0 B10R0.74 C#CCCCCCC(=O)OC MCULE-3816855542 [0,0,0,0,0,0|0,0,4]=4 1 B10R0.74 C=CC(=O)OCCCCCC MCULE-5221212930 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.74 CC/C=C\CCOC(=O)OC MCULE-7384996356 [0,0,0,0,0,0|1,0,3]=4 3 B10R0.74 CCC=CCCOC(=O)OC MCULE-9789450516 [0,0,0,0,0,0|1,0,3]=4 4 B10R0.74 CCCCC/C=C/C(=O)OC MCULE-1812424019 [0,0,0,0,0,0|0,0,2]=2 5 B10R0.74 CCCCCC#CC(=O)OC MCULE-8436103758 [0,0,0,0,0,0|0,0,0]=0 6 B10R0.74 CCCCCC=CC(=O)OC MCULE-3787684558 [0,0,0,0,0,0|0,0,2]=2 7 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [0,0,0,0,0,0|1,0,2]=3 8 B10R0.74 CCCCCCCC(=O)NN MCULE-6629350924 [0,0,0,0,0,0|2,0,2]=4 9 B10R0.74 CCCCCCCC(=O)NO MCULE-2604662374 [0,0,0,0,0,0|2,0,2]=4 10 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-1745709791 [0,0,0,0,0,0|2,0,2]=4 11 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-4610313780 [0,0,0,0,0,0|2,0,2]=4 12 B10R0.74 CCCCCCCC(=O)OC MCULE-9368782203 [0,0,0,0,0,0|0,0,2]=2 13 B10R0.74 CCCCCCNC(=O)CCl MCULE-9418401258 [0,0,0,0,0,0|3,0,1]=4 14 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [0,0,0,0,0,0|2,0,1]=3 15 B10R0.74 CCCCCCOC(=O)CCl MCULE-7320709801 [0,0,0,0,0,0|3,0,1]=4 16 B10R0.74 CCCCCCOC(=O)CN MCULE-5357348178 [0,0,0,0,0,0|3,0,1]=4 17 B10R0.74 CCCCCCOC(=O)CS MCULE-4845823799 [0,0,0,0,0,0|3,0,1]=4 18 B10R0.74 CCCCCCOC(=O)C[NH3+] MCULE-4114261473 [0,0,0,0,0,0|3,0,1]=4 19 B10R0.74 CCOCCSCC(=O)OC MCULE-6906722616 [0,0,0,0,0,0|2,0,1]=3 20 B10R0.74 COC(=O)CCCCCC=O MCULE-1071696685 [0,0,0,0,0,0|1,0,3]=4 21 B10R0.74 COC(=O)CCCCCCBr MCULE-5801566678 [0,0,0,0,0,0|1,0,2]=3 22 B10R0.74 COC(=O)CCCCCCI MCULE-5629338002 [0,0,0,0,0,0|1,0,2]=3 23 B10R0.74 COC(=O)CCCCCCN MCULE-3174162228 [0,0,0,0,0,0|1,0,2]=3 24 B10R0.74 COC(=O)CCCCCCN MCULE-7552954472 [0,0,0,0,0,0|1,0,2]=3 25 B10R0.74 COC(=O)CCCCCCO MCULE-1234987175 [0,0,0,0,0,0|1,0,2]=3 26 B10R0.74 COC(=O)CCNCCCO MCULE-4138256366 [0,0,0,0,0,0|2,0,2]=4 27 B10R0.74 COC(=O)CCOCCCO MCULE-5017264772 [0,0,0,0,0,0|2,0,2]=4 28 B10R0.74 COCCNCCC(=O)OC MCULE-2355570615 [0,0,0,0,0,0|2,0,2]=4 29 B10R0.74 COCCOCCC(=O)OC MCULE-5131212223 [0,0,0,0,0,0|2,0,2]=4 30 B9R0.2 C=C(C)CCCCCCC MCULE-6074571960 [1,0,0,0,0,0|1,0,2]=4 31 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [1,0,0,0,0,0|1,0,2]=4 32 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [1,0,0,0,0,0|1,0,2]=4 33 B9R0.2 CC(=O)NCCCCCCl MCULE-9253955715 [1,0,0,0,0,0|2,0,1]=4 34 B9R0.2 CC(=O)NCCCCCN MCULE-6340089295 [1,0,0,0,0,0|2,0,1]=4 35 B9R0.2 CC(=O)NCCCCCN MCULE-9533682248 [1,0,0,0,0,0|2,0,1]=4 36 B9R0.2 CC(=O)OCCCCCBr MCULE-2710815321 [1,0,0,0,0,0|2,0,1]=4 37 B9R0.2 CC(=O)OCCCCCCl MCULE-4259346820 [1,0,0,0,0,0|2,0,1]=4 38 B9R0.2 CC(=O)SCCCCCBr MCULE-3706830993 [1,0,0,0,0,0|2,0,1]=4 39 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [1,0,0,0,0,0|0,0,3]=4 40 B9R0.2 CCCCC#CCC(=O)O MCULE-2685341100 [1,0,0,0,0,0|0,0,2]=3 41 B9R0.2 CCCCC/C=C/C(=O)C MCULE-4810438787 [1,0,0,0,0,0|0,0,2]=3 42 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [1,0,0,0,0,0|0,0,2]=3 43 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [1,0,0,0,0,0|0,0,3]=4 44 B9R0.2 CCCCCC#CC(=O)O MCULE-1860076106 [1,0,0,0,0,0|0,0,0]=1 45 B9R0.2 CCCCCC=CC(=O)C MCULE-2447853309 [1,0,0,0,0,0|0,0,2]=3 46 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [1,0,0,0,0,0|0,0,2]=3 47 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [1,0,0,0,0,0|0,0,2]=3 48 B9R0.2 CCCCCCCC(=O)Cl MCULE-9979489292 [1,0,0,0,0,0|1,0,2]=4 49 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [1,0,0,0,0,0|1,0,2]=4 50 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [1,0,0,0,0,0|0,0,2]=3 51 B9R0.2 CCCCCCCC(=O)[O-] MCULE-3608650495 [1,0,0,0,0,0|0,0,3]=4 52 B9R0.2 CCCCCCCC(=O)[O-] MCULE-8227046407 [1,0,0,0,0,0|0,0,3]=4 53 B9R0.2 CCCCCCNC(=O)N MCULE-4236638652 [1,0,0,0,0,0|2,0,1]=4 54 B9R0.2 CCCCCCOC(=O)C MCULE-7353613022 [1,0,0,0,0,0|1,0,1]=3 55 B9R0.2 CCCCCCOC(=O)Cl MCULE-3135055168 [1,0,0,0,0,0|2,0,1]=4 56 B9R0.2 CCCCCCOC(=O)N MCULE-3909923308 [1,0,0,0,0,0|2,0,1]=4 57 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [1,0,0,0,0,0|2,0,1]=4 58 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [1,0,0,0,0,0|2,0,1]=4 59 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [1,0,0,0,0,0|1,0,1]=3 60 B9R0.2 CCCCOCCC(=O)O MCULE-3735085695 [1,0,0,0,0,0|1,0,2]=4 61 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [1,0,0,0,0,0|1,0,2]=4 62 B9R0.2 CCCOCCCC(=O)O MCULE-8829980105 [1,0,0,0,0,0|1,0,2]=4 63 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [1,0,0,0,0,0|1,0,2]=4 64 B9R0.2 CCNCCCCC(=O)O MCULE-1386195341 [1,0,0,0,0,0|1,0,2]=4 65 B9R0.2 CCNCCCCC(=O)O MCULE-1922836400 [1,0,0,0,0,0|1,0,2]=4 66 B9R0.2 CCOCCCCC(=O)O MCULE-8522289104 [1,0,0,0,0,0|1,0,2]=4 67 B9R0.2 CCOCCOCC(=O)O MCULE-2273372397 [1,0,0,0,0,0|2,0,1]=4 68 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [1,0,0,0,0,0|1,0,2]=4 69 B9R0.2 COCCCCCC(=O)O MCULE-1769987918 [1,0,0,0,0,0|1,0,2]=4 70 B9R0.2 COCCCCOC(=O)C MCULE-4352807618 [1,0,0,0,0,0|2,0,1]=4 71 B9R0.2 COCCCOCC(=O)O MCULE-7774967166 [1,0,0,0,0,0|2,0,1]=4 72 B9R0.2 CSCCCCCC(=O)O MCULE-9069370044 [1,0,0,0,0,0|1,0,2]=4 73 B9R0.2 C[NH2+]CCCCCC(=O)O MCULE-8971339830 [1,0,0,0,0,0|1,0,2]=4 74 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [1,0,0,0,0,0|1,0,2]=4 75 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [1,0,0,0,0,0|1,0,2]=4 76 B9R0.2 O=C(O)CCCCCCBr MCULE-3980379488 [1,0,0,0,0,0|1,0,2]=4 77 B9R0.2 O=C(O)CCCCCCF MCULE-7539264820 [1,0,0,0,0,0|1,0,2]=4 78 B9R0.2 O=C(O)CCCCCCO MCULE-7270362706 [1,0,0,0,0,0|1,0,2]=4 79 B9R0.2 O=C(O)CCCCCCS MCULE-5659986053 [1,0,0,0,0,0|1,0,2]=4 80 B9R0.2 O=C(O)CNCCCCO MCULE-6377863888 [1,0,0,0,0,0|2,0,1]=4 81 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [1,0,0,0,0,0|1,0,2]=4 82 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [1,0,0,0,0,0|1,0,2]=4 83 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [1,0,0,0,0,0|1,0,1]=3 84 B9R0.45 CCCCCC#CCCO MCULE-7189083538 [1,0,0,0,0,0|2,0,1]=4 85 B9R0.45 CCCCCCCCOC MCULE-4646070035 [1,0,0,0,0,0|0,0,3]=4 86 B9R0.46 C#CCCCCC(=O)OC MCULE-4261649689 [1,0,0,0,0,0|0,0,3]=4 87 B9R0.46 C=C(C=NCCCC)OC MCULE-4916638013 [1,0,0,0,0,0|2,0,1]=4 88 B9R0.46 C=CC(=O)CCCCCC MCULE-4486396694 [1,0,0,0,0,0|1,0,2]=4 89 B9R0.46 C=CC(=O)OCCCCC MCULE-6727835934 [1,0,0,0,0,0|2,0,1]=4 90 B9R0.46 C=CCCCCC(=O)OC MCULE-7317556908 [1,0,0,0,0,0|0,0,3]=4 91 B9R0.46 CCCCC#CC(=O)OC MCULE-6610188635 [1,0,0,0,0,0|0,0,0]=1 92 B9R0.46 CCCCC=CC(=O)OC MCULE-3507079471 [1,0,0,0,0,0|0,0,2]=3 93 B9R0.46 CCCCCCC(=O)CBr MCULE-5041636942 [1,0,0,0,0,0|2,0,1]=4 94 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [1,0,0,0,0,0|1,0,1]=3 95 B9R0.46 CCCCCCC(=O)NN MCULE-6491418749 [1,0,0,0,0,0|2,0,1]=4 96 B9R0.46 CCCCCCC(=O)NO MCULE-7308576516 [1,0,0,0,0,0|2,0,1]=4 97 B9R0.46 CCCCCCC(=O)OC MCULE-7883111323 [1,0,0,0,0,0|0,0,1]=2 98 B9R0.46 CCCCCNC(=O)CCl MCULE-8028345115 [1,0,0,0,0,0|3,0,0]=4 99 B9R0.46 CCCCCOC(=O)CBr MCULE-3749700207 [1,0,0,0,0,0|3,0,0]=4 100 B9R0.46 CCCCCOC(=O)CC MCULE-6912037911 [1,0,0,0,0,0|2,0,0]=3 101 B9R0.46 CCCCCOC(=O)CCl MCULE-6254869186 [1,0,0,0,0,0|3,0,0]=4 102 B9R0.46 CCCCCOC(=O)CN MCULE-1223174561 [1,0,0,0,0,0|3,0,0]=4 103 B9R0.46 CCCCCOC(=O)CS MCULE-8048926704 [1,0,0,0,0,0|3,0,0]=4 104 B9R0.46 CCCCCOC(=O)C[NH3+] MCULE-4653269874 [1,0,0,0,0,0|3,0,0]=4 105 B9R0.46 CCCCSCC(=O)OC MCULE-1208944064 [1,0,0,0,0,0|1,0,1]=3 106 B9R0.46 CCCNCCC(=O)NC MCULE-7368054577 [1,0,0,0,0,0|2,0,1]=4 107 B9R0.46 CCCNCCC(=O)OC MCULE-4786941347 [1,0,0,0,0,0|1,0,1]=3 108 B9R0.46 CCNCCCC(=O)OC MCULE-1330024068 [1,0,0,0,0,0|1,0,1]=3 109 B9R0.46 CCNCCCC(=O)OC MCULE-1608160566 [1,0,0,0,0,0|1,0,1]=3 110 B9R0.46 CNCCCCC(=O)OC MCULE-3479794664 [1,0,0,0,0,0|1,0,1]=3 111 B9R0.46 CNCCCCC(=O)OC MCULE-3875784281 [1,0,0,0,0,0|1,0,1]=3 112 B9R0.46 COC(=O)CCCCC=O MCULE-6810055406 [1,0,0,0,0,0|1,0,2]=4 113 B9R0.46 COC(=O)CCCCCBr MCULE-5661009403 [1,0,0,0,0,0|1,0,1]=3 114 B9R0.46 COC(=O)CCCCCCl MCULE-2967199349 [1,0,0,0,0,0|1,0,1]=3 115 B9R0.46 COC(=O)CCCCCI MCULE-6638103547 [1,0,0,0,0,0|1,0,1]=3 116 B9R0.46 COC(=O)CCCCCN MCULE-9013585398 [1,0,0,0,0,0|1,0,1]=3 117 B9R0.46 COC(=O)CCCCCN MCULE-9184696999 [1,0,0,0,0,0|1,0,1]=3 118 B9R0.46 COC(=O)CCCCCO MCULE-6405405706 [1,0,0,0,0,0|1,0,1]=3 119 B9R0.46 COC(=O)CCCCCS MCULE-3886120866 [1,0,0,0,0,0|1,0,1]=3 120 B9R0.46 COC(=O)CCNCCO MCULE-8673898296 [1,0,0,0,0,0|2,0,1]=4 121 B9R0.46 COC(=O)CCNCCO MCULE-9372452891 [1,0,0,0,0,0|2,0,1]=4 122 B9R0.46 COC(=O)CCOCCO MCULE-2103874995 [1,0,0,0,0,0|2,0,1]=4 123 B9R0.46 COC(=O)CCSCCBr MCULE-9094494560 [1,0,0,0,0,0|2,0,1]=4 124 B9R0.46 COC(=O)COCCCBr MCULE-4809392864 [1,0,0,0,0,0|2,0,1]=4 125 B9R0.46 COC(=O)CSCCCCl MCULE-4673663390 [1,0,0,0,0,0|2,0,1]=4 126 B9R0.46 COCCCCC(=O)OC MCULE-9886328481 [1,0,0,0,0,0|1,0,1]=3 127 B9R0.46 COCCNCC(=O)OC MCULE-2601282680 [1,0,0,0,0,0|2,0,1]=4 128 B9R0.46 COCCOCC(=O)OC MCULE-4614657424 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.46 COCCSCC(=O)OC MCULE-2376910054 [1,0,0,0,0,0|2,0,1]=4 130 B11R0.4 C(=CC(=O)OCC)CCCCC MCULE-4171275205 [0,1,0,0,0,0|0,0,2]=3 131 B11R0.4 C=COC(=O)CCCCCCC MCULE-8119830012 [0,1,0,0,0,0|0,0,3]=4 132 B11R0.4 CC=CC(=O)OCCCCCC MCULE-4880491449 [0,1,0,0,0,0|2,0,1]=4 133 B11R0.4 CCCCC/C=C/C(=O)OCC MCULE-5442918020 [0,1,0,0,0,0|0,0,2]=3 134 B11R0.4 CCCCCC#CC(=O)OCC MCULE-5790220243 [0,1,0,0,0,0|0,0,0]=1 135 B11R0.4 CCCCCCCC(=O)CCC MCULE-1180729281 [0,1,0,0,0,0|1,0,2]=4 136 B11R0.4 CCCCCCCC(=O)OCC MCULE-2970505348 [0,1,0,0,0,0|0,0,2]=3 137 B11R0.4 CCCCCCCC(=O)OCCl MCULE-2638292153 [0,1,0,0,0,0|0,0,2]=3 138 B11R0.4 CCCCCCNC(=O)CCC MCULE-8057065415 [0,1,0,0,0,0|2,0,1]=4 139 B11R0.4 CCCCCCOC(=O)CCC MCULE-8350935490 [0,1,0,0,0,0|2,0,1]=4 140 B11R0.4 CCCCCCOC(=O)COC MCULE-6245511541 [0,1,0,0,0,0|1,0,1]=3 141 B11R0.4 CCCCCCOC(=O)OCCl MCULE-3018615324 [0,1,0,0,0,0|1,0,1]=3 142 B11R0.4 CCCCNCCC(=O)OCC MCULE-5853777478 [0,1,0,0,0,0|1,0,2]=4 143 B11R0.4 CCCCSCCC(=O)OCC MCULE-6074500572 [0,1,0,0,0,0|1,0,2]=4 144 B11R0.4 CCOC(=O)/C=C/CCCCCl MCULE-6128979271 [0,1,0,0,0,0|1,0,2]=4 145 B11R0.4 CCOC(=O)C=CCCCCCl MCULE-4585677614 [0,1,0,0,0,0|1,0,2]=4 146 B11R0.4 CCOC(=O)CCCCCCBr MCULE-6438098940 [0,1,0,0,0,0|1,0,2]=4 147 B11R0.4 CCOC(=O)CCCCCCCl MCULE-2985397172 [0,1,0,0,0,0|1,0,2]=4 148 B11R0.4 CCOC(=O)CCCCCCI MCULE-6134074150 [0,1,0,0,0,0|1,0,2]=4 149 B11R0.4 CCOC(=O)CCCCCCN MCULE-5019264359 [0,1,0,0,0,0|1,0,2]=4 150 B11R0.4 CCOC(=O)CCCCCCN MCULE-8921407508 [0,1,0,0,0,0|1,0,2]=4 151 B11R0.4 CCOC(=O)CCCCCNC MCULE-3880282111 [0,1,0,0,0,0|1,0,2]=4 152 B11R0.4 CCOC(=O)CCCCCNC MCULE-5211183009 [0,1,0,0,0,0|1,0,2]=4 153 B11R0.4 CCOC(=O)NCCCCCO MCULE-3754810142 [0,1,0,0,0,0|2,0,1]=4 154 B11R0.40 CCCCC/C=C/CC(=O)OC MCULE-2579151246 [0,1,0,0,0,0|0,0,2]=3 155 B11R0.40 CCCCCCC#CC(=O)OC MCULE-7877194626 [0,1,0,0,0,0|0,0,0]=1 156 B11R0.40 CCCCCCC=CC(=O)OC MCULE-3102057992 [0,1,0,0,0,0|0,0,2]=3 157 B11R0.40 CCCCCCCCC(=O)CC MCULE-9958837588 [0,1,0,0,0,0|1,0,2]=4 158 B11R0.40 CCCCCCCCC(=O)OC MCULE-4760106079 [0,1,0,0,0,0|0,0,2]=3 159 B11R0.40 CCCCCCCOC(=O)CC MCULE-6239287032 [0,1,0,0,0,0|1,0,2]=4 160 B11R0.40 CCCCOCCOC(=O)NC MCULE-3584012789 [0,1,0,0,0,0|2,0,1]=4 161 B11R0.40 COC(=O)CCCCCCC#N MCULE-5476473532 [0,1,0,0,0,0|0,0,3]=4 162 B11R0.40 COC(=O)CCCCCCC=O MCULE-8693929860 [0,1,0,0,0,0|0,0,3]=4 163 B11R0.40 COC(=O)CCCCCCCBr MCULE-5537473467 [0,1,0,0,0,0|0,0,2]=3 164 B11R0.40 COC(=O)CCCCCCCCl MCULE-1981178961 [0,1,0,0,0,0|0,0,2]=3 165 B11R0.40 COC(=O)CCCCCCCN MCULE-3361449332 [0,1,0,0,0,0|0,0,2]=3 166 B11R0.40 COC(=O)CCCCCCCN MCULE-5266446188 [0,1,0,0,0,0|0,0,2]=3 167 B11R0.40 COC(=O)CCCCCCCO MCULE-4577508073 [0,1,0,0,0,0|0,0,2]=3 168 B11R0.40 COCCCNCCC(=O)OC MCULE-4020268298 [0,1,0,0,0,0|1,0,2]=4 169 B11R0.42 C=C(C)C(=O)OCCCCCC MCULE-3645366510 [0,1,0,0,0,0|2,0,1]=4 170 B11R0.42 CCCCCCCC(=O)N(C)C MCULE-6939177208 [0,1,0,0,0,0|1,0,2]=4 171 B11R0.42 CCCCCCOC(=O)C(C)C MCULE-2183299447 [0,1,0,0,0,0|2,0,1]=4 172 B11R0.70 COC(=O)NCC(O)CCSC MCULE-5675788618 [0,1,0,0,0,0|2,0,1]=4 173 B11R0.142 CCCCCCC(Br)C(=O)OC MCULE-3994207813 [0,1,0,0,0,0|0,0,2]=3 174 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-1398170037 [0,1,0,0,0,0|0,0,2]=3 175 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-3295480977 [0,1,0,0,0,0|0,0,2]=3 176 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-5212970889 [0,1,0,0,0,0|0,0,2]=3 177 B11R0.142 CCCCCC[C@H](N)C(=O)OC MCULE-7851215638 [0,1,0,0,0,0|0,0,2]=3 178 B11R0.142 CCCCNCC(C)C(=O)OC MCULE-9643286363 [0,1,0,0,0,0|1,0,2]=4 179 B11R0.154 CCCCCC(=O)CC(=O)OC MCULE-9153189731 [0,1,0,0,0,0|0,0,2]=3 180 B11R0.154 CCCCCC(C)NC(=O)CC MCULE-5203796337 [0,1,0,0,0,0|2,0,1]=4 181 B11R0.154 CCCCCC(C)NC(=O)OC MCULE-7863422076 [0,1,0,0,0,0|1,0,1]=3 182 B11R0.154 CCCCCC(O)CC(=O)OC MCULE-9477041708 [0,1,0,0,0,0|0,0,2]=3 183 B11R0.154 CCCCC[C@H](O)CC(=O)OC MCULE-4127190955 [0,1,0,0,0,0|0,0,2]=3 184 B11R0.154 CCCCNC(C)CC(=O)OC MCULE-5927405723 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.1 CCCCC1CCC(=O)CC1 MCULE-3632759144 [0,0,0,1,0,0|1,0,2]=4 186 B11R1.25 CNC(=O)CCC1CCCC1 MCULE-3928070553 [0,0,0,1,0,0|1,0,2]=4 187 B11R1.25 COC(=O)/C=C/C1CCCC1 MCULE-1352596380 [0,0,0,1,0,0|0,0,2]=3 188 B11R1.25 COC(=O)/C=C/N1CCCC1 MCULE-5240446180 [0,0,0,1,0,0|1,0,2]=4 189 B11R1.25 COC(=O)C=CC1CCCC1 MCULE-8918279747 [0,0,0,1,0,0|0,0,2]=3 190 B11R1.25 COC(=O)CCC1CCCC1 MCULE-5184172905 [0,0,0,1,0,0|0,0,2]=3 191 B11R1.25 COC(=O)CCC1CCCO1 MCULE-6365564482 [0,0,0,1,0,0|1,0,2]=4 192 B11R1.25 COC(=O)CCC1CCNC1 MCULE-2733017217 [0,0,0,1,0,0|1,0,2]=4 193 B11R1.25 COC(=O)CCC1CCNC1 MCULE-4098395130 [0,0,0,1,0,0|1,0,2]=4 194 B11R1.25 COC(=O)CCN1CCCC1 MCULE-9621646936 [0,0,0,1,0,0|1,0,2]=4 195 B11R1.25 COC(=O)CNC1CCCC1 MCULE-1776376918 [0,0,0,1,0,0|1,0,1]=3 196 B11R1.25 COC(=O)CNC1CCCC1 MCULE-2460300969 [0,0,0,1,0,0|1,0,1]=3 197 B11R1.25 COC(=O)COC1CCNC1 MCULE-6308232149 [0,0,0,1,0,0|2,0,1]=4 198 B11R1.25 COC(=O)COC1CCNC1 MCULE-7999300938 [0,0,0,1,0,0|2,0,1]=4 199 B11R1.25 COC(=O)CO[C@@H]1CCNC1 MCULE-6381563905 [0,0,0,1,0,0|2,0,1]=4 200 B11R1.25 COC(=O)CO[C@@H]1CCNC1 MCULE-7351317623 [0,0,0,1,0,0|2,0,1]=4 201 B11R1.25 COC(=O)CO[C@@H]1CCNC1 MCULE-7630320653 [0,0,0,1,0,0|2,0,1]=4 202 B11R1.25 COC(=O)CO[C@@H]1CCNC1 MCULE-9165010504 [0,0,0,1,0,0|2,0,1]=4 203 B11R1.25 COC(=O)CO[C@H]1CCNC1 MCULE-4782133215 [0,0,0,1,0,0|2,0,1]=4 204 B11R1.25 COC(=O)CO[C@H]1CCNC1 MCULE-4960889264 [0,0,0,1,0,0|2,0,1]=4 205 B11R1.27 CCCCCC1CCC(=O)O1 MCULE-8658118167 [0,0,0,1,0,0|2,0,1]=4 206 B11R1.27 CCCCC[C@H]1CCC(=O)O1 MCULE-5773106371 [0,0,0,1,0,0|2,0,1]=4 207 B11R1.40 CCC(=O)CC1CCCCC1 MCULE-4548371264 [0,0,0,1,0,0|1,0,2]=4 208 B11R1.40 CCC(=O)NC1CCCCC1 MCULE-3419977107 [0,0,0,1,0,0|2,0,1]=4 209 B11R1.40 CCC(=O)OC1CCCCC1 MCULE-4878482925 [0,0,0,1,0,0|2,0,1]=4 210 B11R1.40 CNC(=O)CC1CCCCC1 MCULE-6265234454 [0,0,0,1,0,0|1,0,2]=4 211 B11R1.40 CNC(=O)NC1CCCCC1 MCULE-1669953265 [0,0,0,1,0,0|2,0,1]=4 212 B11R1.40 COC(=O)C=C1CCCCC1 MCULE-4895716264 [0,0,0,1,0,0|0,0,2]=3 213 B11R1.40 COC(=O)C=C1CCCCN1 MCULE-1404515648 [0,0,0,1,0,0|1,0,2]=4 214 B11R1.40 COC(=O)C=C1CCCOC1 MCULE-4989506759 [0,0,0,1,0,0|1,0,2]=4 215 B11R1.40 COC(=O)C=C1CCOCC1 MCULE-8966074278 [0,0,0,1,0,0|1,0,2]=4 216 B11R1.40 COC(=O)C=C1CCSCC1 MCULE-4860035890 [0,0,0,1,0,0|1,0,2]=4 217 B11R1.40 COC(=O)CC1CCCCC1 MCULE-4749534991 [0,0,0,1,0,0|0,0,2]=3 218 B11R1.40 COC(=O)CC1CCCCN1 MCULE-1659624694 [0,0,0,1,0,0|1,0,2]=4 219 B11R1.40 COC(=O)CC1CCCCN1 MCULE-5592891926 [0,0,0,1,0,0|1,0,2]=4 220 B11R1.40 COC(=O)CC1CCCNC1 MCULE-2894207855 [0,0,0,1,0,0|1,0,2]=4 221 B11R1.40 COC(=O)CC1CCCNC1 MCULE-8539590471 [0,0,0,1,0,0|1,0,2]=4 222 B11R1.40 COC(=O)CC1CCNCC1 MCULE-4818273917 [0,0,0,1,0,0|1,0,2]=4 223 B11R1.40 COC(=O)CC1CCNCC1 MCULE-6454857791 [0,0,0,1,0,0|1,0,2]=4 224 B11R1.40 COC(=O)CC1CCOCC1 MCULE-8506370541 [0,0,0,1,0,0|1,0,2]=4 225 B11R1.40 COC(=O)CC1CCSCC1 MCULE-2405303650 [0,0,0,1,0,0|1,0,2]=4 226 B11R1.40 COC(=O)CN1CCNCC1 MCULE-2924920584 [0,0,0,1,0,0|2,0,1]=4 227 B11R1.40 COC(=O)CN1CCNCC1 MCULE-8392762779 [0,0,0,1,0,0|2,0,1]=4 228 B11R1.40 COC(=O)CN1CCNCC1 MCULE-9092923320 [0,0,0,1,0,0|2,0,1]=4 229 B11R1.40 COC(=O)CN1CCOCC1 MCULE-4150127605 [0,0,0,1,0,0|2,0,1]=4 230 B11R1.40 COC(=O)CN1CCOCC1 MCULE-6948035486 [0,0,0,1,0,0|2,0,1]=4 231 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-3033016054 [0,0,0,1,0,0|1,0,2]=4 232 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-3350930478 [0,0,0,1,0,0|1,0,2]=4 233 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-8139225473 [0,0,0,1,0,0|1,0,2]=4 234 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-8627301252 [0,0,0,1,0,0|1,0,2]=4 235 B11R1.40 COC(=O)C[C@H]1CCCCN1 MCULE-4319190168 [0,0,0,1,0,0|1,0,2]=4 236 B11R1.40 COC(=O)C[C@H]1CCCCN1 MCULE-9265663838 [0,0,0,1,0,0|1,0,2]=4 237 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-1720030033 [0,0,0,1,0,0|1,0,2]=4 