0 B6R0.6 C#CCNCCBr D73839 [0,0,0,0,0,0|2,0,1]=3 1 B6R0.6 COCOCCN AC9200 [0,0,0,0,0,0|3,0,0]=3 2 B6R0.6 Cl[13CH2][13CH2]N[13CH2][13CH2]Cl AT23538 [0,0,0,0,0,0|2,0,0]=2 3 B6R0.6 NCCOCCS AT12749 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.6 NNCCCCO AB9420 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.2 C#CCNOC AT24887 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.2 C=CCNOC AT24925 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.2 CCNCCS AT25561 [1,0,0,0,0,0|1,0,0]=2 8 B5R0.2 CCOCC=O AT18655 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 CNCCCF AT22549 [1,0,0,0,0,0|3,0,0]=4 10 B5R0.2 CSSCCN AT25568 [1,0,0,0,0,0|2,0,0]=3 11 B5R0.2 NCCCCF D75976 [1,0,0,0,0,0|1,0,0]=2 12 B5R0.2 NCCCCS AT25915 [1,0,0,0,0,0|1,0,0]=2 13 B5R0.2 O=CCCCBr AT24507 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.1 C#CCCCCCN D76475 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.1 CCCNNCCC D79943 [0,1,0,0,0,0|2,0,0]=3 16 B7R0.1 NCCCNCCS W12622 [0,1,0,0,0,0|1,0,0]=2 17 B7R0.1 NCCC\C=C\CO AT22200 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.1 NCCSSCCO C70186 [0,1,0,0,0,0|2,0,0]=3 19 B7R0.1 NOCCOCCO C70226 [0,1,0,0,0,0|2,0,0]=3 20 B7R0.3 C[C@H](CN)CCCO AC9867 [0,1,0,0,0,0|2,0,0]=3 21 B7R0.3 O=C(CO)NCCO D86391 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.4 C[S@](=O)CCCCN AT23964 [0,1,0,0,0,0|3,0,0]=4 23 B7R0.4 FC(F)COCCS AT25479 [0,1,0,0,0,0|3,0,0]=4 24 B7R0.4 NCCCCC(N)=O D77059 [0,1,0,0,0,0|1,0,1]=3 25 B7R1.1 CC[C@H]1CCCN1 RB4030 [0,0,0,1,0,0|2,0,0]=3 26 B7R1.1 FC[C@H]1CCCN1 P12557 [0,0,0,1,0,0|2,0,0]=3 27 B7R1.1 NC[C@@H]1C=CCC1 E73245 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.1 OC[C@H]1CCON1 AT14857 [0,0,0,1,0,0|3,0,0]=4 29 B7R1.3 C[C@H]1CNCCS1 AT10752 [0,0,0,1,0,0|2,0,0]=3 30 B7R1.3 C[C@H]1CSCCN1 AT10757 [0,0,0,1,0,0|2,0,0]=3 31 B7R1.3 N[C@@H]1CC=CCC1 AT10535 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.3 N[C@@H]1CC=CCC1 AT10537 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.3 N[C@@H]1CCCCN1 F13375 [0,0,0,1,0,0|1,0,0]=2 34 B7R1.4 CC1CNCC1N AT23640 [0,0,0,1,0,0|1,0,0]=2 35 B7R1.4 C[C@@H]1COC[C@@H]1O 73075 [0,0,0,1,0,0|3,0,0]=4 36 B7R1.4 C[C@H]1CNC[C@@H]1N AT23637 [0,0,0,1,0,0|1,0,0]=2 37 B7R1.4 C[C@H]1CNC[C@@H]1N AT23638 [0,0,0,1,0,0|1,0,0]=2 38 B7R1.4 C[C@H]1CNC[C@@H]1N AT23639 [0,0,0,1,0,0|1,0,0]=2 39 B7R1.4 C[C@H]1CNC[C@@H]1O P12669 [0,0,0,1,0,0|2,0,0]=3 40 B7R1.4 C[C@H]1COC[C@@H]1N D72913 [0,0,0,1,0,0|2,0,0]=3 41 B7R1.4 NC1COCC1F E72312 [0,0,0,1,0,0|2,0,0]=3 42 B7R1.4 N[C@@H]1CNC[C@@H]1F D75765 [0,0,0,1,0,0|1,0,0]=2 43 B7R1.4 N[C@@H]1COC[C@@H]1F D72819 [0,0,0,1,0,0|2,0,0]=3 44 B7R1.4 N[C@@H]1CSC[C@@H]1O D72825 [0,0,0,1,0,0|2,0,0]=3 45 B7R1.4 N[C@H]1CCC[C@H]1N F16268 [0,0,0,1,0,0|1,0,0]=2 46 B7R1.4 N[C@H]1COC[C@@H]1O AT26726 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.4 N[C@H]1CSC[C@@H]1O D72826 [0,0,0,1,0,0|2,0,0]=3 48 B7R1.5 CCO[C@H]1C[C@@H]1N AT11448 [0,0,0,1,0,0|3,0,0]=4 49 B7R1.6 NCCC1CNC1 AC9109 [0,0,0,1,0,0|3,0,0]=4 50 B7R1.7 OCCOC1CC1 AT11518 [0,0,0,1,0,0|3,0,0]=4 51 B7R1.8 COC1CCC1N AT20027 [0,0,0,1,0,0|3,0,0]=4 52 B7R1.8 CO[C@H]1CC[C@@H]1N AT20051 [0,0,0,1,0,0|3,0,0]=4 53 B7R1.8 CO[C@H]1CC[C@@H]1N AT20055 [0,0,0,1,0,0|3,0,0]=4 54 B7R1.8 CO[C@H]1CC[C@H]1N AT20049 [0,0,0,1,0,0|3,0,0]=4 55 B7R1.8 CO[C@H]1CC[C@H]1N AT20056 [0,0,0,1,0,0|3,0,0]=4 56 B7R1.8 CO[C@H]1CC[C@H]1N AT20057 [0,0,0,1,0,0|3,0,0]=4 57 B7R1.8 NC[C@H]1CC[C@@H]1O AT20432 [0,0,0,1,0,0|2,0,0]=3 58 B7R1.8 OC[C@@H]1CC[C@@H]1O P19439 [0,0,0,1,0,0|3,0,0]=4 59 B7R1.9 NC[C@H]1C[C@@H]1CO AT20739 [0,0,0,1,0,0|2,0,0]=3 60 B7R1.9 OC[C@H]1C[C@@H]1CO AT12393 [0,0,0,1,0,0|3,0,0]=4 61 B4R0.2 NOCCF AT14503 [2,0,0,0,0,0|2,0,0]=4 62 B6R0.1 C=CC[C@H](O)CN AT10909 [1,1,0,0,0,0|1,0,1]=4 63 B6R0.1 C=CC[C@H](O)CN AT10910 [1,1,0,0,0,0|1,0,1]=4 64 B6R0.1 CCC[C@H](N)CF AC5307 [1,1,0,0,0,0|2,0,0]=4 65 B6R0.1 CCC[C@H](N)CF AC7092 [1,1,0,0,0,0|2,0,0]=4 66 B6R0.1 CC[C@H](N)CCO AT14304 [1,1,0,0,0,0|2,0,0]=4 67 B6R0.1 CC[C@H](N)CCO AT22343 [1,1,0,0,0,0|2,0,0]=4 68 B6R0.1 CC[C@H](N)CCO AT22346 [1,1,0,0,0,0|2,0,0]=4 69 B6R0.1 CC[C@H](O)CON AT14514 [1,1,0,0,0,0|2,0,0]=4 70 B6R0.1 COC[C@@H](F)CN P20360 [1,1,0,0,0,0|2,0,0]=4 71 B6R0.1 N[C@H](CF)CCO AT24448 [1,1,0,0,0,0|2,0,0]=4 72 B6R0.1 N[C@H](CO)CCF E72842 [1,1,0,0,0,0|2,0,0]=4 