0 B7R0.5 C=CC[C@H](N)C(=O)O 4357-1-X0 [0,0,0,0,0,0|1,0,2]=3 1 B7R0.5 CCC[C@H](N)C(=O)O 4157-1-SN [0,0,0,0,0,0|1,0,0]=1 2 B7R0.5 CCOC(=O)C(=O)Cl 2116-5-06 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.5 CCOC(=O)C(C)=O 2129-1-01 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.5 COCC(Cl)C(=O)O 2121-5-X1 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.5 COC[C@H](N)C(=O)O 4157-5-S0 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.5 N[C@@H](CCO)C(=O)O 4157-1-SQ [0,0,0,0,0,0|2,0,0]=2 7 B7R0.5 O=C(Cl)C(Br)CCBr 2116-D-00 [0,0,0,0,0,0|3,0,0]=3 8 B6R0.1 CCCC(=N)NO 4141-1-X1 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.1 CCCC(C)CCl 1100-5-0A [1,0,0,0,0,0|1,0,1]=3 10 B6R0.1 CCCC(O)CO 2104-1-0A [1,0,0,0,0,0|1,0,1]=3 11 B6R0.1 CCOC(=O)C=O 2323-1-X0 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.1 COCC(O)CO 2107-1-11 [1,0,0,0,0,0|2,0,1]=4 13 B6R0.1 OCC[C@H](O)CO 2104-1-S1 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.3 CC(C#N)C(=O)O 4137-1-0Z [1,0,0,0,0,0|1,0,1]=3 15 B6R0.3 CCC(N)C(=O)O 4157-1-16 [1,0,0,0,0,0|1,0,0]=2 16 B6R0.3 CCN(C)C(=O)Cl 4148-5-18 [1,0,0,0,0,0|2,0,0]=3 17 B6R0.3 CC[C@H](O)C(=O)O 2129-1-SF [1,0,0,0,0,0|1,0,0]=2 18 B6R0.3 CNC(=O)C(=O)O 4156-1-Y4 [1,0,0,0,0,0|2,0,1]=4 19 B6R0.3 CN[C@@H](C)C(=O)O 4157-1-07 [1,0,0,0,0,0|1,0,0]=2 20 B6R0.3 CON(C)C(C)=O 4148-1-44 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.3 C\C=C(/C)C(=O)O 2321-1-17 [1,0,0,0,0,0|0,0,2]=3 22 B6R0.3 C\C=C(/C)C(=O)O 2321-1-E0 [1,0,0,0,0,0|0,0,2]=3 23 B6R0.3 C\C=C(/C)C(C)=O 2317-1-02 [1,0,0,0,0,0|1,0,2]=4 24 B6R0.3 NCC(F)C(=O)O 4157-3-02 [1,0,0,0,0,0|2,0,0]=3 25 B6R0.3 N[C@@H](CS)C(=O)O 8158-1-01 [1,0,0,0,0,0|2,0,0]=3 26 B6R0.3 O=C(O)C(=O)CBr 2129-9-X3 [1,0,0,0,0,0|2,0,1]=4 27 B6R0.3 [C@@H](N)(CC)C(=O)O 4157-1-X5 [1,0,0,0,0,0|1,0,0]=2 28 B6R0.3 [C@H](N)(CC)C(=O)O 4157-1-X4 [1,0,0,0,0,0|1,0,0]=2 29 B6R0.4 C#CCCC(=O)O 2521-1-02 [1,0,0,0,0,0|0,0,2]=3 30 B6R0.4 C=CCCC(=O)Cl 2316-5-06 [1,0,0,0,0,0|1,0,2]=4 31 B6R0.4 CC(=O)CCCCl 2117-5-52 [1,0,0,0,0,0|2,0,0]=3 32 B6R0.4 CC(=O)NCCCl 4148-5-15 [1,0,0,0,0,0|3,0,0]=4 33 B6R0.4 CCC#CC(=O)O 2521-1-12 [1,0,0,0,0,0|0,0,2]=3 34 B6R0.4 CCCCB(O)O 6160-1-06 [1,0,0,0,0,0|1,0,1]=3 35 B6R0.4 CCCCC(=O)O 2121-1-0C [1,0,0,0,0,0|0,0,0]=1 36 B6R0.4 CCCNC(N)=S 7167-1-23 [1,0,0,0,0,0|2,1,0]=4 37 B6R0.4 CCCOC(C)=O 2123-1-32 [1,0,0,0,0,0|2,0,0]=3 38 B6R0.4 CCCO[N+](=O)[O-] 