0 B12R1.8 BrCCCCCC1=CC=CC=C1 PH016116 [0,0,0,0,0,0|1,0,0]=1 1 B12R1.8 BrCCCCSC1=CC=CC=C1 PH010302 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.8 C#CCCOCC1=CC=CC=C1 T269069 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.8 C(=N/NC1=CC=CC=C1)\CCC S848905 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.8 CCCCCOC1=CC=CC=C1 S563374 [0,0,0,0,0,0|2,0,0]=2 5 B12R1.8 CCCCCOC1=CN=CC=C1 S417505 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.8 CCCCN=CC1=CC=CC=C1 S381322 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.8 CCCNCCC1=CC=CC=C1 CBR00107 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.8 CCCNCCC1=NC=CC=C1 VBP00004 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.8 CCNCCCC1=CC=CC=C1 PH014136 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.8 CCNCCOC1=CC=CC=C1 CBR00951 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.8 CNCCCCC1=CN=CC=N1 PH012752 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.8 CNCCNCC1=CC=CC=C1 PH010277 [0,0,0,0,0,0|3,0,0]=3 13 B12R1.8 ClCCCOCC1=CC=CC=C1 PH011743 [0,0,0,0,0,0|2,0,0]=2 14 B12R1.8 N#CCCCCC1=CC=CC=C1 PH002674 [0,0,0,0,0,0|1,0,1]=2 15 B12R1.8 N#CCCCOC1=CC=CC=C1 PH010897 [0,0,0,0,0,0|2,0,1]=3 16 B12R1.8 N#CCCCSC1=CC=CC=C1 S620181 [0,0,0,0,0,0|2,0,1]=3 17 B12R1.8 N#CCCOCC1=CC=CC=C1 ANV00259 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.8 N#CCCSCC1=CC=CC=C1 S614068 [0,0,0,0,0,0|2,0,1]=3 19 B12R1.8 N#CCOCCC1=CC=CC=C1 S148911 [0,0,0,0,0,0|2,0,1]=3 20 B12R1.8 NNCCCCC1=CC=CC=C1 PH018955 [0,0,0,0,0,0|2,0,0]=2 21 B12R1.8 OCCCNCC1=CC=CC=C1 S376310 [0,0,0,0,0,0|1,0,0]=1 22 B12R1.8 OCCCNCC1=CC=CC=N1 S355275 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.8 OCCCSCC1=CC=CC=C1 T166324 [0,0,0,0,0,0|1,0,0]=1 24 B12R1.8 OCCSCCC1=NC=CC=C1 PH011432 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.8 S=C=NCCCC1=CC=CC=C1 CDS020794 [0,0,0,0,0,0|1,1,1]=3 26 B11R1.28 C#CCCCC1=CC=CC=C1 CDS001437 [1,0,0,0,0,0|0,0,2]=3 27 B11R1.28 C#CCOCC1=CC=CC=C1 T268720 [1,0,0,0,0,0|1,0,2]=4 28 B11R1.28 C/C=C/COC1=CC=CC=C1 S767832 [1,0,0,0,0,0|1,0,2]=4 29 B11R1.28 C/C=C/CSC1=CC=CC=C1 S746207 [1,0,0,0,0,0|1,0,2]=4 30 B11R1.28 C=CCNCC1=CC=CC=C1 ANV00005 [1,0,0,0,0,0|1,0,2]=4 31 B11R1.28 C=CCNCC1=CC=CC=C1 CBR01347 [1,0,0,0,0,0|1,0,2]=4 32 B11R1.28 CC#CCOC1=CC=CC=C1 PH009632 [1,0,0,0,0,0|1,0,2]=4 33 B11R1.28 CCC/C=C/C1=CC=CC=C1 S579645 [1,0,0,0,0,0|0,0,2]=3 34 B11R1.28 CCCCOC1=NC=CC=C1 S434299 [1,0,0,0,0,0|2,0,0]=3 35 B11R1.28 CCCCSC1=NC=CC=N1 PH008617 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.28 CCCN=CC1=CC=CC=C1 S376639 [1,0,0,0,0,0|1,0,1]=3 37 B11R1.28 CCNCCC1=CC=CC=N1 S361453 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.28 CCNCCC1=CC=NC=C1 OTV000969 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.28 CCO/C=C/C1=CC=CC=C1 S722103 [1,0,0,0,0,0|1,0,2]=4 40 B11R1.28 CCOCCC1=CC=CC=N1 S361402 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.28 CCOCCC1=CC=NC=C1 S368741 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.28 CNCCCC1=CC=CC=C1 CDS006632 [1,0,0,0,0,0|1,0,0]=2 43 B11R1.28 COCCOC1=CC=CC=C1 S793000 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.28 COCCSC1=CC=CC=C1 TMT00668 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.28 CSCCOC1=CC=CC=C1 S697990 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.28 ClCCCSC1=CC=CC=C1 S799211 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.28 ClCCNCC1=CC=CC=C1 S377872 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.28 N#CCOCC1=CC=CC=C1 S240400 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.28 NCCCNC1=CC=CC=C1 CDS021448 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.28 NCCCNC1=CC=CC=N1 PH014605 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.28 NCCCOC1=CC=CC=C1 PH010546 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.28 NCCCOC1=CC=CC=C1 VBP00077 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.28 NNCCCC1=CC=NC=C1 