0 B8R0.6 CCCCCC(=O)CBr C73149 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.6 COC(=O)COCCO D84694 [0,0,0,0,0,0|2,0,0]=2 2 B8R0.6 COC\C=C\C(=O)OC P17071 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.1 COCCOCCI AT13077 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.3 C#CCCC(=O)OC AT21755 [1,0,0,0,0,0|0,0,2]=3 5 B7R0.3 C=CC(=O)NCCC AB9941 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.3 C=CCCC(=O)OC AT23749 [1,0,0,0,0,0|0,0,2]=3 7 B7R0.3 CCC(=O)OCCO A11774 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.3 CNCCC(=O)OC AB11809 [1,0,0,0,0,0|1,0,0]=2 9 B7R0.3 COC(=O)C#CCO AB7534 [1,0,0,0,0,0|1,0,2]=4 10 B7R0.3 COC(=O)CCCI F19766 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.3 COC(=O)\C=C\CCl AT12623 [1,0,0,0,0,0|1,0,2]=4 12 B7R0.3 COC(=O)\C=C\CN AT20770 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.4 CC(=O)CCCCBr O11558 [1,0,0,0,0,0|1,0,0]=2 14 B7R0.4 CC(=O)OCCCBr C75766 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.4 CC(C)CCCCBr C74820 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.4 CCCNCC(C)C AC1640 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.4 CCCOCC(=O)O AC1647 [1,0,0,0,0,0|1,0,0]=2 18 B7R0.4 CCNCCC(N)=O AT24732 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.4 CN(C)CCCCCl W16936 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.4 CNCCCC(N)=O 21232 [1,0,0,0,0,0|2,0,0]=3 21 B7R0.4 COCCCC(=O)O 78063 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.4 C[C@H](Cl)CCCCCl A12620 [1,0,0,0,0,0|2,0,1]=4 23 B7R0.4 NCCNCC(=O)O FD21628 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.4 O=C([O-])COCCO A11454 [1,0,0,0,0,0|2,0,1]=4 25 B9R0.1 COC(=O)\C=C\CN(C)C D70009 [0,1,0,0,0,0|1,0,2]=4 26 B9R0.5 CCCCC[C@H](O)CCO A10789 [0,1,0,0,0,0|1,0,2]=4 27 B9R0.5 CCOC(=O)CCCC#N 84960 [0,1,0,0,0,0|1,0,1]=3 28 B9R0.5 CCOC(=O)CCCC=O N10598 [0,1,0,0,0,0|1,0,1]=3 29 B9R0.5 CCOC(=O)CCCCN 23836 [0,1,0,0,0,0|1,0,0]=2 30 B9R0.5 CCOC(=O)\C=C\CCBr I11241 [0,1,0,0,0,0|1,0,2]=4 31 B9R0.5 CCOC(=O)\C=C\CCO W16297 [0,1,0,0,0,0|1,0,2]=4 32 B9R0.8 CNC(=O)[C@@H](Br)CCCBr AC6474 [0,1,0,0,0,0|2,0,0]=3 33 B9R0.24 CCC(=O)CCC(=O)CC Y14693 [0,1,0,0,0,0|1,0,1]=3 34 B9R0.24 CCC(O)CCC(O)CC D86710 [0,1,0,0,0,0|1,0,2]=4 35 B9R0.24 CC[C@H](O)CC[C@@H](O)CC 55799 [0,1,0,0,0,0|1,0,2]=4 36 B9R0.24 COC(=O)CCC(=O)CBr D72688 [0,1,0,0,0,0|1,0,1]=3 37 B9R0.34 CCC[C@H](N)CC(=O)OC N15478 [0,1,0,0,0,0|0,0,0]=1 38 B9R0.34 CCC[C@H](N)CC(=O)OC N16940 [0,1,0,0,0,0|0,0,0]=1 39 B9R0.34 CCC[C@H](O)CC(=O)OC D93333 [0,1,0,0,0,0|0,0,0]=1 40 B9R0.46 C=CC(=O)NCCCCO C75218 [0,1,0,0,0,0|2,0,1]=4 41 B9R0.46 CCNCCCC(=O)OC 72977 [0,1,0,0,0,0|0,0,0]=1 42 B9R0.46 CCOCCOC(=O)CCl D79711 [0,1,0,0,0,0|3,0,0]=4 43 B9R0.46 COC(=O)CSCCCCl W12305 [0,1,0,0,0,0|1,0,0]=2 44 B9R0.47 C=C(C)C(=O)NCCCC AB10367 [0,1,0,0,0,0|2,0,0]=3 45 B9R0.47 C=C(C)C(=O)OCCCO A12375 [0,1,0,0,0,0|3,0,0]=4 46 B9R0.47 CCCCCC(=O)N(C)C C16028 [0,1,0,0,0,0|1,0,0]=2 47 B9R1.1 C=C1CCC(CO)CC1 F13032 [0,0,0,1,0,0|3,0,0]=4 48 B9R1.1 CC[C@H]1CC[C@H](O)CC1 F19617 [0,0,0,1,0,0|1,0,2]=4 49 B9R1.1 CON1CCC(=O)CC1 92073 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.1 NCC1CCC(=O)CC1 56684 [0,0,0,1,0,0|2,0,0]=3 51 B9R1.1 NC[C@H]1CCC(=O)NC1 37820 