=O)C(C)OC1=C(C=CC=C1)Cl MCULE-8308855035 [1,1,0,0,0,0|2,0,0]=4 686 B13R1.202 CC(=O)C(C)OC1=C(C=CC=C1)F MCULE-6510267278 [1,1,0,0,0,0|2,0,0]=4 687 B13R1.202 CC(=O)C(C)OC1=C(C=CC=C1)O MCULE-8882726132 [1,1,0,0,0,0|2,0,0]=4 688 B13R1.202 CC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5369615416 [1,1,0,0,0,0|2,0,0]=4 689 B13R1.202 CC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1157893995 [1,1,0,0,0,0|2,0,0]=4 690 B13R1.202 CC(CC1=C(C=CC=C1)F)C(=O)O MCULE-3357333139 [1,1,0,0,0,0|2,0,0]=4 691 B13R1.202 CC(NC1=C(C=CC=C1)F)C(=O)O MCULE-8804996475 [1,1,0,0,0,0|2,0,0]=4 692 B13R1.202 CC(OC1=C(C=CC=C1)Br)C(=O)N MCULE-5589316598 [1,1,0,0,0,0|2,0,0]=4 693 B13R1.202 CC(OC1=C(C=CC=C1)Cl)C(=O)Cl MCULE-9230544626 [1,1,0,0,0,0|2,0,0]=4 694 B13R1.202 CC(OC1=C(C=CC=C1)F)C(=O)O MCULE-6270294701 [1,1,0,0,0,0|1,0,0]=3 695 B13R1.202 CC(OC1=CC=CC=C1Br)C(=O)Cl MCULE-9237105874 [1,1,0,0,0,0|2,0,0]=4 696 B13R1.202 CC(OC1=CC=CC=C1Br)C(=O)O MCULE-5826265032 [1,1,0,0,0,0|1,0,0]=3 697 B13R1.202 CC(OC1=CC=CC=C1Cl)C(=O)N MCULE-2183933636 [1,1,0,0,0,0|2,0,0]=4 698 B13R1.202 CC(OC1=CC=CC=C1Cl)C(=O)O MCULE-8550913719 [1,1,0,0,0,0|1,0,0]=3 699 B13R1.202 CC(SC1=C(C=CC=C1)Cl)C(=O)O MCULE-1204813202 [1,1,0,0,0,0|1,1,0]=4 700 B13R1.202 CC1=C(C=CC=C1)CC(C)C(=O)O MCULE-2487760745 [1,1,0,0,0,0|1,0,0]=3 701 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-3928457353 [1,1,0,0,0,0|1,0,0]=3 702 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-4728915963 [1,1,0,0,0,0|1,0,0]=3 703 B13R1.202 CC1=C(C=CC=C1)CC(N)C(=O)O MCULE-9582945892 [1,1,0,0,0,0|1,0,0]=3 704 B13R1.202 CC1=C(C=CC=C1)C[C@@H](N)C(=O)O MCULE-7777290104 [1,1,0,0,0,0|1,0,0]=3 705 B13R1.202 CC1=C(C=CC=C1)OC(C)C(=O)Cl MCULE-7626850011 [1,1,0,0,0,0|1,0,0]=3 706 B13R1.202 CC1=C(C=CC=C1)OC(C)C(=O)O MCULE-1991115861 [1,1,0,0,0,0|0,0,0]=2 707 B13R1.202 CC1=C(C=CC=C1)O[C@H](C)C(=O)O MCULE-5387842924 [1,1,0,0,0,0|0,0,0]=2 708 B13R1.202 CC1=C(C=CC=N1)CC(C)C(=O)O MCULE-6308639265 [1,1,0,0,0,0|2,0,0]=4 709 B13R1.202 CC1=C(C=CC=N1)C[C@H](N)C(=O)O MCULE-2857482966 [1,1,0,0,0,0|2,0,0]=4 710 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-3139735845 [1,1,0,0,0,0|1,0,0]=3 711 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-4423394672 [1,1,0,0,0,0|1,0,0]=3 712 B13R1.202 CC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-8459527082 [1,1,0,0,0,0|1,0,0]=3 713 B13R1.202 CC1=CC=CC=C1NC(=O)C(=O)O MCULE-4521627182 [1,1,0,0,0,0|1,0,1]=4 714 B13R1.202 CC1=CC=CC=C1N[C@@H](C)C(=O)O MCULE-5947756335 [1,1,0,0,0,0|1,0,0]=3 715 B13R1.202 CC1=CC=CC=C1N[C@H](C)C(=O)O MCULE-9949044264 [1,1,0,0,0,0|1,0,0]=3 716 B13R1.202 CC1=CC=CC=C1OC(C)C(=O)N MCULE-9198402501 [1,1,0,0,0,0|1,0,0]=3 717 B13R1.202 CC1=CC=CC=C1O[C@H](C)C(=O)O MCULE-1647031269 [1,1,0,0,0,0|0,0,0]=2 718 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-1450162280 [1,1,0,0,0,0|2,0,0]=4 719 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-2509567482 [1,1,0,0,0,0|2,0,0]=4 720 B13R1.202 CC1=NC=CC=C1C[C@H](N)C(=O)O MCULE-3945955464 [1,1,0,0,0,0|2,0,0]=4 721 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-5724659686 [1,1,0,0,0,0|2,0,0]=4 722 B13R1.202 NC(CC1=C(C=CC=C1)Br)C(=O)O MCULE-8657034756 [1,1,0,0,0,0|2,0,0]=4 723 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-1003643925 [1,1,0,0,0,0|2,0,0]=4 724 B13R1.202 NC(CC1=C(C=CC=C1)Cl)C(=O)O MCULE-5234125993 [1,1,0,0,0,0|2,0,0]=4 725 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-1643139482 [1,1,0,0,0,0|2,0,0]=4 726 B13R1.202 NC(CC1=C(C=CC=C1)F)C(=O)O MCULE-8132487617 [1,1,0,0,0,0|2,0,0]=4 727 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-2760582536 [1,1,0,0,0,0|2,0,0]=4 728 B13R1.202 NC(CC1=C(C=CC=C1)O)C(=O)O MCULE-3181624921 [1,1,0,0,0,0|2,0,0]=4 729 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O MCULE-4720569207 [1,1,0,0,0,0|2,0,0]=4 730 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O MCULE-5831466387 [1,1,0,0,0,0|2,0,0]=4 731 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-3693150441 [1,1,0,0,0,0|2,0,0]=4 732 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O MCULE-8522650891 [1,1,0,0,0,0|2,0,0]=4 733 B13R1.202 NC1=CC=CC=C1CC(N)C(=O)O MCULE-7465695275 [1,1,0,0,0,0|2,0,0]=4 734 B13R1.202 NC1=CC=CC=C1C[C@@H](N)C(=O)O MCULE-6308202600 [1,1,0,0,0,0|2,0,0]=4 735 B13R1.202 NC1=CC=CC=C1C[C@H](N)C(=O)O MCULE-2066886177 [1,1,0,0,0,0|2,0,0]=4 736 B13R1.202 N[C@@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-5925880420 [1,1,0,0,0,0|2,0,0]=4 737 B13R1.202 N[C@@H](CC1=C(C=CC=C1)I)C(=O)O MCULE-5539213577 [1,1,0,0,0,0|2,0,0]=4 738 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7720110968 [1,1,0,0,0,0|2,0,0]=4 739 B13R1.202 N[C@@H](CC1=CC=CC=C1Br)C(=O)O MCULE-8611213892 [1,1,0,0,0,0|2,0,0]=4 740 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-4843973004 [1,1,0,0,0,0|2,0,0]=4 741 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-6583454610 [1,1,0,0,0,0|2,0,0]=4 742 B13R1.202 N[C@@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-8729370801 [1,1,0,0,0,0|2,0,0]=4 743 B13R1.202 N[C@@H](CC1=CC=CC=C1F)C(=O)O MCULE-1023509436 [1,1,0,0,0,0|2,0,0]=4 744 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O MCULE-1271250491 [1,1,0,0,0,0|2,0,0]=4 745 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-3324530063 [1,1,0,0,0,0|2,0,0]=4 746 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-4252485679 [1,1,0,0,0,0|2,0,0]=4 747 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-8738209502 [1,1,0,0,0,0|2,0,0]=4 748 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O MCULE-9497377193 [1,1,0,0,0,0|2,0,0]=4 749 B13R1.202 N[C@H](CC1=C(C=CC=C1)F)C(=O)O MCULE-2582515595 [1,1,0,0,0,0|2,0,0]=4 750 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-1182640112 [1,1,0,0,0,0|2,0,0]=4 751 B13R1.202 N[C@H](CC1=CC=CC=C1Br)C(=O)O MCULE-7433575732 [1,1,0,0,0,0|2,0,0]=4 752 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-2211654501 [1,1,0,0,0,0|2,0,0]=4 753 B13R1.202 N[C@H](CC1=CC=CC=C1Cl)C(=O)O MCULE-7072462727 [1,1,0,0,0,0|2,0,0]=4 754 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-2083626274 [1,1,0,0,0,0|2,0,0]=4 755 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-3474904707 [1,1,0,0,0,0|2,0,0]=4 756 B13R1.202 N[C@H](CC1=CC=CC=C1F)C(=O)O MCULE-4069544287 [1,1,0,0,0,0|2,0,0]=4 757 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-1367493363 [1,1,0,0,0,0|2,0,0]=4 758 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O MCULE-5236102575 [1,1,0,0,0,0|2,0,0]=4 759 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-2348504704 [1,1,0,0,0,0|2,0,0]=4 760 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O MCULE-8147742693 [1,1,0,0,0,0|2,0,0]=4 761 B13R1.202 O=C(O)C(Br)CC1=C(C=CC=C1)Br MCULE-5032087774 [1,1,0,0,0,0|2,0,0]=4 762 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1Cl MCULE-4038063637 [1,1,0,0,0,0|2,0,0]=4 763 B13R1.202 O=C(O)C(Br)CC1=CC=CC=C1F MCULE-3940590279 [1,1,0,0,0,0|2,0,0]=4 764 