0 B8R0.8 CCC/C=C(\C)/C(=O)O CDS000408 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.8 CCCCC(=O)N(C)C S939811 [0,0,0,0,0,0|2,0,0]=2 2 B8R0.8 CCCCC(C)C(=O)Cl PH011486 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.8 CCCCC(C)C(C)O S374199 [0,0,0,0,0,0|1,0,3]=4 4 B8R0.8 CCCCC(N)C(=O)N CDS003890 [0,0,0,0,0,0|2,0,1]=3 5 B8R0.8 CN(C)C(=O)CCCN CBR00927 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.8 COCCC(=O)C(C)C CDS024032 [0,0,0,0,0,0|2,0,1]=3 7 B8R0.8 CSCCC(O)C(=O)O PH000120 [0,0,0,0,0,0|2,0,2]=4 8 B8R0.8 NCCCC(N)C(=O)O S594881 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.8 [C@H](N)(CSCC)C(=O)O S361615 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.3 C(=O)C(=C)CCCC R425885 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.3 C=C(CC)CCCC CDS000215 [1,0,0,0,0,0|1,0,1]=3 12 B7R0.3 CCC#CC(=O)OC T242845 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.3 CCCCC(N)CC CDS021471 [1,0,0,0,0,0|1,0,2]=4 14 B7R0.3 CCCNC(=O)CCl OTV000047 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.3 CCCNC(=S)NC S512176 [1,0,0,0,0,0|2,1,0]=4 16 B7R0.3 CCCOC(=O)CBr PH011324 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.3 CCCOC(=O)CCl S431443 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.3 CCCOC(=O)CN PH019063 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.3 CCOCC(=O)OC EME00071 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.3 CCSCS(=O)CC S697834 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.3 CNC(=O)OCCCl L163082 [1,0,0,0,0,0|3,0,0]=4 22 B7R0.3 CNC(=O)OCCO S392650 [1,0,0,0,0,0|3,0,0]=4 23 B7R0.3 CNCCC(=O)NC CBR01261 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.3 COC(=O)CCC#N S369640 [1,0,0,0,0,0|2,0,1]=4 25 B7R0.3 COCCC(=O)NN CDS018970 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.3 NNC(=O)CCCO CDS001562 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 C/C(=C\CCCBr)/Br S877557 [1,0,0,0,0,0|2,0,0]=3 28 B7R0.4 C=CCCOC(=O)C S510343 [1,0,0,0,0,0|1,0,2]=4 29 B7R0.4 CC(=O)NCCCO OTV000276 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.4 CC(=O)OCCCS S786683 [1,0,0,0,0,0|2,0,0]=3 31 B7R0.4 CCC/C=C/C(=O)C CDS001219 [1,0,0,0,0,0|0,0,1]=2 32 B7R0.4 CCC/C=C/C(=O)N PH008310 [1,0,0,0,0,0|1,0,1]=3 33 B7R0.4 CCC/C=C/C(C)C R289590 [1,0,0,0,0,0|1,0,2]=4 34 