PH019436 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.28 NNCCCC1=NC=CC=C1 PH019447 [1,0,0,0,0,0|3,0,0]=4 55 B11R1.28 NOCCOC1=CC=CC=C1 CDS015326 [1,0,0,0,0,0|3,0,0]=4 56 B11R1.28 O/N=C/CCC1=CC=CC=C1 PH009095 [1,0,0,0,0,0|1,0,1]=3 57 B11R1.28 OCC/N=C/C1=CC=CC=C1 PH007114 [1,0,0,0,0,0|1,0,1]=3 58 B11R1.28 OCCCNC1=NC=CC=C1 EME00343 [1,0,0,0,0,0|2,0,0]=3 59 B11R1.28 OCCCSC1=CC=CC=C1 S799238 [1,0,0,0,0,0|1,0,0]=2 60 B11R1.28 OCCNCC1=NC=CC=C1 PH014542 [1,0,0,0,0,0|2,0,0]=3 61 B13R1.6 CC1=CC(=CC=C1)OCCCCCl S363707 [0,1,0,0,0,0|2,0,0]=3 62 B13R1.6 CCNCCOC1=CC=CC(=C1)C PH012546 [0,1,0,0,0,0|3,0,0]=4 63 B13R1.6 CNCCCOC1=CC=CC(=C1)Cl CBR00243 [0,1,0,0,0,0|3,0,0]=4 64 B13R1.6 ClC1=CC(=CC=C1)OCCCCBr PH011043 [0,1,0,0,0,0|2,0,0]=3 65 B13R1.6 NCCCCOC1=CC=CC(=C1)O PH012980 [0,1,0,0,0,0|2,0,0]=3 66 B13R1.9 CC1=CC=C(C=C1)OCCCCCl S363715 [0,1,0,0,0,0|2,0,0]=3 67 B13R1.9 CCCCCCC1=CC=C(C=C1)O CDS000247 [0,1,0,0,0,0|1,0,0]=2 68 B13R1.9 CCCCCOC1=CC=C(C=C1)O PH011487 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.9 CCNCCOC1=CC=C(C=C1)Cl PH012070 [0,1,0,0,0,0|3,0,0]=4 70 B13R1.9 CNCCCOC1=CC=C(C=C1)Cl CBR00262 [0,1,0,0,0,0|3,0,0]=4 71 B13R1.9 COCCCNC1=CC=C(C=C1)N S883050 [0,1,0,0,0,0|3,0,0]=4 72 B13R1.9 ClCCCCSC1=CC=C(C=C1)Cl PH010751 [0,1,0,0,0,0|2,0,0]=3 73 B13R1.9 FC1=CC=C(C=C1)OCCCCBr PH011048 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.24 C=CCCCS(=O)C1=CC=CC=C1 T293229 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.24 CCCCNC(=O)C1=CC=CC=C1 R128538 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.24 CCCCNC(C)C1=CC=CC=C1 R592528 [0,1,0,0,0,0|2,0,0]=3 77 B13R1.24 ClCCNCC(Cl)C1=CC=CC=C1 PH012046 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.28 BrCC/C=C/CSC1=CC=CC=C1 T245429 [0,1,0,0,0,0|1,0,2]=4 79 B13R1.28 C#CCCCC#CC1=CC=CC=C1 T304271 [0,1,0,0,0,0|1,0,2]=4 80 B13R1.28 C#CCCCOCC1=CC=CC=C1 T286494 [0,1,0,0,0,0|1,0,1]=3 81 B13R1.28 CCCCC/N=C\C1=CC=CC=C1 PH008433 [0,1,0,0,0,0|1,0,1]=3 82 B13R1.28 CCCCNCCC1=CN=CC=N1 PH012721 [0,1,0,0,0,0|3,0,0]=4 83 B13R1.28 CCCCOCCC1=NC=CC=C1 PH007371 [0,1,0,0,0,0|2,0,0]=3 84 B13R1.28 CCCCSCCC1=NC=CC=C1 PH007370 [0,1,0,0,0,0|2,0,0]=3 85 B13R1.28 CCCNCCOC1=CC=CC=C1 PH013289 [0,1,0,0,0,0|2,0,0]=3 86 B13R1.28 ClCCCCCCC1=CC=CC=C1 PH000050 [0,1,0,0,0,0|1,0,0]=2 87 B13R1.28 N#CCCCCCC1=CC=CC=C1 PH011038 [0,1,0,0,0,0|1,0,0]=2 88 B13R1.28 NCCCCCOC1=CC=CC=C1 PH010158 [0,1,0,0,0,0|1,0,0]=2 89 B13R1.28 NCCCCNCC1=CC=CC=C1 PH010300 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.28 O=CNCCCCC1=CC=CC=C1 PH000636 [0,1,0,0,0,0|0,0,2]=3 91 B13R1.28 OC/C=C/COCC1=CC=CC=C1 T274372 [0,1,0,0,0,0|0,0,2]=3 92 B13R1.28 OCCCCNCC1=CC=CC=C1 CDS000390 [0,1,0,0,0,0|0,0,0]=1 93 B13R1.42 C=C(CCO)CSC1=CC=CC=C1 T232815 [0,1,0,0,0,0|1,0,1]=3 94 B13R1.42 CCCC(=O)NCC1=CC=CC=C1 R343269 [0,1,0,0,0,0|2,0,1]=4 95 B13R1.42 CCCC(O)CSC1=CC=CC=C1 S314021 [0,1,0,0,0,0|2,0,0]=3 96 B13R1.42 CN(CCN)CCC1=CC=CC=C1 PH014610 [0,1,0,0,0,0|2,0,0]=3 97 B13R1.42 CNCC(O)COC1=CC=CC=C1 CDS001676 [0,1,0,0,0,0|3,0,0]=4 98 B13R1.42 O=C(CCCl)NCC1=CC=CC=C1 S358282 [0,1,0,0,0,0|2,0,1]=4 99 B13R1.42 O=C(CCO)NNC1=CC=CC=C1 PH007197 [0,1,0,0,0,0|2,0,1]=4 100 B13R1.44 CCCCC(O)CC1=CC=CC=C1 S782025 [0,1,0,0,0,0|1,0,0]=2 101 B13R1.44 CN(CCCCl)CC1=CC=CC=C1 S427357 [0,1,0,0,0,0|2,0,0]=3 102 B13R1.44 CN(CCCN)CC1=CC=CC=C1 OTV000381 [0,1,0,0,0,0|2,0,0]=3 103 B13R1.44 CNCCN(C)CC1=CC=CC=C1 PH014509 [0,1,0,0,0,0|3,0,0]=4 104 B13R1.44 O=C(CC1=CC=CC=C1)NCCO PH001912 [0,1,0,0,0,0|1,0,1]=3 105 B13R1.44 O=C(CCCCl)OC1=CC=CC=C1 S354538 [0,1,0,0,0,0|2,0,1]=4 106 B13R1.44 O=C(NCCO)NC1=CC=CC=C1 S556297 [0,1,0,0,0,0|2,0,1]=4 107 B13R1.44 OCCNC(=S)NC1=CC=CC=C1 S531359 [0,1,0,0,0,0|2,0,1]=4 108 B13R1.337 NC(=O)CCSCC1=CC=CC=C1 S620157 [0,1,0,0,0,0|1,0,2]=4 109 B13R1.337 NC(=O)OCCCC1=CC=CC=C1 PH006883 [0,1,0,0,0,0|1,0,2]=4 110 B13R1.337 O=C(Cl)CCCOC1=CC=CC=C1 CDS000728 [0,1,0,0,0,0|1,0,2]=4 111 B13R1.337 O=C(O)CCNCC1=CC=CC=C1 PH010076 [0,1,0,0,0,0|1,0,1]=3 112 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 ANV00333 [0,1,0,0,0,0|1,0,1]=3 113 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 S541575 [0,1,0,0,0,0|1,0,1]=3 114 B13R1.337 O=C(O)CSCCC1=CC=CC=C1 S541567 [0,1,0,0,0,0|1,0,1]=3 115 B13R1.555 CC1=CC=CC=C1OCCCCCl S353205 [0,1,0,0,0,0|2,0,0]=3 116 B13R1.555 CCCCCCC1=C(C=CC=C1)O PH007151 [0,1,0,0,0,0|1,0,0]=2 117 B13R1.555 ClC1=CC=CC=C1OCCCCBr PH000368 [0,1,0,0,0,0|2,0,0]=3 118 B13R1.555 FC1=C(C=CC=C1)COCCCBr PH001814 [0,1,0,0,0,0|2,0,0]=3 119 B13R1.555 OCCCOCC1=CC=CC=C1F ANV00325 [0,1,0,0,0,0|1,0,0]=2 120 B13R1.718 COC(=O)CCCC1=CC=CC=C1 PH010421 [0,1,0,0,0,0|2,0,1]=4 121 B13R1.718 C[C@@H](CO)COCC1=CC=CC=C1 T252972 [0,1,0,0,0,0|1,0,0]=2 122 B13R1.718 O=C(CBr)NCCC1=CC=CC=C1 CDS006204 [0,1,0,0,0,0|2,0,1]=4 123 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 R397792 [0,1,0,0,0,0|2,0,1]=4 124 B13R2.1 N#CCN1CCC2=C1C=CC=C2 PH011604 [0,0,0,1,0,0|2,0,1]=4 125 B13R2.1 NCCN1CCC2=CC=CC=C12 CBR01137 [0,0,0,1,0,0|2,0,0]=3 126 B13R2.3 C1=CC(=CC=N1)C2CCNCC2 CBR00621 [0,0,0,1,0,0|3,0,0]=4 127 B13R2.3 C1=CC(=CC=N1)C2CCNCC2 CDS015527 [0,0,0,1,0,0|3,0,0]=4 128 B13R2.3 C1=CC(=CC=N1)C2CCOCC2 S546267 [0,0,0,1,0,0|3,0,0]=4 129 B13R2.3 C1=CC(=CN=C1)C2CNCCS2 PH014942 [0,0,0,1,0,0|2,1,0]=4 130 B13R2.3 C1=CC=C(C=C1)C2=CCNCC2 CDS005086 [0,0,0,1,0,0|2,0,1]=4 131 B13R2.3 C1=CC=C(C=C1)C2CC=CCC2 CDS000056 [0,0,0,1,0,0|1,0,2]=4 132 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 CDS006181 [0,0,0,1,0,0|2,0,0]=3 133 B13R2.3 C1=CC=C(C=C1)C2COCCN2 CDS019264 [0,0,0,1,0,0|2,0,0]=3 134 B13R2.3 C1=CC=C(C=C1)C2CSCCN2 CDS010247 [0,0,0,1,0,0|2,0,0]=3 135 B13R2.3 C1=CC=C(C=C1)N2CCCNC2 PH012041 [0,0,0,1,0,0|3,0,0]=4 136 B13R2.3 C1=CC=C(C=C1)N2CCNCC2 S364509 [0,0,0,1,0,0|3,0,0]=4 137 B13R2.3 C1=CC=C(N=C1)C2CCCCN2 CBR02282 [0,0,0,1,0,0|2,0,0]=3 138 B13R2.3 [SiH]1(CCCCC1)C2=CC=CC=C2 S830259 [0,0,0,1,0,0|1,1,0]=3 139 B13R2.15 CC1NCCC1C2=CC=CC=C2 PH012643 [0,0,0,1,0,0|2,0,0]=3 140 B13R2.15 CN1CCOC1C2=CC=CC=C2 T152714 [0,0,0,1,0,0|3,0,0]=4 141 B13R2.15 NN1CCCC1C2=CC=CC=C2 PH011021 [0,0,0,1,0,0|2,0,0]=3 142 B13R2.15 N[C@H]1CCC[C@@H]1C2=CC=CC=C2 PH018837 [0,0,0,1,0,0|1,0,0]=2 143 B13R2.15 O=C1CCCC1C2=CC=CC=N2 PH013013 [0,0,0,1,0,0|1,0,2]=4 144 B13R2.15 O=C1NCCC1C2=CC=CC=C2 PH002073 [0,0,0,1,0,0|1,0,2]=4 145 B13R2.64 C1=CC=C(C=C1)CN2CCCC2 PH011177 [0,0,0,1,0,0|2,0,0]=3 146 B13R2.64 C1=CC=C(C=C1)CN2CCOC2 CDS000096 [0,0,0,1,0,0|3,0,0]=4 147 B13R2.64 C1=CC=C(C=C1)C[S+]2CCCC2 SYX00265 [0,0,0,1,0,0|2,0,0]=3 148 B13R2.64 C1=CC=C(C=C1)NC2CCCC2 PH011144 [0,0,0,1,0,0|2,0,0]=3 149 B13R2.64 C1=CC=C(C=C1)SC2C=CCC2 T278858 [0,0,0,1,0,0|2,0,1]=4 150 B13R2.64 C1=CC=C(C=C1)[Se]C2=CCCO2 T292648 [0,0,0,1,0,0|1,0,2]=4 151 B13R2.64 C1=CC=C(N=C1)CC2CCCN2 CDS013764 [0,0,0,1,0,0|2,0,0]=3 152 B13R2.64 C1=CN=C(C=C1)NC2CCCC2 EME00355 [0,0,0,1,0,0|3,0,0]=4 153 B13R2.64 N1CCN=C1CC2=CC=CC=C2 S734241 [0,0,0,1,0,0|2,0,1]=4 154 B13R2.67 C1=CC=C2CCCCCCC2=C1 T170933 [0,0,0,1,0,0|1,0,0]=2 155 B13R2.67 C1=CCC2=C(C1)CCCCCC2 T169773 [0,0,0,1,0,0|1,0,2]=4 156 B13R2.1613 CCC1NCCC2=C1C=CC=C2 PH016245 [0,0,0,1,0,0|2,0,0]=3 157 B13R2.1613 NNC1CCCC2=CC=CC=C12 PH019356 [0,0,0,1,0,0|2,0,0]=3 158 B13R2.1613 NNC1CCOC2=CC=CC=C12 PH019432 [0,0,0,1,0,0|3,0,0]=4 159 B13R2.1613 O/N=C/1\CCCC2=C1C=CC=C2 S702498 [0,0,0,1,0,0|1,0,1]=3 160 B13R2.1613 O/N=C/1\CCSC2=C1C=CC=C2 S659258 [0,0,0,1,0,0|2,0,1]=4 161 B13R2.1613 O/N=C\1/CCCC2=C1C=CC=N2 PH009629 [0,0,0,1,0,0|2,0,1]=4 162 B13R2.2383 C1=CC=C(C=C1)COC2CNC2 CBR01702 [0,0,0,1,0,0|3,0,0]=4 163 B13R2.5252 CN1CCCCC2=CC=CC=C12 T167851 [0,0,0,1,0,0|2,0,0]=3 164 B13R2.5252 O=C1CCCSC2=C1C=CC=C2 S761877 [0,0,0,1,0,0|1,0,2]=4 165 B13R2.5252 O=C1NCCCC2=CC=CC=C12 CDS005171 [0,0,0,1,0,0|1,0,2]=4 166 B13R2.5252 OC1CCCSC2=C1C=CC=C2 S759236 [0,0,0,1,0,0|1,0,0]=2 167 B11R1.4 OCCCNCC1=CC=CO1 CDS002750 [0,0,0,0,1,0|2,0,0]=3 168 B10R0.71 C=CCC/C=C\CCCCO S310573 [1,0,1,0,0,0|0,0,2]=4 169 B10R1.17 