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Br MCULE-1533586444 [1,1,0,0,0,0|2,0,0]=4 765 B13R1.202 O=C(O)C(O)CC1=C(C=CC=C1)Cl MCULE-2811622154 [1,1,0,0,0,0|2,0,0]=4 766 B13R1.528 CC1=C(C=CC=C1)OC/C(=N/O)/N MCULE-3094893795 [1,1,0,0,0,0|1,0,0]=3 767 B13R1.528 CC1=C(C=CC=C1)OCC(=O)NN MCULE-8741704026 [1,1,0,0,0,0|1,0,0]=3 768 B13R1.528 CC1=C(C=CC=C1)OCC(O)CN MCULE-5280328074 [1,1,0,0,0,0|1,0,1]=4 769 B13R1.528 CC1=C(C=CC=C1)OCC(O)CN MCULE-8657354397 [1,1,0,0,0,0|1,0,1]=4 770 B13R1.528 CC1=C(C=CC=C1)OCC(O)CO MCULE-1125347766 [1,1,0,0,0,0|0,0,2]=4 771 B13R1.528 CC1=C(C=CC=C1)SCC(=O)NN MCULE-1084947474 [1,1,0,0,0,0|1,1,0]=4 772 B13R1.528 CC1=CC=CC=C1CCC(=O)NN MCULE-6044085722 [1,1,0,0,0,0|2,0,0]=4 773 B13R1.528 CC1=CC=CC=C1NCC(=O)NN MCULE-1040053759 [1,1,0,0,0,0|2,0,0]=4 774 B13R1.528 CNC(=O)CNC1=C(C=CC=C1)C MCULE-7779588199 [1,1,0,0,0,0|2,0,0]=4 775 B13R1.528 CNC(=O)COC1=C(C=CC=C1)Br MCULE-6518117531 [1,1,0,0,0,0|2,0,0]=4 776 B13R1.528 CNC(=O)COC1=C(C=CC=C1)C MCULE-8143383544 [1,1,0,0,0,0|1,0,0]=3 777 B13R1.528 CNC(=O)COC1=C(C=CC=C1)F MCULE-8555351004 [1,1,0,0,0,0|2,0,0]=4 778 B13R1.528 CNC(=O)COC1=C(C=CC=C1)I MCULE-1211201128 [1,1,0,0,0,0|2,0,0]=4 779 B13R1.528 CNC(=O)COC1=C(C=CC=C1)O MCULE-8614776997 [1,1,0,0,0,0|2,0,0]=4 780 B13R1.528 COC(=O)/C=C/C1=CC=CC=C1C MCULE-1824606875 [1,1,0,0,0,0|1,0,1]=4 781 B13R1.528 COC(=O)C#CC1=C(C=CC=C1)C MCULE-8123341281 [1,1,0,0,0,0|1,0,1]=4 782 B13R1.528 COC(=O)C=CC1=CC=CC=C1C MCULE-4421095204 [1,1,0,0,0,0|1,0,1]=4 783 B13R1.528 COC(=O)CCC1=C(C=CC=C1)Br MCULE-5804791554 [1,1,0,0,0,0|2,0,0]=4 784 B13R1.528 COC(=O)CCC1=C(C=CC=C1)O MCULE-9685325534 [1,1,0,0,0,0|2,0,0]=4 785 B13R1.528 COC(=O)CCC1=CC=CC=C1Cl MCULE-9629364932 [1,1,0,0,0,0|2,0,0]=4 786 B13R1.528 COC(=O)CCC1=CC=CC=C1F MCULE-7775567242 [1,1,0,0,0,0|2,0,0]=4 787 B13R1.528 COC(=O)CCC1=CC=CC=C1N MCULE-9770165708 [1,1,0,0,0,0|2,0,0]=4 788 B13R1.528 COC(=O)CNC1=C(C=CC=C1)C MCULE-3184859260 [1,1,0,0,0,0|1,0,0]=3 789 B13R1.528 COC(=O)CNC1=C(C=CC=C1)F MCULE-4615445682 [1,1,0,0,0,0|2,0,0]=4 790 B13R1.528 COC(=O)CNC1=CC=CC=C1Cl MCULE-4789352870 [1,1,0,0,0,0|2,0,0]=4 791 B13R1.528 COC(=O)CNC1=CC=CC=C1Cl MCULE-8275093783 [1,1,0,0,0,0|2,0,0]=4 792 B13R1.528 COC(=O)CNC1=CC=CC=C1I MCULE-5096402422 [1,1,0,0,0,0|2,0,0]=4 793 B13R1.528 COC(=O)COC1=C(C=CC=C1)Br MCULE-5985998603 [1,1,0,0,0,0|1,0,0]=3 794 B13R1.528 COC(=O)COC1=C(C=CC=C1)C MCULE-5893648010 [1,1,0,0,0,0|0,0,0]=2 795 B13R1.528 COC(=O)COC1=C(C=CC=C1)F MCULE-3748770159 [1,1,0,0,0,0|1,0,0]=3 796 B13R1.528 COC(=O)COC1=C(C=CC=C1)I MCULE-8029302941 [1,1,0,0,0,0|1,0,0]=3 797 B13R1.528 COC(=O)COC1=CC=CC=C1Cl MCULE-7111132374 [1,1,0,0,0,0|1,0,0]=3 798 B13R1.528 COC(=O)COC1=CC=CC=C1O MCULE-2055223191 [1,1,0,0,0,0|1,0,0]=3 799 B13R1.528 COC(=O)COC1=NC=CC=C1N MCULE-5973471099 [1,1,0,0,0,0|2,0,0]=4 800 B13R1.528 COC(=O)CSC1=C(C=CC=C1)O MCULE-1658715632 [1,1,0,0,0,0|1,1,0]=4 801 B13R1.528 N/C(=N\O)/COC1=C(C=CC=C1)Br MCULE-5526801305 [1,1,0,0,0,0|2,0,0]=4 802 B13R1.528 N/C(=N\O)/COC1=C(C=CC=C1)Cl MCULE-4468711689 [1,1,0,0,0,0|2,0,0]=4 803 B13R1.528 N/C(=N\O)/COC1=C(C=CC=C1)F MCULE-8484368479 [1,1,0,0,0,0|2,0,0]=4 804 B13R1.528 NNC(=O)COC1=C(C=CC=C1)Br MCULE-7862502069 [1,1,0,0,0,0|2,0,0]=4 805 B13R1.528 NNC(=O)COC1=C(C=CC=C1)F MCULE-7428743634 [1,1,0,0,0,0|2,0,0]=4 806 B13R1.528 NNC(=O)COC1=C(C=CC=C1)O MCULE-8642952358 [1,1,0,0,0,0|2,0,0]=4 807 B13R1.528 NNC(=O)COC1=CC=CC=C1Br MCULE-9332780403 [1,1,0,0,0,0|2,0,0]=4 808 B13R1.528 NNC(=O)COC1=CC=CC=C1Cl MCULE-6953764713 [1,1,0,0,0,0|2,0,0]=4 809 B13R1.528 NNC(=O)COC1=CC=CC=C1I MCULE-7528807060 [1,1,0,0,0,0|2,0,0]=4 810 B13R1.528 O=C(COC1=CC=CC=C1O)NO MCULE-6803022656 [1,1,0,0,0,0|1,0,0]=3 811 B13R1.893 CC(=O)COC1=C(C=CC(=C1)Br)F MCULE-3051650074 [1,1,0,0,0,0|2,0,0]=4 812 B13R1.893 CC1=C(C=C(C=C1)Br)CCC(=O)O MCULE-5968096077 [1,1,0,0,0,0|1,0,0]=3 813 B13R1.893 CC1=C(C=C(C=C1)F)C=CC(=O)O MCULE-6270367867 [1,1,0,0,0,0|1,0,1]=4 814 B13R1.893 CC1=CC(=C(C=C1)C)/C=C/C(=O)O MCULE-7219822685 [1,1,0,0,0,0|1,0,1]=4 815 B13R1.893 CC1=CC(=C(C=C1)C)C#CC(=O)O MCULE-4766447423 [1,1,0,0,0,0|1,0,1]=4 816 B13R1.893 CC1=CC(=C(C=C1)C)OCC(=O)O MCULE-6008691554 [1,1,0,0,0,0|0,0,0]=2 817 B13R1.893 CC1=CC(=C(C=C1)C)SCC(=O)O MCULE-6067611926 [1,1,0,0,0,0|0,1,0]=3 818 B13R1.893 CC1=CC(=C(C=C1)Cl)OCC(=O)O MCULE-8889925946 [1,1,0,0,0,0|1,0,0]=3 819 B13R1.893 CC1=CC(=C(C=C1)F)CCC(=O)O MCULE-1055932586 [1,1,0,0,0,0|2,0,0]=4 820 B13R1.893 CC1=CC(=C(C=C1)F)OCC(=O)O MCULE-3338573561 [1,1,0,0,0,0|1,0,0]=3 821 B13R1.893 CC1=CC=C(C(=C1)C=CC(=O)O)C MCULE-4267277889 [1,1,0,0,0,0|1,0,1]=4 822 B13R1.893 CC1=CC=C(C(=C1)CCC(=O)O)Br MCULE-2892861192 [1,1,0,0,0,0|2,0,0]=4 823 B13R1.893 CC1=CC=C(C(=C1)CCC(=O)O)C MCULE-7653653195 [1,1,0,0,0,0|1,0,0]=3 824 B13R1.893 CC1=CC=C(C(=C1)OCC(=O)Cl)C MCULE-1858659834 [1,1,0,0,0,0|1,0,0]=3 825 B13R1.893 CC1=CC=C(C(=C1)OCC(=O)Cl)Cl MCULE-7398291563 [1,1,0,0,0,0|2,0,0]=4 826 B13R1.893 CC1=CC=C(C(=C1)OCC(=O)N)Br MCULE-5594697663 [1,1,0,0,0,0|2,0,0]=4 827 B13R1.893 CC1=CC=C(C=C1/C=C/C(=O)O)F MCULE-9303958963 [1,1,0,0,0,0|1,0,1]=4 828 B13R1.893 CC1=CC=C(C=C1C#CC(=O)O)Cl MCULE-7703332696 [1,1,0,0,0,0|1,0,1]=4 829 B13R1.893 CC1=CC=C(C=C1C#CC(=O)O)F MCULE-9657823609 [1,1,0,0,0,0|1,0,1]=4 830 B13R1.893 CC1=CC=C(C=C1CCC(=O)O)F MCULE-4729858053 [1,1,0,0,0,0|1,0,0]=3 831 B13R1.893 CC1=CC=C(C=C1NCC(=O)O)Br MCULE-2384286280 [1,1,0,0,0,0|1,0,0]=3 832 B13R1.893 CC1=CC=C(C=C1OCC(=O)O)Cl MCULE-5397340721 [1,1,0,0,0,0|0,0,0]=2 833 B13R1.893 NC(=O)COC1=CC(=CC=C1F)Br MCULE-7894222196 [1,1,0,0,0,0|2,0,0]=4 834 B13R1.893 NC(=O)COC1=CC(=CC=C1I)Br MCULE-1566519917 [1,1,0,0,0,0|2,0,0]=4 835 B13R1.893 NC1=C(C=C(C=C1)Cl)SCC(=O)O MCULE-8692336214 [1,1,0,0,0,0|1,1,0]=4 836 B13R1.893 O=C(Cl)COC1=C(C=CC(=C1)Cl)Cl MCULE-6314015068 [1,1,0,0,0,0|2,0,0]=4 837 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)Br)F MCULE-3390746556 [1,1,0,0,0,0|2,0,0]=4 838 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)Cl)Br MCULE-1563190310 [1,1,0,0,0,0|2,0,0]=4 839 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)Cl)Cl MCULE-5496521354 [1,1,0,0,0,0|2,0,0]=4 840 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)F)Br MCULE-5248031550 [1,1,0,0,0,0|2,0,0]=4 841 B13R1.893 O=C(O)CCC1=C(C=CC(=C1)F)F MCULE-6559181360 [1,1,0,0,0,0|2,0,0]=4 842 B13R1.893 O=C(O)CCC1=CC(=CC=C1Cl)Br MCULE-4693709232 [1,1,0,0,0,0|2,0,0]=4 843 B13R1.893 O=C(O)CCC1=CC(=CC=C1Cl)F MCULE-5004566797 [1,1,0,0,0,0|2,0,0]=4 844 B13R1.893 O=C(O)CCC1=CC(=CC=C1F)Cl MCULE-6294449557 [1,1,0,0,0,0|2,0,0]=4 845 B13R1.893 O=C(O)CCC1=CC(=CC=C1F)O MCULE-9166086562 [1,1,0,0,0,0|2,0,0]=4 846 B13R1.893 O=C(O)CCC1=CC(=CC=C1O)Cl MCULE-1656132621 [1,1,0,0,0,0|2,0,0]=4 847 B13R1.893 O=C(O)CCC1=CC(=CC=C1O)O MCULE-5524289510 [1,1,0,0,0,0|2,0,0]=4 848 B13R1.893 O=C(O)COC1=C(C=CC(=C1)Cl)Br MCULE-7344989041 [1,1,0,0,0,0|1,0,0]=3 849 B13R1.893 O=C(O)COC1=C(C=CC(=C1)Cl)Cl MCULE-8783205198 [1,1,0,0,0,0|1,0,0]=3 850 B13R1.893 O=C(O)COC1=C(C=CC(=C1)F)Br