0 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [0,0,0,0,0,0|4,0,0]=4 1 B8R0.7 C=C(Br)CCCCCCl MCULE-8350652246 [0,0,0,0,0,0|4,0,0]=4 2 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [0,0,0,0,0,0|4,0,0]=4 3 B8R0.7 C=C(C)CCCCCCl MCULE-5646492015 [0,0,0,0,0,0|4,0,0]=4 4 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [0,0,0,0,0,0|4,0,0]=4 5 B8R0.7 C=C(Cl)CCCCCCl MCULE-3447520654 [0,0,0,0,0,0|4,0,0]=4 6 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [0,0,0,0,0,0|4,0,0]=4 7 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [0,0,0,0,0,0|3,0,0]=3 8 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [0,0,0,0,0,0|3,0,0]=3 9 B8R0.7 CC(=O)NCCCCN MCULE-6666803790 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.7 CC(=O)NCCCCN MCULE-8971714473 [0,0,0,0,0,0|2,0,0]=2 11 B8R0.7 CC(=O)NCCCCO MCULE-5119895862 [0,0,0,0,0,0|3,0,0]=3 12 B8R0.7 CC(=O)OCCCCBr MCULE-6081921662 [0,0,0,0,0,0|4,0,0]=4 13 B8R0.7 CC(=O)OCCCCCl MCULE-3999602136 [0,0,0,0,0,0|4,0,0]=4 14 B8R0.7 CC(=O)OCCCCI MCULE-6699791525 [0,0,0,0,0,0|4,0,0]=4 15 B8R0.7 CC(=O)OCCCCO MCULE-7064721476 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.7 CC(=O)SCCCCBr MCULE-1636667997 [0,0,0,0,0,0|4,0,0]=4 17 B8R0.7 CC(=O)SCCCCN MCULE-2425585672 [0,0,0,0,0,0|3,0,0]=3 18 B8R0.7 CC(=O)SCCCCN MCULE-9899884734 [0,0,0,0,0,0|3,0,0]=3 19 B8R0.7 CC(C)CCCCCN MCULE-4764798524 [0,0,0,0,0,0|3,0,1]=4 20 B8R0.7 CC(C)NCCCCO MCULE-2420054943 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.7 CC(C)OCCCCN MCULE-1961317000 [0,0,0,0,0,0|3,0,1]=4 22 B8R0.7 CC(C)SCCCCN MCULE-5756873286 [0,0,0,0,0,0|3,0,1]=4 23 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,0,0,0,0,0|4,0,0]=4 24 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [0,0,0,0,0,0|4,0,0]=4 25 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [0,0,0,0,0,0|3,0,0]=3 26 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [0,0,0,0,0,0|4,0,0]=4 27 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [0,0,0,0,0,0|4,0,0]=4 28 B8R0.7 CCCCCCC(C)N MCULE-9884342317 [0,0,0,0,0,0|3,0,1]=4 29 B8R0.7 CCCCCC[C@@H](C)N MCULE-1174114183 [0,0,0,0,0,0|3,0,1]=4 30 B8R0.7 CCCCCC[C@@H](C)N MCULE-2566479481 [0,0,0,0,0,0|3,0,1]=4 31 B8R0.7 CCCCCC[C@@H](C)N MCULE-9213725375 [0,0,0,0,0,0|3,0,1]=4 32 B8R0.7 CCCCCC[C@H](C)N MCULE-1870649953 [0,0,0,0,0,0|3,0,1]=4 33 B8R0.7 CCCCCC[C@H](C)N MCULE-1893221172 [0,0,0,0,0,0|3,0,1]=4 34 B8R0.7 CCCCCC[C@H](C)N MCULE-7722036180 [0,0,0,0,0,0|3,0,1]=4 35 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [0,0,0,0,0,0|2,0,0]=2 36 B8R0.7 CCCCCNC(C)C MCULE-7953510120 [0,0,0,0,0,0|3,0,1]=4 37 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [0,0,0,0,0,0|4,0,0]=4 38 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [0,0,0,0,0,0|4,0,0]=4 39 B8R0.7 CCCCCOC(=S)[S-] MCULE-2950713727 [0,0,0,0,0,0|4,0,0]=4 40 B8R0.7 CCCCCOC(=S)[S-] MCULE-3707330245 [0,0,0,0,0,0|4,0,0]=4 41 B8R0.7 CCCCCSC(=N)N MCULE-5906999949 [0,0,0,0,0,0|2,0,0]=2 42 B8R0.7 CCCCCSC(=N)N MCULE-7508276539 [0,0,0,0,0,0|2,0,0]=2 43 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [0,0,0,0,0,0|4,0,0]=4 44 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [0,0,0,0,0,0|4,0,0]=4 45 B8R0.7 CCCCNNC(=S)N MCULE-4424512679 [0,0,0,0,0,0|3,0,0]=3 46 B8R0.7 CCCCSCC(=N)N MCULE-5468671942 [0,0,0,0,0,0|3,0,0]=3 47 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [0,0,0,0,0,0|4,0,0]=4 48 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [0,0,0,0,0,0|4,0,0]=4 49 B8R0.7 CCOCCNC(=O)N MCULE-7568793312 [0,0,0,0,0,0|3,0,0]=3 50 B8R0.7 CCOCCSC(=N)N MCULE-2352484898 [0,0,0,0,0,0|3,0,0]=3 51 B8R0.7 CCOCCSC(=N)N MCULE-6818754585 [0,0,0,0,0,0|3,0,0]=3 52 B8R0.7 CCOCCSC(=[NH2+])N MCULE-4947783882 [0,0,0,0,0,0|3,0,1]=4 53 B8R0.7 CCSCCSC(=N)N MCULE-7457408043 [0,0,0,0,0,0|3,0,0]=3 54 B8R0.7 CCSCCSC(=N)N MCULE-8427297147 [0,0,0,0,0,0|3,0,0]=3 55 B8R0.7 CN(C)CCCCCN MCULE-4877386224 [0,0,0,0,0,0|4,0,0]=4 56 B8R0.7 CN(C)CCCCCN MCULE-8183173530 [0,0,0,0,0,0|4,0,0]=4 57 B8R0.7 CN(C)CCCCCN MCULE-8560175640 [0,0,0,0,0,0|4,0,0]=4 58 B8R0.7 CNCCCNC(=O)C MCULE-2682619502 [0,0,0,0,0,0|4,0,0]=4 59 B8R0.7 CNCCCNC(=O)C MCULE-3477977807 [0,0,0,0,0,0|4,0,0]=4 60 B8R0.7 CNCCCNC(=S)S MCULE-3322917565 [0,0,0,0,0,0|4,0,0]=4 61 B8R0.7 COCCCNC(=N)N MCULE-3770501669 [0,0,0,0,0,0|2,0,0]=2 62 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [0,0,0,0,0,0|4,0,0]=4 63 B8R0.7 COCCCNC(=O)N MCULE-4038737956 [0,0,0,0,0,0|3,0,0]=3 64 B8R0.7 COCCCNC(=S)N MCULE-6009717743 [0,0,0,0,0,0|3,0,0]=3 65 B8R0.7 N#CCCCCC(=O)N MCULE-7791035164 [0,0,0,0,0,0|2,0,2]=4 66 B8R0.7 N#CCCCSC(=N)N MCULE-1880118296 [0,0,0,0,0,0|1,0,2]=3 67 B8R0.7 N#CCCCSC(=N)N MCULE-9286739361 [0,0,0,0,0,0|1,0,2]=3 68 B8R0.7 N=C(N)NCCCCN MCULE-1546201217 [0,0,0,0,0,0|0,0,0]=0 69 B8R0.7 N=C(N)NCCCCN MCULE-8707833566 [0,0,0,0,0,0|0,0,0]=0 70 B8R0.7 N=C(N)NCCCCN MCULE-9916947559 [0,0,0,0,0,0|0,0,0]=0 71 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [0,0,0,0,0,0|3,0,0]=3 72 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [0,0,0,0,0,0|3,0,0]=3 73 B8R0.7 NC(=O)CCNCCS MCULE-4682566242 [0,0,0,0,0,0|4,0,0]=4 74 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [0,0,0,0,0,0|2,0,0]=2 75 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [0,0,0,0,0,0|2,0,0]=2 76 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [0,0,0,0,0,0|3,0,0]=3 77 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [0,0,0,0,0,0|3,0,0]=3 78 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [0,0,0,0,0,0|3,0,0]=3 79 B8R0.7 NCCCCNC(=O)N MCULE-6339634491 [0,0,0,0,0,0|1,0,0]=1 80 B8R0.7 NCCCCNC(=O)N MCULE-8210849027 [0,0,0,0,0,0|1,0,0]=1 81 B8R0.7 NCCCCNC(=[NH2+])N MCULE-1741616711 [0,0,0,0,0,0|0,0,1]=1 82 B8R0.7 NCCCCOC(F)F MCULE-2093293575 [0,0,0,0,0,0|3,0,1]=4 83 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [0,0,0,0,0,0|4,0,0]=4 84 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [0,0,0,0,0,0|4,0,0]=4 85 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [0,0,0,0,0,0|4,0,0]=4 86 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [0,0,0,0,0,0|4,0,0]=4 87 B8R0.7 NCCNCCC(=O)[O-] MCULE-8896439746 [0,0,0,0,0,0|4,0,0]=4 88 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [0,0,0,0,0,0|4,0,0]=4 89 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [0,0,0,0,0,0|4,0,0]=4 90 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [0,0,0,0,0,0|4,0,0]=4 91 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [0,0,0,0,0,0|4,0,0]=4 92 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [0,0,0,0,0,0|4,0,0]=4 93 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [0,0,0,0,0,0|4,0,0]=4 94 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [0,0,0,0,0,0|4,0,0]=4 95 B8R0.7 O=C(Cl)OCCCCCl MCULE-4992919323 [0,0,0,0,0,0|4,0,0]=4 96 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [0,0,0,0,0,0|4,0,0]=4 97 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [0,0,0,0,0,0|4,0,0]=4 98 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [0,0,0,0,0,0|4,0,0]=4 99 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [0,0,0,0,0,0|4,0,0]=4 100 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [0,0,0,0,0,0|4,0,0]=4 101 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [0,0,0,0,0,0|4,0,0]=4 102 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [0,0,0,0,0,0|4,0,0]=4 103 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [0,0,0,0,0,0|4,0,0]=4 104 B7R0.1 C#CCCCCCN MCULE-3067915237 [1,0,0,0,0,0|2,0,1]=4 105 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [1,0,0,0,0,0|3,0,0]=4 106 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [1,0,0,0,0,0|3,0,0]=4 107 B7R0.1 C=CCCCCCBr MCULE-7782876660 [1,0,0,0,0,0|3,0,0]=4 108 B7R0.1 C=CCCCCCC MCULE-6867393536 [1,0,0,0,0,0|3,0,0]=4 109 B7R0.1 C=CCCCCCCl MCULE-2205880878 [1,0,0,0,0,0|3,0,0]=4 110 B7R0.1 C=CCCCCCI MCULE-1823596954 [1,0,0,0,0,0|3,0,0]=4 111 B7R0.1 C=CCCCCCN MCULE-2913783474 [1,0,0,0,0,0|2,0,0]=3 112 B7R0.1 C=CCCCCCN MCULE-9545708862 [1,0,0,0,0,0|2,0,0]=3 113 B7R0.1 C=CCCCCCO MCULE-1200112990 [1,0,0,0,0,0|3,0,0]=4 114 B7R0.1 C=CCCCCON MCULE-1155744928 [1,0,0,0,0,0|3,0,0]=4 115 B7R0.1 C=CCCCCON MCULE-1741904620 [1,0,0,0,0,0|3,0,0]=4 116 B7R0.1 C=CCCOCCN MCULE-5958891740 [1,0,0,0,0,0|3,0,0]=4 117 B7R0.1 C=CCCSCCN MCULE-5541844264 [1,0,0,0,0,0|3,0,0]=4 118 B7R0.1 C=CCOCCCN MCULE-4862923195 [1,0,0,0,0,0|3,0,0]=4 119 B7R0.1 C=COCCCCC MCULE-4024159480 [1,0,0,0,0,0|3,0,0]=4 120 B7R0.1 C=COCCCCO MCULE-3537265926 [1,0,0,0,0,0|3,0,0]=4 121 B7R0.1 CC=CCCCCC MCULE-7111489659 [1,0,0,0,0,0|3,0,0]=4 122 B7R0.1 CC=CCCCCO MCULE-8707373340 [1,0,0,0,0,0|3,0,0]=4 123 B7R0.1 CCCCCC=CI MCULE-9964634818 [1,0,0,0,0,0|3,0,0]=4 124 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,0,0,0,0,0|3,0,0]=4 125 B7R0.1 CCCCCCCN MCULE-1126747714 [1,0,0,0,0,0|2,0,1]=4 126 B7R0.1 CCCCCCNN MCULE-5116098983 [1,0,0,0,0,0|3,0,0]=4 127 B7R0.1 CCCCCCON MCULE-1836746134 [1,0,0,0,0,0|3,0,0]=4 128 B7R0.1 CCCCCCON MCULE-9566158736 [1,0,0,0,0,0|3,0,0]=4 129 B7R0.1 CCCCCOC=O MCULE-2718009140 [1,0,0,0,0,0|3,0,0]=4 130 B7R0.1 CCNCCCCO MCULE-4851249509 [1,0,0,0,0,0|2,0,1]=4 131 B7R0.1 CCOCCCCN MCULE-6583734908 [1,0,0,0,0,0|2,0,1]=4 132 B7R0.1 CCSCCCCN MCULE-7961306984 [1,0,0,0,0,0|2,0,1]=4 133 B7R0.1 CNCCCCCN MCULE-8023367999 [1,0,0,0,0,0|3,0,0]=4 134 B7R0.1 COCCCCCN MCULE-2109050097 [1,0,0,0,0,0|3,0,0]=4 135 B7R0.1 CSCCCCCN MCULE-8771942873 [1,0,0,0,0,0|3,0,0]=4 136 B7R0.1 N#CCCCCCN MCULE-4837507252 [1,0,0,0,0,0|1,0,2]=4 137 B7R0.1 N#N=NCCCCN MCULE-6258134369 [1,0,0,0,0,0|1,0,2]=4 138 B7R0.1 N#N=NCCCCN MCULE-7187588793 [1,0,0,0,0,0|1,0,2]=4 139 B7R0.1 NCCCCCCBr MCULE-4017495581 [1,0,0,0,0,0|2,0,1]=4 140 B7R0.1 NCCCCCCBr MCULE-4048883510 [1,0,0,0,0,0|2,0,1]=4 141 B7R0.1 NCCCCCCN MCULE-1038764376 [1,0,0,0,0,0|1,0,1]=3 142 B7R0.1 NCCCCCCN MCULE-3766020930 [1,0,0,0,0,0|1,0,1]=3 143 B7R0.1 NCCCCCCN MCULE-9535729200 [1,0,0,0,0,0|1,0,1]=3 144 B7R0.1 NCCCCCCO MCULE-2264326846 [1,0,0,0,0,0|2,0,1]=4 145 B7R0.1 NCCCCCCS MCULE-3764839885 [1,0,0,0,0,0|2,0,1]=4 146 B7R0.1 NCCCCCCS MCULE-5822376723 [1,0,0,0,0,0|2,0,1]=4 147 B7R0.1 NCCCNCCN MCULE-4817006723 [1,0,0,0,0,0|2,0,1]=4 148 B7R0.1 O=CCCCCCBr MCULE-7014516847 [1,0,0,0,0,0|3,0,0]=4 149 B7R0.1 O=CCCCCCCl MCULE-8269912560 [1,0,0,0,0,0|3,0,0]=4 150 B7R0.1 O=CCCCCCF MCULE-8174281286 [1,0,0,0,0,0|3,0,0]=4 151 B7R0.1 O=CCCCCCO MCULE-3978349845 [1,0,0,0,0,0|3,0,0]=4 152 B7R0.1 O=CCCCCCO MCULE-4997016680 [1,0,0,0,0,0|3,0,0]=4 153 B7R0.4 C#CCCCC(=O)N MCULE-3927386617 [1,0,0,0,0,0|2,0,1]=4 154 B7R0.4 C#CCCNC(=O)N MCULE-3889590992 [1,0,0,0,0,0|1,0,2]=4 155 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [1,0,0,0,0,0|3,0,0]=4 156 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,0,0,0,0,0|3,0,0]=4 157 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [1,0,0,0,0,0|3,0,0]=4 158 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [1,0,0,0,0,0|3,0,0]=4 159 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [1,0,0,0,0,0|3,0,0]=4 160 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [1,0,0,0,0,0|3,0,0]=4 161 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [1,0,0,0,0,0|3,0,0]=4 162 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [1,0,0,0,0,0|3,0,0]=4 163 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [1,0,0,0,0,0|2,0,0]=3 164 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [1,0,0,0,0,0|2,0,0]=3 165 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [1,0,0,0,0,0|3,0,0]=4 166 B7R0.4 CC(=O)NCCON MCULE-3703048482 [1,0,0,0,0,0|3,0,0]=4 167 B7R0.4 CC(C)CCCCN MCULE-3591523204 [1,0,0,0,0,0|2,0,1]=4 168 B7R0.4 CC(C)NCCCN MCULE-2900400569 [1,0,0,0,0,0|2,0,1]=4 169 B7R0.4 CC(N)CCCCN MCULE-3497267062 [1,0,0,0,0,0|1,0,1]=3 170 B7R0.4 CC(N)CCCCN MCULE-9887360104 [1,0,0,0,0,0|1,0,1]=3 171 B7R0.4 CC(N)CCCCO MCULE-7039935081 [1,0,0,0,0,0|2,0,1]=4 172 B7R0.4 CC(N)CCCCO MCULE-8167834378 [1,0,0,0,0,0|2,0,1]=4 173 B7R0.4 CCC=NNC(=S)N MCULE-6637349631 [1,0,0,0,0,0|2,0,1]=4 174 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [1,0,0,0,0,0|1,0,0]=2 175 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [1,0,0,0,0,0|1,0,0]=2 176 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,0,0,0,0,0|3,0,0]=4 177 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [1,0,0,0,0,0|3,0,0]=4 178 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [1,0,0,0,0,0|2,0,0]=3 