4154-1-11 [1,0,0,0,0,0|2,0,1]=4 39 B6R0.4 CCOCC(=O)Cl 2116-5-0F [1,0,0,0,0,0|2,0,0]=3 40 B6R0.4 CNCCC(N)=O 4148-1-30 [1,0,0,0,0,0|2,0,0]=3 41 B6R0.4 NC(=O)NCCO 4153-1-02 [1,0,0,0,0,0|3,0,0]=4 42 B6R0.4 NCCCC(=O)O 4157-1-X2 [1,0,0,0,0,0|1,0,0]=2 43 B6R0.4 NCCNC(N)=O 4153-5-07 [1,0,0,0,0,0|3,0,0]=4 44 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [1,0,0,0,0,0|2,0,0]=3 45 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O 4157-1-0X [0,1,0,0,0,0|1,0,0]=2 46 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O 4157-1-19 [0,1,0,0,0,0|1,0,0]=2 47 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O 4158-1-X5 [0,1,0,0,0,0|2,0,0]=3 48 B8R0.3 COCC(Br)C(=O)OC 2123-9-23 [0,1,0,0,0,0|2,0,0]=3 49 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 4158-1-S9 [0,1,0,0,0,0|1,0,1]=3 50 B8R0.23 CC(=O)N[C@H](C)C(=O)O 4158-1-59 [0,1,0,0,0,0|1,0,1]=3 51 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl 2123-5-S0 [0,1,0,0,0,0|2,0,1]=4 52 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [0,1,0,0,0,0|1,0,0]=2 53 B8R0.23 O=C(O)C[C@@H](O)C(=O)O 2129-1-49 [0,1,0,0,0,0|2,0,1]=4 54 B8R1.5 CC1=CCCCC1=O 2417-1-01 [0,0,0,1,0,0|1,0,2]=4 55 B8R1.5 CC1=NCCCN1C 3H32-1-6P [0,0,0,1,0,0|3,0,0]=4 56 B8R1.5 CC1CCCCC1=O 2217-1-1E [0,0,0,1,0,0|1,0,0]=2 57 B8R1.5 CC1CCCCC1O 2102-1-X1 [0,0,0,1,0,0|1,0,1]=3 58 B8R1.5 CC1CNCCC1O 4H56-5-B5 [0,0,0,1,0,0|2,0,1]=4 59 B8R1.5 CN1CCNCC1=O 4H17-1-16 [0,0,0,1,0,0|3,0,0]=4 60 B8R1.5 CN1CCNCC1=O 4H48-5-BC [0,0,0,1,0,0|3,0,0]=4 61 B8R1.5 CN1CCOCC1=O 4H48-1-4C [0,0,0,1,0,0|3,0,0]=4 62 B8R1.5 NC1CCCCC1O 4256-1-X3 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.5 NC1CCCNC1=O 4H48-1-3C [0,0,0,1,0,0|2,0,0]=3 64 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-1-48 [0,0,0,1,0,0|2,0,1]=4 65 B8R1.5 N[C@@H]1CCCC[C@H]1O 4256-5-36 [0,0,0,1,0,0|2,0,1]=4 66 B8R1.5 N[C@H]1CCCC[C@H]1O 4256-5-49 [0,0,0,1,0,0|2,0,1]=4 67 B8R1.5 O=C1CCCCC1=O 2218-1-X7 [0,0,0,1,0,0|2,0,1]=4 68 B8R1.5 O=C1CCNCC1F 4H56-7-14 [0,0,0,1,0,0|3,0,0]=4 69 B8R1.7 NC(=O)C1CCCC1 4248-1-0J [0,0,0,1,0,0|1,0,0]=2 70 B8R1.7 NC(=O)[C@@H]1CCCN1 4H48-1-Q3 [0,0,0,1,0,0|2,0,0]=3 71 B8R1.7 NC(=O)[C@@H]1CCCN1 4H48-5-S8 [0,0,0,1,0,0|2,0,0]=3 72 B8R1.7 O=C(Cl)C1CCCC1 2216-5-X0 [0,0,0,1,0,0|1,0,0]=2 73 B8R1.7 O=C(Cl)C1CCOC1 2H16-5-X0 [0,0,0,1,0,0|2,0,0]=3 74 B8R1.7 O=C(Cl)N1CCCC1 4H16-5-0R [0,0,0,1,0,0|2,0,0]=3 75 B8R1.7 O=C(O)C1=CCCC1 