MCULE-1262365888 [1,1,0,0,0,0|1,0,0]=3 851 B13R1.893 O=C(O)COC1=C(C=CC(=C1)F)F MCULE-7325272078 [1,1,0,0,0,0|1,0,0]=3 852 B13R1.893 O=C(O)COC1=CC(=CC=C1F)Br MCULE-1192657108 [1,1,0,0,0,0|1,0,0]=3 853 B13R1.893 O=C(O)COC1=CC(=CC=C1I)Br MCULE-3373466910 [1,1,0,0,0,0|1,0,0]=3 854 B13R1.893 O=C(O)CSC1=C(C=CC(=C1)Cl)Cl MCULE-8592317925 [1,1,0,0,0,0|1,1,0]=4 855 B13R1.1601 C=CCCC1=C(C=C(C=C1C)C)C MCULE-3169604099 [1,1,0,0,0,0|2,0,0]=4 856 B13R1.1601 CC1=CC(=C(C(=C1)C)C=CC=O)C MCULE-7275340356 [1,1,0,0,0,0|1,0,1]=4 857 B13R1.1601 CC1=CC(=C(C(=C1)C)CCCO)C MCULE-5255188600 [1,1,0,0,0,0|1,0,1]=4 858 B13R1.1601 CC1=CC(=C(C(=C1)C)OCCBr)C MCULE-3794268091 [1,1,0,0,0,0|1,0,1]=4 859 B13R1.1601 CC1=CC(=C(C(=C1)C)OCCN)C MCULE-5193977648 [1,1,0,0,0,0|1,0,1]=4 860 B13R1.1601 CC1=CC(=C(C(=C1)C)OCCN)C MCULE-7071221722 [1,1,0,0,0,0|1,0,1]=4 861 B13R1.1601 CC1=CC(=CC(=C1OCC#N)C)Br MCULE-7522279142 [1,1,0,0,0,0|1,0,1]=4 862 B13R1.1601 CC1=CC(=CC(=C1OCCN)C)Br MCULE-2418491249 [1,1,0,0,0,0|1,0,1]=4 863 B13R1.1601 CC1=CC(=CC(=C1OCCN)C)Br MCULE-6015339106 [1,1,0,0,0,0|1,0,1]=4 864 B13R1.1601 CCCOC1=C(C=C(C=C1C)Br)C MCULE-4291227407 [1,1,0,0,0,0|1,0,1]=4 865 B13R1.1601 CCCOC1=C(C=C(C=C1C)S)C MCULE-6108263201 [1,1,0,0,0,0|1,0,1]=4 866 B13R1.1601 COCOC1=C(C=C(C=C1C)Br)C MCULE-1331698211 [1,1,0,0,0,0|2,0,0]=4 867 B13R1.1601 COCOC1=C(C=C(C=C1C)I)C MCULE-5166141357 [1,1,0,0,0,0|2,0,0]=4 868 B13R1.1619 C=CCOC1=C(C=CC=C1C#N)C MCULE-2709529464 [1,1,0,0,0,0|1,0,1]=4 869 B13R1.1619 COCOC1=C(C=CC=C1C)OC MCULE-5380349277 [1,1,0,0,0,0|2,0,0]=4 870 B13R1.4453 C=CC[C@@H](N)C1=C(C=CC=C1C)C MCULE-9106986740 [1,1,0,0,0,0|2,0,0]=4 871 B13R1.4453 C=CC[C@@H](N)C1=C(C=CC=C1C)C MCULE-9472634988 [1,1,0,0,0,0|2,0,0]=4 872 B13R1.4453 C=CC[C@H](N)C1=C(C=CC=C1C)C MCULE-5505353210 [1,1,0,0,0,0|2,0,0]=4 873 B13R1.4453 C=CC[C@H](N)C1=C(C=CC=C1C)C MCULE-8286689016 [1,1,0,0,0,0|2,0,0]=4 874 B13R1.4453 CC1=CC=CC(=C1[C@@H](N)CCO)C MCULE-2698121673 [1,1,0,0,0,0|1,0,1]=4 875 B13R1.4453 CC1=CC=CC(=C1[C@@H](N)CCO)C MCULE-3930619642 [1,1,0,0,0,0|1,0,1]=4 876 B13R1.4453 CC1=CC=CC(=C1[C@H](N)CCO)C MCULE-2138555602 [1,1,0,0,0,0|1,0,1]=4 877 B13R1.4453 CC1=CC=CC(=C1[C@H](N)CCO)C MCULE-9899601363 [1,1,0,0,0,0|1,0,1]=4 878 B13R1.4928 CC1=CC=CC(=C1CC(N)CO)C MCULE-3529431291 [1,1,0,0,0,0|1,0,1]=4 879 B13R1.8919 CC1=CC=CC(=C1OCCCBr)C MCULE-2197784382 [1,1,0,0,0,0|1,0,1]=4 880 B13R1.8919 CC1=CC=CC(=C1OCCCN)C MCULE-2070331587 [1,1,0,0,0,0|1,0,1]=4 881 B13R1.8919 CC1=CC=CC(=C1OCCCN)C MCULE-8283214713 [1,1,0,0,0,0|1,0,1]=4 882 B13R1.8919 CC1=CC=CC(=C1OCCCS)C MCULE-2668605482 [1,1,0,0,0,0|0,1,1]=4 883 B13R1.8919 CNCCOC1=C(C=CC=C1C)C MCULE-2564754081 [1,1,0,0,0,0|1,0,1]=4 884 B13R1.8919 CNCCOC1=C(C=CC=C1C)C MCULE-3455405634 [1,1,0,0,0,0|1,0,1]=4 885 B13R1.3467 CC1=NN(C(=C1OCC(=O)O)C)C MCULE-5474305797 [0,1,0,0,1,0|2,0,0]=4 886 B13R1.885 CC(=O)NC1=C(C(=CC=C1C)N)C MCULE-7174398637 [0,1,0,0,1,0|2,0,0]=4 887 B13R1.885 CC(=O)NC1=C(C(=CC=C1C)O)C MCULE-2633740700 [0,1,0,0,1,0|2,0,0]=4 888 B13R1.885 CC(=O)NC1=C(C=CC(=C1C)N)C MCULE-2307487490 [0,1,0,0,1,0|2,0,0]=4 889 B13R1.885 CC1=C(C(=C(C=C1)Cl)Br)CC(=O)O MCULE-5363582326 [0,1,0,0,1,0|1,0,0]=3 890 B13R1.885 CC1=CC=C(C(=C1Cl)CC(=O)O)F MCULE-6245600824 [0,1,0,0,1,0|2,0,0]=4 891 B13R1.885 CC1=CC=C(C(=C1F)CC(=O)O)Cl MCULE-8146432052 [0,1,0,0,1,0|2,0,0]=4 892 B13R1.885 CC1=CC=C(C(=C1F)CC(=O)O)F MCULE-6543194685 [0,1,0,0,1,0|2,0,0]=4 893 B13R1.885 NC1=C(C(=C(C=C1)F)F)CC(=O)O MCULE-9240836623 [0,1,0,0,1,0|2,0,0]=4 894 B13R1.885 O=C(O)CC1=C(C(=CC=C1Br)Cl)Cl MCULE-2124723401 [0,1,0,0,1,0|2,0,0]=4 895 B13R1.885 O=C(O)CC1=C(C(=CC=C1Cl)Cl)Cl MCULE-7028199246 [0,1,0,0,1,0|2,0,0]=4 896 B13R1.885 O=C(O)CC1=C(C(=CC=C1Cl)O)Cl MCULE-2865199778 [0,1,0,0,1,0|2,0,0]=4 897 B13R1.885 O=C(O)CC1=C(C(=CC=C1F)Br)F MCULE-3712179169 [0,1,0,0,1,0|2,0,0]=4 898 B13R1.885 O=C(O)CC1=C(C(=CC=C1F)F)Br MCULE-1015063530 [0,1,0,0,1,0|2,0,0]=4 899 B13R1.885 O=C(O)CC1=C(C(=CC=C1F)F)Cl MCULE-8574069200 [0,1,0,0,1,0|2,0,0]=4 900 B13R1.885 O=C(O)CC1=C(C=CC(=C1Br)Br)F MCULE-1317025405 [0,1,0,0,1,0|2,0,0]=4 901 B13R1.885 O=C(O)CC1=C(C=CC(=C1Br)F)Br MCULE-3435447215 [0,1,0,0,1,0|2,0,0]=4 902 B13R1.885 O=C(O)CC1=C(C=CC(=C1Cl)Cl)F MCULE-3606616161 [0,1,0,0,1,0|2,0,0]=4 903 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)Br)Br MCULE-8664387418 [0,1,0,0,1,0|2,0,0]=4 904 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)Cl)Cl MCULE-7114398014 [0,1,0,0,1,0|2,0,0]=4 905 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)Cl)F MCULE-4576043131 [0,1,0,0,1,0|2,0,0]=4 906 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)F)Br MCULE-5041817461 [0,1,0,0,1,0|2,0,0]=4 907 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)F)Cl MCULE-5672554876 [0,1,0,0,1,0|2,0,0]=4 908 B13R1.885 O=C(O)CC1=C(C=CC(=C1F)F)F MCULE-1169742300 [0,1,0,0,1,0|2,0,0]=4 909 B13R1.2135 CCC1=CC=CC(=C1NC(=O)C)C MCULE-7609906703 [0,1,0,0,1,0|2,0,0]=4 910 B13R1.2135 COC1=C(C(=CC=C1)Cl)CC(=O)O MCULE-3569790389 [0,1,0,0,1,0|1,0,0]=3 911 B13R1.2135 COC1=C(C(=CC=C1)F)CC(=O)O MCULE-2353170391 [0,1,0,0,1,0|1,0,0]=3 912 B13R1.2135 N#CC1=C(C(=CC=C1)Cl)CC(=O)O MCULE-6438283113 [0,1,0,0,1,0|1,0,1]=4 913 B13R1.2808 C=C(Br)CC1=C(C=C(C=C1C)C)C MCULE-4682726930 [0,1,0,0,1,0|2,0,0]=4 914 B13R1.2808 C=C(C)CC1=C(C=C(C=C1C)C)C MCULE-3121562746 [0,1,0,0,1,0|2,0,0]=4 915 B13R1.2808 C=C(Cl)CC1=C(C=C(C=C1C)C)C MCULE-1635832100 [0,1,0,0,1,0|2,0,0]=4 916 B13R1.2808 CC(=O)CC1=C(C=C(C=C1C)C)C MCULE-8004055335 [0,1,0,0,1,0|1,0,0]=3 917 B13R1.2808 CC(=O)NC1=C(C=C(C=C1C)Br)C MCULE-1411359082 [0,1,0,0,1,0|2,0,0]=4 918 B13R1.2808 CC(=O)NC1=C(C=C(C=C1C)C)C MCULE-1666211203 [0,1,0,0,1,0|2,0,0]=4 919 B13R1.2808 CC(=O)NC1=C(C=C(C=C1C)N)C MCULE-7675719407 [0,1,0,0,1,0|2,0,0]=4 920 B13R1.2808 CC(=O)NC1=C(C=C(C=C1C)O)C MCULE-1542339951 [0,1,0,0,1,0|2,0,0]=4 921 B13R1.2808 CC(=O)OC1=C(C=C(C=C1C)Br)C MCULE-8011616155 [0,1,0,0,1,0|1,0,0]=3 922 B13R1.2808 CC1=C(C(=CC(=C1)F)F)CC(=O)O MCULE-2785144018 [0,1,0,0,1,0|1,0,0]=3 923 B13R1.2808 CC1=CC(=C(C(=C1)C)CC(=O)Cl)C MCULE-1172167640 [0,1,0,0,1,0|1,0,0]=3 924 B13R1.2808 CC1=CC(=C(C(=C1)C)CC(=O)O)C MCULE-3017049310 [0,1,0,0,1,0|0,0,0]=2 925 B13R1.2808 CC1=CC(=C(C(=C1)C)CC(C)O)C MCULE-6092691461 [0,1,0,0,1,0|1,0,1]=4 926 B13R1.2808 CC1=CC(=C(C(=C1)C)NC(=O)N)C MCULE-4477526417 [0,1,0,0,1,0|2,0,0]=4 927 B13R1.2808 CC1=CC(=C(C(=N1)Br)CC(=O)O)C MCULE-4363941994 [0,1,0,0,1,0|2,0,0]=4 928 B13R1.2808 CC1=CC(=C(C(=N1)Cl)CC(=O)O)C MCULE-2456083423 [0,1,0,0,1,0|2,0,0]=4 929 B13R1.2808 CC1=CC(=C(C(=O)N1)CC(=O)O)C MCULE-8605116169 [0,1,0,0,1,0|2,0,0]=4 930 B13R1.2808 CC1=CC(=CC(=C1CC(=O)O)C)Br MCULE-7926852452 [0,1,0,0,1,0|0,0,0]=2 931 B13R1.2808 CC1=CC(=CC(=C1CC(=O)O)C)F MCULE-4788521524 [0,1,0,0,1,0|0,0,0]=2 932 B13R1.2808 CC1=CC(=CC(=O)N1CC(=O)O)O MCULE-7322740411 [0,1,0,0,1,0|2,0,0]=4 933 B13R1.2808 CC1=CC(=O)C=C(N1CC(=O)O)C MCULE-8261650871 [0,1,0,0,1,0|1,0,0]=3 934 B13R1.2808 CC1=NC(=C(C(=N1)C)CC(=O)O)C MCULE-6093135960 [0,1,0,0,1,0|2,0,0]=4 935 B13R1.2808 CC1=NC(=NC(=C1CC(=O)O)C)N MCULE-5554907690 [0,1,0,0,1,0|2,0,0]=4 936 B13R1.2808 CC1=NC(=O)NC(=C1CC(=O)O)C MCULE-3095120735 [0,1,0,0,1,0|2,0,0]=4 937 B13R1.2808 NC1=CC(=C(C(=C1)F)CC(=O)O)F MCULE-6376738734 [0,1,0,0,1,0|2,0,0]=4 938 B13R1.2808 O=C(O)CC1=C(C=C(C=C1Br)F)Br MCULE-9586643060 [0,1,0,0,1,0|2,0,0]=4 939 B13R1.2808 O=C(O)CC1=C(C=C(C=C1Cl)F)Cl MCULE-7974142741 [0,1,0,0,1,0|2,0,0]=4 940 B13R1.2808 O=C(O)CC1=C(C=C(C=C1Cl)O)Cl MCULE-2122316319 [0,1,0,0,1,0|2,0,0]=4 941 B13R1.2808 O=C(O)CC1=C(C=C(C=C1F)Br)F MCULE-5332747776 [0,1,0,0,1,0|2,0,0]=4 942 B13R1.2808 O=C(O)CC1=C(C=C(C=C1F)Cl)F MCULE-6561372794 [0,1,0,0,1,0|2,0,0]=4 943 B13R1.2808 O=C(O)CC1=C(C=C(C=C1F)F)F MCULE-1380105435 [0,1,0,0,1,0|2,0,0]=4 944 B13R1.3788 CC1=CC=CC(=C1CS(=O)(=O)Cl)C MCULE-5383392105 [0,1,0,0,1,0|1,0,1]=4 945 B13R1.3788 CC1=CC=CC(=C1CS(=O)(=O)N)C MCULE-4623227118 [0,1,0,0,1,0|1,0,1]=4 946 B13R1.3788 CC1=CC=CC(=C1OP(=O)(C)N)C MCULE-9070199034 [0,1,0,0,1,0|2,0,0]=4 947 B13R1.3789 CC(=O)N(C)C1=C(C=CC=C1C)C MCULE-6935285317 [0,1,0,0,1,0|2,0,0]=4 948 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1Cl)Br MCULE-8665739563 [0,1,0,0,1,0|2,0,0]=4 949 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1Cl)Cl MCULE-1846208931 [0,1,0,0,1,0|2,0,0]=4 950 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1F)Cl MCULE-1968564153 [0,1,0,0,1,0|2,0,0]=4 951 B13R1.3789 CC(C(=O)O)C1=C(C=CC=C1F)F MCULE-6128062939 [0,1,0,0,1,0|2,0,0]=4 952 B13R1.3789 CC1=CC=CC(=C1C(O)C(=O)O)C MCULE-8040272793 [0,1,0,0,1,0|0,0,0]=2 953 B13R1.3789 CC1=CC=CC(=C1[C@@H](N)[C@H](C)O)C MCULE-5667557418 [0,1,0,0,1,0|1,0,1]=4 954 B13R1.3789 CC1=CC=CC(=C1[C@@H](N)[C@H](C)O)C MCULE-7345351480 [0,1,0,0,1,0|1,0,1]=4 955 B13R1.3789 CC1=CC=CC(=C1[C@H](N)[C@@H](C)O)C MCULE-1572417831 [0,1,0,0,1,0|1,0,1]=4 956 B13R1.3789 CC1=CC=CC(=C1[C@H](N)[C@@H](C)O)C MCULE-6651600325 [0,1,0,0,1,0|1,0,1]=4 957 B13R1.3789 NC(C(=O)O)C1=C(C=CC=C1Cl)F MCULE-4202987992 [0,1,0,0,1,0|2,0,0]=4 958 B13R1.3789 NC(C(=O)O)C1=C(C=CC=C1F)Cl MCULE-9056653213 [0,1,0,0,1,0|2,0,0]=4 959 B13R1.3789 NC(C(=O)O)C1=C(C=CC=C1F)F MCULE-4618180030 [0,1,0,0,1,0|2,0,0]=4 960 B13R1.3789 NC(C(=O)O)C1=C(C=CC=C1F)F MCULE-7860355537 [0,1,0,0,1,0|2,0,0]=4 961 B13R1.3789 O=C(O)C(O)C1=C(C=CC=C1F)F MCULE-4111301818 [0,1,0,0,1,0|2,0,0]=4 962 B15R1.8287 CC(=O)CC(=O)NC1=C(C=CC=C1C)C MCULE-4980852055 [0,1,0,0,0,1|2,0,0]=4 963 B15R1.8312 CC(=O)OCC(=O)C1=C(C=CC=C1C)C MCULE-9299450962 [0,1,0,0,0,1|2,0,0]=4 964 B15R1.8312 CC1=CC=CC(=C1C(=O)NCC(=O)O)C MCULE-7700143088 [0,1,0,0,0,1|1,0,0]=3 965 B15R1.25387 CC1=CC(=O)C=C(N1CCCC(=O)O)C MCULE-9136821901 [0,1,0,0,0,1|2,0,0]=4 966 B15R1.441 O=CC1=C(C(=CC(=C1)I)Br)OCC(=O)O MCULE-9134469407 [0,2,0,0,0,0|1,0,1]=4 967 B15R1.441 O=CC1=CC(=CC(=C1OCC(=O)O)Br)Br MCULE-6975974876 [0,2,0,0,0,0|1,0,1]=4 968 B15R1.441 O=CC1=CC(=CC(=C1OCC(=O)O)Br)Cl MCULE-8527092069 [0,2,0,0,0,0|1,0,1]=4 969 B15R1.1605 CC(OC1=C(C=CC=C1C=O)F)C(=O)O MCULE-8713714490 [0,2,0,0,0,0|1,0,1]=4 970 B15R1.1605 CC(OC1=C(C=CC=C1Cl)C=O)C(=O)O MCULE-8197833027 [0,2,0,0,0,0|1,0,1]=4 971 B15R1.1605 CC1=CC=CC(=C1OC(C)C(=O)O)C=O MCULE-1556115655 [0,2,0,0,0,0|0,0,1]=3 972 B15R1.1605 CCC1=C(C(=CC=C1)C)NC(=O)C(=O)O MCULE-2147077936 [0,2,0,0,0,0|1,0,1]=4 973 B15R1.1645 COC1=C(C(=CC=C1)C#N)OCC(=O)N MCULE-7908161801 [0,2,0,0,0,0|1,0,1]=4 974 B15R1.1645 COC1=C(C(=CC=C1)C#N)OCC(=O)O MCULE-4441989503 [0,2,0,0,0,0|0,0,1]=3 975 B15R1.1645 COC1=CC=CC(=C1/C=C/C(=O)O)OC MCULE-1578539413 [0,2,0,0,0,0|1,0,1]=4 976 B15R1.1645 COC1=CC=CC(=C1C=CC(=O)O)OC MCULE-4195827296 [0,2,0,0,0,0|1,0,1]=4 977 B15R1.1645 COC1=CC=CC(=C1OCC(=O)N)C=O MCULE-8233411796 [0,2,0,0,0,0|1,0,1]=4 978 B15R1.1645 COC1=CC=CC(=C1OCC(=O)O)C=O MCULE-6842253843 [0,2,0,0,0,0|0,0,1]=3 979 B15R1.1645 COC1=CC=CC(=C1OCC(=O)O)OC MCULE-1535940628 [0,2,0,0,0,0|0,0,0]=2 980 B15R1.6620 CC1=CC=CC(=C1CCC(=O)O)N(=O)=O MCULE-6355627054 [0,2,0,0,0,0|2,0,0]=4 981 B15R1.702 COC1=CC(=C(C(=C1)C)C=CC(=O)O)C MCULE-5092485037 [0,2,0,0,0,0|1,0,1]=4 982 B15R1.702 O=C(O)COC1=C(C=C(C=C1Br)CO)Cl MCULE-8389690067 [0,2,0,0,0,0|2,0,0]=4 983 B15R1.702 O=C(O)COC1=C(C=C(C=C1I)CO)I MCULE-4878718994 [0,2,0,0,0,0|2,0,0]=4 984 B15R1.702 O=CC1=CC(=C(C(=C1)Br)OCC(=O)O)Br MCULE-7547462394 [0,2,0,0,0,0|2,0,0]=4 985 B15R1.702 O=CC1=CC(=C(C(=C1)Cl)OCC(=O)O)Br MCULE-7481011263 [0,2,0,0,0,0|2,0,0]=4 986 B15R1.702 O=CC1=CC(=C(C(=C1)Cl)OCC(=O)O)Cl MCULE-9727698381 [0,2,0,0,0,0|2,0,0]=4 987 B15R1.3552 CC1=CC(=C(C(=C1)C)CC(N)C(=O)O)C MCULE-9694510035 [0,2,0,0,0,0|1,0,0]=3 988 B15R1.3552 CC1=CC(=C(C(=C1)C)CC(N)C(=O)O)C MCULE-9948855234 [0,2,0,0,0,0|1,0,0]=3 989 B15R1.3552 CC1=CC(=C(C(=C1)C)C[C@H](N)C(=O)O)C MCULE-4817195203 [0,2,0,0,0,0|1,0,0]=3 990 B15R1.3552 CC1=CC(=C(C(=C1)C)NC(=O)C(=O)O)C MCULE-6397913790 [0,2,0,0,0,0|1,0,1]=4 991 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-3528979301 [0,2,0,0,0,0|1,0,0]=3 992 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-4096674612 [0,2,0,0,0,0|1,0,0]=3 993 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-6434365773 [0,2,0,0,0,0|1,0,0]=3 994 B15R1.3552 CC1=CC(=CC(=C1CC(N)C(=O)O)C)O MCULE-6538588246 [0,2,0,0,0,0|1,0,0]=3 995 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-1921088727 [0,2,0,0,0,0|1,0,0]=3 996 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-5039746762 [0,2,0,0,0,0|1,0,0]=3 997 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-6653767064 [0,2,0,0,0,0|1,0,0]=3 998 B15R1.3552 CC1=CC(=CC(=C1C[C@@H](N)C(=O)O)C)O MCULE-9366808925 [0,2,0,0,0,0|1,0,0]=3 999 B15R1.3552 CC1=CC(=CC(=C1C[C@H](C)C(=O)O)C)O MCULE-4421952936 [0,2,0,0,0,0|1,0,0]=3 1000 B15R1.3552 CC1=CC(=CC(=C1C[C@H](C)C(=O)O)C)O MCULE-6207057400 [0,2,0,0,0,0|1,0,0]=3 1001 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-5420373170 [0,2,0,0,0,0|1,0,0]=3 1002 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-6297085956 [0,2,0,0,0,0|1,0,0]=3 1003 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-7986194105 [0,2,0,0,0,0|1,0,0]=3 1004 B15R1.3552 CC1=CC(=CC(=C1C[C@H](N)C(=O)O)C)O MCULE-9474098059 [0,2,0,0,0,0|1,0,0]=3 1005 B15R1.3552 CC1=CC(=CC(=C1OC(C)C(=O)N)C)Br MCULE-9209550602 [0,2,0,0,0,0|1,0,0]=3 1006 B15R1.3552 CC1=CC(=CC(=C1OC(C)C(=O)O)C)Br MCULE-1063828065 [0,2,0,0,0,0|0,0,0]=2 1007 B15R1.3553 CC(=O)CC(=O)C1=C(C=C(C=C1C)C)C MCULE-7716980719 [0,2,0,0,0,0|2,0,0]=4 1008 B15R1.3553 CC1=CC(=C(C(=C1)C)C(N)CC(=O)O)C MCULE-3985329866 [0,2,0,0,0,0|1,0,0]=3 1009 B15R1.38791 CC1=C(C(=CC(=C1)Br)Br)OCC(=O)NN MCULE-4221325298 [0,2,0,0,0,0|2,0,0]=4 1010 B15R1.38791 CC1=CC(=C(C(=C1)C)NCC(=O)NN)C MCULE-9528875648 [0,2,0,0,0,0|2,0,0]=4 1011 B15R1.38791 CC1=CC(=C(C(=C1)C)OCC(=O)NN)Br MCULE-6046974753 [0,2,0,0,0,0|2,0,0]=4 1012 B15R1.38791 CC1=CC(=C(C(=C1)C)OCC(=O)NN)C MCULE-3308120711 [0,2,0,0,0,0|1,0,0]=3 1013 B15R1.38791 CC1=CC(=CC(=C1OCC(=O)NN)C)Br MCULE-2782160120 [0,2,0,0,0,0|1,0,0]=3 1014 B15R1.38791 CC1=CC(=CC(=C1OCC(=O)NN)C)I MCULE-8672869633 [0,2,0,0,0,0|1,0,0]=3 1015 B15R1.38791 COC(=O)COC1=C(C=C(C=C1Br)Cl)Cl MCULE-6186843429 [0,2,0,0,0,0|2,0,0]=4 1016 B15R1.38791 COC(=O)COC1=C(C=C(C=C1C)Br)Br MCULE-9539153799 [0,2,0,0,0,0|1,0,0]=3 1017 B15R1.38791 COC(=O)COC1=C(C=C(C=C1C)C)C MCULE-8722371805 [0,2,0,0,0,0|0,0,0]=2 1018 B15R1.38791 COC(=O)COC1=C(C=C(C=C1Cl)Cl)Cl MCULE-1762617449 [0,2,0,0,0,0|2,0,0]=4 1019 B15R1.36276 COC(=O)CC(N)C1=C(C=CC=C1C)C MCULE-2594891436 [0,2,0,0,0,0|1,0,0]=3 1020 B15R1.36276 COC(=O)CC(N)C1=C(C=CC=C1C)C MCULE-4848216667 [0,2,0,0,0,0|1,0,0]=3 1021 B15R1.36276 COC(=O)C[C@@H](N)C1=C(C=CC=C1C)C MCULE-2527715687 [0,2,0,0,0,0|1,0,0]=3 1022 B15R1.36276 COC(=O)C[C@@H](N)C1=C(C=CC=C1C)C MCULE-7415210615 [0,2,0,0,0,0|1,0,0]=3 1023 B15R1.36276 COC(=O)C[C@@H](N)C1=C(C=CC=C1Cl)C MCULE-2799351843 [0,2,0,0,0,0|2,0,0]=4 1024 B15R1.36276 COC(=O)C[C@@H](N)C1=C(C=CC=C1Cl)C MCULE-8433266004 [0,2,0,0,0,0|2,0,0]=4 1025 B15R1.36276 COC(=O)C[C@H](N)C1=C(C=CC=C1C)C MCULE-4213023279 [0,2,0,0,0,0|1,0,0]=3 1026 B15R1.36276 COC(=O)C[C@H](N)C1=C(C=CC=C1C)C MCULE-6935221291 [0,2,0,0,0,0|1,0,0]=3 1027 B15R1.36276 COC(=O)C[C@H](N)C1=C(C=CC=C1Cl)C MCULE-6961177558 [0,2,0,0,0,0|2,0,0]=4 1028 B15R1.36276 COC(=O)C[C@H](N)C1=C(C=CC=C1Cl)C MCULE-8699008931 [0,2,0,0,0,0|2,0,0]=4 1029 B15R1.13264 COC(=O)C(C)NC1=C(C=CC=C1C)C MCULE-8303018649 [0,2,0,0,0,0|1,0,0]=3 1030 B15R1.13264 COC(=O)C(C)OC1=C(C=CC=C1C)C MCULE-5665258334 [0,2,0,0,0,0|0,0,0]=2 1031 B15R1.13264 COC(=O)C(C)OC1=C(C=CC=C1Cl)Cl MCULE-6683068192 [0,2,0,0,0,0|2,0,0]=4 1032 B15R1.13264 COC(=O)C(N)CC1=C(C=CC=C1C)C MCULE-9499946334 [0,2,0,0,0,0|1,0,0]=3 1033 B15R1.13264 COC(=O)[C@@H](N)CC1=C(C=CC=C1C)C MCULE-6792064220 [0,2,0,0,0,0|1,0,0]=3 1034 B15R1.13264 COC(=O)[C@@H](N)CC1=C(C=CC=C1C)Cl MCULE-9817176997 [0,2,0,0,0,0|2,0,0]=4 1035 B15R1.13264 COC(=O)[C@@H](N)CC1=C(C=CC=C1C)F MCULE-4210705988 [0,2,0,0,0,0|2,0,0]=4 1036 B15R1.13264 COC(=O)[C@H](N)CC1=C(C=CC=C1C)C MCULE-3799783209 [0,2,0,0,0,0|1,0,0]=3 1037 B15R1.13264 COC(=O)[C@H](N)CC1=C(C=CC=C1C)Cl MCULE-4564898338 [0,2,0,0,0,0|2,0,0]=4 1038 B15R1.13264 COC(=O)[C@H](N)CC1=C(C=CC=C1C)F MCULE-7939868452 [0,2,0,0,0,0|2,0,0]=4 1039 B15R1.25617 CC(C)(OC1=C(C=CC=C1F)F)C(=O)O MCULE-2919866454 [0,2,0,0,0,0|2,0,0]=4 1040 B15R1.25617 CC1=CC=CC(=C1OC(C)(C)C(=O)O)C MCULE-6014989109 [0,2,0,0,0,0|0,0,0]=2 1041 B15R1.12386 CC1=CC=C(C(=C1C)OCC(=O)NN)C MCULE-7603360301 [0,2,0,0,0,0|1,0,0]=3 1042 B15R1.15580 O=C(O)COC1=C(C(=CC(=C1F)F)F)F MCULE-8483662253 [0,2,0,0,0,0|2,0,0]=4 1043 B15R1.30116 COC(COC1=C(C=CC=C1C)C)OC MCULE-1202269032 [0,2,0,0,0,0|0,0,2]=4 1044 B15R1.36731 CCOC(=O)COC1=C(C=CC=C1Br)F MCULE-9132543172 [0,2,0,0,0,0|2,0,0]=4 1045 B15R1.36731 CCOC(=O)COC1=C(C=CC=C1C)C MCULE-5548345114 [0,2,0,0,0,0|0,0,0]=2 1046 B15R1.36731 CCOC(=O)COC1=C(C=CC=C1Cl)Cl MCULE-7008529605 [0,2,0,0,0,0|2,0,0]=4 1047 B15R1.36731 CCOC(=O)COC1=C(C=CC=C1F)F MCULE-3433135095 [0,2,0,0,0,0|2,0,0]=4 1048 B15R1.36731 CCOC(=O)NNC1=C(C=CC=C1C)C MCULE-4772436514 [0,2,0,0,0,0|2,0,0]=4 1049 B13R1.115 COC1=C(C=CC=C1CC(=O)O)C MCULE-7225573779 [0,0,1,1,0,0|2,0,0]=4 1050 B13R1.149 CC1=CC(=CC=C1)COCC(=O)O MCULE-5107743765 [0,0,1,1,0,0|0,0,2]=4 1051 B13R1.342 C/C(=N\OCC(=O)O)/C1=CC=CS1 MCULE-5387206216 [0,0,1,1,0,0|2,0,0]=4 1052 B13R1.342 CC(=NOCC(=O)O)C1=CC=CS1 MCULE-9323955301 [0,0,1,1,0,0|2,0,0]=4 1053 B13R1.3089 COC1=CC=C(C=C1CC(=O)O)C MCULE-2799853217 [0,0,1,1,0,0|2,0,0]=4 1054 B13R2.33 O=C1CCC2=C(C=CC=C2)CC1 MCULE-2873455623 [1,0,0,1,0,0|2,0,0]=4 1055 B13R2.33 O=C1CCC2=C(C=CC=C2)OC1 MCULE-5585630356 [1,0,0,1,0,0|1,0,0]=3 1056 B13R2.33 O=C1CCC2=CC=CC=C2CN1 MCULE-1946761141 [1,0,0,1,0,0|2,0,0]=4 1057 B13R2.33 O=C1CNC2=CC=CC=C2CN1 MCULE-5788629291 [1,0,0,1,0,0|2,0,0]=4 1058 B13R2.33 O=C1COC2=C(C=CC=C2)SC1 MCULE-1040268954 [1,0,0,1,0,0|2,0,0]=4 1059 B13R2.33 O=C1COC2=CC=CC=C2CN1 MCULE-1363307017 [1,0,0,1,0,0|1,0,0]=3 1060 B13R2.33 OC1COC2=C(C=CC=C2)CN1 MCULE-7537533247 [1,0,0,1,0,0|1,0,1]=4 1061 B13R2.216 CC1=C(C=CC=C1)C2CC(=O)C2 MCULE-6550212238 [1,0,0,1,0,0|2,0,0]=4 1062 B13R2.222 O=P1(COC2=CC=CC=C2O1)O MCULE-6038481692 [1,0,0,1,0,0|2,0,0]=4 1063 B13R2.435 CC(=O)C1CC2=CC=CC=C2C1 MCULE-8754780715 [1,0,0,1,0,0|2,0,0]=4 1064 B13R2.435 NC(=O)C1CC2=C(N1)C=CC=C2 MCULE-3871508317 [1,0,0,1,0,0|2,0,0]=4 1065 B13R2.435 NC(=O)C1CC2=C(O1)C=CC=C2 MCULE-5611172380 [1,0,0,1,0,0|1,0,0]=3 1066 B13R2.435 NC(=O)C1CC2=CC=CC=C2C1 MCULE-6025604730 [1,0,0,1,0,0|2,0,0]=4 1067 B13R2.435 NC(=O)[C@@H]1CC2=CC=CC=C2N1 MCULE-4568317333 [1,0,0,1,0,0|2,0,0]=4 1068 B13R2.435 O=C(Cl)C1CC2=CC=CC=C2O1 MCULE-1847395844 [1,0,0,1,0,0|1,0,0]=3 1069 B13R2.435 O=C(O)C1=CC2=C(C1)C=CC=C2 MCULE-2006282606 [1,0,0,1,0,0|1,0,1]=4 1070 B13R2.435 O=C(O)C1=CC2=C(O1)C=CC=C2 MCULE-5646971945 [1,0,0,1,0,0|0,0,2]=4 1071 B13R2.435 O=C(O)C1=NC2=CC=CC=C2O1 MCULE-7872604073 [1,0,0,1,0,0|1,0,1]=4 1072 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-1316584114 [1,0,0,1,0,0|2,0,0]=4 1073 B13R2.435 O=C(O)C1CC2=C(C1)C=NC=C2 MCULE-4209278865 [1,0,0,1,0,0|2,0,0]=4 1074 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-2562454412 [1,0,0,1,0,0|1,0,0]=3 1075 B13R2.435 O=C(O)C1CC2=C(N1)C=CC=C2 MCULE-7215841209 [1,0,0,1,0,0|1,0,0]=3 1076 B13R2.435 O=C(O)C1CC2=CC=CC=C2C1 MCULE-3552591967 [1,0,0,1,0,0|1,0,0]=3 1077 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 MCULE-7206708690 [1,0,0,1,0,0|0,0,0]=2 1078 B13R2.435 O=C(O)C1CC2=CC=CC=C2S1 MCULE-1880873093 [1,0,0,1,0,0|0,1,0]=3 1079 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-2688790100 [1,0,0,1,0,0|2,0,0]=4 1080 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 MCULE-3306473482 [1,0,0,1,0,0|2,0,0]=4 1081 B13R2.435 O=C(O)C1CC2=CC=CN=C2N1 MCULE-8537870180 [1,0,0,1,0,0|2,0,0]=4 1082 B13R2.435 O=C(O)C1OC2=CC=CC=C2O1 MCULE-4160196773 [1,0,0,1,0,0|1,0,0]=3 1083 B13R2.435 O=C(O)[C@@H]1CC2=C(N1)C=CC=C2 MCULE-7672663112 [1,0,0,1,0,0|1,0,0]=3 1084 B13R2.435 O=C(O)[C@@H]1CC2=CC=CC=C2N1 MCULE-8181141847 [1,0,0,1,0,0|1,0,0]=3 1085 B13R2.435 O=C(O)[C@@H]1CC2=CC=CN=C2N1 MCULE-4315790053 [1,0,0,1,0,0|2,0,0]=4 1086 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-1818842898 [1,0,0,1,0,0|1,0,0]=3 1087 B13R2.435 O=C(O)[C@H]1CC2=C(N1)C=CC=C2 MCULE-5551098234 [1,0,0,1,0,0|1,0,0]=3 1088 B13R2.435 O=C([O-])C1CC2=C(C1)C=CC=C2 MCULE-7440231201 [1,0,0,1,0,0|1,0,1]=4 1089 B13R2.3587 CC1=C(C=CC=C1)OCC2CO2 MCULE-1434311248 [1,0,0,1,0,0|1,0,1]=4 1090 B13R2.4852 O=C(O)C1CC2=C(C=CC=C12)Cl MCULE-9655188482 [1,0,0,1,0,0|2,0,0]=4 1091 B13R2.5179 CC1=C2CCC(=O)NC2=CC=C1 MCULE-1241678456 [1,0,0,1,0,0|2,0,0]=4 1092 B13R2.5179 CC1=C2OCC(=O)NC2=CC=C1 MCULE-2496947130 [1,0,0,1,0,0|1,0,0]=3 1093 B13R2.5179 CC1=CC=CC2=C1CCC(=O)C2 MCULE-6952423413 [1,0,0,1,0,0|2,0,0]=4 1094 B13R2.5179 NC1=C2OCC(=O)NC2=CC=C1 MCULE-6752309501 [1,0,0,1,0,0|2,0,0]=4 1095 B13R2.5179 O=C1COC2=C(C1)C=CC=C2Br MCULE-6911914516 [1,0,0,1,0,0|2,0,0]=4 1096 B13R2.5179 O=C1COC2=C(C=CC=C2N1)Cl MCULE-3896209937 [1,0,0,1,0,0|2,0,0]=4 1097 B13R2.5179 O=C1COC2=C(C=CC=C2N1)F