0 B8R0.2 CCC(C)C(=O)C(=O)O 2129-1-1A [0,0,0,0,0,0|1,0,1]=2 1 B8R0.2 CCC(O)C(Cl)C(=O)O 2129-5-03 [0,0,0,0,0,0|2,0,0]=2 2 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O 2121-5-0B [0,0,0,0,0,0|1,0,0]=1 3 B7R0.2 CC(=O)NC(C)CN 4148-1-0B [1,0,0,0,0,0|3,0,0]=4 4 B7R0.2 CC(=O)NC(C)CN 4148-5-0L [1,0,0,0,0,0|3,0,0]=4 5 B7R0.2 CC(CN)CC(=O)O 4157-5-12 [1,0,0,0,0,0|1,0,0]=2 6 B7R0.2 CCC(=O)CC(=O)O 2129-1-1N [1,0,0,0,0,0|1,0,1]=3 7 B7R0.2 CCC(=O)CC(C)=O 2118-1-09 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.2 CCC(C)CC(=O)O 2121-1-00 [1,0,0,0,0,0|0,0,0]=1 9 B7R0.2 CCC(C)CC(C)C 1100-1-24 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.2 CCC(C)OC(=O)Cl 2116-5-08 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.2 CCC(N)CC(=O)O 4157-1-20 [1,0,0,0,0,0|1,0,0]=2 12 B7R0.2 CC[C@@H](N)CC(=O)O 4156-5-R2 [1,0,0,0,0,0|1,0,0]=2 13 B7R0.2 CC[C@H](C)CC(=O)O 2121-1-S4 [1,0,0,0,0,0|0,0,0]=1 14 B7R0.2 COC(=O)CC(=O)O 2123-1-85 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.2 NCC(O)CC(=O)O 4157-1-14 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.5 C#CCC(N)C(=O)O 4557-1-01 [1,0,0,0,0,0|0,0,2]=3 17 B7R0.5 C#CC[C@@H](N)C(=O)O 4557-1-R3 [1,0,0,0,0,0|0,0,2]=3 18 B7R0.5 C#CC[C@H](N)C(=O)O 4557-1-S3 [1,0,0,0,0,0|0,0,2]=3 19 B7R0.5 C=CC[C@@H](N)C(=O)O 4357-1-01 [1,0,0,0,0,0|0,0,2]=3 20 B7R0.5 CCCC(Br)C(=O)O 2121-9-0C [1,0,0,0,0,0|1,0,0]=2 21 B7R0.5 CCCC(C)C(=O)O 2121-1-0R [1,0,0,0,0,0|1,0,0]=2 22 B7R0.5 CCC[C@@H](N)C(=O)O 4157-1-RA [1,0,0,0,0,0|0,0,0]=1 23 B7R0.5 CC\C=C(/C)C(=O)O 2321-1-0R [1,0,0,0,0,0|1,0,2]=4 24 B7R0.5 CNCC(N)C(=O)O 4157-5-00 [1,0,0,0,0,0|1,0,0]=2 25 B7R0.5 CNC[C@H](N)C(=O)O 4157-1-SK [1,0,0,0,0,0|1,0,0]=2 26 B7R0.5 COCC(N)C(=O)O 4157-1-18 [1,0,0,0,0,0|1,0,0]=2 27 B7R0.5 COC[C@@H](N)C(=O)O 4157-5-R0 [1,0,0,0,0,0|1,0,0]=2 28 B7R0.5 COC[C@H](N)C(=O)O 4157-1-S3 [1,0,0,0,0,0|1,0,0]=2 29 B7R0.5 NC(CCO)C(=O)O 4157-1-0D [1,0,0,0,0,0|1,0,0]=2 30 B7R0.5 NCCC(N)C(=O)O 4157-5-04 [1,0,0,0,0,0|1,0,0]=2 31 B7R0.5 NCC[C@@H](F)C(=O)O 4157-3-R0 [1,0,0,0,0,0|2,0,0]=3 32 B7R0.5 NCC[C@H](F)C(=O)O 4157-3-S0 [1,0,0,0,0,0|2,0,0]=3 33 B7R0.5 NCC[C@H](N)C(=O)O 4157-1-SG [1,0,0,0,0,0|1,0,0]=2 34 B7R0.5 O=C(Br)C(Br)CCBr 2116-9-00 [1,0,0,0,0,0|3,0,0]=4 35 B7R0.10 O=C[C@H](O)[C@H](O)CO 2112-1-06 [1,0,0,0,0,0|3,0,0]=4 36 B7R0.16 CC(C)C(=O)C(=O)O 2129-1-0Q [1,0,0,0,0,0|1,0,1]=3 37 B7R0.16 CC(C)C(Br)C(=O)Br 2116-9-06 [1,0,0,0,0,0|2,0,0]=3 38 B7R0.16 CC(C)C(Br)C(=O)O 2121-9-10 [1,0,0,0,0,0|1,0,0]=2 39 B7R0.16 CC(C)C(N)C(=O)O 4157-1-10 [1,0,0,0,0,0|0,0,0]=1 40 B7R0.16 CC(C)[C@@H](Br)C(=O)O 2121-9-R1 [1,0,0,0,0,0|1,0,0]=2 41 B7R0.16 CC(C)[C@@H](N)C(=O)O 4157-1-Y1 [1,0,0,0,0,0|0,0,0]=1 42 B7R0.16 CC(C)[C@@H](O)C(=O)O 2129-1-18 [1,0,0,0,0,0|1,0,0]=2 43 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O 4157-1-33 [1,0,0,0,0,0|1,0,0]=2 44 B7R0.16 NC(C(=O)O)C(F)F 4157-3-38 [1,0,0,0,0,0|2,0,0]=3 45 B7R0.16 O=C(O)C(O)C(F)F 2129-3-44 [1,0,0,0,0,0|3,0,0]=4 46 B7R0.16 [C@@H](N)(C(=O)O)[C@@H](C)O 4157-1-X7 [1,0,0,0,0,0|1,0,0]=2 47 B9R0.6 CCCC(F)C(N)C(=O)O 4157-3-X0 [0,1,0,0,0,0|1,0,0]=2 48 B9R0.25 CC[C@H](C)[C@H](N)C(F)(F)F 3130-3-S9 [0,1,0,0,0,0|2,0,1]=4 49 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC 4158-5-0J [0,1,0,0,0,0|0,0,0]=1 50 B9R0.27 COC(=O)C(N)C(=O)OC 4158-1-18 [0,1,0,0,0,0|2,0,1]=4 51 B9R0.32 COC(C)(C)C(Br)C(=O)O 2121-9-02 [0,1,0,0,0,0|2,0,0]=3 52 B9R0.32 COC(C)(C)C(N)C(=O)O 4157-1-Y2 [0,1,0,0,0,0|1,0,0]=2 53 B9R0.79 CC(C(=O)O)C(C)C(=O)O 2121-1-0H [0,1,0,0,0,0|2,0,1]=4 54 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O 4157-1-0T [0,1,0,0,0,0|1,0,0]=2 55 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O 4156-1-46 [0,1,0,0,0,0|0,0,0]=1 56 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O 4157-1-45 [0,1,0,0,0,0|0,0,0]=1 57 B9R0.79 NC(C(=O)O)C(N)C(=O)O 4157-1-0M [0,1,0,0,0,0|2,0,1]=4 58 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O 4157-1-0S [0,1,0,0,0,0|2,0,1]=4 59 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O 4157-1-42 [0,1,0,0,0,0|2,0,1]=4 60 B9R1.3 CC1CCCC(O)C1C 2202-1-0U [0,0,0,1,0,0|2,0,1]=4 61 B9R1.37 CC1CC(=O)C(=O)C1C 2218-1-16 [0,0,0,1,0,0|2,0,1]=4 62 B9R1.37 CC1OC(=O)C(=O)C1C 2H29-1-0B [0,0,0,1,0,0|1,0,1]=3 63 B9R1.41 CC1CNCC1C(=O)O 4H58-1-044 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.41 CN1CCCC1C(=O)O 4H21-1-FK [0,0,0,1,0,0|2,0,0]=3 65 B9R1.41 NN1CCC[C@@H]1C(=O)O 4H57-1-28 [0,0,0,1,0,0|3,0,0]=4 66 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O 4257-5-09 [0,0,0,1,0,0|2,0,0]=3 67 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O 4257-5-08 [0,0,0,1,0,0|2,0,0]=3 68 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O 4257-5-10 [0,0,0,1,0,0|2,0,0]=3 69 B9R1.93 C=CC1CC1(N)C(=O)O 4357-1-03 [0,0,0,1,0,0|0,0,2]=3 70 