0 B6R0.1 CCOC(=O)C#N SPC-g163 [1,0,0,0,0,0|2,0,1]=4 1 B6R0.4 CC\C=C\C(=O)O SPC-t510 [1,0,0,0,0,0|1,0,2]=4 2 B6R0.6 ICCCCCI SPC-m904 [1,0,0,0,0,0|2,0,1]=4 3 B8R0.1 CCC#CC(=O)OCC SPC-t629 [0,1,0,0,0,0|0,0,2]=3 4 B8R1.1 CN1CC[C@@H](CN)C1 SPC-m834 [0,0,0,1,0,0|3,0,0]=4 5 B8R1.1 CN1CC[C@@H](CN)C1 SPC-m835 [0,0,0,1,0,0|3,0,0]=4 6 B8R1.1 CN1CC[C@@H](CO)C1 SPC-j335 [0,0,0,1,0,0|3,0,0]=4 7 B8R1.1 CN1CC[C@H](CN)C1 SPC-h345 [0,0,0,1,0,0|3,0,0]=4 8 B8R1.1 CN1CC[C@H](CN)C1 SPC-n837 [0,0,0,1,0,0|3,0,0]=4 9 B8R1.1 CN1CC[C@H](CO)C1 SPC-j334 [0,0,0,1,0,0|3,0,0]=4 10 B8R1.1 NC[C@@H]1CNC(=O)C1 SPC-m273 [0,0,0,1,0,0|2,0,0]=3 11 B8R1.1 NC[C@@H]1CNC(=O)C1 SPC-m274 [0,0,0,1,0,0|2,0,0]=3 12 B8R1.1 NC[C@@H]1CNC(=O)C1 SPC-p435 [0,0,0,1,0,0|2,0,0]=3 13 B8R1.1 NC[C@@H]1CNC(=O)O1 SPC-n802 [0,0,0,1,0,0|3,0,0]=4 14 B8R1.1 NC[C@H]1CNC(=O)C1 SPC-m271 [0,0,0,1,0,0|2,0,0]=3 15 B8R1.1 NC[C@H]1CNC(=O)C1 SPC-m272 [0,0,0,1,0,0|2,0,0]=3 16 B8R1.1 NC[C@H]1CNC(=O)O1 SPC-j887 [0,0,0,1,0,0|3,0,0]=4 17 B8R1.1 NC[C@H]1CNC(=O)O1 SPC-q943 [0,0,0,1,0,0|3,0,0]=4 18 B8R1.1 NC[C@H]1COC(=O)N1 SPC-p433 [0,0,0,1,0,0|3,0,0]=4 19 B8R1.1 O=C1CC[C@@H](CO)N1 SPC-g157 [0,0,0,1,0,0|2,0,0]=3 20 B8R1.1 O=C1CC[C@H](CO)N1 SPC-n804 [0,0,0,1,0,0|2,0,0]=3 21 B8R1.2 BrCC1=CCCCC1 SPC-j295 [0,0,0,1,0,0|2,0,0]=3 22 B8R1.2 OC[C@@H]1CCCCO1 SPC-v087 [0,0,0,1,0,0|1,0,2]=4 23 B8R1.2 OC[C@H]1CCCCO1 SPC-s718 [0,0,0,1,0,0|1,0,2]=4 24 B8R1.2 OC[C@H]1CCCCO1 SPC-v058 [0,0,0,1,0,0|1,0,2]=4 25 B8R1.3 CN1CCC(N)CC1 SPC-j190 [0,0,0,1,0,0|2,0,1]=4 26 B8R1.3 C[C@@H]1C=CC(=O)CC1 SPC-s978 [0,0,0,1,0,0|0,0,2]=3 27 B8R1.3 C[C@@H]1CNC(=O)CN1 SPC-u069 [0,0,0,1,0,0|2,0,0]=3 28 B8R1.3 C[C@H]1CCC(=O)NC1 SPC-p145 [0,0,0,1,0,0|1,0,0]=2 29 B8R1.3 C[C@H]1CC[C@@H](O)CN1 SPC-u032 [0,0,0,1,0,0|1,0,2]=4 30 B8R1.3 C[C@H]1CNC(=O)CN1 SPC-n806 [0,0,0,1,0,0|2,0,0]=3 31 B8R1.3 N[C@@H]1CCC(=O)NC1 SPC-r045 [0,0,0,1,0,0|2,0,0]=3 32 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-h503 [0,0,0,1,0,0|2,0,0]=3 33 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-r044 [0,0,0,1,0,0|2,0,0]=3 34 B8R1.3 N[C@H]1CC[C@@H](O)CC1 SPC-g837 [0,0,0,1,0,0|1,0,2]=4 35 B8R1.3 N[C@H]1CC[C@@H](O)CC1 SPC-k248 [0,0,0,1,0,0|1,0,2]=4 36 B8R1.3 O=C1CCC(F)CC1 SPC-u525 [0,0,0,1,0,0|1,0,0]=2 37 B8R1.3 O[C@H]1CC[C@@H](O)CC1 SPC-n343 [0,0,0,1,0,0|1,0,2]=4 38 B8R1.3 O[C@H]1CC[C@H](O)CC1 SPC-n631 [0,0,0,1,0,0|1,0,2]=4 39 B8R1.5 CC1CCNCC1O SPC-p589 [0,0,0,1,0,0|1,0,2]=4 40 B8R1.5 CC1CNCCC1O SPC-m644 [0,0,0,1,0,0|1,0,2]=4 41 B8R1.5 CN1CCNCC1=O SPC-j564 [0,0,0,1,0,0|2,0,0]=3 42 B8R1.5 CN1CCNCC1=O SPC-r023 [0,0,0,1,0,0|2,0,0]=3 43 B8R1.5 C[C@@H]1CCCN[C@@H]1C SPC-u259 [0,0,0,1,0,0|2,0,1]=4 44 B8R1.5 C[C@@H]1CCNC[C@H]1O SPC-q479 [0,0,0,1,0,0|1,0,2]=4 45 B8R1.5 C[C@@H]1CNCCN1C SPC-j879 [0,0,0,1,0,0|3,0,0]=4 46 B8R1.5 C[C@@H]1CNCCN1C SPC-r024 [0,0,0,1,0,0|3,0,0]=4 47 B8R1.5 C[C@H]1CCNC[C@H]1O SPC-p949 [0,0,0,1,0,0|1,0,2]=4 48 B8R1.5 C[C@H]1CNCCC1=O SPC-n076 [0,0,0,1,0,0|1,0,0]=2 49 B8R1.5 C[C@H]1CNCCN1C SPC-k695 [0,0,0,1,0,0|3,0,0]=4 50 B8R1.5 C[C@H]1CNCCN1C SPC-m797 [0,0,0,1,0,0|3,0,0]=4 51 B8R1.5 C[C@H]1COCCC1=O SPC-p410 [0,0,0,1,0,0|1,0,0]=2 52 B8R1.5 N[C@@H]1CCCC[C@H]1F SPC-v023 [0,0,0,1,0,0|2,0,1]=4 53 B8R1.5 N[C@@H]1CCCC[C@H]1N SPC-k252 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.5 N[C@@H]1CCCC[C@H]1O SPC-t809 [0,0,0,1,0,0|1,0,2]=4 55 B8R1.5 O=C1CCNC[C@@H]1F SPC-g858 [0,0,0,1,0,0|2,0,0]=3 56 B8R1.5 O=C1CCOC[C@@H]1Br SPC-h143 [0,0,0,1,0,0|2,0,0]=3 57 B8R1.5 O=C1CCOC[C@@H]1F SPC-p380 [0,0,0,1,0,0|2,0,0]=3 58 B8R1.22 F[C@H]1CCCNCC1 SPC-p568 [0,0,0,1,0,0|2,0,1]=4 59 B8R1.22 O=C1CCNCCN1 SPC-q669 [0,0,0,1,0,0|2,0,0]=3 60 B8R1.38 COC(=O)C1CNC1 SPC-g203 [0,0,0,1,0,0|2,0,0]=3 61 B8R1.38 COC(=O)C1COC1 SPC-i614 [0,0,0,1,0,0|2,0,0]=3 62 B8R1.38 COC(=O)[C@@H]1CCN1 SPC-h839 [0,0,0,1,0,0|2,0,0]=3 63 B8R1.38 COC(=O)[C@@H]1CCN1 SPC-m118 [0,0,0,1,0,0|2,0,0]=3 64 B8R1.38 COC(=O)[C@H]1CCN1 SPC-h849 [0,0,0,1,0,0|2,0,0]=3 65 B8R1.38 O=C(CBr)C1CCC1 SPC-t926 [0,0,0,1,0,0|1,0,0]=2 66 B8R1.40 COC(=O)CC1CC1 SPC-k723 [0,0,0,1,0,0|1,0,0]=2 67 B8R1.47 CCN1CC(CN)C1 SPC-u779 [0,0,0,1,0,0|3,0,0]=4 68 B8R1.52 NCC1(F)CCCC1 SPC-s642 [0,0,0,1,0,0|2,0,1]=4 69 B8R1.52 NCC1(O)CCCC1 SPC-n897 [0,0,0,1,0,0|1,0,2]=4 70 