MCULE-2614563662 [1,0,0,1,0,0|2,0,0]=4 1098 B13R2.5179 O=C1COC2=C(C=CC=C2N1)O MCULE-7292771133 [1,0,0,1,0,0|2,0,0]=4 1099 B13R2.5179 O=C1COC2=C(N1)C=CC=C2Br MCULE-6588774997 [1,0,0,1,0,0|2,0,0]=4 1100 B13R2.54 CC1=C2OC(=NC2=CC=C1)C=O MCULE-5800760816 [1,0,0,1,0,0|1,0,1]=4 1101 B13R2.54 OCC1CC2=CC=CC(=C2O1)Br MCULE-8994556821 [1,0,0,1,0,0|1,0,1]=4 1102 B13R2.54 OCC1CC2=CC=CC(=C2O1)Cl MCULE-4057192242 [1,0,0,1,0,0|1,0,1]=4 1103 B13R2.4820 CC1=C2OCCNCC2=CC=C1 MCULE-7259021427 [1,0,0,1,0,0|1,0,1]=4 1104 B13R2.162 CC1=C2NC(=O)OCC2=CC=C1 MCULE-8442987150 [0,0,0,1,1,0|1,0,0]=3 1105 B13R2.162 CC1=CC=CC2=C1CC(=O)CC2 MCULE-8228174055 [0,0,0,1,1,0|1,0,0]=3 1106 B13R2.162 CC1=CC=CC2=C1NC(=O)CC2 MCULE-9088381228 [0,0,0,1,1,0|2,0,0]=4 1107 B13R2.162 NC1=C2NC(=O)OCC2=CC=C1 MCULE-7197292988 [0,0,0,1,1,0|2,0,0]=4 1108 B13R2.162 NC1=CC=CC2=C1CC(=O)CC2 MCULE-2017130114 [0,0,0,1,1,0|2,0,0]=4 1109 B13R2.162 NC1=CC=CC2=C1CC(=O)NC2 MCULE-2328257953 [0,0,0,1,1,0|2,0,0]=4 1110 B13R2.162 O=C1CC2=C(C=CC=C2CN1)Br MCULE-1994294016 [0,0,0,1,1,0|2,0,0]=4 1111 B13R2.162 O=C1CC2=C(C=CC=C2CN1)F MCULE-6706712873 [0,0,0,1,1,0|2,0,0]=4 1112 B13R2.162 O=C1CCC2=C(C1)C(=CC=C2)F MCULE-2213379137 [0,0,0,1,1,0|2,0,0]=4 1113 B13R2.162 O=C1CCC2=C(O1)C(=CC=C2)Br MCULE-9639111752 [0,0,0,1,1,0|2,0,0]=4 1114 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Br MCULE-5324327941 [0,0,0,1,1,0|2,0,0]=4 1115 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Cl MCULE-1935499736 [0,0,0,1,1,0|2,0,0]=4 1116 B13R2.162 O=C1CCC2=CC=CC(=C2C1)O MCULE-2221401927 [0,0,0,1,1,0|2,0,0]=4 1117 B13R2.162 O=C1NC2=C(C=CC=C2CO1)Br MCULE-5090543152 [0,0,0,1,1,0|2,0,0]=4 1118 B13R2.162 O=C1NC2=C(C=CC=C2CO1)Cl MCULE-9766829141 [0,0,0,1,1,0|2,0,0]=4 1119 B13R2.162 O=C1NC2=C(C=CC=C2CO1)F MCULE-7864115860 [0,0,0,1,1,0|2,0,0]=4 1120 B13R2.162 O=C1NC2=C(C=CC=C2CO1)I MCULE-4174837707 [0,0,0,1,1,0|2,0,0]=4 1121 B13R2.162 O=C1NCC2=CC=CC(=C2O1)O MCULE-1727138421 [0,0,0,1,1,0|2,0,0]=4 1122 B15R2.6956 CC1=CC=CC(=C1[C@@H]2CNC(=O)N2)C MCULE-5201776996 [0,0,0,1,0,1|2,0,0]=4 1123 B15R2.6956 CC1=CC=CC(=C1[C@@H]2COC(=O)N2)C MCULE-9213157887 [0,0,0,1,0,1|2,0,0]=4 1124 B15R2.6956 CC1=CC=CC(=C1[C@@H]2COC(=O)N2)C MCULE-9236539885 [0,0,0,1,0,1|2,0,0]=4 1125 B15R2.6956 CC1=CC=CC(=C1[C@H]2CNC(=O)N2)C MCULE-3541767374 [0,0,0,1,0,1|2,0,0]=4 1126 B15R2.6956 CC1=CC=CC(=C1[C@H]2COC(=O)N2)C MCULE-1893302057 [0,0,0,1,0,1|2,0,0]=4 1127 B15R2.6956 CC1=CC=CC(=C1[C@H]2COC(=O)N2)C MCULE-3440670315 [0,0,0,1,0,1|2,0,0]=4 1128 B15R2.13461 O=C(O)CC1CC2=C(C1)C(=CC=C2)O MCULE-5638701414 [0,0,0,1,0,1|2,0,0]=4 1129 B15R2.13461 O=C(O)CC1CC2=CC=CC(=C2C1)Br MCULE-5130287024 [0,0,0,1,0,1|2,0,0]=4 1130 B15R2.13598 CC1=CC=CC2=C1OCC(C2)C(=O)O MCULE-7106017265 [0,0,0,1,0,1|0,0,0]=2 1131 B15R2.13598 NC1=C2OCC(CC2=CC=C1)C(=O)O MCULE-3769781331 [0,0,0,1,0,1|1,0,0]=3 1132 B15R2.13598 O=C(O)C1=CC2=C(OC1)C(=CC=C2)Br MCULE-9933140338 [0,0,0,1,0,1|1,0,1]=4 1133 B15R2.13598 O=C(O)C1=CC2=C(OC1)C(=CC=C2)O MCULE-4180755839 [0,0,0,1,0,1|1,0,1]=4 1134 B15R2.13598 O=C(O)C1CCC2=C(C=CC=C2C1)Br MCULE-6772347880 [0,0,0,1,0,1|2,0,0]=4 1135 B15R2.13598 O=C(O)C1COC2=C(C1)C=CC=C2Br MCULE-7206008844 [0,0,0,1,0,1|1,0,0]=3 1136 B15R2.13598 O=C(O)C1COC2=C(C1)C=CC=C2Cl MCULE-9535133165 [0,0,0,1,0,1|1,0,0]=3 1137 B15R2.13598 O=C(O)C1COC2=C(C1)C=CC=C2O MCULE-1377941693 [0,0,0,1,0,1|1,0,0]=3 1138 B15R2.13463 CC1=C(OC2=C1C=CC=C2Br)C(=O)O MCULE-8622660280 [0,1,0,1,0,0|1,0,1]=4 1139 B15R2.13463 CC1=C(OC2=C1C=CC=C2Cl)C(=O)O MCULE-2907904660 [0,1,0,1,0,0|1,0,1]=4 1140 B15R2.13463 CC1=C(OC2=C1C=CC=C2F)C(=O)O MCULE-7318485704 [0,1,0,1,0,0|1,0,1]=4 1141 B15R2.13463 CC1=C2C=C(N(C2=CC=C1)C)C(=O)O MCULE-7324749180 [0,1,0,1,0,0|1,0,1]=4 1142 B15R2.13463 CC1=C2NC(=C(C2=CC=C1)C)C(=O)O MCULE-8619315816 [0,1,0,1,0,0|1,0,1]=4 1143 B15R2.13463 CC1=C2OC(=C(C2=CC=C1)C)C(=O)O MCULE-7987044630 [0,1,0,1,0,0|0,0,1]=3 1144 B15R2.13624 CC1=C2C(=CC=C1)C=CN2CC(=O)O MCULE-2760013779 [0,1,0,1,0,0|1,0,1]=4 1145 B15R2.13624 CC1=C2C(=CNC2=CC=C1)CC(=O)O MCULE-7906795026 [0,1,0,1,0,0|1,0,1]=4 1146 B15R2.20824 COC1=C2OC(CC2=CC=C1)C(=O)O MCULE-7623312018 [0,1,0,1,0,0|0,0,0]=2 1147 B15R2.20824 COC1=CC=CC2=C1CC(C2)C(=O)O MCULE-6514931988 [0,1,0,1,0,0|1,0,0]=3 1148 B15R2.20824 COC1=CC=CC2=C1OC(=C2)C(=O)O MCULE-8665710432 [0,1,0,1,0,0|0,0,2]=4 1149 B15R2.61353 O=C(O)C1CCC2=CC=CC(=C2C1)O MCULE-5872671103 [0,1,0,1,0,0|2,0,0]=4 1150 B15R2.61353 O=C(O)C1COC2=CC=CC(=C2C1)Br MCULE-7452842846 [0,1,0,1,0,0|2,0,0]=4 1151 B15R2.13975 CC1=CC(=C2OCC(=O)NCC2=C1)N MCULE-5794993607 [0,1,0,1,0,0|2,0,0]=4 1152 B15R2.15633 CC1=C2OC(=CC2=CC(=C1)Br)C(=O)O MCULE-3448008968 [0,1,0,1,0,0|0,0,2]=4 1153 B15R2.15633 CC1=CC(=C2CC(SC2=C1)C(=O)O)C MCULE-6975459756 [0,1,0,1,0,0|2,0,0]=4 1154 B15R2.15633 O=C(O)C1CC2=C(O1)C(=CC(=C2)F)F MCULE-6952923134 [0,1,0,1,0,0|1,0,0]=3 1155 B15R2.14566 CC1=C2C=C(OC2=C(C=C1)C)C(=O)O MCULE-1348343869 [0,1,0,1,0,0|0,0,2]=4 1156 B15R2.15646 CC1=C(C(=C(C=C1)C)OCC2CO2)C MCULE-4907155417 [0,1,0,1,0,0|1,0,1]=4 1157 B15R2.1598 COC(=O)C1=CC2=C(O1)C(=CC=C2)C MCULE-6824944456 [0,1,0,1,0,0|0,0,2]=4 1158 B15R2.1598 COC(=O)C1=NC2=CC=CC(=C2O1)C MCULE-6790781195 [0,1,0,1,0,0|1,0,1]=4 1159 B15R2.1598 COC(=O)C1CC2=C(C1)C(=CC=C2)N MCULE-7587761354 [0,1,0,1,0,0|2,0,0]=4 1160 B15R2.1598 COC(=O)C1CC2=C(C=CC=C2N1)C MCULE-4151404451 [0,1,0,1,0,0|2,0,0]=4 1161 B15R2.1598 COC(=O)C1CC2=C(C=CC=C2N1)C MCULE-6602505977 [0,1,0,1,0,0|2,0,0]=4 1162 B15R2.1598 COC(=O)C1CC2=CC=CC(=C2O1)N MCULE-7795954026 [0,1,0,1,0,0|1,0,0]=3 1163 B15R2.1598 COC(=O)C1NC2=CC=CC(=C2O1)Cl MCULE-7088310572 [0,1,0,1,0,0|2,0,0]=4 1164 B11R1.86 C=C(Br)CC1=C(C=CC=C1)C MCULE-1080242723 [1,0,0,0,1,0|2,0,0]=4 1165 B11R1.86 C=C(C)CC1=C(C=CC=C1)C MCULE-4884505681 [1,0,0,0,1,0|2,0,0]=4 1166 B11R1.86 C=C(Cl)CC1=C(C=CC=C1)C MCULE-8217754507 [1,0,0,0,1,0|2,0,0]=4 1167 B11R1.86 CC(=O)CC1=C(C=CC=C1)C MCULE-9820796471 [1,0,0,0,1,0|1,0,0]=3 1168 B11R1.86 CC(=O)CC1=C(C=CC=C1)F MCULE-8585489510 [1,0,0,0,1,0|2,0,0]=4 1169 B11R1.86 CC(=O)CC1=C(C=CC=C1)I MCULE-4542421041 [1,0,0,0,1,0|2,0,0]=4 1170 B11R1.86 CC(=O)CC1=CC=CC=C1Br MCULE-4564996057 [1,0,0,0,1,0|2,0,0]=4 1171 B11R1.86 CC(=O)CC1=CC=CC=C1Cl MCULE-3810531384 [1,0,0,0,1,0|2,0,0]=4 1172 B11R1.86 CC(=O)CC1=CC=CC=C1O MCULE-6749216407 [1,0,0,0,1,0|2,0,0]=4 1173 B11R1.86 CC(=O)CC1=NC=CC=C1C MCULE-6420535756 [1,0,0,0,1,0|2,0,0]=4 1174 B11R1.86 CC(=O)C[N+]1=C(C=CC=C1)C MCULE-5182177077 [1,0,0,0,1,0|2,0,0]=4 1175 B11R1.86 CC(=O)C[N+]1=C(C=CC=C1)C MCULE-9613379443 [1,0,0,0,1,0|2,0,0]=4 1176 B11R1.86 CC(=O)NC1=CC=CC=C1C MCULE-6798591484 [1,0,0,0,1,0|2,0,0]=4 1177 B11R1.86 CC(=O)OC1=C(C=CC=C1)Br MCULE-2567160688 [1,0,0,0,1,0|2,0,0]=4 1178 B11R1.86 CC(=O)OC1=C(C=CC=C1)C MCULE-2196965070 [1,0,0,0,1,0|1,0,0]=3 1179 B11R1.86 CC(=O)OC1=C(C=CC=C1)F MCULE-7296003099 [1,0,0,0,1,0|2,0,0]=4 1180 B11R1.86 CC(=O)OC1=C(C=CC=C1)I MCULE-1642126482 [1,0,0,0,1,0|2,0,0]=4 1181 B11R1.86 CC(=O)OC1=CC=CC=C1Cl MCULE-9535428783 [1,0,0,0,1,0|2,0,0]=4 