0 B7R0.6 CC(=O)CCC(C)=O 2118-1-25 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.6 CC(=O)OCC(=O)Cl 2129-5-X0 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.6 CC(=O)OCC(F)F 2123-3-09 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.6 CC(=O)\C=C\C(C)C 2317-1-04 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.6 CC(C)=NNC(N)=O 4153-1-0A [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 CC(C)CCC(=O)Cl 2116-5-0A [0,0,0,0,0,0|1,0,0]=1 6 B7R0.6 CC(C)COC(=O)Cl 2123-5-1N [0,0,0,0,0,0|2,0,0]=2 7 B7R0.6 CC(C)OCC(=O)O 2121-1-43 [0,0,0,0,0,0|1,0,0]=1 8 B7R0.6 CC(C)\C=C\C(=O)O 2321-1-13 [0,0,0,0,0,0|0,0,2]=2 9 B7R0.6 CN(C)CCC(=O)O 4158-5-13 [0,0,0,0,0,0|1,0,0]=1 10 B7R0.6 CN(C)CCN(C)C 3132-1-06 [0,0,0,0,0,0|4,0,0]=4 11 B7R0.6 N=C(N)NCC(=O)O 4156-1-60 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.6 O=C(Cl)OCC(F)F 2123-7-00 [0,0,0,0,0,0|4,0,0]=4 13 B6R0.4 C#CCCC(=O)O 2521-1-02 [1,0,0,0,0,0|0,0,2]=3 14 B6R0.4 C=CCCC(=O)Cl 2316-5-06 [1,0,0,0,0,0|1,0,2]=4 15 B6R0.4 C=CCC[C@@H](C)O 2302-1-R1 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.4 CC(=O)CCCCl 2117-5-52 [1,0,0,0,0,0|2,0,0]=3 17 B6R0.4 CC(=O)NCCCl 4148-5-15 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.4 CC(C)CN=C=S 7168-1-X1 [1,0,0,0,0,0|1,1,1]=4 19 B6R0.4 CC(C)OCCO 2107-1-0H [1,0,0,0,0,0|1,0,1]=3 20 B6R0.4 CCC#CC(=O)O 2521-1-12 [1,0,0,0,0,0|0,0,2]=3 21 B6R0.4 CCCCB(O)O 6160-1-06 [1,0,0,0,0,0|1,0,1]=3 22 B6R0.4 CCCCC(=O)O 2121-1-0C [1,0,0,0,0,0|0,0,0]=1 23 B6R0.4 CCCNC(N)=S 7167-1-23 [1,0,0,0,0,0|2,1,0]=4 24 B6R0.4 CCCOC(C)=O 2123-1-32 [1,0,0,0,0,0|2,0,0]=3 25 B6R0.4 CCCO[N+](=O)[O-] 4154-1-11 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.4 CCOCC(=O)Cl 2116-5-0F [1,0,0,0,0,0|2,0,0]=3 27 B6R0.4 CN(C)CCCBr 3132-9-03 [1,0,0,0,0,0|2,0,1]=4 28 B6R0.4 CN(C)CCCCl 3132-5-X0 [1,0,0,0,0,0|2,0,1]=4 29 B6R0.4 CN(C)CCCO 4156-1-40 [1,0,0,0,0,0|1,0,1]=3 30 B6R0.4 CNCCC(N)=O 4148-1-30 [1,0,0,0,0,0|2,0,0]=3 31 B6R0.4 NC(=O)NCCO 4153-1-02 [1,0,0,0,0,0|3,0,0]=4 32 B6R0.4 NCCCC(=O)O 4157-1-X2 [1,0,0,0,0,0|1,0,0]=2 33 B6R0.4 NCCNC(N)=O 4153-5-07 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.4 O=C(Cl)CCCCl 2116-5-X5 [1,0,0,0,0,0|2,0,0]=3 35 B8R0.9 CC(=O)OCC(O)CCl 2129-5-08 [0,1,0,0,0,0|3,0,0]=4 36 B8R0.9 COC(=O)OCC(F)F 2128-3-03 [0,1,0,0,0,0|3,0,0]=4 37 B8R0.9 COC(=O)\C=C\C(C)C 2323-1-X3 [0,1,0,0,0,0|0,0,2]=3 38 B8R0.9 NCC(=O)CCC(=O)O 4157-5-07 [0,1,0,0,0,0|1,0,1]=3 39 B8R0.9 NCC(=O)NCC(=O)O 4157-1-X3 [0,1,0,0,0,0|2,0,1]=4 40 B8R0.23 CC(=O)N[C@@H](C)C(=O)O 4158-1-S9 [0,1,0,0,0,0|2,0,1]=4 41 B8R0.23 CC(=O)N[C@H](C)C(=O)O 4158-1-59 [0,1,0,0,0,0|2,0,1]=4 42 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [0,1,0,0,0,0|0,0,0]=1 43 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 44 B8R0.29 CC(=O)CCC(F)(F)F 2117-3-26 [0,1,0,0,0,0|3,0,0]=4 45 B8R0.29 CC(C)(C)OCC(=O)O 2121-1-X5 [0,1,0,0,0,0|1,0,0]=2 46 B8R0.29 O=C(O)CCC(F)(F)F 2121-3-44 [0,1,0,0,0,0|2,0,0]=3 47 B8R1.3 CC1=NNC(=O)CC1 4H56-1-XC [0,0,0,1,0,0|2,0,1]=4 48 B8R1.3 CN1CCC(=O)CC1 4H56-1-7L [0,0,0,1,0,0|2,0,0]=3 49 B8R1.3 CN1CCC(O)CC1 4H56-1-XM [0,0,0,1,0,0|2,0,1]=4 50 B8R1.3 C[C@H]1CC[C@H](N)CC1 3230-1-X3 [0,0,0,1,0,0|2,0,1]=4 51 B8R1.3 N[C@H]1CC[C@@H](O)CC1 4256-5-15 [0,0,0,1,0,0|2,0,1]=4 52 B8R1.3 N[C@H]1CC[C@H](O)CC1 4256-1-X6 [0,0,0,1,0,0|2,0,1]=4 53 B8R1.3 N[C@H]1CC[C@H](O)CC1 4H56-5-L1 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.3 O=C1COC(=O)CO1 2H08-1-X0 [0,0,0,1,0,0|2,0,1]=4 55 B8R1.3 OC1CCC(O)CC1 2204-1-X0 [0,0,0,1,0,0|2,0,1]=4 56 B8R1.23 C=C1CC(C(=O)O)C1 2321-1-X3 [0,0,0,1,0,0|0,0,2]=3 57 B8R1.23 CC(=O)N1CC(N)C1 4H48-5-71 [0,0,0,1,0,0|3,0,0]=4 58 B8R1.23 CN1CC(C(=O)O)C1 4H58-1-60 [0,0,0,1,0,0|1,0,0]=2 59 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 60 B8R1.23 O=C1CC(C(=O)O)C1 