73 B6R0.1 N[C@H](CO)CCO D75100 [1,1,0,0,0,0|2,0,0]=4 74 B6R0.1 OCC[C@H](O)CCl AT21895 [1,1,0,0,0,0|2,0,0]=4 75 B6R0.4 CC#CC[C@H](C)N AT21841 [1,1,0,0,0,0|1,0,1]=4 76 B6R0.4 CC(=O)CCCN C77428 [1,1,0,0,0,0|1,0,1]=4 77 B6R0.4 CCNCC(F)F AT23781 [1,1,0,0,0,0|1,0,0]=3 78 B6R0.4 NCCCC(F)F D75977 [1,1,0,0,0,0|1,0,0]=3 79 B6R0.4 NCCOC(F)F AT12486 [1,1,0,0,0,0|2,0,0]=4 80 B6R0.4 NCCSC(F)F AT25569 [1,1,0,0,0,0|2,0,0]=4 81 B8R0.1 NOCC(=O)NCCO AT10370 [0,2,0,0,0,0|1,0,1]=4 82 B8R0.4 C#CCCCCCCN AT24987 [0,2,0,0,0,0|2,0,0]=4 83 B8R0.4 C#CCCCCCCN D76981 [0,2,0,0,0,0|2,0,0]=4 84 B8R0.4 COCCOCCON C70681 [0,2,0,0,0,0|2,0,0]=4 85 B8R0.7 C#CCNCCN(C)C AT25986 [0,2,0,0,0,0|1,0,1]=4 86 B8R0.7 NCCCOCC(F)F E72835 [0,2,0,0,0,0|2,0,0]=4 87 B8R0.28 FC(F)CNCC(F)F AT23780 [0,2,0,0,0,0|2,0,0]=4 88 B6R1.2 Br[C@H]1CCNC1 D87521 [1,0,0,1,0,0|1,0,0]=3 89 B6R1.3 NCCN1CC1 P18027 [1,0,0,1,0,0|0,0,0]=2 90 B6R1.3 OCC[C@H]1CO1 D72936 [1,0,0,1,0,0|2,0,0]=4 91 B6R1.3 OCC[C@H]1CO1 D74321 [1,0,0,1,0,0|2,0,0]=4 92 B6R1.4 CC1CCC1N AT10478 [1,0,0,1,0,0|1,0,0]=3 93 B6R1.4 CC1CCC1O AC8042 [1,0,0,1,0,0|2,0,0]=4 94 B6R1.4 CC1CNC1C E72893 [1,0,0,1,0,0|1,0,0]=3 95 B6R1.4 C[C@@H]1NC[C@@H]1F AT24718 [1,0,0,1,0,0|1,0,0]=3 96 B6R1.4 C[C@@H]1NC[C@@H]1F AT24722 [1,0,0,1,0,0|1,0,0]=3 97 B6R1.4 C[C@H]1NC[C@@H]1F AT24723 [1,0,0,1,0,0|1,0,0]=3 98 B6R1.4 C[C@H]1NC[C@@H]1F D79132 [1,0,0,1,0,0|1,0,0]=3 99 B6R1.4 N[C@@H]1CC[C@@H]1O P20950 [1,0,0,1,0,0|1,0,0]=3 100 B6R1.4 N[C@@H]1CC[C@@H]1O P20953 [1,0,0,1,0,0|1,0,0]=3 101 B6R1.4 N[C@H]1CCC1=O AT24523 [1,0,0,1,0,0|1,0,1]=4 102 B6R1.4 N[C@H]1CNC1=O P16451 [1,0,0,1,0,0|1,0,1]=4 103 B6R1.4 N[C@H]1CNC1=O P18336 [1,0,0,1,0,0|1,0,1]=4 104 B6R1.6 FC[C@H]1CCN1 P12566 [1,0,0,1,0,0|1,0,0]=3 105 B6R1.6 FC[C@H]1CCN1 P13956 [1,0,0,1,0,0|1,0,0]=3 106 B6R1.6 FC[C@H]1CCN1 P14908 [1,0,0,1,0,0|1,0,0]=3 107 B6R1.6 N#C[C@@H]1CCN1 P14910 [1,0,0,1,0,0|0,0,2]=4 108 B6R1.6 N#C[C@@H]1CCN1 P14911 [1,0,0,1,0,0|0,0,2]=4 109 B6R1.6 N#C[C@@H]1CCN1 P15768 [1,0,0,1,0,0|0,0,2]=4 110 B6R1.6 NOC1CCC1 97654 [1,0,0,1,0,0|2,0,0]=4 111 B6R1.8 CC1CC1CN E73335 [1,0,0,1,0,0|1,0,0]=3 112 B6R1.8 COC1CC1N 92032 [1,0,0,1,0,0|2,0,0]=4 