2421-1-01 [0,0,0,1,0,0|0,0,2]=3 76 B8R1.7 O=C(O)C1=COCC1 2H21-1-41 [0,0,0,1,0,0|1,0,2]=4 77 B8R1.7 O=C(O)C1CC=CC1 2421-1-X0 [0,0,0,1,0,0|0,0,2]=3 78 B8R1.7 O=C(O)C1CCNC1 4H21-1-43 [0,0,0,1,0,0|1,0,0]=2 79 B8R1.7 O=C(O)C1CCOC1 2H21-1-Y0 [0,0,0,1,0,0|1,0,0]=2 80 B8R1.7 O=C(O)C1NCCS1 8H21-1-73 [0,0,0,1,0,0|2,0,0]=3 81 B8R1.7 O=C(O)[C@@H]1CCCN1 4H57-1-V2 [0,0,0,1,0,0|1,0,0]=2 82 B8R1.7 O=C(O)[C@@H]1CCCO1 2H21-1-S1 [0,0,0,1,0,0|1,0,0]=2 83 B8R1.7 O=C(O)[C@H]1CCCN1 4H57-1-X3 [0,0,0,1,0,0|1,0,0]=2 84 B8R1.7 O=C(O)[C@H]1CCCO1 2H21-1-R0 [0,0,0,1,0,0|1,0,0]=2 85 B8R1.7 O=C(O)[C@H]1CCNC1 4H21-1-S5 [0,0,0,1,0,0|1,0,0]=2 86 B8R1.7 OB(O)C1CCCC1 6260-1-X0 [0,0,0,1,0,0|1,0,1]=3 87 B8R1.23 C=C1CC(C(=O)O)C1 2321-1-X3 [0,0,0,1,0,0|0,0,2]=3 88 B8R1.23 CC(=O)N1CC(N)C1 4H48-5-71 [0,0,0,1,0,0|3,0,0]=4 89 B8R1.23 CN1CC(C(=O)O)C1 4H58-1-60 [0,0,0,1,0,0|1,0,0]=2 90 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 2229-1-Z2 [0,0,0,1,0,0|1,0,0]=2 91 B8R1.23 O=C1CC(C(=O)O)C1 P911-A-73 [0,0,0,1,0,0|1,0,1]=3 92 B8R1.78 CC1(C(=O)O)COC1 2H21-1-42 [0,0,0,1,0,0|1,0,0]=2 93 B8R0.5 CCOC(=O)CC(=O)O 2123-1-84 [0,0,0,0,0,1|2,0,1]=4 94 B5R0.1 C=CCC(C)O 2302-1-00 [2,0,0,0,0,0|0,0,2]=4 95 B5R0.1 CC#CC(=O)O 2521-1-13 [2,0,0,0,0,0|0,0,2]=4 96 B5R0.1 CC(C)CCI 1100-H-X4 [2,0,0,0,0,0|1,0,1]=4 97 B5R0.1 CC(C)CCN 3130-1-X4 [2,0,0,0,0,0|1,0,1]=4 98 B5R0.1 CC(C)CCO 2101-1-53 [2,0,0,0,0,0|1,0,1]=4 99 B5R0.1 CC(N)CCO 4156-1-4D [2,0,0,0,0,0|2,0,0]=4 100 B5R0.1 CCCB(O)O 6160-1-X5 [2,0,0,0,0,0|1,0,1]=4 101 B5R0.1 CCCC(=O)Cl 2116-5-09 [2,0,0,0,0,0|1,0,0]=3 102 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [2,0,0,0,0,0|0,0,1]=3 103 B5R0.1 CCCC(C)C 1100-1-04 [2,0,0,0,0,0|0,0,1]=3 104 B5R0.1 CCCC(C)O 2102-1-52 [2,0,0,0,0,0|0,0,0]=2 105 B5R0.1 CCNC(N)=O 4153-1-X1 [2,0,0,0,0,0|2,0,0]=4 106 B5R0.1 COCC(=O)Cl 2116-5-X4 [2,0,0,0,0,0|2,0,0]=4 107 B5R0.1 CSCC(=O)O 6166-1-05 [2,0,0,0,0,0|1,0,0]=3 108 B5R0.1 C[C@@H](N)CCO 4156-1-RB [2,0,0,0,0,0|2,0,0]=4 109 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [2,0,0,0,0,0|1,0,0]=3 110 B5R0.1 NC(=O)CCBr 4148-9-00 [2,0,0,0,0,0|2,0,0]=4 111 B5R0.1 NC(=O)CCCl 4148-5-02 [2,0,0,0,0,0|2,0,0]=4 112 B5R0.1 O=C(O)CCO 2129-1-Y8 [2,0,0,0,0,0|1,0,0]=3 113 B5R0.2 C#CCCCC 1500-1-X2 [2,0,0,0,0,0|1,0,1]=4 114 B5R0.2 C=CCCCBr 1300-9-13 [2,0,0,0,0,0|2,0,0]=4 115 B5R0.2 C=CCCCC 1300-1-48 [2,0,0,0,0,0|1,0,0]=3 116 B5R0.2 CCCCC=O 