0 B11R1.1074 CCC1(CCCCC1)C(=O)O MCULE-1239882099 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.1074 CCC1(CCCCN1)C(=O)O MCULE-3363810836 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.1074 CCC1(CCCCN1)C(=O)O MCULE-3511835420 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.1074 CCC1(CCCNC1)C(=O)N MCULE-1504498322 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.1074 CCC1(CCCNC1)C(=O)N MCULE-3364775133 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.1074 CCC1(CCCNC1)C(=O)O MCULE-4082709895 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.1074 CCC1(CCCNC1)C(=O)O MCULE-4330535403 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.1074 CCC1(CCNCC1)C(=O)N MCULE-3957031995 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.1074 CCC1(CCNCC1)C(=O)N MCULE-7799942946 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.1074 CCC1(CCNCC1)C(=O)O MCULE-1398986416 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.1074 CCC1(CCNCC1)C(=O)O MCULE-8638291608 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.1074 CCC1(CCOCC1)C(=O)O MCULE-8667730132 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.1074 CCC1(COCCN1)C(=O)O MCULE-7441313827 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.1074 CCC1(COCOC1)C(=O)O MCULE-8515251768 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.1074 CCC1(SCCCS1)C(=O)O MCULE-3611309990 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.1074 CNC1(CCCCC1)C(=O)O MCULE-7399184595 [0,0,0,0,0,0|0,0,0]=0 16 B11R1.1074 CNC1(CCOCC1)C(=O)N MCULE-4218348330 [0,0,0,0,0,0|2,0,0]=2 17 B11R1.1074 CNC1(CCOCC1)C(=O)O MCULE-3359408926 [0,0,0,0,0,0|1,0,0]=1 18 B11R1.1074 CNC1(CCOCC1)C(=O)O MCULE-4436067730 [0,0,0,0,0,0|1,0,0]=1 19 B11R1.1074 CNC1(CCSCC1)C(=O)N MCULE-5035728799 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.1074 CNC1(CCSCC1)C(=O)O MCULE-5303303431 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.1074 COC1(CCCCC1)C(=O)C MCULE-4191142379 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.1074 COC1(CCCCC1)C(=O)O MCULE-1591494554 [0,0,0,0,0,0|1,0,0]=1 23 B11R1.1074 COC1(CCCNC1)C(=O)O MCULE-7763705716 [0,0,0,0,0,0|2,0,0]=2 24 B11R1.1074 COC1(CCCNC1)C(=O)O MCULE-9595367468 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.1074 COC1(CCNCC1)C(=O)N MCULE-2708625340 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.1074 COC1(CCNCC1)C(=O)N MCULE-3801272999 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.1074 COC1(CCNCC1)C(=O)O MCULE-1300106015 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.1074 COC1(CCNCC1)C(=O)O MCULE-7196776076 [0,0,0,0,0,0|2,0,0]=2 29 B11R1.1074 COC1(CCOCC1)C(=O)C MCULE-5105886912 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.1074 COC1(CCOCC1)C(=O)O MCULE-1535370902 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.1074 COC1(CCOCC1)C(=S)N MCULE-6816464000 [0,0,0,0,0,0|3,1,0]=4 32 B11R1.1074 N#CC1(CCCCC1)C(=O)O MCULE-2346110250 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.1074 N#CC1(CCCOC1)C(=O)O MCULE-2226541127 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.1074 N#CC1(CCNCC1)C(=O)O MCULE-7981587223 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.1074 N#CC1(CCNCC1)C(=O)O MCULE-8603071721 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.1074 N#CC1(CCOCC1)C(=O)O MCULE-1172521926 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.1074 N#CC1(CCSCC1)C(=O)O MCULE-3118110353 [0,0,0,0,0,0|3,0,0]=3 38 B11R1.1074 NCC1(CCCCC1)C(=O)O MCULE-6540997661 [0,0,0,0,0,0|2,0,0]=2 39 B11R1.1074 NCC1(CCCCC1)C(=O)O MCULE-8691521129 [0,0,0,0,0,0|2,0,0]=2 40 B11R1.1074 NCC1(CCCOC1)C(=O)O MCULE-1802610214 [0,0,0,0,0,0|3,0,0]=3 41 B11R1.1074 NCC1(CCCOC1)C(=O)O MCULE-5207801423 [0,0,0,0,0,0|3,0,0]=3 42 B11R1.1074 NCC1(CCOCC1)C(=O)N MCULE-7556510912 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.1074 NCC1(CCOCC1)C(=O)O MCULE-3943984495 [0,0,0,0,0,0|3,0,0]=3 44 B11R1.1074 NCC1(CCOCC1)C(=O)O MCULE-4788693444 [0,0,0,0,0,0|3,0,0]=3 45 B11R1.1074 O=C(O)C1(CCCCC1)CO MCULE-2836039300 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.1074 O=C(O)C1(CCOCC1)CF MCULE-8551611962 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.1074 O=C(O)C1(CCOCC1)CO MCULE-6309166747 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.1074 O=N(=O)C1(CCCCC1)CO MCULE-4678380705 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.363 CC(=O)C1(CCCCC1)Br MCULE-1087745376 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.363 CC(=O)C1(CCCCC1)C MCULE-2400194377 [1,0,0,0,0,0|1,0,0]=2 51 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-2403671270 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-8220968252 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.363 CC(=O)C1(CCCCC1)O MCULE-8708554984 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-2089718696 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-3448978894 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.363 CC(=O)C1(CCOCC1)C MCULE-6994899414 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.363 CC(=O)C1(CCOCC1)O MCULE-4174424855 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.363 CC(=O)C1(COCOC1)C MCULE-2297528523 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.363 CC1(C=CCCC1)C(=O)O MCULE-7610148262 [1,0,0,0,0,0|0,0,2]=3 60 B10R1.363 CC1(CC=CCC1)C(=O)N MCULE-8468605392 [1,0,0,0,0,0|1,0,2]=4 61 B10R1.363 CC1(CC=CCC1)C(=O)O MCULE-5814640957 [1,0,0,0,0,0|0,0,2]=3 62 B10R1.363 CC1(CCCCC1)C(=O)Cl MCULE-2304699201 [1,0,0,0,0,0|1,0,0]=2 63 B10R1.363 CC1(CCCCC1)C(=O)N MCULE-2748976288 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.363 CC1(CCCCC1)C(=O)O MCULE-8617368211 [1,0,0,0,0,0|0,0,0]=1 65 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-5510028076 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-9010382394 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-4353837718 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-5823768018 [1,0,0,0,0,0|1,0,0]=2 69 B10R1.363 CC1(CCCCO1)C(=O)O MCULE-8167039984 [1,0,0,0,0,0|1,0,0]=2 70 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-6281064804 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-7011930506 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-1830247756 [1,0,0,0,0,0|1,0,0]=2 73 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-4554317503 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.363 CC1(CCCOC1)C(=O)O MCULE-3722771180 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-1830846193 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-7847544229 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-5925956345 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-9595642308 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.363 CC1(CCOCC1)C(=O)O MCULE-6824729734 [1,0,0,0,0,0|1,0,0]=2 80 B10R1.363 CC1(CCSCC1)C(=O)O MCULE-4494370785 [1,0,0,0,0,0|1,0,0]=2 81 B10R1.363 CC1(CNCCO1)C(=O)N MCULE-9521473906 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-6864976931 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-7815848744 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.363 CC1(COCCN1)C(=O)O MCULE-2577762263 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.363 CC1(COCCN1)C(=O)O MCULE-4596611063 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.363 CC1(COCCO1)C(=O)O MCULE-5074851185 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.363 CC1(COCOC1)C(=O)O MCULE-7267825356 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-2751244606 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-9588562839 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.363 C[C@@]1(CCCCO1)C(=O)O MCULE-8351337180 [1,0,0,0,0,0|1,0,0]=2 91 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-2580172241 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-5735574050 [1,0,0,0,0,0|1,0,0]=2 93 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-6097682986 [1,0,0,0,0,0|1,0,0]=2 94 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-8361078667 [1,0,0,0,0,0|1,0,0]=2 95 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-2019738412 [1,0,0,0,0,0|1,0,0]=2 96 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-5663835052 [1,0,0,0,0,0|1,0,0]=2 97 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-8254704116 [1,0,0,0,0,0|1,0,0]=2 98 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-1520204390 [1,0,0,0,0,0|1,0,0]=2 99 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-5357080399 [1,0,0,0,0,0|1,0,0]=2 100 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-4789999853 [1,0,0,0,0,0|1,0,0]=2 101 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-5338426663 [1,0,0,0,0,0|1,0,0]=2 102 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-6021049561 [1,0,0,0,0,0|1,0,0]=2 103 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-7816386590 [1,0,0,0,0,0|1,0,0]=2 104 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-2241799409 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-4555567865 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.363 NC(=O)C1(CCCCC1)N MCULE-9213834644 [1,0,0,0,0,0|1,0,0]=2 107 B10R1.363 NC(=O)C1(CCCCC1)O MCULE-9953817877 [1,0,0,0,0,0|2,0,0]=3 108 B10R1.363 NC(=O)C1(CCCNC1)O MCULE-5624973083 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-1637528026 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-9426392755 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-2419590647 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-4475585786 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.363 NC(=O)C1(CCOCC1)O MCULE-6043002573 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.363 NC(=O)C1(CCSCC1)N MCULE-4385733187 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.363 NC(=O)C1(CCSCC1)O MCULE-5322321936 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.363 NC1(CCCCC1)C(=O)O MCULE-9219404299 [1,0,0,0,0,0|0,0,0]=1 117 B10R1.363 NC1(CCCCC1)C(F)F MCULE-1818635571 [1,0,0,0,0,0|2,0,1]=4 118 B10R1.363 NC1(CCCCC1)C(F)F MCULE-8461575374 [1,0,0,0,0,0|2,0,1]=4 119 B10R1.363 NC1(CCCOC1)C(=O)O MCULE-7592747043 [1,0,0,0,0,0|1,0,0]=2 120 B10R1.363 NC1(CCCSC1)C(=O)O MCULE-5875012341 [1,0,0,0,0,0|1,0,0]=2 121 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-2468722313 [1,0,0,0,0,0|1,0,0]=2 122 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-4525710147 [1,0,0,0,0,0|1,0,0]=2 123 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-5856930946 [1,0,0,0,0,0|1,0,0]=2 124 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-8458518802 [1,0,0,0,0,0|1,0,0]=2 125 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-8720926076 [1,0,0,0,0,0|1,0,0]=2 126 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-9032013861 [1,0,0,0,0,0|1,0,0]=2 127 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-3400288648 [1,0,0,0,0,0|1,0,0]=2 128 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-7826194478 [1,0,0,0,0,0|1,0,0]=2 129 B10R1.363 O=C(Cl)C1(CCCCC1)Br MCULE-3943135228 [1,0,0,0,0,0|2,0,0]=3 130 B10R1.363 O=C(Cl)C1(CCCCC1)Cl MCULE-5594029874 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.363 O=C(O)C1(CCCCC1)Br MCULE-4457572618 [1,0,0,0,0,0|1,0,0]=2 132 B10R1.363 O=C(O)C1(CCCCC1)Cl MCULE-9172453010 [1,0,0,0,0,0|1,0,0]=2 133 B10R1.363 O=C(O)C1(CCCCC1)F MCULE-6566089811 [1,0,0,0,0,0|1,0,0]=2 134 B10R1.363 O=C(O)C1(CCCCC1)O MCULE-8504861268 [1,0,0,0,0,0|1,0,0]=2 135 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-4880129058 [1,0,0,0,0,0|2,0,0]=3 136 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-9960592206 [1,0,0,0,0,0|2,0,0]=3 137 B10R1.363 O=C(O)C1(CCCOC1)F MCULE-8290066035 [1,0,0,0,0,0|2,0,0]=3 138 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-1312767997 [1,0,0,0,0,0|2,0,0]=3 139 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-5915477961 [1,0,0,0,0,0|2,0,0]=3 140 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-4619147711 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-6538244346 [1,0,0,0,0,0|2,0,0]=3 142 B10R1.363 O=C(O)C1(CCOCC1)F MCULE-7783441156 [1,0,0,0,0,0|2,0,0]=3 143 B10R1.363 O=C(O)C1(CCOCC1)O MCULE-4186201239 [1,0,0,0,0,0|2,0,0]=3 144 B10R1.363 O=C(O)C1(CCSCC1)O MCULE-8230713014 [1,0,0,0,0,0|2,0,0]=3 145 B10R1.363 [NH3+]C1(CCCCC1)C(=O)O MCULE-1248384499 [1,0,0,0,0,0|0,0,1]=2 146 B10R1.487 C#CC1(CCCCC1)OC MCULE-5811239952 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.487 C=CC1(CCOCC1)OC MCULE-6818745874 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.487 CCC1(CCCCC1)CN MCULE-4769827229 [1,0,0,0,0,0|2,0,1]=4 149 B10R1.487 CCC1(CCCNC1)CO MCULE-6591194281 [1,0,0,0,0,0|2,0,1]=4 150 B10R1.487 CCC1(CCCNC1)CO MCULE-9271145315 [1,0,0,0,0,0|2,0,1]=4 151 B10R1.487 CCC1(CCNCC1)CO MCULE-6336290340 [1,0,0,0,0,0|2,0,1]=4 152 B10R1.487 CCC1(CCNCC1)CO MCULE-7869895864 [1,0,0,0,0,0|2,0,1]=4 153 B10R1.487 CCC1(CCOCC1)CO MCULE-6335178539 [1,0,0,0,0,0|2,0,1]=4 154 B10R1.487 CNC1(CCCCC1)C#N MCULE-8588505335 [1,0,0,0,0,0|1,0,1]=3 155 B10R1.487 CNC1(CCCCC1)CN MCULE-5101210458 [1,0,0,0,0,0|1,0,1]=3 156 B10R1.487 CNC1(CCCCC1)CO MCULE-2878521476 [1,0,0,0,0,0|0,0,1]=2 157 B10R1.487 CNC1(CCCCC1)CO MCULE-7291157208 [1,0,0,0,0,0|0,0,1]=2 158 B10R1.487 CNC1(CCOCC1)CO MCULE-1617755077 [1,0,0,0,0,0|1,0,1]=3 159 B10R1.487 CNC1(CCSCC1)CO MCULE-2059879780 [1,0,0,0,0,0|1,0,1]=3 160 B10R1.487 CNC1(CCSCC1)CO MCULE-9315596120 [1,0,0,0,0,0|1,0,1]=3 161 B10R1.487 COC1(CCCCC1)C#N MCULE-5623812669 [1,0,0,0,0,0|2,0,1]=4 162 B10R1.487 COC1(CCCCC1)C=O MCULE-3270143141 [1,0,0,0,0,0|1,0,0]=2 163 B10R1.487 COC1(CCCCC1)CN MCULE-6817153076 [1,0,0,0,0,0|2,0,1]=4 164 B10R1.487 COC1(CCCCC1)CN MCULE-8837640864 [1,0,0,0,0,0|2,0,1]=4 165 B10R1.487 COC1(CCCCC1)CO MCULE-5194988278 [1,0,0,0,0,0|1,0,1]=3 166 B10R1.487 COC1(CCCCC1)OC MCULE-3730731071 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.487 COC1(CCCNC1)CO MCULE-1246674811 [1,0,0,0,0,0|2,0,1]=4 168 B10R1.487 COC1(CCCNC1)CO MCULE-8933039366 [1,0,0,0,0,0|2,0,1]=4 169 B10R1.487 COC1(CCNCC1)CO MCULE-3338391871 [1,0,0,0,0,0|2,0,1]=4 170 B10R1.487 COC1(CCNCC1)CO MCULE-5448268570 [1,0,0,0,0,0|2,0,1]=4 171 B10R1.487 COC1(CCOCC1)C=O MCULE-4311342455 [1,0,0,0,0,0|2,0,0]=3 172 B10R1.487 COC1(CCOCC1)CO MCULE-4757906992 [1,0,0,0,0,0|2,0,1]=4 173 B10R1.487 CSC1(CCCCC1)CN MCULE-1859636540 [1,0,0,0,0,0|2,0,1]=4 174 B10R1.487 CSC1(CCCCC1)CN MCULE-6441452905 [1,0,0,0,0,0|2,0,1]=4 175 B10R1.487 N#CC1(CCCCC1)CO MCULE-3295676775 [1,0,0,0,0,0|2,0,1]=4 176 B10R1.487 NCC1(CCCCC1)CO MCULE-2307493796 [1,0,0,0,0,0|2,0,1]=4 177 B10R1.487 NCC1(CCCCC1)CO MCULE-6025330717 [1,0,0,0,0,0|2,0,1]=4 178 B10R1.487 OCC1(CCCCC1)CO MCULE-3643412268 [1,0,0,0,0,0|2,0,1]=4 179 B12R1.2627 C#CCC1(CCCCC1)C(=O)O MCULE-8297559285 [0,1,0,0,0,0|1,0,1]=3 180 B12R1.2627 C#CCC1(CCCCO1)C(=O)O MCULE-8790236207 [0,1,0,0,0,0|2,0,1]=4 181 B12R1.2627 C#CCC1(CCOCC1)C(=O)O MCULE-4996566836 [0,1,0,0,0,0|2,0,1]=4 182 B12R1.2627 C=CCC1(CCCCC1)C(=O)O MCULE-6549482029 [0,1,0,0,0,0|1,0,1]=3 183 B12R1.2627 C=CCC1(CCOCC1)C(=O)O MCULE-5804147237 [0,1,0,0,0,0|2,0,1]=4 184 B12R1.2627 CCCC1(CCCNC1)C(=O)O MCULE-2714398842 [0,1,0,0,0,0|2,0,0]=3 185 B12R1.2627 CCCC1(CCCNC1)C(=O)O MCULE-3251757456 [0,1,0,0,0,0|2,0,0]=3 186 B12R1.2627 CCCC1(CCNCC1)C(=O)O MCULE-3367280064 [0,1,0,0,0,0|2,0,0]=3 187 B12R1.2627 CCCC1(CCNCC1)C(=O)O MCULE-5006003060 [0,1,0,0,0,0|2,0,0]=3 188 B12R1.2627 CCNC1(CCNCC1)C(=O)N MCULE-2664344908 [0,1,0,0,0,0|2,0,0]=3 189 B12R1.2627 CCOC1(CCOCC1)C(=O)O MCULE-1151838991 [0,1,0,0,0,0|2,0,0]=3 190 B12R1.2627 COCC1(CC=CCC1)C(=O)O MCULE-4724851687 [0,1,0,0,0,0|1,0,2]=4 191 B12R1.2627 COCC1(CCCCC1)C(=O)O MCULE-7209012226 [0,1,0,0,0,0|1,0,0]=2 192 B12R1.2627 COCC1(CCCCO1)C(=O)O MCULE-4234935408 [0,1,0,0,0,0|2,0,0]=3 193 B12R1.2627 COCC1(CCCNC1)C(=O)O MCULE-7378189237 [0,1,0,0,0,0|2,0,0]=3 194 B12R1.2627 COCC1(CCCNC1)C(=O)O MCULE-7497599762 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.2627 COCC1(CCNCC1)C(=O)O MCULE-3343949128 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.2627 COCC1(CCNCC1)C(=O)O MCULE-6152155338 [0,1,0,0,0,0|2,0,0]=3 197 B12R1.2627 COCC1(CCOCC1)C(=O)O MCULE-6381851934 [0,1,0,0,0,0|2,0,0]=3 198 B12R1.2627 O=C(O)C1(CCCCC1)CCO MCULE-2714050817 [0,1,0,0,0,0|1,0,0]=2 199 B12R1.3098 CC(C)C1(CCCCC1)C(=O)O MCULE-8924560333 [0,1,0,0,0,0|1,0,0]=2 200 B12R1.3098 CN(C)C1(CCCCC1)C(=O)N MCULE-8594603874 [0,1,0,0,0,0|1,0,0]=2 201 B12R1.3098 CN(C)C1(CCCCC1)C(=O)O MCULE-7815317778 [0,1,0,0,0,0|0,0,0]=1 202 B12R1.3098 CN(C)C1(CCCSC1)C(=O)O MCULE-5220457077 [0,1,0,0,0,0|1,0,0]=2 203 B12R1.3098 CN(C)C1(CCNCC1)C(=O)N MCULE-1180814017 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.3098 CN(C)C1(CCNCC1)C(=O)N MCULE-4941175850 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.3098 CN(C)C1(CCNCC1)C(=O)O MCULE-2460296319 [0,1,0,0,0,0|1,0,0]=2 206 B12R1.3098 CN(C)C1(CCNCC1)C(=O)O MCULE-7970769435 [0,1,0,0,0,0|1,0,0]=2 207 B12R1.3098 CN(C)C1(CCOCC1)C(=O)N MCULE-7185792327 [0,1,0,0,0,0|2,0,0]=3 208 B12R1.3098 CN(C)C1(CCSCC1)C(=O)N MCULE-1245203821 [0,1,0,0,0,0|2,0,0]=3 209 B12R1.3098 CN(C)C1(CCSCC1)C(=O)O MCULE-5790313396 [0,1,0,0,0,0|1,0,0]=2 210 B12R1.3098 NC(=O)C1(CCCCC1)C(=O)O MCULE-3106293224 [0,1,0,0,0,0|2,0,0]=3 211 B12R1.3098 O=C(O)C1(CCCCC1)C(=O)O MCULE-4011811531 [0,1,0,0,0,0|2,0,0]=3 212 B12R1.3098 O=C(O)C1(CCCCC1)C(F)F MCULE-5111818693 [0,1,0,0,0,0|2,0,0]=3 213 B12R1.3098 O=C(O)C1(CCOCC1)C(=O)O MCULE-4251495830 [0,1,0,0,0,0|3,0,0]=4 214 B12R1.3098 O=C(O)C1(CCOCC1)C(F)F MCULE-3903772181 [0,1,0,0,0,0|3,0,0]=4 215 B12R1.3454 C#CC1(CCOCC1)C(=O)OC MCULE-4214368959 [0,1,0,0,0,0|2,0,1]=4 216 B12R1.3454 CCC1(CCCNC1)C(=O)OC MCULE-3622213519 [0,1,0,0,0,0|2,0,0]=3 217 B12R1.3454 CCC1(CCCNC1)C(=O)OC MCULE-5745860758 [0,1,0,0,0,0|2,0,0]=3 218 B12R1.3454 CCC1(CCNCC1)C(=O)NC MCULE-3896685494 [0,1,0,0,0,0|3,0,0]=4 219 B12R1.3454 CCC1(CCNCC1)C(=O)NC MCULE-7738765373 [0,1,0,0,0,0|3,0,0]=4 220 B12R1.3454 CCC1(CCNCC1)C(=O)OC MCULE-4886133441 [0,1,0,0,0,0|2,0,0]=3 221 B12R1.3454 CCC1(CCNCC1)C(=O)OC MCULE-6320804594 [0,1,0,0,0,0|2,0,0]=3 222 B12R1.3454 CCC1(CCOCC1)C(=O)OC MCULE-7201588912 [0,1,0,0,0,0|2,0,0]=3 223 B12R1.3454 CNC(=O)C1(CCCCC1)CO MCULE-5098420470 [0,1,0,0,0,0|3,0,0]=4 224 B12R1.3454 CNC1(CCCCC1)C(=O)OC MCULE-9367298430 [0,1,0,0,0,0|0,0,0]=1 225 B12R1.3454 CNC1(CCOCC1)C(=O)OC MCULE-6406892588 [0,1,0,0,0,0|1,0,0]=2 226 B12R1.3454 CNC1(CCSCC1)C(=O)OC MCULE-1477781638 [0,1,0,0,0,0|1,0,0]=2 227 B12R1.3454 COC(=O)C1(CCCCC1)C#N MCULE-2044015492 [0,1,0,0,0,0|2,0,0]=3 228 B12R1.3454 COC(=O)C1(CCCCC1)C=O MCULE-4819149844 [0,1,0,0,0,0|2,0,0]=3 229 B12R1.3454 COC(=O)C1(CCCCC1)CBr MCULE-1409960472 [0,1,0,0,0,0|2,0,0]=3 230 B12R1.3454 COC(=O)C1(CCCCC1)CN MCULE-5834300968 [0,1,0,0,0,0|2,0,0]=3 231 B12R1.3454 COC(=O)C1(CCCCC1)CN MCULE-9741042571 [0,1,0,0,0,0|2,0,0]=3 232 B12R1.3454 COC(=O)C1(CCCCC1)CO MCULE-1965981989 [0,1,0,0,0,0|2,0,0]=3 233 B12R1.3454 COC(=O)C1(CCNCC1)C#N MCULE-4709516626 [0,1,0,0,0,0|3,0,0]=4 234 B12R1.3454 COC(=O)C1(CCNCC1)C#N MCULE-6271270843 [0,1,0,0,0,0|3,0,0]=4 235 B12R1.3454 COC(=O)C1(CCNCC1)CO MCULE-4187789144 [0,1,0,0,0,0|3,0,0]=4 236 B12R1.3454 COC(=O)C1(CCNCC1)CO MCULE-8823465967 [0,1,0,0,0,0|3,0,0]=4 237 B12R1.3454 COC(=O)C1(CCNCC1)OC MCULE-3284652950 [0,1,0,0,0,0|2,0,0]=3 238 B12R1.3454 COC(=O)C1(CCNCC1)OC MCULE-6767926751 [0,1,0,0,0,0|2,0,0]=3 239 B12R1.3454 COC(=O)C1(CCOCC1)C#N MCULE-9795186838 [0,1,0,0,0,0|3,0,0]=4 240 B12R1.3454 COC(=O)C1(CCOCC1)C=O MCULE-1062581649 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.3454 COC(=O)C1(CCOCC1)CBr MCULE-7141556770 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.3454 COC(=O)C1(CCOCC1)CN MCULE-1762142600 [0,1,0,0,0,0|3,0,0]=4 243 B12R1.3454 COC(=O)C1(CCOCC1)CN MCULE-3388133819 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.3454 COC(=O)C1(CCOCC1)CO MCULE-9974248887 [0,1,0,0,0,0|3,0,0]=4 245 B12R1.3454 COC(=O)C1(CCOCC1)OC MCULE-1394604300 [0,1,0,0,0,0|2,0,0]=3 246 B12R1.3824 C=CC1(CCC(=O)CC1)C(=O)O MCULE-6230553063 [0,1,0,0,0,0|1,0,2]=4 247 B12R1.3824 COC1(CCC(=O)CC1)C(=O)O MCULE-5495045531 [0,1,0,0,0,0|1,0,1]=3 248 B12R1.3824 COC1(CCN(CC1)C)C(=O)O MCULE-7945682647 [0,1,0,0,0,0|2,0,0]=3 249 B12R1.3824 N#CC1(CCC(=O)CC1)C(=O)O MCULE-5424518203 [0,1,0,0,0,0|2,0,1]=4 250 B10R0.86 CCCCCC(CC)C(=O)C MCULE-1913128605 [0,0,1,0,0,0|2,0,0]=3 251 B10R0.86 CCCCCC(CC)C(=O)O MCULE-3515775261 [0,0,1,0,0,0|1,0,0]=2 252 B10R0.86 CNC(CCCCN)C(=O)O MCULE-3351204873 [0,0,1,0,0,0|1,0,0]=2 253 B10R0.86 CNC(CCCCN)C(=O)O MCULE-6279634717 [0,0,1,0,0,0|1,0,0]=2 254 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-1289342070 [0,0,1,0,0,0|1,0,0]=2 255 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-4082358865 [0,0,1,0,0,0|1,0,0]=2 256 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-5920807456 [0,0,1,0,0,0|1,0,0]=2 257 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-9072694055 [0,0,1,0,0,0|1,0,0]=2 258 B10R0.133 C=CC(C)(CCOC)C(=O)O MCULE-4169963054 [0,0,1,0,0,0|2,0,1]=4 259 B10R0.133 CCCC[C@](N)(CC)C(=O)O MCULE-5511664944 [0,0,1,0,0,0|2,0,0]=3 260 B10R0.133 CCCC[C@](N)(CC)C(=O)O MCULE-7828282573 [0,0,1,0,0,0|2,0,0]=3 261 B12R2.8 O=C1CCCC12CCCCC2 MCULE-9298549455 [0,0,0,1,0,0|2,0,0]=3 262 B12R2.8 O=C1CCCC12CCCCO2 MCULE-1136852767 [0,0,0,1,0,0|3,0,0]=4 263 B12R2.8 O=C1CCCC12CCNCC2 MCULE-1556519667 [0,0,0,1,0,0|3,0,0]=4 264 B12R2.8 O=C1CCCC12CCNCC2 MCULE-5511389506 [0,0,0,1,0,0|3,0,0]=4 265 B12R2.8 O=C1CCCC12CCOCC2 MCULE-5216795208 [0,0,0,1,0,0|3,0,0]=4 266 B12R2.8 O=C1CCNC12CCCCC2 MCULE-2135170746 [0,0,0,1,0,0|1,0,0]=2 267 B12R2.8 O=C1CCNC12CCCCC2 MCULE-5158335905 [0,0,0,1,0,0|1,0,0]=2 268 B12R2.8 O=C1CCOC12CCCCC2 MCULE-7988152610 [0,0,0,1,0,0|2,0,0]=3 269 B12R2.8 O=C1CCOC12CCOCC2 MCULE-2523497109 [0,0,0,1,0,0|3,0,0]=4 270 B12R2.8 O=C1NCCC12CCCCC2 MCULE-6119455539 [0,0,0,1,0,0|2,0,0]=3 271 B12R2.8 O=C1NCCC12CCCCN2 MCULE-7915882875 [0,0,0,1,0,0|3,0,0]=4 272 B12R2.8 O=C1NCCC12CCCCN2 MCULE-8171160853 [0,0,0,1,0,0|3,0,0]=4 273 B12R2.8 O=C1NCCC12CCCNC2 MCULE-3093425024 [0,0,0,1,0,0|3,0,0]=4 274 B12R2.8 O=C1NCCC12CCCNC2 MCULE-5555034305 [0,0,0,1,0,0|3,0,0]=4 275 B12R2.8 O=C1NCCC12CCNCC2 MCULE-1200506011 [0,0,0,1,0,0|3,0,0]=4 276 B12R2.8 O=C1NCCC12CCNCC2 MCULE-1898782138 [0,0,0,1,0,0|3,0,0]=4 277 B12R2.8 O=C1NCCC12CCOCC2 MCULE-7988759417 [0,0,0,1,0,0|3,0,0]=4 278 B12R2.8 O=C1NCNC12CCNCC2 MCULE-2083981056 [0,0,0,1,0,0|2,0,0]=3 279 B12R2.8 O=C1NCNC12CCNCC2 MCULE-6292198792 [0,0,0,1,0,0|2,0,0]=3 280 B12R2.8 O=C1NCNC12CCNCC2 MCULE-8736749340 [0,0,0,1,0,0|2,0,0]=3 281 B12R2.8 O=C1OCCC12CCCCC2 MCULE-8668963304 [0,0,0,1,0,0|1,0,0]=2 282 B12R2.8 O=C1OCCC12CCNCC2 MCULE-3112643480 [0,0,0,1,0,0|2,0,0]=3 283 B12R2.8 O=C1OCCC12CCNCC2 MCULE-4821486023 [0,0,0,1,0,0|2,0,0]=3 284 B12R2.8 OC1CCNC12CCCCC2 MCULE-8562222246 [0,0,0,1,0,0|1,0,1]=3 285 B12R2.13 O=C1CC(=O)C12CCCCC2 MCULE-7337775084 [0,0,0,1,0,0|3,0,0]=4 286 B12R2.3099 O=C(O)C12CCCC(C1)CC2 MCULE-9196143930 [0,0,0,1,0,0|1,0,0]=2 287 B12R2.3099 O=C(O)C12CCCC(C1)CN2 MCULE-2122376026 [0,0,0,1,0,0|0,0,0]=1 288 B12R2.3099 O=C(O)C12CCCC(C1)CN2 MCULE-6451355418 [0,0,0,1,0,0|0,0,0]=1 289 B12R2.3099 O=C(O)C12CCCN(C1)CC2 MCULE-7875346485 [0,0,0,1,0,0|2,0,0]=3 290 B12R2.3099 O=C(O)C12CCCN(C1)CC2 MCULE-8048870101 [0,0,0,1,0,0|2,0,0]=3 291 B12R2.6473 CC(=O)C12CCC(CC1)CC2 MCULE-8372769811 [0,0,0,1,0,0|2,0,0]=3 292 B12R2.6473 O=C(O)C12CCC(CC1)CC2 MCULE-6885772881 [0,0,0,1,0,0|1,0,0]=2 293 B12R2.6473 O=C(O)C12CCC(CC1)CO2 MCULE-7804091182 [0,0,0,1,0,0|1,0,0]=2 294 B12R2.6473 O=C(O)C12CCC(CC1)NC2 MCULE-2868963317 [0,0,0,1,0,0|2,0,0]=3 295 B12R2.6473 O=C(O)C12CCC(CC1)NC2 MCULE-7093125138 [0,0,0,1,0,0|2,0,0]=3 296 B12R2.6473 O=C(O)C12CCC(CC1)OC2 MCULE-4415660416 [0,0,0,1,0,0|2,0,0]=3 297 B12R2.6473 O=C(O)C12CCC(CN1)OC2 MCULE-1450795756 [0,0,0,1,0,0|1,0,0]=2 298 B12R2.6473 O=C(O)C12CCC(CN1)OC2 MCULE-1728091235 [0,0,0,1,0,0|1,0,0]=2 299 B12R2.6473 O=C(O)C12CCN(CC1)CC2 MCULE-1195823178 [0,0,0,1,0,0|2,0,0]=3 300 B12R2.6473 O=C(O)C12CCN(CC1)CC2 MCULE-3362052060 [0,0,0,1,0,0|2,0,0]=3 301 B10R1.477 C#CC1(CCCC1)C(=O)O MCULE-5542543621 [0,0,0,0,1,0|1,0,1]=3 302 B10R1.477 CCC1(CCCC1)C(=O)O MCULE-5656602965 [0,0,0,0,1,0|1,0,0]=2 303 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-3641915361 [0,0,0,0,1,0|2,0,0]=3 304 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-4597310469 [0,0,0,0,1,0|2,0,0]=3 305 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-5699616237 [0,0,0,0,1,0|2,0,0]=3 306 B10R1.477 CCC1(CCCN1)C(=O)O MCULE-9288027580 [0,0,0,0,1,0|2,0,0]=3 307 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-1110693309 [0,0,0,0,1,0|2,0,0]=3 308 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-3125780437 [0,0,0,0,1,0|2,0,0]=3 309 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-3747201084 [0,0,0,0,1,0|2,0,0]=3 310 B10R1.477 CC[C@@]1(CCCN1)C(=O)O MCULE-4962257347 [0,0,0,0,1,0|2,0,0]=3 311 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-3237722025 [0,0,0,0,1,0|2,0,0]=3 312 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-4656804455 [0,0,0,0,1,0|2,0,0]=3 313 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-7911479004 [0,0,0,0,1,0|2,0,0]=3 314 B10R1.477 CC[C@]1(CCCN1)C(=O)O MCULE-8941344909 [0,0,0,0,1,0|2,0,0]=3 315 B10R1.477 CNC1(CCCC1)C(=O)N