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.1 NC[C@H]1CNC(=O)CO1 W10861 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.1 O=C1CC[C@H](CO)CN1 C72773 [0,0,0,1,0,0|2,0,0]=3 54 B9R1.1 O=C1CN[C@@H](CF)CN1 D97270 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.1 O=C1CO[C@@H](CO)CN1 AB7325 [0,0,0,1,0,0|3,0,0]=4 56 B9R1.1 O=C1CO[C@@H](CO)CN1 P10704 [0,0,0,1,0,0|3,0,0]=4 57 B9R1.1 O=C1CO[C@@H](CO)CN1 P10705 [0,0,0,1,0,0|3,0,0]=4 58 B9R1.1 O=CC1CCC(=O)CC1 C77323 [0,0,0,1,0,0|2,0,1]=4 59 B9R1.2 CO[C@H]1CCC[C@@H](N)C1 D96541 [0,0,0,1,0,0|2,0,1]=4 60 B9R1.3 CN1C(=O)CCCC1=O C74292 [0,0,0,1,0,0|2,0,1]=4 61 B9R1.5 CN1CCCNCC1=O 37932 [0,0,0,1,0,0|2,0,0]=3 62 B9R1.5 CN1CCCNCC1=O Y10016 [0,0,0,1,0,0|2,0,0]=3 63 B9R1.5 CN1CCNCCC1=O Y10618 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.5 C[C@@H]1NCCCNC1=O F50270 [0,0,0,1,0,0|3,0,0]=4 65 B9R1.5 C[C@@H]1NCCCNC1=O F50344 [0,0,0,1,0,0|3,0,0]=4 66 B9R1.5 C[C@H]1CCNCCC1=O 73013 [0,0,0,1,0,0|2,0,0]=3 67 B9R1.5 N[C@H]1CCCCNC1=O A56020 [0,0,0,1,0,0|3,0,0]=4 68 B9R1.5 O=C1CCNCC[C@@H]1Br 98344 [0,0,0,1,0,0|3,0,0]=4 69 B9R1.5 O=C1CNCCC[C@@H]1F 72994 [0,0,0,1,0,0|3,0,0]=4 70 B9R1.7 CCC[C@@H]1COC(=O)C1 S10720 [0,0,0,1,0,0|0,0,0]=1 71 B9R1.7 CCC[C@H]1CCC(=O)C1 A10517 [0,0,0,1,0,0|1,0,0]=2 72 B9R1.11 CNC(=O)[C@@H]1CCCN1 C13792 [0,0,0,1,0,0|2,0,0]=3 73 B9R1.11 CNC(=O)[C@H]1CCNC1 C77874 [0,0,0,1,0,0|2,0,0]=3 74 B9R1.11 COC(=O)C1=CCSC1 T71209 [0,0,0,1,0,0|1,0,2]=4 75 B9R1.11 COC(=O)[C@@H]1CCCN1 D82335 [0,0,0,1,0,0|1,0,0]=2 76 B9R1.11 COC(=O)[C@H]1CCNC1 37185 [0,0,0,1,0,0|1,0,0]=2 77 B9R1.11 COC(=O)[C@H]1CCNC1 37186 [0,0,0,1,0,0|1,0,0]=2 78 B9R1.11 COC(=O)[C@H]1CCOC1 P12029 [0,0,0,1,0,0|1,0,0]=2 79 B9R1.11 COC(=O)[C@H]1CCOC1 P12030 [0,0,0,1,0,0|1,0,0]=2 80 B9R1.11 NCC(=O)N1CCCC1 W18110 [0,0,0,1,0,0|3,0,0]=4 81 B9R1.11 NNC(=O)[C@H]1CCOC1 28802 [0,0,0,1,0,0|3,0,0]=4 82 B9R1.11 O=C(CBr)C1CCCC1 P20314 [0,0,0,1,0,0|2,0,0]=3 83 B9R1.11 O=C(CO)N1CCCC1 W15877 [0,0,0,1,0,0|3,0,0]=4 84 B9R1.49 CN1CCNC(=O)CC1 Y10078 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.49 O=C1CCC[C@H](O)CN1 N10631 [0,0,0,1,0,0|2,0,0]=3 86 B9R1.50 O=C1CNCCCNC1 77720 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.50 O=C1NCCCCCN1 W17640 [0,0,0,1,0,0|2,0,0]=3 88 B9R1.79 COC(=O)CC1CCC1 20777 [0,0,0,1,0,0|0,0,0]=1 89 B9R1.79 COC(=O)CC1CNC1 C71903 [0,0,0,1,0,0|1,0,0]=2 90 B9R1.79 COC(=O)CC1COC1 82645 [0,0,0,1,0,0|1,0,0]=2 91 B9R1.79 O=C(CBr)CC1CCC1 D79065 [0,0,0,1,0,0|2,0,0]=3 92 B9R1.80 COC(=O)C#CC1CC1 W15222 [0,0,0,1,0,0|0,0,2]=3 93 B9R1.80 COC(=O)\C=C\C1CC1 89072 [0,0,0,1,0,0|0,0,2]=3 94 B9R1.81 COC(=O)C1CNC1C P14367 [0,0,0,1,0,0|1,0,0]=2 95 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N 37832 [0,0,0,1,0,0|1,0,0]=2 96 B9R1.88 COC(=O)C1CC1CN P14227 [0,0,0,1,0,0|1,0,0]=2 97 B9R1.88 COC(=O)[C@H]1C[C@@H]1CO P20071 [0,0,0,1,0,0|1,0,0]=2 98 B9R1.89 CCN1CCCCCC1 A11156 [0,0,0,1,0,0|3,0,0]=4 99 B9R1.89 CO[C@H]1CCCNCC1 37044 [0,0,0,1,0,0|2,0,1]=4 100 B9R1.89 CO[C@H]1CCCNCC1 37045 [0,0,0,1,0,0|2,0,1]=4 101 B9R1.118 CCC1(N)CCCCC1 21224 [0,0,0,1,0,0|2,0,1]=4 102 B9R1.118 COC1(C)CCNCC1 72328 [0,0,0,1,0,0|2,0,1]=4 103 B9R1.132 CN1C(=O)CC[C@@H]1CO 94188 [0,0,0,1,0,0|2,0,0]=3 104 B9R1.132 CN1C(=O)CC[C@@H]1CO 94193 [0,0,0,1,0,0|2,0,0]=3 105 B9R1.132 