B7R0.4 CCC/C=C/C(C)C S369713 [1,0,0,0,0,0|1,0,2]=4 35 B7R0.4 CCCCCC(=N)N CBR01197 [1,0,0,0,0,0|2,0,1]=4 36 B7R0.4 CCCCCC(C)Cl CDS000285 [1,0,0,0,0,0|1,0,2]=4 37 B7R0.4 CCCCNC(=O)C CDS013581 [1,0,0,0,0,0|1,0,0]=2 38 B7R0.4 CCCCNC(=S)N S565970 [1,0,0,0,0,0|2,1,0]=4 39 B7R0.4 CCCCSC(=N)N S500534 [1,0,0,0,0,0|3,0,0]=4 40 B7R0.4 CCCCSC(=N)N S557153 [1,0,0,0,0,0|3,0,0]=4 41 B7R0.4 CCCCSC(C)C S570605 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.4 CCO/C=C/C(=O)O CDS016341 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.4 CCOCCC(=O)O S448745 [1,0,0,0,0,0|2,0,1]=4 44 B7R0.4 CNCCCC(=O)O PH006886 [1,0,0,0,0,0|2,0,1]=4 45 B7R0.4 COCCCC(=O)O CDS021485 [1,0,0,0,0,0|2,0,1]=4 46 B7R0.4 CSCCCC(=O)O OTV000795 [1,0,0,0,0,0|2,0,1]=4 47 B7R0.4 CSCCOC(=O)C S375721 [1,0,0,0,0,0|2,0,0]=3 48 B7R0.4 NC(=O)CCCCO S441481 [1,0,0,0,0,0|2,0,1]=4 49 B7R0.5 C=C(CCC)C(C)C R289221 [1,0,0,0,0,0|2,0,1]=4 50 B7R0.5 CC(=O)C(Cl)CCO S561894 [1,0,0,0,0,0|2,0,1]=4 51 B7R0.5 CC(=O)N(C)CCN PH019599 [1,0,0,0,0,0|3,0,0]=4 52 B7R0.5 CC(=O)N(C)CCO CBR01454 [1,0,0,0,0,0|3,0,0]=4 53 B7R0.5 CCCC(=C(C)C)C R289469 [1,0,0,0,0,0|2,0,0]=3 54 B7R0.5 CCOC(=O)C(C)N CDS015013 [1,0,0,0,0,0|2,0,1]=4 55 B7R0.5 CCOC(=O)N(C)C PH001938 [1,0,0,0,0,0|3,0,0]=4 56 B7R0.5 CCOC(=O)N(C)N PH007944 [1,0,0,0,0,0|3,0,0]=4 57 B7R0.5 CN(C)C(=O)CCN CBR00920 [1,0,0,0,0,0|3,0,0]=4 58 B7R0.5 CNCC(=O)N(C)C CDS007544 [1,0,0,0,0,0|3,0,0]=4 59 B7R0.5 COCC(=O)C(C)C CDS024045 [1,0,0,0,0,0|2,0,1]=4 60 B7R0.5 CSCC(=O)N(C)C PH007257 [1,0,0,0,0,0|3,0,0]=4 61 B9R0.6 CCCC(C)C(=O)C(C)C S433179 [0,1,0,0,0,0|1,0,1]=3 62 B9R0.7 C=C(C)C(=O)NCC(C)O ANV00013 [0,1,0,0,0,0|2,0,0]=3 63 B9R0.7 CC(=O)C(=O)OCC(C)C PH008589 [0,1,0,0,0,0|1,0,0]=2 64 B9R0.7 CC(C)CCC(=O)C(C)C S450499 [0,1,0,0,0,0|1,0,1]=3 65 B9R0.7 CC(C)CCC(=O)C(Cl)Cl R462357 [0,1,0,0,0,0|2,0,1]=4 66 B9R0.8 C=CCOC(=O)C(=O)OC PH008416 [0,1,0,0,0,0|1,0,2]=4 67 B9R0.8 CCCCC(=O)C(C)CC S431486 [0,1,0,0,0,0|1,0,1]=3 68 B9R0.8 CCCOC(=O)C(C)CC CDS000542 [0,1,0,0,0,0|2,0,1]=4 69 B9R0.13 C(=C(\CC)/C(=O)C)\CCC S129674 [0,1,0,0,0,0|1,0,1]=3 70 B9R0.13 CCCC/C(=N\O)/C(=O)O PH007213 [0,1,0,0,0,0|1,0,1]=3 71 B9R0.13 CCN(CCCN)C(=O)C PH010126 [0,1,0,0,0,0|3,0,0]=4 72 B9R0.42 C=C(C)C(=O)OC(C)CC CDS010603 [0,1,0,0,0,0|2,0,0]=3 73 B9R0.47 CCCCCC(=O)C(C)C S357944 [0,1,0,0,0,0|1,0,1]=3 74 B9R0.51 CCCCC(C)(C)C(=O)O PH000318 [0,1,0,0,0,0|2,0,1]=4 75 B9R0.51 CCCCS(=O)(=O)C(C)Cl T163740 [0,1,0,0,0,0|2,0,1]=4 76 B9R1.5 N[C@@H]1CCCCNC1=O CDS006947 [0,0,0,1,0,0|2,0,1]=4 77 B9R1.5 O=C1CCCCCC1=O PH003588 [0,0,0,1,0,0|0,0,0]=1 78 B9R1.6 CC(=O)C1CCCCC1 PH000084 [0,0,0,1,0,0|1,0,1]=3 79 B9R1.6 CC(=O)C1CCCNC1 CBR02306 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.6 CC(N)C1=CCCCC1 CBR01205 [0,0,0,1,0,0|2,0,1]=4 81 B9R1.6 CC(O)C1=CCCCC1 PH015453 [0,0,0,1,0,0|1,0,2]=4 82 B9R1.6 NC(=O)C1CCCCN1 CDS009633 [0,0,0,1,0,0|2,0,1]=4 83 B9R1.6 O=C(O)C1=COCCC1 CDS022220 [0,0,0,1,0,0|3,0,0]=4 84 B9R1.6 O=C(O)C1CCCCO1 CDS015473 [0,0,0,1,0,0|1,0,2]=4 85 B9R1.23 CN1CC(CC1=O)CN CBR00012 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.35 CC(=O)N1CCC(C1)O CDS023189 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.35 CC(=O)N1CC[C@@H](C1)O CDS023190 [0,0,0,1,0,0|3,0,0]=4 88 B9R1.40 CC1(CNCCC1=O)C PHB00252 [0,0,0,1,0,0|2,0,1]=4 89 B9R1.69 CC1CCC(=O)C(C1)C T295450 [0,0,0,1,0,0|1,0,1]=3 90 B9R1.69 C[C@H]1C[C@H](COC1=O)C T269239 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.112 N[C@@H](CC1CC1)C(=O)O CDS007244 [0,0,0,1,0,0|2,0,1]=4 92 B9R1.163 CC1(CCCC1)C(=O)N S11585 [0,0,0,1,0,0|2,0,1]=4 93 B9R1.163 O=C(O)C1(CCCC1)O CBR00072 [0,0,0,1,0,0|1,0,2]=4 94 B9R0.4 CC(=O)CC(=O)OCCCl PH003373 [0,0,0,0,0,1|2,0,0]=3 95 B9R0.4 CCCCC(=O)CC(=O)C CDS001230 [0,0,0,0,0,1|0,0,0]=1 96 B9R0.4 CCCCC(=O)CC(=O)C S839590 [0,0,0,0,0,1|0,0,0]=1 97 B9R0.4 CCCCC(N)CC(=O)O CBR00513 [0,0,0,0,0,1|2,0,1]=4 98 B9R0.4 CCCNC(=O)CC(=O)C R466107 [0,0,0,0,0,1|1,0,0]=2 99 B9R0.4 CCCOC(=O)CC(=O)C CDS000562 [0,0,0,0,0,1|1,0,0]=2 100 B9R0.4 CCCOC(=O)N[N+](=O)[O-] R647373 [0,0,0,0,0,1|3,0,0]=4 101 B6R0.1 CCC(=O)COC CDS024044 [2,0,0,0,0,0|1,0,1]=4 102 B6R0.1 CCOC(=O)NC PH010865 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.1 CCSC(=O)CC CDS001498 [2,0,0,0,0,0|1,0,1]=4 104 B6R0.1 CNCC(=O)NC CBR00235 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.1 CNCC(=O)OC PH006931 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.1 [Li]OC(=O)CCC S813958 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.4 C=C(Br)CCCO T297658 [2,0,0,0,0,0|2,0,0]=4 108 B6R0.4 CC(=O)NCCCl CDS001220 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.4 