BrCCNC1=CC=CC=C1 S374776 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.17 BrCCSC1=CC=CC=C1 PH011242 [2,0,0,0,0,0|2,0,0]=4 171 B10R1.17 CCCC[N+]1=CC=CC=C1 CDS000353 [2,0,0,0,0,0|1,0,0]=3 172 B10R1.17 CCNCC1=NC=CC=C1 CBR00044 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.17 CNCCC1=CC=NC=C1 CDS007517 [2,0,0,0,0,0|2,0,0]=4 174 B10R1.17 CNCCC1=NC=CC=C1 R750492 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.17 COCCC1=CC=NC=C1 PH007374 [2,0,0,0,0,0|2,0,0]=4 176 B10R1.17 CSCCC1=NC=CC=C1 PH007369 [2,0,0,0,0,0|2,0,0]=4 177 B10R1.17 ClCCCC1=CC=CC=N1 CDS021720 [2,0,0,0,0,0|2,0,0]=4 178 B10R1.17 NNCCC1=CC=CC=C1 CDS015167 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.17 [SiH3]CCCC1=CC=CC=C1 S833584 [2,0,0,0,0,0|0,1,0]=3 180 B12R1.1 BrCCCOC1=CC=C(C=C1)Br PH000245 [1,1,0,0,0,0|2,0,0]=4 181 B12R1.1 CC1=CC=C(C=C1)CCCCO JRD0946 [1,1,0,0,0,0|0,0,0]=2 182 B12R1.1 CC1=CC=C(C=C1)OCCCBr PH011050 [1,1,0,0,0,0|2,0,0]=4 183 B12R1.1 CCC/C=C/C1=CC=C(C=C1)Cl PH008528 [1,1,0,0,0,0|0,0,2]=4 184 B12R1.1 CCCCOC1=CC=C(C=C1)Br PH014759 [1,1,0,0,0,0|1,0,0]=3 185 B12R1.1 CCCCOC1=CC=C(C=N1)N S357502 [1,1,0,0,0,0|2,0,0]=4 186 B12R1.1 CCCCSC1=CC=C(C=C1)C S799149 [1,1,0,0,0,0|1,0,0]=3 187 B12R1.1 CCCNCC1=CC=C(C=C1)Cl PH010169 [1,1,0,0,0,0|1,0,0]=3 188 B12R1.1 CNCCOC1=CC=C(C=C1)C PH012059 [1,1,0,0,0,0|2,0,0]=4 189 B12R1.1 ClCCCSC1=CC=C(C=C1)Br S799203 [1,1,0,0,0,0|2,0,0]=4 190 B12R1.1 ClCCCSC1=CC=C(C=C1)Cl S803723 [1,1,0,0,0,0|2,0,0]=4 191 B12R1.1 ClCCNCC1=CC=C(C=C1)Cl S377902 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.1 ClCCSCC1=CC=C(C=C1)Cl S637939 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.1 FC1=CC=C(C=C1)OCCCBr PH011047 [1,1,0,0,0,0|2,0,0]=4 194 B12R1.1 NCCCOC1=CC=C(C=C1)Cl PH011995 [1,1,0,0,0,0|2,0,0]=4 195 B12R1.1 OCC/N=C/C1=CC=C(C=C1)Cl S753289 [1,1,0,0,0,0|1,0,1]=4 196 B12R1.1 OCC/N=C/C1=CC=C(C=C1)O S691011 [1,1,0,0,0,0|1,0,1]=4 197 B12R1.1 OCCCCC1=CC=C(C=C1)Br JRD0948 [1,1,0,0,0,0|0,0,0]=2 198 B12R1.1 OCCCCC1=CC=C(C=C1)Cl JRD0947 [1,1,0,0,0,0|0,0,0]=2 199 B12R1.1 OCCCCC1=CC=C(C=C1)F JRD0949 [1,1,0,0,0,0|0,0,0]=2 200 B12R1.1 OCCCOC1=CC=C(C=C1)F PH016159 [1,1,0,0,0,0|1,0,0]=3 201 B12R1.1 OCCNCC1=CC=C(C=C1)Cl S378291 [1,1,0,0,0,0|1,0,0]=3 202 B12R1.1 OCCSCC1=CC=C(C=C1)Cl S614092 [1,1,0,0,0,0|1,0,0]=3 203 B12R1.27 CCC(=O)CCC1=CC=CC=C1 S570338 [1,1,0,0,0,0|0,0,1]=3 204 B12R1.27 NCC(O)COC1=CC=CC=C1 PH010102 [1,1,0,0,0,0|2,0,0]=4 205 B12R1.27 O=C(CCl)CCC1=CC=CC=C1 PH016229 [1,1,0,0,0,0|1,0,1]=4 206 B12R1.27 OC(CCl)CSC1=CC=CC=C1 PH009388 [1,1,0,0,0,0|2,0,0]=4 207 B12R1.27 OCC(O)COC1=CN=CC=C1 PH008942 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.27 OCC(O)CSC1=CC=CC=C1 S614637 [1,1,0,0,0,0|1,0,0]=3 209 B12R1.28 CC1=CC(=CC=C1)SCCCCl S799289 [1,1,0,0,0,0|2,0,0]=4 210 B12R1.28 CC1=CC=CC(=C1)OCCCBr PH000366 [1,1,0,0,0,0|2,0,0]=4 211 B12R1.28 CCCCOC1=CC=CC(=C1)N CBR00368 [1,1,0,0,0,0|1,0,0]=3 212 B12R1.28 CCCCOC1=CC=CC(=C1)O PH015345 [1,1,0,0,0,0|1,0,0]=3 213 B12R1.28 CCOCCC1=CC=CC(=N1)C S361399 [1,1,0,0,0,0|2,0,0]=4 214 B12R1.28 COCCOC1=CC(=CC=C1)N CBR01420 [1,1,0,0,0,0|2,0,0]=4 215 B12R1.28 ClC1=CC(=CC=C1)OCCCBr PH000250 [1,1,0,0,0,0|2,0,0]=4 216 B12R1.28 NCCCOC1=CC=CC(=C1)Cl CDS002045 [1,1,0,0,0,0|2,0,0]=4 217 B12R1.30 CC(OCCO)C1=CC=CC=C1 PH001956 [1,1,0,0,0,0|1,0,0]=3 218 B12R1.30 CCCCC(O)C1=CC=CC=C1 S458872 [1,1,0,0,0,0|0,0,0]=2 219 B12R1.30 CCCNC(=O)C1=CC=CC=C1 S779121 [1,1,0,0,0,0|1,0,1]=4 220 B12R1.30 CCSCC(=O)C1=CC=CC=C1 S577030 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.30 O=C(NCCO)C1=CC=CC=C1 EME00384 [1,1,0,0,0,0|1,0,1]=4 222 B12R1.30 OCC#CC(O)C1=CC=CC=C1 PH007064 [1,1,0,0,0,0|0,0,2]=4 223 B12R1.30 OCCNC(=S)C1=CC=CC=C1 T149144 [1,1,0,0,0,0|1,0,1]=4 224 B12R1.32 C=CCC(O)CC1=CC=CC=C1 PH010446 [1,1,0,0,0,0|0,0,2]=4 225 B12R1.32 CC#CC(O)CC1=CC=CC=C1 S935468 [1,1,0,0,0,0|0,0,2]=4 226 B12R1.32 CC(CCN)SC1=CC=CC=C1 S117501 [1,1,0,0,0,0|2,0,0]=4 227 B12R1.32 CCCC(O)CC1=CC=CC=C1 