CN1C(=O)CC[C@@H]1CO S11484 [0,0,0,1,0,0|2,0,0]=3 106 B6R0.6 CCOCCON W15834 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.6 CNCCCCBr C74879 [2,0,0,0,0,0|2,0,0]=4 108 B6R0.6 CNCCCCN D80538 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.6 OCCCCCO D77911 [2,0,0,0,0,0|1,0,1]=4 110 B6R0.1 CNC(=O)CCN C75423 [2,0,0,0,0,0|2,0,0]=4 111 B6R0.1 CNC(=O)CCO AC6610 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.1 CNC(=O)CCS A11187 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.1 COC(=O)OCCl R10013 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.4 C=C(C)CCCBr 71968 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.4 CC(=O)CCC=O P17049 [2,0,0,0,0,0|1,0,1]=4 116 B6R0.4 CC(=O)CCCBr 25631 [2,0,0,0,0,0|1,0,0]=3 117 B6R0.4 CC(=O)OCCN W11955 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.4 CCOCC(=O)O D73862 [2,0,0,0,0,0|1,0,0]=3 119 B6R0.4 NCCCC(N)=O C72206 [2,0,0,0,0,0|2,0,0]=4 120 B8R0.4 COCCCCCCBr S10679 [1,1,0,0,0,0|0,0,1]=3 121 B8R0.4 COCCOCCOC D72523 [1,1,0,0,0,0|1,0,1]=4 122 B8R0.3 C=CC[C@H](N)C(=O)OC 50494 [1,1,0,0,0,0|0,0,2]=4 123 B8R0.3 C=CC[C@H](N)C(=O)OC 78270 [1,1,0,0,0,0|0,0,2]=4 124 B8R0.3 CCCC(=O)C(=O)OC T72754 [1,1,0,0,0,0|0,0,1]=3 125 B8R0.3 COC(=O)[C@@H](N)CCBr 52036 [1,1,0,0,0,0|1,0,0]=3 126 B8R0.3 COC[C@H](N)C(=O)OC C73433 [1,1,0,0,0,0|1,0,0]=3 127 B8R0.8 CCCCC(=O)[C@H](C)N C72970 [1,1,0,0,0,0|1,0,0]=3 128 B8R0.8 CN(C)C(=O)CCCCl S12226 [1,1,0,0,0,0|2,0,0]=4 129 B8R0.19 CC[C@H](N)CC(=O)OC N12944 [1,1,0,0,0,0|0,0,0]=2 130 B8R0.19 CC[C@H](O)CC(=O)OC C15791 [1,1,0,0,0,0|0,0,0]=2 131 B8R0.19 COC(=O)C[C@H](O)CCl A11858 [1,1,0,0,0,0|1,0,0]=3 132 B8R0.19 COC(=O)N[C@@H](C)CN D95526 [1,1,0,0,0,0|2,0,0]=4 133 B8R0.5 C=CC[C@H](N)CC(=O)O F15070 [1,1,0,0,0,0|0,0,2]=4 134 B8R0.5 CCCC(=O)CC(C)=O 79568 [1,1,0,0,0,0|0,0,1]=3 135 B8R0.5 CCC[C@H](C)CC(C)=O D93522 [1,1,0,0,0,0|0,0,0]=2 136 B8R0.5 CCC[C@H](C)CC(C)C F17729 [1,1,0,0,0,0|1,0,1]=4 137 B8R0.5 CCC[C@H](N)CC(=O)O C76010 [1,1,0,0,0,0|0,0,0]=2 138 B8R0.5 CCC\C(C)=C\C(=O)O A11778 [1,1,0,0,0,0|0,0,2]=4 139 B8R0.21 CCCCCS(N)(=O)=O P18656 [1,1,0,0,0,0|1,0,1]=4 140 B8R0.21 NCCCCP(=O)(O)O C10655 [1,1,0,0,0,0|2,0,0]=4 141 B8R0.28 CC(=O)NCCC(C)C S10520 [1,1,0,0,0,0|1,0,0]=3 142 B8R0.28 CC(=O)OCCC(=O)O C77559 [1,1,0,0,0,0|1,0,1]=4 143 B8R0.28 CC(C)=CCCC(=O)O F16793 [1,1,0,0,0,0|0,0,2]=4 144 B8R0.28 CC(C)CNCC(=O)O W10796 [1,1,0,0,0,0|1,0,0]=3 145 B10R0.3 C=C(C)CCCC(=O)OCC C75004 [0,2,0,0,0,0|0,0,1]=3 146 B10R0.3 CCOC(=O)CCC[N+](=O)[O-] Y14690 [0,2,0,0,0,0|2,0,0]=4 147 B10R0.44 COC(=O)CC(=O)CC(C)=O C74527 [0,2,0,0,0,0|0,0,2]=4 148 B10R0.57 COC(=O)[C@@H](N)CCC(N)=O 68604 [0,2,0,0,0,0|1,0,1]=4 149 B10R0.59 COC(=O)COCC(=O)OC C16251 [0,2,0,0,0,0|1,0,1]=4 150 B10R0.82 COC(=O)CC[C@H](N)C(N)=O W12035 [0,2,0,0,0,0|1,0,1]=4 151 B10R0.1 CCCC(=O)OCCCSC 73858 [0,2,0,0,0,0|2,0,0]=4 152 B10R0.1 CCCCNCC(=O)OCC AB3730 [0,2,0,0,0,0|0,0,0]=2 153 B10R0.1 CCOC(=O)CNCCC#N AB7171 [0,2,0,0,0,0|1,0,1]=4 154 B10R0.1 CCOC(=O)CNCCC#N Y10514 [0,2,0,0,0,0|1,0,1]=4 155 B10R0.1 CCOC(=O)\C=C\CCCCl 58166 [0,2,0,0,0,0|0,0,2]=4 156 B10R0.19 C=CCC[C@H](N)C(=O)OCC W17088 [0,2,0,0,0,0|0,0,2]=4 157 B10R0.83 CCCCCC(=O)[C@@H](C)CC D84197 [0,2,0,0,0,0|1,0,0]=3 158 B10R0.83 C\C=C(/C)C(=O)OCCCC A12842 [0,2,0,0,0,0|2,0,0]=4 