179 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,0,0,0,0,0|3,0,0]=4 180 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [1,0,0,0,0,0|3,0,0]=4 181 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [1,0,0,0,0,0|3,0,0]=4 182 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [1,0,0,0,0,0|2,0,0]=3 183 B7R0.4 CCCCCC(C)N MCULE-1307982487 [1,0,0,0,0,0|2,0,1]=4 184 B7R0.4 CCCCCC(C)N MCULE-8625441795 [1,0,0,0,0,0|2,0,1]=4 185 B7R0.4 CCCCCC(C)N MCULE-9791654909 [1,0,0,0,0,0|2,0,1]=4 186 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [1,0,0,0,0,0|2,0,1]=4 187 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [1,0,0,0,0,0|2,0,1]=4 188 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [1,0,0,0,0,0|2,0,1]=4 189 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [1,0,0,0,0,0|2,0,1]=4 190 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [1,0,0,0,0,0|2,0,1]=4 191 B7R0.4 CCCCNC(=N)N MCULE-4548909930 [1,0,0,0,0,0|0,0,0]=1 192 B7R0.4 CCCCNC(=N)N MCULE-4773969181 [1,0,0,0,0,0|0,0,0]=1 193 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [1,0,0,0,0,0|2,0,0]=3 194 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [1,0,0,0,0,0|2,0,0]=3 195 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [1,0,0,0,0,0|1,0,0]=2 196 B7R0.4 CCCCNC(=S)N MCULE-7448930772 [1,0,0,0,0,0|1,0,0]=2 197 B7R0.4 CCCCNC(C)C MCULE-2695970517 [1,0,0,0,0,0|2,0,1]=4 198 B7R0.4 CCCCNC(C)C MCULE-9973816117 [1,0,0,0,0,0|2,0,1]=4 199 B7R0.4 CCCCNN(=O)=O MCULE-2055512271 [1,0,0,0,0,0|3,0,0]=4 200 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [1,0,0,0,0,0|3,0,0]=4 201 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [1,0,0,0,0,0|3,0,0]=4 202 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [1,0,0,0,0,0|2,0,0]=3 203 B7R0.4 CCCCOC(=S)[S-] MCULE-2197583773 [1,0,0,0,0,0|3,0,0]=4 204 B7R0.4 CCCCOC(=S)[S-] MCULE-3219674247 [1,0,0,0,0,0|3,0,0]=4 205 B7R0.4 CCCCSC(=N)N MCULE-1202813594 [1,0,0,0,0,0|1,0,0]=2 206 B7R0.4 CCCCSC(=N)N MCULE-6798856505 [1,0,0,0,0,0|1,0,0]=2 207 B7R0.4 CCCCSC(=N)N MCULE-8701506154 [1,0,0,0,0,0|1,0,0]=2 208 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [1,0,0,0,0,0|3,0,0]=4 209 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [1,0,0,0,0,0|3,0,0]=4 210 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [1,0,0,0,0,0|3,0,0]=4 211 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [1,0,0,0,0,0|3,0,0]=4 212 B7R0.4 CCCOCC(=S)N MCULE-4681127635 [1,0,0,0,0,0|3,0,0]=4 213 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [1,0,0,0,0,0|3,0,0]=4 214 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [1,0,0,0,0,0|3,0,0]=4 215 B7R0.4 CCO/C=C/C(=N)N MCULE-5385104731 [1,0,0,0,0,0|2,0,1]=4 216 B7R0.4 CCO/C=C/C(=N)N MCULE-9722827005 [1,0,0,0,0,0|2,0,1]=4 217 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [1,0,0,0,0,0|2,0,0]=3 218 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [1,0,0,0,0,0|2,0,0]=3 219 B7R0.4 CCOCNC(=O)N MCULE-7680870721 [1,0,0,0,0,0|2,0,0]=3 220 B7R0.4 CN(C)CCCCN MCULE-4457571368 [1,0,0,0,0,0|3,0,0]=4 221 B7R0.4 CN(C)CCCCN MCULE-9067239115 [1,0,0,0,0,0|3,0,0]=4 222 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [1,0,0,0,0,0|3,0,0]=4 223 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [1,0,0,0,0,0|3,0,0]=4 224 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [1,0,0,0,0,0|3,0,0]=4 225 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [1,0,0,0,0,0|3,0,0]=4 226 B7R0.4 CNCCSC(=N)N MCULE-4335831899 [1,0,0,0,0,0|2,0,0]=3 227 B7R0.4 CNCCSC(=N)N MCULE-5500737932 [1,0,0,0,0,0|2,0,0]=3 228 B7R0.4 COCCCC(=S)N MCULE-5066867181 [1,0,0,0,0,0|3,0,0]=4 229 B7R0.4 COCCNC(=N)N MCULE-4122240317 [1,0,0,0,0,0|1,0,0]=2 230 B7R0.4 COCCNC(=N)N MCULE-5184785677 [1,0,0,0,0,0|1,0,0]=2 231 B7R0.4 COCCNC(=N)N MCULE-5799549903 [1,0,0,0,0,0|1,0,0]=2 232 B7R0.4 COCCNC(=O)C MCULE-2794263612 [1,0,0,0,0,0|3,0,0]=4 233 B7R0.4 COCCNC(=O)N MCULE-1380726553 [1,0,0,0,0,0|2,0,0]=3 234 B7R0.4 COCCNC(=S)N MCULE-1285240117 [1,0,0,0,0,0|2,0,0]=3 235 B7R0.4 COCCOC(=O)N MCULE-3401505850 [1,0,0,0,0,0|3,0,0]=4 236 B7R0.4 COCCSC(=N)N MCULE-2093405339 [1,0,0,0,0,0|2,0,0]=3 237 B7R0.4 COCCSC(=N)N MCULE-7836023475 [1,0,0,0,0,0|2,0,0]=3 238 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [1,0,0,0,0,0|3,0,0]=4 239 B7R0.4 CSCCNC(=O)N MCULE-7254695938 [1,0,0,0,0,0|2,0,0]=3 240 B7R0.4 CSCCNC(=S)N MCULE-1778031613 [1,0,0,0,0,0|2,0,0]=3 241 B7R0.4 N#CCCNC(=S)N MCULE-1184051700 [1,0,0,0,0,0|1,0,2]=4 242 B7R0.4 N#CCCSC(=N)N MCULE-6729718356 [1,0,0,0,0,0|1,0,2]=4 243 B7R0.4 N#CCCSC(=N)N MCULE-7887790936 [1,0,0,0,0,0|1,0,2]=4 244 B7R0.4 N=C(N)CCCCCl MCULE-4352194585 [1,0,0,0,0,0|1,0,0]=2 245 B7R0.4 N=C(N)CCCCCl MCULE-5262170460 [1,0,0,0,0,0|1,0,0]=2 246 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [1,0,0,0,0,0|2,0,0]=3 247 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [1,0,0,0,0,0|2,0,0]=3 248 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [1,0,0,0,0,0|2,0,0]=3 249 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [1,0,0,0,0,0|3,0,0]=4 250 B7R0.4 NC(=O)COCCO MCULE-3158372920 [1,0,0,0,0,0|3,0,0]=4 251 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [1,0,0,0,0,0|3,0,0]=4 252 B7R0.4 NC(=O)NCCCO MCULE-3167491311 [1,0,0,0,0,0|2,0,0]=3 253 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [1,0,0,0,0,0|1,0,0]=2 254 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [1,0,0,0,0,0|1,0,0]=2 255 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,0,0,0,0,0|2,0,0]=3 256 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,0,0,0,0,0|2,0,0]=3 257 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,0,0,0,0,0|2,0,0]=3 258 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,0,0,0,0,0|2,0,0]=3 259 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [1,0,0,0,0,0|1,0,0]=2 260 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [1,0,0,0,0,0|1,0,0]=2 261 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [1,0,0,0,0,0|3,0,0]=4 262 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [1,0,0,0,0,0|3,0,0]=4 263 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [1,0,0,0,0,0|3,0,0]=4 264 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [1,0,0,0,0,0|3,0,0]=4 265 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [1,0,0,0,0,0|3,0,0]=4 266 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [1,0,0,0,0,0|3,0,0]=4 267 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [1,0,0,0,0,0|3,0,0]=4 268 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [1,0,0,0,0,0|3,0,0]=4 269 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [1,0,0,0,0,0|3,0,0]=4 270 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [1,0,0,0,0,0|3,0,0]=4 271 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [1,0,0,0,0,0|3,0,0]=4 272 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,0,0,0,0,0|3,0,0]=4 273 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,0,0,0,0,0|3,0,0]=4 274 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,0,0,0,0,0|3,0,0]=4 275 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,0,0,0,0,0|3,0,0]=4 276 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [1,0,0,0,0,0|3,0,0]=4 277 B9R0.1 CCS(=O)CCSC(=N)N MCULE-6531935455 [0,1,0,0,0,0|3,0,0]=4 278 B9R0.1 CCS(=O)CCSC(=N)N MCULE-8158175247 [0,1,0,0,0,0|3,0,0]=4 279 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [0,1,0,0,0,0|3,0,0]=4 280 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [0,1,0,0,0,0|3,0,0]=4 281 B9R0.2 CC(=O)NCCCCCCl MCULE-9253955715 [0,1,0,0,0,0|3,0,0]=4 282 B9R0.2 CC(=O)NCCCCCN MCULE-6340089295 [0,1,0,0,0,0|2,0,0]=3 283 B9R0.2 CC(=O)NCCCCCN MCULE-9533682248 [0,1,0,0,0,0|2,0,0]=3 284 B9R0.2 CC(=O)NCCOCCBr MCULE-2348291899 [0,1,0,0,0,0|3,0,0]=4 285 B9R0.2 CC(=O)NCCOCCO MCULE-4601425982 [0,1,0,0,0,0|3,0,0]=4 286 B9R0.2 CC(C)NCCCCCN MCULE-1109263155 [0,1,0,0,0,0|2,0,1]=4 287 B9R0.2 CC(C)NCCNCCN MCULE-1846427510 [0,1,0,0,0,0|2,0,1]=4 288 B9R0.2 CC(C)NCCOCCN MCULE-8379305503 [0,1,0,0,0,0|2,0,1]=4 289 B9R0.2 CCCCCCCC(=N)N MCULE-8703701987 [0,1,0,0,0,0|2,0,0]=3 290 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [0,1,0,0,0,0|3,0,0]=4 291 B9R0.2 CCCCCCNC(=O)N MCULE-4236638652 [0,1,0,0,0,0|2,0,0]=3 292 B9R0.2 CCCCCCNC(=S)N MCULE-1507775926 [0,1,0,0,0,0|2,0,0]=3 293 B9R0.2 CCCCCCOC(=O)N MCULE-3909923308 [0,1,0,0,0,0|3,0,0]=4 294 B9R0.2 CCCCCCSC(=N)N MCULE-5637553864 [0,1,0,0,0,0|2,0,0]=3 295 B9R0.2 CCCCCCSC(=N)N MCULE-7474503542 [0,1,0,0,0,0|2,0,0]=3 296 B9R0.2 CCCCCCSC(=[NH2+])N MCULE-5793664409 [0,1,0,0,0,0|2,0,1]=4 297 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [0,1,0,0,0,0|2,0,0]=3 298 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [0,1,0,0,0,0|2,0,0]=3 299 B9R0.2 CCOCCCNC(=S)N MCULE-6254590619 [0,1,0,0,0,0|2,0,0]=3 300 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [0,1,0,0,0,0|3,0,0]=4 301 B9R0.2 NC(=O)CCCCCCO MCULE-7432797193 [0,1,0,0,0,0|3,0,0]=4 302 B9R0.2 NC(=O)CCNCCCO MCULE-1089880795 [0,1,0,0,0,0|3,0,0]=4 303 B9R0.2 NC(=O)CCNCCCO MCULE-8808474432 [0,1,0,0,0,0|3,0,0]=4 304 B9R0.2 NC(=O)NCCOCCO MCULE-5514708038 [0,1,0,0,0,0|2,0,0]=3 305 B9R0.2 NCCCCCCC(=O)N MCULE-9587339996 [0,1,0,0,0,0|2,0,0]=3 306 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [0,1,0,0,0,0|3,0,0]=4 307 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [0,1,0,0,0,0|3,0,0]=4 308 B9R0.2 NOCCCCCC(=O)O MCULE-3221083368 [0,1,0,0,0,0|3,0,0]=4 309 B9R0.2 NOCCCCCC(=O)O MCULE-6721085396 [0,1,0,0,0,0|3,0,0]=4 310 B9R0.2 NOCCCCCC(=O)O MCULE-7170875932 [0,1,0,0,0,0|3,0,0]=4 311 B9R0.2 O=C(O)CNCCCCO MCULE-6377863888 [0,1,0,0,0,0|3,0,0]=4 312 B9R0.2 [NH2+]=C(N)SCCCCCC MCULE-3527944138 [0,1,0,0,0,0|2,0,1]=4 313 B9R0.4 CCCNC(=N)NC(=N)N MCULE-3513981853 [0,1,0,0,0,0|2,0,1]=4 314 B9R0.4 CCCNC(=N)NC(=N)N MCULE-9602259164 [0,1,0,0,0,0|2,0,1]=4 315 B9R0.4 NC(=O)NC(=O)CCCCl MCULE-9550011428 [0,1,0,0,0,0|2,0,1]=4 316 B9R0.4 NCCCC(N)CC(=O)O MCULE-3705980324 [0,1,0,0,0,0|3,0,0]=4 317 B9R0.4 NCCCC(N)CC(=O)O MCULE-5566899547 [0,1,0,0,0,0|3,0,0]=4 318 B9R0.4 NCCC[C@@H](N)CC(=O)O MCULE-3425525065 [0,1,0,0,0,0|3,0,0]=4 319 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-2321041121 [0,1,0,0,0,0|3,0,0]=4 320 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-6552199637 [0,1,0,0,0,0|3,0,0]=4 321 B9R0.38 NCCCCCC(N)(N)N MCULE-1706774109 [0,1,0,0,0,0|1,0,2]=4 322 B9R0.46 C=CC(=O)NCCCCO MCULE-8904662179 [0,1,0,0,0,0|3,0,0]=4 323 B9R0.46 CCCCCCC(=O)NN MCULE-6491418749 [0,1,0,0,0,0|3,0,0]=4 324 B9R0.46 CCCCCCC(=O)NO MCULE-7308576516 [0,1,0,0,0,0|3,0,0]=4 325 B9R0.46 CCCCCNC(=O)CCl MCULE-8028345115 [0,1,0,0,0,0|3,0,0]=4 326 B9R0.46 CCCCCNC(=S)NN MCULE-4797307496 [0,1,0,0,0,0|2,0,0]=3 327 B9R0.46 CCCCCOC(=O)CN MCULE-1223174561 [0,1,0,0,0,0|3,0,0]=4 328 B9R0.46 COC(=O)CCCCCN MCULE-9013585398 [0,1,0,0,0,0|3,0,0]=4 329 B9R0.46 COC(=O)CCCCCN MCULE-9184696999 [0,1,0,0,0,0|3,0,0]=4 330 B9R0.46 COCCCNC(=O)CN MCULE-7060884264 [0,1,0,0,0,0|3,0,0]=4 331 B9R0.46 COCCCNC(=O)CN MCULE-9864887903 [0,1,0,0,0,0|3,0,0]=4 332 B9R0.46 COCCCNC(=O)NN MCULE-3220013672 [0,1,0,0,0,0|3,0,0]=4 333 B9R0.46 COCCCNC(=S)NN MCULE-8891394445 [0,1,0,0,0,0|3,0,0]=4 334 B9R0.46 CSCCCNC(=S)NN MCULE-3205624186 [0,1,0,0,0,0|3,0,0]=4 335 B9R0.46 CSCCCNC(=S)NN MCULE-9365401873 [0,1,0,0,0,0|3,0,0]=4 336 B9R0.46 NCCCCNC(=O)CCl MCULE-3702390388 [0,1,0,0,0,0|2,0,0]=3 337 B9R0.46 NCCCCNC(=O)CCl MCULE-8135973380 [0,1,0,0,0,0|2,0,0]=3 338 B9R0.46 NNC(=O)CCCCCO MCULE-7442906607 [0,1,0,0,0,0|3,0,0]=4 339 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [0,1,0,0,0,0|3,0,0]=4 340 B9R0.47 CC(C)N(C)CCCCN MCULE-3227717777 [0,1,0,0,0,0|2,0,1]=4 341 B9R0.47 NCCCCC(N)C(=O)N MCULE-5695768231 [0,1,0,0,0,0|2,0,0]=3 342 B9R0.47 NCCCCC(N)C(=O)N MCULE-8502146041 [0,1,0,0,0,0|2,0,0]=3 343 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [0,1,0,0,0,0|3,0,0]=4 344 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [0,1,0,0,0,0|3,0,0]=4 345 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [0,1,0,0,0,0|3,0,0]=4 346 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [0,1,0,0,0,0|3,0,0]=4 347 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [0,1,0,0,0,0|3,0,0]=4 348 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [0,1,0,0,0,0|3,0,0]=4 349 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [0,1,0,0,0,0|3,0,0]=4 350 