2115-1-00 [2,0,0,0,0,0|0,0,0]=2 117 B5R0.2 CCCCCC 1100-1-18 [2,0,0,0,0,0|1,0,1]=4 118 B5R0.2 CCCCCF 1100-3-65 [2,0,0,0,0,0|1,0,1]=4 119 B5R0.2 CCCCCN 3130-1-X6 [2,0,0,0,0,0|1,0,1]=4 120 B5R0.2 OCCCCF 2101-3-1V [2,0,0,0,0,0|1,0,1]=4 121 B5R0.3 CCC(C)C=O 2115-1-0C [2,0,0,0,0,0|0,0,0]=2 122 B5R0.3 CCC(C)CN 3130-1-X5 [2,0,0,0,0,0|1,0,1]=4 123 B5R0.3 CCC(N)CO 4156-1-38 [2,0,0,0,0,0|1,0,1]=4 124 B5R0.3 CC[C@@H](N)CO 4156-1-R4 [2,0,0,0,0,0|1,0,1]=4 125 B5R0.3 CC[C@H](N)CO 4156-1-W2 [2,0,0,0,0,0|1,0,1]=4 126 B5R0.5 C=C(C)C(C)C 1300-1-24 [2,0,0,0,0,0|2,0,0]=4 127 B5R0.5 CC(=O)C(=O)O 2129-1-03 [2,0,0,0,0,0|1,0,1]=4 128 B5R0.5 CC(=O)C(C)C 2117-1-13 [2,0,0,0,0,0|1,0,0]=3 129 B5R0.5 CC(=O)C(C)F 2117-3-11 [2,0,0,0,0,0|2,0,0]=4 130 B5R0.5 CC(=O)N(C)C 4148-1-08 [2,0,0,0,0,0|2,0,0]=4 131 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [2,0,0,0,0,0|2,0,0]=4 132 B5R0.5 CC(C)B(O)O 6160-1-X0 [2,0,0,0,0,0|1,0,1]=4 133 B5R0.5 CC(C)C(=N)N 3141-5-X0 [2,0,0,0,0,0|2,0,0]=4 134 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [2,0,0,0,0,0|1,0,0]=3 135 B5R0.5 CC(F)C(=O)O 2121-3-95 [2,0,0,0,0,0|1,0,0]=3 136 B5R0.5 CC(N)C(N)=O 4158-5-X5 [2,0,0,0,0,0|2,0,0]=4 137 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [2,0,0,0,0,0|1,0,0]=3 138 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [2,0,0,0,0,0|2,0,0]=4 139 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [2,0,0,0,0,0|1,0,0]=3 140 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [2,0,0,0,0,0|2,0,0]=4 141 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [2,0,0,0,0,0|1,0,0]=3 142 B5R0.5 O=C(O)C(F)Br 2121-B-03 [2,0,0,0,0,0|2,0,0]=4 143 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [2,0,0,0,0,0|2,0,0]=4 144 B5R0.5 O=C(O)C(F)F 2121-3-05 [2,0,0,0,0,0|2,0,0]=4 145 B5R0.5 O=C(O)C(F)I 2121-K-01 [2,0,0,0,0,0|2,0,0]=4 146 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [2,0,0,0,0,0|1,0,0]=3 147 B7R0.2 CCC(C)CC(C)N 3130-5-X2 [1,1,0,0,0,0|1,0,1]=4 148 B7R0.7 CCCC(C)N=C=S 7168-1-23 [1,1,0,0,0,0|0,1,1]=4 149 B7R0.13 CC(C)(CF)C(=O)O 2121-3-0B [1,1,0,0,0,0|1,0,0]=3 150 B7R0.13 CC(C)(CN)C(N)=O 4148-1-38 [1,1,0,0,0,0|2,0,0]=4 151 B7R0.13 CCC(C)(O)C(=O)O 2129-1-1P [1,1,0,0,0,0|0,0,0]=2 152 B7R0.13 CCC(F)(F)C(=O)O 2121-3-53 [1,1,0,0,0,0|1,0,0]=3 153 B7R0.13 CCC(F)(F)C(=O)[O-] 2122-3-53 [1,1,0,0,0,0|1,0,1]=4 154 B7R0.14 CCC(C)S(C)(=O)=O 6163-1-01 [1,1,0,0,0,0|1,0,1]=4 