CC(=O)OCCS S363049 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.4 CC/C=C/C(=O)Cl PH009861 [2,0,0,0,0,0|1,0,1]=4 111 B6R0.4 CCC#CC(=O)C CDS000006 [2,0,0,0,0,0|0,0,2]=4 112 B6R0.4 CCCC=C(C)C S419117 [2,0,0,0,0,0|1,0,0]=3 113 B6R0.4 CCCCC(=N)N PH017352 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.4 CCCCC(=S)N PH000512 [2,0,0,0,0,0|1,1,0]=4 115 B6R0.4 CCCSC(=O)C CDS000298 [2,0,0,0,0,0|1,0,0]=3 116 B6R0.4 CCNCC(=O)N S877379 [2,0,0,0,0,0|2,0,0]=4 117 B6R0.4 CCNCC(=O)N S986194 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.4 CCSCC(=O)C S614262 [2,0,0,0,0,0|1,0,0]=3 119 B6R0.4 CNCCC(=O)O CDS013939 [2,0,0,0,0,0|1,0,1]=4 120 B6R0.4 CSCCC(=O)Cl CDS000414 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.4 NC(=O)CCCCl OTV000845 [2,0,0,0,0,0|2,0,0]=4 122 B6R0.4 O=C(O)CCCS CDS004545 [2,0,0,0,0,0|1,0,1]=4 123 B6R0.6 CCCCCSC S357952 [2,0,0,0,0,0|1,0,1]=4 124 B6R0.6 CCCCNC=O S550981 [2,0,0,0,0,0|1,0,0]=3 125 B6R0.6 COCCCC=O CDS022820 [2,0,0,0,0,0|1,0,1]=4 126 B6R0.6 COCCNC=O PH007296 [2,0,0,0,0,0|2,0,0]=4 127 B8R0.1 C/C=C\C(O)CCCC S364290 [1,1,0,0,0,0|0,0,2]=4 128 B8R0.1 CC=CC(=O)NCCC T173770 [1,1,0,0,0,0|1,0,0]=3 129 B8R0.1 CCCCC(=O)CCC S456489 [1,1,0,0,0,0|0,0,1]=3 130 B8R0.1 CCCNC(=O)NCC S805858 [1,1,0,0,0,0|1,0,1]=4 131 B8R0.1 CCCNC(=O)OCC S361909 [1,1,0,0,0,0|1,0,1]=4 132 B8R0.1 CCOC(=O)CCOC CDS025273 [1,1,0,0,0,0|1,0,1]=4 133 B8R0.3 CCCC(O)C(=O)CC PH008572 [1,1,0,0,0,0|0,0,1]=3 134 B8R0.3 CCC[C@H](N)C(=O)OC CDS003875 [1,1,0,0,0,0|1,0,0]=3 135 B8R0.6 C#CCCCC(=O)OC T287598 [1,1,0,0,0,0|1,0,1]=4 136 B8R0.6 C=CC(=O)OCCCC S444715 [1,1,0,0,0,0|0,0,1]=3 137 B8R0.6 CCC/C=C/C(=O)OC R436038 [1,1,0,0,0,0|1,0,1]=4 138 B8R0.6 CCCCCC(=O)NN S849049 [1,1,0,0,0,0|2,0,0]=4 139 B8R0.6 CCCCCC(=O)SC CDS010601 [1,1,0,0,0,0|1,0,0]=3 140 B8R0.6 CCCCNC(=O)CCl TMT00394 [1,1,0,0,0,0|1,0,1]=4 141 B8R0.6 CCCCNC(=O)OC S352683 [1,1,0,0,0,0|1,0,0]=3 142 B8R0.6 CCCCOC(=O)CCl S431451 [1,1,0,0,0,0|1,0,1]=4 143 B8R0.6 CCCCOC(=O)CS S436992 [1,1,0,0,0,0|0,1,1]=4 144 B8R0.6 CCOCCC(=O)OC PH000125 [1,1,0,0,0,0|1,0,0]=3 145 B8R0.6 CCSCCC(=O)OC S365688 [1,1,0,0,0,0|1,0,0]=3 146 B8R0.9 C=CC(=O)OCC(C)O S511951 [1,1,0,0,0,0|1,0,1]=4 147 B8R0.19 CCC(C)NC(=O)NC S724750 [1,1,0,0,0,0|2,0,0]=4 148 B8R0.25 CCCCC(Cl)(Cl)C=O PH014412 [1,1,0,0,0,0|1,0,1]=4 149 