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO 4257-1-0E [0,0,0,1,0,0|1,0,0]=2 71 B9R1.110 NC(C(=O)O)C1COC1 4H57-1-71 [0,0,0,1,0,0|1,0,0]=2 72 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O 4157-1-R9 [0,0,0,0,0,1|2,0,1]=4 73 B6R0.1 CCCC(C)C=O 2115-1-12 [2,0,0,0,0,0|1,0,0]=3 74 B6R0.1 CCCC(N)C#N 3137-5-03 [2,0,0,0,0,0|1,0,1]=4 75 B6R0.1 CCC[C@@H](N)CO 4156-1-72 [2,0,0,0,0,0|0,0,1]=3 76 B6R0.1 CCC[C@H](N)CO 4156-1-70 [2,0,0,0,0,0|0,0,1]=3 77 B6R0.1 CC[C@H](C)CCO 2101-1-S3 [2,0,0,0,0,0|0,0,1]=3 78 B6R0.1 C[C@H](CO)CCO 2104-1-S4 [2,0,0,0,0,0|1,0,1]=4 79 B6R0.2 C=C(Br)CC(C)C 1300-9-16 [2,0,0,0,0,0|2,0,0]=4 80 B6R0.2 CC(C)CC(=O)O 2121-1-18 [2,0,0,0,0,0|0,0,0]=2 81 B6R0.2 CC(C)NC(N)=O 4153-1-10 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.2 CC(C)OC(N)=O 4156-1-2S [2,0,0,0,0,0|2,0,0]=4 83 B6R0.2 CC(C)SC(=O)Cl 6166-5-00 [2,0,0,0,0,0|2,0,0]=4 84 B6R0.2 CC(Cl)CC(=O)O 2121-5-09 [2,0,0,0,0,0|1,0,0]=3 85 B6R0.2 CN(C)CC(=O)O 4158-1-41 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.2 C[C@@H](N)CC(=O)O 4157-1-12 [2,0,0,0,0,0|1,0,0]=3 87 B6R0.2 C[C@H](N)CC(=O)O 4157-5-06 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.4 C=C(Br)CCCC 1300-9-19 [2,0,0,0,0,0|2,0,0]=4 89 B6R0.4 C=CCCC(=O)O 2321-1-0D [2,0,0,0,0,0|0,0,2]=4 90 B6R0.4 CC(=O)CCCBr 2117-9-0A [2,0,0,0,0,0|2,0,0]=4 91 B6R0.4 CCCCC(=N)N 3141-1-03 [2,0,0,0,0,0|2,0,0]=4 92 B6R0.4 CCCCC(=O)Br 2116-9-0A [2,0,0,0,0,0|1,0,0]=3 93 B6R0.4 CCCCC(C)=O 2117-1-11 [2,0,0,0,0,0|1,0,0]=3 94 B6R0.4 CCCCC(C)O 2102-1-07 [2,0,0,0,0,0|1,0,1]=4 95 B6R0.4 CCCCC(N)=O 4148-1-0P [2,0,0,0,0,0|1,0,0]=3 96 B6R0.4 CCCC[C@H](C)O 2102-1-S0 [2,0,0,0,0,0|1,0,1]=4 97 B6R0.4 CCCNC(N)=O 4153-1-00 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.4 CCCOC(=O)Cl 2116-5-30 [2,0,0,0,0,0|2,0,0]=4 99 B6R0.4 CCCOC(N)=O 4156-1-2G [2,0,0,0,0,0|2,0,0]=4 100 B6R0.4 CCCSC(C)=O 6166-1-0A [2,0,0,0,0,0|2,0,0]=4 101 B6R0.4 CCNCC(=O)O 4158-1-76 [2,0,0,0,0,0|1,0,0]=3 102 B6R0.4 CCOCC(=O)O 2121-1-20 [2,0,0,0,0,0|1,0,0]=3 103 B6R0.4 CC\C=C\C(=O)O 2321-1-X5 [2,0,0,0,0,0|0,0,2]=4 104 B6R0.4 CNCCC(=O)O 4157-1-11 [2,0,0,0,0,0|1,0,0]=3 105 B6R0.4 COCCC(=O)Cl 2116-5-0C [2,0,0,0,0,0|2,0,0]=4 106 B6R0.4 COCCC(=O)O 2123-1-63 [2,0,0,0,0,0|1,0,0]=3 107 B6R0.4 CSCCC(=O)Cl 6166-5-01 [2,0,0,0,0,0|2,0,0]=4 108 B6R0.4 CSCCC(C)=O 6166-1-0J [2,0,0,0,0,0|2,0,0]=4 109 B6R0.4 N#CCCC(=O)O 4137-1-00 [2,0,0,0,0,0|1,0,1]=4 110 