1182 B11R1.86 CC1=C(C=CC=C1)CC(=N)N MCULE-5932098623 [1,0,0,0,1,0|2,0,0]=4 1183 B11R1.86 CC1=C(C=CC=C1)CC(=N)N MCULE-9579060564 [1,0,0,0,1,0|2,0,0]=4 1184 B11R1.86 CC1=C(C=CC=C1)CC(=O)Cl MCULE-2204169666 [1,0,0,0,1,0|1,0,0]=3 1185 B11R1.86 CC1=C(C=CC=C1)CC(=O)N MCULE-2017359459 [1,0,0,0,1,0|1,0,0]=3 1186 B11R1.86 CC1=C(C=CC=C1)CC(=O)O MCULE-2711057842 [1,0,0,0,1,0|0,0,0]=2 1187 B11R1.86 CC1=C(C=CC=N1)CC(=O)O MCULE-5704276980 [1,0,0,0,1,0|1,0,0]=3 1188 B11R1.86 CC1=C(C=CC=N1)CC(=O)O MCULE-7638762778 [1,0,0,0,1,0|1,0,0]=3 1189 B11R1.86 CC1=C(C=CN=C1)CC(=O)O MCULE-4672812145 [1,0,0,0,1,0|1,0,0]=3 1190 B11R1.86 CC1=C(C=CN=C1)CC(=O)O MCULE-4759143341 [1,0,0,0,1,0|1,0,0]=3 1191 B11R1.86 CC1=C(C=NC=C1)CC(=O)O MCULE-8291249240 [1,0,0,0,1,0|1,0,0]=3 1192 B11R1.86 CC1=C(C=NC=C1)CC(=O)O MCULE-9979416293 [1,0,0,0,1,0|1,0,0]=3 1193 B11R1.86 CC1=C(N=CC=C1)CC(=O)O MCULE-1657726107 [1,0,0,0,1,0|1,0,0]=3 1194 B11R1.86 CC1=C(N=CC=C1)CC(=O)O MCULE-5554854883 [1,0,0,0,1,0|1,0,0]=3 1195 B11R1.86 CC1=CC=CC=C1NC(=O)N MCULE-3078706756 [1,0,0,0,1,0|2,0,0]=4 1196 B11R1.86 CC1=CC=CC=C1NC(=O)O MCULE-8442522789 [1,0,0,0,1,0|1,0,0]=3 1197 B11R1.86 CC1=CC=CC=C1OC(=O)Cl MCULE-5904035790 [1,0,0,0,1,0|1,0,0]=3 1198 B11R1.86 N=C1C=CC=CN1CC(=O)O MCULE-4047006810 [1,0,0,0,1,0|2,0,0]=4 1199 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl MCULE-7984575726 [1,0,0,0,1,0|2,0,0]=4 1200 B11R1.86 NC(=O)CC1=C(C=CC=C1)F MCULE-5223110999 [1,0,0,0,1,0|2,0,0]=4 1201 B11R1.86 NC(=O)CC1=C(C=CC=C1)N MCULE-9751863950 [1,0,0,0,1,0|2,0,0]=4 1202 B11R1.86 NC(=O)CC1=CC=CC=C1Br MCULE-2881709255 [1,0,0,0,1,0|2,0,0]=4 1203 B11R1.86 NC(=O)CC1=CC=CC=C1I MCULE-3974289803 [1,0,0,0,1,0|2,0,0]=4 1204 B11R1.86 NC(=O)CC1=CC=CC=C1O MCULE-2645715128 [1,0,0,0,1,0|2,0,0]=4 1205 B11R1.86 NC1=C(C=CC=C1)CC(=O)O MCULE-7344835351 [1,0,0,0,1,0|1,0,0]=3 1206 B11R1.86 NC1=C(C=CC=N1)CC(=O)O MCULE-4550054935 [1,0,0,0,1,0|2,0,0]=4 1207 B11R1.86 NC1=C(C=CC=N1)CC(=O)O MCULE-6464422351 [1,0,0,0,1,0|2,0,0]=4 1208 B11R1.86 NC1=C(C=CN=C1)CC(=O)O MCULE-5002738797 [1,0,0,0,1,0|2,0,0]=4 1209 B11R1.86 NC1=C(C=NC=C1)CC(=O)O MCULE-6048065095 [1,0,0,0,1,0|2,0,0]=4 1210 B11R1.86 NC1=CC=CN=C1CC(=O)O MCULE-8212393793 [1,0,0,0,1,0|2,0,0]=4 1211 B11R1.86 O=C(Cl)CC1=C(C=CC=C1)Cl MCULE-2665699098 [1,0,0,0,1,0|2,0,0]=4 1212 B11R1.86 O=C(Cl)CC1=C(C=CC=C1)F MCULE-4601183572 [1,0,0,0,1,0|2,0,0]=4 1213 B11R1.86 O=C(Cl)CC1=CC=CC=C1Br MCULE-6472987280 [1,0,0,0,1,0|2,0,0]=4 1214 B11R1.86 O=C(Cl)CC1=CC=CC=C1I MCULE-1059914627 [1,0,0,0,1,0|2,0,0]=4 1215 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl MCULE-7823005178 [1,0,0,0,1,0|2,0,0]=4 1216 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br MCULE-8258964302 [1,0,0,0,1,0|1,0,0]=3 1217 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl MCULE-1722831263 [1,0,0,0,1,0|1,0,0]=3 1218 B11R1.86 O=C(O)CC1=C(C=CC=C1)F MCULE-2522299107 [1,0,0,0,1,0|1,0,0]=3 1219 B11R1.86 O=C(O)CC1=C(C=CC=C1)O MCULE-1517169773 [1,0,0,0,1,0|1,0,0]=3 1220 B11R1.86 O=C(O)CC1=C(C=CC=C1)S MCULE-3123903302 [1,0,0,0,1,0|1,0,0]=3 1221 B11R1.86 O=C(O)CC1=C(C=CC=N1)F MCULE-8535073521 [1,0,0,0,1,0|2,0,0]=4 1222 B11R1.86 O=C(O)CC1=C(C=CC=N1)F MCULE-8980680031 [1,0,0,0,1,0|2,0,0]=4 1223 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl MCULE-3609089817 [1,0,0,0,1,0|2,0,0]=4 1224 B11R1.86 O=C(O)CC1=C(C=CN=C1)Cl MCULE-7141750507 [1,0,0,0,1,0|2,0,0]=4 1225 B11R1.86 O=C(O)CC1=C(C=NC=C1)Cl MCULE-3650211007 [1,0,0,0,1,0|2,0,0]=4 1226 B11R1.86 O=C(O)CC1=C(N=CC=C1)Br MCULE-1401373922 [1,0,0,0,1,0|2,0,0]=4 1227 B11R1.86 O=C(O)CC1=CC=CC=C1I MCULE-3027871824 [1,0,0,0,1,0|1,0,0]=3 1228 B11R1.86 O=C(O)CC1=CC=CN=C1Cl MCULE-3452487494 [1,0,0,0,1,0|2,0,0]=4 1229 B11R1.86 O=C(O)CC1=CC=CN=C1F MCULE-9166192219 [1,0,0,0,1,0|2,0,0]=4 1230 B11R1.86 O=C(O)CC1=NC=CC=C1Br MCULE-4380218656 [1,0,0,0,1,0|2,0,0]=4 1231 B11R1.86 O=C(O)CC1=NC=CC=C1Cl MCULE-2193861295 [1,0,0,0,1,0|2,0,0]=4 1232 B11R1.86 O=C(O)CC1=NC=CC=C1Cl MCULE-5369354529 [1,0,0,0,1,0|2,0,0]=4 1233 B11R1.86 O=C(O)CC1=NC=CC=C1O MCULE-7203302758 [1,0,0,0,1,0|2,0,0]=4 1234 B11R1.86 O=C(O)CN1C=CC=CC1=O MCULE-8279762588 [1,0,0,0,1,0|2,0,0]=4 1235 B11R1.86 O=C([O-])CC1=CC=CC=C1O MCULE-2898464164 [1,0,0,0,1,0|1,0,1]=4 1236 B11R1.90 CC1=C(SC=C1)CCC(=O)O MCULE-6164958609 [1,0,0,0,1,0|2,0,0]=4 1237 B11R1.90 CN1C=CC=C1CCC(=O)O MCULE-2837121735 [1,0,0,0,1,0|2,0,0]=4 1238 B11R1.90 O=C(O)COC1=C(SC=C1)Cl MCULE-3642002301 [1,0,0,0,1,0|2,0,0]=4 1239 B11R1.495 CC1=CC=C(N1CC(=O)O)C MCULE-9329947233 [0,0,0,0,2,0|1,0,0]=3 1240 B11R1.495 CC1=NNC(=C1CC(=O)O)C MCULE-1898086009 [0,0,0,0,2,0|2,0,0]=4 1241 B11R1.495 CC1=NOC(=C1CC(=O)O)C MCULE-5670834149 [0,0,0,0,2,0|2,0,0]=4 1242 B11R1.156 C=C(C)C1=C(C=CC=C1C)C MCULE-2794647349 [0,0,0,0,2,0|2,0,0]=4 1243 B11R1.156 CC(=O)C1=C(C=CC=C1C)C MCULE-1535634375 [0,0,0,0,2,0|1,0,0]=3 1244 B11R1.156 CC(=O)C1=C(C=CC=C1C)N MCULE-9108071888 [0,0,0,0,2,0|2,0,0]=4 1245 B11R1.156 CC(=O)C1=C(C=CC=C1F)C MCULE-7159277859 [0,0,0,0,2,0|2,0,0]=4 1246 B11R1.156 CC(=O)C1=C(C=CC=C1O)C MCULE-2278824911 [0,0,0,0,2,0|2,0,0]=4 1247 B11R1.156 CC(=O)C1=C(C=CN=C1C)C MCULE-1556145997 [0,0,0,0,2,0|2,0,0]=4 1248 B11R1.156 CC1=C(C(=CC=C1)Br)C(=O)N MCULE-6910754562 [0,0,0,0,2,0|2,0,0]=4 1249 B11R1.156 CC1=C(C(=CC=C1)Br)C(=O)O MCULE-1508172708 [0,0,0,0,2,0|1,0,0]=3 1250 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)Cl MCULE-4196230531 [0,0,0,0,2,0|2,0,0]=4 1251 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)N MCULE-7886769773 [0,0,0,0,2,0|2,0,0]=4 1252 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)O MCULE-7203081508 [0,0,0,0,2,0|1,0,0]=3 1253 B11R1.156 CC1=C(C(=CC=C1)F)C(=O)Cl MCULE-9667875565 [0,0,0,0,2,0|2,0,0]=4 1254 B11R1.156 CC1=C(C(=CC=C1)F)C(=O)N MCULE-8956844751 [0,0,0,0,2,0|2,0,0]=4 1255 B11R1.156 CC1=C(C(=CC=C1)I)C(=O)O MCULE-3401416648 [0,0,0,0,2,0|1,0,0]=3 1256 B11R1.156 CC1=C(C(=CC=C1)N)C(=O)N MCULE-5148427944 [0,0,0,0,2,0|2,0,0]=4 1257 B11R1.156 CC1=C(C(=CC=C1)N)C(=O)O MCULE-6964999092 [0,0,0,0,2,0|1,0,0]=3 1258 B11R1.156 CC1=C(C(=CC=N1)Br)C(=O)O MCULE-2678679304 [0,0,0,0,2,0|2,0,0]=4 1259 B11R1.156 CC1=C(C(=CC=N1)Cl)C(=O)O MCULE-7462825634 [0,0,0,0,2,0|2,0,0]=4 1260 B11R1.156 CC1=C(C(=CC=N1)O)C(=O)O MCULE-6706890122 [0,0,0,0,2,0|2,0,0]=4 1261 B11R1.156 CC1=C(C(=CN=C1)F)C(=O)O MCULE-5399700082 [0,0,0,0,2,0|2,0,0]=4 1262 B11R1.156 CC1=C(C(=CN=C1)F)C(=O)O MCULE-9084236675 [0,0,0,0,2,0|2,0,0]=4 1263 B11R1.156 CC1=C(C(=CN=C1)N)C(=O)O MCULE-9525218986 [0,0,0,0,2,0|2,0,0]=4 1264 B11R1.156 CC1=C(C(=NC=C1)Br)C(=O)O MCULE-2224807091 [0,0,0,0,2,0|2,0,0]=4 1265 B11R1.156 CC1=C(C(=NC=C1)Cl)C(=O)O MCULE-9070633242 [0,0,0,0,2,0|2,0,0]=4 1266 B11R1.156 CC1=C(C(=NC=C1)F)C(=O)O MCULE-1959820116 [0,0,0,0,2,0|2,0,0]=4 1267 B11R1.156 CC1=C(C(=NC=C1)N)C(=O)O MCULE-3319150306 [0,0,0,0,2,0|2,0,0]=4 1268 B11R1.156 CC1=C(C(=NC=C1)O)C(=O)O MCULE-3896494131 [0,0,0,0,2,0|2,0,0]=4 1269 B11R1.156 CC1=CC=CC(=C1B(O)O)C MCULE-7535204141 [0,0,0,0,2,0|1,0,1]=4 