159 B10R0.91 CCCCNC(=O)OCCO D93331 [0,2,0,0,0,0|1,0,0]=3 160 B10R0.108 CCOC(=O)CCC(=O)CBr 79134 [0,2,0,0,0,0|1,0,1]=4 161 B10R0.108 CCOC(=O)CNC(=O)OC 74367 [0,2,0,0,0,0|1,0,1]=4 162 B10R0.108 CCOC(=O)NCC(=O)OC AB7223 [0,2,0,0,0,0|1,0,1]=4 163 B10R0.45 COC(=O)CCC(OC)OC W12514 [0,2,0,0,0,0|1,0,0]=3 164 B10R0.18 C#CCCC(=O)CC(=O)OC N11412 [0,2,0,0,0,0|0,0,2]=4 165 B10R0.18 COCCC(=O)CC(=O)OC T72723 [0,2,0,0,0,0|0,0,1]=3 166 B10R0.29 CCC[C@H](CC)CC(=O)OC D94272 [0,2,0,0,0,0|0,0,0]=2 167 B10R0.55 COC(=O)CCCCC(C)=O F16317 [0,2,0,0,0,0|0,0,0]=2 168 B10R0.74 NCC(=O)NCCCCCBr D84097 [0,2,0,0,0,0|2,0,0]=4 169 B8R1.2 BrC[C@H]1CCCOC1 38662 [1,0,0,1,0,0|1,0,1]=4 170 B8R1.2 CCC1CCNCC1 W10090 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.2 CC[C@H]1COCCN1 F17630 [1,0,0,1,0,0|1,0,1]=4 172 B8R1.2 CC[C@H]1COCCN1 FD6008 [1,0,0,1,0,0|1,0,1]=4 173 B8R1.2 COC1=NCCCC1 D87703 [1,0,0,1,0,0|1,0,0]=3 174 B8R1.2 IC[C@H]1CCCOC1 P20725 [1,0,0,1,0,0|1,0,1]=4 175 B8R1.2 NC[C@H]1CCCOC1 SC1491 [1,0,0,1,0,0|1,0,1]=4 176 B8R1.2 OC[C@H]1CCCOC1 38674 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.5 C[C@H]1CCCN[C@H]1C P18680 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.8 CCN[C@H]1CCOC1 F14260 [1,0,0,1,0,0|1,0,1]=4 179 B8R1.8 COC[C@H]1CCCN1 11152 [1,0,0,1,0,0|1,0,1]=4 180 B8R1.8 COC[C@H]1CCCN1 11153 [1,0,0,1,0,0|1,0,1]=4 181 B8R1.8 COC[C@H]1CCCN1 71289 [1,0,0,1,0,0|1,0,1]=4 182 B8R1.8 COC[C@H]1CCNC1 72010 [1,0,0,1,0,0|1,0,1]=4 183 B8R1.8 COC[C@H]1CCNC1 P10622 [1,0,0,1,0,0|1,0,1]=4 184 B8R1.8 COC[C@H]1CCNC1 P12588 [1,0,0,1,0,0|1,0,1]=4 185 B8R1.8 COC[C@H]1CCNC1 P15249 [1,0,0,1,0,0|1,0,1]=4 186 B8R1.8 COC[C@H]1CCNC1 P15255 [1,0,0,1,0,0|1,0,1]=4 187 B8R1.10 OCCCC1COC1 89590 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.22 C[C@H]1CCCCCN1 D79537 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.22 C[C@H]1CCCCCN1 D79538 [1,0,0,1,0,0|2,0,0]=4 190 B8R1.22 C[C@H]1CCCCCN1 W10101 [1,0,0,1,0,0|2,0,0]=4 191 B8R1.22 C[C@H]1CCCCNC1 72971 [1,0,0,1,0,0|1,0,1]=4 192 B8R1.22 C[C@H]1CNCCOC1 73160 [1,0,0,1,0,0|1,0,1]=4 193 B8R1.36 OCCCC[C@H]1CO1 F52608 [1,0,0,1,0,0|1,0,1]=4 194 B8R1.1 C=C[C@@H]1COC(=O)C1 88423 [1,0,0,1,0,0|0,0,2]=4 195 B8R1.1 NC[C@@H]1CNC(=O)C1 37317 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.1 NC[C@@H]1CNC(=O)C1 37318 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.1 NC[C@@H]1CNC(=O)C1 P15063 [1,0,0,1,0,0|2,0,0]=4 198 B8R1.1 O=C1CC[C@H](CO)C1 D79584 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.1 O=C1C[C@H](CO)CN1 P11209 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.1 O=C1N[C@@H](CI)CO1 C72732 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.1 O=C1N[C@@H](CO)CO1 AC1845 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.1 O=C1N[C@@H](CO)CO1 F50277 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.1 O=C1N[C@@H](CO)CO1 F50345 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.3 C[C@@H]1C=CC(=O)CC1 P17313 [1,0,0,1,0,0|1,0,1]=4 205 B8R1.3 C[C@H]1CCC(=O)NC1 P11593 [1,0,0,1,0,0|1,0,0]=3 206 B8R1.3 C[C@H]1CNC(=O)CN1 P15845 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.3 C[C@H]1CNC(=O)CN1 P17730 [1,0,0,1,0,0|2,0,0]=4 208 B8R1.3 C[C@H]1CNC(=O)CN1 P18573 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.3 