238 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-6508778923 [0,0,0,1,0,0|1,0,2]=4 239 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-8131066241 [0,0,0,1,0,0|1,0,2]=4 240 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-8434859537 [0,0,0,1,0,0|1,0,2]=4 241 B11R1.40 COC(=O)NC1CCCCC1 MCULE-4935299070 [0,0,0,1,0,0|1,0,1]=3 242 B11R1.40 COC(=O)NC1CCCNC1 MCULE-9996682353 [0,0,0,1,0,0|2,0,1]=4 243 B11R1.40 COC(=O)NC1CCNCC1 MCULE-8108415339 [0,0,0,1,0,0|2,0,1]=4 244 B11R1.40 COC(=O)NC1CCNCC1 MCULE-8590745688 [0,0,0,1,0,0|2,0,1]=4 245 B11R1.40 CSC(=O)NC1CCCCC1 MCULE-8779554641 [0,0,0,1,0,0|1,1,1]=4 246 B11R1.59 CCN1CCCC1C(=O)OC MCULE-2111423873 [0,0,0,1,0,0|1,0,2]=4 247 B11R1.59 COC(=O)C1CCCC1CO MCULE-5803357761 [0,0,0,1,0,0|1,0,2]=4 248 B11R1.59 COC(=O)N1CCCC1OC MCULE-4556392766 [0,0,0,1,0,0|2,0,1]=4 249 B11R1.59 COC(=O)[C@@H]1CCC[C@H]1CO MCULE-4195422588 [0,0,0,1,0,0|1,0,2]=4 250 B11R1.59 COC(=O)[C@H]1CCC[C@@H]1CO MCULE-1028620967 [0,0,0,1,0,0|1,0,2]=4 251 B11R1.101 O=C1CCCCCCCCC1 MCULE-7431354983 [0,0,0,1,0,0|1,0,2]=4 252 B11R1.101 O=C1CCCCCCCCN1 MCULE-4805310836 [0,0,0,1,0,0|1,0,2]=4 253 B11R1.135 CCCC1CCNC(=O)CC1 MCULE-3101429191 [0,0,0,1,0,0|2,0,1]=4 254 B11R1.222 COC(=O)C1CCCCC1N MCULE-1825299804 [0,0,0,1,0,0|1,0,2]=4 255 B11R1.222 COC(=O)C1CCCCC1N MCULE-4137070739 [0,0,0,1,0,0|1,0,2]=4 256 B11R1.222 COC(=O)C1CCCCC1O MCULE-5625433366 [0,0,0,1,0,0|1,0,2]=4 257 B11R1.222 COC(=O)C1CCCCN1C MCULE-8053559173 [0,0,0,1,0,0|1,0,2]=4 258 B11R1.222 COC(=O)C1CCCNC1C MCULE-4090993645 [0,0,0,1,0,0|1,0,2]=4 259 B11R1.222 COC(=O)C1CCCNC1C MCULE-4200305359 [0,0,0,1,0,0|1,0,2]=4 260 B11R1.222 COC(=O)C1CCNCC1C MCULE-7624789928 [0,0,0,1,0,0|1,0,2]=4 261 B11R1.222 COC(=O)C1CCNCC1C MCULE-8344260310 [0,0,0,1,0,0|1,0,2]=4 262 B11R1.222 COC(=O)C1CNCCC1C MCULE-3273710064 [0,0,0,1,0,0|1,0,2]=4 263 B11R1.222 COC(=O)C1CNCCC1C MCULE-9474733870 [0,0,0,1,0,0|1,0,2]=4 264 B11R1.222 COC(=O)C1NCCCC1C MCULE-4240891821 [0,0,0,1,0,0|1,0,1]=3 265 B11R1.222 COC(=O)C1NCCCC1C MCULE-4887956825 [0,0,0,1,0,0|1,0,1]=3 266 B11R1.222 COC(=O)C1NCCCC1O MCULE-7175985212 [0,0,0,1,0,0|2,0,1]=4 267 B11R1.222 COC(=O)C1NCCCC1O MCULE-8696579515 [0,0,0,1,0,0|2,0,1]=4 268 B11R1.222 COC(=O)C1NCCOC1C MCULE-7481378868 [0,0,0,1,0,0|2,0,1]=4 269 B11R1.222 COC(=O)C1NCCOC1C MCULE-8115578923 [0,0,0,1,0,0|2,0,1]=4 270 B11R1.222 COC(=O)N1CCNC[C@@H]1C MCULE-8978482948 [0,0,0,1,0,0|2,0,1]=4 271 B11R1.222 COC(=O)N1CCNC[C@@H]1C MCULE-9419640595 [0,0,0,1,0,0|2,0,1]=4 272 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N MCULE-3760129587 [0,0,0,1,0,0|1,0,2]=4 273 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N MCULE-7526276286 [0,0,0,1,0,0|1,0,2]=4 274 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O MCULE-2744100865 [0,0,0,1,0,0|1,0,2]=4 275 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O MCULE-4997449445 [0,0,0,1,0,0|1,0,2]=4 276 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-2322146114 [0,0,0,1,0,0|1,0,2]=4 277 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-2671634853 [0,0,0,1,0,0|1,0,2]=4 278 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-8874981464 [0,0,0,1,0,0|1,0,2]=4 279 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-8895226982 [0,0,0,1,0,0|1,0,2]=4 280 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-9015389744 [0,0,0,1,0,0|1,0,2]=4 281 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-9606268315 [0,0,0,1,0,0|1,0,2]=4 282 B11R1.222 COC(=O)[C@@H]1CCCN[C@@H]1C MCULE-4860895329 [0,0,0,1,0,0|1,0,2]=4 283 B11R1.222 COC(=O)[C@@H]1CCCN[C@@H]1C MCULE-8654537084 [0,0,0,1,0,0|1,0,2]=4 284 B11R1.222 COC(=O)[C@@H]1CCCN[C@H]1C MCULE-7498048591 [0,0,0,1,0,0|1,0,2]=4 285 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4676728316 [0,0,0,1,0,0|1,0,2]=4 286 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4693869526 [0,0,0,1,0,0|1,0,2]=4 287 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-6672831529 [0,0,0,1,0,0|1,0,2]=4 288 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-8735606409 [0,0,0,1,0,0|1,0,2]=4 289 B11R1.222 COC(=O)[C@@H]1CNCC[C@@H]1C MCULE-4956578565 [0,0,0,1,0,0|1,0,2]=4 290 B11R1.222 COC(=O)[C@@H]1CNCC[C@@H]1C MCULE-6306125390 [0,0,0,1,0,0|1,0,2]=4 291 B11R1.222 COC(=O)[C@@H]1CNCC[C@H]1C MCULE-1098365784 [0,0,0,1,0,0|1,0,2]=4 292 B11R1.222 COC(=O)[C@@H]1CNCC[C@H]1C MCULE-6581985698 [0,0,0,1,0,0|1,0,2]=4 293 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-3421501449 [0,0,0,1,0,0|1,0,2]=4 294 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-4527749095 [0,0,0,1,0,0|1,0,2]=4 295 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-5241465045 [0,0,0,1,0,0|1,0,2]=4 296 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-9223863052 [0,0,0,1,0,0|1,0,2]=4 297 B11R1.222 COC(=O)[C@H]1CCCN[C@@H]1C MCULE-2757355307 [0,0,0,1,0,0|1,0,2]=4 298 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-3385138275 [0,0,0,1,0,0|1,0,2]=4 299 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-4359847105 [0,0,0,1,0,0|1,0,2]=4 300 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-7058619393 [0,0,0,1,0,0|1,0,2]=4 301 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1C MCULE-7100934081 [0,0,0,1,0,0|1,0,2]=4 302 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1C MCULE-9285767505 [0,0,0,1,0,0|1,0,2]=4 303 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-2607251792 [0,0,0,1,0,0|1,0,2]=4 304 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-3363958778 [0,0,0,1,0,0|1,0,2]=4 305 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-3805360011 [0,0,0,1,0,0|1,0,2]=4 306 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-7618725820 [0,0,0,1,0,0|1,0,2]=4 307 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-3063776541 [0,0,0,1,0,0|1,0,1]=3 308 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-5946883789 [0,0,0,1,0,0|1,0,1]=3 309 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-6952115958 [0,0,0,1,0,0|1,0,1]=3 310 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-7399475599 [0,0,0,1,0,0|1,0,1]=3 311 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-1027378651 [0,0,0,1,0,0|2,0,1]=4 312 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-4535362622 [0,0,0,1,0,0|2,0,1]=4 313 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-6155846476 [0,0,0,1,0,0|2,0,1]=4 314 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-7704553510 [0,0,0,1,0,0|2,0,1]=4 315 B11R1.228 COC(=O)C=C1CCCN1C MCULE-5736162283 [0,0,0,1,0,0|1,0,2]=4 316 B11R1.237 COC(=O)CCNCC1CC1 MCULE-5813060615 [0,0,0,1,0,0|1,0,2]=4 317 B11R1.381 CCC1CCCCC(=O)N1C MCULE-7428713358 [0,0,0,1,0,0|1,0,2]=4 318 B11R1.852 CCC(=O)C1CCCCCC1 MCULE-7443621337 [0,0,0,1,0,0|1,0,2]=4 319 B11R1.852 CNC(=O)C1CCCCCC1 MCULE-8197745195 [0,0,0,1,0,0|1,0,2]=4 320 B11R1.852 CNC(=O)C1CCCCCN1 MCULE-7805616586 [0,0,0,1,0,0|2,0,1]=4 321 B11R1.852 COC(=O)C1CCCCCC1 MCULE-8003000735 [0,0,0,1,0,0|0,0,2]=3 322 B11R1.852 COC(=O)C1CCCCCN1 MCULE-8548406183 [0,0,0,1,0,0|1,0,1]=3 323 B11R1.852 COC(=O)C1CCCCCN1 MCULE-9755218906 [0,0,0,1,0,0|1,0,1]=3 324 B11R1.852 COC(=O)C1CCCCNC1 MCULE-5033307999 [0,0,0,1,0,0|1,0,2]=4 325 B11R1.852 COC(=O)C1CCCCNC1 MCULE-5999850816 [0,0,0,1,0,0|1,0,2]=4 326 B11R1.852 COC(=O)C1CCCNCC1 MCULE-3407559638 [0,0,0,1,0,0|1,0,2]=4 327 B11R1.852 COC(=O)C1CCCNCC1 MCULE-7978075592 [0,0,0,1,0,0|1,0,2]=4 328 B11R1.852 COC(=O)C1CNCCCN1 MCULE-4382038267 [0,0,0,1,0,0|2,0,1]=4 329 B11R1.852 COC(=O)C1CNCCCO1 MCULE-5602819799 [0,0,0,1,0,0|2,0,1]=4 330 B11R1.852 COC(=O)C1CNCCCO1 MCULE-9238281261 [0,0,0,1,0,0|2,0,1]=4 331 B11R1.852 COC(=O)N1CCCNCC1 MCULE-2036464472 [0,0,0,1,0,0|2,0,1]=4 332 B11R1.852 COC(=O)N1CCCNCC1 MCULE-5917538833 [0,0,0,1,0,0|2,0,1]=4 333 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-2832726026 [0,0,0,1,0,0|1,0,1]=3 334 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-6917033588 [0,0,0,1,0,0|1,0,1]=3 335 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-1594353042 [0,0,0,1,0,0|1,0,1]=3 336 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-7957773860 [0,0,0,1,0,0|1,0,1]=3 337 B8R0.4 CC=CCCCCCC MCULE-2766900913 [2,0,0,0,0,0|0,0,2]=4 338 B8R0.4 CCC#CCCCCC MCULE-3250800871 [2,0,0,0,0,0|0,0,1]=3 339 B8R0.4 CCCCC/C=C/C=O MCULE-9410244042 [2,0,0,0,0,0|0,0,2]=4 340 B8R0.4 CCCCCC#CC=O MCULE-6367130572 [2,0,0,0,0,0|0,0,0]=2 341 B8R0.4 CCCCCC#CCBr MCULE-7228145409 [2,0,0,0,0,0|1,0,1]=4 342 B8R0.4 