113 B6R1.8 CO[C@H]1C[C@@H]1N AT11447 [1,0,0,1,0,0|2,0,0]=4 114 B6R1.8 CO[C@H]1C[C@@H]1N D74325 [1,0,0,1,0,0|2,0,0]=4 115 B6R1.8 C[C@H]1C[C@@H]1CBr 55227 [1,0,0,1,0,0|2,0,0]=4 116 B6R1.8 C[C@H]1C[C@@H]1CBr AT23414 [1,0,0,1,0,0|2,0,0]=4 117 B6R1.8 C[C@H]1C[C@@H]1CBr AT23416 [1,0,0,1,0,0|2,0,0]=4 118 B6R1.8 C[C@H]1C[C@@H]1CN 73150 [1,0,0,1,0,0|1,0,0]=3 119 B6R1.8 C[C@H]1C[C@@H]1CO AT23417 [1,0,0,1,0,0|2,0,0]=4 120 B6R1.8 C[C@H]1C[C@@H]1CO AT23419 [1,0,0,1,0,0|2,0,0]=4 121 B6R1.8 NC1CC1CF AT23905 [1,0,0,1,0,0|1,0,0]=3 122 B6R1.8 N[C@H]1C[C@@H]1CF AT13342 [1,0,0,1,0,0|1,0,0]=3 123 B6R1.8 N[C@H]1C[C@@H]1CF AT23917 [1,0,0,1,0,0|1,0,0]=3 124 B6R1.8 N[C@H]1C[C@@H]1CO AT13340 [1,0,0,1,0,0|1,0,0]=3 125 B6R1.8 N[C@H]1C[C@H]1CF AT23916 [1,0,0,1,0,0|1,0,0]=3 126 B6R1.8 N[C@H]1C[C@H]1CO AT12843 [1,0,0,1,0,0|1,0,0]=3 127 B6R1.8 OCC1CC1Cl AT20161 [1,0,0,1,0,0|2,0,0]=4 128 B6R1.8 OC[C@@H]1C[C@@H]1F 97730 [1,0,0,1,0,0|2,0,0]=4 129 B6R1.8 OC[C@@H]1C[C@@H]1F CS3456 [1,0,0,1,0,0|2,0,0]=4 130 B6R1.8 OC[C@@H]1C[C@@H]1F CS3462 [1,0,0,1,0,0|2,0,0]=4 131 B6R1.8 OC[C@H]1C[C@@H]1F CS3465 [1,0,0,1,0,0|2,0,0]=4 132 B8R1.2 CC[C@H]1CCCCN1 I11451 [0,1,0,1,0,0|2,0,0]=4 133 B8R1.2 CC[C@H]1CNCCN1 77623 [0,1,0,1,0,0|1,0,0]=3 134 B8R1.2 FC[C@H]1CCCCN1 P14250 [0,1,0,1,0,0|2,0,0]=4 135 B8R1.2 FC[C@H]1CNCCN1 61665 [0,1,0,1,0,0|1,0,0]=3 136 B8R1.2 FC[C@H]1CNCCN1 AT10420 [0,1,0,1,0,0|1,0,0]=3 137 B8R1.2 FC[C@H]1CNCCN1 AT10423 [0,1,0,1,0,0|1,0,0]=3 138 B8R1.2 FC[C@H]1CNCCN1 AT11400 [0,1,0,1,0,0|1,0,0]=3 139 B8R1.2 FC[C@H]1CNCCN1 AT11401 [0,1,0,1,0,0|1,0,0]=3 140 B8R1.2 N#C[C@@H]1CCCCN1 P10260 [0,1,0,1,0,0|1,0,1]=4 141 B8R1.2 N#C[C@@H]1CCCCN1 P14176 [0,1,0,1,0,0|1,0,1]=4 142 B8R1.2 N#C[C@@H]1CCCCN1 P17878 [0,1,0,1,0,0|1,0,1]=4 143 B8R1.2 N#C[C@@H]1COCCN1 AT23926 [0,1,0,1,0,0|1,0,1]=4 144 B8R1.2 N#C[C@@H]1COCCN1 C72094 [0,1,0,1,0,0|1,0,1]=4 145 B8R1.2 NC[C@H]1CCCOC1 P12202 [0,1,0,1,0,0|2,0,0]=4 146 B8R1.2 NC[C@H]1CCCOC1 P12792 [0,1,0,1,0,0|2,0,0]=4 147 B8R1.2 NC[C@H]1CNCCO1 AT21336 [0,1,0,1,0,0|1,0,0]=3 148 B8R1.2 NC[C@H]1CNCCO1 AT21337 [0,1,0,1,0,0|1,0,0]=3 149 B8R1.2 NC[C@H]1CNCCO1 AT21338 [0,1,0,1,0,0|1,0,0]=3 