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [2,0,0,0,0,0|2,0,0]=4 111 B6R0.4 O=C(O)CCCBr 2121-9-05 [2,0,0,0,0,0|1,0,0]=3 112 B6R0.3 C=C(Br)C(C)CC 1300-9-17 [2,0,0,0,0,0|1,0,1]=4 113 B6R0.3 CC(CBr)C(=O)O 2121-9-0A [2,0,0,0,0,0|2,0,0]=4 114 B6R0.3 CC(CS)C(=O)O 6261-1-00 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.3 CCC(Br)C(=O)Br 2116-9-09 [2,0,0,0,0,0|2,0,0]=4 116 B6R0.3 CCC(Br)C(=O)Cl 2116-D-02 [2,0,0,0,0,0|2,0,0]=4 117 B6R0.3 CCC(Br)C(=O)O 2121-9-15 [2,0,0,0,0,0|1,0,0]=3 118 B6R0.3 CCC(C)B(O)O 6160-1-05 [2,0,0,0,0,0|2,0,0]=4 119 B6R0.3 CCC(O)C(=O)O 2129-1-1J [2,0,0,0,0,0|1,0,0]=3 120 B6R0.3 CCC(S)C(C)=O 6161-1-00 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.3 CC[C@@H](Cl)C(=O)O 2121-5-R0 [2,0,0,0,0,0|1,0,0]=3 122 B6R0.3 CC[C@@H](O)C(=O)O 2129-1-RF [2,0,0,0,0,0|1,0,0]=3 123 B6R0.3 CC[C@H](C)C(=O)O 2121-1-S0 [2,0,0,0,0,0|1,0,0]=3 124 B6R0.3 CC[C@H](Cl)C(=O)O 2121-5-S0 [2,0,0,0,0,0|1,0,0]=3 125 B6R0.3 CC[C@H](N)C(N)=O 4148-5-S0 [2,0,0,0,0,0|1,0,0]=3 126 B6R0.3 CNC(C)C(=O)O 4157-1-0A [2,0,0,0,0,0|2,0,0]=4 127 B6R0.3 CO[C@@H](C)C(=O)O 2121-1-S1 [2,0,0,0,0,0|2,0,0]=4 128 B6R0.3 CO[C@H](C)C(=O)O 2121-1-R1 [2,0,0,0,0,0|2,0,0]=4 129 B6R0.3 NC(CS)C(=O)O 8161-5-00 [2,0,0,0,0,0|1,0,0]=3 130 B6R0.3 NCC(N)C(=O)O 4157-1-27 [2,0,0,0,0,0|1,0,0]=3 131 B6R0.3 NCC(N)C(=O)O 4157-5-02 [2,0,0,0,0,0|1,0,0]=3 132 B6R0.3 NCC(O)C(=O)O 4157-1-47 [2,0,0,0,0,0|2,0,0]=4 133 B6R0.3 NC[C@@H](N)C(=O)O 4157-5-R5 [2,0,0,0,0,0|1,0,0]=3 134 B6R0.3 NC[C@H](N)C(=O)O 4157-5-S5 [2,0,0,0,0,0|1,0,0]=3 135 B6R0.3 NC[C@H](O)C(=O)O 4156-1-SR [2,0,0,0,0,0|2,0,0]=4 136 B6R0.3 N[C@@H](CCl)C(=O)O 4157-5-R3 [2,0,0,0,0,0|1,0,0]=3 137 B6R0.3 N[C@@H](CS)C(=O)O 8161-5-R2 [2,0,0,0,0,0|1,0,0]=3 138 B6R0.3 N[C@H](CS)C(=O)O 8161-5-S2 [2,0,0,0,0,0|1,0,0]=3 139 B6R0.3 O=C(O)C(Br)CBr 2121-9-06 [2,0,0,0,0,0|2,0,0]=4 140 B6R0.3 O=C(O)C(F)CF 2121-3-1P [2,0,0,0,0,0|2,0,0]=4 141 B8R0.5 CCC\C(C)=C\C(=O)O 2321-1-21 [1,1,0,0,0,0|0,0,2]=4 142 B8R0.19 CC[C@H](O)CC(=O)OC 2129-1-SE [1,1,0,0,0,0|1,0,0]=3 143 B8R0.19 COC(=O)C[C@H](O)CCl 2129-5-S0 [1,1,0,0,0,0|2,0,0]=4 144 B8R0.23 CC(C)C(N)CC(=O)O 4157-1-40 [1,1,0,0,0,0|1,0,0]=3 145 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-1-R40 [1,1,0,0,0,0|1,0,0]=3 146 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-5-10 [1,1,0,0,0,0|1,0,0]=3 147 B8R0.23 CC(CC(=O)O)C(=O)O 2121-1-0D [1,1,0,0,0,0|1,0,1]=4 