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [0,1,0,0,0,0|3,0,0]=4 351 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [0,1,0,0,0,0|3,0,0]=4 352 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-2490465776 [0,1,0,0,0,0|2,0,0]=3 353 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-5523101334 [0,1,0,0,0,0|2,0,0]=3 354 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-7682920289 [0,1,0,0,0,0|2,0,0]=3 355 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-9381942600 [0,1,0,0,0,0|2,0,0]=3 356 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [0,1,0,0,0,0|3,0,0]=4 357 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [0,1,0,0,0,0|3,0,0]=4 358 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [0,1,0,0,0,0|3,0,0]=4 359 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [0,1,0,0,0,0|3,0,0]=4 360 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [0,1,0,0,0,0|3,0,0]=4 361 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [0,1,0,0,0,0|3,0,0]=4 362 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [0,1,0,0,0,0|3,0,0]=4 363 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [0,1,0,0,0,0|3,0,0]=4 364 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [0,1,0,0,0,0|3,0,0]=4 365 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [0,1,0,0,0,0|3,0,0]=4 366 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [0,1,0,0,0,0|3,0,0]=4 367 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [0,1,0,0,0,0|3,0,0]=4 368 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [0,1,0,0,0,0|3,0,0]=4 369 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [0,1,0,0,0,0|3,0,0]=4 370 B9R0.55 CC(C)CCCCC(=O)N MCULE-5796308812 [0,1,0,0,0,0|3,0,0]=4 371 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [0,1,0,0,0,0|3,0,0]=4 372 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [0,1,0,0,0,0|3,0,0]=4 373 B9R0.55 CC(N)CCCCC(C)N MCULE-6403395102 [0,1,0,0,0,0|2,0,1]=4 374 B9R0.55 CN(C)CCCNC(=N)N MCULE-2379216044 [0,1,0,0,0,0|2,0,0]=3 375 B9R0.55 CN(C)CCCNC(=O)N MCULE-7609255843 [0,1,0,0,0,0|3,0,0]=4 376 B9R0.55 CN(C)CCCNC(=O)N MCULE-8074263689 [0,1,0,0,0,0|3,0,0]=4 377 B9R0.55 CN(C)CCCNC(=S)N MCULE-5669456802 [0,1,0,0,0,0|3,0,0]=4 378 B9R0.55 CN(C)CCCSC(=N)N MCULE-2433505845 [0,1,0,0,0,0|3,0,0]=4 379 B9R0.55 CN(C)CCCSC(=N)N MCULE-9946927340 [0,1,0,0,0,0|3,0,0]=4 380 B9R0.55 N=C(N)NCCCC(=O)O MCULE-6633038701 [0,1,0,0,0,0|1,0,1]=3 381 B9R0.55 N=C(N)NCCOS(=O)=O MCULE-6628403362 [0,1,0,0,0,0|3,0,0]=4 382 B9R0.55 N=C(N)NCCSC(=N)N MCULE-5987043830 [0,1,0,0,0,0|1,0,1]=3 383 B9R0.55 N=C(N)NCCSC(=N)N MCULE-7364549685 [0,1,0,0,0,0|1,0,1]=3 384 B9R0.55 N=C(N)SCCSC(=N)N MCULE-3606525631 [0,1,0,0,0,0|2,0,1]=4 385 B9R0.55 N=C(N)SCCSC(=N)N MCULE-4743449987 [0,1,0,0,0,0|2,0,1]=4 386 B9R0.55 N=C(N)SCCSC(=N)N MCULE-6143797504 [0,1,0,0,0,0|2,0,1]=4 387 B9R0.55 NC(=O)CCCCC(=O)N MCULE-7701704987 [0,1,0,0,0,0|2,0,1]=4 388 B9R0.55 NC(=O)CCCN=C(N)N MCULE-3216497199 [0,1,0,0,0,0|0,0,3]=4 389 B9R0.55 NC(=O)CCCN=C(N)N MCULE-6570668893 [0,1,0,0,0,0|0,0,3]=4 390 B9R0.55 NC(=O)NCCCC(=O)O MCULE-4986363363 [0,1,0,0,0,0|2,0,1]=4 391 B9R0.55 NC(=S)NCCNC(=S)N MCULE-3186489920 [0,1,0,0,0,0|2,0,1]=4 392 B9R1.2 CCC1CCCC(=O)N1 MCULE-7034650517 [0,0,0,1,0,0|3,0,0]=4 393 B9R1.2 CCC1CCNC(=O)C1 MCULE-7827721769 [0,0,0,1,0,0|3,0,0]=4 394 B9R1.2 N#CC1CCNC(=S)N1 MCULE-6149808768 [0,0,0,1,0,0|1,0,2]=4 395 B9R1.2 NCC1CCCC(=O)N1 MCULE-2515108436 [0,0,0,1,0,0|2,0,0]=3 396 B9R1.2 NCC1CCCC(=O)N1 MCULE-2893640240 [0,0,0,1,0,0|2,0,0]=3 397 B9R1.2 NCC1CCCC(=O)N1 MCULE-4568961930 [0,0,0,1,0,0|2,0,0]=3 398 B9R1.2 NCC1CCCC(C1)N MCULE-9853807311 [0,0,0,1,0,0|2,0,1]=4 399 B9R1.2 NCC1CCNC(=O)C1 MCULE-8340928139 [0,0,0,1,0,0|2,0,0]=3 400 B9R1.2 NCC1CCNC(=O)C1 MCULE-9503049309 [0,0,0,1,0,0|2,0,0]=3 401 B9R1.2 NCC1CCNC(=O)N1 MCULE-7299072097 [0,0,0,1,0,0|1,0,0]=2 402 B9R1.2 NCC1CCNC(=O)O1 MCULE-4253031438 [0,0,0,1,0,0|2,0,0]=3 403 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-6439919372 [0,0,0,1,0,0|2,0,0]=3 404 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-8074777058 [0,0,0,1,0,0|2,0,0]=3 405 B9R1.2 O=C1CC(CCN1)CBr MCULE-5514747029 [0,0,0,1,0,0|3,0,0]=4 406 B9R1.2 O=C1CC(CCN1)CO MCULE-9526076179 [0,0,0,1,0,0|3,0,0]=4 407 B9R1.2 O=C1CCCC(N1)CO MCULE-6546170250 [0,0,0,1,0,0|3,0,0]=4 408 B9R1.2 O=C1CCC[C@@H](N1)CO MCULE-6845836782 [0,0,0,1,0,0|3,0,0]=4 409 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-2745722091 [0,0,0,1,0,0|3,0,0]=4 410 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-3358051383 [0,0,0,1,0,0|3,0,0]=4 411 B9R1.2 O=C1C[C@H](CCN1)CO MCULE-5682710079 [0,0,0,1,0,0|3,0,0]=4 412 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [0,0,0,1,0,0|3,0,0]=4 413 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [0,0,0,1,0,0|3,0,0]=4 414 B9R1.6 CC(=O)N1CCCCC1 MCULE-2376049669 [0,0,0,1,0,0|3,0,0]=4 415 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [0,0,0,1,0,0|3,0,0]=4 416 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [0,0,0,1,0,0|3,0,0]=4 417 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [0,0,0,1,0,0|3,0,0]=4 418 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [0,0,0,1,0,0|3,0,0]=4 419 B9R1.6 CC(N)C1CCCCN1 MCULE-2177574791 [0,0,0,1,0,0|2,0,1]=4 420 B9R1.6 N=C(N)C1CCCCC1 MCULE-3107787417 [0,0,0,1,0,0|2,0,0]=3 421 B9R1.6 N=C(N)C1CCCCC1 MCULE-9030561972 [0,0,0,1,0,0|2,0,0]=3 422 B9R1.6 N=C(N)C1CCCCN1 MCULE-3219883116 [0,0,0,1,0,0|1,0,0]=2 423 B9R1.6 N=C(N)C1CCCCN1 MCULE-8067475683 [0,0,0,1,0,0|1,0,0]=2 424 B9R1.6 N=C(N)C1CCCNC1 MCULE-1952956995 [0,0,0,1,0,0|3,0,0]=4 425 B9R1.6 N=C(N)C1CCCNC1 MCULE-5965162460 [0,0,0,1,0,0|3,0,0]=4 426 B9R1.6 N=C(N)C1CCNCC1 MCULE-5469691156 [0,0,0,1,0,0|3,0,0]=4 427 B9R1.6 N=C(N)C1CCNCC1 MCULE-5841148719 [0,0,0,1,0,0|3,0,0]=4 428 B9R1.6 N=C(N)C1CCOCC1 MCULE-5311101584 [0,0,0,1,0,0|3,0,0]=4 429 B9R1.6 N=C(N)C1CCOCC1 MCULE-9918917702 [0,0,0,1,0,0|3,0,0]=4 430 B9R1.6 N=C(N)N1CCCCC1 MCULE-1949406939 [0,0,0,1,0,0|1,0,0]=2 431 B9R1.6 N=C(N)N1CCCCC1 MCULE-4074763290 [0,0,0,1,0,0|1,0,0]=2 432 B9R1.6 N=C(N)N1CCCCC1 MCULE-4391511847 [0,0,0,1,0,0|1,0,0]=2 433 B9R1.6 N=C(N)N1CCCCC1 MCULE-6020071553 [0,0,0,1,0,0|1,0,0]=2 434 B9R1.6 N=C(N)N1CCCCC1 MCULE-6436130948 [0,0,0,1,0,0|1,0,0]=2 435 B9R1.6 N=C(N)N1CCCCC1 MCULE-7924235577 [0,0,0,1,0,0|1,0,0]=2 436 B9R1.6 N=C(N)N1CCNCC1 MCULE-1061785770 [0,0,0,1,0,0|2,0,0]=3 437 B9R1.6 N=C(N)N1CCNCC1 MCULE-7545173576 [0,0,0,1,0,0|2,0,0]=3 438 B9R1.6 N=C(N)N1CCNCC1 MCULE-8331323401 [0,0,0,1,0,0|2,0,0]=3 439 B9R1.6 N=C(N)N1CCNCC1 MCULE-8556219303 [0,0,0,1,0,0|2,0,0]=3 440 B9R1.6 N=C(N)N1CCOCC1 MCULE-1375941942 [0,0,0,1,0,0|2,0,0]=3 441 B9R1.6 N=C(N)N1CCOCC1 MCULE-2091955958 [0,0,0,1,0,0|2,0,0]=3 442 B9R1.6 N=C(N)N1CCOCC1 MCULE-2780294354 [0,0,0,1,0,0|2,0,0]=3 443 B9R1.6 N=C(N)N1CCOCC1 MCULE-2904401269 [0,0,0,1,0,0|2,0,0]=3 444 B9R1.6 N=C(N)N1CCOCC1 MCULE-7640540249 [0,0,0,1,0,0|2,0,0]=3 445 B9R1.6 N=C(N)N1CCOCC1 MCULE-8547826146 [0,0,0,1,0,0|2,0,0]=3 446 B9R1.6 N=C(N)N1CCOCC1 MCULE-9805787549 [0,0,0,1,0,0|2,0,0]=3 447 B9R1.6 N=C(N)N1CCSCC1 MCULE-1035907164 [0,0,0,1,0,0|2,0,0]=3 448 B9R1.6 N=C(N)N1CCSCC1 MCULE-9230892148 [0,0,0,1,0,0|2,0,0]=3 449 B9R1.6 N=C(N)N1CCSCC1 MCULE-9378394572 [0,0,0,1,0,0|2,0,0]=3 450 B9R1.6 NC(=O)C1CCCCC1 MCULE-8611311863 [0,0,0,1,0,0|3,0,0]=4 451 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [0,0,0,1,0,0|2,0,0]=3 452 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [0,0,0,1,0,0|2,0,0]=3 453 B9R1.6 NC(=O)C1CNCCN1 MCULE-6032361805 [0,0,0,1,0,0|3,0,0]=4 454 B9R1.6 NC(=O)C1CNCCN1 MCULE-7459621704 [0,0,0,1,0,0|3,0,0]=4 455 B9R1.6 NC(=O)C1COCCN1 MCULE-3997305592 [0,0,0,1,0,0|3,0,0]=4 456 B9R1.6 NC(=O)C1COCCN1 MCULE-8679226087 [0,0,0,1,0,0|3,0,0]=4 457 B9R1.6 NC(=O)C1CSCCN1 MCULE-5519659168 [0,0,0,1,0,0|3,0,0]=4 458 B9R1.6 NC(=O)N1CCCCC1 MCULE-9935688246 [0,0,0,1,0,0|2,0,0]=3 459 B9R1.6 NC(=O)N1CCNCC1 MCULE-2703076090 [0,0,0,1,0,0|3,0,0]=4 460 B9R1.6 NC(=O)N1CCNCC1 MCULE-9778565861 [0,0,0,1,0,0|3,0,0]=4 461 B9R1.6 NC(=O)N1CCOCC1 MCULE-2181195591 [0,0,0,1,0,0|3,0,0]=4 462 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3203472135 [0,0,0,1,0,0|3,0,0]=4 463 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3866777440 [0,0,0,1,0,0|3,0,0]=4 464 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-6105431602 [0,0,0,1,0,0|3,0,0]=4 465 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-7727900968 [0,0,0,1,0,0|3,0,0]=4 466 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [0,0,0,1,0,0|2,0,0]=3 467 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-1527418805 [0,0,0,1,0,0|3,0,0]=4 468 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-6529490056 [0,0,0,1,0,0|3,0,0]=4 469 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-9894216692 [0,0,0,1,0,0|3,0,0]=4 470 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-1904729907 [0,0,0,1,0,0|3,0,0]=4 471 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7069433109 [0,0,0,1,0,0|3,0,0]=4 472 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7970834070 [0,0,0,1,0,0|3,0,0]=4 473 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-9117686776 [0,0,0,1,0,0|3,0,0]=4 474 B9R1.6 NC(=S)C1CCCCC1 MCULE-8109334870 [0,0,0,1,0,0|3,0,0]=4 475 B9R1.6 NC(=S)N1CCCCC1 MCULE-1564707293 [0,0,0,1,0,0|2,0,0]=3 476 B9R1.6 NC(=S)N1CCNCC1 MCULE-5753295153 [0,0,0,1,0,0|3,0,0]=4 477 B9R1.6 NC(=S)N1CCOCC1 MCULE-9473931640 [0,0,0,1,0,0|3,0,0]=4 478 B9R1.6 NC(=S)N1CCSCC1 MCULE-9993053346 [0,0,0,1,0,0|3,0,0]=4 479 B9R1.6 O=C(Cl)N1CCCCC1 MCULE-8197895576 [0,0,0,1,0,0|3,0,0]=4 480 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,0,0,1,0,0|3,0,0]=4 481 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,0,0,1,0,0|3,0,0]=4 482 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,0,0,1,0,0|3,0,0]=4 483 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,0,0,1,0,0|3,0,0]=4 484 B9R1.6 O=C(O)N1CCCCC1 MCULE-2727154893 [0,0,0,1,0,0|3,0,0]=4 485 B9R1.6 O=C(O)N1CCCCC1 MCULE-4559010344 [0,0,0,1,0,0|3,0,0]=4 486 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,0,0,1,0,0|3,0,0]=4 487 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,0,0,1,0,0|3,0,0]=4 488 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,0,0,1,0,0|3,0,0]=4 489 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,0,0,1,0,0|3,0,0]=4 490 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,0,0,1,0,0|3,0,0]=4 491 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,0,0,1,0,0|3,0,0]=4 492 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,0,0,1,0,0|3,0,0]=4 493 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,0,0,1,0,0|3,0,0]=4 494 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [0,0,0,1,0,0|3,0,0]=4 495 B9R1.6 S=C(S)N1CCCCC1 MCULE-3707818588 [0,0,0,1,0,0|3,0,0]=4 496 B9R1.6 S=C(S)N1CCCCC1 MCULE-9173625423 [0,0,0,1,0,0|3,0,0]=4 497 B9R1.6 [NH2+]=C(N)N1CCCCC1 MCULE-2030047624 [0,0,0,1,0,0|1,0,1]=3 498 B9R1.7 CC1=NC(=CN1)CCN MCULE-4286245183 [0,0,0,1,0,0|1,0,2]=4 499 B9R1.7 CC1=NC(=CN1)CCN MCULE-8688066841 [0,0,0,1,0,0|1,0,2]=4 500 B9R1.7 CC1=NC(=NN1)CCN MCULE-2818397910 [0,0,0,1,0,0|2,0,1]=4 501 B9R1.7 CC1=NC(=NN1)CCN MCULE-4520286651 [0,0,0,1,0,0|2,0,1]=4 502 B9R1.7 CC1=NC(=NN1)CCN MCULE-5547968277 [0,0,0,1,0,0|2,0,1]=4 503 B9R1.7 CCCC1=NNC(=N1)N MCULE-9063928893 [0,0,0,1,0,0|2,0,1]=4 504 B9R1.7 CCCC1CNC(=O)C1 MCULE-4931707298 [0,0,0,1,0,0|3,0,0]=4 505 B9R1.7 CCCC1CSC(=N1)C MCULE-8321565598 [0,0,0,1,0,0|3,0,0]=4 506 B9R1.7 NCCC1=CSC(=N1)N MCULE-1069176633 [0,0,0,1,0,0|1,0,2]=4 507 B9R1.7 NCCC1=CSC(=N1)N MCULE-5704615813 [0,0,0,1,0,0|1,0,2]=4 508 B9R1.7 NCCC1=CSC(=N1)N MCULE-9083458244 [0,0,0,1,0,0|1,0,2]=4 509 B9R1.7 NCCC1=NC(=NN1)N MCULE-8225046144 [0,0,0,1,0,0|1,0,2]=4 510 B9R1.7 NCCC1=NC(=NO1)N MCULE-3189340510 [0,0,0,1,0,0|1,0,2]=4 511 B9R1.7 NCCC1=NC(=NO1)N MCULE-5979625623 [0,0,0,1,0,0|1,0,2]=4 512 B9R1.7 NCCC1=NC(=O)NN1 MCULE-4058649069 [0,0,0,1,0,0|2,0,1]=4 513 B9R1.7 NCCC1=NC(=O)NN1 MCULE-7357049395 [0,0,0,1,0,0|2,0,1]=4 514 B9R1.7 NCCC1=NNC(=N1)N MCULE-4164964731 [0,0,0,1,0,0|1,0,1]=3 515 B9R1.7 NCCC1=NNC(=S)N1 MCULE-3254882561 [0,0,0,1,0,0|2,0,1]=4 516 B9R1.7 NCCC1CCC(=O)N1 MCULE-5980289637 [0,0,0,1,0,0|2,0,0]=3 517 B9R1.7 NCCC1CNC(=O)C1 MCULE-8054842830 [0,0,0,1,0,0|2,0,0]=3 518 B9R1.7 NCCC1CNC(=O)C1 MCULE-8879419553 [0,0,0,1,0,0|2,0,0]=3 519 B9R1.7 NCC[C@@H]1CCC(=O)N1 MCULE-8053535061 [0,0,0,1,0,0|2,0,0]=3 520 B9R1.7 O=C1CC(CN1)CCO MCULE-6468116083 [0,0,0,1,0,0|3,0,0]=4 521 B9R1.7 O=C1CCC(N1)CCO MCULE-8691061986 [0,0,0,1,0,0|3,0,0]=4 522 B9R1.7 O=C1CC[C@H](N1)CCO MCULE-7396523836 [0,0,0,1,0,0|3,0,0]=4 523 B9R1.7 O=C1CC[C@H](N1)CCO MCULE-8307506069 [0,0,0,1,0,0|3,0,0]=4 524 B9R1.13 C1(CCCN1)CC(=O)O MCULE-3743402418 [0,0,0,1,0,0|3,0,0]=4 525 B9R1.13 C1(CCCN1)CC(=O)O MCULE-9966702869 [0,0,0,1,0,0|3,0,0]=4 526 B9R1.13 CC(=O)NC1CCCC1 MCULE-5984597819 [0,0,0,1,0,0|3,0,0]=4 527 B9R1.13 N=C(N)CN1CCCC1 MCULE-4701046871 [0,0,0,1,0,0|3,0,0]=4 528 B9R1.13 N=C(N)CN1CCCC1 MCULE-6983675892 [0,0,0,1,0,0|3,0,0]=4 529 B9R1.13 N=C(N)NC1CCCC1 MCULE-2712949871 [0,0,0,1,0,0|1,0,0]=2 530 B9R1.13 N=C(N)NC1CCCC1 MCULE-8069558442 [0,0,0,1,0,0|1,0,0]=2 531 B9R1.13 NC(=NC1CCCC1)N MCULE-1167874672 [0,0,0,1,0,0|1,0,2]=4 532 B9R1.13 NC(=NC1CCCC1)N MCULE-9434603443 [0,0,0,1,0,0|1,0,2]=4 533 B9R1.13 NC(=O)/N=C\1/CCCN1 MCULE-4992899283 [0,0,0,1,0,0|1,0,2]=4 534 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [0,0,0,1,0,0|3,0,0]=4 535 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [0,0,0,1,0,0|2,0,0]=3 536 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [0,0,0,1,0,0|2,0,0]=3 537 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [0,0,0,1,0,0|2,0,0]=3 538 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [0,0,0,1,0,0|2,0,0]=3 539 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [0,0,0,1,0,0|2,0,0]=3 540 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [0,0,0,1,0,0|2,0,0]=3 541 B9R1.13 NC(=O)NC1CCCC1 MCULE-9715014489 [0,0,0,1,0,0|2,0,0]=3 542 B9R1.13 NC(=O)NC1NCCN1 MCULE-5746168335 [0,0,0,1,0,0|2,0,0]=3 543 B9R1.13 NC(=O)OC1CCCC1 MCULE-7706681395 [0,0,0,1,0,0|3,0,0]=4 544 B9R1.13 NC(=S)CC1CCCC1 MCULE-6979331241 [0,0,0,1,0,0|3,0,0]=4 545 B9R1.13 NC(=S)CC1CCCO1 MCULE-7256451681 [0,0,0,1,0,0|3,0,0]=4 546 B9R1.13 NC(=S)NC1CCCC1 MCULE-6223276405 [0,0,0,1,0,0|2,0,0]=3 547 B9R1.13 O=C(O)CC1CCCN1 MCULE-6784535537 [0,0,0,1,0,0|3,0,0]=4 548 B9R1.13 O=C(O)CC1CCCN1 MCULE-8302150253 [0,0,0,1,0,0|3,0,0]=4 549 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-3034711788 [0,0,0,1,0,0|3,0,0]=4 550 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-8632270998 [0,0,0,1,0,0|3,0,0]=4 551 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-9053746158 [0,0,0,1,0,0|3,0,0]=4 552 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-1934097379 [0,0,0,1,0,0|3,0,0]=4 553 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-3129569449 [0,0,0,1,0,0|3,0,0]=4 554 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-8499782890 [0,0,0,1,0,0|3,0,0]=4 555 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-9712071738 [0,0,0,1,0,0|3,0,0]=4 556 B9R1.13 [C@H]1(CCCN1)CC(=O)O MCULE-6368276149 [0,0,0,1,0,0|3,0,0]=4 557 B9R1.41 N=C(N)N1CCCC1=O MCULE-2949809967 [0,0,0,1,0,0|1,0,1]=3 558 B9R1.41 N=C(N)N1CCCC1=O MCULE-3208253060 [0,0,0,1,0,0|1,0,1]=3 559 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [0,0,0,1,0,0|2,0,0]=3 560 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [0,0,0,1,0,0|2,0,0]=3 561 B9R1.41 NC(=O)N1CCCC1=O MCULE-5194166141 [0,0,0,1,0,0|2,0,1]=4 562 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [0,0,0,1,0,0|2,0,0]=3 563 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [0,0,0,1,0,0|2,0,0]=3 564 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [0,0,0,1,0,0|2,0,0]=3 565 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [0,0,0,1,0,0|2,0,0]=3 566 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [0,0,0,1,0,0|3,0,0]=4 567 B9R1.41 NC(=S)C1=C(CCC1)N MCULE-5950100327 [0,0,0,1,0,0|2,0,1]=4 568 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,0,0,1,0,0|3,0,0]=4 569 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,0,0,1,0,0|3,0,0]=4 570 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,0,0,1,0,0|3,0,0]=4 571 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,0,0,1,0,0|3,0,0]=4 572 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,0,0,1,0,0|3,0,0]=4 573 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,0,0,1,0,0|3,0,0]=4 574 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,0,0,1,0,0|3,0,0]=4 575 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,0,0,1,0,0|3,0,0]=4 576 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,0,0,1,0,0|3,0,0]=4 577 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,0,0,1,0,0|3,0,0]=4 578 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,0,0,1,0,0|3,0,0]=4 579 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,0,0,1,0,0|3,0,0]=4 580 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,0,0,1,0,0|3,0,0]=4 581 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,0,0,1,0,0|3,0,0]=4 582 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,0,0,1,0,0|3,0,0]=4 583 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,0,0,1,0,0|3,0,0]=4 584 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,0,0,1,0,0|3,0,0]=4 585 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,0,0,1,0,0|3,0,0]=4 586 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,0,0,1,0,0|3,0,0]=4 587 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,0,0,1,0,0|3,0,0]=4 588 B9R1.48 CC1CCCCC(=O)N1 MCULE-8985894348 [0,0,0,1,0,0|3,0,0]=4 589 B9R1.48 NC1CCCNC(=O)C1 MCULE-3170887073 [0,0,0,1,0,0|2,0,0]=3 590 B9R1.48 O=C1CC(CCCN1)O MCULE-6648954515 [0,0,0,1,0,0|3,0,0]=4 591 B9R1.48 O=C1CCCCC(N1)O MCULE-6756895418 [0,0,0,1,0,0|3,0,0]=4 592 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [0,0,0,1,0,0|2,0,1]=4 593 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [0,0,0,1,0,0|3,0,0]=4 594 B9R1.50 O=C1NCCCCCN1 MCULE-7237090911 [0,0,0,1,0,0|2,0,0]=3 595 B9R1.50 S=C1NCCOCCN1 MCULE-6311148765 [0,0,0,1,0,0|3,0,0]=4 596 B9R1.84 NC(=S)NCC1CCC1 MCULE-7506306285 [0,0,0,1,0,0|2,0,0]=3 597 B9R1.85 NC(=S)NCCC1CC1 MCULE-2774330420 [0,0,0,1,0,0|2,0,0]=3 598 B9R1.96 CC(=O)N1CCC1CO MCULE-2554026906 [0,0,0,1,0,0|3,0,0]=4 599 B9R1.148 O=S1(=O)NCCCCN1 MCULE-2617905096 [0,0,0,1,0,0|3,0,0]=4 600 B6R0.6 C#CCCCCN MCULE-1313888655 [2,0,0,0,0,0|1,0,1]=4 601 B6R0.6 C#CCCCCN MCULE-5521830994 [2,0,0,0,0,0|1,0,1]=4 602 B6R0.6 C/C=C/CCCC MCULE-6900331316 [2,0,0,0,0,0|2,0,0]=4 603 B6R0.6 C/C=C\CCCC MCULE-8426867799 [2,0,0,0,0,0|2,0,0]=4 604 B6R0.6 C=CCCCCBr MCULE-4313298656 [2,0,0,0,0,0|2,0,0]=4 605 B6R0.6 C=CCCCCC MCULE-5868303078 [2,0,0,0,0,0|2,0,0]=4 606 B6R0.6 C=CCCCCCl MCULE-7600727876 [2,0,0,0,0,0|2,0,0]=4 607 B6R0.6 C=CCCCCI MCULE-5694143061 [2,0,0,0,0,0|2,0,0]=4 608 B6R0.6 C=CCCCCN MCULE-1489231988 [2,0,0,0,0,0|1,0,0]=3 609 B6R0.6 C=CCCCCN MCULE-4288584778 [2,0,0,0,0,0|1,0,0]=3 610 B6R0.6 C=CCCCCO MCULE-3631432277 [2,0,0,0,0,0|2,0,0]=4 611 B6R0.6 C=CCCCON MCULE-6496647420 [2,0,0,0,0,0|2,0,0]=4 612 B6R0.6 C=CCCCON MCULE-7055713530 [2,0,0,0,0,0|2,0,0]=4 613 B6R0.6 C=CCOCCN MCULE-5411259412 [2,0,0,0,0,0|2,0,0]=4 614 B6R0.6 C=CCOCCN MCULE-9798285838 [2,0,0,0,0,0|2,0,0]=4 615 B6R0.6 C=CCSCCN MCULE-3972995930 [2,0,0,0,0,0|2,0,0]=4 616 B6R0.6 C=CCSCCN MCULE-9922932955 [2,0,0,0,0,0|2,0,0]=4 617 B6R0.6 C=COCCCC MCULE-2025922328 [2,0,0,0,0,0|2,0,0]=4 618 B6R0.6 C=COCCCN MCULE-1669664157 [2,0,0,0,0,0|2,0,0]=4 619 B6R0.6 CC=CCCCC MCULE-7277981733 [2,0,0,0,0,0|2,0,0]=4 620 B6R0.6 CCCCCC=O MCULE-6770578514 [2,0,0,0,0,0|2,0,0]=4 621 B6R0.6 CCCCCCN MCULE-2944455155 [2,0,0,0,0,0|1,0,1]=4 622 B6R0.6 CCCCCCN MCULE-6014217174 [2,0,0,0,0,0|1,0,1]=4 623 B6R0.6 CCCCCCN MCULE-6021451227 [2,0,0,0,0,0|1,0,1]=4 624 B6R0.6 CCCCCNC MCULE-8082703734 [2,0,0,0,0,0|1,0,1]=4 625 B6R0.6 CCCCCNN MCULE-5089668540 [2,0,0,0,0,0|1,0,0]=3 626 B6R0.6 CCCCCNN MCULE-7265120524 [2,0,0,0,0,0|1,0,0]=3 627 B6R0.6 CCCCCON MCULE-5372426564 [2,0,0,0,0,0|2,0,0]=4 628 B6R0.6 CCCCCON MCULE-8557641459 [2,0,0,0,0,0|2,0,0]=4 629 B6R0.6 CCCCNC=O MCULE-8821792924 [2,0,0,0,0,0|1,0,0]=3 630 B6R0.6 CCCCNCC MCULE-8816750429 [2,0,0,0,0,0|1,0,1]=4 631 B6R0.6 CCCCNOC MCULE-4265481432 [2,0,0,0,0,0|2,0,0]=4 632 B6R0.6 CCCCOC=O MCULE-4633421026 [2,0,0,0,0,0|2,0,0]=4 633 B6R0.6 CCNCCCN MCULE-5811169148 [2,0,0,0,0,0|1,0,1]=4 634 B6R0.6 CCOCCNN MCULE-2995792378 [2,0,0,0,0,0|2,0,0]=4 635 B6R0.6 CCOCCNN MCULE-7756116612 [2,0,0,0,0,0|2,0,0]=4 636 B6R0.6 CNCCCCBr MCULE-4148452640 [2,0,0,0,0,0|1,0,1]=4 637 B6R0.6 CNCCCCBr MCULE-8686440557 [2,0,0,0,0,0|1,0,1]=4 638 B6R0.6 CNCCCCCl MCULE-1170786568 [2,0,0,0,0,0|1,0,1]=4 639 B6R0.6 CNCCCCCl MCULE-1726466829 [2,0,0,0,0,0|1,0,1]=4 640 B6R0.6 CNCCCCN MCULE-2542685963 [2,0,0,0,0,0|0,0,1]=3 641 B6R0.6 CNCCCCN MCULE-7925344560 [2,0,0,0,0,0|0,0,1]=3 642 B6R0.6 CNCCCCO MCULE-9264393637 [2,0,0,0,0,0|1,0,1]=4 643 B6R0.6 COCCCCN MCULE-9584631056 [2,0,0,0,0,0|1,0,1]=4 644 B6R0.6 COCCCNN MCULE-5097653856 [2,0,0,0,0,0|2,0,0]=4 645 B6R0.6 COCCCNN MCULE-7758841774 [2,0,0,0,0,0|2,0,0]=4 646 B6R0.6 COCCNC=O MCULE-9003279073 [2,0,0,0,0,0|2,0,0]=4 647 B6R0.6 CONCCCN MCULE-4780444103 [2,0,0,0,0,0|2,0,0]=4 648 B6R0.6 CONCCCN MCULE-6095720673 [2,0,0,0,0,0|2,0,0]=4 649 B6R0.6 CONCCCN MCULE-9121351484 [2,0,0,0,0,0|2,0,0]=4 650 B6R0.6 CSCCCCN MCULE-2391033479 [2,0,0,0,0,0|1,0,1]=4 651 B6R0.6 N#CCCCCN MCULE-4183048720 [2,0,0,0,0,0|0,0,2]=4 652 B6R0.6 N#CCCCCN MCULE-4775375165 [2,0,0,0,0,0|0,0,2]=4 653 B6R0.6 NCCCCCBr MCULE-3577483607 [2,0,0,0,0,0|1,0,1]=4 654 B6R0.6 NCCCCCBr MCULE-7572691537 [2,0,0,0,0,0|1,0,1]=4 655 B6R0.6 NCCCCCF MCULE-1057270243 [2,0,0,0,0,0|1,0,1]=4 656 B6R0.6 NCCCCCN MCULE-3785554987 [2,0,0,0,0,0|0,0,1]=3 657 B6R0.6 NCCCCCN MCULE-5173983982 [2,0,0,0,0,0|0,0,1]=3 658 B6R0.6 NCCCCCO MCULE-8877250712 [2,0,0,0,0,0|1,0,1]=4 659 B6R0.6 NCCCCCS MCULE-1813104379 [2,0,0,0,0,0|1,0,1]=4 660 B6R0.6 NCCCCCS MCULE-6081835870 [2,0,0,0,0,0|1,0,1]=4 661 B6R0.6 NCCCCNO MCULE-6478748569 [2,0,0,0,0,0|1,0,0]=3 662 B6R0.6 NCCCNC=O MCULE-9651299205 [2,0,0,0,0,0|1,0,0]=3 663 B6R0.6 NCCNCCN MCULE-4710767146 [2,0,0,0,0,0|1,0,1]=4 664 B6R0.6 NCCNCCN MCULE-4803305991 [2,0,0,0,0,0|1,0,1]=4 665 B6R0.6 NCCOCCN MCULE-1630934305 [2,0,0,0,0,0|1,0,1]=4 666 B6R0.6 NCCOCCN MCULE-3282393357 [2,0,0,0,0,0|1,0,1]=4 667 B6R0.6 NCCOCCN MCULE-3788231540 [2,0,0,0,0,0|1,0,1]=4 668 B6R0.6 NCCSCCN MCULE-4317147284 [2,0,0,0,0,0|1,0,1]=4 669 B6R0.6 NCCSCCN MCULE-5449033874 [2,0,0,0,0,0|1,0,1]=4 670 B6R0.6 NNCCCCO MCULE-3928748589 [2,0,0,0,0,0|1,0,0]=3 671 B6R0.6 NOCCCON MCULE-1133530094 [2,0,0,0,0,0|2,0,0]=4 672 B6R0.6 NOCCCON MCULE-5394799847 [2,0,0,0,0,0|2,0,0]=4 673 B6R0.6 O=CCCCCCl MCULE-1257670284 [2,0,0,0,0,0|2,0,0]=4 674 B6R0.6 O=CCCCCO MCULE-7959082228 [2,0,0,0,0,0|2,0,0]=4 675 B6R0.6 O=CNCCCO MCULE-7926485528 [2,0,0,0,0,0|2,0,0]=4 676 B6R0.4 C=C(C)CCCC MCULE-1010177756 [2,0,0,0,0,0|2,0,0]=4 677 B6R0.4 C=CCCC(=N)N MCULE-6900789687 [2,0,0,0,0,0|0,0,2]=4 678 B6R0.4 C=CCCC(=N)N MCULE-8560021860 [2,0,0,0,0,0|0,0,2]=4 679 B6R0.4 CC(=O)NCCN MCULE-2230084818 [2,0,0,0,0,0|2,0,0]=4 680 B6R0.4 CC(N)CCCN MCULE-4857113826 [2,0,0,0,0,0|1,0,1]=4 681 B6R0.4 CC(N)CCCN MCULE-4899798325 [2,0,0,0,0,0|1,0,1]=4 682 B6R0.4 CC/C=C/C(=N)N MCULE-7871697378 [2,0,0,0,0,0|0,0,2]=4 683 B6R0.4 CC/C=C/C(=N)N MCULE-9276291098 [2,0,0,0,0,0|0,0,2]=4 684 B6R0.4 CCCCC(=N)N MCULE-3271993509 [2,0,0,0,0,0|0,0,0]=2 685 B6R0.4 CCCCC(=N)N MCULE-3935017760 [2,0,0,0,0,0|0,0,0]=2 686 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [2,0,0,0,0,0|2,0,0]=4 687 B6R0.4 CCCCC(=O)C MCULE-3554390184 [2,0,0,0,0,0|2,0,0]=4 688 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [2,0,0,0,0,0|2,0,0]=4 689 B6R0.4 CCCCC(=O)N MCULE-6419483436 [2,0,0,0,0,0|1,0,0]=3 690 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|2,0,0]=4 691 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [2,0,0,0,0,0|2,0,0]=4 692 B6R0.4 CCCCC(=S)N MCULE-8236760762 [2,0,0,0,0,0|1,0,0]=3 693 B6R0.4 CCCCC(C)N MCULE-5349371506 [2,0,0,0,0,0|1,0,1]=4 694 B6R0.4 CCCCC(C)N MCULE-6696490028 [2,0,0,0,0,0|1,0,1]=4 695 B6R0.4 CCCCN(C)N MCULE-7927159797 [2,0,0,0,0,0|2,0,0]=4 696 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [2,0,0,0,0,0|1,0,1]=4 697 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [2,0,0,0,0,0|1,0,1]=4 698 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [2,0,0,0,0,0|1,0,1]=4 699 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [2,0,0,0,0,0|1,0,1]=4 700 B6R0.4 CCCNC(=N)N MCULE-6381843991 [2,0,0,0,0,0|0,0,0]=2 701 B6R0.4 CCCNC(=N)N MCULE-8286774592 [2,0,0,0,0,0|0,0,0]=2 702 B6R0.4 