B8R1.52 NCC1(O)CCCC1 SPC-s734 [0,0,0,1,0,0|1,0,2]=4 71 B5R0.1 CCC[C@H](C)N SPC-k309 [2,0,0,0,0,0|1,0,1]=4 72 B7R0.5 CC(C)C(=O)OCCl SPC-n339 [1,1,0,0,0,0|2,0,0]=4 73 B7R0.5 CN(C)C(=O)CCN SPC-t561 [1,1,0,0,0,0|2,0,0]=4 74 B7R0.7 [C-]#[N+]CC(=O)OCC SPC-q003 [1,1,0,0,0,0|1,0,1]=4 75 B7R1.1 BrCC1=CCCC1 SPC-n905 [1,0,0,1,0,0|2,0,0]=4 76 B7R1.2 C[C@@H]1CNC(=O)C1 SPC-r288 [1,0,0,1,0,0|1,0,0]=3 77 B7R1.2 C[C@H]1CNC(=O)C1 SPC-n787 [1,0,0,1,0,0|1,0,0]=3 78 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m128 [1,0,0,1,0,0|2,0,0]=4 79 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m129 [1,0,0,1,0,0|2,0,0]=4 80 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m820 [1,0,0,1,0,0|2,0,0]=4 81 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-t534 [1,0,0,1,0,0|2,0,0]=4 82 B7R1.2 O=C1CCC(=O)C1 SPC-h715 [1,0,0,1,0,0|1,0,1]=4 83 B7R1.2 O=C1CC[C@H](O)C1 SPC-q537 [1,0,0,1,0,0|1,0,0]=3 84 B7R1.2 O=C1C[C@@H](O)CN1 SPC-s696 [1,0,0,1,0,0|2,0,0]=4 85 B7R1.2 O=C1C[C@@H](S)CN1 SPC-u488 [1,0,0,1,0,0|2,0,0]=4 86 B7R1.3 C=C1CCOCC1 SPC-m646 [1,0,0,1,0,0|2,0,0]=4 87 B7R1.3 O=C1CCCNC1 SPC-q237 [1,0,0,1,0,0|1,0,0]=3 88 B7R1.3 O=C1CCCOC1 SPC-g865 [1,0,0,1,0,0|1,0,0]=3 89 B7R1.3 O=C1CCCSC1 SPC-k221 [1,0,0,1,0,0|1,0,0]=3 90 B7R1.3 O=C1CCOCC1 SPC-g072 [1,0,0,1,0,0|1,0,0]=3 91 B7R1.3 O=C1CCSCC1 SPC-g130 [1,0,0,1,0,0|1,0,0]=3 92 B7R1.3 O=C1CNCCN1 SPC-g151 [1,0,0,1,0,0|2,0,0]=4 93 B7R1.3 O=C1COCCN1 SPC-g147 [1,0,0,1,0,0|2,0,0]=4 94 B7R1.4 N[C@H]1CCNC1=O SPC-u507 [1,0,0,1,0,0|2,0,0]=4 95 B7R1.4 N[C@H]1CCOC1=O SPC-s908 [1,0,0,1,0,0|2,0,0]=4 96 B7R1.8 O=C1CC[C@@H]1CO SPC-p096 [1,0,0,1,0,0|1,0,0]=3 97 B7R1.22 CC[C@H](N)C1CC1 SPC-n986 [1,0,0,1,0,0|1,0,1]=4 98 B7R1.22 NNC(=O)C1CC1 SPC-g371 [1,0,0,1,0,0|2,0,0]=4 99 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O SPC-v344 [1,0,0,1,0,0|1,0,0]=3 100 B7R1.12 C[C@@H]1C[C@H]1C(=O)O SPC-t366 [1,0,0,1,0,0|1,0,0]=3 101 B7R1.12 C[C@H]1C[C@H]1C(=O)O SPC-t640 [1,0,0,1,0,0|1,0,0]=3 102 B7R1.12 C[C@H]1C[C@H]1C(=O)O SPC-v485 [1,0,0,1,0,0|1,0,0]=3 103 B7R1.12 O=C(O)C1CC1F SPC-s871 [1,0,0,1,0,0|2,0,0]=4 104 