MCULE-8303519887 [0,0,0,0,1,0|1,0,0]=2 316 B10R1.477 CNC1(CCCC1)C(=O)O MCULE-1767562494 [0,0,0,0,1,0|0,0,0]=1 317 B10R1.477 CNC1(CCCC1)C(=O)O MCULE-7365959763 [0,0,0,0,1,0|0,0,0]=1 318 B10R1.477 CNC1(CCOC1)C(=O)O MCULE-7971278840 [0,0,0,0,1,0|1,0,0]=2 319 B10R1.477 CNC1(CCSC1)C(=O)N MCULE-3173742173 [0,0,0,0,1,0|2,0,0]=3 320 B10R1.477 CNC1(CCSC1)C(=O)O MCULE-1204206450 [0,0,0,0,1,0|1,0,0]=2 321 B10R1.477 COC1(CCCC1)C(=O)C MCULE-8752650901 [0,0,0,0,1,0|2,0,0]=3 322 B10R1.477 COC1(CCCC1)C(=O)Cl MCULE-6593147343 [0,0,0,0,1,0|2,0,0]=3 323 B10R1.477 COC1(CCCC1)C(=O)O MCULE-1739308870 [0,0,0,0,1,0|1,0,0]=2 324 B10R1.477 COC1(CCNC1)C(=O)O MCULE-7327143800 [0,0,0,0,1,0|2,0,0]=3 325 B10R1.477 COC1(CCNC1)C(=O)O MCULE-9120807147 [0,0,0,0,1,0|2,0,0]=3 326 B10R1.477 COC1(CCOC1)C(=O)O MCULE-5931705357 [0,0,0,0,1,0|2,0,0]=3 327 B10R1.477 COC1(CCSC1)C(=O)O MCULE-4950827658 [0,0,0,0,1,0|2,0,0]=3 328 B10R1.477 N#CC1(CCCC1)C(=O)O MCULE-1638254148 [0,0,0,0,1,0|2,0,0]=3 329 B10R1.477 N#CC1(CCOC1)C(=O)O MCULE-4615848690 [0,0,0,0,1,0|3,0,0]=4 330 B10R1.477 NCC1(CCCC1)C(=O)N MCULE-7074465709 [0,0,0,0,1,0|3,0,0]=4 331 B10R1.477 NCC1(CCCC1)C(=O)O MCULE-2746708245 [0,0,0,0,1,0|2,0,0]=3 332 B10R1.477 NCC1(CCCC1)C(=O)O MCULE-4666634845 [0,0,0,0,1,0|2,0,0]=3 333 B10R1.477 O=C(O)C1(CCCC1)CO MCULE-7987056998 [0,0,0,0,1,0|2,0,0]=3 334 B10R1.477 O=C(O)C1(CCCO1)CO MCULE-7539008546 [0,0,0,0,1,0|3,0,0]=4 335 B12R1.2346 COC1(CCCCCC1)C(=O)O MCULE-8474203191 [0,0,0,0,0,1|1,0,0]=2 336 B12R1.3862 C#CC1(CCCCC1)NC(=O)C MCULE-1647999894 [0,0,0,0,0,1|2,0,1]=4 337 B12R1.3862 C#CC1(CCCCC1)NC(=O)N MCULE-5077005697 [0,0,0,0,0,1|2,0,1]=4 338 B12R1.3862 C#CC1(CCCCC1)OC(=O)N MCULE-2780446623 [0,0,0,0,0,1|2,0,1]=4 339 B12R1.3862 C=CC1(CCCCC1)CC(=O)O MCULE-4180815907 [0,0,0,0,0,1|1,0,1]=3 340 B12R1.3862 C=CC1(CCOCC1)CC(=O)O MCULE-6161182720 [0,0,0,0,0,1|2,0,1]=4 341 B12R1.3862 CC(=O)NC1(CCCCC1)C#N MCULE-6563066219 [0,0,0,0,0,1|3,0,0]=4 342 B12R1.3862 CCC1(CCOCC1)CC(=O)O MCULE-1274569934 [0,0,0,0,0,1|2,0,0]=3 343 B12R1.3862 CNC1(CCCCC1)CC(=O)O MCULE-1231263579 [0,0,0,0,0,1|0,0,0]=1 344 B12R1.3862 CNC1(CCCCC1)CC(=O)O MCULE-9425170049 [0,0,0,0,0,1|0,0,0]=1 345 B12R1.3862 N#CC1(CCCCC1)CC(=O)O MCULE-7945776155 [0,0,0,0,0,1|2,0,0]=3 346 B12R1.3862 N#CC1(CCOCC1)CC(=O)O MCULE-6362533888 [0,0,0,0,0,1|3,0,0]=4 347 B12R1.3862 NCC1(CCCCC1)CC(=O)N MCULE-6032002626 [0,0,0,0,0,1|3,0,0]=4 348 B12R1.3862 NCC1(CCCCC1)CC(=O)N MCULE-9141931500 [0,0,0,0,0,1|3,0,0]=4 349 B12R1.3862 NCC1(CCCCC1)CC(=O)O MCULE-4071359359 [0,0,0,0,0,1|2,0,0]=3 350 B12R1.3862 NCC1(CCCCC1)CC(=O)O MCULE-5392848565 [0,0,0,0,0,1|2,0,0]=3 351 B12R1.3862 NCC1(CCOCC1)CC(=O)O MCULE-6787867866 [0,0,0,0,0,1|3,0,0]=4 352 B12R1.3862 NCC1(CCOCC1)CC(=O)O MCULE-6947108641 [0,0,0,0,0,1|3,0,0]=4 353 B12R1.3862 O=C(O)CC1(CCCCC1)CO MCULE-7582955995 [0,0,0,0,0,1|2,0,0]=3 354 B12R1.3862 O=C([O-])CC1(CCCCC1)CO MCULE-2058287343 [0,0,0,0,0,1|2,0,1]=4 355 B9R0.13 CCC(CCOC)C(=O)O MCULE-9329790915 [1,0,1,0,0,0|2,0,0]=4 356 B9R0.13 CCCCC(CC)C(=O)C MCULE-6594996935 [1,0,1,0,0,0|2,0,0]=4 357 B9R0.13 CCCCC(CC)C(=O)Cl MCULE-5129133966 [1,0,1,0,0,0|2,0,0]=4 358 B9R0.13 CCCCC(CC)C(=O)N MCULE-6741704780 [1,0,1,0,0,0|2,0,0]=4 359 B9R0.13 CCCCC(CC)C(=O)O MCULE-5686478683 [1,0,1,0,0,0|1,0,0]=3 360 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6405828438 [1,0,1,0,0,0|1,0,1]=4 361 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6841285360 [1,0,1,0,0,0|1,0,1]=4 362 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-9345456808 [1,0,1,0,0,0|1,0,1]=4 363 B9R0.13 CCCCC(CN)C(=O)O MCULE-6509321720 [1,0,1,0,0,0|2,0,0]=4 364 B9R0.13 CCCCC(CO)C(=O)O MCULE-7586035948 [1,0,1,0,0,0|2,0,0]=4 365 B9R0.13 CCCCC(NC)C(=O)N MCULE-5960268514 [1,0,1,0,0,0|1,0,0]=3 366 B9R0.13 CCCCC(NC)C(=O)O MCULE-1290797295 [1,0,1,0,0,0|0,0,0]=2 367 B9R0.13 CCCCC(OC)C(=O)O MCULE-4251070702 [1,0,1,0,0,0|1,0,0]=3 368 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-3017621334 [1,0,1,0,0,0|1,0,0]=3 369 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-9782965208 [1,0,1,0,0,0|1,0,0]=3 370 B9R0.13 CCCC[C@@H](CN)C(=O)O MCULE-8769717308 [1,0,1,0,0,0|2,0,0]=4 371 B9R0.13 CCCC[C@@H](CO)C(=O)O MCULE-4035754044 [1,0,1,0,0,0|2,0,0]=4 372 B9R0.13 CCCC[C@H](CC)C(=O)O MCULE-7435371149 [1,0,1,0,0,0|1,0,0]=3 373 B9R0.13 CCCC[C@H](CN)C(=O)O MCULE-3507398764 [1,0,1,0,0,0|2,0,0]=4 374 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-1956509117 [1,0,1,0,0,0|2,0,0]=4 375 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-3776577040 [1,0,1,0,0,0|2,0,0]=4 376 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-2734051077 [1,0,1,0,0,0|0,0,0]=2 377 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-3251368399 [1,0,1,0,0,0|0,0,0]=2 378 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-5821422660 [1,0,1,0,0,0|0,0,0]=2 379 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-6933942099 [1,0,1,0,0,0|0,0,0]=2 380 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-3425842174 [1,0,1,0,0,0|1,0,0]=3 381 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-5957010617 [1,0,1,0,0,0|1,0,0]=3 382 B9R0.13 CN[C@@H](CCSC)C(=O)O MCULE-4656254779 [1,0,1,0,0,0|1,0,0]=3 383 B9R0.13 CN[C@@H](CCSC)C(=O)O MCULE-9180929954 [1,0,1,0,0,0|1,0,0]=3 384 B9R0.13 COC(CCSC)C(=O)O MCULE-2968161259 [1,0,1,0,0,0|2,0,0]=4 385 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-1522125822 [1,0,1,0,0,0|0,0,2]=4 386 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-2184948430 [1,0,1,0,0,0|0,0,2]=4 387 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-3478575968 [1,0,1,0,0,0|0,0,2]=4 388 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-5307313414 [1,0,1,0,0,0|0,0,2]=4 389 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [1,0,1,0,0,0|1,0,0]=3 390 B9R0.47 C=CCCCC(N)C(=O)O MCULE-3707920281 [1,0,1,0,0,0|0,0,2]=4 391 B9R0.47 C=CCCCC(N)C(=O)O MCULE-5939027667 [1,0,1,0,0,0|0,0,2]=4 392 B9R0.47 C=CCCCC(N)C(=O)O MCULE-6095387409 [1,0,1,0,0,0|0,0,2]=4 393 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-2101628204 [1,0,1,0,0,0|0,0,2]=4 394 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-7328150693 [1,0,1,0,0,0|0,0,2]=4 395 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-1162071877 [1,0,1,0,0,0|0,0,2]=4 396 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-7245809917 [1,0,1,0,0,0|0,0,2]=4 397 B9R0.47 CC(CSCCN)C(=O)O MCULE-8181129041 [1,0,1,0,0,0|2,0,0]=4 398 B9R0.47 CC(CSCCN)C(=O)O MCULE-9927031234 [1,0,1,0,0,0|2,0,0]=4 399 B9R0.47 CCCCCC(=O)C(=O)O MCULE-2334480456 [1,0,1,0,0,0|1,0,1]=4 400 B9R0.47 CCCCCC(C)C(=O)C MCULE-8141962187 [1,0,1,0,0,0|1,0,0]=3 401 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [1,0,1,0,0,0|0,0,0]=2 402 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [1,0,1,0,0,0|0,0,0]=2 403 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [1,0,1,0,0,0|0,0,0]=2 404 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [1,0,1,0,0,0|1,0,0]=3 405 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [1,0,1,0,0,0|0,0,0]=2 406 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [1,0,1,0,0,0|0,0,0]=2 407 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [1,0,1,0,0,0|0,0,0]=2 408 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [1,0,1,0,0,0|0,0,0]=2 409 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [1,0,1,0,0,0|1,0,0]=3 410 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [1,0,1,0,0,0|1,0,0]=3 411 B9R0.47 CCCSCC(N)C(=O)O MCULE-1465196294 [1,0,1,0,0,0|1,0,0]=3 412 B9R0.47 CCCSCC(N)C(=O)O MCULE-2196835186 [1,0,1,0,0,0|1,0,0]=3 413 B9R0.47 CCCSC[C@H](N)C(=O)O MCULE-2274873569 [1,0,1,0,0,0|1,0,0]=3 414 B9R0.47 CCNCCC(N)C(=O)O MCULE-8873123795 [1,0,1,0,0,0|1,0,0]=3 415 B9R0.47 CCSCCC(N)C(=O)O MCULE-8503033566 [1,0,1,0,0,0|1,0,0]=3 416 B9R0.47 CCSCCC(N)C(=O)O MCULE-9465623190 [1,0,1,0,0,0|1,0,0]=3 417 B9R0.47 CCSCC[C@@H](N)C(=O)O MCULE-2836325620 [1,0,1,0,0,0|1,0,0]=3 418 B9R0.47 CCSCC[C@H](N)C(=O)O MCULE-6614300528 [1,0,1,0,0,0|1,0,0]=3 419 B9R0.47 CC[Se]CCC(N)C(=O)O MCULE-7426703933 [1,0,1,0,0,0|1,0,0]=3 420 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [1,0,1,0,0,0|1,0,0]=3 421 B9R0.47 COCCNC(C)C(=O)O MCULE-1762428923 [1,0,1,0,0,0|2,0,0]=4 422 B9R0.47 COCCNC(C)C(=O)O MCULE-8532368084 [1,0,1,0,0,0|2,0,0]=4 423 B9R0.47 COCCOC(C)C(=O)O MCULE-5271320344 [1,0,1,0,0,0|2,0,0]=4 424 B9R0.47 CSCCOC(C)C(=O)O MCULE-2180057271 [1,0,1,0,0,0|2,0,0]=4 425 B9R0.47 CSCSC[C@H](N)C(=O)O MCULE-2792975111 [1,0,1,0,0,0|2,0,0]=4 426 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [1,0,1,0,0,0|1,0,0]=3 427 B9R0.47 NC(CSCCO)C(=O)O MCULE-9765321939 [1,0,1,0,0,0|2,0,0]=4 428 B9R0.47 NCCCCC(N)C(=O)N MCULE-5695768231 [1,0,1,0,0,0|2,0,0]=4 429 B9R0.47 NCCCCC(N)C(=O)N MCULE-8502146041 [1,0,1,0,0,0|2,0,0]=4 430 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [1,0,1,0,0,0|1,0,0]=3 431 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [1,0,1,0,0,0|1,0,0]=3 432 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [1,0,1,0,0,0|1,0,0]=3 433 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [1,0,1,0,0,0|1,0,0]=3 434 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [1,0,1,0,0,0|1,0,0]=3 435 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [1,0,1,0,0,0|1,0,0]=3 436 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [1,0,1,0,0,0|1,0,0]=3 437 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [1,0,1,0,0,0|1,0,0]=3 438 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [1,0,1,0,0,0|1,0,0]=3 439 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-2490465776 [1,0,1,0,0,0|2,0,0]=4 440 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-5523101334 [1,0,1,0,0,0|2,0,0]=4 441 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-7682920289 [1,0,1,0,0,0|2,0,0]=4 442 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-9381942600 [1,0,1,0,0,0|2,0,0]=4 443 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [1,0,1,0,0,0|1,0,0]=3 444 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [1,0,1,0,0,0|1,0,0]=3 445 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [1,0,1,0,0,0|1,0,0]=3 446 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [1,0,1,0,0,0|1,0,0]=3 447 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [1,0,1,0,0,0|1,0,0]=3 448 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [1,0,1,0,0,0|1,0,0]=3 449 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [1,0,1,0,0,0|1,0,0]=3 450 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [1,0,1,0,0,0|1,0,0]=3 451 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [1,0,1,0,0,0|1,0,0]=3 452 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [1,0,1,0,0,0|1,0,0]=3 453 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [1,0,1,0,0,0|1,0,0]=3 454 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [1,0,1,0,0,0|1,0,1]=4 455 B9R0.47 NCCOCC(N)C(=O)O MCULE-7224841130 [1,0,1,0,0,0|2,0,0]=4 456 B9R0.47 NCCOCC(N)C(=O)O MCULE-7654083918 [1,0,1,0,0,0|2,0,0]=4 457 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4415047402 [1,0,1,0,0,0|2,0,0]=4 458 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4663780920 [1,0,1,0,0,0|2,0,0]=4 459 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4696145098 [1,0,1,0,0,0|2,0,0]=4 460 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-9286897415 [1,0,1,0,0,0|2,0,0]=4 461 B9R0.47 NCCSCC(N)C(=O)O MCULE-5256853681 [1,0,1,0,0,0|2,0,0]=4 462 B9R0.47 NCCSCC(N)C(=O)O MCULE-7420723141 [1,0,1,0,0,0|2,0,0]=4 463 B9R0.47 NCCSCC(N)C(=O)O MCULE-9409306380 [1,0,1,0,0,0|2,0,0]=4 464 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-3159724083 [1,0,1,0,0,0|2,0,0]=4 465 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-4836746198 [1,0,1,0,0,0|2,0,0]=4 466 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6032940560 [1,0,1,0,0,0|2,0,0]=4 467 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6994785146 [1,0,1,0,0,0|2,0,0]=4 468 B9R0.47 NCC[Se]C[C@H](N)C(=O)O MCULE-1630938680 [1,0,1,0,0,0|2,0,0]=4 469 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [1,0,1,0,0,0|1,0,0]=3 470 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [1,0,1,0,0,0|1,0,0]=3 471 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-2690192301 [1,0,1,0,0,0|2,0,0]=4 472 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-8331389811 [1,0,1,0,0,0|2,0,0]=4 473 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9071251692 [1,0,1,0,0,0|2,0,0]=4 474 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9613387165 [1,0,1,0,0,0|2,0,0]=4 475 B9R0.47 N[C@@H](CSCCO)C(=O)O MCULE-4219102659 [1,0,1,0,0,0|2,0,0]=4 476 B9R0.47 N[C@H](CSCCO)C(=O)O