R425753 [1,1,0,0,0,0|0,0,0]=2 228 B12R1.32 CCNC(=O)CC1=CC=CC=C1 PH007355 [1,1,0,0,0,0|1,0,1]=4 229 B12R1.32 CN(CCCl)CC1=CC=CC=C1 S427179 [1,1,0,0,0,0|2,0,0]=4 230 B12R1.252 CC(=O)CCSC1=CC=CC=C1 S635030 [1,1,0,0,0,0|1,0,1]=4 231 B12R1.252 CC(=O)CSCC1=CC=CC=C1 S646199 [1,1,0,0,0,0|1,0,1]=4 232 B12R1.252 CC(=O)NCCC1=CC=CC=C1 S581887 [1,1,0,0,0,0|1,0,1]=4 233 B12R1.252 CC(C)CCNC1=CC=CC=C1 S705780 [1,1,0,0,0,0|1,0,0]=3 234 B12R1.252 CC(C)CNCC1=CC=CC=C1 CBR01593 [1,1,0,0,0,0|1,0,0]=3 235 B12R1.252 CC(C)NCCC1=CC=CC=N1 PH010347 [1,1,0,0,0,0|2,0,0]=4 236 B12R1.252 CC(O)C/N=C/C1=CC=CC=C1 PH009580 [1,1,0,0,0,0|1,0,1]=4 237 B12R1.252 CC(O)CCCC1=CC=CC=C1 PH000677 [1,1,0,0,0,0|0,0,0]=2 238 B12R1.252 CC(O)CCSC1=CC=CC=C1 T233005 [1,1,0,0,0,0|1,0,0]=3 239 B12R1.252 CC(O)CNCC1=CC=CC=C1 PH009735 [1,1,0,0,0,0|1,0,0]=3 240 B12R1.252 CC(O)COCC1=CC=CC=C1 S376620 [1,1,0,0,0,0|1,0,0]=3 241 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 PH007995 [1,1,0,0,0,0|1,0,0]=3 242 B12R1.252 NC(=O)CCCC1=CC=CC=C1 S669202 [1,1,0,0,0,0|0,0,2]=4 243 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 PH000271 [1,1,0,0,0,0|0,0,2]=4 244 B12R1.252 O=C(O)CCNC1=CC=CC=C1 R155780 [1,1,0,0,0,0|1,0,1]=4 245 B12R1.252 O=C(O)CCSC1=CC=CC=C1 L305855 [1,1,0,0,0,0|1,0,1]=4 246 B12R1.252 O=C(O)CC[Te]C1=CC=CC=C1 S949442 [1,1,0,0,0,0|1,0,1]=4 247 B12R1.252 [SiH](C)(C)CCCC1=CC=CC=C1 S829870 [1,1,0,0,0,0|0,1,0]=3 248 B12R1.267 BrCCCOC1=C(C=CC=C1)Br PH011151 [1,1,0,0,0,0|2,0,0]=4 249 B12R1.267 CC1=CC=CC=C1OCCCBr PH000372 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.267 CCCCOC1=CC=CC=C1C S518476 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.267 CCCCOC1=CC=CC=C1N CDS001693 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.267 CCCCON1C=CC=CC1=O T300780 [1,1,0,0,0,0|2,0,0]=4 253 B12R1.267 CCCNCC1=CC=CC=C1N PH010097 [1,1,0,0,0,0|1,0,0]=3 254 B12R1.267 CNCCOC1=CC=CC=C1C PH012062 [1,1,0,0,0,0|2,0,0]=4 255 B12R1.267 COCCOC1=C(C=CC=C1)N CBR00261 [1,1,0,0,0,0|2,0,0]=4 256 B12R1.267 ClC1=C(C=CC=C1)OCCCBr PH000248 [1,1,0,0,0,0|2,0,0]=4 257 B12R1.255 O=C(O)CCCCC1=CC=CS1 R436631 [0,1,0,0,1,0|1,0,1]=4 258 B14R1.26 CCCCCCOC1=CC(=CC=C1)N S183342 [0,2,0,0,0,0|1,0,0]=3 259 B14R1.26 CNCCCCOC1=CC=CC(=C1)O PH012988 [0,2,0,0,0,0|2,0,0]=4 260 B14R1.218 CC1=CC=C(C(=C1)OCCCCBr)C PH000369 [0,2,0,0,0,0|2,0,0]=4 261 B14R1.228 CCCCCOC1=CC(=CC=C1)C=O PH010585 [0,2,0,0,0,0|2,0,0]=4 262 B14R1.14 C=CCCCCOC1=CC=C(C=C1)O S262293 [0,2,0,0,0,0|1,0,1]=4 263 B14R1.14 CCCCCCCC1=CC=C(C=C1)O CDS000684 [0,2,0,0,0,0|1,0,0]=3 264 B14R1.14 FC1=CC=C(C=C1)OCCCCCBr PH000247 [0,2,0,0,0,0|1,0,0]=3 265 B14R1.19 CCCCCC(=O)C1=CC=C(C=C1)Cl S759295 [0,2,0,0,0,0|1,0,1]=4 266 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Br JRD1063 [0,2,0,0,0,0|1,0,1]=4 267 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)Cl JRD1061 [0,2,0,0,0,0|1,0,1]=4 268 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)F JRD1062 [0,2,0,0,0,0|1,0,1]=4 269 B14R1.677 O=C(O)CCCOC1=CC=C(C=C1)F OTV000983 [0,2,0,0,0,0|1,0,1]=4 270 B14R1.774 CCCCCCC1=CC=C(C=C1C)O PH007150 [0,2,0,0,0,0|1,0,0]=3 271 B14R1.776 C#CC1=CC=C(C=C1)CCCCCC CDS000275 [0,2,0,0,0,0|1,0,0]=3 272 B14R1.776 CCCCCOC1=CC=C(C=C1)C=O PH011491 [0,2,0,0,0,0|2,0,0]=4 273 B14R1.776 COC1=CC=C(C=C1)COCCCO T269409 [0,2,0,0,0,0|1,0,0]=3 274 B14R1.29 CCCN(C)CC(O)C1=CC=CC=C1 PH014920 [0,2,0,0,0,0|2,0,0]=4 275 B14R1.38 C=CCCCCC(=O)C1=CC=CC=C1 T242071 [0,2,0,0,0,0|1,0,1]=4 276 B14R1.38 CCCCCOC(=O)C1=CC=CC=C1 CDS000554 [0,2,0,0,0,0|1,0,1]=4 277 B14R1.38 O=C(NCCCCO)C1=CC=CC=C1 PH003561 [0,2,0,0,0,0|0,0,1]=3 278 B14R1.38 O=C(OCCCCCl)C1=CC=CC=C1 S389447 [0,2,0,0,0,0|1,0,1]=4 279 B14R1.38 O=CCCCCC(=O)C1=CC=CC=C1 T270512 [0,2,0,0,0,0|0,0,2]=4 280 B14R1.38 [C@H](C)(NCCCNC)C1=CC=CC=C1 R644331 [0,2,0,0,0,0|2,0,0]=4 281 B14R1.166 CC(NCCO)C(O)C1=CC=CC=C1 S372609 [0,2,0,0,0,0|1,0,0]=3 282 B14R1.123 BrCCCCCCOC1=CC=CC=C1 PH011046 [0,2,0,0,0,0|1,0,0]=3 283 B14R1.123 