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SPC-s015 [1,0,0,1,0,0|2,0,0]=4 105 B7R1.12 O=C(O)[C@@H]1C[C@H]1F SPC-s012 [1,0,0,1,0,0|2,0,0]=4 106 B7R1.12 O=C(O)[C@@H]1C[C@H]1F SPC-t365 [1,0,0,1,0,0|2,0,0]=4 107 B7R1.12 O=C(O)[C@H]1C[C@@H]1F SPC-s008 [1,0,0,1,0,0|2,0,0]=4 108 B7R1.12 O=C(O)[C@H]1C[C@H]1F SPC-s005 [1,0,0,1,0,0|2,0,0]=4 109 B7R1.12 O=C(O)[C@H]1C[C@H]1F SPC-t140 [1,0,0,1,0,0|2,0,0]=4 110 B7R1.14 N=S1(=O)CCCC1 SPC-w059 [1,0,0,1,0,0|2,0,0]=4 111 B7R1.18 CC(=O)C1CCC1 SPC-h776 [1,0,0,1,0,0|0,0,0]=2 112 B7R1.18 CC(=O)C1COC1 SPC-r005 [1,0,0,1,0,0|1,0,0]=3 113 B7R1.18 C[C@H](N)C1CCC1 SPC-i309 [1,0,0,1,0,0|1,0,1]=4 114 B7R1.18 C[C@H](O)C1CCC1 SPC-u195 [1,0,0,1,0,0|0,0,2]=4 115 B7R1.18 N=C(N)C1CCC1 SPC-h880 [1,0,0,1,0,0|2,0,0]=4 116 B7R1.18 NC(=O)C1CNC1 SPC-h816 [1,0,0,1,0,0|2,0,0]=4 117 B7R1.18 O=C(O)C1CCC1 SPC-a107 [1,0,0,1,0,0|1,0,0]=3 118 B7R1.18 O=C(O)C1CNC1 SPC-g671 [1,0,0,1,0,0|2,0,0]=4 119 B7R1.18 O=C(O)C1COC1 SPC-a017 [1,0,0,1,0,0|2,0,0]=4 120 B7R1.18 O=C(O)C1CSC1 SPC-a106 [1,0,0,1,0,0|2,0,0]=4 121 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-g935 [1,0,0,1,0,0|2,0,0]=4 122 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-h064 [1,0,0,1,0,0|2,0,0]=4 123 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-a304 [1,0,0,1,0,0|2,0,0]=4 124 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-u910 [1,0,0,1,0,0|2,0,0]=4 125 B7R1.18 O=C(O)[C@H]1CCN1 SPC-h200 [1,0,0,1,0,0|2,0,0]=4 126 B7R1.18 O=C(O)[C@H]1CCO1 SPC-u911 [1,0,0,1,0,0|2,0,0]=4 127 B7R1.20 O=C(O)CC1CC1 SPC-g479 [1,0,0,1,0,0|1,0,0]=3 128 B7R1.20 O=C(O)C[C@H]1CO1 SPC-v405 [1,0,0,1,0,0|2,0,0]=4 129 B9R1.2 CCN1CCNC(=O)C1 SPC-t007 [0,1,0,1,0,0|1,0,0]=3 130 B9R1.2 NC[C@H]1CCNC(=O)C1 SPC-j120 [0,1,0,1,0,0|1,0,0]=3 131 B9R1.2 O=C1C[C@@H](CO)CCN1 SPC-j635 [0,1,0,1,0,0|1,0,0]=3 132 B9R1.7 CCN[C@H]1CCN(C)C1 SPC-t781 [0,1,0,1,0,0|2,0,0]=4 133 B9R1.7 CN1CC[C@H](CCN)C1 SPC-p069 [0,1,0,1,0,0|2,0,0]=4 134 B9R1.7 CN1CC[C@H](CCO)C1 SPC-j220 [0,1,0,1,0,0|2,0,0]=4 135 B9R1.8 CNCC1CCCCC1 SPC-v381 [0,1,0,1,0,0|1,0,1]=4 136 B9R1.8 ClCCN1CCCCC1 SPC-r409 [0,1,0,1,0,0|2,0,0]=4 