CCCNC(=O)C MCULE-5899703886 [2,0,0,0,0,0|2,0,0]=4 703 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [2,0,0,0,0,0|2,0,0]=4 704 B6R0.4 CCCNC(=O)N MCULE-8528844765 [2,0,0,0,0,0|1,0,0]=3 705 B6R0.4 CCCNC(=S)N MCULE-3142756488 [2,0,0,0,0,0|1,0,0]=3 706 B6R0.4 CCCOC(=O)N MCULE-2760622567 [2,0,0,0,0,0|2,0,0]=4 707 B6R0.4 CCCSC(=N)N MCULE-4777505658 [2,0,0,0,0,0|1,0,0]=3 708 B6R0.4 CCCSC(=N)N MCULE-8873393921 [2,0,0,0,0,0|1,0,0]=3 709 B6R0.4 CCCSC(=[NH2+])N MCULE-6759252204 [2,0,0,0,0,0|1,0,1]=4 710 B6R0.4 CCNCC(=O)N MCULE-1787248899 [2,0,0,0,0,0|2,0,0]=4 711 B6R0.4 CCNCC(=O)N MCULE-3821700273 [2,0,0,0,0,0|2,0,0]=4 712 B6R0.4 CCOCC(=N)N MCULE-3232806707 [2,0,0,0,0,0|1,0,0]=3 713 B6R0.4 CCOCC(=N)N MCULE-4996987536 [2,0,0,0,0,0|1,0,0]=3 714 B6R0.4 CCOCC(=S)N MCULE-7064672670 [2,0,0,0,0,0|2,0,0]=4 715 B6R0.4 CNCCC(=O)N MCULE-1118876220 [2,0,0,0,0,0|2,0,0]=4 716 B6R0.4 CNCCC(=O)N MCULE-6679713144 [2,0,0,0,0,0|2,0,0]=4 717 B6R0.4 COCCC(=N)N MCULE-8118559492 [2,0,0,0,0,0|1,0,0]=3 718 B6R0.4 COCCC(=N)N MCULE-9000138086 [2,0,0,0,0,0|1,0,0]=3 719 B6R0.4 COCCC(=O)N MCULE-7556483675 [2,0,0,0,0,0|2,0,0]=4 720 B6R0.4 COCNC(=O)N MCULE-8367032240 [2,0,0,0,0,0|2,0,0]=4 721 B6R0.4 CSCCC(=N)N MCULE-3926353306 [2,0,0,0,0,0|1,0,0]=3 722 B6R0.4 CSCCC(=N)N MCULE-4451485733 [2,0,0,0,0,0|1,0,0]=3 723 B6R0.4 CSCCC(=O)N MCULE-7105035733 [2,0,0,0,0,0|2,0,0]=4 724 B6R0.4 N=C(N)NCCO MCULE-5114367892 [2,0,0,0,0,0|1,0,0]=3 725 B6R0.4 N=C(N)NCCO MCULE-6389092248 [2,0,0,0,0,0|1,0,0]=3 726 B6R0.4 N=C(N)NCCS MCULE-1108122235 [2,0,0,0,0,0|1,0,0]=3 727 B6R0.4 N=C(N)NCCS MCULE-1842583721 [2,0,0,0,0,0|1,0,0]=3 728 B6R0.4 N=C(N)NCCS MCULE-4497722042 [2,0,0,0,0,0|1,0,0]=3 729 B6R0.4 N=C(N)NCCS MCULE-6123443321 [2,0,0,0,0,0|1,0,0]=3 730 B6R0.4 N=C(N)SCCN MCULE-1482556327 [2,0,0,0,0,0|1,0,0]=3 731 B6R0.4 N=C(N)SCCO MCULE-5563309692 [2,0,0,0,0,0|2,0,0]=4 732 B6R0.4 N=C(N)SCCO MCULE-5671847690 [2,0,0,0,0,0|2,0,0]=4 733 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [2,0,0,0,0,0|2,0,0]=4 734 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|2,0,0]=4 735 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [2,0,0,0,0,0|2,0,0]=4 736 B6R0.4 NC(=O)NCCF MCULE-9526714989 [2,0,0,0,0,0|2,0,0]=4 737 B6R0.4 NC(=O)NCCO MCULE-2353513655 [2,0,0,0,0,0|2,0,0]=4 738 B6R0.4 NC(=S)CCCO MCULE-8951145487 [2,0,0,0,0,0|2,0,0]=4 739 B6R0.4 NC(=S)NCCO MCULE-9343742573 [2,0,0,0,0,0|2,0,0]=4 740 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [2,0,0,0,0,0|2,0,0]=4 741 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [2,0,0,0,0,0|2,0,0]=4 742 B6R0.4 NCCCC(=O)N MCULE-8039142092 [2,0,0,0,0,0|1,0,0]=3 743 B6R0.4 NCCCC(=O)N MCULE-8262250872 [2,0,0,0,0,0|1,0,0]=3 744 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|2,0,0]=4 745 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|2,0,0]=4 746 B6R0.4 NCCNC(=O)N MCULE-1197396950 [2,0,0,0,0,0|1,0,0]=3 747 B6R0.4 NCCNC(=O)N MCULE-2171700183 [2,0,0,0,0,0|1,0,0]=3 748 B6R0.4 NCCNC(=O)N MCULE-3799764813 [2,0,0,0,0,0|1,0,0]=3 749 B6R0.4 NCCNC(=S)N MCULE-7473616024 [2,0,0,0,0,0|1,0,0]=3 750 B6R0.4 NCCNC(=S)N MCULE-7947010145 [2,0,0,0,0,0|1,0,0]=3 751 B6R0.4 NCCOC(=O)N MCULE-4144808257 [2,0,0,0,0,0|2,0,0]=4 752 B6R0.4 NCCOC(=O)N MCULE-5815053840 [2,0,0,0,0,0|2,0,0]=4 753 B8R0.4 C=CCCCCCCN MCULE-3465800348 [1,1,0,0,0,0|2,0,0]=4 754 B8R0.4 C=CCCCCCCN MCULE-9820466293 [1,1,0,0,0,0|2,0,0]=4 755 B8R0.4 C=CCCCCCNC MCULE-9487840122 [1,1,0,0,0,0|2,0,0]=4 756 B8R0.4 C=CCCCCCON MCULE-4401326316 [1,1,0,0,0,0|2,0,0]=4 757 B8R0.4 C=CCCCCCON MCULE-7563390889 [1,1,0,0,0,0|2,0,0]=4 758 B8R0.4 CCCCCCNC=O MCULE-3719637754 [1,1,0,0,0,0|2,0,0]=4 759 B8R0.4 CCCCCNCCN MCULE-5873419228 [1,1,0,0,0,0|1,0,1]=4 760 B8R0.4 CCCNCCCCN MCULE-1576152293 [1,1,0,0,0,0|1,0,1]=4 761 B8R0.4 CCCNCCCCN MCULE-2764845788 [1,1,0,0,0,0|1,0,1]=4 762 B8R0.4 CCNCCCCCN MCULE-1094310455 [1,1,0,0,0,0|1,0,1]=4 763 B8R0.4 CCNCCOCCN MCULE-7419143110 [1,1,0,0,0,0|1,0,1]=4 764 B8R0.4 CNCCCCCCN MCULE-3241182046 [1,1,0,0,0,0|1,0,1]=4 765 B8R0.4 NCCCCCCCN MCULE-3408586405 [1,1,0,0,0,0|1,0,1]=4 766 B8R0.4 NCCCCNCCO MCULE-5679490980 [1,1,0,0,0,0|1,0,1]=4 767 B8R0.4 NCCCNCCCN MCULE-3936851596 [1,1,0,0,0,0|1,0,1]=4 768 B8R0.4 NCCCOCCCN MCULE-5378554478 [1,1,0,0,0,0|1,0,1]=4 769 B8R0.4 NCCNCCCCO MCULE-1668134399 [1,1,0,0,0,0|1,0,1]=4 770 B8R0.4 NCCNCCCCO MCULE-8060063829 [1,1,0,0,0,0|1,0,1]=4 771 B8R0.5 CCCC(C)OC(=O)N MCULE-5471819133 [1,1,0,0,0,0|2,0,0]=4 772 B8R0.5 CCNC(=N)NC(=N)N MCULE-4957267166 [1,1,0,0,0,0|1,0,1]=4 773 B8R0.5 CCNC(=N)NC(=N)N MCULE-6522282435 [1,1,0,0,0,0|1,0,1]=4 774 B8R0.5 CCSC(=N)NC(=N)N MCULE-1773772994 [1,1,0,0,0,0|1,0,1]=4 775 B8R0.5 CCSC(=N)NC(=N)N MCULE-9288651744 [1,1,0,0,0,0|1,0,1]=4 776 B8R0.5 COCC(C)NC(=O)N MCULE-1001849810 [1,1,0,0,0,0|2,0,0]=4 777 B8R0.5 COCC(C)NC(=S)N MCULE-9922053025 [1,1,0,0,0,0|2,0,0]=4 778 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [1,1,0,0,0,0|2,0,0]=4 779 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [1,1,0,0,0,0|2,0,0]=4 780 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [1,1,0,0,0,0|2,0,0]=4 781 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [1,1,0,0,0,0|2,0,0]=4 782 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [1,1,0,0,0,0|2,0,0]=4 783 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [1,1,0,0,0,0|2,0,0]=4 784 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [1,1,0,0,0,0|2,0,0]=4 785 B8R0.8 CCCCN(C)C(=O)Cl MCULE-6884962631 [1,1,0,0,0,0|2,0,0]=4 786 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [1,1,0,0,0,0|2,0,0]=4 787 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [1,1,0,0,0,0|2,0,0]=4 788 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [1,1,0,0,0,0|2,0,0]=4 789 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [1,1,0,0,0,0|2,0,0]=4 790 B8R0.8 COCCN(C)C(=N)N MCULE-1439248667 [1,1,0,0,0,0|1,0,0]=3 791 B8R0.8 COCCN(C)C(=N)N MCULE-2072919131 [1,1,0,0,0,0|1,0,0]=3 792 B8R0.8 COCCN(C)C(=S)N MCULE-9549109784 [1,1,0,0,0,0|2,0,0]=4 793 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|2,0,0]=4 794 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|2,0,0]=4 795 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|2,0,0]=4 796 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|2,0,0]=4 797 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|2,0,0]=4 798 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|2,0,0]=4 799 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|2,0,0]=4 800 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|2,0,0]=4 801 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|2,0,0]=4 802 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|2,0,0]=4 803 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|2,0,0]=4 804 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|2,0,0]=4 805 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|2,0,0]=4 806 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|2,0,0]=4 807 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|2,0,0]=4 808 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|2,0,0]=4 809 B8R0.9 CC(=O)NCC(C)CN MCULE-6305271563 [1,1,0,0,0,0|2,0,0]=4 810 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [1,1,0,0,0,0|2,0,0]=4 811 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [1,1,0,0,0,0|2,0,0]=4 812 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [1,1,0,0,0,0|2,0,0]=4 813 B8R0.21 CCCCNP(=O)(N)N MCULE-1477149786 [1,1,0,0,0,0|1,0,1]=4 814 B8R0.21 CCCCNP(=S)(N)N MCULE-5982188246 [1,1,0,0,0,0|1,0,1]=4 815 B8R0.21 CCCCNS(=O)(=O)N MCULE-3413132305 [1,1,0,0,0,0|2,0,0]=4 816 B8R0.21 NCCCCS(=O)(=O)N MCULE-1137234818 [1,1,0,0,0,0|2,0,0]=4 817 B8R0.21 NCCCCS(=O)(=O)N MCULE-5156729166 [1,1,0,0,0,0|2,0,0]=4 818 B8R0.21 NCCCNS(=O)(=O)N MCULE-2837203147 [1,1,0,0,0,0|2,0,0]=4 819 B8R0.21 NCCCNS(=O)(=O)N MCULE-6164784918 [1,1,0,0,0,0|2,0,0]=4 820 B8R0.28 CC(=CCNC(=N)N)C MCULE-7530787437 [1,1,0,0,0,0|0,0,2]=4 821 B8R0.28 CC(=CCNC(=N)N)C MCULE-8656937078 [1,1,0,0,0,0|0,0,2]=4 822 B8R0.28 CC(=CCNC(=N)N)C MCULE-9564729624 [1,1,0,0,0,0|0,0,2]=4 823 B8R0.28 CC(=O)NCCC(C)C MCULE-7572826846 [1,1,0,0,0,0|2,0,0]=4 824 B8R0.28 CC(C)CCNC(=O)N MCULE-7857218878 [1,1,0,0,0,0|1,0,0]=3 825 B8R0.28 CC(C)CCNC(=S)N MCULE-3531703173 [1,1,0,0,0,0|1,0,0]=3 826 B8R0.28 CC(C)CCSC(=N)N MCULE-2814891417 [1,1,0,0,0,0|1,0,0]=3 827 B8R0.28 CC(C)CCSC(=N)N MCULE-6341574593 [1,1,0,0,0,0|1,0,0]=3 828 B8R0.28 CN(C)CCNC(=N)N MCULE-7208545071 [1,1,0,0,0,0|1,0,0]=3 829 B8R0.28 CN(C)CCNC(=O)N MCULE-5420989663 [1,1,0,0,0,0|2,0,0]=4 830 B8R0.28 CN(C)CCNC(=O)N MCULE-6784836791 [1,1,0,0,0,0|2,0,0]=4 831 B8R0.28 CN(C)CCNC(=S)N MCULE-5710279007 [1,1,0,0,0,0|2,0,0]=4 832 B8R0.28 CN(C)CCNC(=S)N MCULE-5969623703 [1,1,0,0,0,0|2,0,0]=4 833 B8R0.28 CN(C)CCSC(=N)N MCULE-6198414952 [1,1,0,0,0,0|2,0,0]=4 834 B8R0.28 CN(C)CCSC(=N)N MCULE-7791127793 [1,1,0,0,0,0|2,0,0]=4 835 B8R0.28 CN(C)CCSC(=N)N MCULE-9666429478 [1,1,0,0,0,0|2,0,0]=4 836 B8R0.28 N=C(N)NCCC(=O)O MCULE-6783592689 [1,1,0,0,0,0|1,0,1]=4 837 B8R0.28 NC(=O)CCCC(=O)N MCULE-8380308624 [1,1,0,0,0,0|1,0,1]=4 838 B10R0.77 CCN(CC)CCNC(=N)N MCULE-2990424871 [0,2,0,0,0,0|2,0,0]=4 839 B10R0.77 CCN(CC)CCNC(=N)N MCULE-6794521480 [0,2,0,0,0,0|2,0,0]=4 840 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-2234773343 [0,2,0,0,0,0|1,0,1]=4 841 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-9635728361 [0,2,0,0,0,0|1,0,1]=4 842 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-5360635274 [0,2,0,0,0,0|1,0,1]=4 843 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-7633853490 [0,2,0,0,0,0|1,0,1]=4 844 B10R0.4 CC(=O)NCCCCCCN MCULE-6988947031 [0,2,0,0,0,0|2,0,0]=4 845 B10R0.4 CCCCCCCCC(=N)N MCULE-1846296312 [0,2,0,0,0,0|2,0,0]=4 846 B10R0.4 CCCCCCCNC(=S)N MCULE-7534812314 [0,2,0,0,0,0|2,0,0]=4 847 B10R0.4 CCCCSCCSC(=N)N MCULE-3434333786 [0,2,0,0,0,0|2,0,0]=4 848 B10R0.4 CCCCSCCSC(=N)N MCULE-8139259062 [0,2,0,0,0,0|2,0,0]=4 849 B10R0.4 NCCCCCCNC(=O)O MCULE-3865214371 [0,2,0,0,0,0|2,0,0]=4 850 B10R0.4 NCCSSCCNC(=O)O MCULE-5576549611 [0,2,0,0,0,0|2,0,0]=4 851 B10R0.6 CCCCCC(=O)NC(=S)N MCULE-2245655459 [0,2,0,0,0,0|2,0,0]=4 852 B10R0.6 CCCCNC(=N)NC(=N)N MCULE-5413481004 [0,2,0,0,0,0|1,0,1]=4 853 B10R0.6 CCCCNC(=N)NC(=N)N MCULE-8572445680 [0,2,0,0,0,0|1,0,1]=4 854 B10R0.55 NC(=O)NCCC[C@H](N)CO MCULE-3843882509 [0,2,0,0,0,0|1,0,0]=3 855 B10R0.55 NC(=O)NCCC[C@H](N)CO MCULE-6658263929 [0,2,0,0,0,0|1,0,0]=3 856 B10R0.74 CCCCCCNC(=S)NN MCULE-8958102268 [0,2,0,0,0,0|2,0,0]=4 857 B10R0.74 CCOCCCNC(=O)CN MCULE-1200721909 [0,2,0,0,0,0|2,0,0]=4 858 B10R0.74 CCOCCCNC(=O)CN MCULE-4624752579 [0,2,0,0,0,0|2,0,0]=4 859 B10R0.74 NCC(=O)NCCCCCBr MCULE-2648430779 [0,2,0,0,0,0|2,0,0]=4 860 B10R0.74 NCC(=O)NCCCCCBr MCULE-8496903301 [0,2,0,0,0,0|2,0,0]=4 861 B10R0.97 CC(C)OCCCNC(=O)N MCULE-6526725654 [0,2,0,0,0,0|2,0,0]=4 862 B10R0.97 CN(C)CCCCSC(=N)N MCULE-4930376954 [0,2,0,0,0,0|1,0,0]=3 863 B10R0.97 CN(C)CCCCSC(=N)N MCULE-7876242660 [0,2,0,0,0,0|1,0,0]=3 864 B10R0.97 N=C(N)CCCCCC(=N)N MCULE-7581700737 [0,2,0,0,0,0|1,0,0]=3 865 B10R0.97 N=C(N)CCOCCC(=N)N MCULE-2643423338 [0,2,0,0,0,0|1,0,1]=4 866 B10R0.97 N=C(N)CCOCCC(=N)N MCULE-7495309228 [0,2,0,0,0,0|1,0,1]=4 867 B10R0.97 N=C(N)NCCCCC(=O)O MCULE-2807872503 [0,2,0,0,0,0|1,0,0]=3 868 B10R0.97 N=C(N)SCCCCC(=O)O MCULE-6602460811 [0,2,0,0,0,0|2,0,0]=4 869 B10R0.97 N=C(N)SCCCSC(=N)N MCULE-2100796872 [0,2,0,0,0,0|1,0,1]=4 870 B10R0.97 NC(=O)NCCCCC(=O)O MCULE-1121500109 [0,2,0,0,0,0|2,0,0]=4 871 B10R0.83 CNC(=O)[C@@H](N)CCCCN MCULE-4853574180 [0,2,0,0,0,0|2,0,0]=4 872 B10R0.83 NCCCC[C@H](N)C(=O)NO MCULE-6731609596 [0,2,0,0,0,0|2,0,0]=4 873 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [1,0,0,1,0,0|2,0,0]=4 874 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [1,0,0,1,0,0|2,0,0]=4 875 B8R1.2 NCC1CC=CCC1 MCULE-9374023591 [1,0,0,1,0,0|2,0,0]=4 876 B8R1.2 NCC1CCC=CO1 MCULE-9848121283 [1,0,0,1,0,0|2,0,0]=4 877 B8R1.2 NCC1CCCCN1 MCULE-5628582900 [1,0,0,1,0,0|1,0,1]=4 878 B8R1.2 NCC1CCCCN1 MCULE-7762336274 [1,0,0,1,0,0|1,0,1]=4 879 B8R1.2 NCC1CCNCC1 MCULE-3105491297 [1,0,0,1,0,0|1,0,1]=4 880 B8R1.2 NC[C@@H]1CCCCN1 MCULE-2094976900 [1,0,0,1,0,0|1,0,1]=4 881 B8R1.2 NC[C@@H]1CCCCN1 MCULE-3736890217 [1,0,0,1,0,0|1,0,1]=4 882 B8R1.2 NC[C@H]1CCCCN1 MCULE-2124027272 [1,0,0,1,0,0|1,0,1]=4 883 B8R1.2 NC[C@H]1CCCCN1 MCULE-5815797207 [1,0,0,1,0,0|1,0,1]=4 884 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [1,0,0,1,0,0|2,0,0]=4 885 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [1,0,0,1,0,0|2,0,0]=4 886 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [1,0,0,1,0,0|2,0,0]=4 887 B8R1.2 S=CN1CCCCC1 MCULE-9360358622 [1,0,0,1,0,0|2,0,0]=4 888 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [1,0,0,1,0,0|2,0,0]=4 889 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [1,0,0,1,0,0|2,0,0]=4 890 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [1,0,0,1,0,0|2,0,0]=4 891 B8R1.5 NC1CCCCC1N MCULE-1677916175 [1,0,0,1,0,0|1,0,1]=4 892 B8R1.5 NC1CCCCC1N MCULE-9568644004 [1,0,0,1,0,0|1,0,1]=4 893 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [1,0,0,1,0,0|1,0,0]=3 894 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [1,0,0,1,0,0|1,0,0]=3 895 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [1,0,0,1,0,0|1,0,0]=3 896 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [1,0,0,1,0,0|1,0,0]=3 897 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [1,0,0,1,0,0|2,0,0]=4 898 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [1,0,0,1,0,0|1,0,1]=4 899 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [1,0,0,1,0,0|1,0,1]=4 900 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [1,0,0,1,0,0|1,0,1]=4 901 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [1,0,0,1,0,0|1,0,1]=4 902 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [1,0,0,1,0,0|1,0,0]=3 903 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [1,0,0,1,0,0|1,0,0]=3 904 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [1,0,0,1,0,0|1,0,0]=3 905 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [1,0,0,1,0,0|1,0,0]=3 906 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [1,0,0,1,0,0|1,0,1]=4 907 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [1,0,0,1,0,0|1,0,1]=4 908 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [1,0,0,1,0,0|1,0,1]=4 909 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [1,0,0,1,0,0|1,0,1]=4 910 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [1,0,0,1,0,0|1,0,0]=3 911 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [1,0,0,1,0,0|1,0,0]=3 912 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [1,0,0,1,0,0|1,0,0]=3 913 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [1,0,0,1,0,0|1,0,0]=3 914 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [1,0,0,1,0,0|2,0,0]=4 915 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [1,0,0,1,0,0|2,0,0]=4 916 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [1,0,0,1,0,0|2,0,0]=4 917 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [1,0,0,1,0,0|2,0,0]=4 918 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [1,0,0,1,0,0|2,0,0]=4 919 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [1,0,0,1,0,0|2,0,0]=4 920 B8R1.8 C=CCC1CCCN1 MCULE-2522287788 [1,0,0,1,0,0|2,0,0]=4 921 B8R1.8 C=CCC1CCCN1 MCULE-9373442327 [1,0,0,1,0,0|2,0,0]=4 922 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1619177702 [1,0,0,1,0,0|2,0,0]=4 923 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1817861281 [1,0,0,1,0,0|2,0,0]=4 924 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-4058658588 [1,0,0,1,0,0|2,0,0]=4 925 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-5972924318 [1,0,0,1,0,0|2,0,0]=4 926 B8R1.8 C=CC[C@H]1CCCN1 MCULE-4617277800 [1,0,0,1,0,0|2,0,0]=4 927 B8R1.8 C=CC[C@H]1CCCN1 MCULE-6182243336 [1,0,0,1,0,0|2,0,0]=4 928 B8R1.8 NCCC1=CNC=N1 MCULE-1177653177 [1,0,0,1,0,0|0,0,2]=4 929 B8R1.8 NCCC1=CNC=N1 MCULE-2213201369 [1,0,0,1,0,0|0,0,2]=4 930 B8R1.8 NCCC1=CNC=N1 MCULE-4970362785 [1,0,0,1,0,0|0,0,2]=4 931 B8R1.8 NCCC1=CNC=N1 MCULE-5576180655 [1,0,0,1,0,0|0,0,2]=4 932 B8R1.8 NCCC1=CNC=N1 MCULE-7793585534 [1,0,0,1,0,0|0,0,2]=4 933 B8R1.8 NCCC1CC=CC1 MCULE-1981261517 [1,0,0,1,0,0|2,0,0]=4 934 B8R1.8 NCCC1CC=CC1 MCULE-5939427419 [1,0,0,1,0,0|2,0,0]=4 935 B8R1.8 NCCC1CCCN1 MCULE-3948200302 [1,0,0,1,0,0|1,0,1]=4 936 B8R1.8 NCCC1CCCN1 MCULE-8874469745 [1,0,0,1,0,0|1,0,1]=4 937 B8R1.8 O=CNC1CCCC1 MCULE-1453368274 [1,0,0,1,0,0|2,0,0]=4 938 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [1,0,0,1,0,0|2,0,0]=4 939 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [1,0,0,1,0,0|2,0,0]=4 940 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [1,0,0,1,0,0|2,0,0]=4 941 B8R1.11 NCC1CCCC1N MCULE-8430269654 [1,0,0,1,0,0|1,0,1]=4 942 B8R1.11 NCC1CCOC1=O MCULE-5843107965 [1,0,0,1,0,0|2,0,0]=4 943 B8R1.11 NCC1CCOC1=O MCULE-6077637171 [1,0,0,1,0,0|2,0,0]=4 944 B8R1.11 O=C1NCCC1CO MCULE-8442279545 [1,0,0,1,0,0|2,0,0]=4 945 B8R1.11 O=C1NCC[C@@H]1CO MCULE-5339343040 [1,0,0,1,0,0|2,0,0]=4 946 B8R1.12 CCN1CCC1CN MCULE-7381187825 [1,0,0,1,0,0|1,0,1]=4 947 B8R1.12 NCC1CCC1CN MCULE-4127003858 [1,0,0,1,0,0|1,0,1]=4 948 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-1825799395 [1,0,0,1,0,0|1,0,1]=4 949 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-8343153828 [1,0,0,1,0,0|1,0,1]=4 950 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [1,0,0,1,0,0|1,0,1]=4 951 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [1,0,0,1,0,0|1,0,1]=4 952 B8R1.22 NC1C=CCCCC1 MCULE-4893389838 [1,0,0,1,0,0|2,0,0]=4 953 B8R1.22 NC1CCCNCC1 MCULE-5600391911 [1,0,0,1,0,0|1,0,1]=4 954 B8R1.22 NC1CCCNCC1 MCULE-7390953649 [1,0,0,1,0,0|1,0,1]=4 955 B8R1.22 N[C@@H]1CCCNCC1 MCULE-5614702075 [1,0,0,1,0,0|1,0,1]=4 956 B8R1.22 N[C@H]1CCCNCC1 MCULE-1653914126 [1,0,0,1,0,0|1,0,1]=4 957 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [1,0,0,1,0,0|2,0,0]=4 958 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [1,0,0,1,0,0|2,0,0]=4 959 B8R1.22 S=C1NCCCCN1 MCULE-5312414479 [1,0,0,1,0,0|1,0,0]=3 960 B8R1.1 C1(CCC(=O)N1)CBr MCULE-4451864575 [1,0,0,1,0,0|2,0,0]=4 961 B8R1.1 C1(CCC(=O)N1)CN MCULE-3169700074 [1,0,0,1,0,0|1,0,0]=3 962 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [1,0,0,1,0,0|2,0,0]=4 963 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [1,0,0,1,0,0|2,0,0]=4 964 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [1,0,0,1,0,0|2,0,0]=4 965 B8R1.1 CCC1=CNC(=N1)N MCULE-2806731479 [1,0,0,1,0,0|0,0,2]=4 966 B8R1.1 CCC1=CNC(=N1)N MCULE-5988447444 [1,0,0,1,0,0|0,0,2]=4 967 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [1,0,0,1,0,0|2,0,0]=4 968 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [1,0,0,1,0,0|2,0,0]=4 969 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [1,0,0,1,0,0|2,0,0]=4 970 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [1,0,0,1,0,0|2,0,0]=4 971 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [1,0,0,1,0,0|2,0,0]=4 972 B8R1.1 CCC1CSC(=N1)C MCULE-4393928745 [1,0,0,1,0,0|2,0,0]=4 973 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [1,0,0,1,0,0|2,0,0]=4 974 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [1,0,0,1,0,0|2,0,0]=4 975 B8R1.1 NC1=NC(CS1)CBr MCULE-2891354982 [1,0,0,1,0,0|2,0,0]=4 976 B8R1.1 NCC1=NNC(=N1)N MCULE-7772685351 [1,0,0,1,0,0|1,0,1]=4 977 B8R1.1 NCC1CCC(=O)N1 MCULE-2195138544 [1,0,0,1,0,0|1,0,0]=3 978 B8R1.1 NCC1CCC(=O)N1 MCULE-5064964559 [1,0,0,1,0,0|1,0,0]=3 979 B8R1.1 NCC1CCC(=O)N1 MCULE-9686422256 [1,0,0,1,0,0|1,0,0]=3 980 B8R1.1 NCC1CCC(=O)N1 MCULE-9973113927 [1,0,0,1,0,0|1,0,0]=3 981 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [1,0,0,1,0,0|2,0,0]=4 982 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [1,0,0,1,0,0|2,0,0]=4 983 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [1,0,0,1,0,0|2,0,0]=4 984 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [1,0,0,1,0,0|2,0,0]=4 985 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [1,0,0,1,0,0|2,0,0]=4 986 B8R1.1 NCC1CNC(=O)O1 MCULE-3940030823 [1,0,0,1,0,0|2,0,0]=4 987 B8R1.1 NCC1CNC(=O)O1 MCULE-7671055394 [1,0,0,1,0,0|2,0,0]=4 988 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [1,0,0,1,0,0|2,0,0]=4 989 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [1,0,0,1,0,0|2,0,0]=4 990 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-5772277021 [1,0,0,1,0,0|1,0,0]=3 991 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-6147061481 [1,0,0,1,0,0|1,0,0]=3 992 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7644508115 [1,0,0,1,0,0|1,0,0]=3 993 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7782108755 [1,0,0,1,0,0|1,0,0]=3 994 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [1,0,0,1,0,0|2,0,0]=4 995 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [1,0,0,1,0,0|2,0,0]=4 996 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [1,0,0,1,0,0|2,0,0]=4 997 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [1,0,0,1,0,0|2,0,0]=4 998 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-1463241001 [1,0,0,1,0,0|2,0,0]=4 999 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-3217887113 [1,0,0,1,0,0|2,0,0]=4 1000 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-5423398321 [1,0,0,1,0,0|2,0,0]=4 1001 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-9322185538 [1,0,0,1,0,0|2,0,0]=4 1002 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1485902199 [1,0,0,1,0,0|1,0,0]=3 1003 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1751255260 [1,0,0,1,0,0|1,0,0]=3 1004 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-3641870628 [1,0,0,1,0,0|1,0,0]=3 1005 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-9839264859 [1,0,0,1,0,0|1,0,0]=3 1006 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [1,0,0,1,0,0|2,0,0]=4 1007 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [1,0,0,1,0,0|2,0,0]=4 1008 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [1,0,0,1,0,0|2,0,0]=4 1009 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [1,0,0,1,0,0|2,0,0]=4 1010 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-1224919034 [1,0,0,1,0,0|2,0,0]=4 1011 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6003746665 [1,0,0,1,0,0|2,0,0]=4 1012 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6937146715 [1,0,0,1,0,0|2,0,0]=4 1013 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-9419881517 [1,0,0,1,0,0|2,0,0]=4 1014 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [1,0,0,1,0,0|2,0,0]=4 1015 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [1,0,0,1,0,0|2,0,0]=4 1016 B8R1.1 O=C1CCC(N1)CBr MCULE-7024022934 [1,0,0,1,0,0|2,0,0]=4 1017 B8R1.1 O=C1CCC(N1)CI MCULE-6956070937 [1,0,0,1,0,0|2,0,0]=4 1018 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [1,0,0,1,0,0|2,0,0]=4 1019 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-4537645558 [1,0,0,1,0,0|2,0,0]=4 1020 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-6830001458 [1,0,0,1,0,0|2,0,0]=4 1021 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [1,0,0,1,0,0|2,0,0]=4 1022 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [1,0,0,1,0,0|2,0,0]=4 1023 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-1684731751 [1,0,0,1,0,0|2,0,0]=4 1024 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-4479348379 [1,0,0,1,0,0|2,0,0]=4 1025 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [1,0,0,1,0,0|2,0,0]=4 1026 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [1,0,0,1,0,0|2,0,0]=4 1027 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [1,0,0,1,0,0|2,0,0]=4 1028 B8R1.4 CC1CCN=C(S1)N MCULE-2188659606 [1,0,0,1,0,0|1,0,1]=4 1029 B8R1.4 CC1CCN=C(S1)N MCULE-8502352820 [1,0,0,1,0,0|1,0,1]=4 1030 B8R1.4 CC1CCNC(=N)C1 MCULE-2615774284 [1,0,0,1,0,0|1,0,0]=3 1031 B8R1.4 CC1CCNC(=N)C1 MCULE-9034088725 [1,0,0,1,0,0|1,0,0]=3 1032 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [1,0,0,1,0,0|2,0,0]=4 1033 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [1,0,0,1,0,0|1,0,0]=3 1034 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [1,0,0,1,0,0|2,0,0]=4 1035 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [1,0,0,1,0,0|2,0,0]=4 1036 B8R1.4 C[C@@H]1CCN=C(S1)N MCULE-5066686774 [1,0,0,1,0,0|1,0,1]=4 1037 B8R1.4 C[C@@H]1CCN=C(S1)N MCULE-6965708093 [1,0,0,1,0,0|1,0,1]=4 1038 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [1,0,0,1,0,0|2,0,0]=4 1039 B8R1.4 NC1C=C(CCC1)F MCULE-7477602128 [1,0,0,1,0,0|2,0,0]=4 1040 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [1,0,0,1,0,0|2,0,0]=4 1041 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [1,0,0,1,0,0|2,0,0]=4 1042 B8R1.4 NC1CCCC(C1)N MCULE-3029985677 [1,0,0,1,0,0|1,0,1]=4 