C[C@H]1CNC(=O)CO1 AC2156 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.3 N[C@H]1CCC(=O)NC1 37582 [1,0,0,1,0,0|2,0,0]=4 211 B8R1.3 N[C@H]1CCC(=O)NC1 D95207 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.3 N[C@H]1CCC(=O)NC1 P10248 [1,0,0,1,0,0|2,0,0]=4 213 B8R1.3 O=C1CCC(=O)OC1 P20160 [1,0,0,1,0,0|1,0,1]=4 214 B8R1.3 O=C1CCC(F)CC1 23163 [1,0,0,1,0,0|2,0,0]=4 215 B8R1.3 O=C1CC[C@H](F)CN1 P20230 [1,0,0,1,0,0|2,0,0]=4 216 B8R1.3 O=C1CC[C@H](O)CN1 62219 [1,0,0,1,0,0|2,0,0]=4 217 B8R1.3 O=C1CC[C@H](O)CO1 F13840 [1,0,0,1,0,0|1,0,0]=3 218 B8R1.38 CCC(=O)C1COC1 D79147 [1,0,0,1,0,0|2,0,0]=4 219 B8R1.38 CNC(=O)C1CNC1 P20515 [1,0,0,1,0,0|2,0,0]=4 220 B8R1.38 COC(=O)C1COC1 81275 [1,0,0,1,0,0|1,0,0]=3 221 B8R1.38 COC(=O)[C@@H]1CCN1 38788 [1,0,0,1,0,0|1,0,0]=3 222 B8R1.40 COC(=O)CC1CC1 28012 [1,0,0,1,0,0|0,0,0]=2 223 B8R1.4 C=C1CCCC(=O)O1 D93802 [1,0,0,1,0,0|0,0,2]=4 224 B8R1.4 CN1CCCC(=O)C1 S10664 [1,0,0,1,0,0|1,0,0]=3 225 B8R1.4 C[C@@H]1CCC[C@H](N)C1 D84824 [1,0,0,1,0,0|1,0,1]=4 226 B8R1.4 C[C@H]1CC(=O)CCN1 37834 [1,0,0,1,0,0|1,0,0]=3 227 B8R1.4 C[C@H]1CC(=O)CCN1 37835 [1,0,0,1,0,0|1,0,0]=3 228 B8R1.4 C[C@H]1CC(=O)CCN1 37846 [1,0,0,1,0,0|1,0,0]=3 229 B8R1.4 C[C@H]1CC(=O)CCO1 P11761 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.4 C[C@H]1CCNC(=O)C1 P11592 [1,0,0,1,0,0|1,0,0]=3 231 B8R1.4 C[C@H]1CCOC(=O)O1 W17381 [1,0,0,1,0,0|1,0,0]=3 232 B8R1.4 C[C@H]1CNCC(=O)N1 38273 [1,0,0,1,0,0|2,0,0]=4 233 B8R1.4 C[C@H]1CNCC(=O)N1 71648 [1,0,0,1,0,0|2,0,0]=4 234 B8R1.4 C[C@H]1CNCC(=O)N1 P10459 [1,0,0,1,0,0|2,0,0]=4 235 B8R1.4 N[C@H]1CCCC(=O)C1 20374 [1,0,0,1,0,0|1,0,0]=3 236 B8R1.4 N[C@H]1CCNC(=O)C1 27397 [1,0,0,1,0,0|2,0,0]=4 237 B8R1.4 O=C1C[C@@H](O)CCN1 68727 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.4 O=C1C[C@@H](O)CCN1 68728 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.6 CCCC1CC(=O)C1 D96728 [1,0,0,1,0,0|0,0,0]=2 240 B8R1.6 N#CCC1CC(=O)C1 P15944 [1,0,0,1,0,0|1,0,1]=4 241 B8R1.7 CC(=O)[C@H]1CCOC1 79964 [1,0,0,1,0,0|1,0,0]=3 242 B8R1.7 CC(=O)[C@H]1NCCS1 C73779 [1,0,0,1,0,0|2,0,0]=4 243 B8R1.7 C[C@H](N)C1CCCC1 66137 [1,0,0,1,0,0|1,0,1]=4 244 B8R1.7 C[C@H](N)C1CCCC1 83604 [1,0,0,1,0,0|1,0,1]=4 245 B8R1.7 NC(=O)N1CCCC1 32811 [1,0,0,1,0,0|2,0,0]=4 246 B8R1.7 NC(=O)[C@H]1CCNC1 31795 [1,0,0,1,0,0|2,0,0]=4 247 B8R1.7 NC(=O)[C@H]1CCNC1 37190 [1,0,0,1,0,0|2,0,0]=4 248 B8R1.7 NC(=O)[C@H]1CCOC1 39026 [1,0,0,1,0,0|2,0,0]=4 249 B8R1.7 O=C(Cl)[C@@H]1CCCO1 P19141 [1,0,0,1,0,0|2,0,0]=4 250 B8R1.7 O=C(O)[C@@H]1CCCN1 D77952 [1,0,0,1,0,0|1,0,0]=3 251 B8R1.7 O=C(O)[C@@H]1COCN1 A11387 [1,0,0,1,0,0|2,0,0]=4 252 B8R1.7 O=C(O)[C@@H]1COCN1 C73113 [1,0,0,1,0,0|2,0,0]=4 253 B8R1.7 O=C(O)[C@H]1CCNC1 65432 [1,0,0,1,0,0|1,0,0]=3 254 B8R1.7 O=C(O)[C@H]1CCNC1 P10866 [1,0,0,1,0,0|1,0,0]=3 255 B8R1.7 O=C(O)[C@H]1CCOC1 59930 [1,0,0,1,0,0|1,0,0]=3 256 B8R1.7 O=C(O)[C@H]1CCOC1 66517 [1,0,0,1,0,0|1,0,0]=3 257 B8R1.31 CC1NCC1C(=O)O P14366 [1,0,0,1,0,0|1,0,0]=3 258 B8R1.31 CN1CC[C@H]1C(=O)O D79077 [1,0,0,1,0,0|1,0,0]=3 259 B8R1.31 CN1CC[C@H]1C(=O)O F50250 [1,0,0,1,0,0|1,0,0]=3 260 B8R1.31 CN1CC[C@H]1C(=O)O F50319 [1,0,0,1,0,0|1,0,0]=3 261 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O P15238 [1,0,0,1,0,0|1,0,0]=3 262 B8R1.31 