137 B9R1.8 NCCN1CCCCC1 SPC-g106 [0,1,0,1,0,0|2,0,0]=4 138 B9R1.8 OCC[C@@H]1CCCCN1 SPC-s721 [0,1,0,1,0,0|1,0,1]=4 139 B9R1.15 CO[C@H]1COCCC1=O SPC-h609 [0,1,0,1,0,0|1,0,0]=3 140 B9R1.22 O=C1C[C@H](O)[C@@H](CO)O1 SPC-m818 [0,1,0,1,0,0|2,0,0]=4 141 B9R1.48 C[C@H]1CC(=O)NCCN1 SPC-p861 [0,1,0,1,0,0|2,0,0]=4 142 B9R1.49 CN1CCC[C@H](N)CC1 SPC-j079 [0,1,0,1,0,0|1,0,1]=4 143 B9R1.69 CN1CC[C@H](N)CC1=O SPC-h540 [0,1,0,1,0,0|1,0,0]=3 144 B9R1.69 CN1C[C@@H](N)CCC1=O SPC-j654 [0,1,0,1,0,0|1,0,0]=3 145 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 SPC-t564 [0,1,0,1,0,0|2,0,0]=4 146 B9R1.69 C[C@H]1CN(C)C(=O)CN1 SPC-u382 [0,1,0,1,0,0|2,0,0]=4 147 B9R1.69 C[C@H]1CNC(=O)[C@H](C)N1 SPC-u935 [0,1,0,1,0,0|1,0,0]=3 148 B9R1.73 CCOC(=O)C1CCC1 SPC-q614 [0,1,0,1,0,0|0,0,0]=2 149 B9R1.73 CCOC(=O)C1CNC1 SPC-g636 [0,1,0,1,0,0|1,0,0]=3 150 B9R1.73 CCOC(=O)[C@@H]1CCO1 SPC-m749 [0,1,0,1,0,0|1,0,0]=3 151 B9R1.75 CCOC(=O)CC1CC1 SPC-q002 [0,1,0,1,0,0|0,0,0]=2 152 B9R1.117 CCCCC1(O)COC1 SPC-w031 [0,1,0,1,0,0|0,0,2]=4 153 B9R1.3 CN1CCC[C@H](N)C1=O SPC-m069 [0,1,0,1,0,0|1,0,0]=3 154 B9R1.11 COC(=O)C1CC=CC1 SPC-n455 [0,1,0,1,0,0|1,0,1]=4 155 B9R1.11 COC(=O)[C@@H]1CCNC1 SPC-j204 [0,1,0,1,0,0|1,0,0]=3 156 B9R1.11 COC(=O)[C@@H]1CCNC1 SPC-j205 [0,1,0,1,0,0|1,0,0]=3 157 B9R1.11 COC(=O)[C@@H]1CCOC1 SPC-h930 [0,1,0,1,0,0|1,0,0]=3 158 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-g645 [0,1,0,1,0,0|1,0,0]=3 159 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-j202 [0,1,0,1,0,0|1,0,0]=3 160 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-j203 [0,1,0,1,0,0|1,0,0]=3 161 B9R1.11 COC(=O)[C@H]1CCOC1 SPC-j338 [0,1,0,1,0,0|1,0,0]=3 162 B9R1.11 COC(=O)[C@H]1CCOC1 SPC-q074 [0,1,0,1,0,0|1,0,0]=3 163 B9R1.82 C=C1CC(C(=O)OC)C1 SPC-h791 [0,1,0,1,0,0|1,0,1]=4 164 B9R1.82 COC(=O)C1CC(=O)C1 SPC-g763 [0,1,0,1,0,0|1,0,1]=4 165 B9R1.82 COC(=O)C1CC(Br)C1 SPC-h673 [0,1,0,1,0,0|1,0,0]=3 166 B9R1.82 COC(=O)C1CC(Cl)C1 SPC-h318 [0,1,0,1,0,0|1,0,0]=3 167 B9R1.82 COC(=O)C1CC(N)C1 SPC-k185 [0,1,0,1,0,0|1,0,0]=3 168 B9R1.82 COC(=O)C1CC(O)C1 SPC-h741 [0,1,0,1,0,0|1,0,0]=3 