MCULE-6379323435 [1,0,1,0,0,0|2,0,0]=4 477 B9R0.47 O=C(O)C(Br)CCCCBr MCULE-9265332965 [1,0,1,0,0,0|2,0,0]=4 478 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [1,0,1,0,0,0|1,0,0]=3 479 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [1,0,1,0,0,0|1,0,0]=3 480 B9R0.47 [C@H](N)(CCNCC)C(=O)O MCULE-8327043663 [1,0,1,0,0,0|1,0,0]=3 481 B9R0.50 CCCCCC(C=O)CC MCULE-2036961521 [1,0,1,0,0,0|1,0,0]=3 482 B9R0.74 CCC(N)(COC)C(=O)O MCULE-1112258412 [1,0,1,0,0,0|1,0,0]=3 483 B9R0.74 CCC(N)(COC)C(=O)O MCULE-3146530110 [1,0,1,0,0,0|1,0,0]=3 484 B9R0.74 CCCC(C)(CC)C(=O)C MCULE-3275508969 [1,0,1,0,0,0|1,0,0]=3 485 B9R0.74 CCCC(C)(CC)C(=O)O MCULE-2557760328 [1,0,1,0,0,0|0,0,0]=2 486 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-2758260935 [1,0,1,0,0,0|0,0,0]=2 487 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-6297600490 [1,0,1,0,0,0|0,0,0]=2 488 B9R0.74 CNC(C)(COC)C(=O)O MCULE-1951800408 [1,0,1,0,0,0|1,0,0]=3 489 B9R0.74 CNC(C)(COC)C(=O)O MCULE-6037506715 [1,0,1,0,0,0|1,0,0]=3 490 B9R0.74 COCC(C)(OC)C(=O)O MCULE-5307101549 [1,0,1,0,0,0|2,0,0]=4 491 B9R0.78 CCC(C#N)(CC)C(=O)O MCULE-4469512703 [1,0,1,0,0,0|2,0,0]=4 492 B9R0.78 CCC(CC)(CC)C(=O)O MCULE-4084421366 [1,0,1,0,0,0|1,0,0]=3 493 B9R0.78 CCC(CC)(CN)C(=O)O MCULE-4095004267 [1,0,1,0,0,0|2,0,0]=4 494 B9R0.78 CCC(CC)(CN)C(=O)O MCULE-9385355534 [1,0,1,0,0,0|2,0,0]=4 495 B9R0.78 CCC(CC)(CO)C(=O)O MCULE-5860910537 [1,0,1,0,0,0|2,0,0]=4 496 B9R0.51 C=CCCC(C)(C)C(=O)O MCULE-1492058519 [1,0,1,0,0,0|0,0,2]=4 497 B9R0.51 C=CCC[C@@](C)(N)C(=O)O MCULE-8852684173 [1,0,1,0,0,0|0,0,2]=4 498 B9R0.51 C=CCC[C@](C)(N)C(=O)O MCULE-1635647275 [1,0,1,0,0,0|0,0,2]=4 499 B9R0.51 CC(C)(CCC#N)C(=O)O MCULE-6179801954 [1,0,1,0,0,0|1,0,1]=4 500 B9R0.51 CC(C)(CCCO)C(=O)O MCULE-8432032551 [1,0,1,0,0,0|1,0,0]=3 501 B9R0.51 CC(C)(CCCO)C(=O)[O-] MCULE-7948640149 [1,0,1,0,0,0|1,0,1]=4 502 B9R0.51 CC(C)(OCCO)C(=O)O MCULE-7350629526 [1,0,1,0,0,0|2,0,0]=4 503 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-3848172930 [1,0,1,0,0,0|1,0,0]=3 504 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-8569683447 [1,0,1,0,0,0|1,0,0]=3 505 B9R0.51 CCCCC(C)(C)C(=O)C MCULE-3392309275 [1,0,1,0,0,0|1,0,0]=3 506 B9R0.51 CCCCC(C)(C)C(=O)O MCULE-6533628152 [1,0,1,0,0,0|0,0,0]=2 507 B9R0.51 CCCCC(C)(F)C(=O)O MCULE-3264455202 [1,0,1,0,0,0|1,0,0]=3 508 B9R0.51 CCCCC(C)(O)C(=O)O MCULE-4036610380 [1,0,1,0,0,0|1,0,0]=3 509 B9R0.51 CCCCC(F)(F)C(=O)O MCULE-3383573238 [1,0,1,0,0,0|2,0,0]=4 510 B9R0.51 CCOCC(C)(C)C(=O)O MCULE-3248915686 [1,0,1,0,0,0|1,0,0]=3 511 B9R0.51 COCCC(C)(C)C(=O)O MCULE-6792174270 [1,0,1,0,0,0|1,0,0]=3 512 B9R0.51 COCCC(C)(N)C(=O)O MCULE-5241047385 [1,0,1,0,0,0|1,0,0]=3 513 B9R1.6 C1(CC=CCC1)C(=O)O MCULE-7139174666 [2,0,0,0,0,0|0,0,2]=4 514 B9R1.6 C1(CCCNC1)C(=O)N MCULE-1974021716 [2,0,0,0,0,0|2,0,0]=4 515 B9R1.6 C1(CCCNC1)C(=O)N MCULE-3484822743 [2,0,0,0,0,0|2,0,0]=4 516 B9R1.6 C1(CCCNC1)C(=O)O MCULE-5804171064 [2,0,0,0,0,0|1,0,0]=3 517 B9R1.6 C1(CNCCN1)C(=O)O MCULE-2145678876 [2,0,0,0,0,0|2,0,0]=4 518 B9R1.6 C1(CNCCN1)C(=O)O MCULE-9477513225 [2,0,0,0,0,0|2,0,0]=4 519 B9R1.6 C1(COCCN1)C(=O)O MCULE-7653061162 [2,0,0,0,0,0|2,0,0]=4 520 B9R1.6 C1(COCCN1)C(=O)O MCULE-8375563970 [2,0,0,0,0,0|2,0,0]=4 521 B9R1.6 CC(=O)C1CCCCC1 MCULE-3582349091 [2,0,0,0,0,0|1,0,0]=3 522 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [2,0,0,0,0,0|2,0,0]=4 523 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [2,0,0,0,0,0|2,0,0]=4 524 B9R1.6 CC(=O)C1CCCCO1 MCULE-6292051941 [2,0,0,0,0,0|2,0,0]=4 525 B9R1.6 CC(=O)C1CCCNC1 MCULE-5048287619 [2,0,0,0,0,0|2,0,0]=4 526 B9R1.6 CC(=O)C1CCCNC1 MCULE-7308448482 [2,0,0,0,0,0|2,0,0]=4 527 B9R1.6 CC(=O)C1CCCOC1 MCULE-8355092375 [2,0,0,0,0,0|2,0,0]=4 528 B9R1.6 CC(=O)C1CCNCC1 MCULE-5629644359 [2,0,0,0,0,0|2,0,0]=4 529 B9R1.6 CC(=O)C1CCNCC1 MCULE-7994490746 [2,0,0,0,0,0|2,0,0]=4 530 B9R1.6 CC(=O)C1CCOCC1 MCULE-4829713073 [2,0,0,0,0,0|2,0,0]=4 531 B9R1.6 CC(=O)C1CCSCC1 MCULE-1825777359 [2,0,0,0,0,0|2,0,0]=4 532 B9R1.6 CC(=O)N1CCCCC1 MCULE-2376049669 [2,0,0,0,0,0|2,0,0]=4 533 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [2,0,0,0,0,0|2,0,0]=4 534 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [2,0,0,0,0,0|2,0,0]=4 535 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [2,0,0,0,0,0|2,0,0]=4 536 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [2,0,0,0,0,0|2,0,0]=4 537 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [2,0,0,0,0,0|1,0,1]=4 538 B9R1.6 CS(=O)C1CCCCC1 MCULE-4263908685 [2,0,0,0,0,0|2,0,0]=4 539 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [2,0,0,0,0,0|1,0,1]=4 540 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [2,0,0,0,0,0|1,0,1]=4 541 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [2,0,0,0,0,0|1,0,1]=4 542 B9R1.6 N=C(N)C1CCCCC1 MCULE-3107787417 [2,0,0,0,0,0|2,0,0]=4 543 B9R1.6 N=C(N)C1CCCCC1 MCULE-9030561972 [2,0,0,0,0,0|2,0,0]=4 544 B9R1.6 NC(=O)C1CCCCC1 MCULE-8611311863 [2,0,0,0,0,0|1,0,0]=3 545 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [2,0,0,0,0,0|2,0,0]=4 546 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [2,0,0,0,0,0|2,0,0]=4 547 B9R1.6 NC(=O)C1CCCNC1 MCULE-1833696438 [2,0,0,0,0,0|2,0,0]=4 548 B9R1.6 NC(=O)C1CCCNC1 MCULE-5902080067 [2,0,0,0,0,0|2,0,0]=4 549 B9R1.6 NC(=O)C1CCCOC1 MCULE-3754898627 [2,0,0,0,0,0|2,0,0]=4 550 B9R1.6 NC(=O)C1CCNCC1 MCULE-8206211805 [2,0,0,0,0,0|2,0,0]=4 551 B9R1.6 NC(=O)C1CCNCC1 MCULE-8840746533 [2,0,0,0,0,0|2,0,0]=4 552 B9R1.6 NC(=O)C1CCOCC1 MCULE-1626473774 [2,0,0,0,0,0|2,0,0]=4 553 B9R1.6 NC(=O)N1CCCCC1 MCULE-9935688246 [2,0,0,0,0,0|2,0,0]=4 554 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-1302948446 [2,0,0,0,0,0|2,0,0]=4 555 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-3790099707 [2,0,0,0,0,0|2,0,0]=4 556 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-4105759578 [2,0,0,0,0,0|2,0,0]=4 557 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-6022899132 [2,0,0,0,0,0|2,0,0]=4 558 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [2,0,0,0,0,0|2,0,0]=4 559 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-3568267883 [2,0,0,0,0,0|2,0,0]=4 560 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-6403292667 [2,0,0,0,0,0|2,0,0]=4 561 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-7433087477 [2,0,0,0,0,0|2,0,0]=4 562 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-9069766695 [2,0,0,0,0,0|2,0,0]=4 563 B9R1.6 NC(=S)C1CCCCC1 MCULE-8109334870 [2,0,0,0,0,0|1,1,0]=4 564 B9R1.6 O=C(Cl)C1CCCCC1 MCULE-5867897390 [2,0,0,0,0,0|1,0,0]=3 565 B9R1.6 O=C(Cl)C1CCCCO1 MCULE-2871405989 [2,0,0,0,0,0|2,0,0]=4 566 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-6549888109 [2,0,0,0,0,0|2,0,0]=4 567 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-7154842850 [2,0,0,0,0,0|2,0,0]=4 568 B9R1.6 O=C(Cl)C1CCOCC1 MCULE-5435965006 [2,0,0,0,0,0|2,0,0]=4 569 B9R1.6 O=C(Cl)C1CCSCC1 MCULE-2089111376 [2,0,0,0,0,0|2,0,0]=4 570 B9R1.6 O=C(Cl)N1CCCCC1 MCULE-8197895576 [2,0,0,0,0,0|2,0,0]=4 571 B9R1.6 O=C(O)C1=CCCCC1 MCULE-1482472372 [2,0,0,0,0,0|0,0,2]=4 572 B9R1.6 O=C(O)C1C=CCCC1 MCULE-7827178223 [2,0,0,0,0,0|0,0,2]=4 573 B9R1.6 O=C(O)C1CC=CCC1 MCULE-6262725586 [2,0,0,0,0,0|0,0,2]=4 574 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [2,0,0,0,0,0|0,0,0]=2 575 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [2,0,0,0,0,0|1,0,0]=3 576 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [2,0,0,0,0,0|1,0,0]=3 577 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [2,0,0,0,0,0|1,0,0]=3 578 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [2,0,0,0,0,0|1,0,0]=3 579 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [2,0,0,0,0,0|1,0,0]=3 580 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [2,0,0,0,0,0|1,0,0]=3 581 B9R1.6 O=C(O)C1CCCNC1 MCULE-3189529983 [2,0,0,0,0,0|1,0,0]=3 582 B9R1.6 O=C(O)C1CCCNC1 MCULE-5698100100 [2,0,0,0,0,0|1,0,0]=3 583 B9R1.6 O=C(O)C1CCCNC1 MCULE-9486003126 [2,0,0,0,0,0|1,0,0]=3 584 B9R1.6 O=C(O)C1CCCNN1 MCULE-1480488255 [2,0,0,0,0,0|2,0,0]=4 585 B9R1.6 O=C(O)C1CCCNN1 MCULE-3054116225 [2,0,0,0,0,0|2,0,0]=4 586 B9R1.6 O=C(O)C1CCCOC1 MCULE-3431951803 [2,0,0,0,0,0|1,0,0]=3 587 B9R1.6 O=C(O)C1CCCSC1 MCULE-1777528306 [2,0,0,0,0,0|1,0,0]=3 588 B9R1.6 O=C(O)C1CCNCC1 MCULE-5699874022 [2,0,0,0,0,0|1,0,0]=3 589 B9R1.6 O=C(O)C1CCNCC1 MCULE-7477545245 [2,0,0,0,0,0|1,0,0]=3 590 B9R1.6 O=C(O)C1CCOCC1 MCULE-4725122837 [2,0,0,0,0,0|1,0,0]=3 591 B9R1.6 O=C(O)C1CCOCN1 MCULE-2724570105 [2,0,0,0,0,0|2,0,0]=4 592 B9R1.6 O=C(O)C1CCOCN1 MCULE-7891527992 [2,0,0,0,0,0|2,0,0]=4 593 B9R1.6 O=C(O)C1CCSCC1 MCULE-5031108601 [2,0,0,0,0,0|1,0,0]=3 594 B9R1.6 O=C(O)C1CCSCN1 MCULE-7351632016 [2,0,0,0,0,0|2,0,0]=4 595 B9R1.6 O=C(O)C1CCSCN1 MCULE-7786919982 [2,0,0,0,0,0|2,0,0]=4 596 B9R1.6 O=C(O)C1CNCCN1 MCULE-2689074129 [2,0,0,0,0,0|2,0,0]=4 597 B9R1.6 O=C(O)C1CNCCN1 MCULE-4697614875 [2,0,0,0,0,0|2,0,0]=4 598 B9R1.6 O=C(O)C1CNCCN1 MCULE-7015381558 [2,0,0,0,0,0|2,0,0]=4 599 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [2,0,0,0,0,0|2,0,0]=4 600 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [2,0,0,0,0,0|2,0,0]=4 601 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [2,0,0,0,0,0|2,0,0]=4 602 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [2,0,0,0,0,0|2,0,0]=4 603 B9R1.6 O=C(O)C1CNCCS1 MCULE-3981762124 [2,0,0,0,0,0|2,0,0]=4 604 B9R1.6 O=C(O)C1CNCCS1 MCULE-4631923202 [2,0,0,0,0,0|2,0,0]=4 605 B9R1.6 O=C(O)C1COCCN1 MCULE-2235592409 [2,0,0,0,0,0|2,0,0]=4 606 B9R1.6 O=C(O)C1COCCN1 MCULE-6865044459 [2,0,0,0,0,0|2,0,0]=4 607 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [2,0,0,0,0,0|2,0,0]=4 608 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [2,0,0,0,0,0|2,0,0]=4 609 B9R1.6 O=C(O)C1COCOC1 MCULE-4867087023 [2,0,0,0,0,0|2,0,0]=4 610 B9R1.6 O=C(O)C1CSCCN1 MCULE-4003309722 [2,0,0,0,0,0|2,0,0]=4 611 B9R1.6 O=C(O)C1CSCCN1 MCULE-5519716572 [2,0,0,0,0,0|2,0,0]=4 612 B9R1.6 O=C(O)C1CSCCS1 MCULE-6267524662 [2,0,0,0,0,0|2,0,0]=4 613 B9R1.6 O=C(O)C1NCCCS1 MCULE-7316372918 [2,0,0,0,0,0|2,0,0]=4 614 B9R1.6 O=C(O)C1OCCCO1 MCULE-6505925267 [2,0,0,0,0,0|2,0,0]=4 615 B9R1.6 O=C(O)C1SCCCS1 MCULE-6447130734 [2,0,0,0,0,0|2,0,0]=4 616 B9R1.6 O=C(O)N1CCCCC1 MCULE-2727154893 [2,0,0,0,0,0|1,0,0]=3 617 B9R1.6 O=C(O)N1CCCCC1 MCULE-4559010344 [2,0,0,0,0,0|1,0,0]=3 618 B9R1.6 O=C(O)N1CCNCC1 MCULE-3508385346 [2,0,0,0,0,0|2,0,0]=4 619 B9R1.6 O=C(O)N1CCOCC1 MCULE-7938310937 [2,0,0,0,0,0|2,0,0]=4 620 B9R1.6 O=C(O)N1CCSCC1 MCULE-4867596495 [2,0,0,0,0,0|2,0,0]=4 621 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-1597942572 [2,0,0,0,0,0|0,0,2]=4 622 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-6215840629 [2,0,0,0,0,0|0,0,2]=4 623 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [2,0,0,0,0,0|1,0,0]=3 624 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [2,0,0,0,0,0|1,0,0]=3 625 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [2,0,0,0,0,0|1,0,0]=3 626 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [2,0,0,0,0,0|1,0,0]=3 627 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [2,0,0,0,0,0|1,0,0]=3 628 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [2,0,0,0,0,0|1,0,0]=3 629 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-3206278693 [2,0,0,0,0,0|1,0,0]=3 630 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-5509362549 [2,0,0,0,0,0|1,0,0]=3 631 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-8357747886 [2,0,0,0,0,0|1,0,0]=3 632 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-9156802088 [2,0,0,0,0,0|1,0,0]=3 633 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-1404699605 [2,0,0,0,0,0|2,0,0]=4 634 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-4463982289 [2,0,0,0,0,0|2,0,0]=4 635 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-6113826647 [2,0,0,0,0,0|2,0,0]=4 636 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-8270310960 [2,0,0,0,0,0|1,0,0]=3 637 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-9211958407 [2,0,0,0,0,0|1,0,0]=3 638 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-2545046706 [2,0,0,0,0,0|2,0,0]=4 639 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-5694807182 [2,0,0,0,0,0|2,0,0]=4 640 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7177432982 [2,0,0,0,0,0|2,0,0]=4 641 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7413709257 [2,0,0,0,0,0|2,0,0]=4 642 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [2,0,0,0,0,0|2,0,0]=4 643 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [2,0,0,0,0,0|2,0,0]=4 644 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [2,0,0,0,0,0|2,0,0]=4 645 