N[C@H]1CC[C@H]1C(=O)O P15463 [1,0,0,1,0,0|1,0,0]=3 263 B8R1.34 CC(=O)CC1CCC1 D79207 [1,0,0,1,0,0|0,0,0]=2 264 B8R1.34 CC(=O)CC1COC1 CS1731 [1,0,0,1,0,0|1,0,0]=3 265 B8R1.34 CC(=O)OC1CNC1 C72427 [1,0,0,1,0,0|2,0,0]=4 266 B8R1.34 CC(=O)OC1CNC1 C76369 [1,0,0,1,0,0|2,0,0]=4 267 B8R1.34 N=C(N)CC1CCC1 33747 [1,0,0,1,0,0|2,0,0]=4 268 B8R1.34 O=C(O)CC1CNC1 37024 [1,0,0,1,0,0|1,0,0]=3 269 B8R1.34 O=C(O)CC1COC1 66388 [1,0,0,1,0,0|1,0,0]=3 270 B8R1.34 O=C(O)CN1CCC1 55159 [1,0,0,1,0,0|1,0,0]=3 271 B8R1.34 O=C([O-])CC1COC1 P19943 [1,0,0,1,0,0|1,0,1]=4 272 B8R1.35 O=C(O)CNC1CC1 F14996 [1,0,0,1,0,0|1,0,0]=3 273 B8R1.35 O=C(O)CNC1CC1 W15242 [1,0,0,1,0,0|1,0,0]=3 274 B8R1.43 N#CC1CC1C(=O)O P14648 [1,0,0,1,0,0|1,0,1]=4 275 B8R1.43 N#C[C@H]1C[C@@H]1C(=O)O P14731 [1,0,0,1,0,0|1,0,1]=4 276 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O P14732 [1,0,0,1,0,0|1,0,1]=4 277 B8R1.43 O=C(O)C1CC1CCl D85971 [1,0,0,1,0,0|1,0,0]=3 278 B8R1.43 O=C(O)[C@H]1C[C@@H]1CCl P19534 [1,0,0,1,0,0|1,0,0]=3 279 B8R1.72 CC1(Br)CCCCC1 P19508 [1,0,0,1,0,0|1,0,1]=4 280 B10R1.14 COC(=O)C1CCC(O)C1 P17887 [0,1,0,1,0,0|0,0,0]=2 281 B10R1.14 COC(=O)[C@@H]1CCC(=S)N1 W12371 [0,1,0,1,0,0|1,0,1]=4 282 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 86119 [0,1,0,1,0,0|0,0,0]=2 283 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 P13549 [0,1,0,1,0,0|0,0,0]=2 284 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 P13902 [0,1,0,1,0,0|0,0,0]=2 285 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 71650 [0,1,0,1,0,0|1,0,0]=3 286 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 AT21627 [0,1,0,1,0,0|1,0,0]=3 287 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 72963 [0,1,0,1,0,0|1,0,0]=3 288 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 83570 [0,1,0,1,0,0|1,0,0]=3 289 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 C11590 [0,1,0,1,0,0|0,0,2]=4 290 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 P16224 [0,1,0,1,0,0|0,0,2]=4 291 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 P10176 [0,1,0,1,0,0|0,0,1]=3 292 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 P12477 [0,1,0,1,0,0|0,0,1]=3 293 B10R1.14 COC(=O)[C@H]1CCN(C)C1 F12360 [0,1,0,1,0,0|1,0,0]=3 294 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 P16721 [0,1,0,1,0,0|0,0,0]=2 295 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 P13551 [0,1,0,1,0,0|0,0,0]=2 296 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 P20282 [0,1,0,1,0,0|0,0,0]=2 297 B10R1.14 COC(=O)[C@H]1CC[C@H](O)C1 P16736 [0,1,0,1,0,0|0,0,0]=2 298 B10R1.150 COC(=O)CC1CC(=O)C1 84726 [0,1,0,1,0,0|0,0,1]=3 299 B10R1.150 COC(=O)CC1CC(N)C1 P19705 [0,1,0,1,0,0|0,0,0]=2 300 B10R1.150 COC(=O)CC1CC(O)C1 P17672 [0,1,0,1,0,0|0,0,0]=2 301 B10R1.302 CC1(C)CCNC(=O)CC1 W16051 [0,1,0,1,0,0|2,0,0]=4 302 B10R1.408 COC(=O)[C@H]1C[C@@H]1C(=O)O P15598 [0,1,0,1,0,0|1,0,1]=4 303 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O P15789 [0,1,0,1,0,0|1,0,1]=4 304 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O P17161 [0,1,0,1,0,0|1,0,1]=4 305 B10R1.11 CCOC(=O)C1=CCCC1 71128 [0,1,0,1,0,0|0,0,2]=4 306 B10R1.11 CCOC(=O)[C@H]1CCNC1 AC2254 [0,1,0,1,0,0|1,0,0]=3 307 B10R1.11 N#CCC(=O)C1CCCC1 84149 [0,1,0,1,0,0|1,0,1]=4 308 B10R1.25 