169 B9R1.82 COC(=O)N1CC(O)C1 SPC-q678 [0,1,0,1,0,0|2,0,0]=4 170 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 SPC-h432 [0,1,0,1,0,0|1,0,0]=3 171 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 SPC-i358 [0,1,0,1,0,0|1,0,0]=3 172 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 SPC-h525 [0,1,0,1,0,0|1,0,0]=3 173 B9R1.82 O=C(CCl)N1CC(O)C1 SPC-u464 [0,1,0,1,0,0|2,0,0]=4 174 B9R1.186 COC(=O)C1(C)CNC1 SPC-i606 [0,1,0,1,0,0|2,0,0]=4 175 B9R1.186 COC(=O)C1(F)CNC1 SPC-i192 [0,1,0,1,0,0|2,0,0]=4 176 B9R1.186 COC(=O)C1(N)CCC1 SPC-t828 [0,1,0,1,0,0|1,0,0]=3 177 B9R1.186 COC(=O)C1(N)COC1 SPC-i071 [0,1,0,1,0,0|2,0,0]=4 178 B9R1.186 COC(=O)[C@]1(C)CCN1 SPC-v107 [0,1,0,1,0,0|2,0,0]=4 179 B9R1.1 CCN1CCC(O)CC1 SPC-q210 [0,1,0,1,0,0|0,0,2]=4 180 B9R1.1 CN1CCC(CN)CC1 SPC-j217 [0,1,0,1,0,0|2,0,0]=4 181 B9R1.1 CN1CCC(CO)CC1 SPC-g352 [0,1,0,1,0,0|2,0,0]=4 182 B9R1.1 CNC1CCN(C)CC1 SPC-u079 [0,1,0,1,0,0|2,0,0]=4 183 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 SPC-m222 [0,1,0,1,0,0|0,0,2]=4 184 B9R1.1 CN[C@H]1CC[C@H](O)CC1 SPC-m223 [0,1,0,1,0,0|0,0,2]=4 185 B9R1.1 CO[C@H]1CC[C@H](N)CC1 SPC-t444 [0,1,0,1,0,0|1,0,1]=4 186 B9R1.1 NC[C@H]1CCC(=O)NC1 SPC-n169 [0,1,0,1,0,0|1,0,0]=3 187 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 SPC-p950 [0,1,0,1,0,0|0,0,2]=4 188 B9R1.1 NC[C@H]1CC[C@H](O)CC1 SPC-j864 [0,1,0,1,0,0|0,0,2]=4 189 B9R1.1 O=C1CO[C@@H](CO)CN1 SPC-u038 [0,1,0,1,0,0|2,0,0]=4 190 B9R1.1 O=C1CO[C@H](CO)CN1 SPC-v317 [0,1,0,1,0,0|2,0,0]=4 191 B9R1.79 COC(=O)CC1CNC1 SPC-g986 [0,1,0,1,0,0|1,0,0]=3 192 B9R1.79 COC(=O)CC1COC1 SPC-i599 [0,1,0,1,0,0|1,0,0]=3 193 B9R1.81 COC(=O)C1CNC1C SPC-q103 [0,1,0,1,0,0|1,0,0]=3 194 B9R1.81 COC(=O)C1CNC1C SPC-q103 [0,1,0,1,0,0|1,0,0]=3 195 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N SPC-q173 [0,1,0,1,0,0|1,0,0]=3 196 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N SPC-u663 [0,1,0,1,0,0|1,0,0]=3 197 B9R1.118 CCC1(N)CCOCC1 SPC-p229 [0,1,0,1,0,0|1,0,1]=4 198 B9R1.118 CCC1(O)CCNCC1 SPC-k144 [0,1,0,1,0,0|0,0,2]=4 199 B9R1.23 CN1C[C@@H](CN)CC1=O SPC-n100 [0,1,0,1,0,0|2,0,0]=4 