148 B8R0.23 C[C@@H](CC(=O)O)C(=O)O 2121-1-S3 [1,1,0,0,0,0|1,0,1]=4 149 B8R0.23 C[C@H](CC(=O)O)C(=O)O 2121-1-R3 [1,1,0,0,0,0|1,0,1]=4 150 B8R0.34 CC(C)(CN)CC(=O)O 4157-1-51 [1,1,0,0,0,0|1,0,0]=3 151 B8R0.34 CC(O)(CN)CC(=O)O 4157-1-58 [1,1,0,0,0,0|1,0,0]=3 152 B8R0.34 CCC(C)(O)CC(=O)O 2129-1-0V [1,1,0,0,0,0|0,0,0]=2 153 B8R0.34 CCS(=O)(=O)CC(=O)O 6163-1-05 [1,1,0,0,0,0|2,0,0]=4 154 B8R0.34 NCC(F)(F)CC(=O)O 4157-3-37 [1,1,0,0,0,0|2,0,0]=4 155 B8R0.3 C#CC[C@@H](N)C(=O)OC 4558-1-00 [1,1,0,0,0,0|0,0,2]=4 156 B8R0.3 C=CCC(N)C(=O)OC 4358-5-00 [1,1,0,0,0,0|0,0,2]=4 157 B8R0.3 CCCC(N)C(=O)OC 4158-5-0M [1,1,0,0,0,0|0,0,0]=2 158 B8R0.3 CCC[C@H](N)C(=O)OC 4158-1-S00 [1,1,0,0,0,0|0,0,0]=2 159 B8R0.3 CCC[C@H](N)C(=O)OC 4158-5-SH [1,1,0,0,0,0|0,0,0]=2 160 B8R0.3 COC(=O)C(C)CCCl 2123-5-1K [1,1,0,0,0,0|2,0,0]=4 161 B8R0.8 C#CCC[C@@H](N)C(=O)O 4557-1-R1 [1,1,0,0,0,0|0,0,1]=3 162 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [1,1,0,0,0,0|1,0,0]=3 163 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [1,1,0,0,0,0|1,0,0]=3 164 B8R0.8 CCC\C=C(/C)C(=O)O 2321-1-0S [1,1,0,0,0,0|1,0,1]=4 165 B8R0.8 COCC[C@H](N)C(=O)O 4157-5-S8 [1,1,0,0,0,0|0,0,0]=2 166 B8R0.8 CSCCC(N)C(=O)O 8166-1-00 [1,1,0,0,0,0|0,0,0]=2 167 B8R0.8 NOCC[C@H](N)C(=O)O 4157-1-08 [1,1,0,0,0,0|1,0,0]=3 168 B8R0.8 [C@H](N)(CCSC)C(=O)O 8166-1-S5 [1,1,0,0,0,0|0,0,0]=2 169 B8R0.12 C=CC[C@@](C)(N)C(=O)O 4357-1-R1 [1,1,0,0,0,0|0,0,2]=4 170 B8R0.12 CC(C)(CCN)C(=O)O 4157-1-49 [1,1,0,0,0,0|2,0,0]=4 171 B8R0.12 CC(C)(CCN)C(=O)O 4157-5-11 [1,1,0,0,0,0|2,0,0]=4 172 B8R0.12 CCC[C@@](C)(N)C(=O)O 4157-1-RB [1,1,0,0,0,0|0,0,0]=2 173 B8R0.12 CCOC(C)(C)C(=O)O 2121-1-0T [1,1,0,0,0,0|2,0,0]=4 174 B8R0.12 NCCC(F)(F)C(=O)O 4157-3-21 [1,1,0,0,0,0|2,0,0]=4 175 B8R0.12 NCCC(F)(F)C(=O)O 4157-7-02 [1,1,0,0,0,0|2,0,0]=4 176 B8R0.15 COC(CCN)C(=O)O 4157-1-57 [1,1,0,0,0,0|2,0,0]=4 177 B8R0.27 CC(C(=O)O)C(C)(C)C 2121-1-44 [1,1,0,0,0,0|1,0,0]=3 178 B8R0.27 CC(C)(C)C(=O)C(=O)O 2129-1-26 [1,1,0,0,0,0|1,0,1]=4 179 B8R0.27 CC(C)(C)C(N)C(=O)O 4157-1-0V [1,1,0,0,0,0|0,0,0]=2 180 B8R0.27 CC(C)(C)[C@H](O)C(=O)O 2129-1-S5 [1,1,0,0,0,0|1,0,0]=3 181 B8R0.27 CC(C)(F)C(N)C(=O)O 4157-3-X1 [1,1,0,0,0,0|0,0,0]=2 182 B8R0.27 CC(C)(O)C(N)C(=O)O 4157-1-0R [1,1,0,0,0,0|0,0,0]=2 183 B8R0.27 CC(C)(O)[C@H](N)C(=O)O 4157-1-SJ [1,1,0,0,0,0|0,0,0]=2 184 B8R0.37 CC(C)[C@](C)(N)C(=O)O 4157-1-SH [1,1,0,0,0,0|0,0,0]=2 