P911-A-73 [0,0,0,1,0,0|1,0,1]=3 61 B8R1.51 CC1(C)COC(=S)N1 8H67-1-X7 [0,0,0,1,0,0|2,1,0]=4 62 B8R1.51 NC1CCS(=O)(=O)C1 8H70-5-X9 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.77 NC(=O)C1CC1(Cl)Cl 4248-5-X0 [0,0,0,1,0,0|3,0,0]=4 64 B8R1.77 O=C(O)C1CC1(F)Cl 2221-7-X0 [0,0,0,1,0,0|2,0,0]=3 65 B8R1.77 O=C(O)C1CC1(F)F 2221-3-X2 [0,0,0,1,0,0|2,0,0]=3 66 B8R1.77 [C@H]1(C(N)=O)CC1(C)C 4248-1-S1 [0,0,0,1,0,0|1,0,0]=2 67 B6R0.2 CC(=O)CC(C)=O 2118-1-01 [0,0,0,0,1,0|2,0,1]=4 68 B6R0.2 CC(=O)CC(C)C 2118-1-02 [0,0,0,0,1,0|1,0,0]=2 69 B6R0.2 CC(C)=CC(=O)O 2321-1-X4 [0,0,0,0,1,0|0,0,2]=3 70 B6R0.2 CC(C)CB(O)O 6160-1-X3 [0,0,0,0,1,0|1,0,1]=3 71 B6R0.2 CC(C)CC(N)=O 4148-1-Y7 [0,0,0,0,1,0|1,0,0]=2 72 B6R0.2 CC(C)NC(N)=S 7167-1-18 [0,0,0,0,1,0|2,1,0]=4 73 B6R0.2 CC(Cl)OC(=O)Cl 2116-5-X1 [0,0,0,0,1,0|3,0,0]=4 74 B6R0.2 CC(O)CC(=O)[O-] 2129-1-35 [0,0,0,0,1,0|1,0,1]=3 75 B6R0.2 CC(O)CC(C)O 2104-1-X3 [0,0,0,0,1,0|2,0,1]=4 76 B6R0.2 CN(C)CC(=O)O 4158-1-40 [0,0,0,0,1,0|1,0,0]=2 77 B6R0.2 CN(C)CC(N)=S 7167-5-01 [0,0,0,0,1,0|2,1,0]=4 78 B6R0.2 C[C@@H](O)C[C@@H](C)O 2104-1-28 [0,0,0,0,1,0|2,0,1]=4 79 B6R0.2 O=C(O)CC(=O)O 2121-1-05 [0,0,0,0,1,0|2,0,1]=4 80 B8R0.28 N=C(N)NCCC(=O)O 4158-1-49 [0,0,0,0,0,1|2,0,1]=4 81 B8R0.28 O=C(O)CSCC(=O)O 6166-1-X2 [0,0,0,0,0,1|2,0,1]=4 82 B5R0.1 C=CCC(C)O 2302-1-00 [2,0,0,0,0,0|1,0,1]=4 83 B5R0.1 CC#CC(=O)O 2521-1-13 [2,0,0,0,0,0|0,0,2]=4 84 B5R0.1 CC(C)CCI 1100-H-X4 [2,0,0,0,0,0|1,0,0]=3 85 B5R0.1 CC(C)CCN 3130-1-X4 [2,0,0,0,0,0|1,0,0]=3 86 B5R0.1 CC(C)CCO 2101-1-53 [2,0,0,0,0,0|0,0,0]=2 87 B5R0.1 CC(C)CNN 3139-5-X0 [2,0,0,0,0,0|2,0,0]=4 88 B5R0.1 CC(N)CCO 4156-1-4D [2,0,0,0,0,0|1,0,0]=3 89 B5R0.1 CCCB(O)O 6160-1-X5 [2,0,0,0,0,0|1,0,1]=4 90 B5R0.1 CCCC(=O)Cl 2116-5-09 [2,0,0,0,0,0|1,0,0]=3 91 B5R0.1 CCCC(=O)[O-] 2122-1-X1 [2,0,0,0,0,0|0,0,1]=3 92 B5R0.1 CCCC(C)C 1100-1-04 [2,0,0,0,0,0|0,0,1]=3 93 B5R0.1 