155 B7R0.15 COC(OC)C(C)=O 2117-1-16 [1,1,0,0,0,0|2,0,0]=4 156 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [1,1,0,0,0,0|1,0,0]=3 157 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [1,1,0,0,0,0|1,0,0]=3 158 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [1,1,0,0,0,0|1,0,0]=3 159 B7R0.4 C#CCCCC(=O)O 2521-1-X0 [1,1,0,0,0,0|0,0,1]=3 160 B7R0.4 CCCCCB(O)O 6160-1-07 [1,1,0,0,0,0|1,0,1]=4 161 B7R0.4 CCCCCC(=O)Cl 2116-5-11 [1,1,0,0,0,0|1,0,0]=3 162 B7R0.4 CCCCNC(N)=S 7167-1-03 [1,1,0,0,0,0|1,1,0]=4 163 B7R0.4 CCC\C=C\C(=O)O 2321-1-08 [1,1,0,0,0,0|0,0,1]=3 164 B7R0.4 CCO\C=C\C(=O)O 2321-1-X0 [1,1,0,0,0,0|0,0,2]=4 165 B7R0.4 NCCCCC(=O)O 4157-1-37 [1,1,0,0,0,0|0,0,0]=2 166 B7R0.4 NCCNCC(=O)O 4158-1-1D [1,1,0,0,0,0|1,0,0]=3 167 B7R0.4 NCCOCC(=O)O 4157-1-05 [1,1,0,0,0,0|1,0,0]=3 168 B7R0.4 O=C(O)CCCCBr 2121-9-X2 [1,1,0,0,0,0|0,0,0]=2 169 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [1,1,0,0,0,0|1,0,1]=4 170 B7R0.6 CC(C)CCC(=O)Cl 2116-5-0A [1,1,0,0,0,0|1,0,0]=3 171 B7R0.6 CC(C)COC(=O)Cl 2123-5-1N [1,1,0,0,0,0|2,0,0]=4 172 B7R0.6 CC(C)OCC(=O)O 2121-1-43 [1,1,0,0,0,0|1,0,0]=3 173 B7R0.6 CC(C)\C=C\C(=O)O 2321-1-13 [1,1,0,0,0,0|0,0,2]=4 174 B7R0.6 CN(C)CCC(=O)O 4158-5-13 [1,1,0,0,0,0|1,0,0]=3 175 B7R0.8 CCCCS(=O)(=O)Cl 6162-5-09 [1,1,0,0,0,0|1,0,1]=4 176 B9R0.27 COC(=O)C(C)C(=O)OC 2123-1-1A [0,2,0,0,0,0|1,0,1]=4 177 B9R0.8 CCCCC(N)C(=O)OC 4157-5-03 [0,2,0,0,0,0|1,0,0]=3 178 B9R0.8 COC(=O)C(Br)CCCBr 2123-9-X1 [0,2,0,0,0,0|1,0,0]=3 179 B9R0.8 COC(=O)C(N)CCSC 8166-5-03 [0,2,0,0,0,0|1,0,0]=3 180 B9R0.35 CCCC(Br)C(=O)OCC 2123-9-05 [0,2,0,0,0,0|1,0,0]=3 181 B9R0.35 CCCC(O)C(=O)OCC 2129-1-52 [0,2,0,0,0,0|1,0,0]=3 182 B9R0.35 CCOC(=O)C(Cl)OCC 2123-5-X4 [0,2,0,0,0,0|2,0,0]=4 183 B9R0.13 CCCCC(CC)C(=O)[O-] 2122-1-13 [0,2,0,0,0,0|0,0,1]=3 184 B9R0.42 COC(=O)C[C@H](N)C(=O)O 4157-5-S2 [0,2,0,0,0,0|1,0,1]=4 185 B9R0.47 NCCCC[C@H](N)C(=O)O 4157-1-S6 [0,2,0,0,0,0|1,0,0]=3 186 B9R0.47 NCCCC[C@H](N)C(=O)O 4157-1-X0 [0,2,0,0,0,0|1,0,0]=3 187 B9R0.51 CCCCC(C)(C)C(=O)O 2121-1-11 [0,2,0,0,0,0|0,0,0]=2 188 B9R0.51 CCCCC(F)(F)C(=O)O 2121-3-96 [0,2,0,0,0,0|1,0,0]=3 189 B9R0.51 CCCCC(F)(F)C(=O)[O-] 2122-3-56 [0,2,0,0,0,0|1,0,1]=4 190 B9R0.11 CC(C)(CC(=O)O)C(=O)O 2121-1-16 [0,2,0,0,0,0|1,0,1]=4 191 B9R0.15 CCCC(CCC)C(=O)Cl 2116-5-22 [0,2,0,0,0,0|1,0,0]=3 192 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O 8158-1-X1 [0,2,0,0,0,0|1,0,1]=4 193 B9R0.57 CC(CC(F)(F)F)C(=O)O 2121-3-41 [0,2,0,0,0,0|1,0,0]=3 194 B9R0.57 NC(CC(F)(F)F)C(=O)O 4157-3-03 [0,2,0,0,0,0|2,0,0]=4 195 B9R0.57 O=C(O)C(Br)CC(F)(F)F 2121-B-04 [0,2,0,0,0,0|2,0,0]=4 196 B7R1.1 BrCC1CCCC1 1200-9-X1 [1,0,0,1,0,0|1,0,1]=4 197 B7R1.1 CNC1CCCC1 3231-1-03 [1,0,0,1,0,0|2,0,0]=4 198 B7R1.1 COC1CCCC1 2207-1-01 [1,0,0,1,0,0|2,0,0]=4 199 B7R1.1 ICC1CCCC1 1200-H-X0 [1,0,0,1,0,0|1,0,1]=4 200 B7R1.1 NNC1CCCC1 P911-A-67 [1,0,0,1,0,0|2,0,0]=4 201 B7R1.1 O=CC1CCOC1 2H15-1-1K [1,0,0,1,0,0|1,0,0]=3 202 B7R1.1 OCC1CCCC1 2301-1-X3 [1,0,0,1,0,0|0,0,1]=3 203 B7R1.1 OCC1CCCN1 4H01-1-95 [1,0,0,1,0,0|1,0,1]=4 204 B7R1.1 OCC1CCNC1 4H56-5-0C [1,0,0,1,0,0|1,0,1]=4 205 B7R1.1 OCC1CCOC1 2H10-1-34 [1,0,0,1,0,0|1,0,1]=4 206 B7R1.1 OC[C@@H]1CCCN1 4H01-1-M2 [1,0,0,1,0,0|1,0,1]=4 207 B7R1.1 OC[C@@H]1CCCO1 2H01-1-04 [1,0,0,1,0,0|1,0,1]=4 208 B7R1.1 OC[C@@H]1CCNC1 4H56-1-R0 [1,0,0,1,0,0|1,0,1]=4 209 B7R1.1 [C@H]1(CO)CCCN1 4H56-1-L1 [1,0,0,1,0,0|1,0,1]=4 210 B7R1.3 CC1=CCCCC1 1400-1-04 [1,0,0,1,0,0|1,0,1]=4 211 B7R1.3 CC1CCCCC1 1200-1-19 [1,0,0,1,0,0|1,0,1]=4 212 B7R1.3 CC1CCCCN1 3H31-1-00 [1,0,0,1,0,0|2,0,0]=4 213 B7R1.3 CC1COCCN1 4H56-1-98 [1,0,0,1,0,0|1,0,1]=4 214 B7R1.3 C[C@@H]1COCCN1 4H56-1-9Y [1,0,0,1,0,0|1,0,1]=4 215 B7R1.3 C[C@@H]1COCCN1 4H56-5-CX [1,0,0,1,0,0|1,0,1]=4 216 B7R1.3 C[C@H]1CCCCN1 3H31-1-S5 [1,0,0,1,0,0|2,0,0]=4 217 B7R1.3 OC1CCCOC1 2H10-1-41 [1,0,0,1,0,0|1,0,1]=4 218 B7R1.4 NC1CCSC1=O 8H70-5-Z1 [1,0,0,1,0,0|2,0,0]=4 219 B7R1.4 NN1CCCC1=O 4H48-5-BN [1,0,0,1,0,0|2,0,0]=4 220 B7R1.4 O=C1CCCC1Cl 2217-5-04 [1,0,0,1,0,0|1,0,0]=3 221 B7R1.4 O=C1NCCC1O 4H20-1-X1 [1,0,0,1,0,0|2,0,0]=4 222 B7R1.4 O=C1OCCC1Br 2125-9-01 [1,0,0,1,0,0|2,0,0]=4 223 B7R1.25 CC1(C=O)COC1 2H17-1-81 [1,0,0,1,0,0|1,0,0]=3 224 B7R1.25 CC1(CN)CCC1 3230-5-02 [1,0,0,1,0,0|1,0,1]=4 225 B7R1.25 CC1(CO)COC1 2H10-1-54 [1,0,0,1,0,0|1,0,1]=4 226 B7R1.12 O=C(O)C1CC1F 2221-3-0B [1,0,0,1,0,0|1,0,0]=3 227 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F 2221-3-25 [1,0,0,1,0,0|1,0,0]=3 228 B7R1.18 N=C(N)C1CCC1 3241-5-X0 [1,0,0,1,0,0|2,0,0]=4 229 B7R1.18 O=C(Cl)C1CCC1 2216-5-03 [1,0,0,1,0,0|1,0,0]=3 230 B7R1.18 O=C(O)C1CNC1 P911-A-52 [1,0,0,1,0,0|1,0,0]=3 231 B7R1.18 O=C(O)[C@H]1CCN1 4H57-1-03 [1,0,0,1,0,0|1,0,0]=3 232 B7R1.19 CC1(C(=O)O)CC1 2221-1-X3 [1,0,0,1,0,0|0,0,0]=2 233 B7R1.19 NC1(C(=O)O)CC1 4257-1-X0 [1,0,0,1,0,0|1,0,0]=3 