150 B8R1.2 OC[C@H]1CSCCN1 AT25274 [0,1,0,1,0,0|2,0,0]=4 151 B8R1.5 CC1CSCCC1N 70873 [0,1,0,1,0,0|2,0,0]=4 152 B8R1.5 C[C@@H]1CCCC[C@@H]1N FD10501 [0,1,0,1,0,0|2,0,0]=4 153 B8R1.5 C[C@@H]1CCNC[C@@H]1F AT23522 [0,1,0,1,0,0|2,0,0]=4 154 B8R1.5 C[C@@H]1CCNC[C@@H]1O P13523 [0,1,0,1,0,0|2,0,0]=4 155 B8R1.5 C[C@@H]1COCC[C@@H]1N CS2010 [0,1,0,1,0,0|2,0,0]=4 156 B8R1.5 C[C@@H]1COCC[C@@H]1N D75982 [0,1,0,1,0,0|2,0,0]=4 157 B8R1.5 C[C@@H]1OCCN[C@@H]1C 90059 [0,1,0,1,0,0|2,0,0]=4 158 B8R1.5 C[C@@H]1OCCN[C@@H]1C W15992 [0,1,0,1,0,0|2,0,0]=4 159 B8R1.5 C[C@H]1COCC[C@@H]1N P13195 [0,1,0,1,0,0|2,0,0]=4 160 B8R1.5 NC1CCCCC1F 72734 [0,1,0,1,0,0|2,0,0]=4 161 B8R1.5 NC1CCOCC1F C14730 [0,1,0,1,0,0|2,0,0]=4 162 B8R1.5 N[C@@H]1CCOC[C@@H]1F D75516 [0,1,0,1,0,0|2,0,0]=4 163 B8R1.5 N[C@@H]1CCOC[C@@H]1F P14712 [0,1,0,1,0,0|2,0,0]=4 164 B8R1.5 N[C@@H]1CCOC[C@@H]1F P19435 [0,1,0,1,0,0|2,0,0]=4 165 B8R1.5 N[C@@H]1CCOC[C@@H]1O P13194 [0,1,0,1,0,0|2,0,0]=4 166 B8R1.5 N[C@@H]1CCOC[C@@H]1O P13230 [0,1,0,1,0,0|2,0,0]=4 167 B8R1.5 N[C@H]1CCNC[C@@H]1O D76966 [0,1,0,1,0,0|1,0,0]=3 168 B8R1.5 N[C@H]1COCCC1=O E73090 [0,1,0,1,0,0|2,0,0]=4 169 B8R1.5 OC1CNCCC1F 72696 [0,1,0,1,0,0|2,0,0]=4 170 B8R1.5 O[C@H]1CCNC[C@@H]1F P14099 [0,1,0,1,0,0|2,0,0]=4 171 B8R1.5 O[C@H]1CNCC[C@H]1O 39437 [0,1,0,1,0,0|2,0,0]=4 172 B8R1.8 BrCC[C@H]1CCCN1 C77427 [0,1,0,1,0,0|2,0,0]=4 173 B8R1.8 NCC[C@H]1CCCO1 AT11472 [0,1,0,1,0,0|2,0,0]=4 174 B8R1.8 NOCC1CCCC1 Y11655 [0,1,0,1,0,0|2,0,0]=4 175 B8R1.10 OCCNC1COC1 E72818 [0,1,0,1,0,0|2,0,0]=4 176 B8R1.11 CC[C@@H]1NCCC1=O AT25614 [0,1,0,1,0,0|2,0,0]=4 177 B8R1.11 CO[C@H]1COC[C@@H]1N D72866 [0,1,0,1,0,0|2,0,0]=4 178 B8R1.11 C[C@@H]1OCC[C@@H]1CN 73022 [0,1,0,1,0,0|2,0,0]=4 179 B8R1.11 N#C[C@@H]1CCC[C@@H]1N P12194 [0,1,0,1,0,0|1,0,1]=4 180 B8R1.11 NC1COCC1CO AT19653 [0,1,0,1,0,0|2,0,0]=4 181 B8R1.11 NC1COCC1CO AT19655 [0,1,0,1,0,0|2,0,0]=4 182 B8R1.11 NC[C@H]1COC[C@@H]1O P15682 [0,1,0,1,0,0|2,0,0]=4 183 B8R1.11 N[C@H]1CCC[C@@H]1CO AT21376 [0,1,0,1,0,0|2,0,0]=4 184 B8R1.11 N[C@H]1CCC[C@@H]1CO AT21377 [0,1,0,1,0,0|2,0,0]=4 185 B8R1.11 N[C@H]1COC[C@@H]1CO AT19661 [0,1,0,1,0,0|2,0,0]=4 186 