CC[C@H]1CNC(=O)CC1=O 27452 [0,1,0,1,0,0|1,0,1]=4 309 B10R1.78 O=C1CCCCCCCC1 AC8766 [0,1,0,1,0,0|1,0,0]=3 310 B10R1.78 O=C1CCCCCCCN1 D74918 [0,1,0,1,0,0|1,0,0]=3 311 B10R1.135 CCOC(=O)C1CC1C#N A12647 [0,1,0,1,0,0|1,0,1]=4 312 B10R1.135 CCOC(=O)C1CC1CO F13437 [0,1,0,1,0,0|1,0,0]=3 313 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N P16190 [0,1,0,1,0,0|1,0,1]=4 314 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1C#N P16387 [0,1,0,1,0,0|1,0,1]=4 315 B10R1.135 CCOC(=O)[C@H]1C[C@H]1CO F50050 [0,1,0,1,0,0|1,0,0]=3 316 B10R1.137 CCOC(=O)CC1CNC1 D80644 [0,1,0,1,0,0|1,0,0]=3 317 B10R1.137 CCOC(=O)CC1COC1 82536 [0,1,0,1,0,0|1,0,0]=3 318 B10R1.138 CCOC(=O)\C=C\C1CC1 W10675 [0,1,0,1,0,0|0,0,2]=4 319 B10R1.15 CCC(=O)C1CCCCC1 F53827 [0,1,0,1,0,0|1,0,0]=3 320 B10R1.15 CNC(=O)[C@H]1CCCNC1 D75606 [0,1,0,1,0,0|1,0,0]=3 321 B10R1.15 CNC(=O)[C@H]1CCCNC1 P12591 [0,1,0,1,0,0|1,0,0]=3 322 B10R1.15 CNC(=O)[C@H]1CCCNC1 P12592 [0,1,0,1,0,0|1,0,0]=3 323 B10R1.15 COC(=O)C1=CCCNC1 AC6481 [0,1,0,1,0,0|0,0,2]=4 324 B10R1.15 COC(=O)C1=CCNCC1 31667 [0,1,0,1,0,0|0,0,2]=4 325 B10R1.15 COC(=O)C1=CNCCC1 P15502 [0,1,0,1,0,0|0,0,2]=4 326 B10R1.15 COC(=O)C1CCSCC1 74108 [0,1,0,1,0,0|0,0,0]=2 327 B10R1.15 COC(=O)N1CCOCC1 AC6632 [0,1,0,1,0,0|1,0,0]=3 328 B10R1.15 COC(=O)[C@@H]1COCCN1 25784 [0,1,0,1,0,0|1,0,0]=3 329 B10R1.15 COC(=O)[C@@H]1COCCN1 31155 [0,1,0,1,0,0|1,0,0]=3 330 B10R1.15 COC(=O)[C@@H]1COCCN1 P10713 [0,1,0,1,0,0|1,0,0]=3 331 B10R1.15 COC(=O)[C@H]1CCCNC1 P10578 [0,1,0,1,0,0|0,0,0]=2 332 B10R1.15 NCC(=O)N1CCCCC1 F21140 [0,1,0,1,0,0|2,0,0]=4 333 B10R1.15 NNC(=O)[C@H]1CCCOC1 P12180 [0,1,0,1,0,0|2,0,0]=4 334 B10R1.15 O=C(CBr)C1CCOCC1 P11188 [0,1,0,1,0,0|2,0,0]=4 335 B10R1.15 O=C(CBr)N1CCCCC1 S12026 [0,1,0,1,0,0|2,0,0]=4 336 B10R1.15 O=C(CO)C1CCCCC1 D93099 [0,1,0,1,0,0|2,0,0]=4 337 B10R1.169 COC(=O)C1CC(C=O)C1 F16729 [0,1,0,1,0,0|1,0,1]=4 338 B10R1.169 COC(=O)C1CC(CN)C1 P14518 [0,1,0,1,0,0|1,0,0]=3 339 B10R1.169 COC(=O)C1CC(CO)C1 W11147 [0,1,0,1,0,0|1,0,0]=3 340 B10R1.169 COC(=O)[C@H]1C[C@@H](CO)C1 D96731 [0,1,0,1,0,0|1,0,0]=3 341 B10R1.182 COC(=O)[C@@H](N)C1CCC1 67401 [0,1,0,1,0,0|0,0,0]=2 342 B10R1.182 COC(=O)[C@@H](N)C1CCC1 67408 [0,1,0,1,0,0|0,0,0]=2 343 B10R1.182 COC(=O)[C@@H](N)C1CCC1 F53592 [0,1,0,1,0,0|0,0,0]=2 344 B10R1.182 COC(=O)[C@@H](N)C1CCC1 F53678 [0,1,0,1,0,0|0,0,0]=2 345 B10R1.182 COC(=O)[C@@H](N)C1COC1 59697 [0,1,0,1,0,0|1,0,0]=3 346 B10R1.182 COC(=O)[C@@H](N)C1COC1 93236 [0,1,0,1,0,0|1,0,0]=3 347 B10R1.184 CNC(=O)[C@@H](N)CC1CC1 P18030 [0,1,0,1,0,0|1,0,0]=3 348 B10R1.184 COC(=O)[C@@H](O)CC1CC1 69648 [0,1,0,1,0,0|0,0,0]=2 349 B10R1.275 CN1CCCC[C@H](N)C1=O 66077 [0,1,0,1,0,0|1,0,0]=3 350 B10R1.411 CNC(=O)C1(N)CCCC1 P18998 [0,1,0,1,0,0|1,0,0]=3 351 B10R1.411 COC(=O)C1(Br)CCCC1 W12602 [0,1,0,1,0,0|0,0,0]=2 352 B10R1.411 COC(=O)C1(O)CCCC1 P15503 [0,1,0,1,0,0|0,0,0]=2 353 B10R1.411 COC(=O)[C@@]1(C)CCNC1 P11476 [0,1,0,1,0,0|1,0,0]=3 354 B10R1.411 COC(=O)[C@]1(Br)CCOC1 W19570 [0,1,0,1,0,0|1,0,0]=3 355 B10R1.411 COC(=O)[C@]1(C)CCCO1 38867 [0,1,0,1,0,0|1,0,0]=3 356 B10R1.411 COC(=O)[C@]1(F)CCNC1 72785 [0,1,0,1,0,0|1,0,0]=3 357 B10R1.411 COC(=O)[C@]1(N)CCOC1 P13106 [0,1,0,1,0,0|1,0,0]=3 358 B10R1.71 O=C1CCC(=O)OCCO1 D93050 [0,1,0,1,0,0|1,0,1]=4 359 B10R1.473 