B8R0.25 CCCCS(=O)(=O)CC S775738 [1,1,0,0,0,0|1,0,1]=4 150 B8R0.5 CCCC(=O)CC(=O)C S839566 [1,1,0,0,0,0|0,0,2]=4 151 B8R0.5 CCCC(N)CC(=O)O BBO000362 [1,1,0,0,0,0|1,0,1]=4 152 B8R0.7 CC(=CCCCCBr)C PH009497 [1,1,0,0,0,0|1,0,0]=3 153 B8R0.7 CC(=O)NCCCCN CDS021099 [1,1,0,0,0,0|1,0,0]=3 154 B8R0.7 CCC/C=C/CC(=O)O CDS000348 [1,1,0,0,0,0|1,0,1]=4 155 B8R0.7 CCCCCOC(=O)Cl CDS000346 [1,1,0,0,0,0|1,0,1]=4 156 B8R0.7 CCCCOCC(=O)O CDS008145 [1,1,0,0,0,0|1,0,1]=4 157 B8R0.7 CCCC[Hg]OC(=O)C S814512 [1,1,0,0,0,0|1,0,0]=3 158 B8R0.7 CCCNCCC(=O)O OTV000481 [1,1,0,0,0,0|1,0,1]=4 159 B8R0.7 CCSCCCC(=O)O PH008798 [1,1,0,0,0,0|1,0,1]=4 160 B8R0.7 NC(=O)CCCCCBr CDS003086 [1,1,0,0,0,0|1,0,1]=4 161 B8R0.7 NCCCCCC(=O)N CDS015235 [1,1,0,0,0,0|1,0,1]=4 162 B8R0.21 CCCCOS(=O)(=O)C CDS014297 [1,1,0,0,0,0|2,0,0]=4 163 B8R0.28 C=C(C)CCOC(=O)C S881171 [1,1,0,0,0,0|1,0,1]=4 164 B8R0.28 CC(=CCC[C@H](C)O)C T296155 [1,1,0,0,0,0|1,0,0]=3 165 B8R0.28 CC(=O)CCCC(C)C CDS000306 [1,1,0,0,0,0|0,0,1]=3 166 B8R0.28 CC(=O)CCCN(C)C PH014778 [1,1,0,0,0,0|1,0,1]=4 167 B8R0.28 CC(=O)CCOC(=O)C PH003361 [1,1,0,0,0,0|1,0,1]=4 168 B8R0.28 CC(=O)CSCC(C)C EME00074 [1,1,0,0,0,0|1,0,1]=4 169 B8R0.28 CC(=O)OCCN(C)C PH011981 [1,1,0,0,0,0|2,0,0]=4 170 B8R0.28 CC(C)CCCC(=O)O CDS003381 [1,1,0,0,0,0|1,0,1]=4 171 B8R0.28 [C@H](C)(O)CCC=C(C)C T232645 [1,1,0,0,0,0|1,0,0]=3 172 B8R0.2 CCC(Br)C(=O)N(C)C PH009303 [1,1,0,0,0,0|2,0,0]=4 173 B8R0.2 CCC(C)C(=O)C(=O)O CDS000039 [1,1,0,0,0,0|1,0,0]=3 174 B8R0.2 CCC(C)C(=O)C(C)C S431117 [1,1,0,0,0,0|1,0,1]=4 175 B8R0.12 CCCC(C)(C)C(=O)C PH011400 [1,1,0,0,0,0|1,0,1]=4 176 B8R0.12 CCCC(C)(O)C(=O)C PH007070 [1,1,0,0,0,0|0,0,2]=4 177 B8R0.14 CCCC(=O)C(C)(C)C CDS021484 [1,1,0,0,0,0|1,0,1]=4 178 B10R0.6 CCCCCC(=O)C=C(C)C T270466 [0,1,0,0,0,1|1,0,0]=3 179 B10R0.6 CCCCNC(=O)CC(=O)C R466115 [0,1,0,0,0,1|0,0,0]=2 180 B10R0.6 CCCOCC(C)OC(=O)C S84450 [0,1,0,0,0,1|1,0,1]=4 181 B10R0.6 COCCOC(=O)C=C(C)C S240443 [0,1,0,0,0,1|2,0,0]=4 182 B10R0.18 C=CCCC(=O)CC(=O)OC T272175 [0,1,0,0,0,1|0,0,2]=4 183 B10R0.35 CCCC(C)C(=O)C(C)CC S504696 [0,2,0,0,0,0|1,0,1]=4 184 B10R0.57 CCC(=O)/C(=C/CC(C)C)/C S84566 [0,2,0,0,0,0|1,0,1]=4 185 B10R0.84 CC(=C(CO)CCC(C)C)C S351598 [0,2,0,0,0,0|1,0,1]=4 186 B10R0.83 CCCCNC(=O)C(Br)CC PH015166 [0,2,0,0,0,0|1,0,1]=4 187 B10R0.83 COC(=O)C(Br)CCCCBr