1043 B8R1.4 NC1CCCC(C1)N MCULE-6391736640 [1,0,0,1,0,0|1,0,1]=4 1044 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [1,0,0,1,0,0|2,0,0]=4 1045 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [1,0,0,1,0,0|2,0,0]=4 1046 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [1,0,0,1,0,0|2,0,0]=4 1047 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [1,0,0,1,0,0|2,0,0]=4 1048 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [1,0,0,1,0,0|2,0,0]=4 1049 B8R1.4 N[C@@H]1CCC[C@H](C1)N MCULE-2130309446 [1,0,0,1,0,0|1,0,1]=4 1050 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [1,0,0,1,0,0|2,0,0]=4 1051 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [1,0,0,1,0,0|2,0,0]=4 1052 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-1460773264 [1,0,0,1,0,0|1,0,1]=4 1053 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7326708293 [1,0,0,1,0,0|1,0,1]=4 1054 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-7679169264 [1,0,0,1,0,0|1,0,1]=4 1055 B8R1.4 N[C@H]1CCC[C@@H](C1)N MCULE-8810866148 [1,0,0,1,0,0|1,0,1]=4 1056 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-7378030264 [1,0,0,1,0,0|1,0,1]=4 1057 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8100723700 [1,0,0,1,0,0|1,0,1]=4 1058 B8R1.4 N[C@H]1CCC[C@H](C1)N MCULE-8346537188 [1,0,0,1,0,0|1,0,1]=4 1059 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [1,0,0,1,0,0|2,0,0]=4 1060 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [1,0,0,1,0,0|2,0,0]=4 1061 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [1,0,0,1,0,0|2,0,0]=4 1062 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [1,0,0,1,0,0|2,0,0]=4 1063 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [1,0,0,1,0,0|1,0,0]=3 1064 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [1,0,0,1,0,0|1,0,0]=3 1065 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [1,0,0,1,0,0|2,0,0]=4 1066 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [1,0,0,1,0,0|2,0,0]=4 1067 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [1,0,0,1,0,0|2,0,0]=4 1068 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [1,0,0,1,0,0|2,0,0]=4 1069 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [1,0,0,1,0,0|2,0,0]=4 1070 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [1,0,0,1,0,0|2,0,0]=4 1071 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [1,0,0,1,0,0|2,0,0]=4 1072 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [1,0,0,1,0,0|2,0,0]=4 1073 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [1,0,0,1,0,0|2,0,0]=4 1074 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [1,0,0,1,0,0|1,0,0]=3 1075 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [1,0,0,1,0,0|1,0,0]=3 1076 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [1,0,0,1,0,0|0,0,0]=2 1077 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [1,0,0,1,0,0|0,0,0]=2 1078 B8R1.7 N=C(N)C1CCCO1 MCULE-1348627071 [1,0,0,1,0,0|1,0,0]=3 1079 B8R1.7 N=C(N)C1CCCO1 MCULE-4359589378 [1,0,0,1,0,0|1,0,0]=3 1080 B8R1.7 N=C(N)C1CCOC1 MCULE-1442525298 [1,0,0,1,0,0|2,0,0]=4 1081 B8R1.7 N=C(N)C1CCOC1 MCULE-2289256622 [1,0,0,1,0,0|2,0,0]=4 1082 B8R1.7 N=C(N)C1CCOC1 MCULE-6644963466 [1,0,0,1,0,0|2,0,0]=4 1083 B8R1.7 N=C(N)N1CCCC1 MCULE-1081237301 [1,0,0,1,0,0|0,0,0]=2 1084 B8R1.7 N=C(N)N1CCCC1 MCULE-2310711826 [1,0,0,1,0,0|0,0,0]=2 1085 B8R1.7 N=C(N)N1CCCC1 MCULE-5860683743 [1,0,0,1,0,0|0,0,0]=2 1086 B8R1.7 N=C(N)N1CCCC1 MCULE-9334495491 [1,0,0,1,0,0|0,0,0]=2 1087 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [1,0,0,1,0,0|2,0,0]=4 1088 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [1,0,0,1,0,0|1,0,0]=3 1089 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [1,0,0,1,0,0|1,0,0]=3 1090 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [1,0,0,1,0,0|2,0,0]=4 1091 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [1,0,0,1,0,0|2,0,0]=4 1092 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [1,0,0,1,0,0|1,0,0]=3 1093 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [1,0,0,1,0,0|1,0,0]=3 1094 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [1,0,0,1,0,0|1,0,0]=3 1095 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [1,0,0,1,0,0|1,0,0]=3 1096 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [1,0,0,1,0,0|1,0,0]=3 1097 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [1,0,0,1,0,0|2,0,0]=4 1098 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [1,0,0,1,0,0|2,0,0]=4 1099 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [1,0,0,1,0,0|1,0,0]=3 1100 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [1,0,0,1,0,0|1,0,0]=3 1101 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [1,0,0,1,0,0|1,0,0]=3 1102 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [1,0,0,1,0,0|1,0,0]=3 1103 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [1,0,0,1,0,0|2,0,0]=4 1104 B8R1.7 NC(=S)C1CCCO1 MCULE-7906949480 [1,0,0,1,0,0|2,0,0]=4 1105 B8R1.7 NC(=S)N1CCCC1 MCULE-1483517657 [1,0,0,1,0,0|1,0,0]=3 1106 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [1,0,0,1,0,0|2,0,0]=4 1107 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|2,0,0]=4 1108 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|2,0,0]=4 1109 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|2,0,0]=4 1110 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|2,0,0]=4 1111 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [1,0,0,1,0,0|2,0,0]=4 1112 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|2,0,0]=4 1113 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|2,0,0]=4 1114 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|2,0,0]=4 1115 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|2,0,0]=4 1116 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|2,0,0]=4 1117 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|2,0,0]=4 1118 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [1,0,0,1,0,0|2,0,0]=4 1119 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [1,0,0,1,0,0|2,0,0]=4 1120 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [1,0,0,1,0,0|2,0,0]=4 1121 B8R1.7 S=C(S)N1CCCC1 MCULE-1085952223 [1,0,0,1,0,0|2,0,0]=4 1122 B8R1.7 S=C([S-])N1CCCC1 MCULE-9299211770 [1,0,0,1,0,0|2,0,0]=4 1123 B8R1.7 S=C([S-])N1CCCC1 MCULE-9637056918 [1,0,0,1,0,0|2,0,0]=4 1124 B8R1.7 [NH2+]=C(N)N1CCCC1 MCULE-9887365479 [1,0,0,1,0,0|0,0,1]=3 1125 B8R1.20 CC1CC1NC(=S)N MCULE-2224830291 [1,0,0,1,0,0|1,0,0]=3 1126 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [1,0,0,1,0,0|2,0,0]=4 1127 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [1,0,0,1,0,0|2,0,0]=4 1128 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [1,0,0,1,0,0|2,0,0]=4 1129 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [1,0,0,1,0,0|2,0,0]=4 1130 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [1,0,0,1,0,0|2,0,0]=4 1131 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [1,0,0,1,0,0|2,0,0]=4 1132 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [1,0,0,1,0,0|2,0,0]=4 1133 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [1,0,0,1,0,0|2,0,0]=4 1134 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [1,0,0,1,0,0|2,0,0]=4 1135 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [1,0,0,1,0,0|2,0,0]=4 1136 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [1,0,0,1,0,0|2,0,0]=4 1137 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [1,0,0,1,0,0|2,0,0]=4 1138 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [1,0,0,1,0,0|2,0,0]=4 1139 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [1,0,0,1,0,0|2,0,0]=4 1140 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [1,0,0,1,0,0|2,0,0]=4 1141 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [1,0,0,1,0,0|2,0,0]=4 1142 B8R1.34 N=C(N)CC1CCC1 MCULE-7694021103 [1,0,0,1,0,0|1,0,0]=3 1143 B8R1.34 NC(=O)NC1CCC1 MCULE-4153424610 [1,0,0,1,0,0|1,0,0]=3 1144 B8R1.34 NC(=S)CC1CCC1 MCULE-7458307170 [1,0,0,1,0,0|2,0,0]=4 1145 B8R1.34 NC(=S)NC1CCC1 MCULE-2018899467 [1,0,0,1,0,0|1,0,0]=3 1146 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [1,0,0,1,0,0|2,0,0]=4 1147 B8R1.35 CC(=O)NCC1CC1 MCULE-1770864212 [1,0,0,1,0,0|2,0,0]=4 1148 B8R1.35 N=C(N)NCC1CC1 MCULE-9564921056 [1,0,0,1,0,0|0,0,0]=2 1149 B8R1.35 N=C(N)SCC1CC1 MCULE-1163307095 [1,0,0,1,0,0|1,0,0]=3 1150 B8R1.35 N=C(N)SCC1CC1 MCULE-9784235666 [1,0,0,1,0,0|1,0,0]=3 1151 B8R1.35 NC(=O)NCC1CC1 MCULE-9526171923 [1,0,0,1,0,0|1,0,0]=3 1152 B8R1.35 NC(=S)NCC1CC1 MCULE-7980551401 [1,0,0,1,0,0|1,0,0]=3 1153 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [1,0,0,1,0,0|2,0,0]=4 1154 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [1,0,0,1,0,0|2,0,0]=4 1155 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [1,0,0,1,0,0|2,0,0]=4 1156 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [1,0,0,1,0,0|2,0,0]=4 1157 B10R1.13 CC1CCN(CC1)C(=N)N MCULE-4223791626 [0,1,0,1,0,0|1,0,0]=3 1158 B10R1.13 CC1CCN(CC1)C(=N)N MCULE-7714885163 [0,1,0,1,0,0|1,0,0]=3 1159 B10R1.13 CC1CCN(CC1)C(=N)N MCULE-8667869338 [0,1,0,1,0,0|1,0,0]=3 1160 B10R1.13 CC1CCN(CC1)C(=N)N MCULE-8862371672 [0,1,0,1,0,0|1,0,0]=3 1161 B10R1.13 CC1CCN(CC1)C(=S)N MCULE-9233041644 [0,1,0,1,0,0|2,0,0]=4 1162 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-2858447013 [0,1,0,1,0,0|2,0,0]=4 1163 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-3577188904 [0,1,0,1,0,0|2,0,0]=4 1164 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-4238212829 [0,1,0,1,0,0|2,0,0]=4 1165 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-6760037554 [0,1,0,1,0,0|2,0,0]=4 1166 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-6977727543 [0,1,0,1,0,0|2,0,0]=4 1167 B10R1.13 CN1CCN(CC1)C(=N)N MCULE-9788201236 [0,1,0,1,0,0|2,0,0]=4 1168 B10R1.13 NC(=O)N1CCC(CC1)N MCULE-3646405188 [0,1,0,1,0,0|2,0,0]=4 1169 B10R1.13 NC(=O)N1CCC(CC1)N MCULE-9726087016 [0,1,0,1,0,0|2,0,0]=4 1170 B10R1.13 NC(=S)N1CCC(CC1)O MCULE-1295951518 [0,1,0,1,0,0|2,0,0]=4 1171 B10R1.31 CC(=O)N1CCC(C1)CN MCULE-1403031762 [0,1,0,1,0,0|2,0,0]=4 1172 B10R1.31 CC(=O)N1CCC(C1)CN MCULE-1933467126 [0,1,0,1,0,0|2,0,0]=4 1173 B10R1.31 CCC1CCN(C1)C(=S)N MCULE-4395104900 [0,1,0,1,0,0|2,0,0]=4 1174 B10R1.31 NCC1CCN(C1)C(=O)N MCULE-7656043539 [0,1,0,1,0,0|1,0,0]=3 1175 B10R1.31 NCC1CCN(C1)C(=O)N MCULE-8800247157 [0,1,0,1,0,0|1,0,0]=3 1176 B10R1.10 NCCN1CCNC(=O)C1 MCULE-8111198516 [0,1,0,1,0,0|2,0,0]=4 1177 B10R1.16 CC1=CN=C(N1)CCCN MCULE-3348264219 [0,1,0,1,0,0|1,0,1]=4 1178 B10R1.16 CC1=CN=C(N1)CCCN MCULE-8438671338 [0,1,0,1,0,0|1,0,1]=4 1179 B10R1.16 CC1=NC(=NN1)CCCN MCULE-1858516777 [0,1,0,1,0,0|1,0,1]=4 1180 B10R1.16 CC1=NC(=NN1)CCCN MCULE-7066409781 [0,1,0,1,0,0|1,0,1]=4 1181 B10R1.16 CCCCC1=NNC(=N1)N MCULE-9013902690 [0,1,0,1,0,0|1,0,1]=4 1182 B10R1.16 CNCCC1=NNC(=N1)N MCULE-6215176427 [0,1,0,1,0,0|1,0,1]=4 1183 B10R1.16 CNCCC1=NNC(=N1)N MCULE-9264339790 [0,1,0,1,0,0|1,0,1]=4 1184 B10R1.16 NC1=NN=C(N1)CCCO MCULE-9423966666 [0,1,0,1,0,0|1,0,1]=4 1185 B10R1.16 NCCCC1=CSC(=N1)N MCULE-3711047643 [0,1,0,1,0,0|1,0,1]=4 1186 B10R1.16 NCCCC1=CSC(=N1)N MCULE-5847735451 [0,1,0,1,0,0|1,0,1]=4 1187 B10R1.16 NCCCC1=NC(=O)NN1 MCULE-6920406503 [0,1,0,1,0,0|1,0,1]=4 1188 B10R1.16 NCCCC1=NC(=O)NN1 MCULE-9547474508 [0,1,0,1,0,0|1,0,1]=4 1189 B10R1.16 NCCCC1=NN=C(N1)N MCULE-1469942643 [0,1,0,1,0,0|0,0,1]=3 1190 B10R1.16 NCCCC1=NN=C(S1)N MCULE-2763061431 [0,1,0,1,0,0|1,0,1]=4 1191 B10R1.16 NCCCC1=NN=C(S1)N MCULE-5539471860 [0,1,0,1,0,0|1,0,1]=4 1192 B10R1.18 CC(=O)NC1CCCNC1 MCULE-2923451430 [0,1,0,1,0,0|2,0,0]=4 1193 B10R1.18 CC(=O)NC1CCCNC1 MCULE-7850537912 [0,1,0,1,0,0|2,0,0]=4 1194 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-3102769783 [0,1,0,1,0,0|2,0,0]=4 1195 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-4313494103 [0,1,0,1,0,0|2,0,0]=4 1196 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-1582624021 [0,1,0,1,0,0|2,0,0]=4 1197 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-7588247669 [0,1,0,1,0,0|2,0,0]=4 1198 B10R1.18 N=C(N)CC1CCCCC1 MCULE-8473334050 [0,1,0,1,0,0|2,0,0]=4 1199 B10R1.18 N=C(N)CC1CCCCC1 MCULE-9393856468 [0,1,0,1,0,0|2,0,0]=4 1200 B10R1.18 N=C(N)CN1CCOCC1 MCULE-2793241641 [0,1,0,1,0,0|2,0,0]=4 1201 B10R1.18 N=C(N)CN1CCOCC1 MCULE-4715070332 [0,1,0,1,0,0|2,0,0]=4 1202 B10R1.18 N=C(N)NC1CCCCC1 MCULE-8462693519 [0,1,0,1,0,0|1,0,0]=3 1203 B10R1.18 N=C(N)SC1CCCCC1 