CCCC(C)O 2102-1-52 [2,0,0,0,0,0|1,0,1]=4 94 B5R0.1 CCNC(N)=O 4153-1-X1 [2,0,0,0,0,0|2,0,0]=4 95 B5R0.1 CN(C)CCN 3132-1-X2 [2,0,0,0,0,0|2,0,0]=4 96 B5R0.1 COCC(=O)Cl 2116-5-X4 [2,0,0,0,0,0|2,0,0]=4 97 B5R0.1 CSCC(=O)O 6166-1-05 [2,0,0,0,0,0|1,0,0]=3 98 B5R0.1 C[C@@H](N)CCO 4156-1-RB [2,0,0,0,0,0|1,0,0]=3 99 B5R0.1 C[C@@H](O)CCO 2101-1-X0 [2,0,0,0,0,0|1,0,0]=3 100 B5R0.1 NC(=O)CCBr 4148-9-00 [2,0,0,0,0,0|2,0,0]=4 101 B5R0.1 NC(=O)CCCl 4148-5-02 [2,0,0,0,0,0|2,0,0]=4 102 B5R0.1 O=C(O)CCO 2129-1-Y8 [2,0,0,0,0,0|1,0,0]=3 103 B5R0.2 C#CCCCC 1500-1-X2 [2,0,0,0,0,0|1,0,1]=4 104 B5R0.2 C=CCCCBr 1300-9-13 [2,0,0,0,0,0|2,0,0]=4 105 B5R0.2 C=CCCCC 1300-1-48 [2,0,0,0,0,0|1,0,0]=3 106 B5R0.2 CCCCC=O 2115-1-00 [2,0,0,0,0,0|0,0,0]=2 107 B5R0.2 CCCCCC 1100-1-18 [2,0,0,0,0,0|1,0,1]=4 108 B5R0.2 CCCCCF 1100-3-65 [2,0,0,0,0,0|1,0,1]=4 109 B5R0.2 CCCCCN 3130-1-X6 [2,0,0,0,0,0|1,0,1]=4 110 B5R0.2 OCCCCF 2101-3-1V [2,0,0,0,0,0|1,0,1]=4 111 B7R0.2 CN(C)CC(O)CO 4156-1-0H [1,1,0,0,0,0|1,0,1]=4 112 B7R0.3 C=CCCC(=O)OC 2323-1-0J [1,1,0,0,0,0|0,0,2]=4 113 B7R0.3 CC\C=C\C(=O)OC 2323-1-17 [1,1,0,0,0,0|0,0,2]=4 114 B7R0.3 CC\C=C\C(=O)OC 2323-1-E2 [1,1,0,0,0,0|0,0,2]=4 115 B7R0.3 CNCCC(=O)NC 4148-1-31 [1,1,0,0,0,0|2,0,0]=4 116 B7R0.3 COC(=O)CCCBr 2123-9-0H [1,1,0,0,0,0|1,0,0]=3 117 B7R0.3 COC(=O)CCCN 4158-5-18 [1,1,0,0,0,0|1,0,0]=3 118 B7R0.4 C#CCCCC(=O)O 2521-1-X0 [1,1,0,0,0,0|0,0,1]=3 119 B7R0.4 CC(C)CCN=C=S 7168-1-13 [1,1,0,0,0,0|0,1,1]=4 120 B7R0.4 CCCCCB(O)O 6160-1-07 [1,1,0,0,0,0|1,0,1]=4 121 B7R0.4 CCCCCC(=O)Cl 2116-5-11 [1,1,0,0,0,0|1,0,0]=3 122 B7R0.4 CCCCNC(N)=S 7167-1-03 [1,1,0,0,0,0|1,1,0]=4 123 B7R0.4 CCC\C=C\C(=O)O 2321-1-08 [1,1,0,0,0,0|0,0,1]=3 124 B7R0.4 CCO\C=C\C(=O)O 2321-1-X0 [1,1,0,0,0,0|0,0,2]=4 125 B7R0.4 NCCCCC(=O)O 4157-1-37 [1,1,0,0,0,0|0,0,0]=2 126 B7R0.4 NCCNCC(=O)O 4158-1-1D [1,1,0,0,0,0|1,0,0]=3 127 B7R0.4 NCCOCC(=O)O 4157-1-05 [1,1,0,0,0,0|1,0,0]=3 128 B7R0.4 O=C(O)CCCCBr 2121-9-X2 [1,1,0,0,0,0|0,0,0]=2 129 B7R0.5 C=CC[C@H](N)C(=O)O 4357-1-X0 [1,1,0,0,0,0|0,0,2]=4 130 B7R0.5 CCC[C@H](N)C(=O)O 4157-1-SN [1,1,0,0,0,0|0,0,0]=2 131 B7R0.5 COCC(Cl)C(=O)O 2121-5-X1 [1,1,0,0,0,0|1,0,0]=3 132 B7R0.5 COC[C@H](N)C(=O)O 4157-5-S0 [1,1,0,0,0,0|1,0,0]=3 133 B7R0.5 N[C@@H](CCO)C(=O)O 4157-1-SQ [1,1,0,0,0,0|1,0,0]=3 134 B7R0.5 O=C(Cl)C(Br)CCBr 2116-D-00 [1,1,0,0,0,0|2,0,0]=4 135 B7R0.8 CCCCS(=O)(=O)Cl 6162-5-09 [1,1,0,0,0,0|1,0,1]=4 136 B7R0.9 CC(C)(C)CC(=O)O 2121-1-X4 [0,1,0,0,1,0|0,0,0]=2 137 B7R0.9 CC(C)(C)OC(N)=O 4156-1-65 [0,1,0,0,1,0|2,0,0]=4 138 B7R0.9 CC(C)(N)CC(=O)O P911-A-54 [0,1,0,0,1,0|0,0,0]=2 139 B7R0.9 CS(=O)(=O)CC(=O)O 6165-1-01 [0,1,0,0,1,0|2,0,0]=4 140 B7R0.9 O=C(O)CC(F)(F)F 2121-3-11 [0,1,0,0,1,0|2,0,0]=4 141 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [0,1,0,0,1,0|0,0,0]=2 142 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [0,1,0,0,1,0|1,0,0]=3 143 B7R0.16 CN(C)C(=O)C(=O)O 4156-1-Z5 [0,1,0,0,1,0|1,0,1]=4 144 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [0,1,0,0,1,0|1,0,0]=3 145 B9R0.1 COC(=O)CCCC(C)=O 2129-1-1R [0,1,0,0,0,1|1,0,1]=4 146 B9R0.1 COC(=O)\C=C\CC(C)C 2323-1-X4 [0,1,0,0,0,1|0,0,1]=3 147 B9R0.7 CC(=O)N(C)CCC(=O)O 4158-1-X3 [0,1,0,0,0,1|1,0,1]=4 148 B9R0.56 O=C(O)CCCC(F)(F)F 2121-3-55 [0,1,0,0,0,1|2,0,0]=4 149 B9R0.21 COC(=O)CCC(F)(F)F 2123-3-70 [0,2,0,0,0,0|2,0,0]=4 150 B9R0.23 COC(=O)[C@@H](N)CC(C)C 4158-5-SG [0,2,0,0,0,0|0,0,0]=2 151 B9R0.23 COC(=O)[C@H](N)CC(C)C 4158-5-RG [0,2,0,0,0,0|0,0,0]=2 152 B9R0.42 COC(=O)CC(=O)C(C)C 2129-1-68 [0,2,0,0,0,0|0,0,1]=3 153 B9R0.42 COC(=O)C[C@H](N)C(=O)O 4157-5-S2 [0,2,0,0,0,0|1,0,1]=4 154 B9R0.48 CCOC(=O)CCC(C)=O 2129-1-17 [0,2,0,0,0,0|1,0,1]=4 155 B9R0.48 CCOC(=O)CNC(C)C 4158-5-09 [0,2,0,0,0,0|1,0,0]=3 156 B9R0.10 CC(CC(=O)O)C(F)(F)F 2121-3-12 [0,2,0,0,0,0|2,0,0]=4 157 