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [2,0,0,0,0,0|2,0,0]=4 646 B9R1.6 O=C(O)[C@@H]1CNCCS1 MCULE-6650545170 [2,0,0,0,0,0|2,0,0]=4 647 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-1789021231 [2,0,0,0,0,0|2,0,0]=4 648 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-4026574279 [2,0,0,0,0,0|2,0,0]=4 649 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-7736477261 [2,0,0,0,0,0|2,0,0]=4 650 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-8166049277 [2,0,0,0,0,0|2,0,0]=4 651 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [2,0,0,0,0,0|2,0,0]=4 652 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [2,0,0,0,0,0|2,0,0]=4 653 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-3905601111 [2,0,0,0,0,0|2,0,0]=4 654 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9668825603 [2,0,0,0,0,0|2,0,0]=4 655 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9675980130 [2,0,0,0,0,0|2,0,0]=4 656 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-5009469360 [2,0,0,0,0,0|0,0,2]=4 657 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-9797420475 [2,0,0,0,0,0|0,0,2]=4 658 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [2,0,0,0,0,0|1,0,0]=3 659 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [2,0,0,0,0,0|1,0,0]=3 660 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [2,0,0,0,0,0|1,0,0]=3 661 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [2,0,0,0,0,0|1,0,0]=3 662 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [2,0,0,0,0,0|1,0,0]=3 663 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [2,0,0,0,0,0|1,0,0]=3 664 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-5644771403 [2,0,0,0,0,0|1,0,0]=3 665 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-6473613352 [2,0,0,0,0,0|1,0,0]=3 666 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-7395918259 [2,0,0,0,0,0|1,0,0]=3 667 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-8202628107 [2,0,0,0,0,0|1,0,0]=3 668 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-5460978548 [2,0,0,0,0,0|2,0,0]=4 669 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-6296084302 [2,0,0,0,0,0|2,0,0]=4 670 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-3913162278 [2,0,0,0,0,0|1,0,0]=3 671 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-4021468329 [2,0,0,0,0,0|1,0,0]=3 672 B9R1.6 O=C(O)[C@H]1CCCSC1 MCULE-1373166628 [2,0,0,0,0,0|1,0,0]=3 673 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-2073761586 [2,0,0,0,0,0|2,0,0]=4 674 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-3099021896 [2,0,0,0,0,0|2,0,0]=4 675 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-5862899979 [2,0,0,0,0,0|2,0,0]=4 676 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-8591926633 [2,0,0,0,0,0|2,0,0]=4 677 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-9781518658 [2,0,0,0,0,0|2,0,0]=4 678 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [2,0,0,0,0,0|2,0,0]=4 679 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [2,0,0,0,0,0|2,0,0]=4 680 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [2,0,0,0,0,0|2,0,0]=4 681 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [2,0,0,0,0,0|2,0,0]=4 682 B9R1.6 O=C(O)[C@H]1CNCCS1 MCULE-7818958113 [2,0,0,0,0,0|2,0,0]=4 683 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-2388461804 [2,0,0,0,0,0|2,0,0]=4 684 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-3810653827 [2,0,0,0,0,0|2,0,0]=4 685 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-6589310258 [2,0,0,0,0,0|2,0,0]=4 686 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-9158991594 [2,0,0,0,0,0|2,0,0]=4 687 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [2,0,0,0,0,0|2,0,0]=4 688 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [2,0,0,0,0,0|2,0,0]=4 689 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-2174373928 [2,0,0,0,0,0|2,0,0]=4 690 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-5936347595 [2,0,0,0,0,0|2,0,0]=4 691 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-8464504119 [2,0,0,0,0,0|2,0,0]=4 692 B9R1.6 O=C([O-])C1CCCCC1 MCULE-2430887278 [2,0,0,0,0,0|0,0,1]=3 693 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [2,0,0,0,0,0|1,0,1]=4 694 B9R1.6 O=N(=O)C1CCCCC1 MCULE-6198799449 [2,0,0,0,0,0|1,0,1]=4 695 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [2,0,0,0,0,0|1,0,0]=3 696 B9R1.6 O=S([O-])C1CCCCC1 MCULE-4340070525 [2,0,0,0,0,0|1,0,1]=4 697 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [2,0,0,0,0,0|1,0,1]=4 698 B9R1.6 [C@H]1(CSCCN1)C(=O)O MCULE-2592294388 [2,0,0,0,0,0|2,0,0]=4 699 B9R1.118 C#CC1(CCCCC1)C MCULE-5741070838 [2,0,0,0,0,0|1,0,1]=4 700 B9R1.118 C#CC1(CCCCC1)N MCULE-3624994918 [2,0,0,0,0,0|1,0,1]=4 701 B9R1.118 C#CC1(CCCCC1)N MCULE-4253590078 [2,0,0,0,0,0|1,0,1]=4 702 B9R1.118 C#CC1(CCCCC1)N MCULE-5146757979 [2,0,0,0,0,0|1,0,1]=4 703 B9R1.118 C#CC1(CCCCC1)N MCULE-6592648519 [2,0,0,0,0,0|1,0,1]=4 704 B9R1.118 C#CC1(CCCCC1)O MCULE-8943429628 [2,0,0,0,0,0|1,0,1]=4 705 B9R1.118 C=CC1(CCCCC1)O MCULE-7521116261 [2,0,0,0,0,0|1,0,1]=4 706 B9R1.118 CC1(CCCCC1)C#N MCULE-7897108181 [2,0,0,0,0,0|1,0,1]=4 707 B9R1.118 CC1(CCCCC1)C=O MCULE-5963131023 [2,0,0,0,0,0|0,0,0]=2 708 B9R1.118 CC1(CCCCC1)CBr MCULE-2357240305 [2,0,0,0,0,0|1,0,1]=4 709 B9R1.118 CC1(CCCCC1)CCl MCULE-9584097812 [2,0,0,0,0,0|1,0,1]=4 710 B9R1.118 CC1(CCCCC1)CN MCULE-1723013704 [2,0,0,0,0,0|1,0,1]=4 711 B9R1.118 CC1(CCCCC1)CO MCULE-7082905261 [2,0,0,0,0,0|0,0,1]=3 712 B9R1.118 CC1(CCCCC1)CS MCULE-4716166156 [2,0,0,0,0,0|0,1,1]=4 713 B9R1.118 CC1(CCCCC1)NN MCULE-3928679842 [2,0,0,0,0,0|1,0,1]=4 714 B9R1.118 CC1(CCCCC1)NN MCULE-7771268201 [2,0,0,0,0,0|1,0,1]=4 715 B9R1.118 CC1(CCCCN1)CO MCULE-2480758252 [2,0,0,0,0,0|1,0,1]=4 716 B9R1.118 CC1(CCCCN1)CO MCULE-4992390900 [2,0,0,0,0,0|1,0,1]=4 717 B9R1.118 CC1(CCCCO1)C=O MCULE-9760251174 [2,0,0,0,0,0|1,0,0]=3 718 B9R1.118 CC1(CCCCO1)CO MCULE-1474953219 [2,0,0,0,0,0|1,0,1]=4 719 B9R1.118 CC1(CCCNC1)CO MCULE-7859652987 [2,0,0,0,0,0|1,0,1]=4 720 B9R1.118 CC1(CCCNC1)CO MCULE-9138617665 [2,0,0,0,0,0|1,0,1]=4 721 B9R1.118 CC1(CCCOC1)CO MCULE-5818698089 [2,0,0,0,0,0|1,0,1]=4 722 B9R1.118 CC1(CCNCC1)CO MCULE-4193945417 [2,0,0,0,0,0|1,0,1]=4 723 B9R1.118 CC1(CCNCC1)CO MCULE-6270876419 [2,0,0,0,0,0|1,0,1]=4 724 B9R1.118 CC1(CCOCC1)C=O MCULE-8265392725 [2,0,0,0,0,0|1,0,0]=3 725 B9R1.118 CC1(CCOCC1)CO MCULE-5535447172 [2,0,0,0,0,0|1,0,1]=4 726 B9R1.118 CCC1(CCCCC1)Cl MCULE-5513648578 [2,0,0,0,0,0|2,0,0]=4 727 B9R1.118 CCC1(CCCCC1)N MCULE-3886661042 [2,0,0,0,0,0|1,0,1]=4 728 B9R1.118 CCC1(CCCCC1)N MCULE-3921643203 [2,0,0,0,0,0|1,0,1]=4 729 B9R1.118 CCC1(CCCCC1)O MCULE-9314704343 [2,0,0,0,0,0|1,0,0]=3 730 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [2,0,0,0,0,0|2,0,0]=4 731 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [2,0,0,0,0,0|2,0,0]=4 732 B9R1.118 CCC1(CCNCC1)O MCULE-5103122746 [2,0,0,0,0,0|2,0,0]=4 733 B9R1.118 CCC1(CCNCC1)O MCULE-8900140051 [2,0,0,0,0,0|2,0,0]=4 734 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-2002234086 [2,0,0,0,0,0|1,0,1]=4 735 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-7671897310 [2,0,0,0,0,0|1,0,1]=4 736 B9R1.118 N#CC1(CCCCC1)N MCULE-6005660314 [2,0,0,0,0,0|1,0,1]=4 737 B9R1.118 N#CC1(CCCCC1)N MCULE-8198076555 [2,0,0,0,0,0|1,0,1]=4 738 B9R1.118 N#CC1(CCCCC1)O MCULE-5791427313 [2,0,0,0,0,0|2,0,0]=4 739 B9R1.118 NC1(CCCCC1)CO MCULE-5010483791 [2,0,0,0,0,0|0,0,1]=3 740 B9R1.118 NC1(CCCCC1)CO MCULE-9568898546 [2,0,0,0,0,0|0,0,1]=3 741 B9R1.118 NC1(CCNCC1)CO MCULE-4957450788 [2,0,0,0,0,0|1,0,1]=4 742 B9R1.118 NC1(CCNCC1)CO MCULE-8808091761 [2,0,0,0,0,0|1,0,1]=4 743 B9R1.118 NC1(CCOCC1)CO MCULE-5523370445 [2,0,0,0,0,0|1,0,1]=4 744 B9R1.118 NC1(CCOCC1)CO MCULE-7081316740 [2,0,0,0,0,0|1,0,1]=4 745 B9R1.118 NC1(CCSCC1)CO MCULE-3751635501 [2,0,0,0,0,0|1,0,1]=4 746 B9R1.118 NC1(CCSCC1)CO MCULE-5887780207 [2,0,0,0,0,0|1,0,1]=4 747 B9R1.118 NCC1(CCCCC1)N MCULE-1440012619 [2,0,0,0,0,0|1,0,1]=4 748 B9R1.118 NCC1(CCCCC1)N MCULE-4904885698 [2,0,0,0,0,0|1,0,1]=4 749 B9R1.118 NCC1(CCCCC1)N MCULE-5203944425 [2,0,0,0,0,0|1,0,1]=4 750 B9R1.118 NCC1(CCCCC1)O MCULE-2235926257 [2,0,0,0,0,0|2,0,0]=4 751 B9R1.118 NCC1(CCCCC1)O MCULE-3554445977 [2,0,0,0,0,0|2,0,0]=4 752 B9R1.118 O=CC1(CCOCC1)F MCULE-7250965761 [2,0,0,0,0,0|2,0,0]=4 753 B9R1.118 O=CC1(CCSCC1)F MCULE-5821896166 [2,0,0,0,0,0|2,0,0]=4 754 B9R1.118 O=NC1(CCCCC1)Cl MCULE-4752067659 [2,0,0,0,0,0|2,0,0]=4 755 B9R1.118 OC1(CCCCC1)CBr MCULE-3269466977 [2,0,0,0,0,0|2,0,0]=4 756 B9R1.118 OCC1(CCCCC1)F MCULE-6893319227 [2,0,0,0,0,0|1,0,1]=4 757 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [2,0,0,0,0,0|1,0,1]=4 758 B9R1.118 OCC1(CCCCC1)S MCULE-4689452330 [2,0,0,0,0,0|1,0,1]=4 759 B11R0.76 CCCCCCC(CC)C(=O)O MCULE-6377253083 [0,1,1,0,0,0|1,0,0]=3 760 B11R0.76 CCCCCCC(NC)C(=O)O MCULE-7287509088 [0,1,1,0,0,0|0,0,0]=2 761 B11R0.78 CCCC(CCCCN)C(=O)O MCULE-1663275054 [0,1,1,0,0,0|2,0,0]=4 762 B11R0.78 CCCC(CCCCN)C(=O)O MCULE-1979773774 [0,1,1,0,0,0|2,0,0]=4 763 B11R0.78 CCCCCC(CCC)C(=O)O MCULE-5222815142 [0,1,1,0,0,0|1,0,0]=3 764 B11R0.78 CCSCCC(NC=O)C(=O)O MCULE-4482021526 [0,1,1,0,0,0|1,0,1]=4 765 B11R0.78 NCCCC[C@H](NC=O)C(=O)O MCULE-9458118624 [0,1,1,0,0,0|1,0,1]=4 766 B11R0.153 CCCCCC(C(=O)C)C(=O)C MCULE-5667336413 [0,1,1,0,0,0|2,0,0]=4 767 B11R0.153 CCCCCC(C(=O)O)C(=O)O MCULE-4295713715 [0,1,1,0,0,0|2,0,0]=4 768 B11R0.153 CCCCCC(C(=O)O)C(C)C MCULE-3945412548 [0,1,1,0,0,0|1,0,0]=3 769 B11R0.329 CCCCCC(C)(CC)C(=O)O MCULE-5909088545 [0,1,1,0,0,0|1,0,0]=3 770 B11R0.192 CCC(CC)(CCCl)C(=O)OC MCULE-2215334185 [0,1,1,0,0,0|2,0,0]=4 771 B11R0.192 CCNC(CC)(CC)C(=O)OC MCULE-6709759335 [0,1,1,0,0,0|2,0,0]=4 772 B11R0.356 CCCCC(CC)(CC)C(=O)O MCULE-7572073631 [0,1,1,0,0,0|1,0,0]=3 773 B11R0.371 CCC(C)(CCC(C)C)C(=O)O MCULE-4716241218 [0,1,1,0,0,0|1,0,0]=3 774 B11R1.220 CC(=O)C1(CCC(CC1)C)C MCULE-1641456468 [1,1,0,0,0,0|1,0,0]=3 775 B11R1.220 CC1(CCC(=O)CC1)C(=O)O MCULE-1572569153 [1,1,0,0,0,0|0,0,1]=3 776 B11R1.220 CC1(CCC(=O)NC1)C(=O)O MCULE-2805915574 [1,1,0,0,0,0|1,0,1]=4 777 B11R1.220 CC1(CCC(CC1)N)C(=O)N MCULE-9249091360 [1,1,0,0,0,0|1,0,0]=3 778 B11R1.220 CC1(CCC(CC1)O)C(=O)O MCULE-4694168525 [1,1,0,0,0,0|0,0,0]=2 779 B11R1.220 CC1=CCC(CC1)(C)C(=O)O MCULE-9625022025 [1,1,0,0,0,0|0,0,2]=4 780 B11R1.220 CC1CCC(CC1)(C)C(=O)N MCULE-8954217069 [1,1,0,0,0,0|1,0,0]=3 781 B11R1.220 CC1CCC(CC1)(C)C(=O)O MCULE-7822016719 [1,1,0,0,0,0|0,0,0]=2 782 B11R1.220 CC1CCC(CC1)(F)C(=O)O MCULE-8829791353 [1,1,0,0,0,0|1,0,0]=3 783 B11R1.220 CC1CCC(CC1)(N)C(=O)N MCULE-1630564728 [1,1,0,0,0,0|1,0,0]=3 784 B11R1.220 CC1CCC(CC1)(N)C(=O)O MCULE-7735898604 [1,1,0,0,0,0|0,0,0]=2 785 B11R1.220 CC1CCC(CC1)(O)C(=O)O MCULE-2392362320 [1,1,0,0,0,0|1,0,0]=3 786 B11R1.220 CN1CCC(CC1)(C)C(=O)O MCULE-3834694510 [1,1,0,0,0,0|1,0,0]=3 787 B11R1.220 CN1CCC(CC1)(C)C(=O)O MCULE-6310965473 [1,1,0,0,0,0|1,0,0]=3 788 B11R1.220 CN1CCC(CC1)(F)C(=O)O MCULE-5733063609 [1,1,0,0,0,0|2,0,0]=4 789 B11R1.220 CN1CCC(CC1)(F)C(=O)O MCULE-8739311714 [1,1,0,0,0,0|2,0,0]=4 790 B11R1.220 CN1CCC(CC1)(N)C(=O)O MCULE-7077088205 [1,1,0,0,0,0|1,0,0]=3 791 B11R1.220 CN1CCC(CC1)(N)C(=O)O MCULE-9740380672 [1,1,0,0,0,0|1,0,0]=3 792 B11R1.220 CN1CCC(CC1)(O)C(=O)O MCULE-3745539292 [1,1,0,0,0,0|2,0,0]=4 793 B11R1.220 CN1CCC(CC1)(O)C(=O)O MCULE-9976204914 [1,1,0,0,0,0|2,0,0]=4 794 B11R1.220 C[C@@]1(CC[C@@H](CC1)N)C(=O)N MCULE-1121011171 [1,1,0,0,0,0|1,0,0]=3 795 B11R1.220 C[C@@]1(CC[C@@H](CC1)O)C(=O)O MCULE-5793928535 [1,1,0,0,0,0|0,0,0]=2 796 B11R1.220 NC(=O)C1(CCC(CC1)N)O MCULE-5207754653 [1,1,0,0,0,0|2,0,0]=4 797 B11R1.220 NC1(CCC(=O)CC1)C(=O)O MCULE-6857901798 [1,1,0,0,0,0|0,0,1]=3 798 B11R1.220 NC1CCC(CC1)(O)C(=O)O MCULE-8309786604 [1,1,0,0,0,0|1,0,0]=3 799 B11R1.520 CC1(CCCNC1=O)C(=O)O MCULE-2127943120 [1,1,0,0,0,0|1,0,1]=4 800 B11R1.520 CC1CCCCC1(N)C(=O)O MCULE-7674467260 [1,1,0,0,0,0|0,0,0]=2 801 B11R1.520 CC1CCCCC1(O)C(=O)O MCULE-4831471383 [1,1,0,0,0,0|1,0,0]=3 802 B11R1.520 CN1CCCCC1(C)C(=O)O MCULE-8543610232 [1,1,0,0,0,0|1,0,0]=3 803 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-4479358294 [1,1,0,0,0,0|1,0,0]=3 804 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-7328807092 [1,1,0,0,0,0|1,0,0]=3 805 B11R1.667 CC1(CCNC(=O)C1)C(=O)O MCULE-9095450827 [1,1,0,0,0,0|1,0,1]=4 806 B11R1.667 CC1CC(CCO1)(C)C(=O)O MCULE-8913886133 [1,1,0,0,0,0|1,0,0]=3 807 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-2481658934 [1,1,0,0,0,0|1,0,0]=3 808 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-5146905630 [1,1,0,0,0,0|1,0,0]=3 809 B11R1.667 CC1CCCC(C1)(N)C(=O)N