B8R1.11 N[C@H]1COC[C@@H]1CO AT19676 [0,1,0,1,0,0|2,0,0]=4 187 B8R1.11 N[C@H]1COC[C@@H]1CO AT19677 [0,1,0,1,0,0|2,0,0]=4 188 B8R1.11 N[C@H]1COC[C@H]1CO AT19648 [0,1,0,1,0,0|2,0,0]=4 189 B8R1.11 N[C@H]1COC[C@H]1CO AT19656 [0,1,0,1,0,0|2,0,0]=4 190 B8R1.11 N[C@H]1COC[C@H]1CO AT19659 [0,1,0,1,0,0|2,0,0]=4 191 B8R1.12 CCN1CC[C@@H]1CN E73268 [0,1,0,1,0,0|2,0,0]=4 192 B8R1.13 COCC1CCC1N AT20685 [0,1,0,1,0,0|2,0,0]=4 193 B8R1.17 COC[C@H]1C[C@@H]1CN AT20748 [0,1,0,1,0,0|2,0,0]=4 194 B8R1.17 COC[C@H]1C[C@@H]1CN AT20754 [0,1,0,1,0,0|2,0,0]=4 195 B8R1.17 NCCC1CC1CO AT22591 [0,1,0,1,0,0|2,0,0]=4 196 B8R1.22 C[C@H]1CCNCCN1 91998 [0,1,0,1,0,0|1,0,0]=3 197 B8R1.22 C[C@H]1CCNCCN1 91999 [0,1,0,1,0,0|1,0,0]=3 198 B8R1.22 C[C@H]1CCOCCN1 33399 [0,1,0,1,0,0|2,0,0]=4 199 B8R1.22 C[C@H]1CNCCCN1 D76103 [0,1,0,1,0,0|1,0,0]=3 200 B8R1.22 C[C@H]1COCCCN1 AT11439 [0,1,0,1,0,0|2,0,0]=4 201 B8R1.22 C[C@H]1COCCCN1 AT11440 [0,1,0,1,0,0|2,0,0]=4 202 B8R1.22 F[C@H]1CCCCNC1 72488 [0,1,0,1,0,0|2,0,0]=4 203 B8R1.22 F[C@H]1CCCCNC1 AT25232 [0,1,0,1,0,0|2,0,0]=4 204 B8R1.22 F[C@H]1CCCCNC1 AT25234 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.22 NC1CNCCNC1 D86033 [0,1,0,1,0,0|0,0,0]=2 206 B8R1.22 OC1CNCCNC1 AT21564 [0,1,0,1,0,0|1,0,0]=3 207 B8R1.22 O[C@H]1CCCCNC1 AT25228 [0,1,0,1,0,0|2,0,0]=4 208 B8R1.22 O[C@H]1CCCCNC1 AT25231 [0,1,0,1,0,0|2,0,0]=4 209 B8R1.22 O[C@H]1CCCNCC1 AT25235 [0,1,0,1,0,0|2,0,0]=4 210 B8R1.22 O[C@H]1CCCNCC1 AT25242 [0,1,0,1,0,0|2,0,0]=4 211 B8R1.22 O[C@H]1CNCCOC1 AT25211 [0,1,0,1,0,0|2,0,0]=4 212 B8R1.22 O[C@H]1CNCCOC1 AT25212 [0,1,0,1,0,0|2,0,0]=4 213 B8R1.22 O[C@H]1CNCCOC1 AT25213 [0,1,0,1,0,0|2,0,0]=4 214 B8R1.36 NOCCCC1CC1 AT26811 [0,1,0,1,0,0|2,0,0]=4 215 B8R1.1 C[C@@H]1CC[C@H](CO)N1 W10038 [0,1,0,1,0,0|2,0,0]=4 216 B8R1.1 C[C@H]1CN[C@@H](CF)C1 W10040 [0,1,0,1,0,0|2,0,0]=4 217 B8R1.1 NCC1CCC(O)C1 D76686 [0,1,0,1,0,0|2,0,0]=4 218 B8R1.1 N[C@@H]1CN[C@H](CO)C1 91825 [0,1,0,1,0,0|1,0,0]=3 219 B8R1.3 C[C@@H]1CC[C@H](O)CN1 W10035 [0,1,0,1,0,0|2,0,0]=4 220 B8R1.3 C[C@H]1CC[C@H](O)CN1 73247 [0,1,0,1,0,0|2,0,0]=4 221 B8R1.3 C[C@H]1CC[C@H](O)CN1 W10034 [0,1,0,1,0,0|2,0,0]=4 222 B8R1.3 