200 B9R1.23 CN1C[C@@H](CO)CC1=O SPC-s965 [0,1,0,1,0,0|2,0,0]=4 201 B9R1.35 CC(C)[C@H]1COC(=O)N1 SPC-s088 [0,1,0,1,0,0|2,0,0]=4 202 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 SPC-h594 [0,1,0,1,0,0|1,0,1]=4 203 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-h678 [0,1,0,1,0,0|1,0,1]=4 204 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-k770 [0,1,0,1,0,0|1,0,1]=4 205 B9R1.40 CC1(C)CNCCC1=O SPC-m184 [0,1,0,1,0,0|1,0,0]=3 206 B9R1.40 CC1(C)COCCC1=O SPC-p302 [0,1,0,1,0,0|1,0,0]=3 207 B9R1.40 CC1(C)NCCNC1=O SPC-j925 [0,1,0,1,0,0|2,0,0]=4 208 B9R1.106 CC1(C)C(=O)NC[C@@H]1N SPC-k551 [0,1,0,1,0,0|2,0,0]=4 209 B9R1.106 CC1(C)C(=O)NC[C@@H]1N SPC-u282 [0,1,0,1,0,0|2,0,0]=4 210 B9R1.106 CC1(C)C(=O)NC[C@H]1N SPC-n789 [0,1,0,1,0,0|2,0,0]=4 211 B9R1.110 CN(C)C(=O)C1CNC1 SPC-i651 [0,1,0,1,0,0|2,0,0]=4 212 B9R1.10 CC1(C)CCC(=O)CC1 SPC-r386 [0,1,0,1,0,0|0,0,0]=2 213 B9R1.10 CC1(C)CNC(=O)CN1 SPC-p617 [0,1,0,1,0,0|2,0,0]=4 214 B9R1.10 CC1(O)CCC(N)CC1 SPC-m732 [0,1,0,1,0,0|1,0,1]=4 215 B9R1.10 NC1CCS(=O)(=O)CC1 SPC-a112 [0,1,0,1,0,0|2,0,0]=4 216 B9R1.10 NC1CCS(=O)(=O)CC1 SPC-m890 [0,1,0,1,0,0|2,0,0]=4 217 B9R1.10 O=C1CCC(F)(F)CC1 SPC-g678 [0,1,0,1,0,0|1,0,0]=3 218 B9R1.10 O=C1CCC(F)(F)CN1 SPC-m328 [0,1,0,1,0,0|2,0,0]=4 219 B9R2.68 C1CC2CCC(C1)N2 SPC-n293 [0,0,0,2,0,0|1,0,1]=4 220 B9R2.110 NC12CCC(CC1)C2 SPC-a480a [0,0,0,2,0,0|1,0,1]=4 221 B9R2.139 O=C1CC2(CC2)CN1 SPC-b633 [0,0,0,2,0,0|1,0,0]=3 222 B9R2.139 O=C1CC2(CC2)CO1 SPC-t063 [0,0,0,2,0,0|1,0,0]=3 223 B9R2.49 C1CC2CCC1CN2 SPC-m957 [0,0,0,2,0,0|1,0,1]=4 224 B9R2.53 O=C1C2CNCC1C2 SPC-i426 [0,0,0,2,0,0|1,0,0]=3 225 B9R2.123 NC1C2CCCCC12 SPC-v263 [0,0,0,2,0,0|1,0,1]=4 226 B9R2.174 C1CCC2(CC2)NC1 SPC-b083 [0,0,0,2,0,0|1,0,1]=4 227 B9R2.6 NC12CCCCC1C2 SPC-u593 [0,0,0,2,0,0|1,0,1]=4 228 B9R2.109 O=C1CCCC2CC12 SPC-p917 [0,0,0,2,0,0|0,0,0]=2 229 B9R2.140 O=C1COC12CCC2 SPC-b272 [0,0,0,2,0,0|1,0,0]=3 230 B9R2.140 O=C1NCC12CCC2 SPC-b647 [0,0,0,2,0,0|1,0,0]=3 231 B9R2.173 C1CCC2(C1)CCN2 SPC-b260 [0,0,0,2,0,0|1,0,1]=4 232 B9R2.173 C1CCC2(C1)CCN2 SPC-b260 [0,0,0,2,0,0|1,0,1]=4