MCULE-1803408408 [1,1,0,0,0,0|1,0,0]=3 810 B11R1.667 CC1CCCC(C1)(N)C(=O)O MCULE-7952794030 [1,1,0,0,0,0|0,0,0]=2 811 B11R1.667 CN1CCCC(C1)(C)C(=O)O MCULE-6176737385 [1,1,0,0,0,0|1,0,0]=3 812 B11R1.878 CC(=NO)C1(CCCCC1)O MCULE-2919413764 [1,1,0,0,0,0|2,0,0]=4 813 B11R1.878 CC1(CCCCO1)C(=O)NN MCULE-1107519638 [1,1,0,0,0,0|2,0,0]=4 814 B11R1.878 CNC(=O)C1(CCCCC1)N MCULE-1205176044 [1,1,0,0,0,0|1,0,0]=3 815 B11R1.878 CNC(=O)C1(CCCCC1)N MCULE-5586151094 [1,1,0,0,0,0|1,0,0]=3 816 B11R1.878 CNC(=O)C1(CCCNC1)C MCULE-4099432918 [1,1,0,0,0,0|2,0,0]=4 817 B11R1.878 CNC(=O)C1(CCCNC1)C MCULE-4411241332 [1,1,0,0,0,0|2,0,0]=4 818 B11R1.878 CNC(=O)C1(CCNCC1)C MCULE-4324370476 [1,1,0,0,0,0|2,0,0]=4 819 B11R1.878 CNC(=O)C1(CCNCC1)C MCULE-5512794621 [1,1,0,0,0,0|2,0,0]=4 820 B11R1.878 CNC(=O)C1(CCOCC1)N MCULE-3364428519 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.878 CNC(=O)C1(CCOCC1)N MCULE-8082351052 [1,1,0,0,0,0|2,0,0]=4 822 B11R1.878 COC(=O)C1(CCCCC1)Br MCULE-1324398852 [1,1,0,0,0,0|1,0,0]=3 823 B11R1.878 COC(=O)C1(CCCCC1)C MCULE-1116173481 [1,1,0,0,0,0|0,0,0]=2 824 B11R1.878 COC(=O)C1(CCCCC1)N MCULE-2077713130 [1,1,0,0,0,0|0,0,0]=2 825 B11R1.878 COC(=O)C1(CCCCC1)N MCULE-5529190912 [1,1,0,0,0,0|0,0,0]=2 826 B11R1.878 COC(=O)C1(CCCCC1)O MCULE-7312981015 [1,1,0,0,0,0|1,0,0]=3 827 B11R1.878 COC(=O)C1(CCCCN1)C MCULE-1190264508 [1,1,0,0,0,0|1,0,0]=3 828 B11R1.878 COC(=O)C1(CCCCN1)C MCULE-3258376100 [1,1,0,0,0,0|1,0,0]=3 829 B11R1.878 COC(=O)C1(CCCCO1)C MCULE-4831752163 [1,1,0,0,0,0|1,0,0]=3 830 B11R1.878 COC(=O)C1(CCCNC1)C MCULE-2912960772 [1,1,0,0,0,0|1,0,0]=3 831 B11R1.878 COC(=O)C1(CCCNC1)C MCULE-6748274783 [1,1,0,0,0,0|1,0,0]=3 832 B11R1.878 COC(=O)C1(CCCNC1)O MCULE-4695147180 [1,1,0,0,0,0|2,0,0]=4 833 B11R1.878 COC(=O)C1(CCCNC1)O MCULE-7996251761 [1,1,0,0,0,0|2,0,0]=4 834 B11R1.878 COC(=O)C1(CCCOC1)C MCULE-6519149185 [1,1,0,0,0,0|1,0,0]=3 835 B11R1.878 COC(=O)C1(CCNCC1)C MCULE-1287601384 [1,1,0,0,0,0|1,0,0]=3 836 B11R1.878 COC(=O)C1(CCNCC1)C MCULE-5120199516 [1,1,0,0,0,0|1,0,0]=3 837 B11R1.878 COC(=O)C1(CCNCC1)F MCULE-2369065610 [1,1,0,0,0,0|2,0,0]=4 838 B11R1.878 COC(=O)C1(CCNCC1)F MCULE-3197182658 [1,1,0,0,0,0|2,0,0]=4 839 B11R1.878 COC(=O)C1(CCNCC1)N MCULE-7457516879 [1,1,0,0,0,0|1,0,0]=3 840 B11R1.878 COC(=O)C1(CCNCC1)N MCULE-8838613115 [1,1,0,0,0,0|1,0,0]=3 841 B11R1.878 COC(=O)C1(CCNCC1)O MCULE-3066342819 [1,1,0,0,0,0|2,0,0]=4 842 B11R1.878 COC(=O)C1(CCNCC1)O MCULE-9440891544 [1,1,0,0,0,0|2,0,0]=4 843 B11R1.878 COC(=O)C1(CCOCC1)Br MCULE-7180907923 [1,1,0,0,0,0|2,0,0]=4 844 B11R1.878 COC(=O)C1(CCOCC1)C MCULE-2899247948 [1,1,0,0,0,0|1,0,0]=3 845 B11R1.878 COC(=O)C1(CCOCC1)F MCULE-7433586839 [1,1,0,0,0,0|2,0,0]=4 846 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-2933369256 [1,1,0,0,0,0|1,0,0]=3 847 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-5766956671 [1,1,0,0,0,0|1,0,0]=3 848 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-6987517348 [1,1,0,0,0,0|1,0,0]=3 849 B11R1.878 COC(=O)C1(CCOCC1)O MCULE-2689620350 [1,1,0,0,0,0|2,0,0]=4 850 B11R1.878 COC(=O)C1(CCSCC1)N MCULE-3245318067 [1,1,0,0,0,0|1,0,0]=3 851 B11R1.878 COC(=O)C1(CCSCC1)N MCULE-5736843966 [1,1,0,0,0,0|1,0,0]=3 852 B11R1.878 COC(=O)C1(CCSCC1)O MCULE-9114884346 [1,1,0,0,0,0|2,0,0]=4 853 B11R1.878 COC(=O)C1(CNCCO1)C MCULE-2710510669 [1,1,0,0,0,0|2,0,0]=4 854 B11R1.878 COC(=O)C1(CNCCO1)C MCULE-6281859428 [1,1,0,0,0,0|2,0,0]=4 855 B11R1.878 COC(=O)C1(COCCN1)C MCULE-6477520944 [1,1,0,0,0,0|2,0,0]=4 856 B11R1.878 COC(=O)C1(COCCN1)C MCULE-7448041002 [1,1,0,0,0,0|2,0,0]=4 857 B11R1.878 COC(=O)[C@@]1(CCCCN1)C MCULE-9054004047 [1,1,0,0,0,0|1,0,0]=3 858 B11R1.878 COC(=O)[C@@]1(COCCN1)C MCULE-1062911013 [1,1,0,0,0,0|2,0,0]=4 859 B11R1.878 COC(=O)[C@@]1(COCCN1)C MCULE-9828449382 [1,1,0,0,0,0|2,0,0]=4 860 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-1448662011 [1,1,0,0,0,0|2,0,0]=4 861 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-3553596882 [1,1,0,0,0,0|2,0,0]=4 862 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-8150000624 [1,1,0,0,0,0|2,0,0]=4 863 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-9063986834 [1,1,0,0,0,0|2,0,0]=4 864 B11R1.878 N/C(=N/O)/C1(CCCCC1)O MCULE-7526944829 [1,1,0,0,0,0|2,0,0]=4 865 B11R1.878 O=C(CO)C1(CCCCC1)O MCULE-4883134314 [1,1,0,0,0,0|1,0,0]=3 866 B11R1.1048 CNC1(CCC(CC1)C)C#N MCULE-5667217646 [1,1,0,0,0,0|1,0,1]=4 867 B11R1.1048 CNC1(CCC(CC1)C)C#N MCULE-8044405827 [1,1,0,0,0,0|1,0,1]=4 868 B11R1.1253 C=CCC1(CCCCC1)C=O MCULE-7220621801 [1,1,0,0,0,0|1,0,1]=4 869 B11R1.1253 CNCC1(CCOCC1)CO MCULE-8567520667 [1,1,0,0,0,0|1,0,1]=4 870 B11R1.1253 COCC1(CCCCC1)CO MCULE-2726643980 [1,1,0,0,0,0|1,0,1]=4 871 B11R1.1253 COCC1(CCCCO1)C=O MCULE-3037714299 [1,1,0,0,0,0|2,0,0]=4 872 B11R1.1253 N#CC1(CCCCC1)NC=O MCULE-7189277449 [1,1,0,0,0,0|2,0,0]=4 873 B11R1.1253 OCCC1(CCCCC1)CO MCULE-1907667363 [1,1,0,0,0,0|1,0,1]=4 874 B11R1.1239 C#CCC1(CCCC1)C(=O)O MCULE-6947326895 [0,1,0,0,1,0|1,0,1]=4 875 B11R1.1239 C=CCC1(CCCC1)C(=O)O MCULE-1943404346 [0,1,0,0,1,0|1,0,1]=4 876 B11R1.1239 CCCC1(CCCN1)C(=O)O MCULE-4996417067 [0,1,0,0,1,0|2,0,0]=4 877 B11R1.1239 CCCC1(CCCN1)C(=O)O MCULE-7791679512 [0,1,0,0,1,0|2,0,0]=4 878 B11R1.1239 CCC[C@]1(CCCN1)C(=O)O MCULE-9371463504 [0,1,0,0,1,0|2,0,0]=4 879 B11R1.1239 CCOC1(CCCC1)C(=O)O MCULE-4011994377 [0,1,0,0,1,0|1,0,0]=3 880 B11R1.1239 COCC1(CCCC1)C(=O)N MCULE-8317060353 [0,1,0,0,1,0|2,0,0]=4 881 B11R1.1239 COCC1(CCCC1)C(=O)O MCULE-3378176919 [0,1,0,0,1,0|1,0,0]=3 882 B11R1.1239 COCC1(CCCN1)C(=O)O MCULE-6933694896 [0,1,0,0,1,0|2,0,0]=4 883 B11R1.1239 COCC1(CCCN1)C(=O)O MCULE-9894897145 [0,1,0,0,1,0|2,0,0]=4 884 B11R1.1239 COCC1(CCCO1)C(=O)O MCULE-5930784439 [0,1,0,0,1,0|2,0,0]=4 885 B11R1.1239 COCC1(CCNC1)C(=O)O MCULE-2981641932 [0,1,0,0,1,0|2,0,0]=4 886 B11R1.1239 COCC1(CCNC1)C(=O)O MCULE-3093738240 [0,1,0,0,1,0|2,0,0]=4 887 B11R1.1239 COCC1(CCOC1)C(=O)O MCULE-6639499778 [0,1,0,0,1,0|2,0,0]=4 888 B11R1.1239 O=C(O)C1(CCNC1)CCO MCULE-6262681434 [0,1,0,0,1,0|2,0,0]=4 889 B11R1.1385 CC(C)[C@@]1(CCCN1)C(=O)O MCULE-1284531037 [0,1,0,0,1,0|2,0,0]=4 890 B11R1.1385 CN(C)C1(CCCC1)C(=O)N MCULE-1838673832 [0,1,0,0,1,0|1,0,0]=3 891 B11R1.1385 CN(C)C1(CCCC1)C(=O)O MCULE-4694908524 [0,1,0,0,1,0|0,0,0]=2 892 B11R1.1385 CN(C)C1(CCSC1)C(=O)N MCULE-2651765285 [0,1,0,0,1,0|2,0,0]=4 893 B11R1.1385 CN(C)C1(CCSC1)C(=O)O MCULE-5588121920 [0,1,0,0,1,0|1,0,0]=3 894 B11R1.1385 NC(=O)C1(CCCC1)C(=O)O MCULE-1628041900 [0,1,0,0,1,0|2,0,0]=4 895 B11R1.1385 O=C(O)C1(CCCC1)C(=O)O MCULE-1176845799 [0,1,0,0,1,0|2,0,0]=4 896 B11R1.1385 O=C(O)C1(CCCC1)C(F)F MCULE-4072487233 [0,1,0,0,1,0|2,0,0]=4 897 B11R1.1472 CCC1(CCCN1)C(=O)OC MCULE-7143656709 [0,1,0,0,1,0|2,0,0]=4 898 B11R1.1472 CCC1(CCCN1)C(=O)OC MCULE-8400794829 [0,1,0,0,1,0|2,0,0]=4 899 B11R1.1472 CC[C@]1(CCCN1)C(=O)OC MCULE-3490007039 [0,1,0,0,1,0|2,0,0]=4 900 B11R1.1472 CC[C@]1(CCCN1)C(=O)OC MCULE-6560699711 [0,1,0,0,1,0|2,0,0]=4 901 B11R1.1472 CNC1(CCCC1)C(=O)OC MCULE-3636294966 [0,1,0,0,1,0|0,0,0]=2 902 B11R1.1472 CNC1(CCSC1)C(=O)OC MCULE-2677797864 [0,1,0,0,1,0|1,0,0]=3 903 B11R1.1472 COC(=O)C1(CCCC1)C#N MCULE-8462540862 [0,1,0,0,1,0|2,0,0]=4 904 B11R1.1472 COC(=O)C1(CCCC1)CBr MCULE-8121902190 [0,1,0,0,1,0|2,0,0]=4 905 B11R1.1472 COC(=O)C1(CCCC1)CN MCULE-7843446671 [0,1,0,0,1,0|2,0,0]=4 906 B11R1.1472 COC(=O)C1(CCCC1)CN MCULE-9787977893 [0,1,0,0,1,0|2,0,0]=4 907 B11R1.1472 COC(=O)C1(CCNC1)OC MCULE-7946705756 [0,1,0,0,1,0|2,0,0]=4 908 B11R1.1472 COC(=O)C1(CCNC1)OC MCULE-9815566481 [0,1,0,0,1,0|2,0,0]=4 909 B11R1.1472 COC(=O)C1(CCOC1)OC MCULE-4200608813 [0,1,0,0,1,0|2,0,0]=4 910 B13R1.4835 CNC1(CCCCCC1)C(=O)OC MCULE-5346634449 [0,1,0,0,0,1|0,0,0]=2 911 B13R1.4835 COC(=O)C1(CCCCCC1)CN MCULE-2137291905 [0,1,0,0,0,1|2,0,0]=4 912 B13R1.4835 COC(=O)C1(CCCCCC1)OC MCULE-9008566768 [0,1,0,0,0,1|1,0,0]=3 913 B13R1.6006 CCC1(CCCCC(=O)N1)C(=O)O MCULE-9669571695 [0,1,0,0,0,1|1,0,1]=4 914 B13R1.8791 CN(C)C1(CCCCCC1)C(=O)N MCULE-3937377198 [0,1,0,0,0,1|1,0,0]=3 915 B13R1.9036 CCOC1(CCCCCC1)C(=O)O MCULE-2074034896 [0,1,0,0,0,1|1,0,0]=3 916 B13R1.4942 C#CC1(CCCCC1)OC(=O)OC MCULE-8279815194 [0,1,0,0,0,1|1,0,1]=4 917 B13R1.4942 C=CC(=O)OC1(CCCCC1)CC MCULE-8708164268 [0,1,0,0,0,1|2,0,0]=4 918 B13R1.4942 COC(=O)CC1(CCCCC1)CN MCULE-2727579133 [0,1,0,0,0,1|2,0,0]=4 919 B13R1.4942 COC(=O)CC1(CCCCC1)CN MCULE-4439928687 [0,1,0,0,0,1|2,0,0]=4 920 B13R1.7334 COCC1(CCOCC1)CC(=O)O MCULE-3594115440 [0,1,0,0,0,1|2,0,0]=4 921 B13R1.7334 NCCC1(CCCCC1)CC(=O)O MCULE-2025274324 [0,1,0,0,0,1|1,0,0]=3 922 B13R1.7334 NCCC1(CCCCC1)CC(=O)O MCULE-2530858590 [0,1,0,0,0,1|1,0,0]=3 923 B13R1.8842 O=C(O)CC1(CCCCC1)C(=O)O MCULE-6154591690 [0,1,0,0,0,1|2,0,0]=4 924 B13R1.1277 CCC[C@@]1(CCNC[C@@H]1O)C(=O)O MCULE-1998056541 [0,2,0,0,0,0|2,0,0]=4 925 B13R1.1277 CCC[C@@]1(CCNC[C@@H]1O)C(=O)O MCULE-4030533033 [0,2,0,0,0,0|2,0,0]=4 926 B13R1.1277 CCC[C@@]1(CNCC[C@@H]1O)C(=O)O MCULE-4432886277 [0,2,0,0,0,0|2,0,0]=4 927 B13R1.1277 CCC[C@@]1(CNCC[C@@H]1O)C(=O)O MCULE-6631947172 [0,2,0,0,0,0|2,0,0]=4 928 B13R1.4673 COC(=O)C1(CCCCC1)C(=O)O MCULE-5556007535 [0,2,0,0,0,0|1,0,0]=3 929 B13R1.4673 COC(=O)C1(CCCCC1)N(C)C MCULE-4502027921 [0,2,0,0,0,0|0,0,0]=2 930 B13R1.4673 COC(=O)C1(CCOCC1)C(=O)C MCULE-8140498144 [0,2,0,0,0,0|2,0,0]=4 931 B13R1.4673 COC(=O)C1(CCOCC1)C(=O)O MCULE-7766183982 [0,2,0,0,0,0|2,0,0]=4 932 B13R1.4673 COC(=O)C1(CCOCC1)N(C)C MCULE-4107631841 [0,2,0,0,0,0|1,0,0]=3 933 B13R1.4673 COC(=O)C1(CCSCC1)N(C)C MCULE-1909068751 [0,2,0,0,0,0|1,0,0]=3 934 B13R1.6424 CCCCC1(CCCCC1)C(=O)O MCULE-6274586055 [0,2,0,0,0,0|1,0,0]=3 935 B13R1.6424 COCCC1(CCNCC1)C(=O)O MCULE-1360541160 [0,2,0,0,0,0|2,0,0]=4 936 B13R1.6424 COCCC1(CCNCC1)C(=O)O MCULE-4089952823 [0,2,0,0,0,0|2,0,0]=4 937 B13R1.6424 O=C(O)C1(CCCCC1)OCCO MCULE-2512849530 [0,2,0,0,0,0|1,0,0]=3 938 B13R1.7274 COCC1(CCC(=O)CC1)C(=O)O MCULE-9399601825 [0,2,0,0,0,0|1,0,1]=4 939 B13R1.7332 C#CCC1(CCCCC1)C(=O)OC MCULE-7639464542 [0,2,0,0,0,0|1,0,1]=4 940 B13R1.7332 CCCC1(CCCCN1)C(=O)OC MCULE-3075231501 [0,2,0,0,0,0|2,0,0]=4 941 B13R1.7332 CCCC1(CCCCN1)C(=O)OC MCULE-9141478683 [0,2,0,0,0,0|2,0,0]=4 942 B13R1.7332 CCCC1(CCCNC1)C(=O)OC MCULE-2014956561 [0,2,0,0,0,0|2,0,0]=4 943 B13R1.7332 CCCC1(CCCNC1)C(=O)OC MCULE-7346426038 [0,2,0,0,0,0|2,0,0]=4 944 B13R1.7332 CCCC1(CCNCC1)C(=O)OC MCULE-7932601431 [0,2,0,0,0,0|2,0,0]=4 945 B13R1.7332 CCCC1(CCNCC1)C(=O)OC MCULE-9126234774 [0,2,0,0,0,0|2,0,0]=4 946 B13R1.7332 COCC1(CCCCN1)C(=O)OC MCULE-7375411925 [0,2,0,0,0,0|2,0,0]=4 947 B13R1.8658 CC(F)(F)C1(CCOCC1)C(=O)O MCULE-8186304979 [0,2,0,0,0,0|2,0,0]=4 948 B13R1.8658 CS(=O)(=O)C1(CCOCC1)C(=O)O MCULE-3572441184 [0,2,0,0,0,0|2,0,0]=4 949 B13R1.8658 O=C(O)C1(CCCCC1)C(F)(F)F MCULE-1643755186 [0,2,0,0,0,0|2,0,0]=4 950 B13R1.4472 CCOC(=O)C1(CCCCC1)C#N MCULE-4624936025 [0,2,0,0,0,0|2,0,0]=4 951 B13R1.4472 CCOC(=O)C1(CCCCC1)CO MCULE-8509863841 [0,2,0,0,0,0|2,0,0]=4 952 B13R1.4472 CCOC(=O)C1(CCCCC1)NC MCULE-2337965909 [0,2,0,0,0,0|0,0,0]=2 953 B13R1.4472 CCOC(=O)C1(CCCNC1)CC MCULE-4361406865 [0,2,0,0,0,0|2,0,0]=4 954 B13R1.4472 CCOC(=O)C1(CCCNC1)CC MCULE-7227295939 [0,2,0,0,0,0|2,0,0]=4 955 B13R1.4472 CCOC(=O)C1(CCNCC1)CC MCULE-1837647187 [0,2,0,0,0,0|2,0,0]=4 956 B13R1.4472 CCOC(=O)C1(CCNCC1)CC MCULE-6772946983 [0,2,0,0,0,0|2,0,0]=4 957 B13R1.4630 COC(=O)C1(CCC(=O)CC1)OC MCULE-3905046594 [0,2,0,0,0,0|1,0,1]=4 958 B13R1.4630 COC(=O)C1(CCC(CC1)I)OC MCULE-7979404822 [0,2,0,0,0,0|1,0,0]=3 959 B13R1.4630 COC(=O)C1(CCC(CC1)O)OC MCULE-7144286560 [0,2,0,0,0,0|1,0,0]=3 960 B13R1.10790 CCC1(CCC(CC1)(F)F)C(=O)O MCULE-4458318113 [0,2,0,0,0,0|1,0,0]=3 961 B13R1.10790 CCC1(CCS(=O)(=O)CC1)C(=O)O MCULE-7735465418 [0,2,0,0,0,0|2,0,0]=4 962 B13R1.10790 CNC1(CCC(CC1)(F)F)C(=O)O MCULE-3097462303 [0,2,0,0,0,0|0,0,0]=2 963 B13R1.10790 CNC1(CCC(CC1)(F)F)C(=O)O MCULE-4649090872 [0,2,0,0,0,0|0,0,0]=2 964 B13R1.10790 CNC1(CCS(=O)(=O)CC1)C(=O)N MCULE-1870821584 [0,2,0,0,0,0|2,0,0]=4 965 B13R1.10790 CNC1(CCS(=O)(=O)CC1)C(=O)O MCULE-2086173821 [0,2,0,0,0,0|1,0,0]=3 966 B13R1.10790 COC1(CCC(CC1)(C)C)C(=O)O MCULE-1671990386 [0,2,0,0,0,0|1,0,0]=3 967 B13R1.10790 COC1(CCC(CC1)(F)F)C(=O)O MCULE-1314662473 [0,2,0,0,0,0|1,0,0]=3 968 B11R1.3 CCC1CCC(CC1)C(=O)O MCULE-3132418894 [0,0,1,1,0,0|1,0,0]=3 969 B11R1.3 CCN1CCC(CC1)C(=O)O MCULE-1135533995 [0,0,1,1,0,0|2,0,0]=4 970 B11R1.3 CCN1CCC(CC1)C(=O)O MCULE-1740909675 [0,0,1,1,0,0|2,0,0]=4 971 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6485034715 [0,0,1,1,0,0|1,0,0]=3 972 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-4991563635 [0,0,1,1,0,0|2,0,0]=4 973 