CCCCCCOCC1=CC=CC=C1 S630160 [0,2,0,0,0,0|1,0,0]=3 284 B14R1.123 CCCCNCCOC1=CC=CC=C1 PH012073 [0,2,0,0,0,0|1,0,0]=3 285 B14R1.123 NCCCCCCOC1=CC=CC=C1 PH007485 [0,2,0,0,0,0|1,0,0]=3 286 B14R1.123 OCCCCCCCC1=CC=CC=C1 PH010503 [0,2,0,0,0,0|0,0,0]=2 287 B14R1.156 O=C(CCCCl)NCC1=CC=CC=C1 S529494 [0,2,0,0,0,0|1,0,1]=4 288 B14R1.156 O=C(COC1=CC=CC=C1)NCCO S350796 [0,2,0,0,0,0|1,0,1]=4 289 B14R1.158 CCCCCC(=O)OC1=CC=CC=C1 S657891 [0,2,0,0,0,0|1,0,1]=4 290 B14R1.158 CCCCNC(=O)CC1=CC=CC=C1 R371467 [0,2,0,0,0,0|1,0,1]=4 291 B14R1.422 CC(O)CCCCCC1=CC=CC=C1 PH008491 [0,2,0,0,0,0|0,0,0]=2 292 B14R1.422 CN(C)CCCNCC1=CC=CC=C1 PH010177 [0,2,0,0,0,0|2,0,0]=4 293 B14R1.422 O=C(O)CCCCOC1=CC=CC=C1 PH010984 [0,2,0,0,0,0|0,0,1]=3 294 B14R1.520 CCCC(=O)NCCC1=CC=CC=C1 R343404 [0,2,0,0,0,0|1,0,1]=4 295 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 S349542 [0,2,0,0,0,0|1,0,1]=4 296 B14R1.716 CCC(=O)OCCCC1=CC=CC=C1 S528544 [0,2,0,0,0,0|1,0,1]=4 297 B14R1.716 CCC(O)CCC#CC1=CC=CC=C1 S770892 [0,2,0,0,0,0|0,0,2]=4 298 B14R1.716 COC(=O)CCOCC1=CC=CC=C1 PH011057 [0,2,0,0,0,0|1,0,1]=4 299 B14R1.716 COC(=O)CCSCC1=CC=CC=C1 S614165 [0,2,0,0,0,0|1,0,1]=4 300 B14R1.716 O=C(CCl)NCCCC1=CC=CC=C1 TMT00612 [0,2,0,0,0,0|1,0,1]=4 301 B14R1.818 CC(C)CC(=O)CCC1=CC=CC=C1 S411000 [0,2,0,0,0,0|1,0,1]=4 302 B14R1.423 CC(C)NCC(O)CC1=CC=CC=C1 PH013395 [0,2,0,0,0,0|2,0,0]=4 303 B14R1.423 O=C(O)CCS(=O)CC1=CC=CC=C1 PH010240 [0,2,0,0,0,0|1,0,1]=4 304 B14R1.467 CCN(CCCN)CC1=CC=CC=C1 PH014715 [0,2,0,0,0,0|2,0,0]=4 305 B14R1.743 CC(CO)NC(=O)CC1=CC=CC=C1 PH010622 [0,2,0,0,0,0|1,0,1]=4 306 B14R1.4528 CCCCS(=O)(=O)CC1=CC=CC=C1 S799459 [0,2,0,0,0,0|2,0,0]=4 307 B14R1.4528 O=S(=O)(CCCCl)CC1=CC=CC=C1 T165298 [0,2,0,0,0,0|2,0,0]=4 308 B14R1.159 CC1=C(C=CC=C1)SCCCC(=O)O PH011741 [0,2,0,0,0,0|1,0,1]=4 309 B14R1.159 O=C(O)CCCOC1=C(C=CC=C1)Cl OTV000105 [0,2,0,0,0,0|1,0,1]=4 310 B14R1.159 O=C(O)CCOCC1=CC=CC=C1F ANV00320 [0,2,0,0,0,0|1,0,1]=4 311 B14R1.3331 O=S(=O)(O)CCCNC1=CC=CC=C1 S562688 [0,2,0,0,0,0|2,0,0]=4 312 B14R1.3331 O=S(=O)(O)CCCOC1=CC=CC=C1 PH016305 [0,2,0,0,0,0|2,0,0]=4 313 B14R1.6449 CC(CNCC1=CC=CC=C1)C(=O)O PH010724 [0,2,0,0,0,0|1,0,1]=4 314 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O PH010500 [0,2,0,0,0,0|0,0,1]=3 315 B14R1.6449 NC(CCOC1=CC=CC=C1)C(=O)O PH012937 [0,2,0,0,0,0|1,0,1]=4 316 B14R1.6449 NC(COCC1=CC=CC=C1)C(=O)O S635022 [0,2,0,0,0,0|1,0,1]=4 317 B14R1.837 CC1=CC=CC=C1COCC(O)CO S420573 [0,2,0,0,0,0|1,0,0]=3 318 B14R1.20339 ClC1=CC=CC(=C1OCCCCBr)Cl PH001306 [0,2,0,0,0,0|2,0,0]=4 319 B14R1.292 O=S(=O)(CCl)CCCC1=CC=CC=C1 T163767 [0,2,0,0,0,0|2,0,0]=4 320 B14R1.546 CCN(CC)CCCC1=CC=CC=C1 PH007031 [0,2,0,0,0,0|2,0,0]=4 321 B12R2.1 NNC1CCC2=CC=CC=C12 PH019558 [1,0,0,1,0,0|2,0,0]=4 322 B12R2.2 C1=CC(=CC=N1)C2CCCN2 CDS006470 [1,0,0,1,0,0|2,0,0]=4 323 B12R2.2 C1=CC(=CC=N1)C2OCCO2 PH000070 [1,0,0,1,0,0|2,0,0]=4 324 B12R2.2 C1=CC=C(C=C1)C2=CCCC2 L170011 [1,0,0,1,0,0|0,0,2]=4 325 B12R2.2 C1=CC=C(C=C1)C2CCCC2 S109770 [1,0,0,1,0,0|0,0,0]=2 326 B12R2.2 C1=CC=C(C=C1)C2CCCC2 S549312 [1,0,0,1,0,0|0,0,0]=2 327 B12R2.2 C1=CC=C(C=C1)C2NCCS2 S204609 [1,0,0,1,0,0|1,1,0]=4 328 B12R2.2 C1=CC=C(C=C1)C2OCCS2 S653845 [1,0,0,1,0,0|1,0,0]=3 329 B12R2.2 C1=CC=C(C=C1)[C@H]2CCNC2 CDS009943 [1,0,0,1,0,0|1,0,0]=3 330 B12R2.2 C1=CC=C(N=C1)C2CCCN2 MNO000103 [1,0,0,1,0,0|2,0,0]=4 331 B12R2.2 C1=CN=C(C=C1)N2CCCC2 EME00323 [1,0,0,1,0,0|2,0,0]=4 332 B12R2.27 N#CC1C[C@@H]1C2=CC=CC=C2 S446866 [1,0,0,1,0,0|1,0,1]=4 333 B12R2.41 C1=CC2=C(C=C1)CCCC=C2 T254290 [1,0,0,1,0,0|0,0,2]=4 334 B12R2.41 C1=CC=C2NCCNCC2=C1 PH010311 [1,0,0,1,0,0|2,0,0]=4 335 B12R2.1081 CC1=NCCC2=CC=CC=C12 T305197 [1,0,0,1,0,0|1,0,1]=4 336 B12R2.1081 OC1CCCC2=CC=CN=C12 CDS003538 [1,0,0,1,0,0|1,0,0]=3 337 B12R2.2057 C1=CC(=CC=N1)CNC2CC2 CBR02374 [1,0,0,1,0,0|2,0,0]=4 338 B12R2.2057 C1=CC=C(C=C1)CNC2CC2 CDS004803 [1,0,0,1,0,0|1,0,0]=3 339 B12R2.2057 C1=CN=CC(=C1)CNC2CC2 CBR02375 [1,0,0,1,0,0|2,0,0]=4 340 