185 B8R0.37 CC(O)[C@@](C)(N)C(=O)O 4157-1-24 [1,1,0,0,0,0|1,0,0]=3 186 B10R0.144 CCC(CC)C(N)CC(=O)O 4157-1-41 [0,1,0,0,0,1|0,0,0]=2 187 B10R0.154 CC(C(N)C(=O)O)C(F)(F)F 4157-3-12 [0,2,0,0,0,0|1,0,0]=3 188 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC 4158-5-0G [0,2,0,0,0,0|0,0,0]=2 189 B10R0.30 CC[C@H](C)[C@H](N=[N+]=[N-])C(=O)O 4142-1-03 [0,2,0,0,0,0|0,0,1]=3 190 B8R1.1 C=C[C@H]1COC(=O)C1 2H25-1-60 [1,0,0,1,0,0|0,0,2]=4 191 B8R1.1 CCC1CCC(=O)O1 2H25-1-20 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-1-SC [1,0,0,1,0,0|2,0,0]=4 193 B8R1.1 NC[C@H]1CNC(=O)C1 4H48-5-S7 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.1 O=C1CC(CO)CN1 4H48-1-93 [1,0,0,1,0,0|2,0,0]=4 195 B8R1.1 O=C1NC(CO)CO1 4H56-1-0NV [1,0,0,1,0,0|2,0,0]=4 196 B8R1.1 O=C1N[C@@H](CO)CO1 4H56-1-S59 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.1 O=C1N[C@H](CO)CO1 4H56-1-R59 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.1 O=C1OCC(CBr)O1 2H28-9-00 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.1 O=C1OCC(CF)O1 2H28-3-05 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.4 CC1CC(=O)CCN1 4H56-5-0M [1,0,0,1,0,0|2,0,0]=4 201 B8R1.4 CC1CCCC(=O)C1 2217-1-0Z [1,0,0,1,0,0|1,0,0]=3 202 B8R1.4 CC1CCCC(=O)N1 4H48-1-CH [1,0,0,1,0,0|2,0,0]=4 203 B8R1.4 CC1CCCC(O)C1 2202-1-1F [1,0,0,1,0,0|1,0,1]=4 204 B8R1.4 CN1CCCC(=O)C1 4H17-1-2E [1,0,0,1,0,0|2,0,0]=4 205 B8R1.4 CN1CCCC(=O)C1 4H17-5-1E [1,0,0,1,0,0|2,0,0]=4 206 B8R1.4 C[C@@H]1CC(=O)CCN1 4H56-5-1P [1,0,0,1,0,0|2,0,0]=4 207 B8R1.4 C[C@H]1CC(=O)CCN1 4H29-3-S1 [1,0,0,1,0,0|2,0,0]=4 208 B8R1.4 NC1CCNC(=O)C1 4H22-1-10 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.18 CC1CC(=O)OC1=O 2H26-1-0B [1,0,0,1,0,0|1,0,1]=4 210 B8R1.18 C[C@@H]1OC(=O)O[C@@H]1C 2H28-1-Z0 [1,0,0,1,0,0|1,0,0]=3 211 B8R1.34 CC(=O)CC1COC1 2H17-1-01 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.34 O=C(O)CC1CCC1 2221-1-52 [1,0,0,1,0,0|0,0,0]=2 213 B8R1.34 O=C(O)CC1COC1 2H21-1-45 [1,0,0,1,0,0|1,0,0]=3 214 B8R1.43 NCC1CC1C(=O)O 4257-5-05 [1,0,0,1,0,0|1,0,0]=3 215 B8R1.51 CC1CCS(=O)(=O)C1 6H63-1-0A [1,0,0,1,0,0|1,0,1]=4 216 B8R1.62 CC1(CO)CC(=O)C1 2220-1-04 [1,0,0,1,0,0|2,0,0]=4 217 B8R1.5 CC1CCCNC1=O 4H48-1-MX [1,0,0,1,0,0|2,0,0]=4 218 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-0B [1,0,0,1,0,0|1,0,1]=4 219 B8R1.5 N[C@@H]1CCCC[C@@H]1O 4256-5-29 [1,0,0,1,0,0|1,0,1]=4 220 