S943185 [0,2,0,0,0,0|1,0,1]=4 188 B10R0.85 CCCCN(CC)C(=O)CCl PH010558 [0,2,0,0,0,0|2,0,0]=4 189 B10R0.17 CCCCC(C(=O)C)C(C)C S351725 [0,2,0,0,0,0|1,0,1]=4 190 B10R0.17 CCCCC(C(=O)N)C(=O)N PH009401 [0,2,0,0,0,0|1,0,1]=4 191 B10R0.75 CCCCCCC(=O)C(C)C S350575 [0,2,0,0,0,0|1,0,1]=4 192 B10R0.75 CCOCCOC(=O)C(C)C R278068 [0,2,0,0,0,0|1,0,1]=4 193 B10R0.98 CC(C)CCOC(=O)C(C)O PH011490 [0,2,0,0,0,0|0,0,2]=4 194 B8R1.1 CCC1CNC(=O)C1 CBR00057 [1,0,0,1,0,0|1,0,0]=3 195 B8R1.1 CCC1COC(=O)N1 CBR02121 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.1 O=C1CC(CN1)CO CDS002555 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.2 O=CC1CCCCO1 CDS019507 [1,0,0,1,0,0|0,0,2]=4 198 B8R1.3 CC1=CCC(CC1)Cl S109576 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.3 NC1CCC(=O)CC1 CDS009700 [1,0,0,1,0,0|1,0,1]=4 200 B8R1.3 N[C@H]1CCC(=O)NC1 CDS013956 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.3 O=C1CCC(CC1)O T292184 [1,0,0,1,0,0|1,0,1]=4 202 B8R1.3 O=C1CC[C@@H](CN1)O CDS010026 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.5 FC1=C(CCCC1)Br S896187 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.5 N1CCNC(=O)C1=O S15025 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.22 O=C1CCSCCN1 SYX00233 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.22 O=C1CNCCCN1 CDS019453 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.38 COC(=O)C1CCC1 S851957 [1,0,0,1,0,0|1,0,0]=3 208 B8R1.38 COC(=O)C1CNC1 CDS005119 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.38 NNC(=O)C1CCC1 CBR00212 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.83 COC(=O)C1CC1C EME00059 [1,0,0,1,0,0|1,0,0]=3 211 B8R1.4 NC1CCNC(=O)C1 CDS024233 [1,0,0,1,0,0|2,0,0]=4 212 B8R1.7 NC(=O)C1CCCC1 EME00440 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.34 O=C(O)C=C1CCC1 T165123 [1,0,0,1,0,0|1,0,1]=4 214 B8R1.35 O=C(O)/C=C\C1CC1 PH008009 [1,0,0,1,0,0|1,0,1]=4 215 B8R1.37 CCCC(=O)N1CC1 S406996 [1,0,0,1,0,0|2,0,0]=4 216 B8R1.54 CC(C)C(=O)C1CC1 CDS023680 [1,0,0,1,0,0|1,0,1]=4 217 B10R1.8 CCC1CC(=O)CC(=O)C1 CDS014187 [0,0,0,1,0,1|0,0,0]=2 218 B10R1.18 CC(=O)CC1CCCCC1 CDS001548 [0,0,0,1,0,1|1,0,1]=4 219 B10R1.18 CC(=O)CN1CCCCC1 R433675 [0,0,0,1,0,1|2,0,0]=4 220 B10R1.18 CC(=O)NC1CCCCC1 PH004244 [0,0,0,1,0,1|1,0,1]=4 221 B10R1.61 