CCCCCC#CCCl MCULE-8147360928 [2,0,0,0,0,0|1,0,1]=4 343 B8R0.4 CCCCCC#CCO MCULE-5966258062 [2,0,0,0,0,0|0,0,1]=3 344 B8R0.4 CCCCCC=CC=O MCULE-7640230490 [2,0,0,0,0,0|0,0,2]=4 345 B8R0.4 CCCCCCCC=O MCULE-7111365457 [2,0,0,0,0,0|0,0,2]=4 346 B8R0.4 CCCCCCNC=O MCULE-3719637754 [2,0,0,0,0,0|1,0,1]=4 347 B8R0.4 CCCCCCOC=O MCULE-1329787181 [2,0,0,0,0,0|1,0,1]=4 348 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [2,0,0,0,0,0|1,0,1]=4 349 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [2,0,0,0,0,0|1,0,1]=4 350 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [2,0,0,0,0,0|1,0,1]=4 351 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [2,0,0,0,0,0|1,0,1]=4 352 B8R0.7 CC(=O)NCCCCN MCULE-6666803790 [2,0,0,0,0,0|2,0,0]=4 353 B8R0.7 CC(=O)NCCCCN MCULE-8971714473 [2,0,0,0,0,0|2,0,0]=4 354 B8R0.7 CC(=O)NCCCCO MCULE-5119895862 [2,0,0,0,0,0|2,0,0]=4 355 B8R0.7 CC(=O)OCCCCBr MCULE-6081921662 [2,0,0,0,0,0|2,0,0]=4 356 B8R0.7 CC(=O)OCCCCCl MCULE-3999602136 [2,0,0,0,0,0|2,0,0]=4 357 B8R0.7 CC(=O)OCCCCI MCULE-6699791525 [2,0,0,0,0,0|2,0,0]=4 358 B8R0.7 CC(=O)OCCCCO MCULE-7064721476 [2,0,0,0,0,0|2,0,0]=4 359 B8R0.7 CC(=O)SCCCCBr MCULE-1636667997 [2,0,0,0,0,0|2,0,0]=4 360 B8R0.7 CC(=O)SCCCCN MCULE-2425585672 [2,0,0,0,0,0|2,0,0]=4 361 B8R0.7 CC(=O)SCCCCN MCULE-9899884734 [2,0,0,0,0,0|2,0,0]=4 362 B8R0.7 CCCC/C=C/C(=O)C MCULE-1532446839 [2,0,0,0,0,0|0,0,2]=4 363 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [2,0,0,0,0,0|0,0,2]=4 364 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [2,0,0,0,0,0|0,0,0]=2 365 B8R0.7 CCCCC=CC(=O)C MCULE-6026245958 [2,0,0,0,0,0|0,0,2]=4 366 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [2,0,0,0,0,0|0,0,2]=4 367 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [2,0,0,0,0,0|0,0,1]=3 368 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [2,0,0,0,0,0|1,0,1]=4 369 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [2,0,0,0,0,0|1,0,1]=4 370 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [2,0,0,0,0,0|0,0,1]=3 371 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [2,0,0,0,0,0|0,0,2]=4 372 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [2,0,0,0,0,0|2,0,0]=4 373 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [2,0,0,0,0,0|1,0,0]=3 374 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [2,0,0,0,0,0|2,0,0]=4 375 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [2,0,0,0,0,0|1,0,1]=4 376 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [2,0,0,0,0,0|1,0,1]=4 377 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [2,0,0,0,0,0|1,0,1]=4 378 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [2,0,0,0,0,0|1,0,1]=4 379 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [2,0,0,0,0,0|1,0,1]=4 380 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [2,0,0,0,0,0|1,0,1]=4 381 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [2,0,0,0,0,0|1,0,1]=4 382 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [2,0,0,0,0,0|1,0,1]=4 383 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [2,0,0,0,0,0|1,0,1]=4 384 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [2,0,0,0,0,0|1,0,1]=4 385 B8R0.7 CCOCCOC(=O)C MCULE-3053452981 [2,0,0,0,0,0|2,0,0]=4 386 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [2,0,0,0,0,0|1,0,1]=4 387 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [2,0,0,0,0,0|1,0,1]=4 388 B8R0.7 CNCCCNC(=O)C MCULE-2682619502 [2,0,0,0,0,0|2,0,0]=4 389 B8R0.7 CNCCCNC(=O)C MCULE-3477977807 [2,0,0,0,0,0|2,0,0]=4 390 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [2,0,0,0,0,0|1,0,1]=4 391 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [2,0,0,0,0,0|2,0,0]=4 392 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [2,0,0,0,0,0|1,0,1]=4 393 B8R0.7 CSCCCOC(=O)C MCULE-4403232519 [2,0,0,0,0,0|2,0,0]=4 394 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [2,0,0,0,0,0|1,0,1]=4 395 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [2,0,0,0,0,0|1,0,1]=4 396 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [2,0,0,0,0,0|1,0,1]=4 397 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [2,0,0,0,0,0|1,0,1]=4 398 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [2,0,0,0,0,0|1,0,1]=4 399 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [2,0,0,0,0,0|1,0,1]=4 400 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [2,0,0,0,0,0|1,0,1]=4 401 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [2,0,0,0,0,0|0,0,2]=4 402 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [2,0,0,0,0,0|1,0,1]=4 403 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [2,0,0,0,0,0|0,0,2]=4 404 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [2,0,0,0,0,0|0,0,2]=4 405 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [2,0,0,0,0,0|0,0,2]=4 406 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [2,0,0,0,0,0|0,0,0]=2 407 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [2,0,0,0,0,0|0,0,2]=4 408 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [2,0,0,0,0,0|2,0,0]=4 409 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [2,0,0,0,0,0|1,0,0]=3 410 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [2,0,0,0,0,0|2,0,0]=4 411 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [2,0,0,0,0,0|2,0,0]=4 412 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [2,0,0,0,0,0|0,0,0]=2 413 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [2,0,0,0,0,0|2,0,0]=4 414 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [2,0,0,0,0,0|2,0,0]=4 415 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [2,0,0,0,0,0|2,0,0]=4 416 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [2,0,0,0,0,0|2,0,0]=4 417 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [2,0,0,0,0,0|1,0,0]=3 418 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [2,0,0,0,0,0|1,0,0]=3 419 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [2,0,0,0,0,0|1,0,0]=3 420 B8R0.6 CCNCCC(=O)NC MCULE-8230774906 [2,0,0,0,0,0|2,0,0]=4 421 B8R0.6 CCNCCC(=O)NC MCULE-9131674592 [2,0,0,0,0,0|2,0,0]=4 422 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [2,0,0,0,0,0|1,0,0]=3 423 B8R0.6 CCOCCC(=N)OC MCULE-1143058685 [2,0,0,0,0,0|2,0,0]=4 424 B8R0.6 CCOCCC(=N)OC MCULE-1528455249 [2,0,0,0,0,0|2,0,0]=4 425 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [2,0,0,0,0,0|1,0,0]=3 426 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [2,0,0,0,0,0|1,0,0]=3 427 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [2,0,0,0,0,0|1,0,0]=3 428 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [2,0,0,0,0,0|1,0,1]=4 429 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [2,0,0,0,0,0|1,0,1]=4 430 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [2,0,0,0,0,0|1,0,0]=3 431 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [2,0,0,0,0,0|1,0,0]=3 432 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [2,0,0,0,0,0|1,0,0]=3 433 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [2,0,0,0,0,0|1,0,0]=3 434 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [2,0,0,0,0,0|1,0,0]=3 435 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [2,0,0,0,0,0|1,0,0]=3 436 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [2,0,0,0,0,0|1,0,0]=3 437 B8R0.6 COC(=O)CCCON MCULE-1522874324 [2,0,0,0,0,0|2,0,0]=4 438 B8R0.6 COC(=O)CCCON MCULE-4748610058 [2,0,0,0,0,0|2,0,0]=4 439 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [2,0,0,0,0,0|1,0,0]=3 440 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [2,0,0,0,0,0|2,0,0]=4 441 B8R0.6 COC(=O)COCCN MCULE-5090944064 [2,0,0,0,0,0|2,0,0]=4 442 B8R0.6 COC(=O)COCCN MCULE-6748820855 [2,0,0,0,0,0|2,0,0]=4 443 B8R0.6 COC(=O)COCCO MCULE-7869619911 [2,0,0,0,0,0|2,0,0]=4 444 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [2,0,0,0,0,0|2,0,0]=4 445 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [2,0,0,0,0,0|2,0,0]=4 446 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [2,0,0,0,0,0|1,0,0]=3 447 B8R0.6 CONCCC(=O)OC MCULE-8622619087 [2,0,0,0,0,0|2,0,0]=4 448 B10R0.3 CCCC(C)CCCC(=O)C MCULE-6836595014 [1,1,0,0,0,0|0,0,2]=4 449 B10R0.3 CCCC(C)CCCC(=O)O MCULE-9813732292 [1,1,0,0,0,0|0,0,2]=4 450 B10R0.3 CCCC(C)CCOC(=O)C MCULE-7488303006 [1,1,0,0,0,0|1,0,1]=4 451 B10R0.3 CCCC(O)CCCC(=O)O MCULE-6567242953 [1,1,0,0,0,0|0,0,2]=4 452 B10R0.3 CCCC(S)CCOC(=O)C MCULE-9110387170 [1,1,0,0,0,0|1,0,1]=4 453 B10R0.4 C(=CC(=O)O)CCCCCC MCULE-5063564829 [1,1,0,0,0,0|0,0,2]=4 454 B10R0.4 