B14R2.21 BrC1=CC(=CC=C1)N2CCCCC2 CDS022067 [0,1,0,1,0,0|2,0,0]=4 341 B14R2.21 BrC1=CC=CC(=C1)C2NCCCS2 T149640 [0,1,0,1,0,0|1,1,0]=4 342 B14R2.21 CC1=CC(=CC=C1)C2=CCCCC2 S356158 [0,1,0,1,0,0|1,0,1]=4 343 B14R2.21 CC1=CC=CC(=C1)C2CCCNC2 CBR01260 [0,1,0,1,0,0|2,0,0]=4 344 B14R2.21 CC1=CC=CC(=C1)C2SCCCS2 T149594 [0,1,0,1,0,0|1,1,0]=4 345 B14R2.21 CC1CCCN(N1)C2=CC=CC=C2 CBR02313 [0,1,0,1,0,0|2,0,0]=4 346 B14R2.21 FC1=CC=CC(=C1)C2CCNCC2 CDS005497 [0,1,0,1,0,0|2,0,0]=4 347 B14R2.21 FC1=CC=CC(=C1)C2CCNCC2 CDS009654 [0,1,0,1,0,0|2,0,0]=4 348 B14R2.21 FC1=CC=CC(=C1)N2CCCCC2 PH013396 [0,1,0,1,0,0|2,0,0]=4 349 B14R2.21 NC1=CC=CC(=C1)C2=NCCCO2 PH007875 [0,1,0,1,0,0|1,0,1]=4 350 B14R2.21 NC1=CC=CC(=C1)C2OCCCO2 TMT00020 [0,1,0,1,0,0|1,0,0]=3 351 B14R2.21 O=C1CCCC(N1)C2=CC=CC=C2 T313149 [0,1,0,1,0,0|0,0,2]=4 352 B14R2.21 OC1=CC=CC(=C1)C2OCCCO2 TMT00070 [0,1,0,1,0,0|1,0,0]=3 353 B14R2.716 CC1=CC(=NC=C1)CC2CCCN2 PH019440 [0,1,0,1,0,0|2,0,0]=4 354 B14R2.716 NC1=CC(=CC=C1)CN2CCCC2 CBR01277 [0,1,0,1,0,0|2,0,0]=4 355 B14R2.716 NC1=CC=CC(=C1)OC2CCCC2 T316377 [0,1,0,1,0,0|2,0,0]=4 356 B14R2.716 OC1=CC=CC(=C1)CN2CCCC2 PH009277 [0,1,0,1,0,0|2,0,0]=4 357 B14R2.1252 C1=CC2=CC(=C1)CSCCCSC2 S300241 [0,1,0,1,0,0|1,1,0]=4 358 B14R2.68 BrC1=CC=C(C=C1)C2CCCCC2 S288748 [0,1,0,1,0,0|1,0,0]=3 359 B14R2.68 BrC1=CC=C(C=C1)C2CCNCC2 CDS008261 [0,1,0,1,0,0|2,0,0]=4 360 B14R2.68 BrC1=CC=C(C=C1)N2CCCCC2 VBP00057 [0,1,0,1,0,0|2,0,0]=4 361 B14R2.68 CC1=CC=C(C=C1)C2=CCCCC2 S356166 [0,1,0,1,0,0|1,0,1]=4 362 B14R2.68 CC1=CC=C(C=C1)C2CCNCC2 CDS007993 [0,1,0,1,0,0|2,0,0]=4 363 B14R2.68 CC1=CC=C(C=C1)C2NCCCS2 T149667 [0,1,0,1,0,0|1,1,0]=4 364 B14R2.68 CC1=CC=C(C=C1)C2SCCCS2 T149616 [0,1,0,1,0,0|1,1,0]=4 365 B14R2.68 ClC1=CC=C(C=C1)C2CCCNC2 CBR00403 [0,1,0,1,0,0|2,0,0]=4 366 B14R2.68 ClC1=CC=C(C=C1)C2CCNCC2 CDS015248 [0,1,0,1,0,0|2,0,0]=4 367 B14R2.68 FC1=CC=C(C=C1)C2COCCN2 CDS010500 [0,1,0,1,0,0|2,0,0]=4 368 B14R2.68 N=C1C=CC(=[N+]2CCCCC2)C=C1 S887595 [0,1,0,1,0,0|2,0,0]=4 369 B14R2.68 NC1=CC=C(C=C1)C2CCCCC2 PH000034 [0,1,0,1,0,0|1,0,0]=3 370 B14R2.72 BrC1=CC=C(C=C1)CN2CCCC2 PH015438 [0,1,0,1,0,0|2,0,0]=4 371 B14R2.72 ClC1=CC=C(C=C1)CN2CCCC2 PH012276 [0,1,0,1,0,0|2,0,0]=4 372 B14R2.72 NC1=CC=C(C=C1)CN2CCCC2 CBR00965 [0,1,0,1,0,0|2,0,0]=4 373 B14R2.926 N[C@@H]1CCC[C@@H]1C2=CC=C(C=C2)F PH018588 [0,1,0,1,0,0|1,0,0]=3 374 B14R2.11684 CC1=CC\2=C(C=C1)CCC/C2=N\O S671223 [0,1,0,1,0,0|1,0,1]=4 375 B14R2.8 CCC1OCC(O1)C2=CC=CC=C2 S941239 [0,1,0,1,0,0|2,0,0]=4 376 B14R2.8 CCN1CCC(C1)C2=CC=CC=C2 PH012481 [0,1,0,1,0,0|2,0,0]=4 377 B14R2.8 ClCC1CNC(O1)C2=CC=CC=C2 S344389 [0,1,0,1,0,0|2,0,0]=4 378 B14R2.8 NCC1CCN(C1)C2=CC=CC=C2 CDS010126 [0,1,0,1,0,0|2,0,0]=4 379 B14R2.8 OCC1CCN(C1)C2=CC=CC=C2 CBR00380 [0,1,0,1,0,0|1,0,0]=3 380 B14R2.114 C=C(C1=CC=CC=C1)C2CCCC2 S960012 [0,1,0,1,0,0|1,0,1]=4 381 B14R2.114 O=C(C1=CC=CC=C1)C2CCCC2 PH000033 [0,1,0,1,0,0|1,0,1]=4 382 B14R2.317 CC1NCCC1(O)C2=CC=CC=C2 PH012642 [0,1,0,1,0,0|2,0,0]=4 383 B14R2.317 C[C@@H]1CCC[C@@]1(C)C2=CC=CC=C2 T236691 [0,1,0,1,0,0|1,0,0]=3 384 B14R2.317 C[C@H]1CCC[C@@]1(C)C2=CC=CC=C2 T236705 [0,1,0,1,0,0|1,0,0]=3 385 B14R2.5540 CC1(CCOCO1)C2=CC=CC=C2 S669628 [0,1,0,1,0,0|1,0,0]=3 386 B14R2.5540 NC1(CCOCC1)C2=CC=CC=C2 OTV000613 [0,1,0,1,0,0|2,0,0]=4 387 B14R2.5540 OC1(C=CCCC1)C2=CC=CC=C2 T202290 [0,1,0,1,0,0|1,0,1]=4 388 B14R2.5540 OC1(CCOCC1)C2=CC=CC=C2 T320838 [0,1,0,1,0,0|2,0,0]=4 389 B14R2.3 CCCCN1CCC2=C1C=CC=C2 S869902 [0,1,0,1,0,0|1,0,0]=3 390 B14R2.6 C1=CC(=CC=N1)NC2CCCCC2 R908673 [0,1,0,1,0,0|2,0,0]=4 391 B14R2.6 C1=CC=C(C=C1)CC2CCCCC2 S511749 [0,1,0,1,0,0|1,0,0]=3 392 B14R2.6 C1=CC=C(C=C1)CC2CCCCN2 PH002329 [0,1,0,1,0,0|1,0,0]=3 393 B14R2.6 C1=CC=C(C=C1)CC2CNCCO2 CDS019174 [0,1,0,1,0,0|0,0,0]=2 394 B14R2.6 C1=CC=C(C=C1)CC2COCCN2 CDS010466 [0,1,0,1,0,0|1,0,0]=3 395 B14R2.6 C1=CC=C(C=C1)C[C@H]2NCCCO2 PH016293 [0,1,0,1,0,0|0,0,0]=2 396 B14R2.6 C1=CC=C(C=C1)NN2CCCCC2 PH012195 [0,1,0,1,0,0|2,0,0]=4 397 B14R2.6 