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-7459674895 [0,0,1,1,0,0|2,0,0]=4 974 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-2685872520 [0,0,1,1,0,0|2,0,0]=4 975 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8829935799 [0,0,1,1,0,0|2,0,0]=4 976 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-6088017598 [0,0,1,1,0,0|2,0,0]=4 977 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-7349966563 [0,0,1,1,0,0|2,0,0]=4 978 B11R1.3 COC1CCC(CC1)C(=O)O MCULE-7855539599 [0,0,1,1,0,0|2,0,0]=4 979 B11R1.3 CO[C@H]1CC[C@H](CC1)C(=O)O MCULE-8120957519 [0,0,1,1,0,0|2,0,0]=4 980 B11R1.3 NCC1CCC(CC1)C(=O)O MCULE-6116475175 [0,0,1,1,0,0|2,0,0]=4 981 B11R1.3 NC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6087008336 [0,0,1,1,0,0|2,0,0]=4 982 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-1914632389 [0,0,1,1,0,0|2,0,0]=4 983 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-6012248882 [0,0,1,1,0,0|2,0,0]=4 984 B11R1.3 O=C(O)C1CCC(CC1)CBr MCULE-1483354720 [0,0,1,1,0,0|2,0,0]=4 985 B11R1.3 O=C(O)C1CCC(CC1)CO MCULE-2678326595 [0,0,1,1,0,0|2,0,0]=4 986 B11R1.3 O=C(O)[C@H]1CC[C@@H](CC1)CO MCULE-5678408450 [0,0,1,1,0,0|2,0,0]=4 987 B11R1.3 O=C(O)[C@H]1CC[C@H](CC1)CO MCULE-8982391334 [0,0,1,1,0,0|2,0,0]=4 988 B11R1.3 [C@@H]1(CC[C@@H](CC1)C(=O)O)OC MCULE-7032796402 [0,0,1,1,0,0|2,0,0]=4 989 B11R1.124 C#CCC1CNC(C1)C(=O)O MCULE-1007702144 [0,0,1,1,0,0|0,0,2]=4 990 B11R1.124 C#CCC1CNC(C1)C(=O)O MCULE-8985950522 [0,0,1,1,0,0|0,0,2]=4 991 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-1204374334 [0,0,1,1,0,0|0,0,2]=4 992 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-1775730985 [0,0,1,1,0,0|0,0,2]=4 993 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-2867557338 [0,0,1,1,0,0|0,0,2]=4 994 B11R1.124 C#CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-9622349016 [0,0,1,1,0,0|0,0,2]=4 995 B11R1.124 C=CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-7811782520 [0,0,1,1,0,0|0,0,2]=4 996 B11R1.124 C=CC[C@H]1CN[C@@H](C1)C(=O)O MCULE-8003555600 [0,0,1,1,0,0|0,0,2]=4 997 B11R1.143 CN1CCCCCC1C(=O)O MCULE-2653542021 [0,0,1,1,0,0|0,0,0]=2 998 B11R1.143 CN1CCCCCC1C(=O)O MCULE-3417099605 [0,0,1,1,0,0|0,0,0]=2 999 B11R1.143 NC1CCCCCC1C(=O)O MCULE-8944650297 [0,0,1,1,0,0|2,0,0]=4 1000 B11R1.143 NC1CCCCCC1C(=O)O MCULE-9787960494 [0,0,1,1,0,0|2,0,0]=4 1001 B11R1.159 CN1C(=O)CCCC1C(=O)O MCULE-2434427513 [0,0,1,1,0,0|1,0,1]=4 1002 B11R1.180 CCCCCC1CCCC1=O MCULE-7048040111 [0,0,1,1,0,0|2,0,0]=4 1003 B11R1.298 CCC(C(=O)O)N1CCCC1 MCULE-1838152278 [0,0,1,1,0,0|2,0,0]=4 1004 B11R1.298 CCC(C(=O)O)N1CCCC1 MCULE-8225522753 [0,0,1,1,0,0|2,0,0]=4 1005 B11R1.298 CC[C@@H](C(=O)O)N1CCCC1 MCULE-1645939512 [0,0,1,1,0,0|2,0,0]=4 1006 B11R1.298 CC[C@H](C(=O)O)N1CCCC1 MCULE-6359197434 [0,0,1,1,0,0|2,0,0]=4 1007 B11R1.298 CNC(C(=O)O)C1CCCC1 MCULE-4311551882 [0,0,1,1,0,0|0,0,0]=2 1008 B11R1.298 CNC(C(=O)O)C1CCCC1 MCULE-9246811149 [0,0,1,1,0,0|0,0,0]=2 1009 B11R1.298 CN[C@H](C(=O)O)C1CCCC1 MCULE-5322905424 [0,0,1,1,0,0|0,0,0]=2 1010 B11R1.298 COC(C(=O)O)C1CCCC1 MCULE-3859410444 [0,0,1,1,0,0|1,0,0]=3 1011 B11R1.298 COC(C(=O)O)C1CCOC1 MCULE-9838598562 [0,0,1,1,0,0|2,0,0]=4 1012 B11R1.298 NCC(C(=O)O)C1CCCC1 MCULE-1744116697 [0,0,1,1,0,0|2,0,0]=4 1013 B11R1.298 NCC(C(=O)O)C1CCCC1 MCULE-9731662154 [0,0,1,1,0,0|2,0,0]=4 1014 B11R1.565 CN1CCCC(CC1)C(=O)O MCULE-2315942552 [0,0,1,1,0,0|2,0,0]=4 1015 B11R1.706 CC(=O)C1CCCCCCC1 MCULE-7453374150 [0,0,1,1,0,0|2,0,0]=4 1016 B11R1.706 O=C(O)C1CCCCCCC1 MCULE-7220278799 [0,0,1,1,0,0|1,0,0]=3 1017 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2852082428 [0,0,1,1,0,0|0,0,0]=2 1018 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2931630393 [0,0,1,1,0,0|0,0,0]=2 1019 B11R1.991 CCCOCC1(CC1)C(=O)O MCULE-2590464502 [0,0,1,1,0,0|2,0,0]=4 1020 B11R1.991 COCCCC1(CC1)C(=O)O MCULE-7407881889 [0,0,1,1,0,0|2,0,0]=4 1021 B11R1.1016 CCC(CC1CCC1)C(=O)O MCULE-3425899429 [0,0,1,1,0,0|1,0,0]=3 1022 B11R1.1016 CC[C@@H](CN1CCC1)C(=O)O MCULE-5453339197 [0,0,1,1,0,0|2,0,0]=4 1023 B11R1.1016 CC[C@H](CN1CCC1)C(=O)O MCULE-5343090837 [0,0,1,1,0,0|2,0,0]=4 1024 B11R1.737 CC1(CCCCCC1)C(=O)O MCULE-3584192725 [0,0,1,1,0,0|1,0,0]=3 1025 B11R1.737 NC1(CCCCCC1)C(=O)O MCULE-6498749639 [0,0,1,1,0,0|2,0,0]=4 1026 B11R1.737 O=C(O)C1(CCCCCC1)O MCULE-7470096721 [0,0,1,1,0,0|2,0,0]=4 1027 B11R1.905 COCCC1(CCC1)C(=O)O MCULE-4060432640 [0,0,1,1,0,0|2,0,0]=4 1028 B11R1.1229 CCC1CCC(C1)(O)C(=O)O MCULE-3641341110 [0,0,1,1,0,0|2,0,0]=4 1029 B11R1.1229 COC1CNC(C1)(C)C(=O)O MCULE-1262116514 [0,0,1,1,0,0|1,0,0]=3 1030 B11R1.1229 COC1CNC(C1)(C)C(=O)O MCULE-5809003926 [0,0,1,1,0,0|1,0,0]=3 1031 B11R1.1270 CN1C(=O)CCC1(C)C(=O)O MCULE-6058699096 [0,0,1,1,0,0|1,0,1]=4 1032 B11R2.12 O=C1CCC12CCCCC2 MCULE-1472740479 [1,0,0,1,0,0|1,0,0]=3 1033 B11R2.12 O=C1CCC12CCOCC2 MCULE-4099337255 [1,0,0,1,0,0|2,0,0]=4 1034 B11R2.12 O=C1COC12CCCCC2 MCULE-3670246496 [1,0,0,1,0,0|2,0,0]=4 1035 B11R2.12 O=C1NCC12CCCNC2 MCULE-2309975536 [1,0,0,1,0,0|2,0,0]=4 1036 B11R2.12 O=C1NCC12CCCNC2 MCULE-4056738652 [1,0,0,1,0,0|2,0,0]=4 1037 B11R2.12 O=C1NCC12CCNCC2 MCULE-6987871994 [1,0,0,1,0,0|2,0,0]=4 1038 B11R2.12 O=C1NCC12CCNCC2 MCULE-9042821296 [1,0,0,1,0,0|2,0,0]=4 1039 B11R2.12 O=C1NC[C@@]12CCCNC2 MCULE-3023321228 [1,0,0,1,0,0|2,0,0]=4 1040 B11R2.12 OC1CCC12CCCCC2 MCULE-3691147336 [1,0,0,1,0,0|1,0,1]=4 1041 B11R2.12 O[C@H]1CCC12CCCCC2 MCULE-5204946295 [1,0,0,1,0,0|1,0,1]=4 1042 B11R2.679 CC12CCC(CC1)OC2=O MCULE-5263749123 [1,0,0,1,0,0|0,0,0]=2 1043 B11R2.813 CC(=O)C12CCCCC1C2 MCULE-6704773068 [1,0,0,1,0,0|1,0,0]=3 1044 B11R2.813 O=C(O)C12CC1CCCN2 MCULE-4247938910 [1,0,0,1,0,0|1,0,0]=3 1045 B11R2.813 O=C(O)C12CC1CCCN2 MCULE-4913986428 [1,0,0,1,0,0|1,0,0]=3 1046 B11R2.813 O=C(O)C12CCCCC1C2 MCULE-8164847486 [1,0,0,1,0,0|0,0,0]=2 1047 B11R2.813 O=C(O)C12CCNCC1C2 MCULE-1960768540 [1,0,0,1,0,0|1,0,0]=3 1048 B11R2.813 O=C(O)C12CCNCC1C2 MCULE-9023292994 [1,0,0,1,0,0|1,0,0]=3 1049 B11R2.813 O=C(O)C12CNCCC1C2 MCULE-3253248385 [1,0,0,1,0,0|1,0,0]=3 1050 B11R2.813 O=C(O)C12CNCCC1C2 MCULE-4328236690 [1,0,0,1,0,0|1,0,0]=3 1051 B11R2.1826 NC(=O)C12CCCC(C1)C2 MCULE-5396207551 [1,0,0,1,0,0|1,0,0]=3 1052 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-2027717821 [1,0,0,1,0,0|1,0,0]=3 1053 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-3937212667 [1,0,0,1,0,0|1,0,0]=3 1054 B11R2.1826 O=C(O)C12CCCC(C1)C2 MCULE-1931429837 [1,0,0,1,0,0|0,0,0]=2 1055 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-1943461113 [1,0,0,1,0,0|1,0,0]=3 1056 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-5658280461 [1,0,0,1,0,0|1,0,0]=3 1057 B11R2.1839 NC(=O)C12CCC(C1)CC2 MCULE-2431830147 [1,0,0,1,0,0|1,0,0]=3 1058 B11R2.1839 NC(=O)C12CCC(N1)CC2 MCULE-9139917072 [1,0,0,1,0,0|1,0,0]=3 1059 B11R2.1839 NC(=O)C12CCN(C1)CC2 MCULE-8813612154 [1,0,0,1,0,0|2,0,0]=4 1060 B11R2.1839 NC(=O)C12CCN(C1)CC2 MCULE-9070110707 [1,0,0,1,0,0|2,0,0]=4 1061 B11R2.1839 O=C(O)C12C=CC(C1)CC2 MCULE-4960669059 [1,0,0,1,0,0|0,0,2]=4 1062 B11R2.1839 O=C(O)C12CCC(C1)CC2 MCULE-6630732907 [1,0,0,1,0,0|0,0,0]=2 1063 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-5678506531 [1,0,0,1,0,0|1,0,0]=3 1064 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-7284735604 [1,0,0,1,0,0|1,0,0]=3 1065 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-3118230770 [1,0,0,1,0,0|0,0,0]=2 1066 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-9332995177 [1,0,0,1,0,0|0,0,0]=2 1067 B11R2.1839 O=C(O)C12CCC(O1)CC2 MCULE-3125021989 [1,0,0,1,0,0|1,0,0]=3 1068 B11R2.1839 O=C(O)C12CCN(C1)CC2 MCULE-3565766296 [1,0,0,1,0,0|1,0,0]=3 1069 B11R2.1839 O=C(O)C12CCN(C1)CC2 MCULE-9794392710 [1,0,0,1,0,0|1,0,0]=3 1070 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-4354063940 [1,0,0,1,0,0|1,0,0]=3 1071 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-8094375931 [1,0,0,1,0,0|1,0,0]=3 1072 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-1269384340 [1,0,0,1,0,0|1,0,0]=3 1073 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-9709707983 [1,0,0,1,0,0|1,0,0]=3 1074 B11R2.1850 CC1(CC2CC2C1)C(=O)O MCULE-5006077474 [1,0,0,1,0,0|0,0,0]=2 1075 B11R2.1261 C1=CC2(CCCCC2)NC1 MCULE-1902396207 [1,0,0,1,0,0|1,0,0]=3 1076 B11R2.1261 C1CCC2(CC1)CCCN2 MCULE-1676802958 [1,0,0,1,0,0|1,0,1]=4 1077 B11R2.1261 C1CCC2(CC1)CCCN2 MCULE-6049591759 [1,0,0,1,0,0|1,0,1]=4 1078 B11R2.1261 C1CCC2(CC1)NCCO2 MCULE-5583798211 [1,0,0,1,0,0|2,0,0]=4 1079 B11R2.1261 C1CCC2(CC1)NCCS2 MCULE-6903654164 [1,0,0,1,0,0|2,0,0]=4 1080 B11R2.1261 C1CCC2(CC1)NCCS2 MCULE-7854956678 [1,0,0,1,0,0|2,0,0]=4 1081 B11R2.2086 O=CC12CCC(CC1)CC2 MCULE-9935054579 [1,0,0,1,0,0|1,0,0]=3 1082 B11R2.2086 O=CC12CCC(CC1)OC2 MCULE-3065689831 [1,0,0,1,0,0|2,0,0]=4 1083 B11R2.2086 OCC12CCC(CC1)CC2 MCULE-8462216346 [1,0,0,1,0,0|1,0,1]=4 1084 B11R2.2086 OCC12CCC(CC1)CN2 MCULE-1441147628 [1,0,0,1,0,0|0,0,1]=3 1085 B11R2.2086 OCC12CCC(CC1)CN2 MCULE-7641418259 [1,0,0,1,0,0|0,0,1]=3 1086 B11R2.2086 OCC12CCC(CC1)CO2 MCULE-2833609830 [1,0,0,1,0,0|1,0,1]=4 1087 B11R2.3 O=C1CCCC12CCCC2 MCULE-3185184224 [0,0,0,1,1,0|2,0,0]=4 1088 B11R2.3 O=C1CCOC12CCCC2 MCULE-8169925589 [0,0,0,1,1,0|2,0,0]=4 1089 B11R2.3 O=C1NCCC12CCCC2 MCULE-4294140674 [0,0,0,1,1,0|2,0,0]=4 1090 B11R2.3 O=C1OCCC12CCCN2 MCULE-6180378660 [0,0,0,1,1,0|2,0,0]=4 1091 B11R2.3 O=C1OCCC12CCCN2 MCULE-8136172928 [0,0,0,1,1,0|2,0,0]=4 1092 B11R2.3 O=C1OCCC12CCNC2 MCULE-1042332859 [0,0,0,1,1,0|2,0,0]=4 1093 B11R2.3 O=C1OCCC12CCNC2 MCULE-6984072705 [0,0,0,1,1,0|2,0,0]=4 1094 B11R2.3 OC1CCNC12CCCC2 MCULE-9409590659 [0,0,0,1,1,0|1,0,1]=4 1095 B11R2.222 CCC12CCC(C1)CC2=O MCULE-1534160585 [0,0,0,1,1,0|2,0,0]=4 1096 B11R2.576 [C@@H]12CN[C@@](C1)([C@@H]2C)C(=O)O MCULE-1127629056 [0,0,0,1,1,0|2,0,0]=4 1097 B11R2.576 [C@@H]12CN[C@@](C1)([C@@H]2C)C(=O)O MCULE-4290916659 [0,0,0,1,1,0|2,0,0]=4 1098 B11R2.819 O=C(O)C12CCC1CNC2 MCULE-5440576235 [0,0,0,1,1,0|2,0,0]=4 1099 B11R2.819 O=C(O)C12CCC1CNC2 MCULE-7903679300 [0,0,0,1,1,0|2,0,0]=4 1100 B13R2.3130 OC1CCNC12CCCCCC2 MCULE-5452272589 [0,0,0,1,0,1|1,0,1]=4 1101 B13R2.22946 CC(=O)C12CCCC(CC1)CC2 MCULE-1100542815 [0,0,0,1,0,1|2,0,0]=4 1102 B13R2.22946 O=C(O)C12CCCC(CC1)CC2 MCULE-9645413341 [0,0,0,1,0,1|1,0,0]=3 1103 B13R2.437 O=C(O)C1CCC12CCOCC2 MCULE-3586385235 [0,0,0,1,0,1|2,0,0]=4 1104 B13R2.4014 C=C1OC(=O)OC12CCCCC2 MCULE-9030620049 [0,0,0,1,0,1|1,0,1]=4 1105 B13R2.4014 O=C1CC2(CCCCC2)C(=O)O1 MCULE-4319354097 [0,0,0,1,0,1|2,0,0]=4 1106 B13R2.4014 O=C1NC2(CCCCC2)C(=O)O1 MCULE-9769544984 [0,0,0,1,0,1|2,0,0]=4 1107 B13R2.11128 O=C1CCCC2(C1)CCCCC2 MCULE-3281261596 [0,0,0,1,0,1|2,0,0]=4 1108 B13R2.11128 O=C1CCNC2(C1)CCCCC2 MCULE-3217120492 [0,0,0,1,0,1|1,0,0]=3 1109 B13R2.11128 O=C1CCNC2(C1)CCCCC2 MCULE-8293573385 [0,0,0,1,0,1|1,0,0]=3 1110 B13R2.11128 O=C1CCOC2(C1)CCCCC2 MCULE-1198662310 [0,0,0,1,0,1|2,0,0]=4 1111 B13R2.11128 O=C1NC2(CCCNC2)CCO1 MCULE-4454658794 [0,0,0,1,0,1|2,0,0]=4 1112 B13R2.11128 O=C1NC2(CCNCC2)CCO1 MCULE-1167512176 [0,0,0,1,0,1|2,0,0]=4 1113 B13R2.23344 O=C(O)CC12CCC(CC1)CC2 MCULE-9790528588 [0,0,0,1,0,1|1,0,0]=3 1114 B13R2.168 O=C1CCCCC12CCOC2=O MCULE-8725196159 [0,1,0,1,0,0|1,0,1]=4 1115 B13R2.7614 CC[C@@]1(C[C@H]2CC[C@@H]1N2)C(=O)O MCULE-2866842825 [0,1,0,1,0,0|1,0,0]=3 1116 B13R2.7614 CC[C@@]1(C[C@H]2CC[C@@H]1N2)C(=O)O MCULE-9660669394 [0,1,0,1,0,0|1,0,0]=3 1117 B13R2.7614 N#CC1(CC2CCC1C2)C(=O)O MCULE-1383442478 [0,1,0,1,0,0|2,0,0]=4 1118 B13R2.13663 O=C(O)C12CCCCC1CNC2 MCULE-5397839077 [0,1,0,1,0,0|0,0,0]=2 1119 B13R2.13663 O=C(O)C12CCCCC1OCC2 MCULE-2319230396 [0,1,0,1,0,0|1,0,0]=3 1120 B13R2.13663 O=C(O)C12CCCCN1CCC2 MCULE-8267919414 [0,1,0,1,0,0|2,0,0]=4 1121 B13R2.13663 O=C(O)C12CCOC1CCOC2 MCULE-2974999086 [0,1,0,1,0,0|2,0,0]=4 1122 B13R2.13663 O=C(O)C12CCOCC1CNC2 MCULE-8730689047 [0,1,0,1,0,0|1,0,0]=3 1123 B13R2.14 O=C1CCCCC12CCCCC2 MCULE-9031710972 [0,1,0,1,0,0|2,0,0]=4 1124 B13R2.14 O=C1CCOCC12CCCCC2 MCULE-4656627576 [0,1,0,1,0,0|2,0,0]=4 1125 B13R2.14 O=C1NCCCC12CCCCC2 MCULE-9410883978 [0,1,0,1,0,0|2,0,0]=4 1126 B13R2.14 O=C1NCCNC12CCCCC2 MCULE-2688193565 [0,1,0,1,0,0|1,0,0]=3 1127 B13R2.14 O=C1NCCNC12CCCCC2 MCULE-9589331885 [0,1,0,1,0,0|1,0,0]=3 1128 B13R2.14 O=C1NCCNC12CCNCC2 MCULE-3982364745 [0,1,0,1,0,0|2,0,0]=4 1129 B13R2.14 O=C1NCCNC12CCNCC2 MCULE-9723222988 [0,1,0,1,0,0|2,0,0]=4 1130 B13R2.14 O=C1NCCNC12CCOCC2 MCULE-1582738325 [0,1,0,1,0,0|2,0,0]=4 1131 B13R2.14 O=C1OCCNC12CCOCC2 MCULE-4794694260 [0,1,0,1,0,0|1,0,0]=3 1132 B13R2.14 O=C1OCCNC12CCOCC2 MCULE-5803451778 [0,1,0,1,0,0|1,0,0]=3 1133 B13R2.13727 O=C(O)C12CCCN(C1)CCC2 MCULE-9288071518 [0,1,0,1,0,0|2,0,0]=4 1134 B13R2.13727 O=C(O)C12CCCN(C1)CCC2 MCULE-9446606471 [0,1,0,1,0,0|2,0,0]=4 1135 B13R2.14042 O=C(O)C1(CCCCN1)C2CC2 MCULE-3595669220 [0,1,0,1,0,0|2,0,0]=4 1136 B13R2.14042 O=C(O)C1(CCOCC1)C2CC2 MCULE-3259336523 [0,1,0,1,0,0|2,0,0]=4 1137 B13R2.59 CC1=NOC(=O)C12CCOCC2 MCULE-9532434092 [0,1,0,1,0,0|2,0,0]=4 1138 B13R2.59 CN1CNC(=O)C12CCCNC2 MCULE-3387139268 [0,1,0,1,0,0|2,0,0]=4 1139 B13R2.59 CN1CNC(=O)C12CCCNC2 MCULE-7997448560 [0,1,0,1,0,0|2,0,0]=4 1140 B13R2.59 CN1CNC(=O)C12CCNCC2 MCULE-5431793264 [0,1,0,1,0,0|2,0,0]=4 1141 B13R2.22973 CC(=O)C12CCC(C1(C)C)CC2 MCULE-8395815239 [0,1,0,1,0,0|2,0,0]=4 1142 B13R2.22973 CC1(C2CCC1(CC2)C(=O)O)C MCULE-8540593035 [0,1,0,1,0,0|1,0,0]=3 1143 B13R2.15777 COC(=O)C12CCC(CC1)CC2 MCULE-5010895546 [0,1,0,1,0,0|1,0,0]=3 1144 B13R2.15777 COC(=O)C12CCC(CC1)NC2 MCULE-1570506898 [0,1,0,1,0,0|2,0,0]=4 1145 B13R2.15777 COC(=O)C12CCC(CC1)NC2 MCULE-8248069856 [0,1,0,1,0,0|2,0,0]=4 1146 B13R2.15777 COC(=O)C12CCN(CC1)CC2 MCULE-1256142067 [0,1,0,1,0,0|2,0,0]=4 1147 B13R2.15777 COC(=O)C12CCN(CC1)CC2 MCULE-3623750141 [0,1,0,1,0,0|2,0,0]=4 1148 B13R2.22975 CC(=O)C12CCC(CC1)(CC2)O MCULE-1211807346 [0,1,0,1,0,0|2,0,0]=4 1149 B13R2.22975 CC12CCC(CC1)(CC2)C(=O)O MCULE-8819805893 [0,1,0,1,0,0|1,0,0]=3 1150 B13R2.22975 NC(=O)C12CCC(CC1)(CC2)N MCULE-9557210994 [0,1,0,1,0,0|2,0,0]=4 1151 B13R2.22975 NC12CCC(CC1)(CC2)C(=O)O MCULE-3825339928 [0,1,0,1,0,0|1,0,0]=3 1152 B13R2.22975 NC12CCC(CC1)(CC2)C(=O)O MCULE-5524337928 [0,1,0,1,0,0|1,0,0]=3 1153 B13R2.22975 O=C(O)C12CCC(CC1)(CC2)Br MCULE-1245789383 [0,1,0,1,0,0|1,0,0]=3 1154 B13R2.22975 O=C(O)C12CCC(CC1)(CC2)F MCULE-7524308684 [0,1,0,1,0,0|1,0,0]=3 1155 B13R2.22975 O=C(O)C12CCC(CC1)(CC2)I MCULE-9533195510 [0,1,0,1,0,0|1,0,0]=3 1156 B13R2.22975 O=C(O)C12CCC(CC1)(CC2)O MCULE-4845660038 [0,1,0,1,0,0|1,0,0]=3 1157 B9R1.163 CC(=O)C1(CCCC1)C MCULE-7946764519 [1,0,0,0,1,0|1,0,0]=3 1158 B9R1.163 CC(=O)C1(CCCC1)N MCULE-1766488888 [1,0,0,0,1,0|1,0,0]=3 1159 B9R1.163 CC(=O)C1(CCCC1)N MCULE-2390313394 [1,0,0,0,1,0|1,0,0]=3 1160 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [1,0,0,0,1,0|2,0,0]=4 1161 B9R1.163 CC(=O)C1(CCCO1)C MCULE-3832225855 [1,0,0,0,1,0|2,0,0]=4 1162 B9R1.163 CC1(C=CCC1)C(=O)O MCULE-5900825388 [1,0,0,0,1,0|0,0,2]=4 1163 B9R1.163 CC1(CC=CC1)C(=O)O MCULE-6612456038 [1,0,0,0,1,0|0,0,2]=4 1164 B9R1.163 CC1(CCCC1)C(=O)Cl MCULE-6905026517 [1,0,0,0,1,0|1,0,0]=3 1165 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [1,0,0,0,1,0|0,0,0]=2 1166 B9R1.163 CC1(CCCN1)C(=O)N MCULE-1073156492 [1,0,0,0,1,0|2,0,0]=4 1167 B9R1.163 CC1(CCCN1)C(=O)N MCULE-4207908355 [1,0,0,0,1,0|2,0,0]=4 1168 B9R1.163 CC1(CCCN1)C(=O)N MCULE-5102556329 [1,0,0,0,1,0|2,0,0]=4 1169 B9R1.163 CC1(CCCN1)C(=O)O MCULE-2669113714 [1,0,0,0,1,0|1,0,0]=3 1170 B9R1.163 CC1(CCCN1)C(=O)O MCULE-3184723558 [1,0,0,0,1,0|1,0,0]=3 1171 B9R1.163 CC1(CCCN1)C(=O)O MCULE-5494365974 [1,0,0,0,1,0|1,0,0]=3 1172 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9532642299 [1,0,0,0,1,0|1,0,0]=3 1173 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9805069526 [1,0,0,0,1,0|1,0,0]=3 1174 B9R1.163 CC1(CCCO1)C(=O)O MCULE-9576233735 [1,0,0,0,1,0|1,0,0]=3 1175 B9R1.163 CC1(CCCS1)C(=O)O MCULE-3409370715 [1,0,0,0,1,0|1,0,0]=3 1176 B9R1.163 CC1(CCNC1)C(=O)N MCULE-9618767565 [1,0,0,0,1,0|2,0,0]=4 1177 B9R1.163 CC1(CCNC1)C(=O)O MCULE-2715430873 [1,0,0,0,1,0|1,0,0]=3 1178 B9R1.163 CC1(CCNC1)C(=O)O MCULE-4084355022 [1,0,0,0,1,0|1,0,0]=3 1179 B9R1.163 CC1(CCOC1)C(=O)O MCULE-6893882009 [1,0,0,0,1,0|1,0,0]=3 1180 B9R1.163 CC1(CSSC1)C(=O)O MCULE-1267186189 [1,0,0,0,1,0|2,0,0]=4 1181 B9R1.163 CC1(NCCS1)C(=O)O MCULE-3303237869 [1,0,0,0,1,0|2,0,0]=4 1182 B9R1.163 CC1(OCCO1)C(=O)O MCULE-6576803543 [1,0,0,0,1,0|2,0,0]=4 1183 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-2607591453 [1,0,0,0,1,0|1,0,0]=3 1184 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-6141960789 [1,0,0,0,1,0|1,0,0]=3 1185 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-7011144386 [1,0,0,0,1,0|1,0,0]=3 1186 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-8922118927 [1,0,0,0,1,0|1,0,0]=3 1187 B9R1.163 C[C@@]1(CCCO1)C(=O)O MCULE-5169117592 [1,0,0,0,1,0|1,0,0]=3 1188 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3070355045 [1,0,0,0,1,0|1,0,0]=3 1189 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3719506215 [1,0,0,0,1,0|1,0,0]=3 1190 B9R1.163 C[C@@]1(CCOC1)C(=O)O MCULE-5585882923 [1,0,0,0,1,0|1,0,0]=3 1191 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-4783754920 [1,0,0,0,1,0|2,0,0]=4 1192 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-7441682522 [1,0,0,0,1,0|2,0,0]=4 1193 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-8011663424 [1,0,0,0,1,0|2,0,0]=4 1194 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-6724020872 [1,0,0,0,1,0|1,0,0]=3 1195 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-7675502884 [1,0,0,0,1,0|1,0,0]=3 1196 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-8343149548 [1,0,0,0,1,0|1,0,0]=3 1197 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-9260269719 [1,0,0,0,1,0|1,0,0]=3 1198 B9R1.163 C[C@]1(CCCO1)C(=O)O MCULE-3910400790 [1,0,0,0,1,0|1,0,0]=3 1199 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-1423230640 [1,0,0,0,1,0|1,0,0]=3 1200 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-7327407576 [1,0,0,0,1,0|1,0,0]=3 1201 B9R1.163 NC(=O)C1(CCCC1)N MCULE-1603183997 [1,0,0,0,1,0|1,0,0]=3 1202 B9R1.163 NC(=O)C1(CCCC1)N MCULE-6535833155 [1,0,0,0,1,0|1,0,0]=3 1203 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [1,0,0,0,1,0|2,0,0]=4 1204 B9R1.163 NC(=O)C1(CCSC1)N MCULE-1255795217 [1,0,0,0,1,0|2,0,0]=4 1205 B9R1.163 NC(=S)C1(CCCC1)N MCULE-1374309481 [1,0,0,0,1,0|1,1,0]=4 1206 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-1445980877 [1,0,0,0,1,0|0,0,2]=4 1207 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-5381827504 [1,0,0,0,1,0|0,0,2]=4 1208 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [1,0,0,0,1,0|0,0,0]=2 1209 B9R1.163 NC1(CCNC1)C(=O)O MCULE-1061035749 [1,0,0,0,1,0|1,0,0]=3 1210 B9R1.163 NC1(CCOC1)C(=O)O MCULE-1020331216 [1,0,0,0,1,0|1,0,0]=3 1211 B9R1.163 NC1(CCOC1)C(=O)O MCULE-3239849151 [1,0,0,0,1,0|1,0,0]=3 1212 B9R1.163 NC1(CCOC1)C(=O)O MCULE-7635316557 [1,0,0,0,1,0|1,0,0]=3 1213 B9R1.163 NC1(CCSC1)C(=O)O MCULE-2866413498 [1,0,0,0,1,0|1,0,0]=3 1214 B9R1.163 NC1(CCSC1)C(=O)O MCULE-3077570702 [1,0,0,0,1,0|1,0,0]=3 1215 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-4940789798 [1,0,0,0,1,0|1,0,0]=3 1216 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-9120207414 [1,0,0,0,1,0|1,0,0]=3 1217 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-3449072625 [1,0,0,0,1,0|1,0,0]=3 1218 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-6533506498 [1,0,0,0,1,0|1,0,0]=3 1219 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-5112163951 [1,0,0,0,1,0|1,0,0]=3 1220 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-7065442028 [1,0,0,0,1,0|1,0,0]=3 1221 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-6757422211 [1,0,0,0,1,0|1,0,0]=3 1222 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-8786481856 [1,0,0,0,1,0|1,0,0]=3 1223 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1832449395 [1,0,0,0,1,0|1,0,0]=3 1224 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1974139646 [1,0,0,0,1,0|1,0,0]=3 1225 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [1,0,0,0,1,0|1,0,0]=3 1226 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [1,0,0,0,1,0|1,0,0]=3 1227 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [1,0,0,0,1,0|1,0,0]=3 1228 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [1,0,0,0,1,0|2,0,0]=4 1229 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [1,0,0,0,1,0|2,0,0]=4 1230 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [1,0,0,0,1,0|2,0,0]=4 1231 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [1,0,0,0,1,0|2,0,0]=4 1232 B9R1.163 O=C(O)C1(CCOC1)F MCULE-5718551369 [1,0,0,0,1,0|2,0,0]=4 1233 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [1,0,0,0,1,0|2,0,0]=4 1234 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [1,0,0,0,1,0|2,0,0]=4 1235 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [1,0,0,0,1,0|2,0,0]=4 1236 B9R1.204 CNC1(CCCC1)C#N MCULE-2780070669 [1,0,0,0,1,0|1,0,1]=4 1237 B9R1.204 CNC1(CCCC1)CO MCULE-1687582141 [1,0,0,0,1,0|0,0,1]=3 1238 B9R1.204 CNC1(CCOC1)CO MCULE-1597439940 [1,0,0,0,1,0|1,0,1]=4 1239 B9R1.204 CNC1(CCSC1)CO MCULE-8777175880 [1,0,0,0,1,0|1,0,1]=4 1240 B9R1.204 COC1(CCCC1)C=O MCULE-4867100992 [1,0,0,0,1,0|1,0,0]=3 1241 B9R1.204 COC1(CCCC1)CO MCULE-4347741831 [1,0,0,0,1,0|1,0,1]=4 1242 B9R1.204 COC1(CCOC1)C=O MCULE-9770538393 [1,0,0,0,1,0|2,0,0]=4 1243 B9R1.204 N#CC1(CCCC1)C=O MCULE-9713236880 [1,0,0,0,1,0|2,0,0]=4 1244 B9R1.119 C#CC1(CCC1)C(=O)O MCULE-2021077070 [0,0,0,0,2,0|1,0,1]=4 1245 B9R1.119 CCC1(CCC1)C(=O)O MCULE-8472500117 [0,0,0,0,2,0|1,0,0]=3 1246 B9R1.119 CCC1(CCO1)C(=O)O MCULE-9145728118 [0,0,0,0,2,0|2,0,0]=4 1247 B9R1.119 CCC1(CNC1)C(=O)O MCULE-8053068489 [0,0,0,0,2,0|2,0,0]=4 1248 B9R1.119 CCC1(COC1)C(=O)O MCULE-3962066812 [0,0,0,0,2,0|2,0,0]=4 1249 B9R1.119 CC[C@]1(CCO1)C(=O)O MCULE-5752888055 [0,0,0,0,2,0|2,0,0]=4 1250 B9R1.119 CNC1(CCC1)C(=O)N MCULE-9618501617 [0,0,0,0,2,0|1,0,0]=3 1251 B9R1.119 CNC1(CCC1)C(=O)O MCULE-3757495053 [0,0,0,0,2,0|0,0,0]=2 1252 B9R1.119 CNC1(CCC1)C(=O)O MCULE-4024637716 [0,0,0,0,2,0|0,0,0]=2 1253 B9R1.119 CNC1(CNC1)C(=O)N MCULE-8113222638 [0,0,0,0,2,0|2,0,0]=4 1254 B9R1.119 CNC1(CNC1)C(=O)N MCULE-9287185171 [0,0,0,0,2,0|2,0,0]=4 1255 B9R1.119 CNC1(CNC1)C(=O)O MCULE-2429867360 [0,0,0,0,2,0|1,0,0]=3 1256 B9R1.119 CNC1(CNC1)C(=O)O MCULE-6668272665 [0,0,0,0,2,0|1,0,0]=3 1257 B9R1.119 CNC1(COC1)C(=O)O MCULE-5428851378 [0,0,0,0,2,0|1,0,0]=3 1258 B9R1.119 COC1(CCC1)C(=O)C MCULE-7851460728 [0,0,0,0,2,0|2,0,0]=4 1259 B9R1.119 COC1(CCC1)C(=O)Cl MCULE-2970127433 [0,0,0,0,2,0|2,0,0]=4 1260 B9R1.119 COC1(CCC1)C(=O)O MCULE-5969292821 [0,0,0,0,2,0|1,0,0]=3 1261 B9R1.119 COC1(CNC1)C(=O)O MCULE-2037277700 [0,0,0,0,2,0|2,0,0]=4 1262 B9R1.119 COC1(CNC1)C(=O)O MCULE-8524872732 [0,0,0,0,2,0|2,0,0]=4 1263 B9R1.119 CSC1(CCC1)C(=O)O MCULE-8804902018 [0,0,0,0,2,0|1,0,0]=3 1264 B9R1.119 N#CC1(CCC1)C(=O)O MCULE-3878444605 [0,0,0,0,2,0|2,0,0]=4 1265 B9R1.119 NCC1(CCC1)C(=O)O MCULE-3914754838 [0,0,0,0,2,0|2,0,0]=4 1266 B9R1.119 NCC1(CCC1)C(=O)O MCULE-4280814319 [0,0,0,0,2,0|2,0,0]=4 1267 B9R1.119 O=C(O)C1(CCC1)CBr MCULE-5543146509 [0,0,0,0,2,0|2,0,0]=4 1268 B9R1.119 O=C(O)C1(CCC1)CF MCULE-5485073729 [0,0,0,0,2,0|2,0,0]=4 1269 B9R1.119 O=C(O)C1(CCC1)CO MCULE-3232370055 [0,0,0,0,2,0|2,0,0]=4 1270 B11R0.77 CCCCCC(CC)CC(=O)O MCULE-4021687044 [0,0,1,0,0,1|1,0,0]=3 1271 B11R1.928 CC(=O)NC1(CCCCC1)C MCULE-7381251920 [1,0,0,0,0,1|1,0,0]=3 1272 B11R1.928 CC1(CCCCC1)CC(=O)O MCULE-7882506747 [1,0,0,0,0,1|0,0,0]=2 1273 B11R1.928 CC1(CCNCC1)CC(=O)O MCULE-5814680905 [1,0,0,0,0,1|1,0,0]=3 1274 B11R1.928 CC1(CCNCC1)CC(=O)O MCULE-6867782906 [1,0,0,0,0,1|1,0,0]=3 1275 B11R1.928 CC1(CCOCC1)CC(=O)O MCULE-4326857569 [1,0,0,0,0,1|1,0,0]=3 1276 B11R1.928 NC(=O)CC1(CCCCC1)N MCULE-4039201792 [1,0,0,0,0,1|1,0,0]=3 1277 B11R1.928 NC(=O)CC1(CCCCC1)N MCULE-4397477502 [1,0,0,0,0,1|1,0,0]=3 1278 B11R1.928 NC1(CCCCC1)CC(=O)O MCULE-1663310557 [1,0,0,0,0,1|0,0,0]=2 1279 B11R1.928 NC1(CCCCC1)CC(=O)O MCULE-2879076377 [1,0,0,0,0,1|0,0,0]=2 1280 B11R1.928 NC1(CCCOC1)CC(=O)O MCULE-5652559264 [1,0,0,0,0,1|1,0,0]=3 1281 B11R1.928 NC1(CCCOC1)CC(=O)O MCULE-6139247914 [1,0,0,0,0,1|1,0,0]=3 1282 B11R1.928 NC1(CCOCC1)CC(=O)O MCULE-1850281708 [1,0,0,0,0,1|1,0,0]=3 1283 B11R1.928 NC1(CCOCC1)CC(=O)O MCULE-2706982629 [1,0,0,0,0,1|1,0,0]=3 1284 B11R1.928 NC1(CCSCC1)CC(=O)O MCULE-9758860021 [1,0,0,0,0,1|1,0,0]=3 1285 B11R1.928 O=C(O)CC1(CCCCC1)O MCULE-3422507323 [1,0,0,0,0,1|1,0,0]=3 1286 B11R1.928 O=C(O)CC1(CCCOC1)O MCULE-4776333020 [1,0,0,0,0,1|2,0,0]=4 1287 B11R1.928 O=C(O)CC1(CCNCC1)O MCULE-2683625220 [1,0,0,0,0,1|2,0,0]=4 1288 B11R1.928 O=C(O)CC1(CCNCC1)O MCULE-8049713319 [1,0,0,0,0,1|2,0,0]=4 1289 B11R1.928 O=C(O)CC1(CCOCC1)O MCULE-8349755612 [1,0,0,0,0,1|2,0,0]=4 1290 B11R1.1155 CNC1(CCCCCC1)CO MCULE-9059601742 [1,0,0,0,0,1|0,0,1]=3 1291 B11R1.1155 COC1(CCCCCC1)C=O MCULE-2926435851 [1,0,0,0,0,1|1,0,0]=3 1292 B11R1.1155 COC1(CCCCCC1)CO MCULE-8681502262 [1,0,0,0,0,1|1,0,1]=4 1293 B11R1.1062 CCC1(CCCC1)NC(=O)C MCULE-2534167271 [0,0,0,0,1,1|2,0,0]=4 1294 B11R1.1062 NCC1(CCCC1)CC(=O)O MCULE-3599384170 [0,0,0,0,1,1|2,0,0]=4 1295 B11R1.1062 NCC1(CCCC1)CC(=O)O MCULE-8108091315 [0,0,0,0,1,1|2,0,0]=4 1296 B13R1.6787 COC1(CCCCCCC1)C(=O)O MCULE-8013301748 [0,0,0,0,0,2|1,0,0]=3