CC(=O)CCCCCCCO MCULE-6975960500 [1,1,0,0,0,0|0,0,2]=4 455 B10R0.4 CC(=O)NCCCCCCN MCULE-6988947031 [1,1,0,0,0,0|1,0,1]=4 456 B10R0.4 CC(=O)OCCCCCCBr MCULE-9658847674 [1,1,0,0,0,0|1,0,1]=4 457 B10R0.4 CC(=O)OCCCCCCCl MCULE-2777138332 [1,1,0,0,0,0|1,0,1]=4 458 B10R0.4 CC(=O)SCCCCCCN MCULE-6118060031 [1,1,0,0,0,0|1,0,1]=4 459 B10R0.4 CC(=O)SCCCCCCN MCULE-7116355086 [1,1,0,0,0,0|1,0,1]=4 460 B10R0.4 CCCCC/C=C/CC(=O)O MCULE-1378284129 [1,1,0,0,0,0|0,0,2]=4 461 B10R0.4 CCCCCC/C=C/C(=O)O MCULE-8167234483 [1,1,0,0,0,0|0,0,2]=4 462 B10R0.4 CCCCCC=CCC(=O)O MCULE-5507503933 [1,1,0,0,0,0|0,0,2]=4 463 B10R0.4 CCCCCCC=CC(=O)C MCULE-7025674174 [1,1,0,0,0,0|0,0,2]=4 464 B10R0.4 CCCCCCCCC(=O)C MCULE-6168357226 [1,1,0,0,0,0|0,0,2]=4 465 B10R0.4 CCCCCCCCC(=O)O MCULE-4736597375 [1,1,0,0,0,0|0,0,2]=4 466 B10R0.4 CCCCCCCNC(=O)C MCULE-3916780915 [1,1,0,0,0,0|0,0,2]=4 467 B10R0.4 CCCCCCCOC(=O)C MCULE-7061891812 [1,1,0,0,0,0|0,0,2]=4 468 B10R0.4 CCCCCCNCC(=O)O MCULE-3361498309 [1,1,0,0,0,0|0,0,2]=4 469 B10R0.4 CCCCCCOCC(=O)O MCULE-6951993364 [1,1,0,0,0,0|0,0,2]=4 470 B10R0.4 CCCCCCSCC(=O)O MCULE-5086023021 [1,1,0,0,0,0|0,0,2]=4 471 B10R0.4 CCCCOCCOC(=O)C MCULE-4906127008 [1,1,0,0,0,0|1,0,1]=4 472 B10R0.4 CCCCSCCCC(=O)O MCULE-5928316679 [1,1,0,0,0,0|0,0,2]=4 473 B10R0.4 CCOCCCCCC(=O)O MCULE-9514442276 [1,1,0,0,0,0|0,0,2]=4 474 B10R0.4 CSCCCCCCC(=O)O MCULE-9976800222 [1,1,0,0,0,0|0,0,2]=4 475 B10R0.4 NCCCCCCCC(=O)O MCULE-2737882810 [1,1,0,0,0,0|0,0,2]=4 476 B10R0.4 NCCCCCCCC(=O)O MCULE-4269382976 [1,1,0,0,0,0|0,0,2]=4 477 B10R0.4 NCCCCCCNC(=O)O MCULE-3865214371 [1,1,0,0,0,0|1,0,1]=4 478 B10R0.4 O=C(O)CCCCCCCBr MCULE-6425557416 [1,1,0,0,0,0|0,0,2]=4 479 B10R0.4 O=C(O)CCCCCCCO MCULE-1839591073 [1,1,0,0,0,0|0,0,2]=4 480 B10R0.4 O=C(O)CCCCCCCS MCULE-6555950664 [1,1,0,0,0,0|0,0,2]=4 481 B10R0.6 CCCCCC(=O)CC(=O)C MCULE-8236892696 [1,1,0,0,0,0|0,0,2]=4 482 B10R0.6 CCCCCC(C)CC(=O)C MCULE-9366517192 [1,1,0,0,0,0|0,0,2]=4 483 B10R0.6 CCCCCC(C)CC(=O)O MCULE-2066533125 [1,1,0,0,0,0|0,0,2]=4 484 B10R0.6 CCCCCC(N)CC(=O)O MCULE-1332766356 [1,1,0,0,0,0|0,0,2]=4 485 B10R0.6 CCCCCC(N)CC(=O)O MCULE-6217126659 [1,1,0,0,0,0|0,0,2]=4 486 B10R0.6 CCCCCC(O)CC(=O)O MCULE-4825961688 [1,1,0,0,0,0|0,0,2]=4 487 B10R0.6 CCCCC[C@@H](O)CC(=O)O MCULE-2570880673 [1,1,0,0,0,0|0,0,2]=4 488 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-3222730819 [1,1,0,0,0,0|0,0,2]=4 489 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-6407518730 [1,1,0,0,0,0|0,0,2]=4 490 B10R0.22 CCCCCC#C[Si](C)(C)C MCULE-2023301816 [1,1,0,0,0,0|1,1,0]=4 491 B10R0.55 CCC(C)CCCCC(=O)O MCULE-5735580085 [1,1,0,0,0,0|0,0,2]=4 492 B10R0.75 CCCCCCC(Br)C(=O)O MCULE-3532642872 [1,1,0,0,0,0|0,0,2]=4 493 B10R0.75 CCCCCCC(C)C(=O)C MCULE-2296587993 [1,1,0,0,0,0|0,0,2]=4 494 B10R0.75 CCCCCCC(C)C(=O)O MCULE-6664640382 [1,1,0,0,0,0|0,0,2]=4 495 B10R0.75 CCCCCCC(F)C(=O)O MCULE-3865739259 [1,1,0,0,0,0|0,0,2]=4 496 B10R0.75 CCCCCCC(N)C(=O)O MCULE-2527731470 [1,1,0,0,0,0|0,0,2]=4 497 B10R0.75 CCCCCCC(N)C(=O)O MCULE-5498377990 [1,1,0,0,0,0|0,0,2]=4 498 B10R0.75 CCCCCCC(O)C(=O)O MCULE-1679305682 [1,1,0,0,0,0|0,0,2]=4 499 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9163680563 [1,1,0,0,0,0|0,0,2]=4 500 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9959237270 [1,1,0,0,0,0|0,0,2]=4 501 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-6660531044 [1,1,0,0,0,0|0,0,2]=4 502 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-7151037911 [1,1,0,0,0,0|0,0,2]=4 503 B10R0.78 CCCCC(C)CCC(=O)O MCULE-2454273176 [1,1,0,0,0,0|0,0,2]=4 504 B10R0.78 CCCCC(N)CCC(=O)O MCULE-2622598542 [1,1,0,0,0,0|0,0,2]=4 505 B10R0.78 CCCCC(N)CCC(=O)O MCULE-5683869807 [1,1,0,0,0,0|0,0,2]=4 506 B10R0.78 CCCCC(O)CCC(=O)O MCULE-6806538778 [1,1,0,0,0,0|0,0,2]=4 507 B10R0.78 CCCC[C@H](C)CCC(=O)O MCULE-4790339661 [1,1,0,0,0,0|0,0,2]=4 508 B10R0.97 CC(C)CCCCCC(=O)O MCULE-6934503036 [1,1,0,0,0,0|0,0,2]=4 509 B10R0.97 CC(C)CCCOCC(=O)O MCULE-7389478050 [1,1,0,0,0,0|1,0,1]=4 510 B10R0.97 CC(O)CCCCCC(=O)O MCULE-8533691013 [1,1,0,0,0,0|0,0,2]=4 511 B10R0.71 CCCCC#CCCCCC MCULE-9228856431 [1,1,0,0,0,0|1,0,1]=4 512 B10R0.18 CCCCC(=O)CC(=O)OC MCULE-2441269867 [1,1,0,0,0,0|0,0,2]=4 513 B10R0.18 CCCCC(C)NC(=O)SC MCULE-7773386181 [1,1,0,0,0,0|1,1,0]=4 514 B10R0.18 CCCCC(O)CC(=O)OC MCULE-3777448851 [1,1,0,0,0,0|0,0,1]=3 515 B10R0.59 CCC(=O)CCCC(=O)OC MCULE-7955202588 [1,1,0,0,0,0|0,0,2]=4 516 B10R0.59 CCC(C)NCCC(=O)OC MCULE-1748183130 [1,1,0,0,0,0|1,0,1]=4 517 B10R0.83 CCCCCC(N)C(=O)NC MCULE-6020353560 [1,1,0,0,0,0|1,0,1]=4 518 B10R0.83 CCCCCC(N)C(=O)OC MCULE-2018052401 [1,1,0,0,0,0|0,0,1]=3 519 B10R0.83 CCCCCC(N)C(=O)OC MCULE-5487541008 [1,1,0,0,0,0|0,0,1]=3 520 B10R0.83 CCCCCC(O)C(=O)OC MCULE-9996510127 [1,1,0,0,0,0|0,0,1]=3 521 B10R0.83 CCCCC[C@H](N)C(=O)NC MCULE-9979996978 [1,1,0,0,0,0|1,0,1]=4 522 B10R0.83 COC(=O)C(N)CCCCN MCULE-4653959448 [1,1,0,0,0,0|1,0,1]=4 523 B10R0.83 COC(=O)C(N)CCCCN MCULE-5717864681 [1,1,0,0,0,0|1,0,1]=4 524 B10R0.83 COC(=O)C(N)CCCCN MCULE-8914801986 [1,1,0,0,0,0|1,0,1]=4 525 B10R0.83 COC(=O)C(N)CCCCO MCULE-5166100554 [1,1,0,0,0,0|1,0,1]=4 526 B10R0.83 COC(=O)C(N)CCCCO MCULE-6738034786 [1,1,0,0,0,0|1,0,1]=4 527 B10R0.83 COC(=O)C([NH3+])CCCC[NH3+] MCULE-3249374734 [1,1,0,0,0,0|1,0,1]=4 528 B10R0.83 COC(=O)[C@@H](N)CCCCN MCULE-1350520573 [1,1,0,0,0,0|1,0,1]=4 529 B10R0.83 COC(=O)[C@@H](N)CCCCN MCULE-6307487491 [1,1,0,0,0,0|1,0,1]=4 530 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-2204531892 [1,1,0,0,0,0|1,0,1]=4 531 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-2624615589 [1,1,0,0,0,0|1,0,1]=4 532 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-6994501008 [1,1,0,0,0,0|1,0,1]=4 533 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-7046980735 [1,1,0,0,0,0|1,0,1]=4 534 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-7404594930 [1,1,0,0,0,0|1,0,1]=4 535 B10R0.83 [C@H](N)(CCCCN)C(=O)OC MCULE-5018936719 [1,1,0,0,0,0|1,0,1]=4 536 B10R0.83 [C@H](N)(CCCCN)C(=O)OC MCULE-8447837964 [1,1,0,0,0,0|1,0,1]=4 537 B12R0.1 CCCCCC=CCC(=O)OCC MCULE-2452505052 [0,2,0,0,0,0|0,0,2]=4 538 B12R0.1 CCCCCCC#CC(=O)OCC MCULE-9938881189 [0,2,0,0,0,0|0,0,0]=2 539 B12R0.1 CCCCCCC=CC(=O)OCC MCULE-4260025223 [0,2,0,0,0,0|0,0,2]=4 540 B12R0.1 CCCCCCCCC(=O)OCC MCULE-5309868306 [0,2,0,0,0,0|0,0,2]=4 541 B12R0.1 CCCCCCCCC(=O)OCCl MCULE-7482672748 [0,2,0,0,0,0|0,0,2]=4 542 B12R0.1 CCCCCNCCC(=O)OCC MCULE-6006388312 [0,2,0,0,0,0|0,0,2]=4 543 B12R0.1 CCOC(=O)CCCCCCCBr MCULE-8678920768 [0,2,0,0,0,0|0,0,2]=4 544 B12R0.1 CCOC(=O)CCCCCCCCl MCULE-8377860069 [0,2,0,0,0,0|0,0,2]=4 545 B12R0.1 CCOC(=O)CCCCCCCI MCULE-5677306490 [0,2,0,0,0,0|0,0,2]=4 546 B12R0.1 CCOC(=O)CCCCCCCN MCULE-2162819446 [0,2,0,0,0,0|0,0,2]=4 547 B12R0.1 CCOC(=O)CCCCCCCN MCULE-4046698936 [0,2,0,0,0,0|0,0,2]=4 548 B12R0.1 CCOC(=O)CCCCCCCO MCULE-3311157136 [0,2,0,0,0,0|0,0,2]=4 549 B12R0.4 CCCCCCCC(=O)OC(C)C MCULE-9786578174 [0,2,0,0,0,0|0,0,2]=4 550 B12R0.49 CCCCCCC=C(C)C(=O)OC MCULE-9746455818 [0,2,0,0,0,0|0,0,2]=4 551 B12R0.49 CCCCCCCC(=O)N(C)OC MCULE-3329432513 [0,2,0,0,0,0|0,0,2]=4 552 B12R0.49 CCCCCNCC(C)C(=O)OC MCULE-7883564580 [0,2,0,0,0,0|0,0,2]=4 553 B12R0.101 CCCCC(C)CCC(=O)OCC MCULE-6733464056 [0,2,0,0,0,0|0,0,2]=4 554 B12R0.114 CCCCC/C=C(\C)/C(=O)OCC MCULE-8195902601 [0,2,0,0,0,0|0,0,2]=4 555 B12R0.114 CCCCCC=C(C)C(=O)OCC MCULE-5847999326 [0,2,0,0,0,0|0,0,2]=4 556 B12R0.114 CCCCCCC(Br)C(=O)OCC MCULE-8234853299 [0,2,0,0,0,0|0,0,2]=4 557 B12R0.114 CCCCCCC(C)C(=O)OCC MCULE-6433825405 [0,2,0,0,0,0|0,0,2]=4 558 B12R0.206 CCCCCCCC(=O)OCCC MCULE-5108681764 [0,2,0,0,0,0|0,0,2]=4 559 B12R0.239 CCCCCC(=O)CC(=O)OCC MCULE-5338610169 [0,2,0,0,0,0|0,0,2]=4 560 B12R0.239 CCCCCC(C)CC(=O)OCC MCULE-6554122155 [0,2,0,0,0,0|0,0,2]=4 561 B12R0.239 CCCCCC(O)CC(=O)OCC MCULE-5021805198 [0,2,0,0,0,0|0,0,2]=4 562 B12R0.277 CCOC(=O)CCCCCC(C)C MCULE-4669970484 [0,2,0,0,0,0|0,0,2]=4 563 B12R0.57 CCCCCCC#CC(OC)OC MCULE-8529098671 [0,2,0,0,0,0|0,0,2]=4 564 B12R0.113 CCCCCCC(O)CC(=O)OC MCULE-8995113646 [0,2,0,0,0,0|0,0,2]=4 565 B12R0.113 CCCCCNC(C)CC(=O)OC MCULE-2558037544 [0,2,0,0,0,0|0,0,2]=4 566 B12R0.142 CCCCCN(C)CCC(=O)OC MCULE-2291452390 [0,2,0,0,0,0|0,0,2]=4 567 B12R0.184 COC(=O)CCCCCCC(C)C MCULE-3897074156 [0,2,0,0,0,0|0,0,2]=4 568 B12R0.248 C=CCCCCCCCC(=O)OC MCULE-1843303649 [0,2,0,0,0,0|0,0,2]=4 569 B12R0.248 CCCCCCCCCC(=O)OC MCULE-3080392178 [0,2,0,0,0,0|0,0,2]=4 570 B12R0.248 