B9R0.10 NC(CC(=O)O)C(F)(F)F 4157-3-04 [0,2,0,0,0,0|2,0,0]=4 158 B9R0.10 NC(CC(=O)O)C(F)(F)F 4157-7-01 [0,2,0,0,0,0|2,0,0]=4 159 B9R0.10 N[C@H](CC(=O)O)C(F)(F)F 4157-7-R1 [0,2,0,0,0,0|2,0,0]=4 160 B9R0.10 O=C(O)CC(O)C(F)(F)F 2129-3-34 [0,2,0,0,0,0|2,0,0]=4 161 B9R0.57 CC(CC(F)(F)F)C(=O)O 2121-3-41 [0,2,0,0,0,0|2,0,0]=4 162 B9R0.57 NC(CC(F)(F)F)C(=O)O 4157-3-03 [0,2,0,0,0,0|2,0,0]=4 163 B9R0.57 O=C(O)C(Br)CC(F)(F)F 2121-B-04 [0,2,0,0,0,0|2,0,0]=4 164 B7R1.2 CC1=CC(=O)CC1 2417-1-07 [1,0,0,1,0,0|0,0,2]=4 165 B7R1.2 CN1CCC(O)C1 4H56-1-Z4 [1,0,0,1,0,0|1,0,1]=4 166 B7R1.2 CN1CC[C@@H](O)C1 4H56-1-R1 [1,0,0,1,0,0|1,0,1]=4 167 B7R1.2 CN1CC[C@H](O)C1 4H56-1-S4 [1,0,0,1,0,0|1,0,1]=4 168 B7R1.2 O=C1CCC(=O)C1 P911-A-79 [1,0,0,1,0,0|1,0,1]=4 169 B7R1.2 O=C1CCC(=O)O1 2H26-1-X5 [1,0,0,1,0,0|1,0,1]=4 170 B7R1.2 O=C1C[C@H](O)CN1 4H20-1-X7 [1,0,0,1,0,0|2,0,0]=4 171 B7R1.2 O=C1OCC(F)O1 2H28-3-04 [1,0,0,1,0,0|2,0,0]=4 172 B7R1.2 O=C1OCC(F)O1 2H28-3-04H [1,0,0,1,0,0|2,0,0]=4 173 B7R1.3 CC1=CCCCC1 1400-1-04 [1,0,0,1,0,0|2,0,0]=4 174 B7R1.3 CC1CCCCC1 1200-1-19 [1,0,0,1,0,0|1,0,1]=4 175 B7R1.3 CC1CCNCC1 3H31-1-Q3 [1,0,0,1,0,0|2,0,0]=4 176 B7R1.3 CC1COCCN1 4H56-1-98 [1,0,0,1,0,0|1,0,1]=4 177 B7R1.3 C[C@@H]1COCCN1 4H56-1-9Y [1,0,0,1,0,0|1,0,1]=4 178 B7R1.3 C[C@@H]1COCCN1 4H56-5-CX [1,0,0,1,0,0|1,0,1]=4 179 B7R1.3 O=C1C=CCCC1 2417-1-X1 [1,0,0,1,0,0|1,0,1]=4 180 B7R1.3 O=C1C=CCCO1 2H25-1-78 [1,0,0,1,0,0|0,0,2]=4 181 B7R1.3 O=C1CCCCN1 4H48-1-1L [1,0,0,1,0,0|1,0,0]=3 182 B7R1.3 O=C1CCCCO1 2H25-1-X4 [1,0,0,1,0,0|0,0,0]=2 183 B7R1.3 O=C1CCCNC1 4H56-5-M8 [1,0,0,1,0,0|2,0,0]=4 184 B7R1.3 O=C1CCCOC1 2H17-1-09 [1,0,0,1,0,0|2,0,0]=4 185 B7R1.3 O=C1CCCSC1 6H66-1-40 [1,0,0,1,0,0|2,0,0]=4 186 B7R1.3 O=C1CCNCC1 4H17-1-3B [1,0,0,1,0,0|2,0,0]=4 187 B7R1.3 O=C1CCNCC1 4H56-5-3R [1,0,0,1,0,0|2,0,0]=4 188 B7R1.3 O=C1CCOCC1 P911-A-16 [1,0,0,1,0,0|2,0,0]=4 189 B7R1.3 