C[C@H]1CC[C@H](O)CN1 W11753 [0,1,0,1,0,0|2,0,0]=4 223 B8R1.3 C[C@H]1CN[C@@H](C)CN1 AT17299 [0,1,0,1,0,0|1,0,0]=3 224 B8R1.3 C[C@H]1CO[C@@H](C)CN1 AC8572 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.40 NCC(=O)NC1CC1 D76973 [0,1,0,1,0,0|1,0,1]=4 226 B8R1.47 NC[C@H]1C[C@@H](CO)C1 P14792 [0,1,0,1,0,0|2,0,0]=4 227 B8R1.50 CC1CCC(C)C1N N13148 [0,1,0,1,0,0|2,0,0]=4 228 B8R1.50 C[C@@H]1CNC(=O)[C@H]1N AT23635 [0,1,0,1,0,0|1,0,1]=4 229 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O AT23609 [0,1,0,1,0,0|1,0,1]=4 230 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O AT26183 [0,1,0,1,0,0|1,0,1]=4 231 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O AT23610 [0,1,0,1,0,0|1,0,1]=4 232 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O AT26184 [0,1,0,1,0,0|1,0,1]=4 233 B8R1.4 C[C@@H]1CNC[C@@H](O)C1 AT13826 [0,1,0,1,0,0|2,0,0]=4 234 B8R1.4 C[C@H]1CCC[C@H](N)C1 94624 [0,1,0,1,0,0|2,0,0]=4 235 B8R1.4 C[C@H]1CNC[C@H](C)N1 C15745 [0,1,0,1,0,0|1,0,0]=3 236 B8R1.4 C[C@H]1CNC[C@H](C)N1 P10621 [0,1,0,1,0,0|1,0,0]=3 237 B8R1.4 C[C@H]1COC[C@H](C)N1 D72922 [0,1,0,1,0,0|2,0,0]=4 238 B8R1.4 C[C@H]1COC[C@H](C)N1 F17621 [0,1,0,1,0,0|2,0,0]=4 239 B8R1.4 N[C@@H]1CCC[C@H](F)C1 P18319 [0,1,0,1,0,0|2,0,0]=4 240 B8R1.4 N[C@@H]1CCC[C@H](O)C1 W10001 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.4 N[C@H]1CCC[C@H](O)C1 W10002 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.4 O[C@@H]1CNC[C@@H](O)C1 AT24411 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.6 NCCN1CC(F)C1 AT15721 [0,1,0,1,0,0|1,0,0]=3 244 B8R1.7 C[C@H](N)[C@@H]1CCCO1 W15865 [0,1,0,1,0,0|2,0,0]=4 245 B8R1.19 CC1(C)CCC[C@@H]1N P21031 [0,1,0,1,0,0|2,0,0]=4 246 B8R1.19 CC1(C)CNC[C@@H]1O C91233 [0,1,0,1,0,0|2,0,0]=4 247 B8R1.19 CC1(C)CNC[C@@H]1O F12502 [0,1,0,1,0,0|2,0,0]=4 248 B8R1.19 CC1(C)CNC[C@@H]1O F12503 [0,1,0,1,0,0|2,0,0]=4 249 B8R1.19 CC1(O)CCCC1N AT16546 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.19 C[C@]1(O)CCC[C@@H]1N D77066 [0,1,0,1,0,0|2,0,0]=4 251 B8R1.19 N[C@H]1CCCC1(F)F C16718 [0,1,0,1,0,0|2,0,0]=4 252 B8R1.19 N[C@H]1COCC1(F)F AT11688 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.19 