C1=CC=C(C=C1)OC2C=CCCC2 T181099 [0,1,0,1,0,0|1,0,1]=4 398 B14R2.6 C1=CC=C(C=C1)SC2CCCCC2 T285129 [0,1,0,1,0,0|1,0,0]=3 399 B14R2.6 C1=CC=C(C=C1)SC2CCCCO2 S865001 [0,1,0,1,0,0|0,0,0]=2 400 B14R2.6 C1=CC=C(N=C1)CC2CCCCN2 PH018458 [0,1,0,1,0,0|2,0,0]=4 401 B14R2.6 C1=CC=C(N=C1)CN2CCCCC2 S354910 [0,1,0,1,0,0|2,0,0]=4 402 B14R2.6 C1=CC=C(N=C1)NC2CCCCC2 S512419 [0,1,0,1,0,0|2,0,0]=4 403 B14R2.6 C1=CN=C(C=C1)CC2CCCNC2 PH018229 [0,1,0,1,0,0|2,0,0]=4 404 B14R2.24 BrC1CCCCC1[N+]2=CC=CC=C2 R788252 [0,1,0,1,0,0|2,0,0]=4 405 B14R2.24 Br[C@H]1CCCCC1[N+]2=CC=CC=C2 L497991 [0,1,0,1,0,0|2,0,0]=4 406 B14R2.24 CC1=C(C=CC=C1)C2CCCNC2 CBR01834 [0,1,0,1,0,0|2,0,0]=4 407 B14R2.24 CC1=C(C=CC=C1)C2SCCCS2 T149608 [0,1,0,1,0,0|1,1,0]=4 408 B14R2.24 CC1=CC=CC=C1C2=CCCCC2 S356093 [0,1,0,1,0,0|1,0,1]=4 409 B14R2.24 CN1CCNCC1C2=CC=CC=C2 CBR00615 [0,1,0,1,0,0|2,0,0]=4 410 B14R2.24 ClC1=CC=CC=C1C2=CCCCC2 PH001373 [0,1,0,1,0,0|1,0,1]=4 411 B14R2.24 ClC1=CC=CC=C1C2CNCCS2 PH015147 [0,1,0,1,0,0|1,1,0]=4 412 B14R2.24 ClC1COCOC1C2=CC=CC=C2 PH007709 [0,1,0,1,0,0|1,0,0]=3 413 B14R2.24 FC1=CC=CC=C1C2CNCCN2 CDS018430 [0,1,0,1,0,0|2,0,0]=4 414 B14R2.24 NC1CCCCC1C2=CC=CC=C2 PH012427 [0,1,0,1,0,0|1,0,0]=3 415 B14R2.24 NC1COCOC1C2=CC=CC=C2 PH013665 [0,1,0,1,0,0|1,0,0]=3 416 B14R2.24 NC1COCOC1C2=CC=CC=C2 PH018963 [0,1,0,1,0,0|1,0,0]=3 417 B14R2.24 O=C1CCCCC1C2=CC=CC=N2 PH013014 [0,1,0,1,0,0|1,0,1]=4 418 B14R2.24 O=S1CCCSC1C2=CC=CC=C2 S863238 [0,1,0,1,0,0|1,0,1]=4 419 B14R2.24 OC1=CC=CC=C1C2CCCCC2 S458627 [0,1,0,1,0,0|1,0,0]=3 420 B14R2.24 OC1=CC=CC=C1C2CCNCC2 T312177 [0,1,0,1,0,0|2,0,0]=4 421 B14R2.24 OC1CCCCC1C2=CC=CC=C2 S456764 [0,1,0,1,0,0|0,0,0]=2 422 B14R2.24 OC1CCCCC1C2=CC=CC=C2 S459771 [0,1,0,1,0,0|0,0,0]=2 423 B14R2.30 N[C@@H]1CCC[C@@H]1CC2=CC=CC=C2 PH018573 [0,1,0,1,0,0|1,0,0]=3 424 B14R2.30 O=C1CCCC1CC2=CC=CC=C2 S134104 [0,1,0,1,0,0|0,0,1]=3 425 B14R2.101 C1=CC(=CC=N1)CCN2CCCC2 S355372 [0,1,0,1,0,0|2,0,0]=4 426 B14R2.101 C1=CC=C(C=C1)CCC2CCNC2 CDS010462 [0,1,0,1,0,0|1,0,0]=3 427 B14R2.101 C1=CC=C(C=C1)COC2CCNC2 MNO000089 [0,1,0,1,0,0|2,0,0]=4 428 B14R2.101 C1=CC=C(N=C1)CCN2CCCC2 S355364 [0,1,0,1,0,0|2,0,0]=4 429 B14R2.101 C1=CC=C(N=C1)CNC2CCCC2 T327379 [0,1,0,1,0,0|2,0,0]=4 430 B14R2.2014 O/N=C/1\CCCCC2=C1C=CC=C2 S296392 [0,1,0,1,0,0|0,0,1]=3 431 B14R2.2014 O/N=C/1\CCCSC2=C1C=CC=C2 S762202 [0,1,0,1,0,0|1,0,1]=4 432 B14R2.2839 C1=CC=C2CSCCCSCC2=C1 S300519 [0,1,0,1,0,0|1,1,0]=4 433 B14R2.2839 C1=CC=C2CSCCCSCC2=C1 S809616 [0,1,0,1,0,0|1,1,0]=4 434 B14R2.3018 C1=CC=C(C=C1)OCCNC2CC2 PH013244 [0,1,0,1,0,0|2,0,0]=4 435 B14R2.7150 C(=O)NC1CCCC2=CC=CC=C12 S520292 [0,1,0,1,0,0|0,0,2]=4 436 B14R2.7150 N#CCC1NCCC2=CC=CC=C12 BBO000347 [0,1,0,1,0,0|1,0,1]=4 437 B14R2.7150 N#CCN1CCCC2=C1C=CC=C2 S922544 [0,1,0,1,0,0|1,0,1]=4 438 B14R2.7150 NCCN1CCCC2=CC=CC=C12 CBR00962 [0,1,0,1,0,0|1,0,0]=3 439 B14R2.112 ClCCN1CCC2=C(C1)C=CC=C2 PH015384 [0,1,0,1,0,0|2,0,0]=4 440 B14R2.112 NCCN1CCC2=CC=CC=C2C1 CDS012639 [0,1,0,1,0,0|2,0,0]=4 441 B14R2.112 OCCC1COC2=CC=CC=C2O1 CBR01255 [0,1,0,1,0,0|1,0,0]=3 442 B14R2.112 OCCN1CCC2=CC=CC=C2C1 CBR00381 [0,1,0,1,0,0|1,0,0]=3 443 B14R2.2899 CC(NCC1=CC=CC=C1)C2CC2 S246123 [0,1,0,1,0,0|2,0,0]=4 444 B14R2.67 N1C(=NC2=C1C=CC=C2)CCCO S441503 [0,1,0,1,0,0|1,0,1]=4 445 B14R2.2 O=C(O)CC1CCC2=CC=CC=C12 CDS007741 [0,1,0,1,0,0|0,0,1]=3 446 B14R2.31359 O=C(O)C1CCCC2=C1C=CC=C2 CDS007913 [0,1,0,1,0,0|0,0,1]=3 447 B14R2.31359 O=C(O)C1NCCC2=C1C=CC=C2 PH009976 [0,1,0,1,0,0|1,0,1]=4 448 B14R2.50 NC1=CC=CC=C1CN2CCCC2 CBR00332 [0,1,0,1,0,0|2,0,0]=4 449 B14R2.685 O=C1CCCCC2=C(C=CC=C12)Br PH001878 [0,1,0,1,0,0|0,0,2]=4 450 B14R2.3459 NCC1(CCCC2=C1C=CC=C2)O BBO000392 [0,1,0,1,0,0|1,0,0]=3 451 B14R3.608 O=C1CC2CC1C3=C2C=CC=C3 T201596 [0,0,0,2,0,0|0,0,2]=4 452 B14R3.2531 C1=CC=C2C(=C1)C3CSCC2C3 T197777 [0,0,0,2,0,0|2,0,0]=4 453 B14R3.406 O=C1C2CCC1C3=C2C=CC=C3 T206253 [0,0,0,2,0,0|0,0,2]=4 454 B10R1.21 CCCCCC1=NC=CN1 PH008606 [1,0,0,0,1,0|2,0,0]=4