MCULE-2002714434 [0,1,0,1,0,0|2,0,0]=4 1204 B10R1.18 N=C(N)SC1CCCCC1 MCULE-5487361105 [0,1,0,1,0,0|2,0,0]=4 1205 B10R1.18 NC(=O)CC1CCCCN1 MCULE-2185479052 [0,1,0,1,0,0|2,0,0]=4 1206 B10R1.18 NC(=O)CC1CCCCN1 MCULE-4538477610 [0,1,0,1,0,0|2,0,0]=4 1207 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9261260462 [0,1,0,1,0,0|2,0,0]=4 1208 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9756580933 [0,1,0,1,0,0|2,0,0]=4 1209 B10R1.18 NC(=O)CC1COCCN1 MCULE-1907387140 [0,1,0,1,0,0|2,0,0]=4 1210 B10R1.18 NC(=O)CC1COCCN1 MCULE-6398693859 [0,1,0,1,0,0|2,0,0]=4 1211 B10R1.18 NC(=O)CN1CCCCC1 MCULE-5267943459 [0,1,0,1,0,0|2,0,0]=4 1212 B10R1.18 NC(=O)NC1CCCCC1 MCULE-8036346010 [0,1,0,1,0,0|2,0,0]=4 1213 B10R1.18 NC(=O)NC1CCCNC1 MCULE-6949169935 [0,1,0,1,0,0|1,0,0]=3 1214 B10R1.18 NC(=O)NC1CCCNC1 MCULE-7043674090 [0,1,0,1,0,0|1,0,0]=3 1215 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6399383870 [0,1,0,1,0,0|2,0,0]=4 1216 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6486575063 [0,1,0,1,0,0|2,0,0]=4 1217 B10R1.18 NC(=O)NC1CCOCC1 MCULE-4139742761 [0,1,0,1,0,0|2,0,0]=4 1218 B10R1.18 NC(=S)CN1CCCCC1 MCULE-2487691046 [0,1,0,1,0,0|2,0,0]=4 1219 B10R1.18 NC(=S)NC1CCCCC1 MCULE-3435819926 [0,1,0,1,0,0|2,0,0]=4 1220 B10R1.18 NC(=S)NC1CCOCC1 MCULE-2166021989 [0,1,0,1,0,0|2,0,0]=4 1221 B10R1.39 CC(=O)N1CCCC1CN MCULE-8374406668 [0,1,0,1,0,0|2,0,0]=4 1222 B10R1.39 CC(=O)N1CCC[C@H]1CN MCULE-8445880935 [0,1,0,1,0,0|2,0,0]=4 1223 B10R1.39 NC(=O)N1CCC[C@H]1CO MCULE-1529936614 [0,1,0,1,0,0|2,0,0]=4 1224 B10R1.39 NC[C@@H]1CSCN1C(=O)O MCULE-1801556250 [0,1,0,1,0,0|2,0,0]=4 1225 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [0,1,0,1,0,0|2,0,0]=4 1226 B10R1.61 CN1CCCCC1C(=N)N MCULE-3877430212 [0,1,0,1,0,0|1,0,0]=3 1227 B10R1.61 CN1CCCCC1C(=N)N MCULE-6905385954 [0,1,0,1,0,0|1,0,0]=3 1228 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [0,1,0,1,0,0|2,0,0]=4 1229 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [0,1,0,1,0,0|2,0,0]=4 1230 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [0,1,0,1,0,0|2,0,0]=4 1231 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [0,1,0,1,0,0|2,0,0]=4 1232 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [0,1,0,1,0,0|2,0,0]=4 1233 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [0,1,0,1,0,0|2,0,0]=4 1234 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [0,1,0,1,0,0|2,0,0]=4 1235 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [0,1,0,1,0,0|2,0,0]=4 1236 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [0,1,0,1,0,0|2,0,0]=4 1237 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [0,1,0,1,0,0|2,0,0]=4 1238 B10R1.64 NC(=O)NC1CCCC1=O MCULE-8760589602 [0,1,0,1,0,0|2,0,0]=4 1239 B10R1.64 NC(=O)NC1CSCC1O MCULE-1469346128 [0,1,0,1,0,0|2,0,0]=4 1240 B10R1.64 NC(=O)N[C@@H]1CSC[C@@H]1O MCULE-3136982094 [0,1,0,1,0,0|2,0,0]=4 1241 B10R1.64 NC(=O)N[C@@H]1CSC[C@@H]1O MCULE-4789054601 [0,1,0,1,0,0|2,0,0]=4 1242 B10R1.66 CC(=O)NCC1CCCN1 MCULE-7607447093 [0,1,0,1,0,0|2,0,0]=4 1243 B10R1.66 CC(=O)NCC1CCCN1 MCULE-9543275549 [0,1,0,1,0,0|2,0,0]=4 1244 B10R1.66 CC(=O)NCC1CCNC1 MCULE-1169092409 [0,1,0,1,0,0|2,0,0]=4 1245 B10R1.66 CC(=O)NCC1CCNC1 MCULE-2188033072 [0,1,0,1,0,0|2,0,0]=4 1246 B10R1.66 CC(=O)NCC1CCNC1 MCULE-8407363763 [0,1,0,1,0,0|2,0,0]=4 1247 B10R1.66 CC(=O)NC[C@@H]1CCCN1 MCULE-5496183974 [0,1,0,1,0,0|2,0,0]=4 1248 B10R1.66 N=C(N)CCN1CCCC1 MCULE-1786886794 [0,1,0,1,0,0|2,0,0]=4 1249 B10R1.66 N=C(N)CCN1CCCC1 MCULE-9755724579 [0,1,0,1,0,0|2,0,0]=4 1250 B10R1.66 N=C(N)NCC1CCCO1 MCULE-6260783933 [0,1,0,1,0,0|1,0,0]=3 1251 B10R1.66 N=C(N)NCC1CCCO1 MCULE-6720947181 [0,1,0,1,0,0|1,0,0]=3 1252 B10R1.66 N=C(N)NCC1CCCO1 MCULE-9518137890 [0,1,0,1,0,0|1,0,0]=3 1253 B10R1.66 N=C(N)SCC1CCCO1 MCULE-7278581303 [0,1,0,1,0,0|2,0,0]=4 1254 B10R1.66 N=C(N)SCC1CCCO1 MCULE-9976461555 [0,1,0,1,0,0|2,0,0]=4 1255 B10R1.66 NC(=O)CNC1CCCC1 MCULE-5401113380 [0,1,0,1,0,0|2,0,0]=4 1256 B10R1.66 NC(=O)CNC1CCCC1 MCULE-8595660552 [0,1,0,1,0,0|2,0,0]=4 1257 B10R1.66 NC(=O)NCC1CCCN1 MCULE-3595646758 [0,1,0,1,0,0|1,0,0]=3 1258 B10R1.66 NC(=O)NCC1CCCO1 MCULE-5540789879 [0,1,0,1,0,0|2,0,0]=4 1259 B10R1.66 NC(=S)NCC1CCCO1 MCULE-1845300796 [0,1,0,1,0,0|2,0,0]=4 1260 B10R1.66 NC(=S)NCC1CCCS1 MCULE-2374769876 [0,1,0,1,0,0|2,0,0]=4 1261 B10R1.66 NC(=S)NC[C@H]1CCCO1 MCULE-3549920474 [0,1,0,1,0,0|2,0,0]=4 1262 B10R1.162 NCC1CCCCC(=O)N1 MCULE-4887883772 [0,1,0,1,0,0|2,0,0]=4 1263 B10R1.348 N=C(N)C1CCCCCC1 MCULE-2361950713 [0,1,0,1,0,0|2,0,0]=4 1264 B10R1.348 N=C(N)C1CCCCCC1 MCULE-8756683037 [0,1,0,1,0,0|2,0,0]=4 1265 B10R1.348 N=C(N)N1CCCCCC1 MCULE-2545773830 [0,1,0,1,0,0|1,0,0]=3 1266 B10R1.348 N=C(N)N1CCCCCC1 MCULE-7077276891 [0,1,0,1,0,0|1,0,0]=3 1267 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [0,1,0,1,0,0|2,0,0]=4 1268 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [0,1,0,1,0,0|2,0,0]=4 1269 B10R1.348 NC(=O)N1CCCCCC1 MCULE-6181473782 [0,1,0,1,0,0|2,0,0]=4 1270 B10R1.348 NC(=O)N1CCCNCC1 MCULE-1958255797 [0,1,0,1,0,0|2,0,0]=4 1271 B10R1.348 NC(=S)N1CCCCCC1 MCULE-2239849602 [0,1,0,1,0,0|2,0,0]=4 1272 B10R1.348 NC(=[NH2+])N1CCCCCC1 MCULE-6100967271 [0,1,0,1,0,0|1,0,1]=4 1273 B10R1.8 CC1CC(CC(=O)N1)CN MCULE-4583006616 [0,1,0,1,0,0|2,0,0]=4 1274 B10R1.8 CC1CC(CC(=O)N1)CN MCULE-5588706286 [0,1,0,1,0,0|2,0,0]=4 1275 B10R1.130 NCCC1NC(=O)NC1=O MCULE-7419413788 [0,1,0,1,0,0|1,0,1]=4 1276 B10R1.130 NCCC1NC(=S)NC1=O MCULE-4423948104 [0,1,0,1,0,0|1,0,1]=4 1277 B10R1.370 CC1(CCCO1)NC(=S)N MCULE-9804632779 [0,1,0,1,0,0|2,0,0]=4 1278 B10R1.1 NCCC1CCC(=O)NC1 MCULE-4442979377 [0,1,0,1,0,0|2,0,0]=4 1279 B10R1.2 CN1C(=O)CCCC1CN MCULE-5353606512 [0,1,0,1,0,0|2,0,0]=4 1280 B10R1.2 CN1C(=O)CCCC1CN MCULE-9312653603 [0,1,0,1,0,0|2,0,0]=4 1281 B10R1.2 CN1C(=O)NCCC1CN MCULE-3590580692 [0,1,0,1,0,0|1,0,0]=3 1282 B10R1.15 CNC(=O)C1CCCCN1 MCULE-2059398226 [0,1,0,1,0,0|2,0,0]=4 1283 B10R1.15 CNC(=O)C1CCCCN1 MCULE-6797335969 [0,1,0,1,0,0|2,0,0]=4 1284 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-3578222481 [0,1,0,1,0,0|2,0,0]=4 1285 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-5767177119 [0,1,0,1,0,0|2,0,0]=4 1286 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-1484363402 [0,1,0,1,0,0|2,0,0]=4 1287 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-2898288746 [0,1,0,1,0,0|2,0,0]=4 1288 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-8199763754 [0,1,0,1,0,0|2,0,0]=4 1289 B10R1.15 CNC(=S)N1CCCCC1 MCULE-9367513339 [0,1,0,1,0,0|2,0,0]=4 1290 B10R1.15 N/C(=N/O)/C1CCCCC1 MCULE-7400174450 [0,1,0,1,0,0|2,0,0]=4 1291 B10R1.15 N/C(=N\O)/N1CCOCC1 MCULE-1492613638 [0,1,0,1,0,0|2,0,0]=4 1292 B10R1.15 N=C(NN)N1CCOCC1 MCULE-4516496826 [0,1,0,1,0,0|2,0,0]=4 1293 B10R1.15 N=C(NN)N1CCOCC1 MCULE-6627997184 [0,1,0,1,0,0|2,0,0]=4 1294 B10R1.15 N=C(NO)N1CCCCC1 MCULE-3117627837 [0,1,0,1,0,0|1,0,0]=3 1295 B10R1.15 NCC(=O)N1CCCCC1 MCULE-6847570430 [0,1,0,1,0,0|2,0,0]=4 1296 B10R1.15 NCC(=O)N1CCCCC1 MCULE-7684350460 [0,1,0,1,0,0|2,0,0]=4 1297 B10R1.15 NNC(=S)N1CCCCC1 MCULE-1694547046 [0,1,0,1,0,0|2,0,0]=4 1298 B10R1.27 CNC(=O)NC1CCCC1 MCULE-2695826124 [0,1,0,1,0,0|2,0,0]=4 1299 B10R1.27 N/C(=N/O)/CC1CCCC1 MCULE-5747462847 [0,1,0,1,0,0|2,0,0]=4 1300 B10R1.27 N/C(=N\O)/CC1CCCO1 MCULE-5663324435 [0,1,0,1,0,0|2,0,0]=4 1301 B10R1.27 N/C(=N\O)/NC1CCCC1 MCULE-6095099341 [0,1,0,1,0,0|1,0,0]=3 1302 B10R1.27 NCC(=O)NC1CCCC1 MCULE-8019469442 [0,1,0,1,0,0|2,0,0]=4 1303 B10R1.27 NCC(=O)NC1CCCC1 MCULE-9069112041 [0,1,0,1,0,0|2,0,0]=4 1304 B10R1.27 NNC(=O)NC1CCCC1 MCULE-7539809331 [0,1,0,1,0,0|2,0,0]=4 1305 B10R1.27 NNC(=S)NC1CCCC1 MCULE-9577996335 [0,1,0,1,0,0|2,0,0]=4 1306 B10R1.151 NNC(=S)NCC1CCC1 MCULE-2248976379 [0,1,0,1,0,0|2,0,0]=4 1307 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-4642648861 [0,1,0,1,0,0|2,0,0]=4 1308 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-7081928105 [0,1,0,1,0,0|2,0,0]=4 1309 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-2900342300 [0,1,0,1,0,0|2,0,0]=4 1310 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-5325252584 [0,1,0,1,0,0|2,0,0]=4 1311 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-9462446118 [0,1,0,1,0,0|2,0,0]=4 1312 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2743229947 [0,1,0,1,0,0|2,0,0]=4 1313 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2860088162 [0,1,0,1,0,0|2,0,0]=4 1314 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-5518465296 [0,1,0,1,0,0|2,0,0]=4 1315 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-8760084774 [0,1,0,1,0,0|2,0,0]=4 1316 B10R1.113 CC1CCCN(C1)C(=N)N MCULE-1673125896 [0,1,0,1,0,0|1,0,0]=3 1317 B10R1.113 CC1CCCN(C1)C(=N)N MCULE-9712542981 [0,1,0,1,0,0|1,0,0]=3 1318 B10R1.113 CC1CCCN(C1)C(=S)N MCULE-6966556396 [0,1,0,1,0,0|2,0,0]=4 1319 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,1,0,1,0,0|2,0,0]=4 1320 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [0,1,0,1,0,0|2,0,0]=4 1321 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-6231215658 [0,1,0,1,0,0|1,0,0]=3 1322 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-7051693066 [0,1,0,1,0,0|1,0,0]=3 1323 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-7905125532 [0,1,0,1,0,0|1,0,0]=3 1324 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-9518047308 [0,1,0,1,0,0|1,0,0]=3 1325 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [0,1,0,1,0,0|2,0,0]=4 1326 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [0,1,0,1,0,0|2,0,0]=4 1327 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [0,1,0,1,0,0|2,0,0]=4 1328 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [0,1,0,1,0,0|2,0,0]=4 1329 B10R1.131 CN1CC(CC1=O)CCN MCULE-6918414305 [0,1,0,1,0,0|2,0,0]=4 1330 B10R1.176 CN1CCC(CC1=O)CN MCULE-3850118896 [0,1,0,1,0,0|2,0,0]=4 1331 B10R1.176 CN1CCC(CC1=O)CN MCULE-4980643488 [0,1,0,1,0,0|2,0,0]=4 1332 B10R1.176 CN1CCC(CC1=O)CN MCULE-7115920789 [0,1,0,1,0,0|2,0,0]=4 1333 B10R1.176 CN1CC[C@@H](CC1=O)CN MCULE-7105353134 [0,1,0,1,0,0|2,0,0]=4 1334 B10R1.176 CN1CC[C@@H](CC1=O)CN MCULE-8900496569 [0,1,0,1,0,0|2,0,0]=4 1335 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-5510028076 [0,1,0,1,0,0|2,0,0]=4 1336 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-9010382394 [0,1,0,1,0,0|2,0,0]=4 1337 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-2241799409 [0,1,0,1,0,0|2,0,0]=4 1338 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-4555567865 [0,1,0,1,0,0|2,0,0]=4 1339 B10R2.61 O=C1NC2CCNC1C2 MCULE-4221823714 [0,0,0,2,0,0|2,0,0]=4 1340 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-4859115894 [0,0,0,2,0,0|2,0,0]=4 1341 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7323043594 [0,0,0,2,0,0|2,0,0]=4 1342 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7946144059 [0,0,0,2,0,0|2,0,0]=4 1343 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-1783881546 [0,0,0,2,0,0|2,0,0]=4 1344 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-2191940678 [0,0,0,2,0,0|2,0,0]=4 1345 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-3269432034 [0,0,0,2,0,0|2,0,0]=4 1346 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-4463912241 [0,0,0,2,0,0|2,0,0]=4 1347 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6809518361 [0,0,0,2,0,0|2,0,0]=4 1348 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6941150528 [0,0,0,2,0,0|2,0,0]=4 1349 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9444667290 [0,0,0,2,0,0|2,0,0]=4 1350 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9739462821 [0,0,0,2,0,0|2,0,0]=4 1351 B10R2.2 NC1=NN2CCCC2=C1 MCULE-8135965572 [0,0,0,2,0,0|1,0,1]=4 1352 B10R2.2 O=C1CC2NCCC2N1 MCULE-2516258983 [0,0,0,2,0,0|2,0,0]=4 1353 B10R2.2 O=C1CC2NCCC2N1 MCULE-4812066577 [0,0,0,2,0,0|2,0,0]=4 1354 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-1007187560 [0,0,0,2,0,0|2,0,0]=4 1355 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-8278160952 [0,0,0,2,0,0|2,0,0]=4 1356 B10R2.32 C12CCNC1C(=O)NC2 MCULE-9691167616 [0,0,0,2,0,0|2,0,0]=4 1357 B10R2.32 NC1=NC=C2N1CCC2 MCULE-3478361296 [0,0,0,2,0,0|1,0,1]=4 1358 B10R2.32 [C@@H]12CCN[C@@H]1C(=O)NC2 MCULE-6925376025 [0,0,0,2,0,0|2,0,0]=4 1359 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5094345573 [0,0,0,2,0,0|2,0,0]=4 1360 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5128140663 [0,0,0,2,0,0|2,0,0]=4