N[C@H]1COCC1(F)F D72821 [0,1,0,1,0,0|2,0,0]=4 254 B8R1.19 O[C@H]1CNCC1(F)F AT14965 [0,1,0,1,0,0|2,0,0]=4 255 B8R1.27 NCC[C@H]1CC1(F)F AT12582 [0,1,0,1,0,0|2,0,0]=4 256 B8R1.43 NC[C@H]1C[C@H]1C(F)F AT13369 [0,1,0,1,0,0|2,0,0]=4 257 B8R1.48 NC[C@H]1CCC1(F)F P17081 [0,1,0,1,0,0|2,0,0]=4 258 B8R1.72 CC1(C)CCCCN1 AT24207 [0,1,0,1,0,0|2,0,0]=4 259 B8R1.72 CC1(C)CNCCS1 AT25269 [0,1,0,1,0,0|2,0,0]=4 260 B8R1.72 CC1(C)CSCCN1 AT10787 [0,1,0,1,0,0|2,0,0]=4 261 B8R1.72 C[C@]1(F)CCCNC1 73130 [0,1,0,1,0,0|2,0,0]=4 262 B8R1.72 C[C@]1(O)CCCNC1 P19254 [0,1,0,1,0,0|2,0,0]=4 263 B8R1.72 FC1(F)CNCCO1 AT14208 [0,1,0,1,0,0|2,0,0]=4 264 B8R1.72 FC1(F)CNCCO1 C90213 [0,1,0,1,0,0|2,0,0]=4 265 B8R1.18 N[C@H]1C[C@@H](O)C[C@@H]1O AT24208 [0,1,0,1,0,0|2,0,0]=4 266 B8R1.66 NCCC1(N)CCC1 89659 [0,1,0,1,0,0|2,0,0]=4 267 B8R1.66 NCCC1(O)CCC1 AT11470 [0,1,0,1,0,0|2,0,0]=4 268 B8R2.22 C1CC2CNCC12 P11721 [0,0,0,2,0,0|2,0,0]=4 269 B8R2.22 C1C[C@@H]2CC[C@@H]2N1 AT26761 [0,0,0,2,0,0|2,0,0]=4 270 B8R2.22 C1C[C@@H]2NC[C@@H]2O1 E73352 [0,0,0,2,0,0|2,0,0]=4 271 B8R2.22 C1C[C@H]2CNC[C@@H]12 AT20514 [0,0,0,2,0,0|2,0,0]=4 272 B8R2.22 C1NC2COCC12 AT25962 [0,0,0,2,0,0|2,0,0]=4 273 B8R2.34 C1S[C@@H]2CN[C@H]1C2 E72914 [0,0,0,2,0,0|2,0,0]=4 274 B8R2.2 N[C@@]12COC[C@@H]1C2 E73224 [0,0,0,2,0,0|2,0,0]=4 275 B8R2.2 OC12CNCC1C2 85308 [0,0,0,2,0,0|2,0,0]=4 276 B8R2.18 N[C@H]1C[C@@H]2C[C@@H]2C1 P14914 [0,0,0,2,0,0|2,0,0]=4 277 B8R2.23 C1NCC2CC1C2 27063 [0,0,0,2,0,0|2,0,0]=4 278 B8R2.23 C1NCC2CC1O2 32911 [0,0,0,2,0,0|2,0,0]=4 279 B8R2.23 C1OCC2CC1N2 F18884 [0,0,0,2,0,0|2,0,0]=4 280 B8R2.23 C1OCC2CC1N2 W14568 [0,0,0,2,0,0|2,0,0]=4 281 B8R2.25 C1CC2CC2CN1 D73121 [0,0,0,2,0,0|2,0,0]=4 282 B8R2.25 C1CC2NC2CO1 D77143 [0,0,0,2,0,0|2,0,0]=4 283 B8R2.25 C1CCC2NC2C1 AT21517 [0,0,0,2,0,0|2,0,0]=4 284 B8R2.38 NC1CCC2CC12 P12183 [0,0,0,2,0,0|2,0,0]=4 285 B8R2.26 NC1CC1C2CC2 AT24619 [0,0,0,2,0,0|2,0,0]=4 286 B8R2.45 N[C@H]1CC12CCC2 E73216 [0,0,0,2,0,0|2,0,0]=4 287 B8R2.1 C1C[C@@H](C2CC2)N1 P10347 [0,0,0,2,0,0|2,0,0]=4 288 B8R2.19 N[C@H]1CCC12CC2 D73354 [0,0,0,2,0,0|2,0,0]=4 289 B8R2.20 NC[C@H]1CC12CC2 D73416 [0,0,0,2,0,0|2,0,0]=4