O=C1CCSCC1 6H66-1-Y7 [1,0,0,1,0,0|2,0,0]=4 190 B7R1.3 O=C1CNCCN1 4H48-1-W4 [1,0,0,1,0,0|2,0,0]=4 191 B7R1.3 O=C1COCCN1 4H58-1-05 [1,0,0,1,0,0|2,0,0]=4 192 B7R1.3 O=C1OCCCO1 2H28-1-13 [1,0,0,1,0,0|1,0,0]=3 193 B7R1.3 OC1CCCOC1 2H10-1-41 [1,0,0,1,0,0|1,0,1]=4 194 B7R1.12 O=C(O)C1CC1F 2221-3-0B [1,0,0,1,0,0|1,0,0]=3 195 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F 2221-3-25 [1,0,0,1,0,0|1,0,0]=3 196 B7R1.14 CC1(O)CCCC1 2201-1-01 [1,0,0,1,0,0|1,0,1]=4 197 B7R1.14 O=S1(=O)CCCC1 6H70-1-05 [1,0,0,1,0,0|1,0,1]=4 198 B7R1.14 O=S1(=O)CCCC1 6H70-1-05B [1,0,0,1,0,0|1,0,1]=4 199 B7R1.18 N=C(N)C1CCC1 3241-5-X0 [1,0,0,1,0,0|2,0,0]=4 200 B7R1.18 O=C(Cl)C1CCC1 2216-5-03 [1,0,0,1,0,0|1,0,0]=3 201 B7R1.18 O=C(O)C1CNC1 P911-A-52 [1,0,0,1,0,0|1,0,0]=3 202 B7R1.18 O=C(O)[C@H]1CCN1 4H57-1-03 [1,0,0,1,0,0|1,0,0]=3 203 B7R1.20 O=C(O)CC1CC1 2221-1-X4 [1,0,0,1,0,0|0,0,0]=2 204 B9R1.35 CC(C)[C@@H]1COC(=O)N1 4H48-1-R4 [0,0,0,1,0,1|1,0,0]=3 205 B9R1.35 CN1CCC(C(=O)O)C1 4H58-1-E4 [0,0,0,1,0,1|1,0,0]=3 206 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 4248-7-01 [0,0,0,1,0,1|2,0,0]=4 207 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 4H57-1-31 [0,0,0,1,0,1|1,0,0]=3 208 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 4H57-1-S2 [0,0,0,1,0,1|1,0,0]=3 209 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 4H57-1-W9 [0,0,0,1,0,1|1,0,0]=3 210 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 4H58-5-BT [0,0,0,1,0,1|1,0,0]=3 211 B9R1.35 O=C1CC(C(=O)O)CN1 4H58-1-24 [0,0,0,1,0,1|1,0,1]=4 212 B9R1.35 [C@H]1(C(C)C)COC(=O)N1 4H56-1-7T [0,0,0,1,0,1|1,0,0]=3 213 B9R1.1 CCC1CCC(=O)CC1 2217-1-12 [0,1,0,1,0,0|1,0,0]=3 214 B9R1.1 CCN1CCC(=O)CC1 4H56-1-K4 [0,1,0,1,0,0|2,0,0]=4 215 B9R1.1 CN[C@H]1CC[C@H](O)CC1 4256-1-71 [0,1,0,1,0,0|1,0,1]=4 216 B9R1.10 CC1(C)C=CC(=O)CC1 2417-1-02 [0,1,0,1,0,0|1,0,0]=3 217 B9R1.10 CC1(C)CCC(=O)CC1 G311-A-56 [0,1,0,1,0,0|1,0,0]=3 218 B9R1.10 O=C1CCC(F)(F)CC1 2217-3-44 [0,1,0,1,0,0|2,0,0]=4 219 B9R1.82 COC(=O)C1CC(=O)C1 2229-1-02 [0,1,0,1,0,0|1,0,1]=4 220 B9R1.82 COC(=O)C1CC(Cl)C1 2223-5-09 [0,1,0,1,0,0|1,0,0]=3 221 B9R1.82 COC(=O)C1CC(O)C1 2229-1-28 [0,1,0,1,0,0|1,0,0]=3 222 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 2229-1-35 [0,1,0,1,0,0|1,0,0]=3 223 B9R1.137 CC(=O)CC(=O)C1CC1 2218-1-15 [0,1,0,1,0,0|1,0,1]=4 224 B9R1.164 CC1(C)CC(C(=O)O)C1 2221-1-27 [0,1,0,1,0,0|0,0,0]=2 225 B9R1.164 O=C(O)C1CC(F)(F)C1 2221-3-04 [0,1,0,1,0,0|1,0,0]=3 226 B5R0.5 C=C(C)C(C)C 1300-1-24 [0,0,0,0,2,0|2,0,0]=4 227 B5R0.5 CC(=O)C(=O)O 2129-1-03 [0,0,0,0,2,0|1,0,1]=4 228 B5R0.5 CC(=O)C(C)C 2117-1-13 [0,0,0,0,2,0|1,0,0]=3 229 B5R0.5 CC(=O)C(C)F 2117-3-11 [0,0,0,0,2,0|2,0,0]=4 230 B5R0.5 CC(=O)N(C)C 4148-1-08 [0,0,0,0,2,0|2,0,0]=4 231 B5R0.5 CC(Br)C(N)=O 4157-9-X1 [0,0,0,0,2,0|2,0,0]=4 232 B5R0.5 CC(C)B(O)O 6160-1-X0 [0,0,0,0,2,0|1,0,1]=4 233 B5R0.5 CC(C)C(=N)N 3141-5-X0 [0,0,0,0,2,0|2,0,0]=4 234 B5R0.5 CC(C)C(=O)Cl 2116-5-05 [0,0,0,0,2,0|1,0,0]=3 235 B5R0.5 CC(F)C(=O)O 2121-3-95 [0,0,0,0,2,0|1,0,0]=3 236 B5R0.5 CC(N)C(N)=O 4158-5-X5 [0,0,0,0,2,0|2,0,0]=4 237 B5R0.5 C[C@@H](Cl)C(=O)O 2121-5-R1 [0,0,0,0,2,0|1,0,0]=3 238 B5R0.5 C[C@@H](O)C(N)=O 4148-1-R1 [0,0,0,0,2,0|2,0,0]=4 239 B5R0.5 C[C@H](N)C(=O)O 4157-1-S5 [0,0,0,0,2,0|1,0,0]=3 240 B5R0.5 C[C@H](N)C(N)=O 4148-5-04 [0,0,0,0,2,0|2,0,0]=4 241 B5R0.5 C[C@H](O)C(=O)O 2129-1-S8 [0,0,0,0,2,0|1,0,0]=3 242 B5R0.5 O=C(O)C(F)Br 2121-B-03 [0,0,0,0,2,0|2,0,0]=4 243 B5R0.5 O=C(O)C(F)Cl 2121-7-03 [0,0,0,0,2,0|2,0,0]=4 244 B5R0.5 O=C(O)C(F)F 2121-3-05 [0,0,0,0,2,0|2,0,0]=4 245 B5R0.5 O=C(O)C(F)I 2121-K-01 [0,0,0,0,2,0|2,0,0]=4 246 B5R0.5 [C@@H](C)(Cl)C(=O)O 2121-5-S1 [0,0,0,0,2,0|1,0,0]=3 247 B9R0.55 CC(=O)CCCCC(=O)O 2121-1-X0 [0,0,0,0,0,2|1,0,1]=4 248 B9R0.55 CN(C)CCCCC(=O)O 4133-5-02 [0,0,0,0,0,2|1,0,0]=3