CCCCCCCSCC(=O)OC MCULE-8419218207 [0,2,0,0,0,0|0,0,2]=4 571 B12R0.248 CNCCCCCCCC(=O)OC MCULE-2073535841 [0,2,0,0,0,0|0,0,2]=4 572 B12R0.248 COC(=O)CCCCCCCC=O MCULE-8962678443 [0,2,0,0,0,0|0,0,2]=4 573 B12R0.248 COC(=O)CCCCCCCCBr MCULE-8360143365 [0,2,0,0,0,0|0,0,2]=4 574 B12R0.248 COC(=O)CCCCCCCCO MCULE-5867988584 [0,2,0,0,0,0|0,0,2]=4 575 B10R1.10 CCCC1CCCC(=O)C1 MCULE-7668769463 [1,0,0,1,0,0|0,0,2]=4 576 B10R1.10 CCCC1CCCC(=O)O1 MCULE-9181432444 [1,0,0,1,0,0|0,0,2]=4 577 B10R1.10 CCCC1CCNC(=O)C1 MCULE-2999950135 [1,0,0,1,0,0|1,0,1]=4 578 B10R1.16 CCCCC1CCC(=O)O1 MCULE-2172174471 [1,0,0,1,0,0|0,0,2]=4 579 B10R1.16 CCCCC1CNC(=O)C1 MCULE-7940886893 [1,0,0,1,0,0|1,0,1]=4 580 B10R1.18 CC(=O)C=C1CCCCC1 MCULE-8551739363 [1,0,0,1,0,0|0,0,2]=4 581 B10R1.18 CC(=O)CC1CCCCC1 MCULE-4557008527 [1,0,0,1,0,0|0,0,2]=4 582 B10R1.18 CC(=O)CN1CCCCC1 MCULE-2519145455 [1,0,0,1,0,0|1,0,1]=4 583 B10R1.18 CC(=O)CN1CCCCC1 MCULE-8358959341 [1,0,0,1,0,0|1,0,1]=4 584 B10R1.18 CC(=O)NC1CCCCC1 MCULE-8353778142 [1,0,0,1,0,0|1,0,1]=4 585 B10R1.18 CC(=O)OC1CCCCC1 MCULE-8221153491 [1,0,0,1,0,0|1,0,1]=4 586 B10R1.18 O=C(O)C=C1CCCCC1 MCULE-2830279446 [1,0,0,1,0,0|0,0,2]=4 587 B10R1.18 O=C(O)CC1CCCCC1 MCULE-3370925166 [1,0,0,1,0,0|0,0,2]=4 588 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9137136186 [1,0,0,1,0,0|1,0,1]=4 589 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9769416161 [1,0,0,1,0,0|1,0,1]=4 590 B10R1.18 O=C(O)NC1CCCCC1 MCULE-5645794848 [1,0,0,1,0,0|1,0,1]=4 591 B10R1.24 CCCCCC1CC(=O)C1 MCULE-5494050284 [1,0,0,1,0,0|0,0,2]=4 592 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [1,0,0,1,0,0|0,0,2]=4 593 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [1,0,0,1,0,0|1,0,1]=4 594 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [1,0,0,1,0,0|1,0,1]=4 595 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [1,0,0,1,0,0|0,0,2]=4 596 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [1,0,0,1,0,0|1,0,1]=4 597 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [1,0,0,1,0,0|1,0,1]=4 598 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [1,0,0,1,0,0|0,0,2]=4 599 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [1,0,0,1,0,0|0,0,2]=4 600 B10R1.64 CC(=O)CN1CCCC1C MCULE-5489343795 [1,0,0,1,0,0|1,0,1]=4 601 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [1,0,0,1,0,0|0,0,2]=4 602 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [1,0,0,1,0,0|1,0,1]=4 603 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [1,0,0,1,0,0|1,0,1]=4 604 B10R1.66 CC(=O)CCC1CCCC1 MCULE-9602514524 [1,0,0,1,0,0|0,0,2]=4 605 B10R1.66 O=C(O)/C=C/C1CCCC1 MCULE-5196632480 [1,0,0,1,0,0|0,0,2]=4 606 B10R1.66 O=C(O)C#CC1CCCO1 MCULE-1325340304 [1,0,0,1,0,0|1,0,0]=3 607 B10R1.66 O=C(O)C#CC1CCOC1 MCULE-8365235824 [1,0,0,1,0,0|1,0,0]=3 608 B10R1.66 O=C(O)C=CC1CCCC1 MCULE-4492328269 [1,0,0,1,0,0|0,0,2]=4 609 B10R1.66 O=C(O)CCC1CCCC1 MCULE-4583118303 [1,0,0,1,0,0|0,0,2]=4 610 B10R1.66 O=C(O)CNC1CCCC1 MCULE-2656159228 [1,0,0,1,0,0|1,0,1]=4 611 B10R1.66 O=C(O)CNC1CCCC1 MCULE-9561013929 [1,0,0,1,0,0|1,0,1]=4 612 B10R1.66 O=C(O)COC1CCCC1 MCULE-2079008170 [1,0,0,1,0,0|1,0,1]=4 613 B10R1.66 O=C(O)CSC1CCCC1 MCULE-7601914378 [1,0,0,1,0,0|1,0,1]=4 614 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [1,0,0,1,0,0|0,0,2]=4 615 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [1,0,0,1,0,0|1,0,1]=4 616 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [1,0,0,1,0,0|0,0,2]=4 617 B10R1.126 O=C(O)CCCCC1CC1 MCULE-2606424315 [1,0,0,1,0,0|0,0,2]=4 618 B10R1.127 O=C(O)CCCC1CCC1 MCULE-4719788416 [1,0,0,1,0,0|0,0,2]=4 619 B10R1.127 O=C(O)COCC1CCC1 MCULE-7673852901 [1,0,0,1,0,0|1,0,1]=4 620 B10R1.144 CCCCC1CC1C(=O)O MCULE-5737299312 [1,0,0,1,0,0|0,0,2]=4 621 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [1,0,0,1,0,0|0,0,2]=4 622 B10R1.348 CC(=O)N1CCCCCC1 MCULE-4232660324 [1,0,0,1,0,0|1,0,1]=4 623 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [1,0,0,1,0,0|0,0,2]=4 624 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [1,0,0,1,0,0|0,0,2]=4 625 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [1,0,0,1,0,0|1,0,1]=4 626 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [1,0,0,1,0,0|1,0,1]=4 627 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [1,0,0,1,0,0|1,0,1]=4 628 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [1,0,0,1,0,0|1,0,1]=4 629 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [1,0,0,1,0,0|1,0,1]=4 630 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [1,0,0,1,0,0|1,0,1]=4 631 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [1,0,0,1,0,0|1,0,1]=4 632 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [1,0,0,1,0,0|1,0,1]=4 633 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [1,0,0,1,0,0|1,0,1]=4 634 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [1,0,0,1,0,0|1,0,1]=4 635 B10R1.161 COC1=CCCCCCC1 MCULE-3500334234 [1,0,0,1,0,0|0,0,2]=4 636 B10R1.161 COC1=CCCCCCC1 MCULE-4140921077 [1,0,0,1,0,0|0,0,2]=4 637 B10R1.161 COC1=NCCCCCC1 MCULE-5781494943 [1,0,0,1,0,0|1,0,1]=4 638 B10R1.1 CCCC1CCC(=O)CC1 MCULE-4621155554 [1,0,0,1,0,0|1,0,1]=4 639 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-3306037072 [1,0,0,1,0,0|1,0,1]=4 640 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-9288344897 [1,0,0,1,0,0|1,0,1]=4 641 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-4117287216 [1,0,0,1,0,0|1,0,1]=4 642 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-8091301795 [1,0,0,1,0,0|1,0,1]=4 643 B10R1.15 CCC(=O)C1CCCCC1 MCULE-8203276385 [1,0,0,1,0,0|1,0,1]=4 644 B10R1.15 CNC(=O)C1CCCCC1 MCULE-4980742243 [1,0,0,1,0,0|1,0,1]=4 645 B10R1.15 COC(=O)C1=CCCCC1 MCULE-3153400458 [1,0,0,1,0,0|0,0,2]=4 646 B10R1.15 COC(=O)C1CCCCC1 MCULE-6850082589 [1,0,0,1,0,0|0,0,1]=3 647 B10R1.15 COC(=O)C1CCCCN1 MCULE-1345527122 [1,0,0,1,0,0|1,0,1]=4 648 B10R1.15 COC(=O)C1CCCCN1 MCULE-3343413800 [1,0,0,1,0,0|1,0,1]=4 649 B10R1.15 COC(=O)C1CCCCO1 MCULE-4699637806 [1,0,0,1,0,0|1,0,1]=4 650 B10R1.15 COC(=O)C1CCCCS1 MCULE-5621167539 [1,0,0,1,0,0|1,0,1]=4 651 B10R1.15 COC(=O)C1CCCNC1 MCULE-5215588899 [1,0,0,1,0,0|1,0,1]=4 652 B10R1.15 COC(=O)C1CCCNC1 MCULE-8977979820 [1,0,0,1,0,0|1,0,1]=4 653 B10R1.15 COC(=O)C1CCCOC1 MCULE-8852064521 [1,0,0,1,0,0|1,0,1]=4 654 B10R1.15 COC(=O)C1CCNCC1 MCULE-5613020223 [1,0,0,1,0,0|1,0,1]=4 655 B10R1.15 COC(=O)C1CCNCC1 MCULE-9635570834 [1,0,0,1,0,0|1,0,1]=4 656 B10R1.15 COC(=O)C1CCOCC1 MCULE-9277091866 [1,0,0,1,0,0|1,0,1]=4 657 B10R1.15 COC(=O)C1CCSCC1 MCULE-2533530421 [1,0,0,1,0,0|1,0,1]=4 658 B10R1.15 COC(=O)N1CCCCC1 MCULE-4843476028 [1,0,0,1,0,0|1,0,0]=3 659 B10R1.15 COC(=O)N1CCCCC1 MCULE-8096578349 [1,0,0,1,0,0|1,0,0]=3 660 B10R1.15 COC(=O)N1CCNCC1 MCULE-1605451144 [1,0,0,1,0,0|2,0,0]=4 661 B10R1.15 COC(=O)N1CCNCC1 MCULE-1876224214 [1,0,0,1,0,0|2,0,0]=4 662 B10R1.15 COC(=O)N1CCOCC1 MCULE-1622827053 [1,0,0,1,0,0|2,0,0]=4 663 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-4659733955 [1,0,0,1,0,0|1,0,1]=4 664 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-6675153946 [1,0,0,1,0,0|1,0,1]=4 665 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-7164905117 [1,0,0,1,0,0|1,0,1]=4 666 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-8391987811 [1,0,0,1,0,0|1,0,1]=4 667 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-1357072117 [1,0,0,1,0,0|1,0,1]=4 668 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-6685948915 [1,0,0,1,0,0|1,0,1]=4 669 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-7943195603 [1,0,0,1,0,0|1,0,1]=4 670 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-8245028670 [1,0,0,1,0,0|1,0,1]=4 671 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5042289968 [1,0,0,1,0,0|1,0,1]=4 672 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5552610931 [1,0,0,1,0,0|1,0,1]=4 673 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6096933206 [1,0,0,1,0,0|1,0,1]=4 674 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6748268572 [1,0,0,1,0,0|1,0,1]=4 675 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-1258591863 [1,0,0,1,0,0|1,0,1]=4 676 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-2913297882 [1,0,0,1,0,0|1,0,1]=4 677 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-7994934831 [1,0,0,1,0,0|1,0,1]=4 678 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-9664872744 [1,0,0,1,0,0|1,0,1]=4 679 B10R1.15 COC(=O)[C@H]1CCCOC1 MCULE-3895837022 [1,0,0,1,0,0|1,0,1]=4 680 B10R1.15 COC(=S)N1CCCCC1 MCULE-9617506114 [1,0,0,1,0,0|1,1,0]=4 681 B10R1.27 CNC(=O)NC1CCCC1 MCULE-2695826124 [1,0,0,1,0,0|2,0,0]=4 682 B10R1.27 COC(=O)C=C1CCCC1 MCULE-7918747282 [1,0,0,1,0,0|0,0,2]=4 683 B10R1.27 COC(=O)CC1CCCC1 MCULE-9342597891 [1,0,0,1,0,0|0,0,1]=3 684 B10R1.27 COC(=O)CC1CCCN1 MCULE-5803935472 [1,0,0,1,0,0|1,0,1]=4 685 B10R1.27 COC(=O)CC1CCCN1 MCULE-8428971594 [1,0,0,1,0,0|1,0,1]=4 686 B10R1.27 COC(=O)CC1CCCN1 MCULE-8962564154 [1,0,0,1,0,0|1,0,1]=4 687 B10R1.27 COC(=O)CC1CCCN1 MCULE-9463345165 [1,0,0,1,0,0|1,0,1]=4 688 B10R1.27 COC(=O)CC1CCCO1 MCULE-5045576239 [1,0,0,1,0,0|1,0,1]=4 689 B10R1.27 COC(=O)CC1CCNC1 MCULE-1335311848 [1,0,0,1,0,0|1,0,1]=4 690 B10R1.27 COC(=O)CC1CCNC1 MCULE-1342941310 [1,0,0,1,0,0|1,0,1]=4 691 B10R1.27 COC(=O)CC1CCOC1 MCULE-5503781159 [1,0,0,1,0,0|1,0,1]=4 692 B10R1.27 COC(=O)CN1CCCC1 MCULE-6435350712 [1,0,0,1,0,0|1,0,1]=4 693 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-3432361428 [1,0,0,1,0,0|1,0,1]=4 694 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-4923467879 [1,0,0,1,0,0|1,0,1]=4 695 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-7489755473 [1,0,0,1,0,0|1,0,1]=4 696 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-9818066506 [1,0,0,1,0,0|1,0,1]=4 697 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-2278430991 [1,0,0,1,0,0|1,0,1]=4 698 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7607667453 [1,0,0,1,0,0|1,0,1]=4 699 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7633055222 [1,0,0,1,0,0|1,0,1]=4 700 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-8491722899 [1,0,0,1,0,0|1,0,1]=4 701 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3400926095 [1,0,0,1,0,0|1,0,1]=4 702 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3995901791 [1,0,0,1,0,0|1,0,1]=4 703 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-6386262688 [1,0,0,1,0,0|1,0,1]=4 704 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-9243040577 [1,0,0,1,0,0|1,0,1]=4 705 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-2917470545 [1,0,0,1,0,0|1,0,1]=4 706 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-4018086942 [1,0,0,1,0,0|1,0,1]=4 707 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-5775187737 [1,0,0,1,0,0|1,0,1]=4 708 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-6881593954 [1,0,0,1,0,0|1,0,1]=4 709 B10R1.27 COC(=O)NC1CCNC1 MCULE-6293446949 [1,0,0,1,0,0|2,0,0]=4 710 B10R1.27 COC(=O)NC1CCNC1 MCULE-9989519789 [1,0,0,1,0,0|2,0,0]=4 711 B10R1.27 COC(=O)N[C@H]1CCNC1 MCULE-1532656229 [1,0,0,1,0,0|2,0,0]=4 712 B10R1.27 COC(=O)N[C@H]1CCNC1 MCULE-5746263150 [1,0,0,1,0,0|2,0,0]=4 713 B10R1.27 CSC(=O)NC1CCCC1 MCULE-6446995725 [1,0,0,1,0,0|1,1,0]=4 714 B10R1.99 COC(=O)C1CC1CCO MCULE-9852071077 [1,0,0,1,0,0|1,0,1]=4 715 B10R1.99 COC(=O)[C@H]1C[C@@H]1CCO MCULE-2333161396 [1,0,0,1,0,0|1,0,1]=4 716 B10R1.99 COC(=O)[C@H]1C[C@@H]1CCO MCULE-2823946888 [1,0,0,1,0,0|1,0,1]=4 717 B10R1.149 COC(=O)C1CCCC1N MCULE-1292074679 [1,0,0,1,0,0|1,0,1]=4 718 B10R1.149 COC(=O)C1CCCC1N MCULE-1475645605 [1,0,0,1,0,0|1,0,1]=4 719 B10R1.149 COC(=O)C1CCCC1O MCULE-3674845958 [1,0,0,1,0,0|1,0,1]=4 720 B10R1.149 COC(=O)C1CCCN1C MCULE-4362840235 [1,0,0,1,0,0|1,0,1]=4 721 B10R1.149 COC(=O)C1CCCN1C MCULE-5596975421 [1,0,0,1,0,0|1,0,1]=4 722 B10R1.149 COC(=O)C1CCNC1C MCULE-8241817730 [1,0,0,1,0,0|1,0,1]=4 723 B10R1.149 COC(=O)C1CCNC1C MCULE-8840385748 [1,0,0,1,0,0|1,0,1]=4 724 B10R1.149 COC(=O)C1CCOC1C MCULE-1899362431 [1,0,0,1,0,0|1,0,1]=4 725 B10R1.149 COC(=O)C1CNCC1C MCULE-7210179317 [1,0,0,1,0,0|1,0,1]=4 726 B10R1.149 COC(=O)C1CNCC1C MCULE-8278654714 [1,0,0,1,0,0|1,0,1]=4 727 B10R1.149 COC(=O)C1NCCC1C MCULE-2145747628 [1,0,0,1,0,0|1,0,1]=4 728 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-1885742091 [1,0,0,1,0,0|1,0,1]=4 729 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-9974114171 [1,0,0,1,0,0|1,0,1]=4 730 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-2645143657 [1,0,0,1,0,0|1,0,1]=4 731 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-7497757726 [1,0,0,1,0,0|1,0,1]=4 732 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-8238495714 [1,0,0,1,0,0|1,0,1]=4 733 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9068401272 [1,0,0,1,0,0|1,0,1]=4 734 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9532295626 [1,0,0,1,0,0|1,0,1]=4 735 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N MCULE-8649678944 [1,0,0,1,0,0|1,0,1]=4 736 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-2548615141 [1,0,0,1,0,0|1,0,1]=4 737 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-6985668415 [1,0,0,1,0,0|1,0,1]=4 738 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1C MCULE-6327833377 [1,0,0,1,0,0|1,0,1]=4 739 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1C MCULE-8404202430 [1,0,0,1,0,0|1,0,1]=4 740 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-4739167857 [1,0,0,1,0,0|1,0,1]=4 741 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-5685325244 [1,0,0,1,0,0|1,0,1]=4 742 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-1925401143 [1,0,0,1,0,0|1,0,1]=4 743 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-3666883935 [1,0,0,1,0,0|1,0,1]=4 744 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-2108800799 [1,0,0,1,0,0|1,0,1]=4 745 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-9702061223 [1,0,0,1,0,0|1,0,1]=4 746 B10R1.149 COC(=O)[C@H]1CCC[C@H]1O MCULE-9551218859 [1,0,0,1,0,0|1,0,1]=4 747 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-2992960189 [1,0,0,1,0,0|1,0,1]=4 748 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-9449255589 [1,0,0,1,0,0|1,0,1]=4 749 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-1719318949 [1,0,0,1,0,0|1,0,1]=4 750 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-7330244444 [1,0,0,1,0,0|1,0,1]=4 751 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-1764804596 [1,0,0,1,0,0|1,0,1]=4 752 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-2864244140 [1,0,0,1,0,0|1,0,1]=4 753 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-5987586809 [1,0,0,1,0,0|1,0,1]=4 754 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8761929916 [1,0,0,1,0,0|1,0,1]=4 755 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8926066537 [1,0,0,1,0,0|1,0,1]=4 756 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-9572268200 [1,0,0,1,0,0|1,0,1]=4 757 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1C MCULE-6874278829 [1,0,0,1,0,0|1,0,1]=4 758 B10R1.149 COC(=O)[C@H]1NCC[C@H]1C MCULE-1156779891 [1,0,0,1,0,0|1,0,1]=4 759 B10R1.151 COC(=O)/C=C/C1CCC1 MCULE-5455429902 [1,0,0,1,0,0|0,0,2]=4 760 B10R1.151 COC(=O)C=CC1CCC1 MCULE-6690075033 [1,0,0,1,0,0|0,0,2]=4 761 B10R1.151 COC(=O)CCC1CNC1 MCULE-1365275007 [1,0,0,1,0,0|1,0,1]=4 762 B10R1.151 COC(=O)CCC1CNC1 MCULE-2678688700 [1,0,0,1,0,0|1,0,1]=4 763 B10R1.151 COC(=O)CCN1CCC1 MCULE-1137855857 [1,0,0,1,0,0|1,0,1]=4 764 B10R1.151 COC(=O)COC1CCC1 MCULE-1185518800 [1,0,0,1,0,0|1,0,1]=4 765 B10R1.153 COC(=O)CCNC1CC1 MCULE-2301897798 [1,0,0,1,0,0|1,0,1]=4 766 B10R1.153 COC(=O)CNCC1CC1 MCULE-6592202789 [1,0,0,1,0,0|1,0,1]=4 767 B10R1.153 COC(=O)CNCC1CC1 MCULE-9101924352 [1,0,0,1,0,0|1,0,1]=4 768 B10R1.175 COC(=O)C1CCC1CO MCULE-4671679944 [1,0,0,1,0,0|1,0,1]=4 769 B10R1.197 CCC1CCCC(=O)CC1 MCULE-9268041087 [1,0,0,1,0,0|1,0,1]=4 770 B10R1.197 CCC1CCNC(=O)CC1 MCULE-8320678614 [1,0,0,1,0,0|2,0,0]=4 771 B12R1.32 CCOC(=O)C=C1CCCCC1 MCULE-3079324701 [0,1,0,1,0,0|0,0,2]=4 772 B12R1.32 CCOC(=O)CC1CCCCC1 MCULE-1152805009 [0,1,0,1,0,0|0,0,2]=4 773 B12R1.32 CCOC(=O)CN1CCCCC1 MCULE-7400575339 [0,1,0,1,0,0|1,0,1]=4 774 B12R1.32 CCOC(=O)NC1CCCCC1 MCULE-3205850197 [0,1,0,1,0,0|1,0,1]=4 775 B12R1.32 CCOC(=O)NN1CCCCC1 MCULE-9620315682 [0,1,0,1,0,0|2,0,0]=4 776 B12R1.32 O=C(CC1CCCCC1)OCCl MCULE-6172375896 [0,1,0,1,0,0|0,0,2]=4 777 B12R1.32 O=C(OCCl)OC1CCCCC1 MCULE-6321992113 [0,1,0,1,0,0|1,0,1]=4 778 B12R1.51 CCOC(=O)/C=C/C1CCCC1 MCULE-2221943770 [0,1,0,1,0,0|0,0,2]=4 779 B12R1.51 CCOC(=O)C=CC1CCCC1 MCULE-2022772727 [0,1,0,1,0,0|0,0,2]=4 780 B12R1.51 CCOC(=O)CCC1CCCC1 MCULE-2375028456 [0,1,0,1,0,0|0,0,2]=4 781 B12R1.51 CCOC(=O)CNC1CCCC1 MCULE-3738945622 [0,1,0,1,0,0|1,0,1]=4 782 B12R1.51 CCOC(=O)CNC1CCCC1 MCULE-5699447837 [0,1,0,1,0,0|1,0,1]=4 783 B12R1.372 CCCCCCC1CCOC1=O MCULE-7489729502 [0,1,0,1,0,0|0,0,2]=4 784 B12R1.1564 