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-5-0C [1,0,0,1,0,0|1,0,1]=4 221 B8R1.5 N[C@H]1CCCC[C@@H]1O 4256-1-S1 [1,0,0,1,0,0|1,0,1]=4 222 B8R1.5 O=C1CCCCC1Br 2217-9-0C [1,0,0,1,0,0|2,0,0]=4 223 B8R1.5 O=C1CCCCC1Cl 2217-5-09 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.5 O=C1CCCCC1F 2217-3-09 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.7 CC(=O)C1CCCC1 2217-1-0X [1,0,0,1,0,0|2,0,0]=4 226 B8R1.7 O=C(O)C1C=CCN1 4H21-1-6F [1,0,0,1,0,0|0,0,2]=4 227 B8R1.7 O=C(O)C1CCCC1 2221-1-Y5 [1,0,0,1,0,0|1,0,0]=3 228 B8R1.7 O=C(O)C1CCCN1 4H58-1-010 [1,0,0,1,0,0|0,0,0]=2 229 B8R1.7 O=C(O)C1CCCO1 2H21-1-26 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.7 O=C(O)[C@@H]1CCNC1 4H21-1-R5 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.7 O=C(O)[C@@H]1CCOC1 2H21-1-R2 [1,0,0,1,0,0|2,0,0]=4 232 B8R1.7 [C@@H]1(C(=O)O)CCCN1 4H21-1-0P [1,0,0,1,0,0|0,0,0]=2 233 B8R1.23 CC1CC(C(=O)O)C1 2221-1-0B [1,0,0,1,0,0|1,0,0]=3 234 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 2221-1-29 [1,0,0,1,0,0|1,0,0]=3 235 B8R1.23 NC1CC(C(=O)O)C1 4257-1-29 [1,0,0,1,0,0|2,0,0]=4 236 B8R1.23 NC1CC(C(=O)O)C1 4257-5-14 [1,0,0,1,0,0|2,0,0]=4 237 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 4257-5-01 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 4257-5-07 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.23 O=C(O)C1CC(F)C1 2221-3-09 [1,0,0,1,0,0|2,0,0]=4 240 B8R1.23 O=C(O)C1CC(O)C1 2229-1-89 [1,0,0,1,0,0|2,0,0]=4 241 B8R1.54 N[C@@H](C(=O)O)C1CC1 4257-1-R8 [1,0,0,1,0,0|0,0,0]=2 242 B8R1.78 CC1(C(=O)O)CCC1 2221-1-25 [1,0,0,1,0,0|1,0,0]=3 243 B8R1.78 NC1(C(=O)O)CCC1 4257-1-06 [1,0,0,1,0,0|0,0,0]=2 244 B8R1.78 NC1(C(=O)O)CCC1 4257-5-13 [1,0,0,1,0,0|0,0,0]=2 245 B8R1.78 NC1(C(=O)O)CNC1 4H57-1-58 [1,0,0,1,0,0|1,0,0]=3 246 B8R1.78 NC1(C(=O)O)CNC1 4H57-5-13 [1,0,0,1,0,0|1,0,0]=3 247 B8R1.78 NC1(C(=O)O)COC1 4H57-1-68 [1,0,0,1,0,0|1,0,0]=3 248 B8R1.78 NC1(C(=O)O)CSC1 8H57-1-25 [1,0,0,1,0,0|1,0,0]=3 249 B8R1.78 O=C(O)C1(Br)CCC1 2221-9-10 [1,0,0,1,0,0|1,0,0]=3 250 B8R1.78 O=C(O)C1(O)CCC1 2229-1-70 [1,0,0,1,0,0|1,0,0]=3 251 B8R1.38 N\C(=N/O)C1CCC1 4247-1-13 [1,0,0,1,0,0|1,0,1]=4 252 B8R1.50 CC1CCC(=O)C1=O 2218-1-00 [1,0,0,1,0,0|1,0,1]=4 253 B8R1.77 CC1(C)CC1C(=O)O 2221-1-0X [1,0,0,1,0,0|1,0,0]=3 254 B8R1.77 CC1(C)CC1C(N)=O 4248-1-07 [1,0,0,1,0,0|2,0,0]=4 255 B8R1.77 CC1(C)C[C@@H]1C(=O)O 2221-1-S0 [1,0,0,1,0,0|1,0,0]=3 256 B10R1.475 C=C1OC(=O)OC1(C)CC 2H28-1-07 [0,0,0,1,0,1|1,0,1]=4 257 B10R1.113 CC1CCCC(C(=O)O)N1 4H21-5-44 [0,0,0,1,0,1|1,0,0]=3 258 B10R1.113 CC1COCC(C(=O)O)N1 4H21-5-43 [0,0,0,1,0,1|2,0,0]=4 259 B10R1.113 CN1CCCC(C(=O)O)C1 4H21-5-Z1 [0,0,0,1,0,1|2,0,0]=4 260 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 4H21-1-R0 [0,0,0,1,0,1|2,0,0]=4 261 B10R1.113 CN1CCC[C@H](C(=O)O)C1 4H21-1-S0 [0,0,0,1,0,1|2,0,0]=4 262 B10R1.113 NC1CCCC(C(=O)O)C1 4257-1-X1 [0,0,0,1,0,1|2,0,0]=4 263 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 4257-5-0A [0,0,0,1,0,1|2,0,0]=4 264 B10R1.113 O=C(O)C1CCCC(O)C1 2229-1-0Z [0,0,0,1,0,1|2,0,0]=4 265 B10R1.113 O=C(O)C1CS(=O)CCN1 8H65-5-02 [0,0,0,1,0,1|2,0,0]=4 266 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 4H29-5-0A [0,0,0,1,0,1|1,0,0]=3 267 B10R1.204 N[C@H](CC1CCC1)C(=O)O 4257-1-RB [0,0,0,1,0,1|0,0,0]=2 268 B10R1.23 C[C@H](C(=O)O)N1CCCC1 4H58-1-R19 [0,1,0,1,0,0|2,0,0]=4 269 B10R1.34 CCC1OC(=O)C(=O)C1C 2H29-1-0A [0,1,0,1,0,0|1,0,1]=4 270 B10R1.61 CC1CCCC=C1C(=O)O 2421-1-12 [0,1,0,1,0,0|1,0,1]=4 271 B10R1.61 CC1CCCCC1C(=O)O 2221-1-1J [0,1,0,1,0,0|1,0,0]=3 272 B10R1.61 CC1CNCCC1C(=O)O 4H58-5-6B [0,1,0,1,0,0|1,0,0]=3 273 B10R1.61 CN1CCCC[C@@H]1C(=O)O 4H56-1-JS [0,1,0,1,0,0|2,0,0]=4 274 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O 4257-1-19 [0,1,0,1,0,0|2,0,0]=4 275 B10R1.61 O=C(O)C1CCCCC1O 2229-1-1P [0,1,0,1,0,0|2,0,0]=4 276 B10R1.61 O=C(O)C1CCNCC1F 4H58-7-51 [0,1,0,1,0,0|2,0,0]=4 277 B10R1.149 COC(=O)C1CCCC1O 2229-1-0Y [0,1,0,1,0,0|2,0,0]=4 278 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N 4258-5-10 [0,1,0,1,0,0|2,0,0]=4 279 B10R1.39 CCN1CCCC1C(=O)O 4H58-1-00U [0,1,0,1,0,0|2,0,0]=4 280 B10R1.39 CCN1CCC[C@@H]1C(=O)O 4H57-1-1N [0,1,0,1,0,0|2,0,0]=4 281 B10R1.83 CC1(C)C(N)CC1C(=O)O 4257-1-00 [0,1,0,1,0,0|2,0,0]=4 282 B10R1.128 C[C@@]1(N)CCC[C@@H]1C(=O)O 4257-5-19 [0,1,0,1,0,0|1,0,0]=3 283 B10R2.179 CC12CCCC(=O)C1C2 2217-1-1S [0,0,0,2,0,0|2,0,0]=4 284 B10R2.179 CC12CCCC(=O)C1O2 2217-1-0R [0,0,0,2,0,0|2,0,0]=4 285 B10R2.355 [C@@H]12CNC(C(=O)O)[C@@H]1C2 4H57-1-V0 [0,0,0,2,0,0|0,0,0]=2 286 B10R2.638 O=C(O)C1CC12CCC2 2221-1-X6 [0,0,0,2,0,0|1,0,0]=3 287 B8R0.9 CC(=O)OCC(C)CBr 2123-9-0N [1,0,0,0,0,1|2,0,0]=4 288 B8R0.9 CCC(C)COC(=O)Cl 2116-5-28 [1,0,0,0,0,1|1,0,0]=3 289 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [1,0,0,0,0,1|2,0,0]=4