1270 B11R1.156 CC1=CC=CC(=C1C(=N)N)C MCULE-4461498957 [0,0,0,0,2,0|2,0,0]=4 1271 B11R1.156 CC1=CC=CC(=C1C(=O)Cl)C MCULE-4867082484 [0,0,0,0,2,0|1,0,0]=3 1272 B11R1.156 CC1=CC=CC(=C1C(=O)Cl)N MCULE-6875236517 [0,0,0,0,2,0|2,0,0]=4 1273 B11R1.156 CC1=CC=CC(=C1C(=O)N)C MCULE-1584778604 [0,0,0,0,2,0|1,0,0]=3 1274 B11R1.156 CC1=CC=CC(=C1C(=O)O)C MCULE-5446094801 [0,0,0,0,2,0|0,0,0]=2 1275 B11R1.156 CC1=CC=CC(=C1C(=O)O)F MCULE-5548514158 [0,0,0,0,2,0|1,0,0]=3 1276 B11R1.156 CC1=CC=CC(=C1C(=O)O)O MCULE-7176393688 [0,0,0,0,2,0|1,0,0]=3 1277 B11R1.156 CC1=CC=CC(=C1C(=S)N)C MCULE-4161893537 [0,0,0,0,2,0|1,1,0]=4 1278 B11R1.156 CC1=CC=CC(=C1C(C)O)C MCULE-9672845897 [0,0,0,0,2,0|1,0,1]=4 1279 B11R1.156 CC1=CC=CC(=C1N(=O)=O)C MCULE-7620514956 [0,0,0,0,2,0|1,0,1]=4 1280 B11R1.156 CC1=CC=CN(=C1C(=O)O)=O MCULE-7566460017 [0,0,0,0,2,0|2,0,0]=4 1281 B11R1.156 CC1=CC=NC(=C1C(=O)O)C MCULE-6780333890 [0,0,0,0,2,0|1,0,0]=3 1282 B11R1.156 CC1=CC=NC(=C1C(=O)O)N MCULE-2479674667 [0,0,0,0,2,0|2,0,0]=4 1283 B11R1.156 CC1=CN=CC(=C1C(=O)N)C MCULE-5480085238 [0,0,0,0,2,0|2,0,0]=4 1284 B11R1.156 CC1=CN=CC(=C1C(=O)O)C MCULE-5694688254 [0,0,0,0,2,0|1,0,0]=3 1285 B11R1.156 CC1=CN=CC(=C1C(=O)O)Cl MCULE-9853394338 [0,0,0,0,2,0|2,0,0]=4 1286 B11R1.156 CC1=NC=CC(=C1C(=O)O)C MCULE-2292120926 [0,0,0,0,2,0|1,0,0]=3 1287 B11R1.156 CC1=NC=NC(=C1C(=O)O)C MCULE-5680064472 [0,0,0,0,2,0|2,0,0]=4 1288 B11R1.156 NC1=C(C(=CC=C1)Br)C(=O)O MCULE-6095876681 [0,0,0,0,2,0|2,0,0]=4 1289 B11R1.156 NC1=C(C(=CC=C1)Cl)C(=O)O MCULE-3516970636 [0,0,0,0,2,0|2,0,0]=4 1290 B11R1.156 NC1=C(C(=CC=C1)Cl)C(=O)O MCULE-8975160365 [0,0,0,0,2,0|2,0,0]=4 1291 B11R1.156 NC1=C(C(=CC=C1)F)C(=O)O MCULE-7460403012 [0,0,0,0,2,0|2,0,0]=4 1292 B11R1.156 NC1=C(C(=CC=C1)I)C(=O)O MCULE-1664526465 [0,0,0,0,2,0|2,0,0]=4 1293 B11R1.156 NC1=CC=CC(=C1C(=O)O)Br MCULE-1838188120 [0,0,0,0,2,0|2,0,0]=4 1294 B11R1.156 NC1=CC=CC(=C1C(=O)O)O MCULE-1359939534 [0,0,0,0,2,0|2,0,0]=4 1295 B11R1.156 O=C(O)C1=C(C=CC=C1Br)Br MCULE-9665582660 [0,0,0,0,2,0|2,0,0]=4 1296 B11R1.156 O=C(O)C1=C(C=CC=C1Cl)Br MCULE-4150769593 [0,0,0,0,2,0|2,0,0]=4 1297 B11R1.156 O=C(O)C1=C(C=CC=C1Cl)Cl MCULE-4873545049 [0,0,0,0,2,0|2,0,0]=4 1298 B11R1.156 O=C(O)C1=C(C=CC=C1F)Br MCULE-1185303373 [0,0,0,0,2,0|2,0,0]=4 1299 B11R1.156 O=C(O)C1=C(C=CC=C1F)Cl MCULE-6713207133 [0,0,0,0,2,0|2,0,0]=4 1300 B11R1.156 O=C(O)C1=C(C=CC=C1F)F MCULE-2366720632 [0,0,0,0,2,0|2,0,0]=4 1301 B11R1.156 O=C(O)C1=C(C=CC=C1F)I MCULE-7099414850 [0,0,0,0,2,0|2,0,0]=4 1302 B11R1.156 O=C(O)C1=C(C=CC=C1I)Br MCULE-1368152054 [0,0,0,0,2,0|2,0,0]=4 1303 B11R1.156 O=C(O)C1=C(C=CC=C1I)Cl MCULE-5041940906 [0,0,0,0,2,0|2,0,0]=4 1304 B11R1.156 O=C(O)C1=C(C=CC=C1I)O MCULE-2473954380 [0,0,0,0,2,0|2,0,0]=4 1305 B11R1.156 O=C(O)C1=C(C=CC=C1O)Br MCULE-1570151433 [0,0,0,0,2,0|2,0,0]=4 1306 B11R1.156 O=C(O)C1=C(C=CC=C1O)Cl MCULE-8318661261 [0,0,0,0,2,0|2,0,0]=4 1307 B11R1.156 O=C(O)C1=C(C=CC=C1O)F MCULE-2746074430 [0,0,0,0,2,0|2,0,0]=4 1308 B11R1.156 O=C(O)C1=C(C=CC=C1O)O MCULE-1114504762 [0,0,0,0,2,0|2,0,0]=4 1309 B13R1.158 CC(=CCOC1=CC=CC=C1C)C MCULE-1376866677 [1,0,0,0,0,1|2,0,0]=4 1310 B13R1.158 CC(=O)OCCC1=C(C=CC=C1)C MCULE-9970147954 [1,0,0,0,0,1|2,0,0]=4 1311 B13R1.158 CC1=C(C=CC=C1)CCCC(=O)O MCULE-8086754634 [1,0,0,0,0,1|1,0,0]=3 1312 B13R1.158 CC1=C(C=CC=C1)CNCC(=O)O MCULE-7575998033 [1,0,0,0,0,1|1,0,0]=3 1313 B13R1.158 CC1=C(C=CC=C1)CNCC(=O)O MCULE-8080342184 [1,0,0,0,0,1|1,0,0]=3 1314 B13R1.158 CC1=C(C=CC=C1)COCC(=O)O MCULE-1126440851 [1,0,0,0,0,1|0,0,0]=2 1315 B13R1.158 CC1=C(C=CC=C1)CSCC(=O)N MCULE-5201981930 [1,0,0,0,0,1|1,1,0]=4 1316 B13R1.158 CC1=C(C=CC=C1)CSCC(=O)O MCULE-2262275281 [1,0,0,0,0,1|0,1,0]=3 1317 B13R1.158 CC1=C(C=CC=C1)NCCC(=O)O MCULE-6433959628 [1,0,0,0,0,1|1,0,0]=3 1318 B13R1.158 CC1=CC=CC=C1OCCC(=O)O MCULE-1847570735 [1,0,0,0,0,1|0,0,0]=2 1319 B13R1.158 CC1=CC=CC=C1SCCC(=O)O MCULE-3610383733 [1,0,0,0,0,1|0,1,0]=3 1320 B13R1.158 NC(=O)CCOC1=C(C=CC=C1)N MCULE-6323548335 [1,0,0,0,0,1|2,0,0]=4 1321 B13R1.158 NC1=C(C=CC=C1)CCCC(=O)O MCULE-4546839548 [1,0,0,0,0,1|2,0,0]=4 1322 B13R1.158 NC1=C(C=CC=C1)CCCC(=O)O MCULE-8845736053 [1,0,0,0,0,1|2,0,0]=4 1323 B13R1.158 NC1=CC=CC=C1OCCC(=O)O MCULE-4643199382 [1,0,0,0,0,1|1,0,0]=3 1324 B13R1.158 NC1=CC=CC=C1OCCC(=O)O MCULE-9399438033 [1,0,0,0,0,1|1,0,0]=3 1325 B13R1.158 O=C(O)CC=CC1=C(C=CC=C1)F MCULE-9599946758 [1,0,0,0,0,1|2,0,0]=4 1326 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)Br MCULE-9066386382 [1,0,0,0,0,1|2,0,0]=4 1327 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)Cl MCULE-6520890001 [1,0,0,0,0,1|2,0,0]=4 1328 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)F MCULE-7333605867 [1,0,0,0,0,1|2,0,0]=4 1329 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)O MCULE-6061979247 [1,0,0,0,0,1|2,0,0]=4 1330 B13R1.158 O=C(O)CCNC1=C(C=CC=C1)F MCULE-9617002989 [1,0,0,0,0,1|2,0,0]=4 1331 B13R1.158 O=C(O)CCNC1=CC=CC=C1Cl MCULE-7708706863 [1,0,0,0,0,1|2,0,0]=4 1332 B13R1.158 O=C(O)CCNC1=CC=CC=C1I MCULE-8194705706 [1,0,0,0,0,1|2,0,0]=4 1333 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)Br MCULE-1634299141 [1,0,0,0,0,1|1,0,0]=3 1334 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)Cl MCULE-2237792478 [1,0,0,0,0,1|1,0,0]=3 1335 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)F MCULE-8402983120 [1,0,0,0,0,1|1,0,0]=3 1336 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)I MCULE-3745325973 [1,0,0,0,0,1|1,0,0]=3 1337 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)Br MCULE-9251688488 [1,0,0,0,0,1|1,1,0]=4 1338 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)Cl MCULE-1522135518 [1,0,0,0,0,1|1,1,0]=4 1339 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)F MCULE-4201790331 [1,0,0,0,0,1|1,1,0]=4 1340 B13R1.158 O=C(O)CNCC1=C(C=CC=C1)Br MCULE-4326023014 [1,0,0,0,0,1|2,0,0]=4 1341 B13R1.158 O=C(O)CNCC1=CC=CC=C1Cl MCULE-1625907465 [1,0,0,0,0,1|2,0,0]=4 1342 B13R1.158 O=C(O)CNCC1=CC=CC=C1Cl MCULE-7566342930 [1,0,0,0,0,1|2,0,0]=4 1343 B13R1.158 O=C(O)CNCC1=CC=CC=C1F MCULE-9825730426 [1,0,0,0,0,1|2,0,0]=4 1344 B13R1.158 O=C(O)CNCC1=CC=CC=C1I MCULE-5276781878 [1,0,0,0,0,1|2,0,0]=4 1345 B13R1.158 O=C(O)COCC1=C(C=CC=C1)Cl MCULE-5182686332 [1,0,0,0,0,1|1,0,0]=3 1346 B13R1.158 O=C(O)COCC1=C(C=CC=C1)F MCULE-6728381420 [1,0,0,0,0,1|1,0,0]=3 1347 B13R1.158 O=C(O)CSCC1=C(C=CC=C1)Br MCULE-1240587438 [1,0,0,0,0,1|1,1,0]=4 1348 B13R1.158 O=C(O)CSCC1=C(C=CC=C1)Cl MCULE-9571632216 [1,0,0,0,0,1|1,1,0]=4 1349 B13R1.158 O=C(O)CSCC1=C(C=CC=C1)F MCULE-6635727666 [1,0,0,0,0,1|1,1,0]=4 1350 B13R1.3529 CC1=CC=C(N1CCCC(=O)O)C MCULE-3608903389 [0,0,0,0,1,1|2,0,0]=4 1351 B15R1.8290 CC(=O)OCCOC1=C(C=CC=C1C)C MCULE-7971776088 [0,0,0,0,0,2|1,0,0]=3 1352 B15R1.8290 CC1=CC=CC(=C1OCCCC(=O)O)C MCULE-8124915564 [0,0,0,0,0,2|0,0,0]=2 1353 B15R1.8290 O=C(O)C=CCOC1=C(C=CC=C1Cl)Cl MCULE-1074195774 [0,0,0,0,0,2|2,0,0]=4 1354 B15R1.8290 O=C(O)CCCOC1=C(C=CC=C1Cl)Cl MCULE-7187703734 [0,0,0,0,0,2|2,0,0]=4