CC(=O)[C@@H]1CCCC[C@@H]1N PH016419 [0,0,0,1,0,1|1,0,1]=4 222 B10R1.61 NC(=O)C1CCCNC1=O PH007029 [0,0,0,1,0,1|2,0,0]=4 223 B10R1.61 O=C(O)C1CCCCC1=O CDS021562 [0,0,0,1,0,1|1,0,0]=3 224 B10R1.61 O=C(O)C1CCCNC1=O CBR01770 [0,0,0,1,0,1|2,0,0]=4 225 B10R1.130 C#CCC1CC(=O)OC1=O PH009041 [0,0,0,1,0,1|0,0,2]=4 226 B10R1.130 C=CCC1CC(=O)OC1=O CDS000319 [0,0,0,1,0,1|0,0,2]=4 227 B10R1.130 CCCC1SC(=NC1=O)N PH012717 [0,0,0,1,0,1|1,1,0]=4 228 B10R1.192 CC(=O)C1C(=O)CCC1=O R426911 [0,0,0,1,0,1|1,0,1]=4 229 B10R1.266 CC(=O)CC(=O)C1CCC1 SYX00422 [0,0,0,1,0,1|0,0,0]=2 230 B10R1.23 CC(O)C(=O)N1CCCC1 PH010531 [0,1,0,1,0,0|0,0,2]=4 231 B10R1.23 CN(C)C(=O)C1CCCN1 CDS012608 [0,1,0,1,0,0|2,0,0]=4 232 B10R1.94 CCCC1=C(C(=O)CC1)Br PH015992 [0,1,0,1,0,0|1,0,1]=4 233 B10R1.94 CCCC1=C(C(=O)CC1)O PH008317 [0,1,0,1,0,0|0,0,2]=4 234 B10R1.275 CN1CCCC[C@@H](C1=O)N CDS014105 [0,1,0,1,0,0|1,0,1]=4 235 B10R1.275 O=C1C(CCCCC1Br)Br S330213 [0,1,0,1,0,0|1,0,1]=4 236 B10R1.13 CC(=O)N1CCC(CC1)N CDS010756 [0,1,0,1,0,0|2,0,0]=4 237 B10R1.147 CC1(CCC(=O)C(=O)C1)C PH008262 [0,1,0,1,0,0|0,0,0]=2 238 B10R1.7 CC1CCCCCCC1=O S53075 [0,1,0,1,0,0|1,0,1]=4 239 B10R1.15 CC(=C1CCCCC1)C#N T208450 [0,1,0,1,0,0|2,0,0]=4 240 B10R1.15 CNC(=O)N1CCCCC1 S379557 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.15 NCC(=O)N1CCCCC1 CDS002437 [0,1,0,1,0,0|2,0,0]=4 242 B10R1.15 O=C(CBr)N1CCCCC1 CBR00242 [0,1,0,1,0,0|2,0,0]=4 243 B10R1.15 O=C(CI)N1CCCCC1 PH006191 [0,1,0,1,0,0|2,0,0]=4 244 B10R1.29 CCCCN1CCCC1=O S434221 [0,1,0,1,0,0|2,0,0]=4 245 B10R1.176 CCC1CCC(=O)C(=O)C1 PH008686 [0,1,0,1,0,0|0,0,0]=2 246 B10R1.230 CC1(CCCCC1=O)CO T183903 [0,1,0,1,0,0|0,0,2]=4 247 B10R1.411 COC(=O)C1(CCCC1)N PH010854 [0,1,0,1,0,0|1,0,1]=4 248 B10R1.31 CNC1CCN(C1)C(=O)C PH019360 [0,1,0,1,0,0|2,0,0]=4 249 B10R1.113 CC(=O)N1CCCC(C1)N CBR00904 [0,1,0,1,0,0|2,0,0]=4 250 B10R1.113 CC(=O)N1CCCC(C1)O CBR01458 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.118 CC1NC(=O)C(=O)OC1C S756261 [0,1,0,1,0,0|2,0,0]=4 252 B10R1.131 CCCC1OC(=O)C(O1)C S397873 [0,1,0,1,0,0|0,0,2]=4 253 B10R1.131 CNCC1CC(=O)N(C1)C CBR01734 [0,1,0,1,0,0|2,0,0]=4 254 B10R2.61 O=C1CC2CCCC1C2 T289124 [0,0,0,2,0,0|1,0,1]=4 255 B10R2.65 CC12CC1CCCC2=O T180947 [0,0,0,2,0,0|1,0,1]=4 256 B10R0.78 CCCNC(=O)/C=C/C(=O)O S618845 [0,0,0,0,0,2|2,0,0]=4