234 B7R1.19 O=C(O)C1(F)CC1 2221-3-18 [1,0,0,1,0,0|1,0,0]=3 235 B7R1.19 O=C(O)C1(O)CC1 2229-1-X2 [1,0,0,1,0,0|1,0,0]=3 236 B7R1.14 CC1(O)CCCC1 2201-1-01 [1,0,0,1,0,0|1,0,1]=4 237 B7R1.14 O=S1(=O)CCCC1 6H70-1-05 [1,0,0,1,0,0|1,0,1]=4 238 B7R1.14 O=S1(=O)CCCC1 6H70-1-05B [1,0,0,1,0,0|1,0,1]=4 239 B7R1.20 O=C(O)CC1CC1 2221-1-X4 [1,0,0,1,0,0|0,0,0]=2 240 B9R1.13 O=C(Cl)OC1CCCC1 2223-5-X0 [0,0,0,1,0,1|1,0,0]=3 241 B9R1.13 O=C(O)CC1CCCC1 2221-1-Y3 [0,0,0,1,0,1|0,0,0]=2 242 B9R1.13 O=C(O)CN1CCCC1 4H21-5-Z6 [0,0,0,1,0,1|1,0,0]=3 243 B9R1.41 CN1CCC[C@H]1C(=O)O 4H58-1-SW [0,0,0,1,0,1|1,0,0]=3 244 B9R1.3 CN1CCCN(C)C1=O 4H17-1-73 [0,1,0,1,0,0|2,0,0]=4 245 B9R1.3 CN1CCCN(C)C1=O 4H17-3-0K [0,1,0,1,0,0|2,0,0]=4 246 B9R1.110 NC(C(=O)O)C1CCC1 4257-1-07 [0,1,0,1,0,0|1,0,0]=3 247 B9R1.11 COC(=O)C1=CCCC1 2423-1-04 [0,1,0,1,0,0|0,0,2]=4 248 B9R1.11 COC(=O)C1CC=CC1 2423-1-X0 [0,1,0,1,0,0|0,0,2]=4 249 B9R1.11 COC(=O)C1CCCC1 2223-1-48 [0,1,0,1,0,0|0,0,0]=2 250 B9R1.11 COC(=O)C1CCCN1 4H23-5-03 [0,1,0,1,0,0|1,0,0]=3 251 B9R1.11 COC(=O)C1CCNC1 4H58-5-4A [0,1,0,1,0,0|1,0,0]=3 252 B9R1.11 COC(=O)C1NCCS1 8H23-5-05 [0,1,0,1,0,0|2,0,0]=4 253 B9R1.11 COC(=O)[C@@H]1CCCN1 4H58-5-X8 [0,1,0,1,0,0|1,0,0]=3 254 B9R1.11 COC(=O)[C@H]1CCCN1 4H56-5-R5 [0,1,0,1,0,0|1,0,0]=3 255 B9R1.11 NCC(=O)N1CCCC1 4H58-5-22 [0,1,0,1,0,0|2,0,0]=4 256 B9R1.11 O=C(CCl)N1CCCC1 4H48-5-35 [0,1,0,1,0,0|2,0,0]=4 257 B9R1.15 COC1CCCCC1=O 2217-1-1F [0,1,0,1,0,0|1,0,0]=3 258 B9R1.15 N#CC1CCCCC1=O 4237-1-X1 [0,1,0,1,0,0|1,0,1]=4 259 B9R1.82 COC(=O)C1CC(=O)C1 2229-1-02 [0,1,0,1,0,0|1,0,1]=4 260 B9R1.82 COC(=O)C1CC(Cl)C1 2223-5-09 [0,1,0,1,0,0|1,0,0]=3 261 B9R1.82 COC(=O)C1CC(O)C1 2229-1-28 [0,1,0,1,0,0|1,0,0]=3 262 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 2229-1-35 [0,1,0,1,0,0|1,0,0]=3 263 B9R1.6 CC(=O)C1CCOCC1 2H17-1-Y6 [0,1,0,1,0,0|1,0,0]=3 264 B9R1.6 CC(=O)N1CCNCC1 4H48-1-V8 [0,1,0,1,0,0|2,0,0]=4 265 B9R1.6 CC(O)C1CCCCC1 2202-1-1H [0,1,0,1,0,0|1,0,1]=4 266 B9R1.6 NC(=O)C1CCNCC1 4H48-1-D8 [0,1,0,1,0,0|1,0,0]=3 267 B9R1.6 NC(=O)C1CCOCC1 4H48-1-H1 [0,1,0,1,0,0|1,0,0]=3 268 B9R1.6 NC(=O)N1CCNCC1 4H53-5-03 [0,1,0,1,0,0|2,0,0]=4 269 B9R1.6 O=C(Cl)C1CCCCC1 2216-5-06 [0,1,0,1,0,0|1,0,0]=3 270 B9R1.6 O=C(Cl)C1CCOCC1 P311-A-24 [0,1,0,1,0,0|1,0,0]=3 271 B9R1.6 O=C(O)C1=CCCCC1 2421-1-0A [0,1,0,1,0,0|0,0,1]=3 272 B9R1.6 O=C(O)C1=COCCC1 2H21-1-36 [0,1,0,1,0,0|0,0,2]=4 