CCOC(=O)C1CCCCCC1 MCULE-4116850705 [0,1,0,1,0,0|0,0,2]=4 785 B12R1.1564 CCOC(=O)C1CCCCCN1 MCULE-1724738944 [0,1,0,1,0,0|1,0,1]=4 786 B12R1.1564 CCOC(=O)N1CCCCCC1 MCULE-9546533625 [0,1,0,1,0,0|1,0,1]=4 787 B12R1.27 COC(=O)C#CC1=CCCCC1 MCULE-4944660809 [0,1,0,1,0,0|0,0,1]=3 788 B12R1.27 COC(=O)CCC1CCCCC1 MCULE-4982130149 [0,1,0,1,0,0|0,0,2]=4 789 B12R1.27 COC(=O)CCC1CCCCN1 MCULE-5430155727 [0,1,0,1,0,0|0,0,2]=4 790 B12R1.27 COC(=O)CCC1CCCCN1 MCULE-8425873185 [0,1,0,1,0,0|0,0,2]=4 791 B12R1.27 COC(=O)CCC1CCCNC1 MCULE-3207892462 [0,1,0,1,0,0|0,0,2]=4 792 B12R1.27 COC(=O)CCC1CCCNC1 MCULE-4998474197 [0,1,0,1,0,0|0,0,2]=4 793 B12R1.27 COC(=O)CCC1CCNCC1 MCULE-4070291371 [0,1,0,1,0,0|0,0,2]=4 794 B12R1.27 COC(=O)CCC1CCNCC1 MCULE-9899833979 [0,1,0,1,0,0|0,0,2]=4 795 B12R1.27 COC(=O)CCN1CCCCC1 MCULE-8363403616 [0,1,0,1,0,0|0,0,2]=4 796 B12R1.27 COC(=O)CCN1CCCCC1 MCULE-9158799668 [0,1,0,1,0,0|0,0,2]=4 797 B12R1.27 COC(=O)CNC1CCCCC1 MCULE-3628546494 [0,1,0,1,0,0|0,0,2]=4 798 B12R1.27 COC(=O)CNC1CCCCC1 MCULE-8461156941 [0,1,0,1,0,0|0,0,2]=4 799 B12R1.27 COC(=O)CNC1CCOCC1 MCULE-2414362668 [0,1,0,1,0,0|1,0,1]=4 800 B12R1.27 COC(=O)CNC1CCOCC1 MCULE-9240609938 [0,1,0,1,0,0|1,0,1]=4 801 B12R1.27 COC(=O)COC1CCCCC1 MCULE-2770584925 [0,1,0,1,0,0|0,0,2]=4 802 B12R1.27 COC(=O)COC1CCCCO1 MCULE-9132561989 [0,1,0,1,0,0|1,0,1]=4 803 B12R1.27 COC(=O)COC1CCNCC1 MCULE-1515730437 [0,1,0,1,0,0|1,0,1]=4 804 B12R1.27 COC(=O)COC1CCNCC1 MCULE-4644132320 [0,1,0,1,0,0|1,0,1]=4 805 B12R1.27 COC(=O)CSC1CCCCC1 MCULE-3029014522 [0,1,0,1,0,0|0,0,2]=4 806 B12R1.77 COC(=O)C1CCCCC1CCl MCULE-1382388531 [0,1,0,1,0,0|0,0,2]=4 807 B12R1.77 COC(=O)C1CCCCC1CN MCULE-6303964876 [0,1,0,1,0,0|0,0,2]=4 808 B12R1.77 COC(=O)C1CCCCC1CN MCULE-9790305648 [0,1,0,1,0,0|0,0,2]=4 809 B12R1.77 COC(=O)C1CCCCC1CO MCULE-9026826219 [0,1,0,1,0,0|0,0,2]=4 810 B12R1.77 COC(=O)[C@@H]1CCCC[C@H]1CO MCULE-9762653277 [0,1,0,1,0,0|0,0,2]=4 811 B12R1.77 COC(=O)[C@H]1CCCC[C@@H]1CO MCULE-9302510534 [0,1,0,1,0,0|0,0,2]=4 812 B12R1.365 COC(=O)C1CCCCCC1=O MCULE-3603977230 [0,1,0,1,0,0|0,0,2]=4 813 B12R1.365 COC(=O)C1CCCCCC1N MCULE-2985536871 [0,1,0,1,0,0|0,0,2]=4 814 B12R1.365 COC(=O)C1CCCCCC1N MCULE-7391362167 [0,1,0,1,0,0|0,0,2]=4 815 B12R1.371 COC(=O)CC1CCCNC1C MCULE-5727809126 [0,1,0,1,0,0|0,0,2]=4 816 B12R1.371 COC(=O)CC1CNCCC1C MCULE-4797744674 [0,1,0,1,0,0|0,0,2]=4 817 B12R1.371 COC(=O)CC1CNCCC1C MCULE-6244671024 [0,1,0,1,0,0|0,0,2]=4 818 B12R1.371 COC(=O)N[C@@H]1CNCC[C@@H]1C MCULE-3868741323 [0,1,0,1,0,0|1,0,1]=4 819 B12R1.371 COC(=O)N[C@@H]1CNCC[C@@H]1C MCULE-4196602758 [0,1,0,1,0,0|1,0,1]=4 820 B12R1.477 COC(=O)CCNC1CCCC1 MCULE-8194716372 [0,1,0,1,0,0|0,0,2]=4 821 B12R1.1659 COC(=O)C1CCCCCCC1 MCULE-8407585180 [0,1,0,1,0,0|0,0,2]=4 822 B12R1.1748 COC(=O)C=C1CCCCCC1 MCULE-2954267118 [0,1,0,1,0,0|0,0,2]=4 823 B12R1.1748 COC(=O)C=C1CCCCCN1 MCULE-7640918520 [0,1,0,1,0,0|0,0,2]=4 824 B12R1.1748 COC(=O)CC1CCCCCC1 MCULE-5471448909 [0,1,0,1,0,0|0,0,2]=4 825 B12R1.1748 COC(=O)CC1CCCNCC1 MCULE-8246652599 [0,1,0,1,0,0|0,0,2]=4 826 B12R1.1748 COC(=O)CC1CCCNCC1 MCULE-8769597228 [0,1,0,1,0,0|0,0,2]=4 827 B12R1.1748 COC(=O)CN1CCCNCC1 MCULE-2302704687 [0,1,0,1,0,0|1,0,1]=4 828 B12R1.1748 COC(=O)CN1CCCNCC1 MCULE-2502781833 [0,1,0,1,0,0|1,0,1]=4 829 B12R1.1657 COC(=O)C1CCCCC(C1)N MCULE-4941616520 [0,1,0,1,0,0|0,0,2]=4 830 B12R1.1657 COC(=O)C1CCCCC(C1)O MCULE-1860574811 [0,1,0,1,0,0|0,0,2]=4 831 B12R1.49 COC(=O)CC1CCC(CC1)Br MCULE-6083412814 [0,1,0,1,0,0|0,0,2]=4 832 B12R1.49 COC(=O)CC1CCC(CC1)C MCULE-9187132605 [0,1,0,1,0,0|0,0,2]=4 833 B12R1.49 COC(=O)CC1CCC(CC1)N MCULE-8428020310 [0,1,0,1,0,0|0,0,2]=4 834 B12R1.49 COC(=O)CC1CCC(CC1)O MCULE-1746530923 [0,1,0,1,0,0|0,0,2]=4 835 B12R1.49 COC(=O)CC1CCC(CC1)[NH3+] MCULE-7729535272 [0,1,0,1,0,0|0,0,2]=4 836 B12R1.49 COC(=O)CN1CCC(CC1)N MCULE-4664951817 [0,1,0,1,0,0|1,0,1]=4 837 B12R1.49 COC(=O)CN1CCC(CC1)N MCULE-5301559491 [0,1,0,1,0,0|1,0,1]=4 838 B12R1.49 COC(=O)CN1CCC(CC1)O MCULE-9885936783 [0,1,0,1,0,0|1,0,1]=4 839 B12R1.49 COC(=O)C[C@H]1CC[C@H](CC1)O MCULE-1573259386 [0,1,0,1,0,0|0,0,2]=4 840 B12R1.49 COC(=O)NC1CCC(CC1)O MCULE-6122826059 [0,1,0,1,0,0|1,0,1]=4 841 B12R1.1658 COC(=O)C1CCCC(CC1)N MCULE-4632506141 [0,1,0,1,0,0|0,0,2]=4 842 B12R1.1658 COC(=O)C1CCCC(CC1)O MCULE-1825870909 [0,1,0,1,0,0|0,0,2]=4 843 B12R1.50 COC(=O)CC1CCCC(C1)O MCULE-4558889415 [0,1,0,1,0,0|0,0,2]=4 844 B12R1.50 COC(=O)CN1CCCC(C1)N MCULE-8134233660 [0,1,0,1,0,0|1,0,1]=4 845 B12R1.50 COC(=O)CN1CCCC(C1)N MCULE-9646405498 [0,1,0,1,0,0|1,0,1]=4 846 B12R1.50 COC(=O)CN1CCCC(C1)O MCULE-8015730537 [0,1,0,1,0,0|1,0,1]=4 847 B12R1.34 COC(=O)C(=O)C1CCCCC1 MCULE-8477095327 [0,1,0,1,0,0|0,0,2]=4 848 B12R1.34 COC(=O)C(Br)C1CCCCC1 MCULE-8794632800 [0,1,0,1,0,0|0,0,2]=4 849 B12R1.34 COC(=O)C(C)C1CCCCC1 MCULE-4356051746 [0,1,0,1,0,0|0,0,2]=4 850 B12R1.34 COC(=O)C(N)C1CCCCC1 MCULE-2810535327 [0,1,0,1,0,0|0,0,2]=4 851 B12R1.34 COC(=O)C(N)C1CCCCC1 MCULE-6812914231 [0,1,0,1,0,0|0,0,2]=4 852 B12R1.34 COC(=O)C(N)C1CCCCC1 MCULE-8469855937 [0,1,0,1,0,0|0,0,2]=4 853 B12R1.34 COC(=O)C(N)C1CCCCC1 MCULE-9676736559 [0,1,0,1,0,0|0,0,2]=4 854 B12R1.34 COC(=O)[C@@H](N)C1CCCCC1 MCULE-2299100950 [0,1,0,1,0,0|0,0,2]=4 855 B12R1.34 COC(=O)[C@@H](N)C1CCCCC1 MCULE-5316529197 [0,1,0,1,0,0|0,0,2]=4 856 B12R1.34 COC(=O)[C@@H](N)C1CCCCC1 MCULE-5483569351 [0,1,0,1,0,0|0,0,2]=4 857 B12R1.34 COC(=O)[C@@H](N)C1CCCCC1 MCULE-6799341213 [0,1,0,1,0,0|0,0,2]=4 858 B12R1.34 COC(=O)[C@H](N)C1CCCCC1 MCULE-4665460517 [0,1,0,1,0,0|0,0,2]=4 859 B12R1.34 COC(=O)[C@H](N)C1CCCCC1 MCULE-4978326778 [0,1,0,1,0,0|0,0,2]=4 860 B12R1.34 COC(=O)[C@H](N)C1CCCCC1 MCULE-5161076215 [0,1,0,1,0,0|0,0,2]=4 861 B12R1.34 COC(=O)[C@H](N)C1CCCCC1 MCULE-8293184442 [0,1,0,1,0,0|0,0,2]=4 862 B12R1.108 COC(=O)C(Br)CC1CCCC1 MCULE-2551041466 [0,1,0,1,0,0|0,0,2]=4 863 B12R1.108 COC(=O)C(N)CC1CCCC1 MCULE-4151298811 [0,1,0,1,0,0|0,0,2]=4 864 B12R1.108 COC(=O)C(N)CC1CCCC1 MCULE-8301327511 [0,1,0,1,0,0|0,0,2]=4 865 B12R1.108 COC(=O)[C@@H](N)CC1CCCC1 MCULE-2992259182 [0,1,0,1,0,0|0,0,2]=4 866 B12R1.108 COC(=O)[C@@H](N)CC1CCCC1 MCULE-3418415676 [0,1,0,1,0,0|0,0,2]=4 867 B12R1.108 COC(=O)[C@@H](N)CC1CCCC1 MCULE-3537318005 [0,1,0,1,0,0|0,0,2]=4 868 B12R1.108 COC(=O)[C@@H](N)CC1CCCC1 MCULE-7301397661 [0,1,0,1,0,0|0,0,2]=4 869 B12R1.108 COC(=O)[C@H](N)CC1CCCC1 MCULE-1131423480 [0,1,0,1,0,0|0,0,2]=4 870 B12R1.108 COC(=O)[C@H](N)CC1CCCC1 MCULE-2878471737 [0,1,0,1,0,0|0,0,2]=4 871 B12R1.108 COC(=O)[C@H](N)CC1CCCC1 MCULE-3995959600 [0,1,0,1,0,0|0,0,2]=4 872 B12R1.108 COC(=O)[C@H](N)CC1CCCC1 MCULE-7301463211 [0,1,0,1,0,0|0,0,2]=4 873 B12R1.1731 COC(=O)C1(CCCCCC1)N MCULE-7301624288 [0,1,0,1,0,0|0,0,2]=4 874 B12R1.1731 COC(=O)C1(CCCCCC1)N MCULE-7887945019 [0,1,0,1,0,0|0,0,2]=4 875 B12R1.15 COC(=O)CC(=O)C1CCCC1 MCULE-6660894839 [0,1,0,1,0,0|0,0,2]=4 876 B12R1.15 COC(=O)CN(C)C1CCCC1 MCULE-6365165661 [0,1,0,1,0,0|1,0,1]=4 877 B12R1.3524 COC(=O)CC1(CCCCC1)N MCULE-2276068883 [0,1,0,1,0,0|0,0,2]=4 878 B12R1.3524 COC(=O)CC1(CCCCC1)N MCULE-3738848172 [0,1,0,1,0,0|0,0,2]=4 879 B12R1.3524 COC(=O)CC1(CCCCC1)O MCULE-5680015940 [0,1,0,1,0,0|0,0,2]=4 880 B12R2.24 O=C1CCC2CCCCC2O1 MCULE-8264574980 [0,0,0,2,0,0|0,0,2]=4 881 B12R2.24 O=C1CNC2CCCCC2O1 MCULE-1674440433 [0,0,0,2,0,0|1,0,1]=4 882 B12R2.24 O=C1CSC2CCCCC2O1 MCULE-2850415472 [0,0,0,2,0,0|1,0,1]=4 883 B12R2.1596 COC(=O)C1CC2CCC1C2 MCULE-4026654492 [0,0,0,2,0,0|0,0,2]=4 884 B12R2.1596 COC(=O)C1NC2CCC1C2 MCULE-5264898120 [0,0,0,2,0,0|1,0,1]=4 885 B12R2.1596 COC(=O)C1NC2CCC1C2 MCULE-7543272751 [0,0,0,2,0,0|1,0,1]=4 886 B12R2.1596 COC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-2102285718 [0,0,0,2,0,0|1,0,1]=4 887 B12R2.1596 COC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-2658246202 [0,0,0,2,0,0|1,0,1]=4 888 B12R2.1596 COC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-9797608392 [0,0,0,2,0,0|1,0,1]=4 889 B12R2.1596 [C@H]12CC[C@H](C1)C(N2)C(=O)OC MCULE-1993120713 [0,0,0,2,0,0|1,0,1]=4 890 B12R2.1596 [C@H]12CC[C@H](C1)C(N2)C(=O)OC MCULE-5509778867 [0,0,0,2,0,0|1,0,1]=4 891 B12R2.1596 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)OC MCULE-2860196629 [0,0,0,2,0,0|1,0,1]=4 892 B12R2.1596 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)OC MCULE-3915351384 [0,0,0,2,0,0|1,0,1]=4 893 B12R2.3511 COC(=O)C1C2C1CCCC2 MCULE-6065075859 [0,0,0,2,0,0|0,0,2]=4 894 B12R2.1541 COC(=O)C12CCCCC1N2 MCULE-6534342099 [0,0,0,2,0,0|1,0,1]=4