CC[N+]1(C)CCC(=O)CC1 83759 [0,1,0,1,0,0|2,0,0]=4 360 B10R1.27 C=CC(=O)NC1CCCC1 AB10373 [0,1,0,1,0,0|1,0,1]=4 361 B10R1.27 COC(=O)C[C@H]1CCCN1 27751 [0,1,0,1,0,0|0,0,0]=2 362 B10R1.27 COC(=O)C[C@H]1CCCN1 C74748 [0,1,0,1,0,0|0,0,0]=2 363 B10R1.27 COC(=O)C[C@H]1CCNC1 11209 [0,1,0,1,0,0|0,0,0]=2 364 B10R1.27 COC(=O)C[C@H]1CCNC1 11210 [0,1,0,1,0,0|0,0,0]=2 365 B10R1.149 COC(=O)C1=C(C)OCC1 W15954 [0,1,0,1,0,0|0,0,2]=4 366 B10R1.149 COC(=O)C1CNCC1C F21201 [0,1,0,1,0,0|0,0,0]=2 367 B10R1.149 COC(=O)[C@@H]1CCCN1C D94450 [0,1,0,1,0,0|0,0,0]=2 368 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N 30654 [0,1,0,1,0,0|0,0,0]=2 369 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N N12552 [0,1,0,1,0,0|0,0,0]=2 370 B10R1.149 COC(=O)[C@@H]1CCNC1=O 36442 [0,1,0,1,0,0|1,0,1]=4 371 B10R1.149 COC(=O)[C@@H]1CCOC1=O F31228 [0,1,0,1,0,0|1,0,1]=4 372 B10R1.149 COC(=O)[C@@H]1COC[C@@H]1N P15748 [0,1,0,1,0,0|1,0,0]=3 373 B10R1.149 COC(=O)[C@@H]1SCCC1=O 84770 [0,1,0,1,0,0|1,0,1]=4 374 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N D96592 [0,1,0,1,0,0|0,0,0]=2 375 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C 95112 [0,1,0,1,0,0|0,0,0]=2 376 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C P17333 [0,1,0,1,0,0|0,0,0]=2 377 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C P20900 [0,1,0,1,0,0|0,0,0]=2 378 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C S12236 [0,1,0,1,0,0|0,0,0]=2 379 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O 89325 [0,1,0,1,0,0|1,0,0]=3 380 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O P15500 [0,1,0,1,0,0|1,0,0]=3 381 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O P14684 [0,1,0,1,0,0|1,0,0]=3 382 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O VT1192 [0,1,0,1,0,0|1,0,0]=3 383 B10R1.390 COC[C@]1(C)CNC(=O)C1 AT19128 [0,1,0,1,0,0|2,0,0]=4 384 B10R1.1 N#CCC1CCC(=O)CC1 A10161 [0,1,0,1,0,0|1,0,1]=4 385 B10R1.1 O=C1CCC(CCO)CC1 AB7316 [0,1,0,1,0,0|1,0,0]=3 386 B10R1.16 CCCC[C@H]1CCC(=O)O1 AC2057 [0,1,0,1,0,0|1,0,0]=3 387 B10R1.161 O=CC1CCCCCCC1 59424 [0,1,0,1,0,0|1,0,1]=4 388 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 42244 [0,1,0,1,0,0|2,0,0]=4 389 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 C77916 [0,1,0,1,0,0|2,0,0]=4 390 B10R1.23 CN(C)C(=O)[C@H]1CCNC1 D80577 [0,1,0,1,0,0|2,0,0]=4 391 B10R1.23 C[C@H](O)C(=O)N1CCCC1 75158 [0,1,0,1,0,0|2,0,0]=4 392 B10R2.178 O=C1NCC2CCC1N2 P17879 [0,0,0,2,0,0|2,0,0]=4 393 B10R2.335 O=C1CCC2(CC1)CC2 71948 [0,0,0,2,0,0|1,0,0]=3 394 B10R2.2 O=C1CC2CSCC2C1 38018 [0,0,0,2,0,0|2,0,0]=4 395 B10R2.2 O=C1C[C@H]2CSC[C@@H]2C1 AT14674 [0,0,0,2,0,0|2,0,0]=4 396 B10R2.2 O=C1NC2CCCC2O1 N10687 [0,0,0,2,0,0|1,0,0]=3 397 B10R2.32 O=C1CCC2CNCC12 P10378 [0,0,0,2,0,0|2,0,0]=4 398 B10R2.332 O=C1CC2(CCC2)CN1 D73448 [0,0,0,2,0,0|1,0,0]=3 399 B10R2.332 O=C1CC2(CN1)COC2 84048 [0,0,0,2,0,0|2,0,0]=4 400 B10R2.332 O=C1CC2(CNC2)CN1 F16075 [0,0,0,2,0,0|2,0,0]=4 401 B10R2.332 O=C1CC2(CNC2)CN1 O10622 [0,0,0,2,0,0|2,0,0]=4 402 B10R2.332 O=C1COC2(CCC2)C1 D84838 [0,0,0,2,0,0|2,0,0]=4 403 B10R2.332 O=C1NC2(CCC2)CO1 F31393 [0,0,0,2,0,0|1,0,0]=3 404 B10R2.332 O=C1NCC2(CCC2)O1 37823 [0,0,0,2,0,0|2,0,0]=4 405 B10R2.3 O=C1CC[C@@]12CCOC2 84551 [0,0,0,2,0,0|2,0,0]=4