273 B9R1.6 O=C(O)C1CC=CCC1 2421-1-00 [0,1,0,1,0,0|0,0,1]=3 274 B9R1.6 O=C(O)C1CCCCN1 4H57-1-W5 [0,1,0,1,0,0|0,0,0]=2 275 B9R1.6 O=C(O)C1CCCCN1 4H58-5-BW [0,1,0,1,0,0|0,0,0]=2 276 B9R1.6 O=C(O)C1CCCOC1 2H21-1-12 [0,1,0,1,0,0|0,0,0]=2 277 B9R1.6 O=C(O)C1CCNCC1 4257-1-14 [0,1,0,1,0,0|0,0,0]=2 278 B9R1.6 O=C(O)C1CCOCC1 P911-A-47 [0,1,0,1,0,0|0,0,0]=2 279 B9R1.6 O=C(O)C1CNCCO1 4H58-5-8Y [0,1,0,1,0,0|1,0,0]=3 280 B9R1.6 O=C(O)C1CSCCN1 8H21-1-Y5 [0,1,0,1,0,0|1,0,0]=3 281 B9R1.6 O=C(O)[C@@H]1CC=CCC1 2421-1-S0 [0,1,0,1,0,0|0,0,1]=3 282 B9R1.6 O=C(O)[C@@H]1CCCNC1 4H21-1-XV [0,1,0,1,0,0|0,0,0]=2 283 B9R1.6 O=C(O)[C@@H]1CNCCN1 4H21-1-S2 [0,1,0,1,0,0|1,0,0]=3 284 B9R1.6 O=C(O)[C@@H]1CNCCN1 G311-A-13 [0,1,0,1,0,0|1,0,0]=3 285 B9R1.6 O=C(O)[C@H]1CC=CCC1 2421-1-R0 [0,1,0,1,0,0|0,0,1]=3 286 B9R1.6 O=C(O)[C@H]1CCCCN1 4H58-1-RE [0,1,0,1,0,0|0,0,0]=2 287 B9R1.6 O=C(O)[C@H]1CNCCN1 4H21-5-Z4 [0,1,0,1,0,0|1,0,0]=3 288 B9R1.6 O=C(O)[C@H]1CNCCO1 4H58-5-RA [0,1,0,1,0,0|1,0,0]=3 289 B9R1.6 O=C(O)[C@H]1COCCN1 4H58-5-R9 [0,1,0,1,0,0|1,0,0]=3 290 B9R1.6 OB(O)C1CCCCC1 6260-1-01 [0,1,0,1,0,0|1,0,1]=4 291 B9R1.35 CN1CCC(C(=O)O)C1 4H58-1-E4 [0,1,0,1,0,0|0,0,0]=2 292 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 4248-7-01 [0,1,0,1,0,0|2,0,0]=4 293 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 4H57-1-31 [0,1,0,1,0,0|1,0,0]=3 294 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 4H57-1-S2 [0,1,0,1,0,0|1,0,0]=3 295 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 4H57-1-W9 [0,1,0,1,0,0|1,0,0]=3 296 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 4H58-5-BT [0,1,0,1,0,0|1,0,0]=3 297 B9R1.35 O=C1CC(C(=O)O)CN1 4H58-1-24 [0,1,0,1,0,0|1,0,1]=4 298 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 4H56-1-5D [0,1,0,1,0,0|1,0,1]=4 299 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 2H25-1-S1 [0,1,0,1,0,0|1,0,1]=4 300 B9R1.35 O=C1CC[C@H](C(=O)O)N1 4H57-1-R1 [0,1,0,1,0,0|1,0,1]=4 301 B9R1.40 CC1(C)NCCNC1=O 4H48-1-AJ [0,1,0,1,0,0|2,0,0]=4 302 B9R1.163 C[C@@]1(C(=O)O)CCCN1 4H57-5-S3 [0,1,0,1,0,0|0,0,0]=2 303 B9R1.163 C[C@]1(C(=O)O)CCCN1 4H57-5-R3 [0,1,0,1,0,0|0,0,0]=2 304 B9R1.19 O=S(=O)(Cl)C1CCCC1 P311-A-17 [0,1,0,1,0,0|1,0,1]=4 305 B9R1.164 CC1(C)CC(C(=O)O)C1 2221-1-27 [0,1,0,1,0,0|0,0,0]=2 306 B9R1.164 O=C(O)C1CC(F)(F)C1 2221-3-04 [0,1,0,1,0,0|1,0,0]=3 307 B9R2.25 O=C1OC(=O)C2CC12 2H26-1-X0 [0,0,0,2,0,0|1,0,1]=4